smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CN(Cc1ccc(N2CCC[C@]3(C(=O)N4CCOCC4)CN(c4ncccn4)C[C@H]3C2)nc1)C1CC1	ZINC001164430438	718956115	/nfs/dbraw/zinc/95/61/15/718956115.db2.gz	VFIUOWUAYZEWCI-AMGIVPHBSA-N	0	3	491.640	2.048	20	0		JEADHN
COC[C@@H]1CC2(CN1Cc1ccccn1)CCN(c1[nH+]cnc3[n-]cc(S(C)(=O)=O)c31)CC2	ZINC001164716266	720108674	/nfs/dbraw/zinc/10/86/74/720108674.db2.gz	JWAHDEWCPVKOEF-SFHVURJKSA-N	0	3	470.599	2.264	20	0		JEADHN
CCOC(=O)c1c2ccccn2c2ncnc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)c12	ZINC001164745705	720609341	/nfs/dbraw/zinc/60/93/41/720609341.db2.gz	VOWQKJAGPOJYTG-IAGOWNOFSA-N	0	3	459.510	2.191	20	0		JEADHN
CC(C)N1[C@H](Cn2cccn2)C[C@@H]2CN(c3nc(Cl)nc4c3S(=O)(=O)CC4)CC[C@@H]21	ZINC001164836964	720645565	/nfs/dbraw/zinc/64/55/65/720645565.db2.gz	AKJCYJRTPXASGV-VYDXJSESSA-N	0	3	450.996	2.034	20	0		JEADHN
Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164742010	720693743	/nfs/dbraw/zinc/69/37/43/720693743.db2.gz	VIHWVANDOCZOCJ-BFYDXBDKSA-N	0	3	456.938	2.311	20	0		JEADHN
CN(C)C(=O)c1cc2cnc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)nc2n1C1CCCC1	ZINC001164740118	720697205	/nfs/dbraw/zinc/69/72/05/720697205.db2.gz	QFCJGIUVRFJWQY-PMACEKPBSA-N	0	3	476.585	2.380	20	0		JEADHN
O=C(c1cccnc1N1CCN2C[C@H](Oc3cncnc3)C[C@@H]2C1)N1CCN(Cc2ccccc2)CC1	ZINC001164740359	720728566	/nfs/dbraw/zinc/72/85/66/720728566.db2.gz	KGVHHBAPPWQLBM-DNQXCXABSA-N	0	3	499.619	2.172	20	0		JEADHN
COC(=O)/C=C/c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164738545	720738897	/nfs/dbraw/zinc/73/88/97/720738897.db2.gz	FYFGSNAZAYLNAU-NFQYPQQASA-N	0	3	480.569	2.384	20	0		JEADHN
CN(C)Cc1ccnc(N2CCC3(CC[C@]4(C(=O)N5CCCC5)CN(S(C)(=O)=O)C[C@H]34)CC2)c1	ZINC001164843480	720741448	/nfs/dbraw/zinc/74/14/48/720741448.db2.gz	LAYWTOOSRHEGJE-BWKNWUBXSA-N	0	3	489.686	2.024	20	0		JEADHN
c1ncc(O[C@@H]2C[C@H]3CN(c4nc(CN5CCOCC5)nc5sc6c(c54)CCC6)CCN3C2)cn1	ZINC001164739951	720761648	/nfs/dbraw/zinc/76/16/48/720761648.db2.gz	KASOSBKVZRBQMV-ZWKOTPCHSA-N	0	3	493.637	2.144	20	0		JEADHN
Fc1ccccc1N1CCN(c2cc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)ncn2)CC1	ZINC001164746440	720772893	/nfs/dbraw/zinc/77/28/93/720772893.db2.gz	YDSKZDXBMLIRRC-WOJBJXKFSA-N	0	3	476.560	2.074	20	0		JEADHN
O=S(=O)(Nc1cc(F)ccc1F)c1ccc(N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nc1	ZINC001164737846	720783965	/nfs/dbraw/zinc/78/39/65/720783965.db2.gz	CZOLQHYCPWATQY-SJORKVTESA-N	0	3	488.520	2.293	20	0		JEADHN
COCC[N@@H+]1CCO[C@@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@H]2C1	ZINC001164853390	720882223	/nfs/dbraw/zinc/88/22/23/720882223.db2.gz	CJNQJZOKIRMGGA-HRAATJIYSA-N	0	3	482.553	2.334	20	0		JEADHN
COCC[N@H+]1CCO[C@@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@H]2C1	ZINC001164853390	720882227	/nfs/dbraw/zinc/88/22/27/720882227.db2.gz	CJNQJZOKIRMGGA-HRAATJIYSA-N	0	3	482.553	2.334	20	0		JEADHN
COCCOc1cc2ncnc(N3C[C@H]4CN(Cc5cnn(C)c5)CC[C@@H]4C3)c2cc1OCCOC	ZINC001164762145	721090169	/nfs/dbraw/zinc/09/01/69/721090169.db2.gz	CSDFUPKCJRJITJ-NHCUHLMSSA-N	0	3	496.612	2.372	20	0		JEADHN
COCCOc1cc2ncnc(N3C[C@@H]4CCN(Cc5cnn(C)c5)C[C@H]4C3)c2cc1OCCOC	ZINC001164762149	721090635	/nfs/dbraw/zinc/09/06/35/721090635.db2.gz	CSDFUPKCJRJITJ-SFTDATJTSA-N	0	3	496.612	2.372	20	0		JEADHN
CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCN4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)C1	ZINC001164875374	721149275	/nfs/dbraw/zinc/14/92/75/721149275.db2.gz	LCCXINLQPASSSS-YPAWHYETSA-N	0	3	466.586	2.131	20	0		JEADHN
CCC(CC)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164877566	721152697	/nfs/dbraw/zinc/15/26/97/721152697.db2.gz	OQVHTIIFMFZPPD-NHCUHLMSSA-N	0	3	459.616	2.423	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4cc(N5CCN(c6ccccc6)CC5)ncn4)C[C@@H]3C2)cn1	ZINC001164762036	721223790	/nfs/dbraw/zinc/22/37/90/721223790.db2.gz	BYVSBRXAEHGCJY-PKTZIBPZSA-N	0	3	458.614	2.495	20	0		JEADHN
COC(=O)C1CCN(c2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)CC1	ZINC001164906784	721543046	/nfs/dbraw/zinc/54/30/46/721543046.db2.gz	LHYBOTLEQZVHDI-PZJWPPBQSA-N	0	3	455.534	2.347	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2CCN(C[C@H]3CCCO3)CC2)c1CN1CC[C@H](CO)C1	ZINC001165038733	721914269	/nfs/dbraw/zinc/91/42/69/721914269.db2.gz	PNCSUWQXQOBKFF-VQTJNVASSA-N	0	3	459.635	2.181	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)c1CN1CC[C@H](CO)C1	ZINC001164967233	722074328	/nfs/dbraw/zinc/07/43/28/722074328.db2.gz	PCOHRTPJTNQKDU-PCCBWWKXSA-N	0	3	471.646	2.180	20	0		JEADHN
O=C1NCCc2[nH]c(-c3ccnc(N4CC[C@H]5CN(Cc6cccnc6)CCO[C@H]5C4)c3)cc21	ZINC001164977357	722114726	/nfs/dbraw/zinc/11/47/26/722114726.db2.gz	MSTWXVIDCCLHHE-RDPSFJRHSA-N	0	3	458.566	2.485	20	0		JEADHN
c1cncc(CN2CCO[C@@H]3CN(c4nc(N5CCCC5)nc(N5CCCC5)n4)CC[C@H]3C2)c1	ZINC001164972678	722138701	/nfs/dbraw/zinc/13/87/01/722138701.db2.gz	AGYSPCAVQNXFSW-FCHUYYIVSA-N	0	3	464.618	2.194	20	0		JEADHN
c1cncc(CN2CCO[C@H]3CN(c4nc(N5CCCC5)nc(N5CCCC5)n4)CC[C@H]3C2)c1	ZINC001164972687	722139146	/nfs/dbraw/zinc/13/91/46/722139146.db2.gz	AGYSPCAVQNXFSW-VXKWHMMOSA-N	0	3	464.618	2.194	20	0		JEADHN
CCN(CC)S(=O)(=O)c1ccc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc1	ZINC001164974290	722140599	/nfs/dbraw/zinc/14/05/99/722140599.db2.gz	DFYATSNCHUREDB-RBBKRZOGSA-N	0	3	459.616	2.234	20	0		JEADHN
CCOC(=O)N1CCc2nnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc2C1	ZINC001164976140	722142712	/nfs/dbraw/zinc/14/27/12/722142712.db2.gz	HKWUAZAJGHKAJC-DENIHFKCSA-N	0	3	452.559	2.114	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1nc(/C=C\C(=O)OC)ccc1NC(=O)C(C)(C)C)CC2	ZINC001164686562	719733068	/nfs/dbraw/zinc/73/30/68/719733068.db2.gz	PDPYADHUSDGMAI-NTMALXAHSA-N	0	3	471.602	2.433	20	0		JEADHN
COC[C@H]1CC2(CN1Cc1ccccn1)CCN(c1[nH+]cnc3[n-]cc(S(C)(=O)=O)c31)CC2	ZINC001164716265	720108914	/nfs/dbraw/zinc/10/89/14/720108914.db2.gz	JWAHDEWCPVKOEF-GOSISDBHSA-N	0	3	470.599	2.264	20	0		JEADHN
CN(C)C(=O)N1CC2(CCN(c3ccc(CN4CCCC4)cn3)CC2)[C@@]2(CCN(C)C2=O)C1	ZINC001164716329	720161938	/nfs/dbraw/zinc/16/19/38/720161938.db2.gz	ZKKFGYFWYQCWNL-VWLOTQADSA-N	0	3	454.619	2.110	20	0		JEADHN
Cc1ccc(S(=O)(=O)n2ccc3c2ncnc3N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)cc1	ZINC001164739555	720629548	/nfs/dbraw/zinc/62/95/48/720629548.db2.gz	FVSHQHBKLZNNCX-RBUKOAKNSA-N	0	3	491.577	2.109	20	0		JEADHN
CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CCN2C[C@H](Oc3cncnc3)C[C@H]2C1	ZINC001164741018	720699803	/nfs/dbraw/zinc/69/98/03/720699803.db2.gz	RVKNJJAUZLEMIX-DLBZAZTESA-N	0	3	451.531	2.110	20	0		JEADHN
O=C(NCCSCc1ccco1)c1cccnc1N1CCN2C[C@H](Oc3cncnc3)C[C@H]2C1	ZINC001164743368	720728233	/nfs/dbraw/zinc/72/82/33/720728233.db2.gz	PTGQFGDWPPNXGX-AZUAARDMSA-N	0	3	480.594	2.470	20	0		JEADHN
O=C(c1cccnc1N1CCN2C[C@@H](Oc3cncnc3)C[C@H]2C1)N1CCN(Cc2ccccc2)CC1	ZINC001164740361	720728610	/nfs/dbraw/zinc/72/86/10/720728610.db2.gz	KGVHHBAPPWQLBM-ZEQRLZLVSA-N	0	3	499.619	2.172	20	0		JEADHN
NS(=O)(=O)c1cnc(Cl)c(C(F)(F)N2CCCn3cnc(CNC4CCC4)c3C2)c1	ZINC001164837390	720738363	/nfs/dbraw/zinc/73/83/63/720738363.db2.gz	ITPHPCKTOQOJRI-UHFFFAOYSA-N	0	3	460.938	2.176	20	0		JEADHN
CC(C)(C)OC(=O)Nc1cnc(N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)c2[nH]cnc21	ZINC001164739918	720752906	/nfs/dbraw/zinc/75/29/06/720752906.db2.gz	JTIJAIBLQGFUCS-CABCVRRESA-N	0	3	452.519	2.437	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@@H+]2CC2CC2)C1	ZINC001164743684	720835908	/nfs/dbraw/zinc/83/59/08/720835908.db2.gz	JRQUYZYAZNUMGX-IIDMSEBBSA-N	0	3	470.965	2.369	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1	ZINC001164743684	720835910	/nfs/dbraw/zinc/83/59/10/720835910.db2.gz	JRQUYZYAZNUMGX-IIDMSEBBSA-N	0	3	470.965	2.369	20	0		JEADHN
CS(=O)(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)N2CC2CC2)C1	ZINC001164748858	720843667	/nfs/dbraw/zinc/84/36/67/720843667.db2.gz	VAPKWKCVHPVJFU-IXDOHACOSA-N	0	3	450.996	2.109	20	0		JEADHN
CS(=O)(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)N2CC2CC2)C1	ZINC001164748855	720843698	/nfs/dbraw/zinc/84/36/98/720843698.db2.gz	VAPKWKCVHPVJFU-GVDBMIGSSA-N	0	3	450.996	2.109	20	0		JEADHN
c1cc2nc(N3CCN4C[C@H](OCc5cccnc5)C[C@H]4C3)nc(N3CCOCC3)c2s1	ZINC001164867090	721059869	/nfs/dbraw/zinc/05/98/69/721059869.db2.gz	HSNJOEZFIKLFEO-RBUKOAKNSA-N	0	3	452.584	2.403	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)n1C	ZINC001164881181	721135390	/nfs/dbraw/zinc/13/53/90/721135390.db2.gz	ZNWRDXYRSIBKOU-HOTGVXAUSA-N	0	3	456.934	2.283	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@]3(CCN(c4cc(-c5cc6c([nH]5)CCNC6=O)ccn4)C3)O2)CC1	ZINC001164886696	721407495	/nfs/dbraw/zinc/40/74/95/721407495.db2.gz	KTQHPJBSJHVMGR-FQRUVTKNSA-N	0	3	464.614	2.128	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@@]3(CCN(c4cc(-c5cc6c([nH]5)CCNC6=O)ccn4)C3)O2)CC1	ZINC001164886692	721407794	/nfs/dbraw/zinc/40/77/94/721407794.db2.gz	KTQHPJBSJHVMGR-FNZWTVRRSA-N	0	3	464.614	2.128	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4nc(Cl)nc5[nH]cnc54)C3)O2)CC1	ZINC001164890271	721435687	/nfs/dbraw/zinc/43/56/87/721435687.db2.gz	CXGNFOKZNALQNB-LIRRHRJNSA-N	0	3	455.941	2.268	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C(=O)OCC	ZINC001164900291	721522986	/nfs/dbraw/zinc/52/29/86/721522986.db2.gz	PTUYFJHBJUESIQ-WMZOPIPTSA-N	0	3	458.490	2.311	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2CCN(C[C@@H]3CCCO3)CC2)c1CN1CC[C@@H](CO)C1	ZINC001165038732	721914501	/nfs/dbraw/zinc/91/45/01/721914501.db2.gz	PNCSUWQXQOBKFF-UXHICEINSA-N	0	3	459.635	2.181	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2CCN(C[C@@H]3CCCO3)CC2)c1CN1CC[C@H](CO)C1	ZINC001165038731	721914610	/nfs/dbraw/zinc/91/46/10/721914610.db2.gz	PNCSUWQXQOBKFF-PMACEKPBSA-N	0	3	459.635	2.181	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nn2)CC1	ZINC001164975210	722128951	/nfs/dbraw/zinc/12/89/51/722128951.db2.gz	FSSFPQJWZOZAIM-DHIUTWEWSA-N	0	3	480.613	2.378	20	0		JEADHN
CCN(CC)S(=O)(=O)c1ccc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc1	ZINC001164974288	722141079	/nfs/dbraw/zinc/14/10/79/722141079.db2.gz	DFYATSNCHUREDB-IRLDBZIGSA-N	0	3	459.616	2.234	20	0		JEADHN
Cc1ccc(S(=O)(=O)n2ccc3c2ncnc3N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)cc1	ZINC001164739554	720630857	/nfs/dbraw/zinc/63/08/57/720630857.db2.gz	FVSHQHBKLZNNCX-OALUTQOASA-N	0	3	491.577	2.109	20	0		JEADHN
CN(C)C(=O)c1cc2cnc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nc2n1C1CCCC1	ZINC001164740119	720698282	/nfs/dbraw/zinc/69/82/82/720698282.db2.gz	QFCJGIUVRFJWQY-UXHICEINSA-N	0	3	476.585	2.380	20	0		JEADHN
COC(=O)/C=C\c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164738541	720735979	/nfs/dbraw/zinc/73/59/79/720735979.db2.gz	FYFGSNAZAYLNAU-DRICUUHLSA-N	0	3	480.569	2.384	20	0		JEADHN
Fc1ccccc1N1CCN(c2cc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)ncn2)CC1	ZINC001164746436	720773881	/nfs/dbraw/zinc/77/38/81/720773881.db2.gz	YDSKZDXBMLIRRC-PMACEKPBSA-N	0	3	476.560	2.074	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@@H+]2CC2CC2)C1	ZINC001164743686	720836304	/nfs/dbraw/zinc/83/63/04/720836304.db2.gz	JRQUYZYAZNUMGX-RLFYNMQTSA-N	0	3	470.965	2.369	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1	ZINC001164743686	720836307	/nfs/dbraw/zinc/83/63/07/720836307.db2.gz	JRQUYZYAZNUMGX-RLFYNMQTSA-N	0	3	470.965	2.369	20	0		JEADHN
O=S(=O)(c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1)N1CCCCC1	ZINC001164871597	721143564	/nfs/dbraw/zinc/14/35/64/721143564.db2.gz	FVJXCBKNXMAIIR-SFTDATJTSA-N	0	3	457.600	2.131	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4cc(N5CCN(c6ccccc6)CC5)ncn4)C[C@H]3C2)cn1	ZINC001164762034	721222742	/nfs/dbraw/zinc/22/27/42/721222742.db2.gz	BYVSBRXAEHGCJY-DHIUTWEWSA-N	0	3	458.614	2.495	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CC[C@]3(C2)CCC[C@H](CN2CCN(C)CC2)O3)[nH]1	ZINC001164891931	721420372	/nfs/dbraw/zinc/42/03/72/721420372.db2.gz	WRQJCIKKGIRINO-QRQCRPRQSA-N	0	3	462.982	2.163	20	0		JEADHN
CC1(C)NC(=O)N(Cc2ccc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nc2)C1=O	ZINC001164962432	722060227	/nfs/dbraw/zinc/06/02/27/722060227.db2.gz	RWNNVTBFRLRTNJ-UHFFFAOYSA-N	0	3	478.597	2.426	20	0		JEADHN
O=S(=O)(c1ccc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc1)N1CCCCC1	ZINC001164974253	722141042	/nfs/dbraw/zinc/14/10/42/722141042.db2.gz	CWZPQPUVUQTXEH-FYYLOGMGSA-N	0	3	471.627	2.379	20	0		JEADHN
O=C(c1cnc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC001164972628	722143963	/nfs/dbraw/zinc/14/39/63/722143963.db2.gz	AEWZWNZKOUKBMP-UGKGYDQZSA-N	0	3	471.989	2.330	20	0		JEADHN
CN(Cc1ccc(N2CCC[C@]3(C(=O)N4CCOCC4)CN(c4ncccn4)C[C@@H]3C2)nc1)C1CC1	ZINC001164430439	718956499	/nfs/dbraw/zinc/95/64/99/718956499.db2.gz	VFIUOWUAYZEWCI-CUNXSJBXSA-N	0	3	491.640	2.048	20	0		JEADHN
O=C(N1CCOCC1)[C@]12CN(c3ncccn3)C[C@@H]1CN(c1ccc(CN3CCCC3)cn1)CCC2	ZINC001164430706	718956622	/nfs/dbraw/zinc/95/66/22/718956622.db2.gz	WMLVVLKRAHFDAP-WNCULLNHSA-N	0	3	491.640	2.049	20	0		JEADHN
CCOC(=O)c1c2ccccn2c2ncnc(N3CCC4(CCCN4CC(=O)NC)CC3)c21	ZINC001164685489	719695818	/nfs/dbraw/zinc/69/58/18/719695818.db2.gz	KOZBXCHVSZQFCW-UHFFFAOYSA-N	0	3	450.543	2.240	20	0		JEADHN
Cc1cc2c(ncnc2N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1S(=O)(=O)c1ccccc1	ZINC001164746258	720652336	/nfs/dbraw/zinc/65/23/36/720652336.db2.gz	WKFNCVUCHNWURY-RTBURBONSA-N	0	3	491.577	2.109	20	0		JEADHN
CC(C)(C)OC(=O)Nc1cnc(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)c2[nH]cnc21	ZINC001164739920	720752997	/nfs/dbraw/zinc/75/29/97/720752997.db2.gz	JTIJAIBLQGFUCS-HUUCEWRRSA-N	0	3	452.519	2.437	20	0		JEADHN
c1ncc(O[C@H]2C[C@@H]3CN(c4nc(CN5CCOCC5)nc5sc6c(c54)CCC6)CCN3C2)cn1	ZINC001164739943	720763246	/nfs/dbraw/zinc/76/32/46/720763246.db2.gz	KASOSBKVZRBQMV-MSOLQXFVSA-N	0	3	493.637	2.144	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@@H+]2CC2CC2)C1	ZINC001164743681	720836276	/nfs/dbraw/zinc/83/62/76/720836276.db2.gz	JRQUYZYAZNUMGX-HDMKZQKVSA-N	0	3	470.965	2.369	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@@H](C[C@H](Cn3cncn3)[N@H+]2CC2CC2)C1	ZINC001164743681	720836279	/nfs/dbraw/zinc/83/62/79/720836279.db2.gz	JRQUYZYAZNUMGX-HDMKZQKVSA-N	0	3	470.965	2.369	20	0		JEADHN
c1cc2nc(N3CCN4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nc(N3CCOCC3)c2s1	ZINC001164867088	721060340	/nfs/dbraw/zinc/06/03/40/721060340.db2.gz	HSNJOEZFIKLFEO-MOPGFXCFSA-N	0	3	452.584	2.403	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CCN4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)CC1	ZINC001164865977	721112767	/nfs/dbraw/zinc/11/27/67/721112767.db2.gz	QPPLWVLKQVOCGZ-YADHBBJMSA-N	0	3	466.586	2.131	20	0		JEADHN
CC(=O)Oc1cc2ncnc(N3CCN4C[C@@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OC(C)=O	ZINC001164865919	721119701	/nfs/dbraw/zinc/11/97/01/721119701.db2.gz	PTUBFUTWWSYXBL-UXHICEINSA-N	0	3	477.521	2.355	20	0		JEADHN
O=S(=O)(c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1)N1CCCCC1	ZINC001164871592	721141915	/nfs/dbraw/zinc/14/19/15/721141915.db2.gz	FVJXCBKNXMAIIR-LEWJYISDSA-N	0	3	457.600	2.131	20	0		JEADHN
CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164872288	721151036	/nfs/dbraw/zinc/15/10/36/721151036.db2.gz	HHRZPCDLMSWRET-CEWLAPEOSA-N	0	3	459.616	2.423	20	0		JEADHN
CC(C)CCNS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164871650	721152279	/nfs/dbraw/zinc/15/22/79/721152279.db2.gz	GCMHZNIIHLXDPW-RTWAWAEBSA-N	0	3	459.616	2.281	20	0		JEADHN
CC(C)CCNS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164871653	721152827	/nfs/dbraw/zinc/15/28/27/721152827.db2.gz	GCMHZNIIHLXDPW-SFTDATJTSA-N	0	3	459.616	2.281	20	0		JEADHN
COC(=O)c1c[n-]c2nc[nH+]c(N3CCC[C@]4(C3)COCCN(Cc3c(C)noc3C)C4)c12	ZINC001164780248	721355898	/nfs/dbraw/zinc/35/58/98/721355898.db2.gz	DRLFWNZYFUZNJK-QHCPKHFHSA-N	0	3	454.531	2.468	20	0		JEADHN
Cc1nc(CN2CCOC[C@@]3(CN(c4cc(Cl)nc5c4CCNC5)CCO3)C2)cs1	ZINC001164924516	721831569	/nfs/dbraw/zinc/83/15/69/721831569.db2.gz	WUABSMHGYADONA-NRFANRHFSA-N	0	3	450.008	2.253	20	0		JEADHN
O=C(N1CCOCC1)[C@@]12CN(c3ncccn3)C[C@@H]1CN(c1ccc(CN3CCCC3)cn1)CCC2	ZINC001164430704	718956297	/nfs/dbraw/zinc/95/62/97/718956297.db2.gz	WMLVVLKRAHFDAP-HOFKKMOUSA-N	0	3	491.640	2.049	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1nc(CN3CCOCC3)nc3sc(C)c(C)c31)CC2	ZINC001164689627	719739583	/nfs/dbraw/zinc/73/95/83/719739583.db2.gz	JNJWEYDEGUOTND-UHFFFAOYSA-N	0	3	472.659	2.321	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1nc(CN3CCOCC3)nc3sc4c(c31)CCC4)CC2	ZINC001164690046	719739891	/nfs/dbraw/zinc/73/98/91/719739891.db2.gz	QZLNSKASMNNLRF-UHFFFAOYSA-N	0	3	484.670	2.193	20	0		JEADHN
Cc1nc2c(nc(Cl)nc2N2CCC3(CC2)C(=O)N(Cc2csc(C)n2)CCN3C)[nH]1	ZINC001164824140	720364222	/nfs/dbraw/zinc/36/42/22/720364222.db2.gz	JNHWKJFEGKSYQF-UHFFFAOYSA-N	0	3	460.995	2.393	20	0		JEADHN
CC(C)(C)OC(=O)Nc1cnc(N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)c2[nH]cnc21	ZINC001164739919	720751342	/nfs/dbraw/zinc/75/13/42/720751342.db2.gz	JTIJAIBLQGFUCS-GJZGRUSLSA-N	0	3	452.519	2.437	20	0		JEADHN
O=S(=O)(Nc1cc(F)ccc1F)c1ccc(N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)nc1	ZINC001164737844	720783424	/nfs/dbraw/zinc/78/34/24/720783424.db2.gz	CZOLQHYCPWATQY-IRXDYDNUSA-N	0	3	488.520	2.293	20	0		JEADHN
c1cc2nc(N3CCN4C[C@H](OCc5cccnc5)C[C@@H]4C3)nc(N3CCOCC3)c2s1	ZINC001164867092	721060079	/nfs/dbraw/zinc/06/00/79/721060079.db2.gz	HSNJOEZFIKLFEO-RTBURBONSA-N	0	3	452.584	2.403	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CCN4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)CC1	ZINC001164865974	721112218	/nfs/dbraw/zinc/11/22/18/721112218.db2.gz	QPPLWVLKQVOCGZ-FCHUYYIVSA-N	0	3	466.586	2.131	20	0		JEADHN
O=S(=O)(c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1)N1CCCCC1	ZINC001164871596	721141988	/nfs/dbraw/zinc/14/19/88/721141988.db2.gz	FVJXCBKNXMAIIR-RTWAWAEBSA-N	0	3	457.600	2.131	20	0		JEADHN
O=S(=O)(c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1)N1CCCCC1	ZINC001164871594	721142958	/nfs/dbraw/zinc/14/29/58/721142958.db2.gz	FVJXCBKNXMAIIR-NHCUHLMSSA-N	0	3	457.600	2.131	20	0		JEADHN
CCC(C)(C)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164876986	721151209	/nfs/dbraw/zinc/15/12/09/721151209.db2.gz	NJUYRESBWZSUDH-UXHICEINSA-N	0	3	459.616	2.423	20	0		JEADHN
CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164872293	721152947	/nfs/dbraw/zinc/15/29/47/721152947.db2.gz	HHRZPCDLMSWRET-SESVDKBCSA-N	0	3	459.616	2.423	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4ccc(N5CCN(c6ccccc6)CC5)nn4)C[C@H]3C2)cn1	ZINC001164770073	721201905	/nfs/dbraw/zinc/20/19/05/721201905.db2.gz	MWPZTXNZECJILQ-XZOQPEGZSA-N	0	3	458.614	2.495	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4cc(N5CCN(c6ccccc6)CC5)ncn4)C[C@@H]3C2)cn1	ZINC001164762035	721223557	/nfs/dbraw/zinc/22/35/57/721223557.db2.gz	BYVSBRXAEHGCJY-GOTSBHOMSA-N	0	3	458.614	2.495	20	0		JEADHN
COC(=O)c1c[n-]c2nc[nH+]c(N3CCC[C@@]4(C3)COCCN(Cc3c(C)noc3C)C4)c12	ZINC001164780247	721356809	/nfs/dbraw/zinc/35/68/09/721356809.db2.gz	DRLFWNZYFUZNJK-HSZRJFAPSA-N	0	3	454.531	2.468	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4nc(Cl)nc5[nH]cnc54)C3)O2)CC1	ZINC001164890269	721435868	/nfs/dbraw/zinc/43/58/68/721435868.db2.gz	CXGNFOKZNALQNB-IFXJQAMLSA-N	0	3	455.941	2.268	20	0		JEADHN
COC(=O)C1CCN(c2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)CC1	ZINC001164906780	721542229	/nfs/dbraw/zinc/54/22/29/721542229.db2.gz	LHYBOTLEQZVHDI-CTNGQTDRSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)c1cc2c(OC)[nH]c(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc-2n1	ZINC001164980547	722115612	/nfs/dbraw/zinc/11/56/12/722115612.db2.gz	RSZLJFNECWEUQN-UWJYYQICSA-N	0	3	451.527	2.480	20	0		JEADHN
COC(=O)[C@@H]1CNCCN1[C@@]1(F)CN(Cc2ccccc2)Cc2c(Cl)nc(Cl)nc21	ZINC001164635815	719134340	/nfs/dbraw/zinc/13/43/40/719134340.db2.gz	XEHGSMNJMLRAMQ-YWZLYKJASA-N	0	3	454.333	2.368	20	0		JEADHN
CC(C)N(C)Cc1nn(C(F)(F)c2nc(Cl)cc(N3CCOCC3)n2)c2c1CCNC2	ZINC001164684229	719609305	/nfs/dbraw/zinc/60/93/05/719609305.db2.gz	NMRHNLRNPFPONC-UHFFFAOYSA-N	0	3	455.941	2.247	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1cc(N3CCN(c4ccccc4F)CC3)ncn1)CC2	ZINC001164690290	719746130	/nfs/dbraw/zinc/74/61/30/719746130.db2.gz	YNCKCUYFZUXVPX-UHFFFAOYSA-N	0	3	467.593	2.123	20	0		JEADHN
CCN(CC)Cc1nc2sc(C)c(C)c2c(-n2nc(C(=O)N3CCOCC3)c3c2CNC3)n1	ZINC001164816288	720247439	/nfs/dbraw/zinc/24/74/39/720247439.db2.gz	HOIAECSKXRMYAO-UHFFFAOYSA-N	0	3	469.615	2.411	20	0		JEADHN
CC(C)CNC(=O)[C@@]12CCC3(CCN(c4cc(CN(C)C)ccn4)CC3)[C@@H]1CN(S(C)(=O)=O)C2	ZINC001164822371	720356915	/nfs/dbraw/zinc/35/69/15/720356915.db2.gz	DIDVZLILPDCPFJ-SQJMNOBHSA-N	0	3	491.702	2.174	20	0		JEADHN
CC(C)N1[C@@H]2CCN(c3nc(Cl)nc4c3S(=O)(=O)CC4)C[C@@H]2C[C@H]1Cn1cccn1	ZINC001164836966	720645220	/nfs/dbraw/zinc/64/52/20/720645220.db2.gz	AKJCYJRTPXASGV-YQQAZPJKSA-N	0	3	450.996	2.034	20	0		JEADHN
Cc1cc2c(ncnc2N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1S(=O)(=O)c1ccccc1	ZINC001164746256	720651187	/nfs/dbraw/zinc/65/11/87/720651187.db2.gz	WKFNCVUCHNWURY-RBUKOAKNSA-N	0	3	491.577	2.109	20	0		JEADHN
CN(C)C(=O)c1cc2cnc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)nc2n1C1CCCC1	ZINC001164740121	720698306	/nfs/dbraw/zinc/69/83/06/720698306.db2.gz	QFCJGIUVRFJWQY-WOJBJXKFSA-N	0	3	476.585	2.380	20	0		JEADHN
Cc1sc2nc(CN3CCOCC3)nc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c2c1C	ZINC001164740406	720763644	/nfs/dbraw/zinc/76/36/44/720763644.db2.gz	KVTXGMJXLNTSKN-MOPGFXCFSA-N	0	3	481.626	2.272	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)n1C	ZINC001164881186	721135134	/nfs/dbraw/zinc/13/51/34/721135134.db2.gz	ZNWRDXYRSIBKOU-JKSUJKDBSA-N	0	3	456.934	2.283	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4ccc(N5CCN(c6ccccc6)CC5)nn4)C[C@H]3C2)cn1	ZINC001164770069	721202406	/nfs/dbraw/zinc/20/24/06/721202406.db2.gz	MWPZTXNZECJILQ-DHIUTWEWSA-N	0	3	458.614	2.495	20	0		JEADHN
COCCN1CC2(C[C@@H]1COCC1CC1)CCN(c1[nH+]cnc3[n-]cc(S(C)(=O)=O)c31)CC2	ZINC001164788554	721455840	/nfs/dbraw/zinc/45/58/40/721455840.db2.gz	RHMZVRGPLDUCME-GOSISDBHSA-N	0	3	477.631	2.095	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C(=O)OCC	ZINC001164900288	721523078	/nfs/dbraw/zinc/52/30/78/721523078.db2.gz	PTUYFJHBJUESIQ-AEFFLSMTSA-N	0	3	458.490	2.311	20	0		JEADHN
Cc1nc(CN2CCOC[C@]3(CN(c4cc(Cl)nc5c4CCNC5)CCO3)C2)cs1	ZINC001164924522	721831492	/nfs/dbraw/zinc/83/14/92/721831492.db2.gz	WUABSMHGYADONA-OAQYLSRUSA-N	0	3	450.008	2.253	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2C[C@H]3CN(CC4CC4)C[C@@H](C2)O3)c1CN1CC[C@@H](CO)C1	ZINC001164967232	722074135	/nfs/dbraw/zinc/07/41/35/722074135.db2.gz	PCOHRTPJTNQKDU-NJYVYQBISA-N	0	3	471.646	2.180	20	0		JEADHN
NS(=O)(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c1	ZINC001164979585	722135046	/nfs/dbraw/zinc/13/50/46/722135046.db2.gz	LIJZEKMCJDCMEA-YJBOKZPZSA-N	0	3	487.960	2.050	20	0		JEADHN
c1cncc(CN2CCO[C@H]3CN(c4nc(N5CCCC5)nc(N5CCCC5)n4)CC[C@@H]3C2)c1	ZINC001164972691	722138630	/nfs/dbraw/zinc/13/86/30/722138630.db2.gz	AGYSPCAVQNXFSW-YADHBBJMSA-N	0	3	464.618	2.194	20	0		JEADHN
CC(C)CN1CCN(c2nc3cc(CN4CCN(C)CC4)sc3c(N3CCOCC3)n2)CC1	ZINC001164657347	719336533	/nfs/dbraw/zinc/33/65/33/719336533.db2.gz	ITFIMUDCLVTZEQ-UHFFFAOYSA-N	0	3	473.691	2.053	20	0		JEADHN
COC(=O)c1cc2c(ncnc2N2CCN(CC(C)C)CC2)n1S(=O)(=O)c1ccccc1	ZINC001164657452	719336619	/nfs/dbraw/zinc/33/66/19/719336619.db2.gz	MQECSMCQNLKMKI-UHFFFAOYSA-N	0	3	457.556	2.233	20	0		JEADHN
CNC(=O)CN1CCCC12CCN([C@]1(F)CN(C3CCCC3)c3nc(Cl)ncc3NC1=O)CC2	ZINC001164689510	719738242	/nfs/dbraw/zinc/73/82/42/719738242.db2.gz	FRPHJUNFLGKAJN-HSZRJFAPSA-N	0	3	494.015	2.173	20	0		JEADHN
CCOC(=O)c1c2ccccn2c2ncnc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)c12	ZINC001164745706	720608625	/nfs/dbraw/zinc/60/86/25/720608625.db2.gz	VOWQKJAGPOJYTG-IRXDYDNUSA-N	0	3	459.510	2.191	20	0		JEADHN
COc1ccc(Cn2cc3[nH]c(N4CCN5C[C@H](Oc6cncnc6)C[C@H]5C4)ccc-3c2=O)cc1	ZINC001164738030	720752638	/nfs/dbraw/zinc/75/26/38/720752638.db2.gz	DOAORMHONSYZGP-PZJWPPBQSA-N	0	3	472.549	2.378	20	0		JEADHN
c1cc(N2CCOCC2)ccc1-c1ccc(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)nn1	ZINC001164744146	720794010	/nfs/dbraw/zinc/79/40/10/720794010.db2.gz	HLGPTAZIKRIWDO-FGZHOGPDSA-N	0	3	459.554	2.112	20	0		JEADHN
COc1cc(N2CC[C@]3(CN(CC4CC4)C[C@@H]3COCc3cccnc3)C2)nc(S(C)(=O)=O)n1	ZINC001164755607	720891337	/nfs/dbraw/zinc/89/13/37/720891337.db2.gz	MDXOLEILSCXMLZ-YKSBVNFPSA-N	0	3	487.626	2.039	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CCN4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)CC1	ZINC001164865976	721111577	/nfs/dbraw/zinc/11/15/77/721111577.db2.gz	QPPLWVLKQVOCGZ-VXKWHMMOSA-N	0	3	466.586	2.131	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)cc1C(=O)OCC	ZINC001164870948	721192893	/nfs/dbraw/zinc/19/28/93/721192893.db2.gz	XUEJBASDHVGGFJ-MOPGFXCFSA-N	0	3	454.527	2.310	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@@]3(CCN(C(F)(F)c4nc5[nH]cnc5c(Cl)n4)C3)O2)CC1	ZINC001164896656	721435549	/nfs/dbraw/zinc/43/55/49/721435549.db2.gz	RRINDYAPPQMJSX-LIRRHRJNSA-N	0	3	455.941	2.268	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4nc(Cl)nc5[nH]cnc54)C3)O2)CC1	ZINC001164890270	721435889	/nfs/dbraw/zinc/43/58/89/721435889.db2.gz	CXGNFOKZNALQNB-KUHUBIRLSA-N	0	3	455.941	2.268	20	0		JEADHN
CC1(C)NC(=O)N(Cc2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)C1=O	ZINC001164909267	721555811	/nfs/dbraw/zinc/55/58/11/721555811.db2.gz	UDEXTJKAVCAERK-UYAOXDASSA-N	0	3	453.518	2.393	20	0		JEADHN
COc1cccc(OC)c1CN1CCC(N(C)c2nc3c(c(N4CCOCC4)n2)CNC3)CC1	ZINC001165020259	721842954	/nfs/dbraw/zinc/84/29/54/721842954.db2.gz	BGBGSNXTECCSRW-UHFFFAOYSA-N	0	3	468.602	2.034	20	0		JEADHN
COC(=O)c1cc2c(OC)[nH]c(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc-2n1	ZINC001164980541	722114789	/nfs/dbraw/zinc/11/47/89/722114789.db2.gz	RSZLJFNECWEUQN-DYESRHJHSA-N	0	3	451.527	2.480	20	0		JEADHN
CCN(CC)S(=O)(=O)c1ccc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc1	ZINC001164974293	722140435	/nfs/dbraw/zinc/14/04/35/722140435.db2.gz	DFYATSNCHUREDB-UNMCSNQZSA-N	0	3	459.616	2.234	20	0		JEADHN
O=S(=O)(c1ccc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc1)N1CCCCC1	ZINC001164974254	722141067	/nfs/dbraw/zinc/14/10/67/722141067.db2.gz	CWZPQPUVUQTXEH-GGAORHGYSA-N	0	3	471.627	2.379	20	0		JEADHN
CCOC(=O)[C@@H]1CCc2nnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc2C1	ZINC001164973968	722158203	/nfs/dbraw/zinc/15/82/03/722158203.db2.gz	NPPOPEZKLLTHEK-TXTKFYIRSA-N	0	3	451.571	2.267	20	0		JEADHN
O=C(N1CCOCC1)[C@]12CN(c3ncccn3)C[C@H]1CN(c1ccc(CN3CCCC3)cn1)CCC2	ZINC001164430707	718956417	/nfs/dbraw/zinc/95/64/17/718956417.db2.gz	WMLVVLKRAHFDAP-YIXXDRMTSA-N	0	3	491.640	2.049	20	0		JEADHN
O=C(N1CCOCC1)[C@@]12CN(c3ncccn3)C[C@H]1CN(c1ccc(CN3CCCC3)cn1)CCC2	ZINC001164430705	718956432	/nfs/dbraw/zinc/95/64/32/718956432.db2.gz	WMLVVLKRAHFDAP-KCWPFWIISA-N	0	3	491.640	2.049	20	0		JEADHN
CCOC(=O)C1CCN(C2CCN(C(F)(F)c3cc(S(N)(=O)=O)cnc3Cl)CC2)CC1	ZINC001164617359	719029933	/nfs/dbraw/zinc/02/99/33/719029933.db2.gz	KMTGWUPGFJMQOG-UHFFFAOYSA-N	0	3	480.965	2.171	20	0		JEADHN
COC(=O)[C@@H]1CNCCN1[C@]1(F)CN(Cc2ccccc2)Cc2c(Cl)nc(Cl)nc21	ZINC001164635808	719134097	/nfs/dbraw/zinc/13/40/97/719134097.db2.gz	XEHGSMNJMLRAMQ-MGPUTAFESA-N	0	3	454.333	2.368	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1ncccc1C(=O)N1CCN(Cc3ccccc3)CC1)CC2	ZINC001164683670	719729938	/nfs/dbraw/zinc/72/99/38/719729938.db2.gz	CBPQXRULVFRKHM-UHFFFAOYSA-N	0	3	490.652	2.220	20	0		JEADHN
CC(C)CNC(=O)[C@]12CCC3(CCN(c4cc(CN(C)C)ccn4)CC3)[C@@H]1CN(S(C)(=O)=O)C2	ZINC001164822365	720357085	/nfs/dbraw/zinc/35/70/85/720357085.db2.gz	DIDVZLILPDCPFJ-OFVILXPXSA-N	0	3	491.702	2.174	20	0		JEADHN
CCOC(=O)c1c2ccccn2c2ncnc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)c12	ZINC001164745707	720610226	/nfs/dbraw/zinc/61/02/26/720610226.db2.gz	VOWQKJAGPOJYTG-SJORKVTESA-N	0	3	459.510	2.191	20	0		JEADHN
Clc1nc2c(ncn2[C@H]2CCCCO2)c(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164742013	720693542	/nfs/dbraw/zinc/69/35/42/720693542.db2.gz	VIHWVANDOCZOCJ-ZMSDIMECSA-N	0	3	456.938	2.311	20	0		JEADHN
c1cc(-c2cnc(N3CCCCC3)nc2)nc(N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164737054	720720599	/nfs/dbraw/zinc/72/05/99/720720599.db2.gz	CSVCXIDBCKVUDK-PMACEKPBSA-N	0	3	459.558	2.056	20	0		JEADHN
c1cc(-c2cnc(N3CCCCC3)nc2)nc(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164737057	720721153	/nfs/dbraw/zinc/72/11/53/720721153.db2.gz	CSVCXIDBCKVUDK-WOJBJXKFSA-N	0	3	459.558	2.056	20	0		JEADHN
O=C(NCCSCc1ccco1)c1cccnc1N1CCN2C[C@@H](Oc3cncnc3)C[C@H]2C1	ZINC001164743370	720727215	/nfs/dbraw/zinc/72/72/15/720727215.db2.gz	PTGQFGDWPPNXGX-ICSRJNTNSA-N	0	3	480.594	2.470	20	0		JEADHN
COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164745856	720736636	/nfs/dbraw/zinc/73/66/36/720736636.db2.gz	WAYYOLOPFIMUAS-DLBZAZTESA-N	0	3	470.574	2.490	20	0		JEADHN
COC(=O)/C=C\c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164738543	720740014	/nfs/dbraw/zinc/74/00/14/720740014.db2.gz	FYFGSNAZAYLNAU-FOIQLMIDSA-N	0	3	480.569	2.384	20	0		JEADHN
COc1ccc(Cn2cc3[nH]c(N4CCN5C[C@H](Oc6cncnc6)C[C@@H]5C4)ccc-3c2=O)cc1	ZINC001164738032	720750985	/nfs/dbraw/zinc/75/09/85/720750985.db2.gz	DOAORMHONSYZGP-TZIWHRDSSA-N	0	3	472.549	2.378	20	0		JEADHN
Fc1ccccc1N1CCN(c2cc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)ncn2)CC1	ZINC001164746437	720772909	/nfs/dbraw/zinc/77/29/09/720772909.db2.gz	YDSKZDXBMLIRRC-UXHICEINSA-N	0	3	476.560	2.074	20	0		JEADHN
COc1ccc(-c2ccc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)nn2)c(OC)c1OC	ZINC001164750653	720793882	/nfs/dbraw/zinc/79/38/82/720793882.db2.gz	WOERLYCXBTWYQQ-IRXDYDNUSA-N	0	3	464.526	2.301	20	0		JEADHN
COc1ccc(-c2ccc(N3CCN4C[C@@H](Oc5cncnc5)C[C@@H]4C3)nn2)c(OC)c1OC	ZINC001164750659	720793951	/nfs/dbraw/zinc/79/39/51/720793951.db2.gz	WOERLYCXBTWYQQ-SJORKVTESA-N	0	3	464.526	2.301	20	0		JEADHN
C[C@H]1CCCN1C(=O)c1nn(-c2ncnc3c2CCN(Cc2ccccc2)C3)c2c1CNCC2	ZINC001164848112	720805453	/nfs/dbraw/zinc/80/54/53/720805453.db2.gz	ODZBPNCXJOYSEA-SFHVURJKSA-N	0	3	457.582	2.491	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4ncnc5c4ccn5S(=O)(=O)c4ccccc4)C[C@@H]3C2)cn1	ZINC001164768158	721105747	/nfs/dbraw/zinc/10/57/47/721105747.db2.gz	NNBZAAGCMJRMMD-UXHICEINSA-N	0	3	477.594	2.360	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@@]3(CCN(c4cc(-c5cc6c([nH]5)CCNC6=O)ccn4)C3)O2)CC1	ZINC001164886701	721407657	/nfs/dbraw/zinc/40/76/57/721407657.db2.gz	KTQHPJBSJHVMGR-IBVKSMDESA-N	0	3	464.614	2.128	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@@]3(CCN(C(F)(F)c4nc5[nH]cnc5c(Cl)n4)C3)O2)CC1	ZINC001164896652	721435405	/nfs/dbraw/zinc/43/54/05/721435405.db2.gz	RRINDYAPPQMJSX-KUHUBIRLSA-N	0	3	455.941	2.268	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@]3(CCN(C(F)(F)c4nc5[nH]cnc5c(Cl)n4)C3)O2)CC1	ZINC001164896649	721435880	/nfs/dbraw/zinc/43/58/80/721435880.db2.gz	RRINDYAPPQMJSX-IFXJQAMLSA-N	0	3	455.941	2.268	20	0		JEADHN
FC1(F)CCN(c2nc(N3CCOCC3)nc3c2CCN3)C[C@]12CCN(Cc1ccccn1)C2	ZINC001164906093	721696941	/nfs/dbraw/zinc/69/69/41/721696941.db2.gz	LDDKPKICBCXUIU-HSZRJFAPSA-N	0	3	471.556	2.414	20	0		JEADHN
COC(=O)c1cc2c(OC)[nH]c(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc-2n1	ZINC001164980543	722114363	/nfs/dbraw/zinc/11/43/63/722114363.db2.gz	RSZLJFNECWEUQN-LAUBAEHRSA-N	0	3	451.527	2.480	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)nn2)CC1	ZINC001164975213	722128726	/nfs/dbraw/zinc/12/87/26/722128726.db2.gz	FSSFPQJWZOZAIM-XZOQPEGZSA-N	0	3	480.613	2.378	20	0		JEADHN
NS(=O)(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c1	ZINC001164979579	722134803	/nfs/dbraw/zinc/13/48/03/722134803.db2.gz	LIJZEKMCJDCMEA-CRAIPNDOSA-N	0	3	487.960	2.050	20	0		JEADHN
CS(=O)(=O)N(Cc1noc2c1CNCC2)c1ccc2c(n1)CCN(Cc1ccccc1)C2	ZINC001164655554	719327155	/nfs/dbraw/zinc/32/71/55/719327155.db2.gz	QOAALEWYYQSIPY-UHFFFAOYSA-N	0	3	453.568	2.240	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1nccc(-c3cnc(N4CCCCC4)nc3)n1)CC2	ZINC001164685857	719726342	/nfs/dbraw/zinc/72/63/42/719726342.db2.gz	NRTSELDAHUNOTM-UHFFFAOYSA-N	0	3	450.591	2.105	20	0		JEADHN
CNC(=O)C[N@@H+]1CCCC12CCN(c1ccc(S(=O)(=O)[N-]c3cc(F)ccc3F)cn1)CC2	ZINC001164689830	719748147	/nfs/dbraw/zinc/74/81/47/719748147.db2.gz	LANZPKJVNSJGNZ-UHFFFAOYSA-N	0	3	479.553	2.341	20	0		JEADHN
CNC(=O)C[N@H+]1CCCC12CCN(c1ccc(S(=O)(=O)[N-]c3cc(F)ccc3F)cn1)CC2	ZINC001164689830	719748152	/nfs/dbraw/zinc/74/81/52/719748152.db2.gz	LANZPKJVNSJGNZ-UHFFFAOYSA-N	0	3	479.553	2.341	20	0		JEADHN
Cc1nc(CN2CCCC23CCN(c2nc4c(c(N5CCOCC5)n2)CNC4)CC3)cs1	ZINC001164691314	719812723	/nfs/dbraw/zinc/81/27/23/719812723.db2.gz	FSPJSLLNVZFLSJ-UHFFFAOYSA-N	0	3	455.632	2.316	20	0		JEADHN
CN(C)C(=O)N1CC2(CCN(c3ncccc3CN3CCCC3)CC2)[C@]2(CCN(C)C2=O)C1	ZINC001164714503	720162053	/nfs/dbraw/zinc/16/20/53/720162053.db2.gz	PXSMUZUBPDSXDJ-RUZDIDTESA-N	0	3	454.619	2.110	20	0		JEADHN
CCOC(=O)c1c2ccccn2c2ncnc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)c12	ZINC001164745704	720610828	/nfs/dbraw/zinc/61/08/28/720610828.db2.gz	VOWQKJAGPOJYTG-DLBZAZTESA-N	0	3	459.510	2.191	20	0		JEADHN
CC(C)N1[C@@H]2CCN(c3nc(Cl)nc4c3S(=O)(=O)CC4)C[C@H]2C[C@H]1Cn1cccn1	ZINC001164836962	720644567	/nfs/dbraw/zinc/64/45/67/720644567.db2.gz	AKJCYJRTPXASGV-HLLBOEOZSA-N	0	3	450.996	2.034	20	0		JEADHN
Cc1cc2c(ncnc2N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1S(=O)(=O)c1ccccc1	ZINC001164746252	720652264	/nfs/dbraw/zinc/65/22/64/720652264.db2.gz	WKFNCVUCHNWURY-MOPGFXCFSA-N	0	3	491.577	2.109	20	0		JEADHN
CN(C)C(=O)c1cc2cnc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)nc2n1C1CCCC1	ZINC001164740120	720697217	/nfs/dbraw/zinc/69/72/17/720697217.db2.gz	QFCJGIUVRFJWQY-VQTJNVASSA-N	0	3	476.585	2.380	20	0		JEADHN
CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CCN2C[C@@H](Oc3cncnc3)C[C@@H]2C1	ZINC001164741022	720699122	/nfs/dbraw/zinc/69/91/22/720699122.db2.gz	RVKNJJAUZLEMIX-SJORKVTESA-N	0	3	451.531	2.110	20	0		JEADHN
c1ncc(O[C@H]2C[C@H]3CN(c4nc(CN5CCOCC5)nc5sc6c(c54)CCC6)CCN3C2)cn1	ZINC001164739948	720761732	/nfs/dbraw/zinc/76/17/32/720761732.db2.gz	KASOSBKVZRBQMV-ROUUACIJSA-N	0	3	493.637	2.144	20	0		JEADHN
Cc1sc2nc(CN3CCOCC3)nc(N3CCN4C[C@@H](Oc5cncnc5)C[C@H]4C3)c2c1C	ZINC001164740407	720762256	/nfs/dbraw/zinc/76/22/56/720762256.db2.gz	KVTXGMJXLNTSKN-OALUTQOASA-N	0	3	481.626	2.272	20	0		JEADHN
C[C@H]1CCCN1C(=O)c1nn(-c2ncnc3c2CN(Cc2ccccc2)CC3)c2c1CNCC2	ZINC001164848685	720805636	/nfs/dbraw/zinc/80/56/36/720805636.db2.gz	QLCUQIRRWDWKMP-SFHVURJKSA-N	0	3	457.582	2.491	20	0		JEADHN
CC(=O)Oc1cc2ncnc(N3CCN4C[C@H](OCc5cccnc5)C[C@@H]4C3)c2cc1OC(C)=O	ZINC001164865921	721119584	/nfs/dbraw/zinc/11/95/84/721119584.db2.gz	PTUBFUTWWSYXBL-WOJBJXKFSA-N	0	3	477.521	2.355	20	0		JEADHN
CC(C)(C)C(=O)Nc1ccnc(N2CCN(C[C@H]3CCCO3)CC2)c1CN1CC[C@@H](CO)C1	ZINC001165038734	721914732	/nfs/dbraw/zinc/91/47/32/721914732.db2.gz	PNCSUWQXQOBKFF-WOJBJXKFSA-N	0	3	459.635	2.181	20	0		JEADHN
CCN(CC)S(=O)(=O)c1ccc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc1	ZINC001164974286	722140796	/nfs/dbraw/zinc/14/07/96/722140796.db2.gz	DFYATSNCHUREDB-IFMALSPDSA-N	0	3	459.616	2.234	20	0		JEADHN
CCOC(=O)N1CCc2nnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc2C1	ZINC001164976143	722142488	/nfs/dbraw/zinc/14/24/88/722142488.db2.gz	HKWUAZAJGHKAJC-SIKLNZKXSA-N	0	3	452.559	2.114	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1nc(/C=C/C(=O)OC)ccc1NC(=O)C(C)(C)C)CC2	ZINC001164686543	719732704	/nfs/dbraw/zinc/73/27/04/719732704.db2.gz	PDPYADHUSDGMAI-CSKARUKUSA-N	0	3	471.602	2.433	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1ccc(-c3ccc(N4CCOCC4)cc3)nn1)CC2	ZINC001164690295	719751400	/nfs/dbraw/zinc/75/14/00/719751400.db2.gz	YUNPUMBSJQEQIA-UHFFFAOYSA-N	0	3	450.587	2.161	20	0		JEADHN
Cc1nc(CN2CCN(C)C3(CCN(c4cc(N5CCCC5)nc(C)n4)CC3)C2=O)cs1	ZINC001164826810	720360321	/nfs/dbraw/zinc/36/03/21/720360321.db2.gz	ZKKPLKUAAGXFQO-UHFFFAOYSA-N	0	3	455.632	2.463	20	0		JEADHN
Cc1ccc(S(=O)(=O)n2ccc3c2ncnc3N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)cc1	ZINC001164739556	720630305	/nfs/dbraw/zinc/63/03/05/720630305.db2.gz	FVSHQHBKLZNNCX-RTBURBONSA-N	0	3	491.577	2.109	20	0		JEADHN
CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CCN2C[C@H](Oc3cncnc3)C[C@@H]2C1	ZINC001164741020	720699893	/nfs/dbraw/zinc/69/98/93/720699893.db2.gz	RVKNJJAUZLEMIX-IAGOWNOFSA-N	0	3	451.531	2.110	20	0		JEADHN
O=C(NCCSCc1ccco1)c1cccnc1N1CCN2C[C@H](Oc3cncnc3)C[C@@H]2C1	ZINC001164743374	720727442	/nfs/dbraw/zinc/72/74/42/720727442.db2.gz	PTGQFGDWPPNXGX-UYAOXDASSA-N	0	3	480.594	2.470	20	0		JEADHN
COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164745862	720737651	/nfs/dbraw/zinc/73/76/51/720737651.db2.gz	WAYYOLOPFIMUAS-SJORKVTESA-N	0	3	470.574	2.490	20	0		JEADHN
CN(C)Cc1ccnc(N2CCC3(CC[C@@]4(C(=O)N5CCCC5)CN(S(C)(=O)=O)C[C@@H]34)CC2)c1	ZINC001164843483	720741313	/nfs/dbraw/zinc/74/13/13/720741313.db2.gz	LAYWTOOSRHEGJE-SQJMNOBHSA-N	0	3	489.686	2.024	20	0		JEADHN
CN(C)Cc1ccnc(N2CCC3(CC[C@@]4(C(=O)N5CCCC5)CN(S(C)(=O)=O)C[C@H]34)CC2)c1	ZINC001164843482	720741566	/nfs/dbraw/zinc/74/15/66/720741566.db2.gz	LAYWTOOSRHEGJE-PXDATVDWSA-N	0	3	489.686	2.024	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@@H+]2CC2CC2)C1	ZINC001164743688	720836137	/nfs/dbraw/zinc/83/61/37/720836137.db2.gz	JRQUYZYAZNUMGX-RVKKMQEKSA-N	0	3	470.965	2.369	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc(Cl)nc2N1CC[C@@H]2[C@H](C[C@@H](Cn3cncn3)[N@H+]2CC2CC2)C1	ZINC001164743688	720836140	/nfs/dbraw/zinc/83/61/40/720836140.db2.gz	JRQUYZYAZNUMGX-RVKKMQEKSA-N	0	3	470.965	2.369	20	0		JEADHN
COCC[N@@H+]1CCO[C@@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@@H]2C1	ZINC001164853392	720881754	/nfs/dbraw/zinc/88/17/54/720881754.db2.gz	CJNQJZOKIRMGGA-IIBYNOLFSA-N	0	3	482.553	2.334	20	0		JEADHN
COCC[N@H+]1CCO[C@@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@@H]2C1	ZINC001164853392	720881755	/nfs/dbraw/zinc/88/17/55/720881755.db2.gz	CJNQJZOKIRMGGA-IIBYNOLFSA-N	0	3	482.553	2.334	20	0		JEADHN
COc1cc(N2CC[C@@]3(CN(CC4CC4)C[C@@H]3COCc3cccnc3)C2)nc(S(C)(=O)=O)n1	ZINC001164755605	720890940	/nfs/dbraw/zinc/89/09/40/720890940.db2.gz	MDXOLEILSCXMLZ-HYBUGGRVSA-N	0	3	487.626	2.039	20	0		JEADHN
COCCOc1cc2ncnc(N3C[C@@H]4CCN(Cc5cnn(C)c5)C[C@@H]4C3)c2cc1OCCOC	ZINC001164762142	721090179	/nfs/dbraw/zinc/09/01/79/721090179.db2.gz	CSDFUPKCJRJITJ-LEWJYISDSA-N	0	3	496.612	2.372	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4ncnc5c4ccn5S(=O)(=O)c4ccccc4)C[C@@H]3C2)cn1	ZINC001164768155	721105225	/nfs/dbraw/zinc/10/52/25/721105225.db2.gz	NNBZAAGCMJRMMD-PMACEKPBSA-N	0	3	477.594	2.360	20	0		JEADHN
CC(=O)Oc1cc2ncnc(N3CCN4C[C@H](OCc5cccnc5)C[C@H]4C3)c2cc1OC(C)=O	ZINC001164865920	721118626	/nfs/dbraw/zinc/11/86/26/721118626.db2.gz	PTUBFUTWWSYXBL-VQTJNVASSA-N	0	3	477.521	2.355	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)n1C	ZINC001164881184	721134400	/nfs/dbraw/zinc/13/44/00/721134400.db2.gz	ZNWRDXYRSIBKOU-HZPDHXFCSA-N	0	3	456.934	2.283	20	0		JEADHN
CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCN4C[C@H](OCc5cccnc5)C[C@H]4C3)nn2)C1	ZINC001164875368	721149892	/nfs/dbraw/zinc/14/98/92/721149892.db2.gz	LCCXINLQPASSSS-BHIFYINESA-N	0	3	466.586	2.131	20	0		JEADHN
CCC(CC)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164877567	721151677	/nfs/dbraw/zinc/15/16/77/721151677.db2.gz	OQVHTIIFMFZPPD-RTWAWAEBSA-N	0	3	459.616	2.423	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4ccc(N5CCN(c6ccccc6)CC5)nn4)C[C@@H]3C2)cn1	ZINC001164770072	721201223	/nfs/dbraw/zinc/20/12/23/721201223.db2.gz	MWPZTXNZECJILQ-PKTZIBPZSA-N	0	3	458.614	2.495	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc[nH+]c2N1CCC[C@@]2(C1)COCCN(Cc1c(C)noc1C)C2	ZINC001164778429	721338507	/nfs/dbraw/zinc/33/85/07/721338507.db2.gz	WGVDCDDZCOIBDV-HSZRJFAPSA-N	0	3	454.531	2.420	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CC[C@]3(C2)CCC[C@@H](CN2CCN(C)CC2)O3)[nH]1	ZINC001164891929	721420643	/nfs/dbraw/zinc/42/06/43/721420643.db2.gz	WRQJCIKKGIRINO-NYHFZMIOSA-N	0	3	462.982	2.163	20	0		JEADHN
COCCN1CC2(C[C@H]1COCC1CC1)CCN(c1[nH+]cnc3[n-]cc(S(C)(=O)=O)c31)CC2	ZINC001164788555	721455662	/nfs/dbraw/zinc/45/56/62/721455662.db2.gz	RHMZVRGPLDUCME-SFHVURJKSA-N	0	3	477.631	2.095	20	0		JEADHN
Fc1cccc(O[C@@H]2C[C@H]3CN(c4nc5scnc5c(N5CCOCC5)n4)CCN3C2)c1	ZINC001164901292	721524020	/nfs/dbraw/zinc/52/40/20/721524020.db2.gz	WKBSOSBRTYSAFZ-FUHWJXTLSA-N	0	3	456.547	2.404	20	0		JEADHN
COC(=O)C1CCN(c2nccnc2N2CCN3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)CC1	ZINC001164911000	721543899	/nfs/dbraw/zinc/54/38/99/721543899.db2.gz	UXVAISIXGRQVSI-PZJWPPBQSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)C1CCN(c2nccnc2N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@@H]3C2)CC1	ZINC001164910993	721544173	/nfs/dbraw/zinc/54/41/73/721544173.db2.gz	UXVAISIXGRQVSI-CTNGQTDRSA-N	0	3	455.534	2.347	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nn2)CC1	ZINC001164975212	722129050	/nfs/dbraw/zinc/12/90/50/722129050.db2.gz	FSSFPQJWZOZAIM-PKTZIBPZSA-N	0	3	480.613	2.378	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)nn2)CC1	ZINC001164975211	722129187	/nfs/dbraw/zinc/12/91/87/722129187.db2.gz	FSSFPQJWZOZAIM-GOTSBHOMSA-N	0	3	480.613	2.378	20	0		JEADHN
CCOC(=O)[C@@H]1CCc2nnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc2C1	ZINC001164973972	722158458	/nfs/dbraw/zinc/15/84/58/722158458.db2.gz	NPPOPEZKLLTHEK-VIZSFHNOSA-N	0	3	451.571	2.267	20	0		JEADHN
O=C(C[N-]S(=O)(=O)c1ccc(Br)s1)N1CCC([NH+]2CCCCC2)CC1	ZINC000004110723	562932496	/nfs/dbraw/zinc/93/24/96/562932496.db2.gz	LDOQBONBCCLHFH-UHFFFAOYSA-N	0	3	450.424	2.266	20	0		JEADHN
COC(=O)[C@H]1CNCCN1[C@]1(F)CN(Cc2ccccc2)Cc2c(Cl)nc(Cl)nc21	ZINC001164635796	719134786	/nfs/dbraw/zinc/13/47/86/719134786.db2.gz	XEHGSMNJMLRAMQ-FOIQADDNSA-N	0	3	454.333	2.368	20	0		JEADHN
Cc1nc(CN2CCN(C)C3(CCN(c4cc(Cl)nc5c4CCNC5)CC3)C2=O)cs1	ZINC001164820017	720378002	/nfs/dbraw/zinc/37/80/02/720378002.db2.gz	KJDRAGFCYSDHKF-UHFFFAOYSA-N	0	3	461.035	2.459	20	0		JEADHN
Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164742011	720693381	/nfs/dbraw/zinc/69/33/81/720693381.db2.gz	VIHWVANDOCZOCJ-INMHGKMJSA-N	0	3	456.938	2.311	20	0		JEADHN
CC(C)(C)C(=O)OCn1ccc2c1ncnc2N1CCN2C[C@@H](Oc3cncnc3)C[C@H]2C1	ZINC001164741021	720698770	/nfs/dbraw/zinc/69/87/70/720698770.db2.gz	RVKNJJAUZLEMIX-IRXDYDNUSA-N	0	3	451.531	2.110	20	0		JEADHN
Cc1sc2nc(CN3CCOCC3)nc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)c2c1C	ZINC001164740408	720762834	/nfs/dbraw/zinc/76/28/34/720762834.db2.gz	KVTXGMJXLNTSKN-RBUKOAKNSA-N	0	3	481.626	2.272	20	0		JEADHN
O=S(=O)(Nc1cc(F)ccc1F)c1ccc(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)nc1	ZINC001164737828	720780856	/nfs/dbraw/zinc/78/08/56/720780856.db2.gz	CZOLQHYCPWATQY-DLBZAZTESA-N	0	3	488.520	2.293	20	0		JEADHN
c1cc(N2CCOCC2)ccc1-c1ccc(N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)nn1	ZINC001164744148	720793772	/nfs/dbraw/zinc/79/37/72/720793772.db2.gz	HLGPTAZIKRIWDO-VXKWHMMOSA-N	0	3	459.554	2.112	20	0		JEADHN
c1cc(N2CCOCC2)ccc1-c1ccc(N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)nn1	ZINC001164744150	720794798	/nfs/dbraw/zinc/79/47/98/720794798.db2.gz	HLGPTAZIKRIWDO-YADHBBJMSA-N	0	3	459.554	2.112	20	0		JEADHN
COc1ccc(-c2ccc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)nn2)c(OC)c1OC	ZINC001164750645	720795012	/nfs/dbraw/zinc/79/50/12/720795012.db2.gz	WOERLYCXBTWYQQ-DLBZAZTESA-N	0	3	464.526	2.301	20	0		JEADHN
COc1ccc(-c2ccc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)nn2)c(OC)c1OC	ZINC001164750648	720795061	/nfs/dbraw/zinc/79/50/61/720795061.db2.gz	WOERLYCXBTWYQQ-IAGOWNOFSA-N	0	3	464.526	2.301	20	0		JEADHN
COc1cc(N2CC[C@]3(CN(CC4CC4)C[C@H]3COCc3cccnc3)C2)nc(S(C)(=O)=O)n1	ZINC001164755606	720891102	/nfs/dbraw/zinc/89/11/02/720891102.db2.gz	MDXOLEILSCXMLZ-RDPSFJRHSA-N	0	3	487.626	2.039	20	0		JEADHN
Cn1cc(CN2CC[C@@H]3CN(c4ncnc5c4ccn5S(=O)(=O)c4ccccc4)C[C@H]3C2)cn1	ZINC001164768162	721104770	/nfs/dbraw/zinc/10/47/70/721104770.db2.gz	NNBZAAGCMJRMMD-WOJBJXKFSA-N	0	3	477.594	2.360	20	0		JEADHN
CCC(CC)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164877565	721152199	/nfs/dbraw/zinc/15/21/99/721152199.db2.gz	OQVHTIIFMFZPPD-LEWJYISDSA-N	0	3	459.616	2.423	20	0		JEADHN
CCC(CC)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164877568	721152211	/nfs/dbraw/zinc/15/22/11/721152211.db2.gz	OQVHTIIFMFZPPD-SFTDATJTSA-N	0	3	459.616	2.423	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)cc1C(=O)OCC	ZINC001164870963	721192665	/nfs/dbraw/zinc/19/26/65/721192665.db2.gz	XUEJBASDHVGGFJ-RTBURBONSA-N	0	3	454.527	2.310	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4ccc(N5CCN(c6ccccc6)CC5)nn4)C[C@@H]3C2)cn1	ZINC001164770071	721201733	/nfs/dbraw/zinc/20/17/33/721201733.db2.gz	MWPZTXNZECJILQ-GOTSBHOMSA-N	0	3	458.614	2.495	20	0		JEADHN
CN1CCN(C[C@@H]2CCC[C@]3(CCN(c4cc(-c5cc6c([nH]5)CCNC6=O)ccn4)C3)O2)CC1	ZINC001164886706	721407780	/nfs/dbraw/zinc/40/77/80/721407780.db2.gz	KTQHPJBSJHVMGR-RXFWQSSRSA-N	0	3	464.614	2.128	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)CCC[C@H](CN2CCN(C)CC2)O3)[nH]1	ZINC001164891928	721420272	/nfs/dbraw/zinc/42/02/72/721420272.db2.gz	WRQJCIKKGIRINO-IVZQSRNASA-N	0	3	462.982	2.163	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)nc1C(=O)OCC	ZINC001164900290	721522811	/nfs/dbraw/zinc/52/28/11/721522811.db2.gz	PTUYFJHBJUESIQ-SJLPKXTDSA-N	0	3	458.490	2.311	20	0		JEADHN
Fc1cccc(O[C@H]2C[C@@H]3CN(c4nc5scnc5c(N5CCOCC5)n4)CCN3C2)c1	ZINC001164901291	721523824	/nfs/dbraw/zinc/52/38/24/721523824.db2.gz	WKBSOSBRTYSAFZ-AEFFLSMTSA-N	0	3	456.547	2.404	20	0		JEADHN
CN1CCN(Cc2cc3nc(N4CCN(C5CCCC5)CC4)nc(N4CCOCC4)c3s2)CC1	ZINC001165032667	721859063	/nfs/dbraw/zinc/85/90/63/721859063.db2.gz	YNQNNLBIKFJHGB-UHFFFAOYSA-N	0	3	485.702	2.340	20	0		JEADHN
CCc1cc(N2CCC3(CC2)COCCN(Cc2ccncc2)C3)nc(N2CCOCC2)n1	ZINC001164960024	722057773	/nfs/dbraw/zinc/05/77/73/722057773.db2.gz	DAZUORXALSHBAN-UHFFFAOYSA-N	0	3	452.603	2.390	20	0		JEADHN
O=C1NCCc2[nH]c(-c3ccnc(N4CC[C@@H]5CN(Cc6cccnc6)CCO[C@@H]5C4)c3)cc21	ZINC001164977354	722114875	/nfs/dbraw/zinc/11/48/75/722114875.db2.gz	MSTWXVIDCCLHHE-HYBUGGRVSA-N	0	3	458.566	2.485	20	0		JEADHN
CCOC(=O)N1CCc2nnc(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc2C1	ZINC001164976142	722142161	/nfs/dbraw/zinc/14/21/61/722142161.db2.gz	HKWUAZAJGHKAJC-KNQAVFIVSA-N	0	3	452.559	2.114	20	0		JEADHN
CC[C@H]1C(=O)Nc2cnc(N3CCC4(CCCN4CC(=O)NC)CC3)nc2N1C1CCCC1	ZINC001164687540	719717437	/nfs/dbraw/zinc/71/74/37/719717437.db2.gz	ZIACCSJMZGZSRX-IBGZPJMESA-N	0	3	455.607	2.137	20	0		JEADHN
CC[C@H]1C(=O)N(C)c2cnc(N3CCC4(CCCN4CC(=O)NC)CC3)nc2N1C1CCCC1	ZINC001164686526	719719396	/nfs/dbraw/zinc/71/93/96/719719396.db2.gz	PBEIZQUSLKCBBO-IBGZPJMESA-N	0	3	469.634	2.161	20	0		JEADHN
CN(C)C(=O)N1CC2(CCN(c3ncccc3CN3CCCC3)CC2)[C@@]2(CCN(C)C2=O)C1	ZINC001164714506	720162269	/nfs/dbraw/zinc/16/22/69/720162269.db2.gz	PXSMUZUBPDSXDJ-VWLOTQADSA-N	0	3	454.619	2.110	20	0		JEADHN
O=C(c1nn(-c2nc(CN3CCCC3)nc3sc4c(c32)CCCC4)c2c1CNC2)N1CCOCC1	ZINC001164815588	720248712	/nfs/dbraw/zinc/24/87/12/720248712.db2.gz	CISYIHSDYKQEIG-UHFFFAOYSA-N	0	3	493.637	2.427	20	0		JEADHN
c1cc(-c2cnc(N3CCCCC3)nc2)nc(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164737056	720722432	/nfs/dbraw/zinc/72/24/32/720722432.db2.gz	CSVCXIDBCKVUDK-VQTJNVASSA-N	0	3	459.558	2.056	20	0		JEADHN
O=C(c1cccnc1N1CCN2C[C@H](Oc3cncnc3)C[C@H]2C1)N1CCN(Cc2ccccc2)CC1	ZINC001164740358	720727475	/nfs/dbraw/zinc/72/74/75/720727475.db2.gz	KGVHHBAPPWQLBM-BJKOFHAPSA-N	0	3	499.619	2.172	20	0		JEADHN
CN(C)Cc1ccnc(N2CCC3(CC[C@]4(C(=O)N5CCCC5)CN(S(C)(=O)=O)C[C@@H]34)CC2)c1	ZINC001164843481	720741888	/nfs/dbraw/zinc/74/18/88/720741888.db2.gz	LAYWTOOSRHEGJE-OFVILXPXSA-N	0	3	489.686	2.024	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)n1C	ZINC001164881179	721134285	/nfs/dbraw/zinc/13/42/85/721134285.db2.gz	ZNWRDXYRSIBKOU-CVEARBPZSA-N	0	3	456.934	2.283	20	0		JEADHN
CC(C)CCNS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164871645	721151329	/nfs/dbraw/zinc/15/13/29/721151329.db2.gz	GCMHZNIIHLXDPW-LEWJYISDSA-N	0	3	459.616	2.281	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4nc(Cl)nc5[nH]cnc54)C3)O2)CC1	ZINC001164890268	721435733	/nfs/dbraw/zinc/43/57/33/721435733.db2.gz	CXGNFOKZNALQNB-AUUYWEPGSA-N	0	3	455.941	2.268	20	0		JEADHN
COC(=O)C1CCN(c2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nn2)CC1	ZINC001164906782	721542516	/nfs/dbraw/zinc/54/25/16/721542516.db2.gz	LHYBOTLEQZVHDI-FPOVZHCZSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)C1CCN(c2nccnc2N2CCN3C[C@H](Oc4cccc(F)c4)C[C@@H]3C2)CC1	ZINC001164911003	721544135	/nfs/dbraw/zinc/54/41/35/721544135.db2.gz	UXVAISIXGRQVSI-TZIWHRDSSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)C1CCN(c2ccnc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)n2)CC1	ZINC001164911529	721544834	/nfs/dbraw/zinc/54/48/34/721544834.db2.gz	XCHVAUVDULFOGW-TZIWHRDSSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)C1CCN(c2ccnc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)n2)CC1	ZINC001164911519	721545540	/nfs/dbraw/zinc/54/55/40/721545540.db2.gz	XCHVAUVDULFOGW-CTNGQTDRSA-N	0	3	455.534	2.347	20	0		JEADHN
CC1(C)NC(=O)N(Cc2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)C1=O	ZINC001164909263	721555852	/nfs/dbraw/zinc/55/58/52/721555852.db2.gz	UDEXTJKAVCAERK-ICSRJNTNSA-N	0	3	453.518	2.393	20	0		JEADHN
FC1(F)CCN(c2nc(N3CCOCC3)nc3c2CCN3)C[C@@]12CCN(Cc1ccccn1)C2	ZINC001164906095	721696254	/nfs/dbraw/zinc/69/62/54/721696254.db2.gz	LDDKPKICBCXUIU-QHCPKHFHSA-N	0	3	471.556	2.414	20	0		JEADHN
FC1(F)CCN(c2nc3c(c(N4CCOCC4)n2)CNC3)C[C@@]12CCN(Cc1ccccn1)C2	ZINC001164904377	721722012	/nfs/dbraw/zinc/72/20/12/721722012.db2.gz	CXBPZPXQCVPTOX-QHCPKHFHSA-N	0	3	471.556	2.049	20	0		JEADHN
O=C1NCCc2[nH]c(-c3ccnc(N4CC[C@@H]5CN(Cc6cccnc6)CCO[C@H]5C4)c3)cc21	ZINC001164977360	722114538	/nfs/dbraw/zinc/11/45/38/722114538.db2.gz	MSTWXVIDCCLHHE-YKSBVNFPSA-N	0	3	458.566	2.485	20	0		JEADHN
CCOC(=O)N1CCc2nnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc2C1	ZINC001164976145	722142134	/nfs/dbraw/zinc/14/21/34/722142134.db2.gz	HKWUAZAJGHKAJC-UGKGYDQZSA-N	0	3	452.559	2.114	20	0		JEADHN
CN(Cc1ccc(N2CCC[C@@]3(C(=O)N4CCOCC4)CN(c4ncccn4)C[C@@H]3C2)nc1)C1CC1	ZINC001164430440	718956558	/nfs/dbraw/zinc/95/65/58/718956558.db2.gz	VFIUOWUAYZEWCI-WXVAWEFUSA-N	0	3	491.640	2.048	20	0		JEADHN
CC(C)n1nc(CN(c2nccs2)c2ccnc(N3CCN(C)CC3)n2)c2c1CNCC2	ZINC001164711203	720091406	/nfs/dbraw/zinc/09/14/06/720091406.db2.gz	PIDWRAPFINGQDX-UHFFFAOYSA-N	0	3	453.620	2.446	20	0		JEADHN
Cc1sc2nc(CN3CCCC3)nc(-n3nc(C(=O)N4CCOCC4)c4c3CNC4)c2c1C	ZINC001164815739	720248431	/nfs/dbraw/zinc/24/84/31/720248431.db2.gz	DTTKBIZKXYSKHN-UHFFFAOYSA-N	0	3	467.599	2.165	20	0		JEADHN
CC(C)CNC(=O)[C@@]12CCC3(CCN(c4cc(CN(C)C)ccn4)CC3)[C@H]1CN(S(C)(=O)=O)C2	ZINC001164822368	720356986	/nfs/dbraw/zinc/35/69/86/720356986.db2.gz	DIDVZLILPDCPFJ-PXDATVDWSA-N	0	3	491.702	2.174	20	0		JEADHN
CC(C)N1[C@H](Cn2cccn2)C[C@H]2CN(c3nc(Cl)nc4c3S(=O)(=O)CC4)CC[C@@H]21	ZINC001164836968	720644553	/nfs/dbraw/zinc/64/45/53/720644553.db2.gz	AKJCYJRTPXASGV-ZOBUZTSGSA-N	0	3	450.996	2.034	20	0		JEADHN
O=C(c1cccnc1N1CCN2C[C@@H](Oc3cncnc3)C[C@@H]2C1)N1CCN(Cc2ccccc2)CC1	ZINC001164740360	720727606	/nfs/dbraw/zinc/72/76/06/720727606.db2.gz	KGVHHBAPPWQLBM-RPWUZVMVSA-N	0	3	499.619	2.172	20	0		JEADHN
c1ncc(O[C@@H]2C[C@@H]3CN(c4nc(CN5CCOCC5)nc5sc6c(c54)CCC6)CCN3C2)cn1	ZINC001164739945	720761917	/nfs/dbraw/zinc/76/19/17/720761917.db2.gz	KASOSBKVZRBQMV-QZTJIDSGSA-N	0	3	493.637	2.144	20	0		JEADHN
c1cc(N2CCOCC2)ccc1-c1ccc(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)nn1	ZINC001164744144	720795402	/nfs/dbraw/zinc/79/54/02/720795402.db2.gz	HLGPTAZIKRIWDO-FCHUYYIVSA-N	0	3	459.554	2.112	20	0		JEADHN
CS(=O)(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@H](C[C@H](Cn3cncn3)N2CC2CC2)C1	ZINC001164748851	720843521	/nfs/dbraw/zinc/84/35/21/720843521.db2.gz	VAPKWKCVHPVJFU-BRWVUGGUSA-N	0	3	450.996	2.109	20	0		JEADHN
CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCN4C[C@@H](OCc5cccnc5)C[C@@H]4C3)nn2)C1	ZINC001164875372	721150242	/nfs/dbraw/zinc/15/02/42/721150242.db2.gz	LCCXINLQPASSSS-VSKRKVRLSA-N	0	3	466.586	2.131	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@H](Oc4cccc(F)c4)C[C@H]3C2)nc1C(=O)OCC	ZINC001164900289	721522741	/nfs/dbraw/zinc/52/27/41/721522741.db2.gz	PTUYFJHBJUESIQ-FUHWJXTLSA-N	0	3	458.490	2.311	20	0		JEADHN
Fc1cccc(O[C@@H]2C[C@@H]3CN(c4nc5scnc5c(N5CCOCC5)n4)CCN3C2)c1	ZINC001164901293	721524818	/nfs/dbraw/zinc/52/48/18/721524818.db2.gz	WKBSOSBRTYSAFZ-SJLPKXTDSA-N	0	3	456.547	2.404	20	0		JEADHN
COC(=O)C1CCN(c2ccnc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)n2)CC1	ZINC001164911526	721545433	/nfs/dbraw/zinc/54/54/33/721545433.db2.gz	XCHVAUVDULFOGW-PZJWPPBQSA-N	0	3	455.534	2.347	20	0		JEADHN
CC1(C)NC(=O)N(Cc2ccc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@@H]4C3)nc2)C1=O	ZINC001164909265	721556194	/nfs/dbraw/zinc/55/61/94/721556194.db2.gz	UDEXTJKAVCAERK-QUCCMNQESA-N	0	3	453.518	2.393	20	0		JEADHN
COC(=O)c1cc2c(OC)[nH]c(N3CC[C@@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc-2n1	ZINC001164980545	722115542	/nfs/dbraw/zinc/11/55/42/722115542.db2.gz	RSZLJFNECWEUQN-UTKZUKDTSA-N	0	3	451.527	2.480	20	0		JEADHN
NS(=O)(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c1	ZINC001164979583	722134765	/nfs/dbraw/zinc/13/47/65/722134765.db2.gz	LIJZEKMCJDCMEA-QAPCUYQASA-N	0	3	487.960	2.050	20	0		JEADHN
c1cncc(CN2CCO[C@@H]3CN(c4nc(N5CCCC5)nc(N5CCCC5)n4)CC[C@@H]3C2)c1	ZINC001164972682	722138619	/nfs/dbraw/zinc/13/86/19/722138619.db2.gz	AGYSPCAVQNXFSW-FGZHOGPDSA-N	0	3	464.618	2.194	20	0		JEADHN
O=S(=O)(c1ccc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@H]3C2)nc1)N1CCCCC1	ZINC001164974255	722140665	/nfs/dbraw/zinc/14/06/65/722140665.db2.gz	CWZPQPUVUQTXEH-GMAHTHKFSA-N	0	3	471.627	2.379	20	0		JEADHN
CN(Cc1ccc(N2CCC[C@@]3(C(=O)N4CCOCC4)CN(c4ncccn4)C[C@H]3C2)nc1)C1CC1	ZINC001164430437	718956523	/nfs/dbraw/zinc/95/65/23/718956523.db2.gz	VFIUOWUAYZEWCI-AJTFRIOCSA-N	0	3	491.640	2.048	20	0		JEADHN
CC[C@@H]1C(=O)Nc2cnc(N3CCC4(CCCN4CC(=O)NC)CC3)nc2N1C1CCCC1	ZINC001164687542	719719500	/nfs/dbraw/zinc/71/95/00/719719500.db2.gz	ZIACCSJMZGZSRX-LJQANCHMSA-N	0	3	455.607	2.137	20	0		JEADHN
CC[C@@H]1C(=O)N(C)c2cnc(N3CCC4(CCCN4CC(=O)NC)CC3)nc2N1C1CCCC1	ZINC001164686535	719719584	/nfs/dbraw/zinc/71/95/84/719719584.db2.gz	PBEIZQUSLKCBBO-LJQANCHMSA-N	0	3	469.634	2.161	20	0		JEADHN
CNC(=O)CN1CCCC12CCN([C@@]1(F)CN(C3CCCC3)c3nc(Cl)ncc3NC1=O)CC2	ZINC001164689511	719736543	/nfs/dbraw/zinc/73/65/43/719736543.db2.gz	FRPHJUNFLGKAJN-QHCPKHFHSA-N	0	3	494.015	2.173	20	0		JEADHN
CCOC(=O)c1cc2ccc(N3CCc4c(nnn4C)[C@@H]3COCC[NH+]3CCCC3)nc2[n-]1	ZINC001164715976	720190496	/nfs/dbraw/zinc/19/04/96/720190496.db2.gz	NIIMZVHDDFYRTK-IBGZPJMESA-N	0	3	453.547	2.084	20	0		JEADHN
CC(C)CNC(=O)[C@]12CCC3(CCN(c4cc(CN(C)C)ccn4)CC3)[C@H]1CN(S(C)(=O)=O)C2	ZINC001164822344	720357126	/nfs/dbraw/zinc/35/71/26/720357126.db2.gz	DIDVZLILPDCPFJ-BWKNWUBXSA-N	0	3	491.702	2.174	20	0		JEADHN
CCOC(=O)c1c[nH]c2ncnc(N3CCC4(CC3)C(=O)N(Cc3csc(C)n3)CCN4C)c12	ZINC001164824828	720362391	/nfs/dbraw/zinc/36/23/91/720362391.db2.gz	NLSFTPLNQRHTHW-UHFFFAOYSA-N	0	3	483.598	2.213	20	0		JEADHN
Clc1nc2c(ncn2[C@@H]2CCCCO2)c(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164742012	720692994	/nfs/dbraw/zinc/69/29/94/720692994.db2.gz	VIHWVANDOCZOCJ-UXLLHSPISA-N	0	3	456.938	2.311	20	0		JEADHN
COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164745858	720736314	/nfs/dbraw/zinc/73/63/14/720736314.db2.gz	WAYYOLOPFIMUAS-IAGOWNOFSA-N	0	3	470.574	2.490	20	0		JEADHN
O=S(=O)(Nc1cc(F)ccc1F)c1ccc(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)nc1	ZINC001164737842	720784618	/nfs/dbraw/zinc/78/46/18/720784618.db2.gz	CZOLQHYCPWATQY-IAGOWNOFSA-N	0	3	488.520	2.293	20	0		JEADHN
C[C@@H]1CCCN1C(=O)c1nn(-c2ncnc3c2CCN(Cc2ccccc2)C3)c2c1CNCC2	ZINC001164848110	720805778	/nfs/dbraw/zinc/80/57/78/720805778.db2.gz	ODZBPNCXJOYSEA-GOSISDBHSA-N	0	3	457.582	2.491	20	0		JEADHN
COCC[N@@H+]1CCO[C@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@H]2C1	ZINC001164853393	720882061	/nfs/dbraw/zinc/88/20/61/720882061.db2.gz	CJNQJZOKIRMGGA-KKSFZXQISA-N	0	3	482.553	2.334	20	0		JEADHN
COCC[N@H+]1CCO[C@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@H]2C1	ZINC001164853393	720882063	/nfs/dbraw/zinc/88/20/63/720882063.db2.gz	CJNQJZOKIRMGGA-KKSFZXQISA-N	0	3	482.553	2.334	20	0		JEADHN
COc1cc(N2CC[C@@]3(CN(CC4CC4)C[C@H]3COCc3cccnc3)C2)nc(S(C)(=O)=O)n1	ZINC001164755603	720891199	/nfs/dbraw/zinc/89/11/99/720891199.db2.gz	MDXOLEILSCXMLZ-GBXCKJPGSA-N	0	3	487.626	2.039	20	0		JEADHN
c1cc2nc(N3CCN4C[C@@H](OCc5cccnc5)C[C@H]4C3)nc(N3CCOCC3)c2s1	ZINC001164867089	721059941	/nfs/dbraw/zinc/05/99/41/721059941.db2.gz	HSNJOEZFIKLFEO-OALUTQOASA-N	0	3	452.584	2.403	20	0		JEADHN
COCCOc1cc2ncnc(N3C[C@H]4CCN(Cc5cnn(C)c5)C[C@H]4C3)c2cc1OCCOC	ZINC001164762147	721090429	/nfs/dbraw/zinc/09/04/29/721090429.db2.gz	CSDFUPKCJRJITJ-RTWAWAEBSA-N	0	3	496.612	2.372	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4ncnc5c4ccn5S(=O)(=O)c4ccccc4)C[C@H]3C2)cn1	ZINC001164768160	721105664	/nfs/dbraw/zinc/10/56/64/721105664.db2.gz	NNBZAAGCMJRMMD-VQTJNVASSA-N	0	3	477.594	2.360	20	0		JEADHN
CCOC(=O)C1CCN(c2ccc(N3CCN4C[C@H](OCc5cccnc5)C[C@@H]4C3)nn2)CC1	ZINC001164865975	721111346	/nfs/dbraw/zinc/11/13/46/721111346.db2.gz	QPPLWVLKQVOCGZ-FGZHOGPDSA-N	0	3	466.586	2.131	20	0		JEADHN
CCOC(=O)[C@@H]1CCCN(c2ccc(N3CCN4C[C@@H](OCc5cccnc5)C[C@H]4C3)nn2)C1	ZINC001164875370	721148847	/nfs/dbraw/zinc/14/88/47/721148847.db2.gz	LCCXINLQPASSSS-FSSWDIPSSA-N	0	3	466.586	2.131	20	0		JEADHN
CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164872290	721152426	/nfs/dbraw/zinc/15/24/26/721152426.db2.gz	HHRZPCDLMSWRET-JBACZVJFSA-N	0	3	459.616	2.423	20	0		JEADHN
COC(=O)C1CCN(c2ccc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)nn2)CC1	ZINC001164962271	722057734	/nfs/dbraw/zinc/05/77/34/722057734.db2.gz	CEOPEHIBNTTYGA-UHFFFAOYSA-N	0	3	480.613	2.380	20	0		JEADHN
O=S(=O)(c1ccc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)nc1)N1CCCCC1	ZINC001164974256	722140469	/nfs/dbraw/zinc/14/04/69/722140469.db2.gz	CWZPQPUVUQTXEH-JTHBVZDNSA-N	0	3	471.627	2.379	20	0		JEADHN
O=C(c1cnc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c(Cl)c1)N1CCOCC1	ZINC001164972614	722143699	/nfs/dbraw/zinc/14/36/99/722143699.db2.gz	AEWZWNZKOUKBMP-DENIHFKCSA-N	0	3	471.989	2.330	20	0		JEADHN
O=C(c1cnc(N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c(Cl)c1)N1CCOCC1	ZINC001164972626	722143741	/nfs/dbraw/zinc/14/37/41/722143741.db2.gz	AEWZWNZKOUKBMP-SIKLNZKXSA-N	0	3	471.989	2.330	20	0		JEADHN
CCOC(=O)[C@@H]1CCc2nnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@@H]4C3)cc2C1	ZINC001164973975	722158388	/nfs/dbraw/zinc/15/83/88/722158388.db2.gz	NPPOPEZKLLTHEK-ZRCGQRJVSA-N	0	3	451.571	2.267	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1ncc3cc(C(=O)N(C)C)n(C4CCCC4)c3n1)CC2	ZINC001164686728	719720454	/nfs/dbraw/zinc/72/04/54/719720454.db2.gz	QPXPZAKYTCELQV-UHFFFAOYSA-N	0	3	467.618	2.429	20	0		JEADHN
CNC(=O)CN1CCCC12CCN(c1ccc(-c3ccc(OC)c(OC)c3OC)nn1)CC2	ZINC001164690135	719749657	/nfs/dbraw/zinc/74/96/57/719749657.db2.gz	UGRZJDDPEIULIP-UHFFFAOYSA-N	0	3	455.559	2.350	20	0		JEADHN
CN(C)C(=O)N1CC2(CCN(c3ccc(CN4CCCC4)cn3)CC2)[C@]2(CCN(C)C2=O)C1	ZINC001164716327	720161605	/nfs/dbraw/zinc/16/16/05/720161605.db2.gz	ZKKFGYFWYQCWNL-RUZDIDTESA-N	0	3	454.619	2.110	20	0		JEADHN
CCOC(=O)c1cc2ccc(N3CCc4c(nnn4C)[C@H]3COCC[NH+]3CCCC3)nc2[n-]1	ZINC001164715977	720190946	/nfs/dbraw/zinc/19/09/46/720190946.db2.gz	NIIMZVHDDFYRTK-LJQANCHMSA-N	0	3	453.547	2.084	20	0		JEADHN
Cc1ccc(S(=O)(=O)n2ccc3c2ncnc3N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)cc1	ZINC001164739553	720630548	/nfs/dbraw/zinc/63/05/48/720630548.db2.gz	FVSHQHBKLZNNCX-MOPGFXCFSA-N	0	3	491.577	2.109	20	0		JEADHN
O=C(NCCSCc1ccco1)c1cccnc1N1CCN2C[C@@H](Oc3cncnc3)C[C@@H]2C1	ZINC001164743372	720728752	/nfs/dbraw/zinc/72/87/52/720728752.db2.gz	PTGQFGDWPPNXGX-QUCCMNQESA-N	0	3	480.594	2.470	20	0		JEADHN
COc1ccc(Cn2cc3[nH]c(N4CCN5C[C@@H](Oc6cncnc6)C[C@H]5C4)ccc-3c2=O)cc1	ZINC001164738027	720751806	/nfs/dbraw/zinc/75/18/06/720751806.db2.gz	DOAORMHONSYZGP-FPOVZHCZSA-N	0	3	472.549	2.378	20	0		JEADHN
Fc1ccccc1N1CCN(c2cc(N3CCN4C[C@H](Oc5cncnc5)C[C@H]4C3)ncn2)CC1	ZINC001164746439	720772203	/nfs/dbraw/zinc/77/22/03/720772203.db2.gz	YDSKZDXBMLIRRC-VQTJNVASSA-N	0	3	476.560	2.074	20	0		JEADHN
C[C@@H]1CCCN1C(=O)c1nn(-c2ncnc3c2CN(Cc2ccccc2)CC3)c2c1CNCC2	ZINC001164848681	720805595	/nfs/dbraw/zinc/80/55/95/720805595.db2.gz	QLCUQIRRWDWKMP-GOSISDBHSA-N	0	3	457.582	2.491	20	0		JEADHN
CS(=O)(=O)c1ccc(Cl)nc1N1CC[C@@H]2[C@@H](C[C@@H](Cn3cncn3)N2CC2CC2)C1	ZINC001164748861	720843979	/nfs/dbraw/zinc/84/39/79/720843979.db2.gz	VAPKWKCVHPVJFU-YESZJQIVSA-N	0	3	450.996	2.109	20	0		JEADHN
CC(=O)Oc1cc2ncnc(N3CCN4C[C@@H](OCc5cccnc5)C[C@H]4C3)c2cc1OC(C)=O	ZINC001164865918	721118697	/nfs/dbraw/zinc/11/86/97/721118697.db2.gz	PTUBFUTWWSYXBL-PMACEKPBSA-N	0	3	477.521	2.355	20	0		JEADHN
CCC(C)(C)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164876988	721151550	/nfs/dbraw/zinc/15/15/50/721151550.db2.gz	NJUYRESBWZSUDH-WOJBJXKFSA-N	0	3	459.616	2.423	20	0		JEADHN
CCC(C)(C)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164876985	721151698	/nfs/dbraw/zinc/15/16/98/721151698.db2.gz	NJUYRESBWZSUDH-PMACEKPBSA-N	0	3	459.616	2.423	20	0		JEADHN
CC(C)CCNS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164871647	721152604	/nfs/dbraw/zinc/15/26/04/721152604.db2.gz	GCMHZNIIHLXDPW-NHCUHLMSSA-N	0	3	459.616	2.281	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)cc1C(=O)OCC	ZINC001164870954	721193098	/nfs/dbraw/zinc/19/30/98/721193098.db2.gz	XUEJBASDHVGGFJ-RBUKOAKNSA-N	0	3	454.527	2.310	20	0		JEADHN
COC(=O)c1cc2c([n-]1)nc[nH+]c2N1CCC[C@]2(C1)COCCN(Cc1c(C)noc1C)C2	ZINC001164778430	721338563	/nfs/dbraw/zinc/33/85/63/721338563.db2.gz	WGVDCDDZCOIBDV-QHCPKHFHSA-N	0	3	454.531	2.420	20	0		JEADHN
CN1CCN(C[C@H]2CCC[C@]3(CCN(C(F)(F)c4nc5[nH]cnc5c(Cl)n4)C3)O2)CC1	ZINC001164896646	721435340	/nfs/dbraw/zinc/43/53/40/721435340.db2.gz	RRINDYAPPQMJSX-AUUYWEPGSA-N	0	3	455.941	2.268	20	0		JEADHN
Fc1cccc(O[C@H]2C[C@H]3CN(c4nc5scnc5c(N5CCOCC5)n4)CCN3C2)c1	ZINC001164901294	721524779	/nfs/dbraw/zinc/52/47/79/721524779.db2.gz	WKBSOSBRTYSAFZ-WMZOPIPTSA-N	0	3	456.547	2.404	20	0		JEADHN
COC(=O)C1CCN(c2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@@H]4C3)nn2)CC1	ZINC001164906787	721543265	/nfs/dbraw/zinc/54/32/65/721543265.db2.gz	LHYBOTLEQZVHDI-TZIWHRDSSA-N	0	3	455.534	2.347	20	0		JEADHN
COC(=O)C1CCN(c2ccnc(N3CCN4C[C@@H](Oc5cccc(F)c5)C[C@H]4C3)n2)CC1	ZINC001164911522	721545296	/nfs/dbraw/zinc/54/52/96/721545296.db2.gz	XCHVAUVDULFOGW-FPOVZHCZSA-N	0	3	455.534	2.347	20	0		JEADHN
COc1cccc(OC)c1CN1CCC(N(C)c2ncccc2C(=O)N2CCNCC2)CC1	ZINC001165022588	721842177	/nfs/dbraw/zinc/84/21/77/721842177.db2.gz	PSXNMUNAEBZNLQ-UHFFFAOYSA-N	0	3	453.587	2.245	20	0		JEADHN
COC(=O)C1CCN(c2ccnc(N3CCC4(CC3)COCCN(Cc3ccncc3)C4)n2)CC1	ZINC001164961592	722058209	/nfs/dbraw/zinc/05/82/09/722058209.db2.gz	MKANEDOAJKMSGI-UHFFFAOYSA-N	0	3	480.613	2.380	20	0		JEADHN
NS(=O)(=O)c1cnc(Cl)c(C(F)(F)N2CC[C@H]3CN(Cc4cccnc4)CCO[C@@H]3C2)c1	ZINC001164979581	722135229	/nfs/dbraw/zinc/13/52/29/722135229.db2.gz	LIJZEKMCJDCMEA-MAUKXSAKSA-N	0	3	487.960	2.050	20	0		JEADHN
CCOC(=O)[C@@H]1CCc2nnc(N3CC[C@H]4CN(Cc5cccnc5)CCO[C@H]4C3)cc2C1	ZINC001164973965	722158125	/nfs/dbraw/zinc/15/81/25/722158125.db2.gz	NPPOPEZKLLTHEK-QTEQDKRBSA-N	0	3	451.571	2.267	20	0		JEADHN
COC(=O)[C@H]1CNCCN1[C@@]1(F)CN(Cc2ccccc2)Cc2c(Cl)nc(Cl)nc21	ZINC001164635812	719134291	/nfs/dbraw/zinc/13/42/91/719134291.db2.gz	XEHGSMNJMLRAMQ-QRWLVFNGSA-N	0	3	454.333	2.368	20	0		JEADHN
CC(C)n1nc(CN(c2nccs2)c2ccc(N3CCN(C)CC3)nn2)c2c1CNCC2	ZINC001164710757	720091261	/nfs/dbraw/zinc/09/12/61/720091261.db2.gz	LTBFJBZTQIZSDV-UHFFFAOYSA-N	0	3	453.620	2.446	20	0		JEADHN
Cc1cc2c(ncnc2N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1S(=O)(=O)c1ccccc1	ZINC001164746254	720650897	/nfs/dbraw/zinc/65/08/97/720650897.db2.gz	WKFNCVUCHNWURY-OALUTQOASA-N	0	3	491.577	2.109	20	0		JEADHN
c1cc(-c2cnc(N3CCCCC3)nc2)nc(N2CCN3C[C@@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164737055	720721998	/nfs/dbraw/zinc/72/19/98/720721998.db2.gz	CSVCXIDBCKVUDK-UXHICEINSA-N	0	3	459.558	2.056	20	0		JEADHN
COC(OC)c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@@H](Oc4cncnc4)C[C@H]3C2)n1	ZINC001164745860	720736178	/nfs/dbraw/zinc/73/61/78/720736178.db2.gz	WAYYOLOPFIMUAS-IRXDYDNUSA-N	0	3	470.574	2.490	20	0		JEADHN
COC(=O)/C=C/c1ccc(NC(=O)C(C)(C)C)c(N2CCN3C[C@H](Oc4cncnc4)C[C@@H]3C2)n1	ZINC001164738547	720739368	/nfs/dbraw/zinc/73/93/68/720739368.db2.gz	FYFGSNAZAYLNAU-QVHAGIGGSA-N	0	3	480.569	2.384	20	0		JEADHN
CC(C)(C)OC(=O)Nc1cnc(N2CCN3C[C@H](Oc4cncnc4)C[C@H]3C2)c2[nH]cnc21	ZINC001164739921	720751512	/nfs/dbraw/zinc/75/15/12/720751512.db2.gz	JTIJAIBLQGFUCS-LSDHHAIUSA-N	0	3	452.519	2.437	20	0		JEADHN
COc1ccc(Cn2cc3[nH]c(N4CCN5C[C@@H](Oc6cncnc6)C[C@@H]5C4)ccc-3c2=O)cc1	ZINC001164738024	720752315	/nfs/dbraw/zinc/75/23/15/720752315.db2.gz	DOAORMHONSYZGP-CTNGQTDRSA-N	0	3	472.549	2.378	20	0		JEADHN
Cc1sc2nc(CN3CCOCC3)nc(N3CCN4C[C@H](Oc5cncnc5)C[C@@H]4C3)c2c1C	ZINC001164740409	720761985	/nfs/dbraw/zinc/76/19/85/720761985.db2.gz	KVTXGMJXLNTSKN-RTBURBONSA-N	0	3	481.626	2.272	20	0		JEADHN
COCC[N@@H+]1CCO[C@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@@H]2C1	ZINC001164853391	720881846	/nfs/dbraw/zinc/88/18/46/720881846.db2.gz	CJNQJZOKIRMGGA-IERDGZPVSA-N	0	3	482.553	2.334	20	0		JEADHN
COCC[N@H+]1CCO[C@H]2CN(c3ccc(S(=O)(=O)[N-]c4cc(F)ccc4F)cn3)CC[C@@H]2C1	ZINC001164853391	720881849	/nfs/dbraw/zinc/88/18/49/720881849.db2.gz	CJNQJZOKIRMGGA-IERDGZPVSA-N	0	3	482.553	2.334	20	0		JEADHN
CCC[C@H](C)NS(=O)(=O)c1ccc(N2CCN3C[C@@H](OCc4cccnc4)C[C@@H]3C2)nc1	ZINC001164872295	721151663	/nfs/dbraw/zinc/15/16/63/721151663.db2.gz	HHRZPCDLMSWRET-TYPHKJRUSA-N	0	3	459.616	2.423	20	0		JEADHN
CCC(C)(C)NS(=O)(=O)c1ccc(N2CCN3C[C@H](OCc4cccnc4)C[C@H]3C2)nc1	ZINC001164876987	721152097	/nfs/dbraw/zinc/15/20/97/721152097.db2.gz	NJUYRESBWZSUDH-VQTJNVASSA-N	0	3	459.616	2.423	20	0		JEADHN
CCOC(=O)c1cnc(N2CCN3C[C@@H](OCc4cccnc4)C[C@H]3C2)cc1C(=O)OCC	ZINC001164870951	721192723	/nfs/dbraw/zinc/19/27/23/721192723.db2.gz	XUEJBASDHVGGFJ-OALUTQOASA-N	0	3	454.527	2.310	20	0		JEADHN
Cn1cc(CN2CC[C@H]3CN(c4cc(N5CCN(c6ccccc6)CC5)ncn4)C[C@H]3C2)cn1	ZINC001164762037	721223101	/nfs/dbraw/zinc/22/31/01/721223101.db2.gz	BYVSBRXAEHGCJY-XZOQPEGZSA-N	0	3	458.614	2.495	20	0		JEADHN
CN(C)C(=O)CN1CCOCC2(CCN(c3nc(Cl)ccc3CN3CCCC3)CC2)C1	ZINC001164874520	721275805	/nfs/dbraw/zinc/27/58/05/721275805.db2.gz	TXLZBFRYVGXMHX-UHFFFAOYSA-N	0	3	450.027	2.338	20	0		JEADHN
COC(=O)c1cc2c(nc(Cl)nc2N2CC[C@@]3(C2)CCC[C@@H](CN2CCN(C)CC2)O3)[nH]1	ZINC001164891930	721420621	/nfs/dbraw/zinc/42/06/21/721420621.db2.gz	WRQJCIKKGIRINO-OYHNWAKOSA-N	0	3	462.982	2.163	20	0		JEADHN
COC(=O)C1CCN(c2nccnc2N2CCN3C[C@@H](Oc4cccc(F)c4)C[C@H]3C2)CC1	ZINC001164910996	721544438	/nfs/dbraw/zinc/54/44/38/721544438.db2.gz	UXVAISIXGRQVSI-FPOVZHCZSA-N	0	3	455.534	2.347	20	0		JEADHN
CC1(C)NC(=O)N(Cc2ccc(N3CCN4C[C@H](Oc5cccc(F)c5)C[C@H]4C3)nc2)C1=O	ZINC001164909261	721556169	/nfs/dbraw/zinc/55/61/69/721556169.db2.gz	UDEXTJKAVCAERK-AZUAARDMSA-N	0	3	453.518	2.393	20	0		JEADHN
FC1(F)CCN(c2nc3c(c(N4CCOCC4)n2)CNC3)C[C@]12CCN(Cc1ccccn1)C2	ZINC001164904376	721719857	/nfs/dbraw/zinc/71/98/57/721719857.db2.gz	CXBPZPXQCVPTOX-HSZRJFAPSA-N	0	3	471.556	2.049	20	0		JEADHN
Cc1ccc(CN2CCOC3(CCN(c4nc5c(c(N6CCOCC6)n4)CNC5)CC3)C2)cc1	ZINC001164939944	721929766	/nfs/dbraw/zinc/92/97/66/721929766.db2.gz	PAVXAXAZZYRHOZ-UHFFFAOYSA-N	0	3	464.614	2.096	20	0		JEADHN
O=C1NCCc2[nH]c(-c3ccnc(N4CC[C@H]5CN(Cc6cccnc6)CCO[C@@H]5C4)c3)cc21	ZINC001164977352	722114563	/nfs/dbraw/zinc/11/45/63/722114563.db2.gz	MSTWXVIDCCLHHE-GBXCKJPGSA-N	0	3	458.566	2.485	20	0		JEADHN
O=C(c1cnc(N2CC[C@@H]3CN(Cc4cccnc4)CCO[C@H]3C2)c(Cl)c1)N1CCOCC1	ZINC001164972617	722143919	/nfs/dbraw/zinc/14/39/19/722143919.db2.gz	AEWZWNZKOUKBMP-KNQAVFIVSA-N	0	3	471.989	2.330	20	0		JEADHN