Cc4noc(c3cccc(Cc1n[nH]c(=O)c2ccccc12)c3)n4	CHEMBL193918	O=c3[nH]nc(Cc2cccc(c1ncno1)c2)c4ccccc34
O=c1ccc(=O)n1c4cccc(Cc2n[nH]c(=O)c3ccccc23)c4	CHEMBL363617	O=c1ccc(=O)n1c4cccc(Cc2n[nH]c(=O)c3ccccc23)c4
O=C(Nc3cccc(Cc1n[nH]c(=O)c2ccccc12)c3)C4CC4	CHEMBL196507	O=C(Nc3cccc(Cc1n[nH]c(=O)c2ccccc12)c3)C4CC4
CN(C)CC(=O)Nc4ccc1c(Cc2c1[nH]c(=O)c3ccccc23)c4	CHEMBL364752	O=c3[nH]c2c(Cc1ccccc12)c4ccccc34
CN(C)CC(=O)Nc4ccc1c(Cc2c1[nH]c(=O)c3ccccc23)c4	CHEMBL364752	O=c3[nH]c2c(Cc1ccccc12)c4ccccc34
Fc3ccc2c1CNCCc1[nH]c(=O)c2c3	CHEMBL444846	O=c2[nH]c1CCNCc1c3ccccc23
Nc1ccc3c(=O)[nH]c(=O)c2cccc1c23	CHEMBL338790	O=c1[nH]c(=O)c3cccc2cccc1c23
CC3(c2nc1cccc(C(N)=O)c1[nH]2)CCN3	CHEMBL495782	C3CC(c2nc1ccccc1[nH]2)N3
CC3(c2nc1c(C(N)=O)cccc1[nH]2)CCN3	CHEMBL495782	C3CC(c2nc1ccccc1[nH]2)N3
O=c3[nH]c2ccc(CNC1CC1)cc2n4cccc34	CHEMBL549596	O=c3[nH]c2ccc(CNC1CC1)cc2n4cccc34
CN(C)CC(=O)Nc3ccc2[nH]c(=O)c1ccccc1c2n3	CHEMBL543157	O=c2[nH]c1cccnc1c3ccccc23
Cn4nc(c1ccccc1)c3C2CCCCC2C(=O)Nc34	CHEMBL525167	O=C4Nc2[nH]nc(c1ccccc1)c2C3CCCCC34
O=c3[nH]c2cc(c1ccco1)nn2c4ccccc34	CHEMBL550788	O=c3[nH]c2cc(c1ccco1)nn2c4ccccc34
NC(=O)c1ccccc1OCc3cccc(C(=O)N2CCNCC2)c3	CHEMBL480710	O=C(N1CCNCC1)c3cccc(COc2ccccc2)c3
NC(=O)c1ccccc1OCc3cccc(C(=O)N2CCNCC2)c3	CHEMBL480710	O=C(N1CCNCC1)c3cccc(COc2ccccc2)c3
C[N@]3C(C)(C)C=C(c2nc1c(C(N)=O)cccc1[nH]2)C3(C)C	CHEMBL452112	C3NCC(c2nc1ccccc1[nH]2)=C3
C[N@@]3C(C)(C)C=C(c2nc1c(C(N)=O)cccc1[nH]2)C3(C)C	CHEMBL452112	C3NCC(c2nc1ccccc1[nH]2)=C3
C[N@]3C(C)(C)C=C(c2nc1cccc(C(N)=O)c1[nH]2)C3(C)C	CHEMBL452112	C3NCC(c2nc1ccccc1[nH]2)=C3
C[N@@]3C(C)(C)C=C(c2nc1cccc(C(N)=O)c1[nH]2)C3(C)C	CHEMBL452112	C3NCC(c2nc1ccccc1[nH]2)=C3
O=c3[nH]c2cc(CN1CCCC1)ccc2n4ccnc34	CHEMBL555350	O=c3[nH]c2cc(CN1CCCC1)ccc2n4ccnc34
Cc2cccc3c(=O)[nH]c(CC[N@@]1CCC[C@@H]1CO)cc23	CHEMBL1170695	O=c2[nH]c(CCN1CCCC1)cc3ccccc23
Cc2cccc3c(=O)[nH]c(CC[N@]1CCC[C@@H]1CO)cc23	CHEMBL1170695	O=c2[nH]c(CCN1CCCC1)cc3ccccc23
Fc4ccc3c2CN(C(=O)CCN1CCCCC1)CCc2[nH]c(=O)c3c4	CHEMBL84096	O=C(CCN1CCCCC1)N4CCc3[nH]c(=O)c2ccccc2c3C4
CN4CCN(c3ccc2[nH]c(=O)c1ccccc1c2n3)CC4	CHEMBL105995	O=c3[nH]c2ccc(N1CCNCC1)nc2c4ccccc34
CN4CCN(c3ccc2[nH]c(=O)c1ccccc1c2n3)CC4	CHEMBL105995	O=c3[nH]c2ccc(N1CCNCC1)nc2c4ccccc34
O=C(CCn2c1CCCCc1c(=O)[nH]c2=O)NCC(=O)c4ccc3ccccc3c4	CHEMBL432211	O=C(CCn2c1CCCCc1c(=O)[nH]c2=O)NCC(=O)c4ccc3ccccc3c4
Cc2nc1CCSCc1c(=O)[nH]2	CHEMBL483348	O=c2[nH]cnc1CCSCc12
NC(=O)c2cccc3cc(C1CCCCC1)nn23	CHEMBL1169488	C3CCC(c2cc1ccccn1n2)CC3
O=c4[nH]c(N3CC([N@]2CCC(c1ccccc1)=CC2)C3)nc5ccccc45	CHEMBL400581	O=c4[nH]c(N3CC(N2CCC(c1ccccc1)=CC2)C3)nc5ccccc45
O=c4[nH]c(N3CC(N2CCC(c1ccccc1)=CC2)C3)nc5ccccc45	CHEMBL400581	O=c4[nH]c(N3CC(N2CCC(c1ccccc1)=CC2)C3)nc5ccccc45
O=c4[nH]c(N3CC([N@@]2CCC(c1ccccc1)=CC2)C3)nc5ccccc45	CHEMBL400581	O=c4[nH]c(N3CC(N2CCC(c1ccccc1)=CC2)C3)nc5ccccc45
NC(=O)c2cccc3[nH]c(C1(N)CC1)nc23	CHEMBL448924	C1CC1c3nc2ccccc2[nH]3
NC(=O)c2cccc3[nH]c(C1(N)CC1)nc23	CHEMBL448924	C1CC1c3nc2ccccc2[nH]3
N\C(=N\O)C2C(c1ccc(F)cc1)N3CCNC(=O)c4cccc2c34	CHEMBL186776	O=C2NCCN3C(c1ccccc1)Cc4cccc2c34
Oc3ccc2[nH]c(=O)c1CSCCc1c2c3	CHEMBL1091710	O=c3[nH]c1ccccc1c2CCSCc23
NCCc2c[nH]c3ccc1C(=O)NCCc1c23	CHEMBL551001	O=C1NCCc2c1ccc3[nH]ccc23
O=c3[nH]c2cc(CNC1CC1)ccc2n4cccc34	CHEMBL553676	O=c3[nH]c2cc(CNC1CC1)ccc2n4cccc34
Cc2c(C)c1c(=O)[nH]c(=O)c1c4c2[nH]c3ccccc34	CHEMBL380809	O=c1[nH]c(=O)c4c1ccc3[nH]c2ccccc2c34
CCOc4ccc(c3csc(/N=C/c1c[nH]c2ccccc12)n3)c(OCC)c4	CHEMBL480452	C(=Nc2nc(c1ccccc1)cs2)c3c[nH]c4ccccc34
O=c2[nH]nc(CCCCN1CCOCC1)c3ccccc23	CHEMBL373210	O=c2[nH]nc(CCCCN1CCOCC1)c3ccccc23
O=c2[nH]nc(CCCCN1CCOCC1)c3ccccc23	CHEMBL373210	O=c2[nH]nc(CCCCN1CCOCC1)c3ccccc23
Cc2nc1c(O)cccc1c(=O)[nH]2	CHEMBL123904	O=c1[nH]cnc2ccccc12
Cc2nc1c(O)cccc1c(=O)[nH]2	CHEMBL123904	O=c1[nH]cnc2ccccc12
NC(=O)c3cccc2CN(C1CCNC1)C(=O)c23	CHEMBL597889	O=C2N(C1CCNC1)Cc3ccccc23
OS(=O)(=O)c1ccc3c(c1)[nH]c(=O)c2cc(F)ccc23	CHEMBL46137	O=c2[nH]c1ccccc1c3ccccc23
O=C1NCc2cccc3cccc1c23	CHEMBL594596	O=C1NCc2cccc3cccc1c23
O=c2[nH]c1CNCCc1c3ccccc23	CHEMBL83224	O=c2[nH]c1CNCCc1c3ccccc23
O=c4[nH]c(NCCN3CCN(c1n[nH]c2ccccc12)CC3)nc5ccccc45	CHEMBL1171304	O=c4[nH]c(NCCN3CCN(c1n[nH]c2ccccc12)CC3)nc5ccccc45
O=c3[nH]c(CCCN2CCC(c1ccccc1)CC2)nc4ccccc34	CHEMBL249813	O=c3[nH]c(CCCN2CCC(c1ccccc1)CC2)nc4ccccc34
CN(C)Cc3ccc2c(CNC(=O)c1cccn12)c3	CHEMBL549524	O=C2NCc1ccccc1n3cccc23
CNCc3ccc(n2cc1cc(F)cc(C(N)=O)c1n2)cc3	CHEMBL610171	c3ccc(n2cc1ccccc1n2)cc3
O=C2NCC3[N@](Cc1ccccc1)CCc4cccc2c34	CHEMBL593611	O=C2NCC3N(Cc1ccccc1)CCc4cccc2c34
O=c3[nH]c(CCCN2CCN(c1ccccc1)CC2)nc4ccccc34	CHEMBL189500	O=c3[nH]c(CCCN2CCN(c1ccccc1)CC2)nc4ccccc34
CCC(=O)Nc3cccc(Cc1n[nH]c(=O)c2ccccc12)c3	CHEMBL371425	O=c2[nH]nc(Cc1ccccc1)c3ccccc23
O=c1[nH]ccc2ccccc12	CHEMBL339695	O=c1[nH]ccc2ccccc12
O=C1NCc2c[nH]c3cccc1c23	CHEMBL356104	O=C1NCc2c[nH]c3cccc1c23
Cc2ccc1cccc(C(N)=O)c1n2	CHEMBL471966	c2ccc1ncccc1c2
Cc1cccc2C(=O)NCCc12	CHEMBL125200	O=C1NCCc2ccccc12
CC(C)CN2Cc1cccc(C(N)=O)c1C2=O	CHEMBL609617	O=C1NCc2ccccc12
NC(=O)c2cccn3nc(c1ccccc1)nc23	CHEMBL1094313	c3ccc(c2nc1ccccn1n2)cc3
CN(C)Cc4ccc(c1[nH]c3cccc2C(=O)NCc1c23)cc4	CHEMBL344963	O=C2NCc3c(c1ccccc1)[nH]c4cccc2c34
O=c4[nH]c3c(Cc2cc(S(=O)(=O)NCCCn1ccnc1)ccc23)c5ccccc45	CHEMBL364691	O=c4[nH]c3c(Cc2cc(S(=O)(=O)NCCCn1ccnc1)ccc23)c5ccccc45
Nc1cccc2c(=O)[nH]ccc12	CHEMBL446240	O=c1[nH]ccc2ccccc12
O/N=C/c1cn3CCNC(=O)c2cccc1c23	CHEMBL189698	O=C1NCCn2ccc3cccc1c23
Cc1ccn4c(c1)nc3c2ccccc2c(=O)[nH]c34	CHEMBL607844	O=c3[nH]c2c(nc1ccccn12)c4ccccc34
FC(F)(F)c3ccc(c2nc1CCSCc1c(=O)[nH]2)cc3	CHEMBL1086580	O=c3[nH]c(c1ccccc1)nc2CCSCc23
O=C2NCCn3cc(C(=O)c1ccccc1)c4cccc2c34	CHEMBL187566	O=C2NCCn3cc(C(=O)c1ccccc1)c4cccc2c34
CN(C)Cc3ccc(c1c[nH]c(=O)c2cccc(O)c12)cc3	CHEMBL1171806	O=c2[nH]cc(c1ccccc1)c3ccccc23
Cc2nn(C)c3[nH]c(=O)c1CCCc1c23	CHEMBL508796	O=c3[nH]c1[nH]ncc1c2CCCc23
O=C4NC(CCCN2CCC(c1ccccc1)=CC2)=NC3CCCC34	CHEMBL370207	O=C4NC(CCCN2CCC(c1ccccc1)=CC2)=NC3CCCC34
O=C4NC(CCCN2CCC(c1ccccc1)=CC2)=NC3CCCC34	CHEMBL370207	O=C4NC(CCCN2CCC(c1ccccc1)=CC2)=NC3CCCC34
O=c1[nH]c(=O)c7c1c2CCCc2c6[nH]c5ccc(c4csc(c3ccno3)n4)cc5c67	CHEMBL245558	O=c1[nH]c(=O)c7c1c2CCCc2c6[nH]c5ccc(c4csc(c3ccno3)n4)cc5c67
O=c4[nH]c3ccc(N1C[C@H]2C[C@@H]1CN2)nc3c5ccccc45	CHEMBL1160877	O=c4[nH]c3ccc(N1CC2CC1CN2)nc3c5ccccc45
O=C2NCCc3c(OCCCCN1CCCCC1)cccc23	CHEMBL127336	O=C2NCCc3c(OCCCCN1CCCCC1)cccc23
Fc3ccc(Cc1n[nH]c(=O)c2ccccc12)cc3C(=O)N4CCCNCC4	CHEMBL380648	O=C(N1CCCNCC1)c4cccc(Cc2n[nH]c(=O)c3ccccc23)c4
NC(=O)c3cccc4cn(c2ccc1CCNCc1c2)nc34	CHEMBL1095606	C4Cc3ccc(n2cc1ccccc1n2)cc3CN4
O=C2NCC3N(C(=O)C1CNC1)CCc4cccc2c34	CHEMBL593364	O=C2NCC3N(C(=O)C1CNC1)CCc4cccc2c34
O=C(Nc2nc(c1ccccc1)cs2)c3ccncc3	CHEMBL482012	O=C(Nc2nc(c1ccccc1)cs2)c3ccncc3
O=C2NCCn3c(c1ccccn1)cc4cccc2c34	CHEMBL424802	O=C2NCCn3c(c1ccccn1)cc4cccc2c34
O=c3[nH]c2cc(CN1CCOCC1)ccc2c4ccccc34	CHEMBL194535	O=c3[nH]c2cc(CN1CCOCC1)ccc2c4ccccc34
O=c3[nH]c2cc(CN1CCOCC1)ccc2c4ccccc34	CHEMBL194535	O=c3[nH]c2cc(CN1CCOCC1)ccc2c4ccccc34
Cc2cccc3c(=O)[nH]c(c1ccc(N(=O)=O)cc1)nc23	CHEMBL127396	O=c2[nH]c(c1ccccc1)nc3ccccc23
O=C2NCC3N(Cc1ccccc1)CCc4cccc2c34	CHEMBL593611	O=C2NCC3N(Cc1ccccc1)CCc4cccc2c34
O=C2NCC3[N@@](Cc1ccccc1)CCc4cccc2c34	CHEMBL593611	O=C2NCC3N(Cc1ccccc1)CCc4cccc2c34
CC[N@@]4CCC(Oc3ccc2[nH]c(=O)c1CSCCc1c2c3)C4	CHEMBL1089713	O=c4[nH]c2ccc(OC1CCNC1)cc2c3CCSCc34
CC[N@]4CCC(Oc3ccc2[nH]c(=O)c1CSCCc1c2c3)C4	CHEMBL1089713	O=c4[nH]c2ccc(OC1CCNC1)cc2c3CCSCc34
CCOC(=O)CCC(=O)Nc2nc(c1ccccc1)cs2	CHEMBL452158	c2ccc(c1cscn1)cc2
O=c3[nH]c(=O)c4c1cc[nH]c1c2CCCc2c34	CHEMBL201907	O=c3[nH]c(=O)c4c1cc[nH]c1c2CCCc2c34
NC(=O)c1ccccc1OCCc3cccc(C(=O)N2CCNCC2)c3	CHEMBL480715	O=C(N1CCNCC1)c3cccc(CCOc2ccccc2)c3
NC(=O)c1ccccc1OCCc3cccc(C(=O)N2CCNCC2)c3	CHEMBL480715	O=C(N1CCNCC1)c3cccc(CCOc2ccccc2)c3
Clc4cccc5c(=O)[nH]c(C3=C[C@@H](N2CCC(c1ccccc1)CC2)CC3)nc45	CHEMBL248648	O=c4[nH]c(C3=CC(N2CCC(c1ccccc1)CC2)CC3)nc5ccccc45
O=c2[nH]c1CCCCc1c3ccccc23	CHEMBL83760	O=c2[nH]c1CCCCc1c3ccccc23
CN(C)Cc1ccc2c(c1)[nH]c(=O)c3nccn23	CHEMBL570304	O=c2[nH]c1ccccc1n3ccnc23
Cc2nn(C)c3[nH]c(=O)c1CCCCc1c23	CHEMBL455590	O=c3[nH]c1[nH]ncc1c2CCCCc23
Cc1nc3cccc2C(=O)NCCn1c23	CHEMBL294060	O=C1NCCn2cnc3cccc1c23
Cc1c(C)c(=O)[nH]nc1Cc4ccc(F)c(C(=O)N3CCC2(CCN2)CC3)c4	CHEMBL604293	O=C(N2CCC1(CCN1)CC2)c4cccc(Cc3ccc(=O)[nH]n3)c4
O=C1NCc4c1c2CCCc2c5[nH]c3ccc(C#N)cc3c45	CHEMBL383442	O=C1NCc4c1c2CCCc2c5[nH]c3ccccc3c45
O=C(CN1CCOCC1)Nc5ccc4Cc2c([nH]c(=O)c3ccccc23)c4c5	CHEMBL192951	O=C(CN1CCOCC1)Nc5ccc4Cc2c([nH]c(=O)c3ccccc23)c4c5
COc1[nH]c3cccc2C(=O)NCCc1c23	CHEMBL147896	O=C1NCCc2c[nH]c3cccc1c23
NC(=O)c3cccc4[nH]c(c2ccc1OCOc1c2)nc34	CHEMBL337386	C4Oc3ccc(c2nc1ccccc1[nH]2)cc3O4
NC(=O)c3cccc4nc(c2ccc1OCOc1c2)[nH]c34	CHEMBL337386	C4Oc3ccc(c2nc1ccccc1[nH]2)cc3O4
O=c1[nH]c(=O)c3c1ccc2[nH]ccc23	CHEMBL373066	O=c1[nH]c(=O)c3c1ccc2[nH]ccc23
O=c4[nH]c(CCCN2CCC(c1ccccc1)=CC2)nc3CCCc34	CHEMBL480614	O=c4[nH]c(CCCN2CCC(c1ccccc1)=CC2)nc3CCCc34
CN(C)CC(=O)Nc3ccc2[nH]c(=O)c1ccccc1c2n3	CHEMBL543157	O=c2[nH]c1cccnc1c3ccccc23
CN(C)Cc3ccc2N1CCCCC1C(=O)Nc2c3	CHEMBL541744	O=C3Nc1ccccc1N2CCCCC23
O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34	CHEMBL540525	O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34
O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34	CHEMBL540525	O=c3[nH]c2ccc(S(=O)(=O)NCCN1CCCCC1)cc2c4ccccc34
O=c2[nH]c1cccnc1c3ccccc23	CHEMBL320031	O=c2[nH]c1cccnc1c3ccccc23
Fc1ccc4c(c1)c(=O)[nH]c3cc(C(=O)NCCc2ccccc2)ccc34	CHEMBL289834	O=C(NCCc1ccccc1)c2ccc4c(c2)[nH]c(=O)c3ccccc34
CN(C)Cc3ccc2N1CCCC1C(=O)Nc2c3	CHEMBL539660	O=C3Nc1ccccc1N2CCCC23
O=c4[nH]c(CCC[N@]1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45	CHEMBL364763	O=c4[nH]c(CCCN1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45
O=c4[nH]c(CCC[N@@]1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45	CHEMBL364763	O=c4[nH]c(CCCN1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45
O=c4[nH]c(CCCN1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45	CHEMBL364763	O=c4[nH]c(CCCN1CCc2c(C1)[nH]c3ccccc23)nc5ccccc45
O=c2[nH]c1ncccc1c3ccccc23	CHEMBL110381	O=c2[nH]c1ncccc1c3ccccc23
NC(=O)c3cccc4cn(c2ccc1CNCCc1c2)nc34	CHEMBL1098296	C4Cc3cc(n2cc1ccccc1n2)ccc3CN4
CC2=NC1CCSCC1C(=O)N2	CHEMBL194416	O=C2NC=NC1CCSCC12
CC2=NC1CCSCC1C(=O)N2	CHEMBL194416	O=C2NC=NC1CCSCC12
NC(=O)c3cc(F)cc4nc(c2ccc(C1CCCCN1)cc2)[nH]c34	CHEMBL1088788	C4CCC(c3ccc(c2nc1ccccc1[nH]2)cc3)NC4
NC(=O)c3cc(F)cc4[nH]c(c2ccc(C1CCCCN1)cc2)nc34	CHEMBL1088788	C4CCC(c3ccc(c2nc1ccccc1[nH]2)cc3)NC4
Clc4cccc5c(=O)[nH]c(C3=C[C@@H]([N@]2CCC(c1ccccc1)=CC2)CC3)nc45	CHEMBL248827	O=c4[nH]c(C3=CC(N2CCC(c1ccccc1)=CC2)CC3)nc5ccccc45
Clc4cccc5c(=O)[nH]c(C3=C[C@@H]([N@@]2CCC(c1ccccc1)=CC2)CC3)nc45	CHEMBL248827	O=c4[nH]c(C3=CC(N2CCC(c1ccccc1)=CC2)CC3)nc5ccccc45
O=C(CN1CCCCC1)Nc4ccc3[nH]c(=O)c2ccccc2c3n4	CHEMBL542927	O=C(CN1CCCCC1)Nc4ccc3[nH]c(=O)c2ccccc2c3n4
O=C(CN1CCCCC1)Nc4ccc3[nH]c(=O)c2ccccc2c3n4	CHEMBL542927	O=C(CN1CCCCC1)Nc4ccc3[nH]c(=O)c2ccccc2c3n4