smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCC[NH+]1CCC(NC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1	ZINC000159883062	326945369	/nfs/dbraw/zinc/94/53/69/326945369.db2.gz	FITOYKAKKAWZKH-UHFFFAOYSA-N	2	2	359.518	2.173	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NCCc2[nH+]ccn2Cc2ccccc2)CC1	ZINC000159583633	545964248	/nfs/dbraw/zinc/96/42/48/545964248.db2.gz	DTZUCSLUPJNLAW-UHFFFAOYSA-N	2	2	355.486	2.211	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NCCc2[nH+]ccn2Cc2ccccc2)CC1	ZINC000159583633	545964253	/nfs/dbraw/zinc/96/42/53/545964253.db2.gz	DTZUCSLUPJNLAW-UHFFFAOYSA-N	2	2	355.486	2.211	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NCCCOC	ZINC000160019351	546001441	/nfs/dbraw/zinc/00/14/41/546001441.db2.gz	IBXOTSPTZLSMJZ-KRWDZBQOSA-N	2	2	362.518	2.161	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)NC[C@@H]1CCCO1	ZINC000160051348	546003497	/nfs/dbraw/zinc/00/34/97/546003497.db2.gz	HNXOGTMJNQKKNI-HKUYNNGSSA-N	2	2	374.529	2.304	20	70		FEIDLP
C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705766	546064508	/nfs/dbraw/zinc/06/45/08/546064508.db2.gz	BBFAWVJDYOVSST-OAUYIBNBSA-N	2	2	363.412	2.294	20	70		FEIDLP
C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705766	546064516	/nfs/dbraw/zinc/06/45/16/546064516.db2.gz	BBFAWVJDYOVSST-OAUYIBNBSA-N	2	2	363.412	2.294	20	70		FEIDLP
C[NH+](C)C1CC[NH+](CCNC(=O)N[C@@H]2CCO[C@H](c3ccccc3)C2)CC1	ZINC000159888137	326945583	/nfs/dbraw/zinc/94/55/83/326945583.db2.gz	GOBVVJZMDRDMSX-QUCCMNQESA-N	2	2	374.529	2.232	20	70		FEIDLP
COc1cc([C@@H](C)[NH2+]C2CC[NH+](C)CC2)ccc1S(=O)(=O)C(F)F	ZINC000161487280	327000978	/nfs/dbraw/zinc/00/09/78/327000978.db2.gz	HIPWHKYCVGMGFO-LLVKDONJSA-N	2	2	362.442	2.436	20	70		FEIDLP
CCc1ccc(C[NH+]2CCN(C(=O)NC[C@@H]3CCC[N@H+](C)C3)CC2)s1	ZINC000159444911	545954218	/nfs/dbraw/zinc/95/42/18/545954218.db2.gz	HXLLXAIUFJITSJ-INIZCTEOSA-N	2	2	364.559	2.480	20	70		FEIDLP
CCc1ccc(C[NH+]2CCN(C(=O)NC[C@@H]3CCC[N@@H+](C)C3)CC2)s1	ZINC000159444911	545954222	/nfs/dbraw/zinc/95/42/22/545954222.db2.gz	HXLLXAIUFJITSJ-INIZCTEOSA-N	2	2	364.559	2.480	20	70		FEIDLP
COC(=O)C1([N@H+](C)C[C@H](O)Cn2c[nH+]c3cc(C)c(C)cc32)CCCC1	ZINC000159483837	545957628	/nfs/dbraw/zinc/95/76/28/545957628.db2.gz	LKLBBFLUVWCCAJ-INIZCTEOSA-N	2	2	359.470	2.432	20	70		FEIDLP
COC(=O)C1([N@@H+](C)C[C@H](O)Cn2c[nH+]c3cc(C)c(C)cc32)CCCC1	ZINC000159483837	545957631	/nfs/dbraw/zinc/95/76/31/545957631.db2.gz	LKLBBFLUVWCCAJ-INIZCTEOSA-N	2	2	359.470	2.432	20	70		FEIDLP
C[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)[N@@H+]1CCc2ccccc2C1	ZINC000160254435	546023319	/nfs/dbraw/zinc/02/33/19/546023319.db2.gz	QOVSAFOPWYULOY-SFHVURJKSA-N	2	2	373.541	2.250	20	70		FEIDLP
C[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)[N@H+]1CCc2ccccc2C1	ZINC000160254435	546023324	/nfs/dbraw/zinc/02/33/24/546023324.db2.gz	QOVSAFOPWYULOY-SFHVURJKSA-N	2	2	373.541	2.250	20	70		FEIDLP
C[NH+](C)CCCOc1ccc(CNC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1	ZINC000161388939	546126138	/nfs/dbraw/zinc/12/61/38/546126138.db2.gz	AYGUXZVHRLOKRA-QGZVFWFLSA-N	2	2	356.470	2.092	20	70		FEIDLP
CC(=O)Nc1ccccc1C[NH2+]C[C@@H](O)C[N@H+]1CCc2ccccc2C1	ZINC000160252289	546022612	/nfs/dbraw/zinc/02/26/12/546022612.db2.gz	IROMNQWQYPXLLH-HXUWFJFHSA-N	2	2	353.466	2.154	20	70		FEIDLP
C[NH+](C)CCNC(=O)[C@H](Cc1ccccc1)Nc1cc[nH+]c(C2CC2)n1	ZINC000161389193	546126125	/nfs/dbraw/zinc/12/61/25/546126125.db2.gz	YJWWOIRSTGRXEJ-KRWDZBQOSA-N	2	2	353.470	2.055	20	70		FEIDLP
C[NH+](C)C1CC[NH+](CCNC(=O)N[C@H]2CCO[C@@H](c3ccccc3)C2)CC1	ZINC000159888553	545989609	/nfs/dbraw/zinc/98/96/09/545989609.db2.gz	GOBVVJZMDRDMSX-AZUAARDMSA-N	2	2	374.529	2.232	20	70		FEIDLP
Cn1cc[nH+]c1CC1CC[NH+]([C@@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000159968016	545996227	/nfs/dbraw/zinc/99/62/27/545996227.db2.gz	MYXIWZATLRQFHX-CQSZACIVSA-N	2	2	358.408	2.228	20	70		FEIDLP
C[C@H](NC(=O)C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccc(Br)cc1	ZINC000217552051	548682028	/nfs/dbraw/zinc/68/20/28/548682028.db2.gz	OGUKLFIJIZYKMZ-STQMWFEESA-N	2	2	354.292	2.297	20	70		FEIDLP
C[C@H](NC(=O)C[N@H+]1CCC[C@@H](C[NH3+])C1)c1ccc(Br)cc1	ZINC000217552051	548682034	/nfs/dbraw/zinc/68/20/34/548682034.db2.gz	OGUKLFIJIZYKMZ-STQMWFEESA-N	2	2	354.292	2.297	20	70		FEIDLP
CSc1ccc(OCC[NH+]2CCC([N@@H+]3CCC[C@H]3C(N)=O)CC2)cc1	ZINC000159393317	545949990	/nfs/dbraw/zinc/94/99/90/545949990.db2.gz	XVIHOQJLPDHAPO-SFHVURJKSA-N	2	2	363.527	2.201	20	70		FEIDLP
CSc1ccc(OCC[NH+]2CCC([N@H+]3CCC[C@H]3C(N)=O)CC2)cc1	ZINC000159393317	545949995	/nfs/dbraw/zinc/94/99/95/545949995.db2.gz	XVIHOQJLPDHAPO-SFHVURJKSA-N	2	2	363.527	2.201	20	70		FEIDLP
CSCCNC(=O)N(C)[C@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000160482081	546045566	/nfs/dbraw/zinc/04/55/66/546045566.db2.gz	SYNRQLJBAUKUQK-IRXDYDNUSA-N	2	2	356.580	2.328	20	70		FEIDLP
CSCCNC(=O)N(C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000160482081	546045569	/nfs/dbraw/zinc/04/55/69/546045569.db2.gz	SYNRQLJBAUKUQK-IRXDYDNUSA-N	2	2	356.580	2.328	20	70		FEIDLP
CC(C)C[N@@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160856348	546078746	/nfs/dbraw/zinc/07/87/46/546078746.db2.gz	JVYFONYNGJCFOG-IBGZPJMESA-N	2	2	373.545	2.277	20	70		FEIDLP
CC(C)C[N@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160856348	546078749	/nfs/dbraw/zinc/07/87/49/546078749.db2.gz	JVYFONYNGJCFOG-IBGZPJMESA-N	2	2	373.545	2.277	20	70		FEIDLP
O=C(NC[C@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161390851	546126052	/nfs/dbraw/zinc/12/60/52/546126052.db2.gz	PFPFRIJHHFLXCW-RTBURBONSA-N	2	2	352.482	2.126	20	70		FEIDLP
O=C(NC[C@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161390851	546126054	/nfs/dbraw/zinc/12/60/54/546126054.db2.gz	PFPFRIJHHFLXCW-RTBURBONSA-N	2	2	352.482	2.126	20	70		FEIDLP
C[NH+](C)C1CC[NH+](CCNC(=O)N[C@@H]2CCO[C@@H](c3ccccc3)C2)CC1	ZINC000159888408	326945624	/nfs/dbraw/zinc/94/56/24/326945624.db2.gz	GOBVVJZMDRDMSX-UYAOXDASSA-N	2	2	374.529	2.232	20	70		FEIDLP
Cc1ccc(-c2noc(CN3CC[NH+](CCn4cc[nH+]c4)CC3)n2)cc1	ZINC000159718622	545975844	/nfs/dbraw/zinc/97/58/44/545975844.db2.gz	SDYTYZIUGCVYBE-UHFFFAOYSA-N	2	2	352.442	2.059	20	70		FEIDLP
CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160920435	546084155	/nfs/dbraw/zinc/08/41/55/546084155.db2.gz	AUJFBUMFEJJESU-LJQANCHMSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160920435	546084161	/nfs/dbraw/zinc/08/41/61/546084161.db2.gz	AUJFBUMFEJJESU-LJQANCHMSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC(C)(C)[NH+]1CCC(NC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1	ZINC000159459582	326932455	/nfs/dbraw/zinc/93/24/55/326932455.db2.gz	VETXZOJQOGVCTC-UHFFFAOYSA-N	2	2	359.518	2.172	20	70		FEIDLP
NC(=O)[C@H]1CCC[N@@H+]1C1CC[NH+](CCOc2ccccc2Cl)CC1	ZINC000159415764	545951673	/nfs/dbraw/zinc/95/16/73/545951673.db2.gz	UBSHDLGAMYNCRY-MRXNPFEDSA-N	2	2	351.878	2.133	20	70		FEIDLP
NC(=O)[C@H]1CCC[N@H+]1C1CC[NH+](CCOc2ccccc2Cl)CC1	ZINC000159415764	545951678	/nfs/dbraw/zinc/95/16/78/545951678.db2.gz	UBSHDLGAMYNCRY-MRXNPFEDSA-N	2	2	351.878	2.133	20	70		FEIDLP
C[C@@H]1C[N@H+](C(C)(C)CNC(=O)NC[C@H](c2ccco2)[NH+](C)C)C[C@H](C)O1	ZINC000218001855	548684070	/nfs/dbraw/zinc/68/40/70/548684070.db2.gz	HTQDOCNRUWYBSK-OWCLPIDISA-N	2	2	366.506	2.069	20	70		FEIDLP
C[C@@H]1C[N@@H+](C(C)(C)CNC(=O)NC[C@H](c2ccco2)[NH+](C)C)C[C@H](C)O1	ZINC000218001855	548684078	/nfs/dbraw/zinc/68/40/78/548684078.db2.gz	HTQDOCNRUWYBSK-OWCLPIDISA-N	2	2	366.506	2.069	20	70		FEIDLP
C[C@H](c1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1)[NH+]1CCOCC1	ZINC000161446381	326999836	/nfs/dbraw/zinc/99/98/36/326999836.db2.gz	DERDIAMZXUUSOF-NVXWUHKLSA-N	2	2	354.454	2.477	20	70		FEIDLP
C[C@H]1CCC[C@](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)([NH+](C)C)C1	ZINC000159532886	545961465	/nfs/dbraw/zinc/96/14/65/545961465.db2.gz	ACGHVXGMIWOKSN-RXVVDRJESA-N	2	2	373.545	2.419	20	70		FEIDLP
CC[N@H+](C)CCNC(=O)N[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133709	546010096	/nfs/dbraw/zinc/01/00/96/546010096.db2.gz	PIAOWEHPBQCQQJ-JKSUJKDBSA-N	2	2	356.873	2.475	20	70		FEIDLP
CC[N@@H+](C)CCNC(=O)N[C@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133709	546010100	/nfs/dbraw/zinc/01/01/00/546010100.db2.gz	PIAOWEHPBQCQQJ-JKSUJKDBSA-N	2	2	356.873	2.475	20	70		FEIDLP
CC[NH+](C)CCNC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133709	546010109	/nfs/dbraw/zinc/01/01/09/546010109.db2.gz	PIAOWEHPBQCQQJ-JKSUJKDBSA-N	2	2	356.873	2.475	20	70		FEIDLP
CN1CC[NH+]([C@@H]2CCCCN(CC[N@H+](C)Cc3ccc(F)cc3)C2)CC1	ZINC000160877698	546080313	/nfs/dbraw/zinc/08/03/13/546080313.db2.gz	PMVKZGRJSZSCMN-OAQYLSRUSA-N	2	2	362.537	2.359	20	70		FEIDLP
CN1CC[NH+]([C@@H]2CCCCN(CC[N@@H+](C)Cc3ccc(F)cc3)C2)CC1	ZINC000160877698	546080315	/nfs/dbraw/zinc/08/03/15/546080315.db2.gz	PMVKZGRJSZSCMN-OAQYLSRUSA-N	2	2	362.537	2.359	20	70		FEIDLP
C[C@H](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)[NH+]1CCCCC1	ZINC000161234518	326992843	/nfs/dbraw/zinc/99/28/43/326992843.db2.gz	ONFUSRXPTIYKPP-GOSISDBHSA-N	2	2	359.518	2.173	20	70		FEIDLP
C[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000159575507	545964384	/nfs/dbraw/zinc/96/43/84/545964384.db2.gz	CUGWALDGWVGYCO-GOSISDBHSA-N	2	2	373.545	2.419	20	70		FEIDLP
C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000159575507	545964386	/nfs/dbraw/zinc/96/43/86/545964386.db2.gz	CUGWALDGWVGYCO-GOSISDBHSA-N	2	2	373.545	2.419	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)N[C@@H]1CC[N@H+](CC2CC2)C1	ZINC000160650357	546060027	/nfs/dbraw/zinc/06/00/27/546060027.db2.gz	YOIZKBXNEKIJDG-QGZVFWFLSA-N	2	2	353.470	2.430	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)N[C@@H]1CC[N@@H+](CC2CC2)C1	ZINC000160650357	546060034	/nfs/dbraw/zinc/06/00/34/546060034.db2.gz	YOIZKBXNEKIJDG-QGZVFWFLSA-N	2	2	353.470	2.430	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCOCC1	ZINC000160904538	546083181	/nfs/dbraw/zinc/08/31/81/546083181.db2.gz	QPPQYEBFIUELIL-RBUKOAKNSA-N	2	2	366.550	2.003	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCOCC1	ZINC000160904538	546083183	/nfs/dbraw/zinc/08/31/83/546083183.db2.gz	QPPQYEBFIUELIL-RBUKOAKNSA-N	2	2	366.550	2.003	20	70		FEIDLP
C[NH+](C)CC1(CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)CCCC1	ZINC000161252851	326993303	/nfs/dbraw/zinc/99/33/03/326993303.db2.gz	DSSVFUAUYCGFOG-UHFFFAOYSA-N	2	2	359.518	2.031	20	70		FEIDLP
COc1cc([C@H](C)[NH2+]C2CC[NH+](C)CC2)ccc1S(=O)(=O)C(F)F	ZINC000161487168	327001058	/nfs/dbraw/zinc/00/10/58/327001058.db2.gz	HIPWHKYCVGMGFO-NSHDSACASA-N	2	2	362.442	2.436	20	70		FEIDLP
CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)CC1	ZINC000159634334	545968571	/nfs/dbraw/zinc/96/85/71/545968571.db2.gz	WWVHZRUZMXWUKV-LJQANCHMSA-N	2	2	365.562	2.315	20	70		FEIDLP
CC(C)(C)C(=O)N1CCC(C[N@H+]2CCC[C@H](C[NH+]3CCOCC3)C2)CC1	ZINC000159634334	545968574	/nfs/dbraw/zinc/96/85/74/545968574.db2.gz	WWVHZRUZMXWUKV-LJQANCHMSA-N	2	2	365.562	2.315	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NCCc2cn3ccccc3[nH+]2)CC[N@@H+]1CCOC	ZINC000160097352	546006329	/nfs/dbraw/zinc/00/63/29/546006329.db2.gz	IKVDDFAERSZGOQ-SFHVURJKSA-N	2	2	373.501	2.019	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NCCc2cn3ccccc3[nH+]2)CC[N@H+]1CCOC	ZINC000160097352	546006335	/nfs/dbraw/zinc/00/63/35/546006335.db2.gz	IKVDDFAERSZGOQ-SFHVURJKSA-N	2	2	373.501	2.019	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@@H]1CCCC[C@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161213213	546110351	/nfs/dbraw/zinc/11/03/51/546110351.db2.gz	NWYJDMKHVGNFLF-QZTJIDSGSA-N	2	2	366.550	2.002	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@@H]1CCCC[C@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161213213	546110357	/nfs/dbraw/zinc/11/03/57/546110357.db2.gz	NWYJDMKHVGNFLF-QZTJIDSGSA-N	2	2	366.550	2.002	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1CCOC	ZINC000159781053	545979167	/nfs/dbraw/zinc/97/91/67/545979167.db2.gz	HNRQKMDLVLNWAO-SJORKVTESA-N	2	2	366.506	2.025	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1CCOC	ZINC000159781053	545979172	/nfs/dbraw/zinc/97/91/72/545979172.db2.gz	HNRQKMDLVLNWAO-SJORKVTESA-N	2	2	366.506	2.025	20	70		FEIDLP
CN1CC[NH+]([C@H]2CCCCN(CC[N@H+](C)Cc3ccc(F)cc3)C2)CC1	ZINC000160877820	546080007	/nfs/dbraw/zinc/08/00/07/546080007.db2.gz	PMVKZGRJSZSCMN-NRFANRHFSA-N	2	2	362.537	2.359	20	70		FEIDLP
CN1CC[NH+]([C@H]2CCCCN(CC[N@@H+](C)Cc3ccc(F)cc3)C2)CC1	ZINC000160877820	546080010	/nfs/dbraw/zinc/08/00/10/546080010.db2.gz	PMVKZGRJSZSCMN-NRFANRHFSA-N	2	2	362.537	2.359	20	70		FEIDLP
C[NH+](C)CC1CCC(NC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1	ZINC000160878688	546081051	/nfs/dbraw/zinc/08/10/51/546081051.db2.gz	YBYNZVOGAWMRTJ-UHFFFAOYSA-N	2	2	359.518	2.029	20	70		FEIDLP
COC(=O)c1csc(NC(=O)N(C)CC[N@H+](C)C2CC[NH+](C)CC2)c1	ZINC000160892617	546082196	/nfs/dbraw/zinc/08/21/96/546082196.db2.gz	PBPWQWQSBIPLJT-UHFFFAOYSA-N	2	2	368.503	2.024	20	70		FEIDLP
COC(=O)c1csc(NC(=O)N(C)CC[N@@H+](C)C2CC[NH+](C)CC2)c1	ZINC000160892617	546082200	/nfs/dbraw/zinc/08/22/00/546082200.db2.gz	PBPWQWQSBIPLJT-UHFFFAOYSA-N	2	2	368.503	2.024	20	70		FEIDLP
C[C@H](c1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1)[NH+]1CCOCC1	ZINC000161446647	546130618	/nfs/dbraw/zinc/13/06/18/546130618.db2.gz	DERDIAMZXUUSOF-WBVHZDCISA-N	2	2	354.454	2.477	20	70		FEIDLP
C[C@@H]1CCC[C@@](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)([NH+](C)C)C1	ZINC000159532511	545961393	/nfs/dbraw/zinc/96/13/93/545961393.db2.gz	ACGHVXGMIWOKSN-WIYYLYMNSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@@H](c2c(F)cccc2F)[NH+](C)C)CC1	ZINC000159867050	545986900	/nfs/dbraw/zinc/98/69/00/545986900.db2.gz	MUGKJBPODOTZIR-INIZCTEOSA-N	2	2	354.445	2.305	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@@H](c2c(F)cccc2F)[NH+](C)C)CC1	ZINC000159867050	545986904	/nfs/dbraw/zinc/98/69/04/545986904.db2.gz	MUGKJBPODOTZIR-INIZCTEOSA-N	2	2	354.445	2.305	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160875813	546079918	/nfs/dbraw/zinc/07/99/18/546079918.db2.gz	NULKRYMTHGQZEX-HXUWFJFHSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160875813	546079925	/nfs/dbraw/zinc/07/99/25/546079925.db2.gz	NULKRYMTHGQZEX-HXUWFJFHSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)c1nc(N(C)C)nc(NCc2ccnc(OCC[NH+](C)C)c2)[nH+]1	ZINC000161043354	546095029	/nfs/dbraw/zinc/09/50/29/546095029.db2.gz	DGIOBEOGGYVEOA-UHFFFAOYSA-N	2	2	359.478	2.009	20	70		FEIDLP
CC(C)c1nc(NCc2ccnc(OCC[NH+](C)C)c2)nc(N(C)C)[nH+]1	ZINC000161043354	546095032	/nfs/dbraw/zinc/09/50/32/546095032.db2.gz	DGIOBEOGGYVEOA-UHFFFAOYSA-N	2	2	359.478	2.009	20	70		FEIDLP
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@H]1CCCN(c2cccc[nH+]2)C1	ZINC000161408086	546127306	/nfs/dbraw/zinc/12/73/06/546127306.db2.gz	KZUUIIJOZJCUIX-RDJZCZTQSA-N	2	2	356.474	2.191	20	70		FEIDLP
CC[C@@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)[N@@H+]1CCc2ccccc2C1	ZINC000159652012	545970290	/nfs/dbraw/zinc/97/02/90/545970290.db2.gz	MVAKDISJZOMSOE-HKUYNNGSSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC[C@@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)[N@H+]1CCc2ccccc2C1	ZINC000159652012	545970291	/nfs/dbraw/zinc/97/02/91/545970291.db2.gz	MVAKDISJZOMSOE-HKUYNNGSSA-N	2	2	352.482	2.399	20	70		FEIDLP
C[NH+](C)CC[C@H](NC(=O)N1CC[NH+](Cc2ccccn2)CC1)C(C)(C)C	ZINC000160257139	546022690	/nfs/dbraw/zinc/02/26/90/546022690.db2.gz	NOWBVEFQMSKZNR-SFHVURJKSA-N	2	2	361.534	2.275	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NCCCNc2cccc[nH+]2)CC[N@@H+]1CCOC	ZINC000160434792	546040994	/nfs/dbraw/zinc/04/09/94/546040994.db2.gz	NZGGZOGGHJKJJC-QGZVFWFLSA-N	2	2	363.506	2.026	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NCCCNc2cccc[nH+]2)CC[N@H+]1CCOC	ZINC000160434792	546040997	/nfs/dbraw/zinc/04/09/97/546040997.db2.gz	NZGGZOGGHJKJJC-QGZVFWFLSA-N	2	2	363.506	2.026	20	70		FEIDLP
Cc1[nH+]ccn1C[C@@H](C)CNC(=O)N[C@@H]1CCCN(c2cccc[nH+]2)C1	ZINC000161407817	546126840	/nfs/dbraw/zinc/12/68/40/546126840.db2.gz	KZUUIIJOZJCUIX-DOTOQJQBSA-N	2	2	356.474	2.191	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CC(=O)N(c2ccc(F)cc2F)C1=O	ZINC000160259444	546023510	/nfs/dbraw/zinc/02/35/10/546023510.db2.gz	GRTCFLGQBIREHB-INIZCTEOSA-N	2	2	362.380	2.124	20	70		FEIDLP
CC[C@@H]1CCCC[N@@H+]1CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160318005	546029258	/nfs/dbraw/zinc/02/92/58/546029258.db2.gz	VGZWKLRSFHYMQV-LJQANCHMSA-N	2	2	359.518	2.173	20	70		FEIDLP
CC[C@@H]1CCCC[N@H+]1CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160318005	546029261	/nfs/dbraw/zinc/02/92/61/546029261.db2.gz	VGZWKLRSFHYMQV-LJQANCHMSA-N	2	2	359.518	2.173	20	70		FEIDLP
CSCCNC(=O)N(C)[C@H]1CCCC[C@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000160481945	546045660	/nfs/dbraw/zinc/04/56/60/546045660.db2.gz	SYNRQLJBAUKUQK-SJORKVTESA-N	2	2	356.580	2.328	20	70		FEIDLP
CSCCNC(=O)N(C)[C@H]1CCCC[C@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000160481945	546045667	/nfs/dbraw/zinc/04/56/67/546045667.db2.gz	SYNRQLJBAUKUQK-SJORKVTESA-N	2	2	356.580	2.328	20	70		FEIDLP
Cc1[nH+]ccn1CCCN(C)C(=O)Nc1ccc(N2CCOCC2)[nH+]c1C	ZINC000160581989	546054066	/nfs/dbraw/zinc/05/40/66/546054066.db2.gz	SFTVIHJRDJHFPS-UHFFFAOYSA-N	2	2	372.473	2.286	20	70		FEIDLP
CCOC(=O)c1ccc(NC(=O)C[NH+]2CCN(c3cc[nH+]cc3)CC2)cc1	ZINC000161299321	546118159	/nfs/dbraw/zinc/11/81/59/546118159.db2.gz	KBKOKGTZSGWBTJ-UHFFFAOYSA-N	2	2	368.437	2.019	20	70		FEIDLP
O=C(NC[C@@H]1CC[N@H+](CCc2ccccc2)C1)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161391011	546126246	/nfs/dbraw/zinc/12/62/46/546126246.db2.gz	PFPFRIJHHFLXCW-RBUKOAKNSA-N	2	2	352.482	2.126	20	70		FEIDLP
O=C(NC[C@@H]1CC[N@@H+](CCc2ccccc2)C1)[C@@H]1CCn2cc[nH+]c2C1	ZINC000161391011	546126249	/nfs/dbraw/zinc/12/62/49/546126249.db2.gz	PFPFRIJHHFLXCW-RBUKOAKNSA-N	2	2	352.482	2.126	20	70		FEIDLP
COC(C)(C)C[C@@H](C)NC(=O)[C@@H]([NH3+])Cc1cn(Cc2ccccc2)c[nH+]1	ZINC000160969925	326983604	/nfs/dbraw/zinc/98/36/04/326983604.db2.gz	TZNHHJSYYLLHLB-QAPCUYQASA-N	2	2	358.486	2.121	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CC(=O)N(c2ccc(F)cc2F)C1=O	ZINC000160259286	546023023	/nfs/dbraw/zinc/02/30/23/546023023.db2.gz	GRTCFLGQBIREHB-MRXNPFEDSA-N	2	2	362.380	2.124	20	70		FEIDLP
C[N@@H+]1CC[C@H](NC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000160709290	546064778	/nfs/dbraw/zinc/06/47/78/546064778.db2.gz	RRQLZVDCTBVPJN-ROUUACIJSA-N	2	2	366.456	2.495	20	70		FEIDLP
C[N@H+]1CC[C@H](NC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000160709290	546064780	/nfs/dbraw/zinc/06/47/80/546064780.db2.gz	RRQLZVDCTBVPJN-ROUUACIJSA-N	2	2	366.456	2.495	20	70		FEIDLP
C[NH+](C)CCN(C(=O)NCc1cccnc1-n1cc[nH+]c1)C1CCCC1	ZINC000160176199	326956124	/nfs/dbraw/zinc/95/61/24/326956124.db2.gz	XNALTDJXSNRDDK-UHFFFAOYSA-N	2	2	356.474	2.283	20	70		FEIDLP
Clc1ccc(-c2noc(CN3CC[NH+](CCn4cc[nH+]c4)CC3)n2)cc1	ZINC000159710943	545974494	/nfs/dbraw/zinc/97/44/94/545974494.db2.gz	WHQIFZJCESPPLB-UHFFFAOYSA-N	2	2	372.860	2.404	20	70		FEIDLP
O=C(NC[C@H](O)C[NH+]1CCCCC1)c1cccc(Oc2cc[nH+]cc2)c1	ZINC000160409862	546038775	/nfs/dbraw/zinc/03/87/75/546038775.db2.gz	YDZHLHAMUVDOAL-KRWDZBQOSA-N	2	2	355.438	2.451	20	70		FEIDLP
CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(Cn2cc[nH+]c2)cc1	ZINC000159591187	326936161	/nfs/dbraw/zinc/93/61/61/326936161.db2.gz	KORKYKRSXWXACP-UHFFFAOYSA-N	2	2	370.497	2.362	20	70		FEIDLP
O=C(NC[C@@H](O)C[NH+]1CCCCC1)c1cccc(Oc2cc[nH+]cc2)c1	ZINC000160410009	326964801	/nfs/dbraw/zinc/96/48/01/326964801.db2.gz	YDZHLHAMUVDOAL-QGZVFWFLSA-N	2	2	355.438	2.451	20	70		FEIDLP
CSc1ccc(OCC[NH+]2CCC([N@@H+]3CCC[C@@H]3C(N)=O)CC2)cc1	ZINC000159393166	545950325	/nfs/dbraw/zinc/95/03/25/545950325.db2.gz	XVIHOQJLPDHAPO-GOSISDBHSA-N	2	2	363.527	2.201	20	70		FEIDLP
CSc1ccc(OCC[NH+]2CCC([N@H+]3CCC[C@@H]3C(N)=O)CC2)cc1	ZINC000159393166	545950331	/nfs/dbraw/zinc/95/03/31/545950331.db2.gz	XVIHOQJLPDHAPO-GOSISDBHSA-N	2	2	363.527	2.201	20	70		FEIDLP
CC(C)CCn1ccc(NC(=O)NCC[NH+]2CCC([NH+](C)C)CC2)n1	ZINC000159944136	545994253	/nfs/dbraw/zinc/99/42/53/545994253.db2.gz	IKAPKHSKSORYAW-UHFFFAOYSA-N	2	2	350.511	2.077	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)NC[C@H]1CC[N@@H+](C2CC2)C1	ZINC000161161071	546105684	/nfs/dbraw/zinc/10/56/84/546105684.db2.gz	MKDOIRFNGKDPRD-OAHLLOKOSA-N	2	2	353.470	2.430	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)NC[C@H]1CC[N@H+](C2CC2)C1	ZINC000161161071	546105688	/nfs/dbraw/zinc/10/56/88/546105688.db2.gz	MKDOIRFNGKDPRD-OAHLLOKOSA-N	2	2	353.470	2.430	20	70		FEIDLP
C[C@@H](c1ccc(NC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1)[NH+]1CCOCC1	ZINC000161446244	326999915	/nfs/dbraw/zinc/99/99/15/326999915.db2.gz	DERDIAMZXUUSOF-DOTOQJQBSA-N	2	2	354.454	2.477	20	70		FEIDLP
CN(Cc1[nH+]ccn1Cc1ccccc1)c1cc(-n2cccn2)nc(N)[nH+]1	ZINC000159708131	545974303	/nfs/dbraw/zinc/97/43/03/545974303.db2.gz	FOPRUUSAAWCCTK-UHFFFAOYSA-N	2	2	360.425	2.126	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC2CC[NH+](c3ccc(N(C)C)cc3)CC2)CC1	ZINC000159913816	545991513	/nfs/dbraw/zinc/99/15/13/545991513.db2.gz	KAKGBDXOEGJHNX-UHFFFAOYSA-N	2	2	373.545	2.459	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC2CC[NH+](c3ccc(N(C)C)cc3)CC2)CC1	ZINC000159913816	545991517	/nfs/dbraw/zinc/99/15/17/545991517.db2.gz	KAKGBDXOEGJHNX-UHFFFAOYSA-N	2	2	373.545	2.459	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC2CCN(c3ccc([NH+](C)C)cc3)CC2)CC1	ZINC000159913816	545991521	/nfs/dbraw/zinc/99/15/21/545991521.db2.gz	KAKGBDXOEGJHNX-UHFFFAOYSA-N	2	2	373.545	2.459	20	70		FEIDLP
CC[N@@H+](C)[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1	ZINC000159998365	545997984	/nfs/dbraw/zinc/99/79/84/545997984.db2.gz	QDTWBQFMIAIKTF-IBGZPJMESA-N	2	2	361.530	2.496	20	70		FEIDLP
CN(C(=O)C[NH+]1CCN(CCC[NH+]2CCCCC2)CC1)C1CCCCC1	ZINC000160899952	546083390	/nfs/dbraw/zinc/08/33/90/546083390.db2.gz	WCQIJUAKJCRNKA-UHFFFAOYSA-N	2	2	364.578	2.271	20	70		FEIDLP
C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159605037	545966476	/nfs/dbraw/zinc/96/64/76/545966476.db2.gz	MOBPMRAKLCJRJK-CEXWTWQISA-N	2	2	373.545	2.275	20	70		FEIDLP
C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159605037	545966480	/nfs/dbraw/zinc/96/64/80/545966480.db2.gz	MOBPMRAKLCJRJK-CEXWTWQISA-N	2	2	373.545	2.275	20	70		FEIDLP
CC(C)[N@@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160071929	546004198	/nfs/dbraw/zinc/00/41/98/546004198.db2.gz	MSJDQHMQUSPNCK-SFHVURJKSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC(C)[N@H+]1CCC[C@@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160071929	546004202	/nfs/dbraw/zinc/00/42/02/546004202.db2.gz	MSJDQHMQUSPNCK-SFHVURJKSA-N	2	2	359.518	2.029	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@@H+](C)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000160262884	546024009	/nfs/dbraw/zinc/02/40/09/546024009.db2.gz	GYMWIIHXCKCRSK-INIZCTEOSA-N	2	2	360.845	2.499	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@H+](C)[C@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000160262884	546024015	/nfs/dbraw/zinc/02/40/15/546024015.db2.gz	GYMWIIHXCKCRSK-INIZCTEOSA-N	2	2	360.845	2.499	20	70		FEIDLP
CC[C@H](COC)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161437038	546129829	/nfs/dbraw/zinc/12/98/29/546129829.db2.gz	WPLOTEPDEHRAMH-NEWSRXKRSA-N	2	2	368.566	2.390	20	70		FEIDLP
CC[C@H](COC)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161437038	546129833	/nfs/dbraw/zinc/12/98/33/546129833.db2.gz	WPLOTEPDEHRAMH-NEWSRXKRSA-N	2	2	368.566	2.390	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@H](c2cccc(C)c2)[NH+]2CCOCC2)CC1	ZINC000159619660	545967245	/nfs/dbraw/zinc/96/72/45/545967245.db2.gz	KJGUNSHCNAOGSQ-HXUWFJFHSA-N	2	2	374.529	2.106	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@H](c2cccc(C)c2)[NH+]2CCOCC2)CC1	ZINC000159619660	545967248	/nfs/dbraw/zinc/96/72/48/545967248.db2.gz	KJGUNSHCNAOGSQ-HXUWFJFHSA-N	2	2	374.529	2.106	20	70		FEIDLP
CCCCn1ncc(NC(=O)N(C)CC[N@H+](C)C2CC[NH+](C)CC2)c1C	ZINC000159781466	545979557	/nfs/dbraw/zinc/97/95/57/545979557.db2.gz	DLEGJYLIWRYNSA-UHFFFAOYSA-N	2	2	364.538	2.481	20	70		FEIDLP
CCCCn1ncc(NC(=O)N(C)CC[N@@H+](C)C2CC[NH+](C)CC2)c1C	ZINC000159781466	545979560	/nfs/dbraw/zinc/97/95/60/545979560.db2.gz	DLEGJYLIWRYNSA-UHFFFAOYSA-N	2	2	364.538	2.481	20	70		FEIDLP
C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705521	546065415	/nfs/dbraw/zinc/06/54/15/546065415.db2.gz	BBFAWVJDYOVSST-CSMYWGQOSA-N	2	2	363.412	2.294	20	70		FEIDLP
C[C@H](Cn1cc[nH+]c1)NC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705521	546065418	/nfs/dbraw/zinc/06/54/18/546065418.db2.gz	BBFAWVJDYOVSST-CSMYWGQOSA-N	2	2	363.412	2.294	20	70		FEIDLP
CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1cccc(-n2cc[nH+]c2)c1	ZINC000159726860	326940230	/nfs/dbraw/zinc/94/02/30/326940230.db2.gz	XNSBKCOVYOSVSK-UHFFFAOYSA-N	2	2	356.470	2.303	20	70		FEIDLP
Cn1cc[nH+]c1CC1CC[NH+]([C@H]2CCCN(CC(F)(F)F)C2=O)CC1	ZINC000159968133	326948729	/nfs/dbraw/zinc/94/87/29/326948729.db2.gz	MYXIWZATLRQFHX-AWEZNQCLSA-N	2	2	358.408	2.228	20	70		FEIDLP
Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@@H]1CCCN(c2cccc[nH+]2)C1	ZINC000161407950	326998647	/nfs/dbraw/zinc/99/86/47/326998647.db2.gz	KZUUIIJOZJCUIX-NVXWUHKLSA-N	2	2	356.474	2.191	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@@H+]1CCOC	ZINC000159781195	545979994	/nfs/dbraw/zinc/97/99/94/545979994.db2.gz	HNRQKMDLVLNWAO-IRXDYDNUSA-N	2	2	366.506	2.025	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NC[C@@H](c2ccco2)[NH+](C)C)CC[N@H+]1CCOC	ZINC000159781195	545979999	/nfs/dbraw/zinc/97/99/99/545979999.db2.gz	HNRQKMDLVLNWAO-IRXDYDNUSA-N	2	2	366.506	2.025	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)NC[C@@H]1CC[N@@H+](C2CC2)C1	ZINC000161160991	546105994	/nfs/dbraw/zinc/10/59/94/546105994.db2.gz	MKDOIRFNGKDPRD-HNNXBMFYSA-N	2	2	353.470	2.430	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)NC[C@@H]1CC[N@H+](C2CC2)C1	ZINC000161160991	546105997	/nfs/dbraw/zinc/10/59/97/546105997.db2.gz	MKDOIRFNGKDPRD-HNNXBMFYSA-N	2	2	353.470	2.430	20	70		FEIDLP
COc1cccc2c1CC[N@H+](CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)C2	ZINC000161238838	546112829	/nfs/dbraw/zinc/11/28/29/546112829.db2.gz	MCXVBVMCHVAAOZ-FQEVSTJZSA-N	2	2	367.493	2.472	20	70		FEIDLP
COc1cccc2c1CC[N@@H+](CC(=O)NC[C@@H](c1ccccc1)[NH+](C)C)C2	ZINC000161238838	546112833	/nfs/dbraw/zinc/11/28/33/546112833.db2.gz	MCXVBVMCHVAAOZ-FQEVSTJZSA-N	2	2	367.493	2.472	20	70		FEIDLP
C[NH+](C)CCOc1ccccc1C(=O)N[C@@H]1CCN(c2cccc[nH+]2)C1	ZINC000161346143	326996376	/nfs/dbraw/zinc/99/63/76/326996376.db2.gz	ZBWCDRORCIRKSR-MRXNPFEDSA-N	2	2	354.454	2.031	20	70		FEIDLP
C[C@@H](Cn1cc[nH+]c1)NC(=O)N[C@H]1CC[N@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705630	546064853	/nfs/dbraw/zinc/06/48/53/546064853.db2.gz	BBFAWVJDYOVSST-AFAVFJNCSA-N	2	2	363.412	2.294	20	70		FEIDLP
C[C@@H](Cn1cc[nH+]c1)NC(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705630	546064856	/nfs/dbraw/zinc/06/48/56/546064856.db2.gz	BBFAWVJDYOVSST-AFAVFJNCSA-N	2	2	363.412	2.294	20	70		FEIDLP
CC[NH+](CC)CCOc1ccc(CNC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1	ZINC000161294358	546118449	/nfs/dbraw/zinc/11/84/49/546118449.db2.gz	OZPXZKSPKNGTOQ-SFHVURJKSA-N	2	2	370.497	2.483	20	70		FEIDLP
CCc1nnc(C[NH2+][C@@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)[nH]1	ZINC000160394130	326964171	/nfs/dbraw/zinc/96/41/71/326964171.db2.gz	IMKMDQKBAYVXLF-AWEZNQCLSA-N	2	2	360.481	2.499	20	70		FEIDLP
CCc1nn(C)c(CC)c1C[NH2+]C[C@@H](O)C[N@@H+]1CCc2ccccc2C1	ZINC000159952313	545995114	/nfs/dbraw/zinc/99/51/14/545995114.db2.gz	UCRLZRRKWLHIJU-GOSISDBHSA-N	2	2	356.514	2.054	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)Nc1ncccn1	ZINC000160026040	546000524	/nfs/dbraw/zinc/00/05/24/546000524.db2.gz	XNZAWTPLIPKADJ-MRXNPFEDSA-N	2	2	368.485	2.437	20	70		FEIDLP
Cc1cccc(N2CCC(NC(=O)N3CC[N@@H+](C)C[C@@H]3C(C)C)CC2)[nH+]1	ZINC000160249748	546021507	/nfs/dbraw/zinc/02/15/07/546021507.db2.gz	AMUAXPCFVFHGKN-GOSISDBHSA-N	2	2	359.518	2.340	20	70		FEIDLP
Cc1cccc(N2CCC(NC(=O)N3CC[N@H+](C)C[C@@H]3C(C)C)CC2)[nH+]1	ZINC000160249748	546021510	/nfs/dbraw/zinc/02/15/10/546021510.db2.gz	AMUAXPCFVFHGKN-GOSISDBHSA-N	2	2	359.518	2.340	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCOCC1	ZINC000160904407	546083169	/nfs/dbraw/zinc/08/31/69/546083169.db2.gz	QPPQYEBFIUELIL-RTBURBONSA-N	2	2	366.550	2.003	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CCC[C@@H]1C[NH+]1CCOCC1	ZINC000160904407	546083172	/nfs/dbraw/zinc/08/31/72/546083172.db2.gz	QPPQYEBFIUELIL-RTBURBONSA-N	2	2	366.550	2.003	20	70		FEIDLP
C[C@@H]1C[NH+](C(C)(C)CNC(=O)NC[C@H](c2ccco2)[NH+](C)C)C[C@@H](C)O1	ZINC000218001772	328482511	/nfs/dbraw/zinc/48/25/11/328482511.db2.gz	HTQDOCNRUWYBSK-BZUAXINKSA-N	2	2	366.506	2.069	20	70		FEIDLP
C[C@@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)C[NH+]1CCCCC1	ZINC000159462566	326932377	/nfs/dbraw/zinc/93/23/77/326932377.db2.gz	CRQPEETZPUIVMX-SFHVURJKSA-N	2	2	359.518	2.031	20	70		FEIDLP
CC[C@@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(OC)c(OC)c1	ZINC000160388157	326963914	/nfs/dbraw/zinc/96/39/14/326963914.db2.gz	HCCVSNDFOVLTIJ-QGZVFWFLSA-N	2	2	363.502	2.297	20	70		FEIDLP
C[N@H+](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)Cc1ccccc1	ZINC000159569324	545963244	/nfs/dbraw/zinc/96/32/44/545963244.db2.gz	CVGZBKRHHVTDDQ-UHFFFAOYSA-N	2	2	367.497	2.041	20	70		FEIDLP
C[N@@H+](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)Cc1ccccc1	ZINC000159569324	545963248	/nfs/dbraw/zinc/96/32/48/545963248.db2.gz	CVGZBKRHHVTDDQ-UHFFFAOYSA-N	2	2	367.497	2.041	20	70		FEIDLP
CCCCn1ncc(NC(=O)NCC[NH+]2CCC([NH+](C)C)CC2)c1C	ZINC000160021520	546001313	/nfs/dbraw/zinc/00/13/13/546001313.db2.gz	QEWDPFRQZIZMQG-UHFFFAOYSA-N	2	2	350.511	2.139	20	70		FEIDLP
C[NH+](C)C1CCN(CC[NH2+]C2CC[NH+](Cc3cccc(F)c3)CC2)CC1	ZINC000160156885	546012600	/nfs/dbraw/zinc/01/26/00/546012600.db2.gz	IPVRZRRLHUNBNE-UHFFFAOYSA-N	3	2	362.537	2.406	20	70		FEIDLP
CCc1nnc(C[NH2+][C@H](C)c2cc(F)ccc2N2CC[NH+](CC)CC2)[nH]1	ZINC000160394266	546036353	/nfs/dbraw/zinc/03/63/53/546036353.db2.gz	IMKMDQKBAYVXLF-CQSZACIVSA-N	2	2	360.481	2.499	20	70		FEIDLP
C[NH+](C)[C@@H](CNC(=O)N[C@@H]1CCCN(c2cccc[nH+]2)C1)c1ccco1	ZINC000159783380	326941971	/nfs/dbraw/zinc/94/19/71/326941971.db2.gz	NBKWIOXXDROMOM-CVEARBPZSA-N	2	2	357.458	2.246	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NCc2[nH+]ccn2CCc2ccccc2)CC1	ZINC000159958715	545995294	/nfs/dbraw/zinc/99/52/94/545995294.db2.gz	FAYCFRNTZIEFRK-UHFFFAOYSA-N	2	2	355.486	2.363	20	70		FEIDLP
C[NH+](C)CCCOc1ccc(CNC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1	ZINC000161389053	546126341	/nfs/dbraw/zinc/12/63/41/546126341.db2.gz	AYGUXZVHRLOKRA-KRWDZBQOSA-N	2	2	356.470	2.092	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@H](c2c(F)cccc2F)[NH+](C)C)CC1	ZINC000159867196	545987383	/nfs/dbraw/zinc/98/73/83/545987383.db2.gz	MUGKJBPODOTZIR-MRXNPFEDSA-N	2	2	354.445	2.305	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@H](c2c(F)cccc2F)[NH+](C)C)CC1	ZINC000159867196	545987387	/nfs/dbraw/zinc/98/73/87/545987387.db2.gz	MUGKJBPODOTZIR-MRXNPFEDSA-N	2	2	354.445	2.305	20	70		FEIDLP
O=C(N[C@@H]1CC[N@H+](CC2CCCC2)C1)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160463968	546043122	/nfs/dbraw/zinc/04/31/22/546043122.db2.gz	BTGKYBIZUBTSMU-HXUWFJFHSA-N	2	2	371.529	2.173	20	70		FEIDLP
O=C(N[C@@H]1CC[N@@H+](CC2CCCC2)C1)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160463968	546043123	/nfs/dbraw/zinc/04/31/23/546043123.db2.gz	BTGKYBIZUBTSMU-HXUWFJFHSA-N	2	2	371.529	2.173	20	70		FEIDLP
C[C@H]1CCC[C@@](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)([NH+](C)C)C1	ZINC000159532635	545961446	/nfs/dbraw/zinc/96/14/46/545961446.db2.gz	ACGHVXGMIWOKSN-GHTZIAJQSA-N	2	2	373.545	2.419	20	70		FEIDLP
C[NH+](C)CCOc1ccccc1C(=O)N[C@H]1CCN(c2cccc[nH+]2)C1	ZINC000161346260	546122427	/nfs/dbraw/zinc/12/24/27/546122427.db2.gz	ZBWCDRORCIRKSR-INIZCTEOSA-N	2	2	354.454	2.031	20	70		FEIDLP
C[C@H](C[N@@H+]1CCC[C@@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159585133	545965073	/nfs/dbraw/zinc/96/50/73/545965073.db2.gz	UBWIIMDXJXRXSB-QZTJIDSGSA-N	2	2	359.518	2.029	20	70		FEIDLP
C[C@H](C[N@H+]1CCC[C@@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159585133	545965076	/nfs/dbraw/zinc/96/50/76/545965076.db2.gz	UBWIIMDXJXRXSB-QZTJIDSGSA-N	2	2	359.518	2.029	20	70		FEIDLP
C[C@@H](CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)[NH+]1CCCCC1	ZINC000161234414	546111765	/nfs/dbraw/zinc/11/17/65/546111765.db2.gz	ONFUSRXPTIYKPP-SFHVURJKSA-N	2	2	359.518	2.173	20	70		FEIDLP
CC[C@@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)[N@@H+]1CCc2ccccc2C1	ZINC000159651732	545970400	/nfs/dbraw/zinc/97/04/00/545970400.db2.gz	MVAKDISJZOMSOE-MJGOQNOKSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC[C@@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)[N@H+]1CCc2ccccc2C1	ZINC000159651732	545970402	/nfs/dbraw/zinc/97/04/02/545970402.db2.gz	MVAKDISJZOMSOE-MJGOQNOKSA-N	2	2	352.482	2.399	20	70		FEIDLP
COCC[N@H+](C)CC[C@@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1	ZINC000161413621	546128416	/nfs/dbraw/zinc/12/84/16/546128416.db2.gz	MKBYCINBOAROTA-RTBURBONSA-N	2	2	370.497	2.271	20	70		FEIDLP
COCC[N@@H+](C)CC[C@@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1	ZINC000161413621	546128419	/nfs/dbraw/zinc/12/84/19/546128419.db2.gz	MKBYCINBOAROTA-RTBURBONSA-N	2	2	370.497	2.271	20	70		FEIDLP
O=C(C[NH2+]C1CC[NH+](CCc2ccc(F)cc2)CC1)NCC(F)(F)F	ZINC000160563539	546052712	/nfs/dbraw/zinc/05/27/12/546052712.db2.gz	SAMQYPLHTAKBNO-UHFFFAOYSA-N	2	2	361.383	2.101	20	70		FEIDLP
C[C@@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(F)cc1N(C)C	ZINC000160422554	546039401	/nfs/dbraw/zinc/03/94/01/546039401.db2.gz	HEIQGRWTHJQOIH-CQSZACIVSA-N	2	2	350.482	2.095	20	70		FEIDLP
CC(C)CCn1ccc(NC(=O)N(C)CC[N@H+](C)C2CC[NH+](C)CC2)n1	ZINC000160425013	546040081	/nfs/dbraw/zinc/04/00/81/546040081.db2.gz	ZGSRAZFNWSIZBM-UHFFFAOYSA-N	2	2	364.538	2.419	20	70		FEIDLP
CC(C)CCn1ccc(NC(=O)N(C)CC[N@@H+](C)C2CC[NH+](C)CC2)n1	ZINC000160425013	546040083	/nfs/dbraw/zinc/04/00/83/546040083.db2.gz	ZGSRAZFNWSIZBM-UHFFFAOYSA-N	2	2	364.538	2.419	20	70		FEIDLP
C[N@@H+]1CC[C@@H](NC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000160709439	546064697	/nfs/dbraw/zinc/06/46/97/546064697.db2.gz	RRQLZVDCTBVPJN-MSOLQXFVSA-N	2	2	366.456	2.495	20	70		FEIDLP
C[N@H+]1CC[C@@H](NC(=O)NCC[NH+]2CCCCC2)[C@@H]1c1ccc(F)c(F)c1	ZINC000160709439	546064700	/nfs/dbraw/zinc/06/47/00/546064700.db2.gz	RRQLZVDCTBVPJN-MSOLQXFVSA-N	2	2	366.456	2.495	20	70		FEIDLP
O=C1[C@@H]([NH+]2CCN(CCC[NH+]3CCCCC3)CC2)CCN1c1ccccc1	ZINC000161356932	546123203	/nfs/dbraw/zinc/12/32/03/546123203.db2.gz	BGIIGPDTZGHWFW-NRFANRHFSA-N	2	2	370.541	2.286	20	70		FEIDLP
CC(C)c1nc(N[C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)cc[nH+]1	ZINC000161386132	326997883	/nfs/dbraw/zinc/99/78/83/326997883.db2.gz	PZVSXMXANILHEL-KRWDZBQOSA-N	2	2	355.486	2.301	20	70		FEIDLP
NC(=O)[C@@H]1CCC[N@@H+]1C1CC[NH+](CCSc2ccccc2F)CC1	ZINC000159406545	545950648	/nfs/dbraw/zinc/95/06/48/545950648.db2.gz	JLDQWVAHBXLKMX-INIZCTEOSA-N	2	2	351.491	2.332	20	70		FEIDLP
NC(=O)[C@@H]1CCC[N@H+]1C1CC[NH+](CCSc2ccccc2F)CC1	ZINC000159406545	545950651	/nfs/dbraw/zinc/95/06/51/545950651.db2.gz	JLDQWVAHBXLKMX-INIZCTEOSA-N	2	2	351.491	2.332	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161213136	546110992	/nfs/dbraw/zinc/11/09/92/546110992.db2.gz	NWYJDMKHVGNFLF-ROUUACIJSA-N	2	2	366.550	2.002	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161213136	546110997	/nfs/dbraw/zinc/11/09/97/546110997.db2.gz	NWYJDMKHVGNFLF-ROUUACIJSA-N	2	2	366.550	2.002	20	70		FEIDLP
C[NH+](C)[C@@H](CNC(=O)N[C@H]1CCCN(c2cccc[nH+]2)C1)c1ccco1	ZINC000159783656	545980426	/nfs/dbraw/zinc/98/04/26/545980426.db2.gz	NBKWIOXXDROMOM-HOTGVXAUSA-N	2	2	357.458	2.246	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@@H](C)C(=O)Nc1ncccn1	ZINC000160025898	546001204	/nfs/dbraw/zinc/00/12/04/546001204.db2.gz	XNZAWTPLIPKADJ-INIZCTEOSA-N	2	2	368.485	2.437	20	70		FEIDLP
C[NH+](C)CC[C@@H](NC(=O)N1CC[NH+](Cc2ccccn2)CC1)C(C)(C)C	ZINC000160257029	546022935	/nfs/dbraw/zinc/02/29/35/546022935.db2.gz	NOWBVEFQMSKZNR-GOSISDBHSA-N	2	2	361.534	2.275	20	70		FEIDLP
C[C@@H]1CCC[C@](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)([NH+](C)C)C1	ZINC000159532737	326934335	/nfs/dbraw/zinc/93/43/35/326934335.db2.gz	ACGHVXGMIWOKSN-NQIIRXRSSA-N	2	2	373.545	2.419	20	70		FEIDLP
COc1cc(C[NH+]2CCC([N@@H+]3CCC[C@@H]3C(N)=O)CC2)ccc1SC	ZINC000159372581	545948188	/nfs/dbraw/zinc/94/81/88/545948188.db2.gz	DBOVWMNIEPCCIF-MRXNPFEDSA-N	2	2	363.527	2.331	20	70		FEIDLP
COc1cc(C[NH+]2CCC([N@H+]3CCC[C@@H]3C(N)=O)CC2)ccc1SC	ZINC000159372581	545948190	/nfs/dbraw/zinc/94/81/90/545948190.db2.gz	DBOVWMNIEPCCIF-MRXNPFEDSA-N	2	2	363.527	2.331	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)CC1	ZINC000159565748	545963346	/nfs/dbraw/zinc/96/33/46/545963346.db2.gz	QFWPDZPBYXXDRV-QGZVFWFLSA-N	2	2	359.449	2.386	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)N[C@@H](c2[nH+]ccn2C)c2cccc(F)c2)CC1	ZINC000159565748	545963349	/nfs/dbraw/zinc/96/33/49/545963349.db2.gz	QFWPDZPBYXXDRV-QGZVFWFLSA-N	2	2	359.449	2.386	20	70		FEIDLP
CC(C)(C)C(=O)N1CCC(C[N@@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)CC1	ZINC000159634470	545969283	/nfs/dbraw/zinc/96/92/83/545969283.db2.gz	WWVHZRUZMXWUKV-IBGZPJMESA-N	2	2	365.562	2.315	20	70		FEIDLP
CC(C)(C)C(=O)N1CCC(C[N@H+]2CCC[C@@H](C[NH+]3CCOCC3)C2)CC1	ZINC000159634470	545969286	/nfs/dbraw/zinc/96/92/86/545969286.db2.gz	WWVHZRUZMXWUKV-IBGZPJMESA-N	2	2	365.562	2.315	20	70		FEIDLP
CC[N@@H+](C)[C@@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)c1ccccc1	ZINC000159998515	545998051	/nfs/dbraw/zinc/99/80/51/545998051.db2.gz	QDTWBQFMIAIKTF-LJQANCHMSA-N	2	2	361.530	2.496	20	70		FEIDLP
CO[C@@H](C)c1noc(CN2CCC[N@H+](CCC[NH+]3CCCCC3)CC2)n1	ZINC000161445819	546130738	/nfs/dbraw/zinc/13/07/38/546130738.db2.gz	RAKNREUHZXVQJR-KRWDZBQOSA-N	2	2	365.522	2.161	20	70		FEIDLP
CO[C@@H](C)c1noc(CN2CCC[N@@H+](CCC[NH+]3CCCCC3)CC2)n1	ZINC000161445819	546130742	/nfs/dbraw/zinc/13/07/42/546130742.db2.gz	RAKNREUHZXVQJR-KRWDZBQOSA-N	2	2	365.522	2.161	20	70		FEIDLP
O=C(NC1CC[NH+](C2CCCC2)CC1)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160588413	326970443	/nfs/dbraw/zinc/97/04/43/326970443.db2.gz	GIRWBMPMJHESMU-UHFFFAOYSA-N	2	2	371.529	2.316	20	70		FEIDLP
c1ccc(N2CC[NH+](CCC[NH2+]C3CCC4(CC3)OCCO4)CC2)cc1	ZINC000161258587	326993474	/nfs/dbraw/zinc/99/34/74/326993474.db2.gz	UPMKENOJUZGMQV-UHFFFAOYSA-N	2	2	359.514	2.474	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NCCc2cn3ccccc3[nH+]2)CC[N@@H+]1CCOC	ZINC000160097192	546006953	/nfs/dbraw/zinc/00/69/53/546006953.db2.gz	IKVDDFAERSZGOQ-GOSISDBHSA-N	2	2	373.501	2.019	20	70		FEIDLP
CCC[C@@H]1CN(C(=O)NCCc2cn3ccccc3[nH+]2)CC[N@H+]1CCOC	ZINC000160097192	546006955	/nfs/dbraw/zinc/00/69/55/546006955.db2.gz	IKVDDFAERSZGOQ-GOSISDBHSA-N	2	2	373.501	2.019	20	70		FEIDLP
O=C1[C@H]([NH+]2CCN(CCC[NH+]3CCCCC3)CC2)CCN1c1ccccc1	ZINC000161357050	546123484	/nfs/dbraw/zinc/12/34/84/546123484.db2.gz	BGIIGPDTZGHWFW-OAQYLSRUSA-N	2	2	370.541	2.286	20	70		FEIDLP
Cc1ccc2[nH+]c(COc3ccccc3C(=O)N3CC[NH2+]CC3)cn2c1	ZINC000159426881	545952803	/nfs/dbraw/zinc/95/28/03/545952803.db2.gz	LHDOGYSVMYXFMN-UHFFFAOYSA-N	2	2	350.422	2.267	20	70		FEIDLP
Cc1cccc(N2CCC(NC(=O)N3CC[N@@H+](C)C[C@H]3C(C)C)CC2)[nH+]1	ZINC000160249908	546023164	/nfs/dbraw/zinc/02/31/64/546023164.db2.gz	AMUAXPCFVFHGKN-SFHVURJKSA-N	2	2	359.518	2.340	20	70		FEIDLP
Cc1cccc(N2CCC(NC(=O)N3CC[N@H+](C)C[C@H]3C(C)C)CC2)[nH+]1	ZINC000160249908	546023167	/nfs/dbraw/zinc/02/31/67/546023167.db2.gz	AMUAXPCFVFHGKN-SFHVURJKSA-N	2	2	359.518	2.340	20	70		FEIDLP
Cc1cc(N[C@@H](Cc2ccccc2)C(=O)NCC[NH+](C)C)nc(C2CC2)[nH+]1	ZINC000161383497	326997873	/nfs/dbraw/zinc/99/78/73/326997873.db2.gz	IBNSELLKKYQTLC-SFHVURJKSA-N	2	2	367.497	2.363	20	70		FEIDLP
COc1cc(C[NH+]2CCC([N@@H+]3CCC[C@H]3C(N)=O)CC2)ccc1SC	ZINC000159372727	545947399	/nfs/dbraw/zinc/94/73/99/545947399.db2.gz	DBOVWMNIEPCCIF-INIZCTEOSA-N	2	2	363.527	2.331	20	70		FEIDLP
COc1cc(C[NH+]2CCC([N@H+]3CCC[C@H]3C(N)=O)CC2)ccc1SC	ZINC000159372727	545947403	/nfs/dbraw/zinc/94/74/03/545947403.db2.gz	DBOVWMNIEPCCIF-INIZCTEOSA-N	2	2	363.527	2.331	20	70		FEIDLP
Cc1nn(C)cc1C[NH2+]CCCCN1CC[NH+](Cc2ccccc2)CC1	ZINC000160296635	546026704	/nfs/dbraw/zinc/02/67/04/546026704.db2.gz	DIDPQNCKUJHESX-UHFFFAOYSA-N	2	2	355.530	2.416	20	70		FEIDLP
CC(C)C[N@@H+]1CCC[C@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160856220	546078852	/nfs/dbraw/zinc/07/88/52/546078852.db2.gz	JVYFONYNGJCFOG-LJQANCHMSA-N	2	2	373.545	2.277	20	70		FEIDLP
CC(C)C[N@H+]1CCC[C@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160856220	546078856	/nfs/dbraw/zinc/07/88/56/546078856.db2.gz	JVYFONYNGJCFOG-LJQANCHMSA-N	2	2	373.545	2.277	20	70		FEIDLP
COC(C)(C)C[C@H](C)NC(=O)[C@@H]([NH3+])Cc1cn(Cc2ccccc2)c[nH+]1	ZINC000160969796	546089218	/nfs/dbraw/zinc/08/92/18/546089218.db2.gz	TZNHHJSYYLLHLB-YJBOKZPZSA-N	2	2	358.486	2.121	20	70		FEIDLP
C[C@@H](NC(=O)C[N@@H+]1CCC[C@@H](C[NH3+])C1)c1ccc(Br)cc1	ZINC000217551985	548682142	/nfs/dbraw/zinc/68/21/42/548682142.db2.gz	OGUKLFIJIZYKMZ-OLZOCXBDSA-N	2	2	354.292	2.297	20	70		FEIDLP
C[C@@H](NC(=O)C[N@H+]1CCC[C@@H](C[NH3+])C1)c1ccc(Br)cc1	ZINC000217551985	548682146	/nfs/dbraw/zinc/68/21/46/548682146.db2.gz	OGUKLFIJIZYKMZ-OLZOCXBDSA-N	2	2	354.292	2.297	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160875945	546080472	/nfs/dbraw/zinc/08/04/72/546080472.db2.gz	NULKRYMTHGQZEX-FQEVSTJZSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160875945	546080475	/nfs/dbraw/zinc/08/04/75/546080475.db2.gz	NULKRYMTHGQZEX-FQEVSTJZSA-N	2	2	373.545	2.419	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@H]1CCCC[C@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161213325	546110587	/nfs/dbraw/zinc/11/05/87/546110587.db2.gz	NWYJDMKHVGNFLF-MSOLQXFVSA-N	2	2	366.550	2.002	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@H]1CCCC[C@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161213325	546110593	/nfs/dbraw/zinc/11/05/93/546110593.db2.gz	NWYJDMKHVGNFLF-MSOLQXFVSA-N	2	2	366.550	2.002	20	70		FEIDLP
CC(C)[NH+](CCCNC(=O)N1CC[NH+](Cc2ccccn2)CC1)C(C)C	ZINC000160529796	326968575	/nfs/dbraw/zinc/96/85/75/326968575.db2.gz	GANMTHCGFHAVCF-UHFFFAOYSA-N	2	2	361.534	2.418	20	70		FEIDLP
CCc1ncc(NC(=O)NCC2([NH+]3CCCCC3)CC[NH+](C)CC2)cn1	ZINC000161211322	326991797	/nfs/dbraw/zinc/99/17/97/326991797.db2.gz	ZBHRZNFGHRBLQV-UHFFFAOYSA-N	2	2	360.506	2.111	20	70		FEIDLP
CCc1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CCC[N@H+](C)C3)CC2)s1	ZINC000159445044	545953774	/nfs/dbraw/zinc/95/37/74/545953774.db2.gz	HXLLXAIUFJITSJ-MRXNPFEDSA-N	2	2	364.559	2.480	20	70		FEIDLP
CCc1ccc(C[NH+]2CCN(C(=O)NC[C@H]3CCC[N@@H+](C)C3)CC2)s1	ZINC000159445044	545953776	/nfs/dbraw/zinc/95/37/76/545953776.db2.gz	HXLLXAIUFJITSJ-MRXNPFEDSA-N	2	2	364.559	2.480	20	70		FEIDLP
CC[C@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)[N@@H+]1CCc2ccccc2C1	ZINC000159652158	545970162	/nfs/dbraw/zinc/97/01/62/545970162.db2.gz	MVAKDISJZOMSOE-PKOBYXMFSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC[C@H](CNC(=O)[C@H]1CCn2cc[nH+]c2C1)[N@H+]1CCc2ccccc2C1	ZINC000159652158	545970167	/nfs/dbraw/zinc/97/01/67/545970167.db2.gz	MVAKDISJZOMSOE-PKOBYXMFSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC(C)[N@@H+]1CCC[C@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160071818	546003940	/nfs/dbraw/zinc/00/39/40/546003940.db2.gz	MSJDQHMQUSPNCK-GOSISDBHSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC(C)[N@H+]1CCC[C@H](CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000160071818	546003944	/nfs/dbraw/zinc/00/39/44/546003944.db2.gz	MSJDQHMQUSPNCK-GOSISDBHSA-N	2	2	359.518	2.029	20	70		FEIDLP
C[C@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)[NH+]1CCC(C)CC1	ZINC000159771422	326941577	/nfs/dbraw/zinc/94/15/77/326941577.db2.gz	GSHBUMHVZAWOFK-GOSISDBHSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NC[C@@H]1CCCO1	ZINC000160051502	546003582	/nfs/dbraw/zinc/00/35/82/546003582.db2.gz	HNXOGTMJNQKKNI-MJGOQNOKSA-N	2	2	374.529	2.304	20	70		FEIDLP
Cc1ccc2[nH+]c(COc3cccc(C(=O)N4CC[C@@H]([NH3+])C4)c3)cn2c1	ZINC000160224679	546018871	/nfs/dbraw/zinc/01/88/71/546018871.db2.gz	XXNAEQYBPOMJEK-MRXNPFEDSA-N	2	2	350.422	2.395	20	70		FEIDLP
O=C(N[C@H]1CC[N@H+](CC2CCCC2)C1)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160464100	546043614	/nfs/dbraw/zinc/04/36/14/546043614.db2.gz	BTGKYBIZUBTSMU-FQEVSTJZSA-N	2	2	371.529	2.173	20	70		FEIDLP
O=C(N[C@H]1CC[N@@H+](CC2CCCC2)C1)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160464100	546043616	/nfs/dbraw/zinc/04/36/16/546043616.db2.gz	BTGKYBIZUBTSMU-FQEVSTJZSA-N	2	2	371.529	2.173	20	70		FEIDLP
C[C@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)C[NH+]1CCCCC1	ZINC000159462674	326932459	/nfs/dbraw/zinc/93/24/59/326932459.db2.gz	CRQPEETZPUIVMX-GOSISDBHSA-N	2	2	359.518	2.031	20	70		FEIDLP
C[C@@H]1CC[N@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H]1n1cc[nH+]c1	ZINC000159384701	545949107	/nfs/dbraw/zinc/94/91/07/545949107.db2.gz	ASTICZBPESUJSP-HOJAQTOUSA-N	3	2	369.513	2.185	20	70		FEIDLP
C[C@@H]1CC[N@@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H]1n1cc[nH+]c1	ZINC000159384701	545949112	/nfs/dbraw/zinc/94/91/12/545949112.db2.gz	ASTICZBPESUJSP-HOJAQTOUSA-N	3	2	369.513	2.185	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccncc2)CC1	ZINC000160960433	546087744	/nfs/dbraw/zinc/08/77/44/546087744.db2.gz	RXQDUYBCHOHCHL-HXUWFJFHSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@@H]1CNC(=O)N1CC[NH+](Cc2ccncc2)CC1	ZINC000160960433	546087747	/nfs/dbraw/zinc/08/77/47/546087747.db2.gz	RXQDUYBCHOHCHL-HXUWFJFHSA-N	2	2	373.545	2.419	20	70		FEIDLP
CCCC(O)(CCC)CC(=O)NC1CC[NH+](C2CC[NH+](C)CC2)CC1	ZINC000161053475	546095786	/nfs/dbraw/zinc/09/57/86/546095786.db2.gz	XBEBOOLJRVCPMT-UHFFFAOYSA-N	2	2	353.551	2.383	20	70		FEIDLP
COCC[N@H+](C)CC[C@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1	ZINC000161413495	546128439	/nfs/dbraw/zinc/12/84/39/546128439.db2.gz	MKBYCINBOAROTA-MOPGFXCFSA-N	2	2	370.497	2.271	20	70		FEIDLP
COCC[N@@H+](C)CC[C@H](NC(=O)[C@@H]1CCn2cc[nH+]c2C1)c1ccccc1	ZINC000161413495	546128445	/nfs/dbraw/zinc/12/84/45/546128445.db2.gz	MKBYCINBOAROTA-MOPGFXCFSA-N	2	2	370.497	2.271	20	70		FEIDLP
CC[C@H](COC)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161436782	546129096	/nfs/dbraw/zinc/12/90/96/546129096.db2.gz	WPLOTEPDEHRAMH-NZSAHSFTSA-N	2	2	368.566	2.390	20	70		FEIDLP
CC[C@H](COC)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161436782	546129101	/nfs/dbraw/zinc/12/91/01/546129101.db2.gz	WPLOTEPDEHRAMH-NZSAHSFTSA-N	2	2	368.566	2.390	20	70		FEIDLP
C[C@@H](c1ccc(NC(=O)[C@H]2CCn3cc[nH+]c3C2)cc1)[NH+]1CCOCC1	ZINC000161446514	546131054	/nfs/dbraw/zinc/13/10/54/546131054.db2.gz	DERDIAMZXUUSOF-RDJZCZTQSA-N	2	2	354.454	2.477	20	70		FEIDLP
NC(=O)[C@@H]1CCC[N@@H+]1C1CC[NH+](CCOc2ccccc2Cl)CC1	ZINC000159415909	545952229	/nfs/dbraw/zinc/95/22/29/545952229.db2.gz	UBSHDLGAMYNCRY-INIZCTEOSA-N	2	2	351.878	2.133	20	70		FEIDLP
NC(=O)[C@@H]1CCC[N@H+]1C1CC[NH+](CCOc2ccccc2Cl)CC1	ZINC000159415909	545952235	/nfs/dbraw/zinc/95/22/35/545952235.db2.gz	UBSHDLGAMYNCRY-INIZCTEOSA-N	2	2	351.878	2.133	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)N[C@@H](c2[nH+]ccn2C)c2ccc(OC)cc2)CC1	ZINC000159568898	545963542	/nfs/dbraw/zinc/96/35/42/545963542.db2.gz	OSTGPJQWLOHUDG-GOSISDBHSA-N	2	2	371.485	2.255	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)N[C@@H](c2[nH+]ccn2C)c2ccc(OC)cc2)CC1	ZINC000159568898	545963543	/nfs/dbraw/zinc/96/35/43/545963543.db2.gz	OSTGPJQWLOHUDG-GOSISDBHSA-N	2	2	371.485	2.255	20	70		FEIDLP
C[C@@H](Cn1cc[nH+]c1)NC(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705384	546065205	/nfs/dbraw/zinc/06/52/05/546065205.db2.gz	BBFAWVJDYOVSST-JCURWCKSSA-N	2	2	363.412	2.294	20	70		FEIDLP
C[C@@H](Cn1cc[nH+]c1)NC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)c(F)c1	ZINC000160705384	546065211	/nfs/dbraw/zinc/06/52/11/546065211.db2.gz	BBFAWVJDYOVSST-JCURWCKSSA-N	2	2	363.412	2.294	20	70		FEIDLP
COc1cccc2c1CC[N@H+](CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)C2	ZINC000161238957	546112395	/nfs/dbraw/zinc/11/23/95/546112395.db2.gz	MCXVBVMCHVAAOZ-HXUWFJFHSA-N	2	2	367.493	2.472	20	70		FEIDLP
COc1cccc2c1CC[N@@H+](CC(=O)NC[C@H](c1ccccc1)[NH+](C)C)C2	ZINC000161238957	546112397	/nfs/dbraw/zinc/11/23/97/546112397.db2.gz	MCXVBVMCHVAAOZ-HXUWFJFHSA-N	2	2	367.493	2.472	20	70		FEIDLP
CC(=O)NC1CCC([NH2+]CCC[NH+]2CCN(c3ccccc3)CC2)CC1	ZINC000161258470	546113737	/nfs/dbraw/zinc/11/37/37/546113737.db2.gz	MKFWFJBPPKSKAB-UHFFFAOYSA-N	2	2	358.530	2.236	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)N[C@H](c2[nH+]ccn2C)c2cccc(F)c2)CC1	ZINC000159565613	545963490	/nfs/dbraw/zinc/96/34/90/545963490.db2.gz	QFWPDZPBYXXDRV-KRWDZBQOSA-N	2	2	359.449	2.386	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)N[C@H](c2[nH+]ccn2C)c2cccc(F)c2)CC1	ZINC000159565613	545963491	/nfs/dbraw/zinc/96/34/91/545963491.db2.gz	QFWPDZPBYXXDRV-KRWDZBQOSA-N	2	2	359.449	2.386	20	70		FEIDLP
CN(CC(C)(C)C[NH+]1CCOCC1)C(=O)c1ccc(-n2cc[nH+]c2)cc1	ZINC000159785190	545981175	/nfs/dbraw/zinc/98/11/75/545981175.db2.gz	LSTYKFJCLSIBCW-UHFFFAOYSA-N	2	2	356.470	2.303	20	70		FEIDLP
CC[C@H]1CCCC[N@@H+]1CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160318147	546029982	/nfs/dbraw/zinc/02/99/82/546029982.db2.gz	VGZWKLRSFHYMQV-IBGZPJMESA-N	2	2	359.518	2.173	20	70		FEIDLP
CC[C@H]1CCCC[N@H+]1CCNC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000160318147	546029986	/nfs/dbraw/zinc/02/99/86/546029986.db2.gz	VGZWKLRSFHYMQV-IBGZPJMESA-N	2	2	359.518	2.173	20	70		FEIDLP
C[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)[N@@H+]1CCc2ccccc2C1	ZINC000160254552	546022355	/nfs/dbraw/zinc/02/23/55/546022355.db2.gz	QOVSAFOPWYULOY-GOSISDBHSA-N	2	2	373.541	2.250	20	70		FEIDLP
C[C@H](C(=O)N(C)CC(C)(C)C[NH+]1CCOCC1)[N@H+]1CCc2ccccc2C1	ZINC000160254552	546022357	/nfs/dbraw/zinc/02/23/57/546022357.db2.gz	QOVSAFOPWYULOY-GOSISDBHSA-N	2	2	373.541	2.250	20	70		FEIDLP
COCC[C@H](C)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000160408655	546037264	/nfs/dbraw/zinc/03/72/64/546037264.db2.gz	WLRCKYYGIQPIMN-YTQUADARSA-N	2	2	368.566	2.390	20	70		FEIDLP
COCC[C@H](C)NC(=O)N(C)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000160408655	546037271	/nfs/dbraw/zinc/03/72/71/546037271.db2.gz	WLRCKYYGIQPIMN-YTQUADARSA-N	2	2	368.566	2.390	20	70		FEIDLP
COc1ccccc1C[NH+]1CCN(C(=O)N[C@H]2CC[N@H+](CC3CC3)C2)CC1	ZINC000160776125	546071190	/nfs/dbraw/zinc/07/11/90/546071190.db2.gz	UIAWIIJUUHWWAH-IBGZPJMESA-N	2	2	372.513	2.007	20	70		FEIDLP
COc1ccccc1C[NH+]1CCN(C(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)CC1	ZINC000160776125	546071193	/nfs/dbraw/zinc/07/11/93/546071193.db2.gz	UIAWIIJUUHWWAH-IBGZPJMESA-N	2	2	372.513	2.007	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000161212942	546110153	/nfs/dbraw/zinc/11/01/53/546110153.db2.gz	NWYJDMKHVGNFLF-ZWKOTPCHSA-N	2	2	366.550	2.002	20	70		FEIDLP
CN(C(=O)NCC1(C)COC1)[C@@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000161212942	546110158	/nfs/dbraw/zinc/11/01/58/546110158.db2.gz	NWYJDMKHVGNFLF-ZWKOTPCHSA-N	2	2	366.550	2.002	20	70		FEIDLP
COCC[C@H](C)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@H+](C)C1CC[NH+](C)CC1	ZINC000160408917	546039108	/nfs/dbraw/zinc/03/91/08/546039108.db2.gz	WLRCKYYGIQPIMN-WDSOQIARSA-N	2	2	368.566	2.390	20	70		FEIDLP
COCC[C@H](C)NC(=O)N(C)[C@H]1CCCC[C@@H]1[N@@H+](C)C1CC[NH+](C)CC1	ZINC000160408917	546039110	/nfs/dbraw/zinc/03/91/10/546039110.db2.gz	WLRCKYYGIQPIMN-WDSOQIARSA-N	2	2	368.566	2.390	20	70		FEIDLP
COc1ccccc1C[NH+]1CCN(C(=O)N[C@@H]2CC[N@H+](CC3CC3)C2)CC1	ZINC000160775993	546071064	/nfs/dbraw/zinc/07/10/64/546071064.db2.gz	UIAWIIJUUHWWAH-LJQANCHMSA-N	2	2	372.513	2.007	20	70		FEIDLP
COc1ccccc1C[NH+]1CCN(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)CC1	ZINC000160775993	546071067	/nfs/dbraw/zinc/07/10/67/546071067.db2.gz	UIAWIIJUUHWWAH-LJQANCHMSA-N	2	2	372.513	2.007	20	70		FEIDLP
COc1ccc(C[NH+]2CCN(C(=O)[C@H](C(C)C)[NH+](C)C)CC2)cc1F	ZINC000159539665	326934781	/nfs/dbraw/zinc/93/47/81/326934781.db2.gz	DVLUXHFQOXPGQW-SFHVURJKSA-N	2	2	351.466	2.065	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)N[C@H](c2[nH+]ccn2C)c2ccc(OC)cc2)CC1	ZINC000159568773	545963458	/nfs/dbraw/zinc/96/34/58/545963458.db2.gz	OSTGPJQWLOHUDG-SFHVURJKSA-N	2	2	371.485	2.255	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)N[C@H](c2[nH+]ccn2C)c2ccc(OC)cc2)CC1	ZINC000159568773	545963460	/nfs/dbraw/zinc/96/34/60/545963460.db2.gz	OSTGPJQWLOHUDG-SFHVURJKSA-N	2	2	371.485	2.255	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@@H](c2cccc(C)c2)[NH+]2CCOCC2)CC1	ZINC000159619527	545967653	/nfs/dbraw/zinc/96/76/53/545967653.db2.gz	KJGUNSHCNAOGSQ-FQEVSTJZSA-N	2	2	374.529	2.106	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@@H](c2cccc(C)c2)[NH+]2CCOCC2)CC1	ZINC000159619527	545967655	/nfs/dbraw/zinc/96/76/55/545967655.db2.gz	KJGUNSHCNAOGSQ-FQEVSTJZSA-N	2	2	374.529	2.106	20	70		FEIDLP
C[C@H]1CC[N@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H]1n1cc[nH+]c1	ZINC000159384815	545948475	/nfs/dbraw/zinc/94/84/75/545948475.db2.gz	ASTICZBPESUJSP-IHPCNDPISA-N	3	2	369.513	2.185	20	70		FEIDLP
C[C@H]1CC[N@@H+](CC(=O)NC[C@@H](c2ccccc2)[NH+](C)C)C[C@@H]1n1cc[nH+]c1	ZINC000159384815	545948478	/nfs/dbraw/zinc/94/84/78/545948478.db2.gz	ASTICZBPESUJSP-IHPCNDPISA-N	3	2	369.513	2.185	20	70		FEIDLP
C[C@@H]1C[N@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCCC[NH+]1CCC[C@@H]1CO	ZINC000160749343	546069108	/nfs/dbraw/zinc/06/91/08/546069108.db2.gz	CCKCDVGIQGENHM-NRSPTQNISA-N	3	2	360.546	2.119	20	70		FEIDLP
C[C@@H]1C[N@@H+](Cc2ccccn2)CC[C@@H]1[NH2+]CCCC[NH+]1CCC[C@@H]1CO	ZINC000160749343	546069113	/nfs/dbraw/zinc/06/91/13/546069113.db2.gz	CCKCDVGIQGENHM-NRSPTQNISA-N	3	2	360.546	2.119	20	70		FEIDLP
C[C@@H]1C[NH+](Cc2ccccn2)CC[C@@H]1[NH2+]CCCC[N@@H+]1CCC[C@@H]1CO	ZINC000160749343	546069118	/nfs/dbraw/zinc/06/91/18/546069118.db2.gz	CCKCDVGIQGENHM-NRSPTQNISA-N	3	2	360.546	2.119	20	70		FEIDLP
C[C@@H]1C[NH+](Cc2ccccn2)CC[C@@H]1[NH2+]CCCC[N@H+]1CCC[C@@H]1CO	ZINC000160749343	546069122	/nfs/dbraw/zinc/06/91/22/546069122.db2.gz	CCKCDVGIQGENHM-NRSPTQNISA-N	3	2	360.546	2.119	20	70		FEIDLP
Cc1c(C(=O)NC2CC[NH+](C3CC[NH+](C)CC3)CC2)cnn1CC(C)C	ZINC000161144827	546103812	/nfs/dbraw/zinc/10/38/12/546103812.db2.gz	IJQJHPUACRZYQQ-UHFFFAOYSA-N	2	2	361.534	2.136	20	70		FEIDLP
Cc1[nH+]ccn1C[C@H](C)CNC(=O)N[C@H]1CCCN(c2cccc[nH+]2)C1	ZINC000161408219	546128061	/nfs/dbraw/zinc/12/80/61/546128061.db2.gz	KZUUIIJOZJCUIX-WBVHZDCISA-N	2	2	356.474	2.191	20	70		FEIDLP
COC(=O)C1([NH+](C)C/C=C/C[N@@H+](C)C2(C(=O)OC)CCCC2)CCCC1	ZINC000159477113	545957652	/nfs/dbraw/zinc/95/76/52/545957652.db2.gz	YKBXTNGFOHMIKI-MDZDMXLPSA-N	2	2	366.502	2.378	20	70		FEIDLP
COC(=O)C1([NH+](C)C/C=C/C[N@H+](C)C2(C(=O)OC)CCCC2)CCCC1	ZINC000159477113	545957655	/nfs/dbraw/zinc/95/76/55/545957655.db2.gz	YKBXTNGFOHMIKI-MDZDMXLPSA-N	2	2	366.502	2.378	20	70		FEIDLP
C[C@@H](CNC(=O)N1CC[NH+](Cc2ccccn2)CC1)[NH+]1CCC(C)CC1	ZINC000159771306	326941592	/nfs/dbraw/zinc/94/15/92/326941592.db2.gz	GSHBUMHVZAWOFK-SFHVURJKSA-N	2	2	359.518	2.029	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)N[C@H]1CC[N@H+](CC2CC2)C1	ZINC000160650474	546060589	/nfs/dbraw/zinc/06/05/89/546060589.db2.gz	YOIZKBXNEKIJDG-KRWDZBQOSA-N	2	2	353.470	2.430	20	70		FEIDLP
O=C(NCCNc1ccc2ccccc2[nH+]1)N[C@H]1CC[N@@H+](CC2CC2)C1	ZINC000160650474	546060591	/nfs/dbraw/zinc/06/05/91/546060591.db2.gz	YOIZKBXNEKIJDG-KRWDZBQOSA-N	2	2	353.470	2.430	20	70		FEIDLP
C[NH+](C)[C@H](CNC(=O)N[C@H]1CCCN(c2cccc[nH+]2)C1)c1ccco1	ZINC000159783797	326941721	/nfs/dbraw/zinc/94/17/21/326941721.db2.gz	NBKWIOXXDROMOM-JKSUJKDBSA-N	2	2	357.458	2.246	20	70		FEIDLP
C[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000159575631	545964057	/nfs/dbraw/zinc/96/40/57/545964057.db2.gz	CUGWALDGWVGYCO-SFHVURJKSA-N	2	2	373.545	2.419	20	70		FEIDLP
C[C@H]1CCC[N@H+](C(C)(C)CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)C1	ZINC000159575631	545964063	/nfs/dbraw/zinc/96/40/63/545964063.db2.gz	CUGWALDGWVGYCO-SFHVURJKSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)C[N@@H+]1CCCC[C@H]1CNC(=O)N1CC[NH+](Cc2ccncc2)CC1	ZINC000160960569	546087630	/nfs/dbraw/zinc/08/76/30/546087630.db2.gz	RXQDUYBCHOHCHL-FQEVSTJZSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC(C)C[N@H+]1CCCC[C@H]1CNC(=O)N1CC[NH+](Cc2ccncc2)CC1	ZINC000160960569	546087634	/nfs/dbraw/zinc/08/76/34/546087634.db2.gz	RXQDUYBCHOHCHL-FQEVSTJZSA-N	2	2	373.545	2.419	20	70		FEIDLP
CC[NH+](CC)CCOc1ccc(CNC(=O)[C@@H]2CCn3cc[nH+]c3C2)cc1	ZINC000161294206	546118345	/nfs/dbraw/zinc/11/83/45/546118345.db2.gz	OZPXZKSPKNGTOQ-GOSISDBHSA-N	2	2	370.497	2.483	20	70		FEIDLP
CC[NH+]1CCC(CCNC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1	ZINC000160401588	326964468	/nfs/dbraw/zinc/96/44/68/326964468.db2.gz	FKCURBKZCHSEHN-UHFFFAOYSA-N	2	2	359.518	2.031	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@@H+](C)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000160262748	546024579	/nfs/dbraw/zinc/02/45/79/546024579.db2.gz	GYMWIIHXCKCRSK-MRXNPFEDSA-N	2	2	360.845	2.499	20	70		FEIDLP
Cc1[nH+]ccn1CCC[N@H+](C)[C@@H]1CC(=O)N(c2cccc(Cl)c2)C1=O	ZINC000160262748	546024584	/nfs/dbraw/zinc/02/45/84/546024584.db2.gz	GYMWIIHXCKCRSK-MRXNPFEDSA-N	2	2	360.845	2.499	20	70		FEIDLP
C[NH+](C)[C@H](CNC(=O)N[C@@H]1CCCN(c2cccc[nH+]2)C1)c1ccco1	ZINC000159783534	326941841	/nfs/dbraw/zinc/94/18/41/326941841.db2.gz	NBKWIOXXDROMOM-HZPDHXFCSA-N	2	2	357.458	2.246	20	70		FEIDLP
C[NH+](C)C1CC[NH+](CCNC(=O)N[C@H]2CCO[C@H](c3ccccc3)C2)CC1	ZINC000159888268	326945585	/nfs/dbraw/zinc/94/55/85/326945585.db2.gz	GOBVVJZMDRDMSX-ICSRJNTNSA-N	2	2	374.529	2.232	20	70		FEIDLP
Cc1ccc(C(=O)CC[NH+]2CCN(c3cc[nH+]c(N(C)C)n3)CC2)cc1	ZINC000159776346	545979801	/nfs/dbraw/zinc/97/98/01/545979801.db2.gz	PWOBLGMQNWYLSW-UHFFFAOYSA-N	2	2	353.470	2.246	20	70		FEIDLP
COC(=O)C1([N@H+](C)C[C@@H](O)Cn2c[nH+]c3cc(C)c(C)cc32)CCCC1	ZINC000159483721	545957412	/nfs/dbraw/zinc/95/74/12/545957412.db2.gz	LKLBBFLUVWCCAJ-MRXNPFEDSA-N	2	2	359.470	2.432	20	70		FEIDLP
COC(=O)C1([N@@H+](C)C[C@@H](O)Cn2c[nH+]c3cc(C)c(C)cc32)CCCC1	ZINC000159483721	545957414	/nfs/dbraw/zinc/95/74/14/545957414.db2.gz	LKLBBFLUVWCCAJ-MRXNPFEDSA-N	2	2	359.470	2.432	20	70		FEIDLP
CC[C@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)[N@@H+]1CCc2ccccc2C1	ZINC000159651867	545970049	/nfs/dbraw/zinc/97/00/49/545970049.db2.gz	MVAKDISJZOMSOE-IEBWSBKVSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC[C@H](CNC(=O)[C@@H]1CCn2cc[nH+]c2C1)[N@H+]1CCc2ccccc2C1	ZINC000159651867	545970056	/nfs/dbraw/zinc/97/00/56/545970056.db2.gz	MVAKDISJZOMSOE-IEBWSBKVSA-N	2	2	352.482	2.399	20	70		FEIDLP
CC[NH+]1CCN(C(=O)CC2CC[NH+](CCC[NH+]3CCCCC3)CC2)CC1	ZINC000161353697	546121949	/nfs/dbraw/zinc/12/19/49/546121949.db2.gz	LSBNBIRRRDKPIX-UHFFFAOYSA-N	3	2	364.578	2.129	20	70		FEIDLP
C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159605273	545966283	/nfs/dbraw/zinc/96/62/83/545966283.db2.gz	MOBPMRAKLCJRJK-GUDVDZBRSA-N	2	2	373.545	2.275	20	70		FEIDLP
CC[N@H+](C)CCNC(=O)N[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133568	546009981	/nfs/dbraw/zinc/00/99/81/546009981.db2.gz	PIAOWEHPBQCQQJ-HZPDHXFCSA-N	2	2	356.873	2.475	20	70		FEIDLP
CC[N@@H+](C)CCNC(=O)N[C@@H]1CC[NH+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133568	546009986	/nfs/dbraw/zinc/00/99/86/546009986.db2.gz	PIAOWEHPBQCQQJ-HZPDHXFCSA-N	2	2	356.873	2.475	20	70		FEIDLP
CC[NH+](C)CCNC(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(Cl)c(F)c1	ZINC000160133568	546009995	/nfs/dbraw/zinc/00/99/95/546009995.db2.gz	PIAOWEHPBQCQQJ-HZPDHXFCSA-N	2	2	356.873	2.475	20	70		FEIDLP
C[C@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(F)cc1N(C)C	ZINC000160422417	546040069	/nfs/dbraw/zinc/04/00/69/546040069.db2.gz	HEIQGRWTHJQOIH-AWEZNQCLSA-N	2	2	350.482	2.095	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NCCCNc2cccc[nH+]2)CC[N@@H+]1CCOC	ZINC000160434876	546041198	/nfs/dbraw/zinc/04/11/98/546041198.db2.gz	NZGGZOGGHJKJJC-KRWDZBQOSA-N	2	2	363.506	2.026	20	70		FEIDLP
CCC[C@H]1CN(C(=O)NCCCNc2cccc[nH+]2)CC[N@H+]1CCOC	ZINC000160434876	546041200	/nfs/dbraw/zinc/04/12/00/546041200.db2.gz	NZGGZOGGHJKJJC-KRWDZBQOSA-N	2	2	363.506	2.026	20	70		FEIDLP
O=C(C[N@@H+]1CC[C@@H]2CCCC[C@@H]21)NCc1ccccc1C[NH+]1CCOCC1	ZINC000160543936	546050422	/nfs/dbraw/zinc/05/04/22/546050422.db2.gz	IEKVHKPWCXBNOP-RXVVDRJESA-N	2	2	371.525	2.400	20	70		FEIDLP
O=C(C[N@H+]1CC[C@@H]2CCCC[C@@H]21)NCc1ccccc1C[NH+]1CCOCC1	ZINC000160543936	546050425	/nfs/dbraw/zinc/05/04/25/546050425.db2.gz	IEKVHKPWCXBNOP-RXVVDRJESA-N	2	2	371.525	2.400	20	70		FEIDLP
CC[C@H]([NH2+]C1CC[NH+](CC(=O)N(C)C)CC1)c1ccc(OC)c(OC)c1	ZINC000160388045	326963992	/nfs/dbraw/zinc/96/39/92/326963992.db2.gz	HCCVSNDFOVLTIJ-KRWDZBQOSA-N	2	2	363.502	2.297	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCOCC2)CC1	ZINC000159713320	545975421	/nfs/dbraw/zinc/97/54/21/545975421.db2.gz	UDYCOTDVDKDDCN-FQEVSTJZSA-N	2	2	374.529	2.106	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@@H](c2ccc(C)cc2)[NH+]2CCOCC2)CC1	ZINC000159713320	545975427	/nfs/dbraw/zinc/97/54/27/545975427.db2.gz	UDYCOTDVDKDDCN-FQEVSTJZSA-N	2	2	374.529	2.106	20	70		FEIDLP
CC[N@@H+](CC1CCN(c2cccc[nH+]2)CC1)[C@H](C)C(=O)NCCCOC	ZINC000160019469	546000822	/nfs/dbraw/zinc/00/08/22/546000822.db2.gz	IBXOTSPTZLSMJZ-QGZVFWFLSA-N	2	2	362.518	2.161	20	70		FEIDLP
Cc1ccc(NC(=O)NC(=O)C[NH+]2CCN(c3cc[nH+]cc3)CC2)c(C)c1	ZINC000161354771	546122708	/nfs/dbraw/zinc/12/27/08/546122708.db2.gz	WHLSSDRDIMRKME-UHFFFAOYSA-N	2	2	367.453	2.169	20	70		FEIDLP
NC(=O)[C@H]1CCC[N@@H+]1C1CC[NH+](CCSc2ccccc2F)CC1	ZINC000159406402	545951148	/nfs/dbraw/zinc/95/11/48/545951148.db2.gz	JLDQWVAHBXLKMX-MRXNPFEDSA-N	2	2	351.491	2.332	20	70		FEIDLP
NC(=O)[C@H]1CCC[N@H+]1C1CC[NH+](CCSc2ccccc2F)CC1	ZINC000159406402	545951150	/nfs/dbraw/zinc/95/11/50/545951150.db2.gz	JLDQWVAHBXLKMX-MRXNPFEDSA-N	2	2	351.491	2.332	20	70		FEIDLP
C[C@H](C[N@@H+]1CCC[C@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159585261	545965144	/nfs/dbraw/zinc/96/51/44/545965144.db2.gz	UBWIIMDXJXRXSB-ZWKOTPCHSA-N	2	2	359.518	2.029	20	70		FEIDLP
C[C@H](C[N@H+]1CCC[C@H](C)C1)NC(=O)N1CC[NH+](Cc2ccccn2)CC1	ZINC000159585261	545965146	/nfs/dbraw/zinc/96/51/46/545965146.db2.gz	UBWIIMDXJXRXSB-ZWKOTPCHSA-N	2	2	359.518	2.029	20	70		FEIDLP
CC[N@@H+]1CCCN(C(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCOCC2)CC1	ZINC000159713419	545975544	/nfs/dbraw/zinc/97/55/44/545975544.db2.gz	UDYCOTDVDKDDCN-HXUWFJFHSA-N	2	2	374.529	2.106	20	70		FEIDLP
CC[N@H+]1CCCN(C(=O)NC[C@H](c2ccc(C)cc2)[NH+]2CCOCC2)CC1	ZINC000159713419	545975547	/nfs/dbraw/zinc/97/55/47/545975547.db2.gz	UDYCOTDVDKDDCN-HXUWFJFHSA-N	2	2	374.529	2.106	20	70		FEIDLP
CCC[NH+]1CCC(CNC(=O)N2CC[NH+](Cc3ccccn3)CC2)CC1	ZINC000159875467	545988080	/nfs/dbraw/zinc/98/80/80/545988080.db2.gz	BPSHMNPZOHWQJH-UHFFFAOYSA-N	2	2	359.518	2.031	20	70		FEIDLP
CO[C@H](C)c1noc(CN2CCC[N@H+](CCC[NH+]3CCCCC3)CC2)n1	ZINC000161445964	546131086	/nfs/dbraw/zinc/13/10/86/546131086.db2.gz	RAKNREUHZXVQJR-QGZVFWFLSA-N	2	2	365.522	2.161	20	70		FEIDLP
CO[C@H](C)c1noc(CN2CCC[N@@H+](CCC[NH+]3CCCCC3)CC2)n1	ZINC000161445964	546131092	/nfs/dbraw/zinc/13/10/92/546131092.db2.gz	RAKNREUHZXVQJR-QGZVFWFLSA-N	2	2	365.522	2.161	20	70		FEIDLP