smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c(O)c(C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)ccc1[N+](=O)[O-]	ZINC000843121177	589051436	/nfs/dbraw/zinc/05/14/36/589051436.db2.gz	GEBKQULYQJUWMU-ZDUSSCGKSA-N	2	0	336.392	0.789	20	10		ECCDRP
COC(=O)[C@H]1C[C@@H](O)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000843433639	589066992	/nfs/dbraw/zinc/06/69/92/589066992.db2.gz	BQAZSXZXTIFJDP-FUHWJXTLSA-N	2	0	347.459	0.794	20	10		ECCDRP
COc1ccc(N2CCN(C[C@H](O)C[NH2+]C[C@H]3CCN3C)CC2)cc1	ZINC000905547412	586898835	/nfs/dbraw/zinc/89/88/35/586898835.db2.gz	WPCLXBDJMXDIEU-QZTJIDSGSA-N	2	0	348.491	0.472	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2c[nH]nc2[C@@H]2CC[NH2+]C2)cc1	ZINC000852792688	589512197	/nfs/dbraw/zinc/51/21/97/589512197.db2.gz	ZQZNFJRFFNOZAL-CJNGLKHVSA-N	2	0	342.447	0.982	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)C[C@H](C)[NH3+])CC2)cc1	ZINC000923408930	611239994	/nfs/dbraw/zinc/23/99/94/611239994.db2.gz	KRFMTKLXVMVJHL-DOTOQJQBSA-N	2	0	336.480	0.457	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H](N4CC[NH2+]CC4)C3)cc2)CC1	ZINC000843120559	589051344	/nfs/dbraw/zinc/05/13/44/589051344.db2.gz	ACDCCXXEHULMRD-HXUWFJFHSA-N	3	0	343.519	0.918	20	10		ECCDRP
[NH3+]CCC(=O)NC[C@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2	ZINC000843122826	589051775	/nfs/dbraw/zinc/05/17/75/589051775.db2.gz	VNQHJYBXHGSQQA-CYBMUJFWSA-N	2	0	335.404	0.940	20	10		ECCDRP
CN1C(=O)[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]2C1=O	ZINC000877720710	590479472	/nfs/dbraw/zinc/47/94/72/590479472.db2.gz	VDXYRDBFUBIUBM-CALCHBBNSA-N	2	0	342.443	0.485	20	10		ECCDRP
CCOC(=O)[C@H]1NCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000925764462	611498972	/nfs/dbraw/zinc/49/89/72/611498972.db2.gz	ZCHOXRDEUSNXRE-MSOLQXFVSA-N	2	0	346.475	0.822	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C2=NOC3(C2)CC[NH2+]CC3)cc1	ZINC000911665481	609904474	/nfs/dbraw/zinc/90/44/74/609904474.db2.gz	CUDHREVVYNIEBU-HNNXBMFYSA-N	2	0	345.447	0.767	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@]23C[NH2+]C[C@H]2CCOC3)cc1	ZINC000911665988	609904495	/nfs/dbraw/zinc/90/44/95/609904495.db2.gz	GHJJMZQSGUDZAA-KYJSFNMBSA-N	2	0	332.448	0.495	20	10		ECCDRP
CNS(=O)(=O)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000783998617	578748335	/nfs/dbraw/zinc/74/83/35/578748335.db2.gz	FHRWOLVPAWEYRK-UHFFFAOYSA-N	2	0	326.466	0.077	20	10		ECCDRP
CN1CCO[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@H]21	ZINC000775716804	579270363	/nfs/dbraw/zinc/27/03/63/579270363.db2.gz	GYZDBCFULJLZIP-MOPGFXCFSA-N	2	0	330.476	0.953	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]3COCC[NH2+]3)cc2)CC1	ZINC000892291730	586243446	/nfs/dbraw/zinc/24/34/46/586243446.db2.gz	ZWNMQPKHZSEVRA-MRXNPFEDSA-N	2	0	347.463	0.226	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@]23C[NH2+]C[C@H]2CCOC3)cc1	ZINC000911665984	609904449	/nfs/dbraw/zinc/90/44/49/609904449.db2.gz	GHJJMZQSGUDZAA-HFTRVMKXSA-N	2	0	332.448	0.495	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CCC([NH3+])CC3)CC2)cc1	ZINC000923277113	611223289	/nfs/dbraw/zinc/22/32/89/611223289.db2.gz	JYDVIECWUUXAET-GOSISDBHSA-N	2	0	348.491	0.601	20	10		ECCDRP
COc1ccc(N2CCN(C[C@H](O)C[N@@H+]3CC[C@@H](C[NH3+])C3)CC2)cc1	ZINC000923280894	611224314	/nfs/dbraw/zinc/22/43/14/611224314.db2.gz	JROJAHXJJPBXNM-WMZOPIPTSA-N	2	0	348.491	0.459	20	10		ECCDRP
C[C@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[N@@H+]1CCO	ZINC000779213725	579314251	/nfs/dbraw/zinc/31/42/51/579314251.db2.gz	MWCHFYRMYGMOEK-KRWDZBQOSA-N	2	0	332.492	0.937	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)N[C@H](C)C[NH3+])CC2)cc1	ZINC000841666550	588996926	/nfs/dbraw/zinc/99/69/26/588996926.db2.gz	XQQZVILWYNFKIP-OAHLLOKOSA-N	2	0	349.479	0.854	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]([NH3+])C3CC3)cc2)CC1	ZINC000892051422	586218292	/nfs/dbraw/zinc/21/82/92/586218292.db2.gz	RWTFXKVFWSJHKR-QGZVFWFLSA-N	2	0	331.464	0.975	20	10		ECCDRP
COc1ccc(O)c(C[N@@H+]2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)c1	ZINC000872254712	590108234	/nfs/dbraw/zinc/10/82/34/590108234.db2.gz	CBKGSSFSSRFNDH-BJJXKVORSA-N	2	0	333.388	0.768	20	10		ECCDRP
C[C@@H]([NH3+])CN(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578194	609899579	/nfs/dbraw/zinc/89/95/79/609899579.db2.gz	KDHAGTSQFQQQQV-CZUORRHYSA-N	2	0	349.479	0.277	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)[C@H](C)C[NH3+])CC2)cc1	ZINC000923289431	611225473	/nfs/dbraw/zinc/22/54/73/611225473.db2.gz	ILYYKYMRSNXHKO-NVXWUHKLSA-N	2	0	336.480	0.457	20	10		ECCDRP
C[NH2+]CCOCCNC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000892281178	586242103	/nfs/dbraw/zinc/24/21/03/586242103.db2.gz	QPCMIKBZMBTYHS-UHFFFAOYSA-N	2	0	349.479	0.474	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)C[C@]3(O)CCOC3)cc2)CC1	ZINC000905427850	586893836	/nfs/dbraw/zinc/89/38/36/586893836.db2.gz	OGPBVIDVEOECCH-RTBURBONSA-N	2	0	349.475	0.430	20	10		ECCDRP
CCOC(=O)[C@H]1NCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000925764464	611499210	/nfs/dbraw/zinc/49/92/10/611499210.db2.gz	ZCHOXRDEUSNXRE-ROUUACIJSA-N	2	0	346.475	0.822	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NCC34CC(C3)C[NH2+]4)cc2)CC1	ZINC000892260696	586239548	/nfs/dbraw/zinc/23/95/48/586239548.db2.gz	BZFCHHFIATWAKS-UHFFFAOYSA-N	2	0	343.475	0.990	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNS(=O)(=O)CCC[NH+](C)C)cc1	ZINC000866757172	589769661	/nfs/dbraw/zinc/76/96/61/589769661.db2.gz	LJTPPNBRTHSGCB-OAHLLOKOSA-N	2	0	328.482	0.624	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNCc3nc(C[NH3+])cc(=O)[nH]3)cc2)CC1	ZINC000863648120	590028781	/nfs/dbraw/zinc/02/87/81/590028781.db2.gz	KCJOWIGZARGNMG-UHFFFAOYSA-N	2	0	342.447	0.683	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[C@H]([NH3+])[C@@H]3C)CC2)cc1	ZINC000923367547	611233858	/nfs/dbraw/zinc/23/38/58/611233858.db2.gz	HHNCSRODBLJVBC-IEZWGBDMSA-N	2	0	348.491	0.600	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)C[C@@H](C)[NH3+])CC2)cc1	ZINC000923409167	611239947	/nfs/dbraw/zinc/23/99/47/611239947.db2.gz	KRFMTKLXVMVJHL-WBVHZDCISA-N	2	0	336.480	0.457	20	10		ECCDRP
CN1CCO[C@H]2C[N@H+](Cc3ccc(N4CC[NH+](C)CC4)cc3)C[C@@H]21	ZINC000775716805	579270334	/nfs/dbraw/zinc/27/03/34/579270334.db2.gz	GYZDBCFULJLZIP-OALUTQOASA-N	2	0	330.476	0.953	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC[C@@H](O)C[NH+]3CCCC3)cc2)CC1	ZINC000905427411	586893382	/nfs/dbraw/zinc/89/33/82/586893382.db2.gz	NWNYPRVSMVUGEU-LJQANCHMSA-N	2	0	332.492	0.985	20	10		ECCDRP
C[NH+](C)CCNC(=S)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000905532149	586900503	/nfs/dbraw/zinc/90/05/03/586900503.db2.gz	YHHDKFCFTKNQER-UHFFFAOYSA-N	2	0	335.521	0.964	20	10		ECCDRP
CCOC(=O)[C@@H]1NCC[C@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000925764463	611498882	/nfs/dbraw/zinc/49/88/82/611498882.db2.gz	ZCHOXRDEUSNXRE-QZTJIDSGSA-N	2	0	346.475	0.822	20	10		ECCDRP
COC(=O)[C@@]1(O)CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000895703706	586199238	/nfs/dbraw/zinc/19/92/38/586199238.db2.gz	NZYQZYIKGAVASU-GOSISDBHSA-N	2	0	333.432	0.548	20	10		ECCDRP
CC[NH+]1CCN(CC(=O)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)CC1	ZINC000844162994	589097048	/nfs/dbraw/zinc/09/70/48/589097048.db2.gz	QVOLACWYRGFORV-KRWDZBQOSA-N	2	0	333.480	0.506	20	10		ECCDRP
C[NH+]1CCN(C[C@H](O)C[NH2+]Cc2ccc(N3CC=CC3)cc2)CC1	ZINC000819094821	587468324	/nfs/dbraw/zinc/46/83/24/587468324.db2.gz	NGTLOHGSZBSOMC-LJQANCHMSA-N	2	0	330.476	0.761	20	10		ECCDRP
O=C(NCc1ccc(N2CC[NH2+]CC2)c(F)c1)[C@H]1C[C@]12CC[NH2+]C2	ZINC000377391742	438308554	/nfs/dbraw/zinc/30/85/54/438308554.db2.gz	NGWWUEYCHKXLCM-KDOFPFPSSA-N	2	0	332.423	0.851	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3CCN4CCOC[C@@H]4C3)cc2)CC1	ZINC000757930577	579465832	/nfs/dbraw/zinc/46/58/32/579465832.db2.gz	PJMNWLVDXHFEAC-IBGZPJMESA-N	2	0	330.476	0.955	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@H]3CC(C(N)=O)=NO3)cc2)CC1	ZINC000789562649	578856943	/nfs/dbraw/zinc/85/69/43/578856943.db2.gz	YJGSNNTZQZWZTH-OAHLLOKOSA-N	2	0	331.420	0.158	20	10		ECCDRP
Cn1ncnc1C1(O)CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000895617952	586193102	/nfs/dbraw/zinc/19/31/02/586193102.db2.gz	BAXAWYYDPCIYJP-UHFFFAOYSA-N	2	0	342.447	0.270	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NCC[NH2+]C3CC3)cc2)CC1	ZINC000891985228	586212048	/nfs/dbraw/zinc/21/20/48/586212048.db2.gz	ZGLXBFYWVJWNMK-UHFFFAOYSA-N	2	0	331.464	0.990	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@@H]3CCC[NH2+]C3)cc2)CC1	ZINC000892017776	586215412	/nfs/dbraw/zinc/21/54/12/586215412.db2.gz	XJVMGRKMECRYGB-MRXNPFEDSA-N	2	0	331.464	0.990	20	10		ECCDRP
C[C@@H]1[NH2+]CC[C@H]1NC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000892306170	586244956	/nfs/dbraw/zinc/24/49/56/586244956.db2.gz	STKJXJQSVXRZRQ-WMLDXEAASA-N	2	0	331.464	0.988	20	10		ECCDRP
C[NH+]1CCN(C[C@@H](O)C[NH2+]Cc2ccc(N3CCOCC3)cc2)CC1	ZINC000818973718	587462869	/nfs/dbraw/zinc/46/28/69/587462869.db2.gz	VZIMDFLEJNWDQS-IBGZPJMESA-N	2	0	348.491	0.221	20	10		ECCDRP
C[NH2+][C@@H](C)C(=O)NCCC[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000848416069	589292916	/nfs/dbraw/zinc/29/29/16/589292916.db2.gz	XUOBRJHWQNVGJK-HNNXBMFYSA-N	2	0	334.464	0.931	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2c[nH]nc2[C@H]2CC[NH2+]C2)cc1	ZINC000852792691	589512024	/nfs/dbraw/zinc/51/20/24/589512024.db2.gz	ZQZNFJRFFNOZAL-XJKSGUPXSA-N	2	0	342.447	0.982	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CN3CCC([NH2+]CCO)CC3)cc2)CC1	ZINC000873218058	590186916	/nfs/dbraw/zinc/18/69/16/590186916.db2.gz	XXFVNYWXLZZTTH-UHFFFAOYSA-N	2	0	332.492	0.985	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@H](C)[C@H]([NH3+])C3)CC2)cc1	ZINC000923365575	611233842	/nfs/dbraw/zinc/23/38/42/611233842.db2.gz	GCJISRBWRBPVBL-VDZJLULYSA-N	2	0	348.491	0.457	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cc([C@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000841847125	589002618	/nfs/dbraw/zinc/00/26/18/589002618.db2.gz	ZXEMXYHQAVEWRD-ZFWWWQNUSA-N	2	0	342.447	0.982	20	10		ECCDRP
COc1c(O)c(C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)ccc1[N+](=O)[O-]	ZINC000843121174	589051519	/nfs/dbraw/zinc/05/15/19/589051519.db2.gz	GEBKQULYQJUWMU-CYBMUJFWSA-N	2	0	336.392	0.789	20	10		ECCDRP
COC(=O)[C@H]1C[NH2+]CCCN1Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000843122761	589051801	/nfs/dbraw/zinc/05/18/01/589051801.db2.gz	DUYFYQFEIRTEGY-GOSISDBHSA-N	2	0	346.475	0.775	20	10		ECCDRP
C[NH+]1CCN(C[C@H](O)C[NH2+]CCCSc2nccs2)CC1	ZINC000819063430	587466298	/nfs/dbraw/zinc/46/62/98/587466298.db2.gz	MXCTWGMGMUNTCL-CYBMUJFWSA-N	2	0	330.523	0.823	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC[C@H](O)C[NH+]3CCCC3)cc2)CC1	ZINC000905427408	586893812	/nfs/dbraw/zinc/89/38/12/586893812.db2.gz	NWNYPRVSMVUGEU-IBGZPJMESA-N	2	0	332.492	0.985	20	10		ECCDRP
CN(C)c1ccc([C@H](CNC(=O)C(=O)N2CC[C@@H]([NH3+])C2)[NH+](C)C)cc1	ZINC000911577351	609899465	/nfs/dbraw/zinc/89/94/65/609899465.db2.gz	CAVGHGUZEGLNAG-ZBFHGGJFSA-N	2	0	347.463	0.031	20	10		ECCDRP
C[C@@H](O)C[NH+]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1	ZINC000775675738	579269783	/nfs/dbraw/zinc/26/97/83/579269783.db2.gz	AQDYPCZAHLFFRP-QGZVFWFLSA-N	2	0	332.492	0.937	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@H+]3C[C@@H]4CS(=O)(=O)C[C@@H]4C3)cc2)CC1	ZINC000897618224	586352006	/nfs/dbraw/zinc/35/20/06/586352006.db2.gz	BFZVFHDXDULZLN-CALCHBBNSA-N	2	0	349.500	0.915	20	10		ECCDRP
CC[NH+]1CCN(CCC(=O)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)CC1	ZINC000844163320	589097035	/nfs/dbraw/zinc/09/70/35/589097035.db2.gz	YTVMGFBZYWZIKE-SFHVURJKSA-N	2	0	347.507	0.896	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)[C@H]3CC[NH2+]C3)CC2)cc1	ZINC000923288311	611225082	/nfs/dbraw/zinc/22/50/82/611225082.db2.gz	VIRYEGDKZPDYPG-ZWKOTPCHSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@H]3CCC[NH2+]C3)cc2)CC1	ZINC000892017775	586215303	/nfs/dbraw/zinc/21/53/03/586215303.db2.gz	XJVMGRKMECRYGB-INIZCTEOSA-N	2	0	331.464	0.990	20	10		ECCDRP
C[N@H+](CCN1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)c(F)c1	ZINC000843053314	589048130	/nfs/dbraw/zinc/04/81/30/589048130.db2.gz	VJULKICTLXMTLU-UHFFFAOYSA-N	2	0	336.455	0.999	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNS(=O)(=O)CCC[NH+](C)C)cc1	ZINC000866757171	589769495	/nfs/dbraw/zinc/76/94/95/589769495.db2.gz	LJTPPNBRTHSGCB-HNNXBMFYSA-N	2	0	328.482	0.624	20	10		ECCDRP
CCN(CC[NH3+])C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578107	609899581	/nfs/dbraw/zinc/89/95/81/609899581.db2.gz	ICDQKULFWSFEHI-INIZCTEOSA-N	2	0	349.479	0.279	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[NH2+][C@H](C)C3)CC2)cc1	ZINC000923290690	611225409	/nfs/dbraw/zinc/22/54/09/611225409.db2.gz	NPLGXJZAPQYCMX-AEFFLSMTSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH2+]CCN(C)C[C@@H](O)C[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000923361458	611234443	/nfs/dbraw/zinc/23/44/43/611234443.db2.gz	JYSXMAFDWUBCSS-QGZVFWFLSA-N	2	0	336.480	0.329	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNS(=O)(=O)[C@H]2CCC[NH2+]C2)cc1	ZINC000923633122	611332888	/nfs/dbraw/zinc/33/28/88/611332888.db2.gz	DCUPHRWVUNEBQT-LSDHHAIUSA-N	2	0	326.466	0.424	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[NH2+]CC3)CC2)cc1	ZINC000325164266	756959369	/nfs/dbraw/zinc/95/93/69/756959369.db2.gz	JIVWTVXGGAKTQW-QGZVFWFLSA-N	2	0	334.464	0.083	20	10		ECCDRP
COc1ccc(N2CCC([NH2+]CC(=O)N3CC[NH2+]CC3)CC2)cc1	ZINC000817945814	587392899	/nfs/dbraw/zinc/39/28/99/587392899.db2.gz	MPRXIHGBVUKGGC-UHFFFAOYSA-N	2	0	332.448	0.685	20	10		ECCDRP
C[C@@H](C[NH3+])CNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911292626	609840522	/nfs/dbraw/zinc/84/05/22/609840522.db2.gz	QVIQOWKMGXLWFC-XJKSGUPXSA-N	2	0	349.479	0.183	20	10		ECCDRP
CN(C)c1ccc([C@H](CNC(=O)C(=O)N(C)CCC[NH3+])[NH+](C)C)cc1	ZINC000911581006	609899941	/nfs/dbraw/zinc/89/99/41/609899941.db2.gz	XZVDNVGUNVFFPZ-INIZCTEOSA-N	2	0	349.479	0.279	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CCC[C@@H]3C[NH3+])CC2)cc1	ZINC000923292299	611225486	/nfs/dbraw/zinc/22/54/86/611225486.db2.gz	HIQCVEIIAUPEOE-QZTJIDSGSA-N	2	0	348.491	0.601	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@@H]4OCC(=O)N[C@H]4C3)cc2)CC1	ZINC000835055986	611306889	/nfs/dbraw/zinc/30/68/89/611306889.db2.gz	CTGWXAIACMWHHS-ROUUACIJSA-N	2	0	344.459	0.528	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3CCN4CCOC[C@H]4C3)cc2)CC1	ZINC000757930578	579465853	/nfs/dbraw/zinc/46/58/53/579465853.db2.gz	PJMNWLVDXHFEAC-LJQANCHMSA-N	2	0	330.476	0.955	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH+]3CCN([C@@H]4CC[NH2+]C4)CC3)cc2)CC1	ZINC000843124453	589051898	/nfs/dbraw/zinc/05/18/98/589051898.db2.gz	AZKIHGKMAQXKJO-HXUWFJFHSA-N	3	0	343.519	0.918	20	10		ECCDRP
C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000886294716	590827052	/nfs/dbraw/zinc/82/70/52/590827052.db2.gz	KKFZIQZUTARQQJ-PBHICJAKSA-N	2	0	337.489	0.961	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNS(=O)(=O)CC2CC[NH2+]CC2)cc1	ZINC000905341559	586888175	/nfs/dbraw/zinc/88/81/75/586888175.db2.gz	AAZXXYFFZHNZDM-MRXNPFEDSA-N	2	0	340.493	0.671	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)COC2CC[NH+](C)CC2)cc1	ZINC000911665542	609904485	/nfs/dbraw/zinc/90/44/85/609904485.db2.gz	DHWHMWGQESRISC-QGZVFWFLSA-N	2	0	334.464	0.979	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)[C@H](C)C[NH3+])CC2)cc1	ZINC000923289433	611225320	/nfs/dbraw/zinc/22/53/20/611225320.db2.gz	ILYYKYMRSNXHKO-WBVHZDCISA-N	2	0	336.480	0.457	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)NC[C@@H](C)[NH3+])CC2)cc1	ZINC000841665880	588997003	/nfs/dbraw/zinc/99/70/03/588997003.db2.gz	RRFBGLMIFMFFRH-OAHLLOKOSA-N	2	0	349.479	0.854	20	10		ECCDRP
COCCNC(=O)C1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1	ZINC000839193620	586840592	/nfs/dbraw/zinc/84/05/92/586840592.db2.gz	UJLFBPHPZLDXAG-UHFFFAOYSA-N	2	0	346.475	0.823	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)C2=NOC3(C2)CC[NH2+]CC3)cc1	ZINC000911665482	609904607	/nfs/dbraw/zinc/90/46/07/609904607.db2.gz	CUDHREVVYNIEBU-OAHLLOKOSA-N	2	0	345.447	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)[C@@H](C)C[NH3+])CC2)cc1	ZINC000923289430	611225034	/nfs/dbraw/zinc/22/50/34/611225034.db2.gz	ILYYKYMRSNXHKO-DOTOQJQBSA-N	2	0	336.480	0.457	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@H]([NH3+])C[C@@H]3C)CC2)cc1	ZINC000923411263	611240333	/nfs/dbraw/zinc/24/03/33/611240333.db2.gz	BMNXISMOEAULMQ-JZXOWHBKSA-N	2	0	348.491	0.600	20	10		ECCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)[C@@H](C[NH3+])OC)cc2F)CC1	ZINC000290250148	437474039	/nfs/dbraw/zinc/47/40/39/437474039.db2.gz	WHYGBDPWKBPSPY-MRXNPFEDSA-N	2	0	338.427	0.558	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@@H]([NH3+])C[C@@H]3C)CC2)cc1	ZINC000923411262	611240257	/nfs/dbraw/zinc/24/02/57/611240257.db2.gz	BMNXISMOEAULMQ-BQFCYCMXSA-N	2	0	348.491	0.600	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3C[C@@H](C)[C@H]([NH3+])C3)CC2)cc1	ZINC000923507704	611252683	/nfs/dbraw/zinc/25/26/83/611252683.db2.gz	GCJISRBWRBPVBL-SZVBFZGTSA-N	2	0	348.491	0.457	20	10		ECCDRP
C[C@@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)S(C)(=O)=O	ZINC000771857544	579197055	/nfs/dbraw/zinc/19/70/55/579197055.db2.gz	JFZDIQPHVPLPML-AWEZNQCLSA-N	2	0	325.478	0.961	20	10		ECCDRP
C[N@H+](CCN1CC[NH2+]CC1)Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000843052466	589048108	/nfs/dbraw/zinc/04/81/08/589048108.db2.gz	LVIGRCKXPIGGAK-UHFFFAOYSA-N	3	0	331.508	0.775	20	10		ECCDRP
CN(C)c1ccc([C@H](CNS(=O)(=O)C2C[NH2+]C2)[NH+](C)C)cc1	ZINC000903598739	586794503	/nfs/dbraw/zinc/79/45/03/586794503.db2.gz	PVFPVWPJOXEZED-HNNXBMFYSA-N	2	0	326.466	0.247	20	10		ECCDRP
CN(C)c1ccc(CN(C)C(=O)C[NH+]2CCC(O)(C[NH3+])CC2)cc1	ZINC000844225028	589103894	/nfs/dbraw/zinc/10/38/94/589103894.db2.gz	VQJPYKOPPRXTNQ-UHFFFAOYSA-N	2	0	334.464	0.497	20	10		ECCDRP
C[C@@H](C(=O)NCc1cc(NC(=O)[C@H](C)[NH+](C)C)ccc1O)[NH+](C)C	ZINC000923121205	611204162	/nfs/dbraw/zinc/20/41/62/611204162.db2.gz	YFTKTYQRHVDEAL-RYUDHWBXSA-N	2	0	336.436	0.847	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[NH2+]C[C@H]3C)CC2)cc1	ZINC000923279794	611224364	/nfs/dbraw/zinc/22/43/64/611224364.db2.gz	DAXNQGKOBGOGHK-SJLPKXTDSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@]3(C)CC[NH2+]C3)cc2)CC1	ZINC000892938581	586301780	/nfs/dbraw/zinc/30/17/80/586301780.db2.gz	BCVQEQLCMHBZED-GOSISDBHSA-N	2	0	331.464	0.990	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@@]3(C)CC[NH2+]C3)cc2)CC1	ZINC000892938582	586301989	/nfs/dbraw/zinc/30/19/89/586301989.db2.gz	BCVQEQLCMHBZED-SFHVURJKSA-N	2	0	331.464	0.990	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@@H]2[NH2+]CC23CCOCC3)cc1	ZINC000852826310	589515833	/nfs/dbraw/zinc/51/58/33/589515833.db2.gz	SSPMYBUQVFEBFY-CVEARBPZSA-N	2	0	332.448	0.637	20	10		ECCDRP
C[C@H](C[NH3+])N(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911581009	609899947	/nfs/dbraw/zinc/89/99/47/609899947.db2.gz	YASZMEOXUGTKRC-CJNGLKHVSA-N	2	0	349.479	0.277	20	10		ECCDRP
CO[C@H]1C[C@@H](C(=O)NCc2ccc(N3CC[NH+](C)CC3)cc2)[N@H+](C)C1	ZINC000918852869	610020810	/nfs/dbraw/zinc/02/08/10/610020810.db2.gz	YJAQDOWJYVHGIR-ROUUACIJSA-N	2	0	346.475	0.774	20	10		ECCDRP
COc1ccc(N2CCN(C[C@@H](O)C[N@@H+]3CC[C@@H](C[NH3+])C3)CC2)cc1	ZINC000923280890	611224010	/nfs/dbraw/zinc/22/40/10/611224010.db2.gz	JROJAHXJJPBXNM-FUHWJXTLSA-N	2	0	348.491	0.459	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CCC[C@H]3C[NH3+])CC2)cc1	ZINC000923292300	611225439	/nfs/dbraw/zinc/22/54/39/611225439.db2.gz	HIQCVEIIAUPEOE-ROUUACIJSA-N	2	0	348.491	0.601	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)C[NH+](C)C)CC2)cc1	ZINC000193557530	612337301	/nfs/dbraw/zinc/33/73/01/612337301.db2.gz	YARGGRFLJOIEEY-UHFFFAOYSA-N	2	0	334.464	0.885	20	10		ECCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NCC[NH2+]C)cc2F)CC1	ZINC000841792408	589001196	/nfs/dbraw/zinc/00/11/96/589001196.db2.gz	BTBSTFFIJWLZLX-UHFFFAOYSA-N	2	0	337.443	0.986	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)C[C@@]3(O)CCOC3)cc2)CC1	ZINC000905427848	586893916	/nfs/dbraw/zinc/89/39/16/586893916.db2.gz	OGPBVIDVEOECCH-OALUTQOASA-N	2	0	349.475	0.430	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3C[C@@H]4C[C@H]3C[NH2+]4)CC2)cc1	ZINC000923409616	611239889	/nfs/dbraw/zinc/23/98/89/611239889.db2.gz	CASOKQYVIQNPTI-RYQLBKOJSA-N	2	0	346.475	0.224	20	10		ECCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)[C@H](C[NH3+])OC)cc2F)CC1	ZINC000290250146	437474018	/nfs/dbraw/zinc/47/40/18/437474018.db2.gz	WHYGBDPWKBPSPY-INIZCTEOSA-N	2	0	338.427	0.558	20	10		ECCDRP
C[C@H](C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1)S(C)(=O)=O	ZINC000771857546	579197046	/nfs/dbraw/zinc/19/70/46/579197046.db2.gz	JFZDIQPHVPLPML-CQSZACIVSA-N	2	0	325.478	0.961	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cc([C@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000841847122	589002646	/nfs/dbraw/zinc/00/26/46/589002646.db2.gz	ZXEMXYHQAVEWRD-DZGCQCFKSA-N	2	0	342.447	0.982	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNS(=O)(=O)CC2CC[NH2+]CC2)cc1	ZINC000905341558	586888270	/nfs/dbraw/zinc/88/82/70/586888270.db2.gz	AAZXXYFFZHNZDM-INIZCTEOSA-N	2	0	340.493	0.671	20	10		ECCDRP
C[NH+]1CCN(C[C@@H](O)C[NH2+]CCCSc2nccs2)CC1	ZINC000819063434	587466404	/nfs/dbraw/zinc/46/64/04/587466404.db2.gz	MXCTWGMGMUNTCL-ZDUSSCGKSA-N	2	0	330.523	0.823	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)CCNC(=O)[C@H]2CCC[NH2+]2)cc1	ZINC000832274636	588477679	/nfs/dbraw/zinc/47/76/79/588477679.db2.gz	WIOIBJMQACZWGO-JKSUJKDBSA-N	2	0	347.463	0.127	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCCN3CCNC(=O)C3)cc2)CC1	ZINC000848557861	589300522	/nfs/dbraw/zinc/30/05/22/589300522.db2.gz	MDQMCLVTSAUUSV-UHFFFAOYSA-N	2	0	345.491	0.350	20	10		ECCDRP
C[C@@H](CS(C)(=O)=O)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000883289554	590610873	/nfs/dbraw/zinc/61/08/73/590610873.db2.gz	SFXXONNOTGUDPZ-AWEZNQCLSA-N	2	0	325.478	0.961	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)NC[C@H](C)[NH3+])CC2)cc1	ZINC000841665878	588997055	/nfs/dbraw/zinc/99/70/55/588997055.db2.gz	RRFBGLMIFMFFRH-HNNXBMFYSA-N	2	0	349.479	0.854	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3CC[C@H](N4CC[NH2+]CC4)C3)cc2)CC1	ZINC000843120557	589051605	/nfs/dbraw/zinc/05/16/05/589051605.db2.gz	ACDCCXXEHULMRD-FQEVSTJZSA-N	3	0	343.519	0.918	20	10		ECCDRP
COC(=O)[C@@H]1C[NH2+]CCCN1Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000843122764	589051936	/nfs/dbraw/zinc/05/19/36/589051936.db2.gz	DUYFYQFEIRTEGY-SFHVURJKSA-N	2	0	346.475	0.775	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)CCNC(=O)[C@@H]2CCC[NH2+]2)cc1	ZINC000832274633	588477619	/nfs/dbraw/zinc/47/76/19/588477619.db2.gz	WIOIBJMQACZWGO-HOTGVXAUSA-N	2	0	347.463	0.127	20	10		ECCDRP
C[N@H+](CCC(=O)N1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)cc1	ZINC000844221089	589103747	/nfs/dbraw/zinc/10/37/47/589103747.db2.gz	UEEHBKGSZJASPY-UHFFFAOYSA-N	2	0	346.475	0.777	20	10		ECCDRP
C[NH2+][C@@H]1CCN(C[C@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000923277049	611223543	/nfs/dbraw/zinc/22/35/43/611223543.db2.gz	BFMPUYMJMIHUDV-SJLPKXTDSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H]3CC(C(N)=O)=NO3)cc2)CC1	ZINC000789562637	578856887	/nfs/dbraw/zinc/85/68/87/578856887.db2.gz	YJGSNNTZQZWZTH-HNNXBMFYSA-N	2	0	331.420	0.158	20	10		ECCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)NCC3C[NH2+]C3)cc2F)CC1	ZINC000841793975	589001347	/nfs/dbraw/zinc/00/13/47/589001347.db2.gz	WSDBSDXBGYQJDB-UHFFFAOYSA-N	2	0	349.454	0.986	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cc([C@@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000841847124	589002600	/nfs/dbraw/zinc/00/26/00/589002600.db2.gz	ZXEMXYHQAVEWRD-UKRRQHHQSA-N	2	0	342.447	0.982	20	10		ECCDRP
COc1cccc(O)c1C[N@@H+]1CC[C@@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1	ZINC000872255216	590108663	/nfs/dbraw/zinc/10/86/63/590108663.db2.gz	RLCNIGSSEIFLCF-KFNAQCHYSA-N	2	0	333.388	0.768	20	10		ECCDRP
C[NH2+]CCCNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911270214	609834888	/nfs/dbraw/zinc/83/48/88/609834888.db2.gz	JFONUPMATZPYNP-INIZCTEOSA-N	2	0	349.479	0.197	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@@H]([NH3+])C[C@H]3C)CC2)cc1	ZINC000923411265	611240249	/nfs/dbraw/zinc/24/02/49/611240249.db2.gz	BMNXISMOEAULMQ-RYRKJORJSA-N	2	0	348.491	0.600	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2[nH]nc3c2C[NH2+]CC3)cc1	ZINC000841846680	589002549	/nfs/dbraw/zinc/00/25/49/589002549.db2.gz	RZKNISVGZNRVAN-AWEZNQCLSA-N	2	0	328.420	0.551	20	10		ECCDRP
O=C([C@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1)N1CC[NH2+]CC1	ZINC000843047538	589047865	/nfs/dbraw/zinc/04/78/65/589047865.db2.gz	VIRDCBUCWQRLAU-ZDUSSCGKSA-N	2	0	347.415	0.765	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)C3(O)CCOCC3)cc2)CC1	ZINC000905426776	586893331	/nfs/dbraw/zinc/89/33/31/586893331.db2.gz	JZWNBOLNALBYPU-SFHVURJKSA-N	2	0	349.475	0.430	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCCn3cc(CO)nn3)cc2)CC1	ZINC000810162656	587191093	/nfs/dbraw/zinc/19/10/93/587191093.db2.gz	ORDZANASQWACDN-UHFFFAOYSA-N	2	0	344.463	0.702	20	10		ECCDRP
C[C@@H]1C[N@H+](CCO)CCN1Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000825336872	587933491	/nfs/dbraw/zinc/93/34/91/587933491.db2.gz	AEOQEVIGVQQKOB-QGZVFWFLSA-N	2	0	332.492	0.937	20	10		ECCDRP
COCC1(C(=O)NC[C@H]([NH3+])c2ccc(N(C)C)cc2)CC[NH2+]CC1	ZINC000832272652	588477382	/nfs/dbraw/zinc/47/73/82/588477382.db2.gz	IDERRABSQBMURJ-INIZCTEOSA-N	2	0	334.464	0.885	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C2=NO[C@@]3(C2)CCC[NH2+]C3)cc1	ZINC000911668547	609904884	/nfs/dbraw/zinc/90/48/84/609904884.db2.gz	ZMBHWUHRRMRTOY-MAUKXSAKSA-N	2	0	345.447	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[NH2+]C[C@H]3C)CC2)cc1	ZINC000923279791	611224021	/nfs/dbraw/zinc/22/40/21/611224021.db2.gz	DAXNQGKOBGOGHK-AEFFLSMTSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)C3CC([NH3+])C3)CC2)cc1	ZINC000923363316	611233832	/nfs/dbraw/zinc/23/38/32/611233832.db2.gz	RRYYMXAZEAATCU-VJFUWPCTSA-N	2	0	348.491	0.600	20	10		ECCDRP
O=C(NCc1ccc(N2CC[NH2+]CC2)c(F)c1)[C@H]1C[C@@]12CC[NH2+]C2	ZINC000377391744	438309878	/nfs/dbraw/zinc/30/98/78/438309878.db2.gz	NGWWUEYCHKXLCM-RDTXWAMCSA-N	2	0	332.423	0.851	20	10		ECCDRP
[NH3+]CCNC(=O)NCc1ccc(N2CC[NH+](CC3CC3)CC2)cc1	ZINC000841868263	589003577	/nfs/dbraw/zinc/00/35/77/589003577.db2.gz	CQBJBVHPQZFNCT-UHFFFAOYSA-N	2	0	331.464	0.977	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@H](C[NH3+])C3CC3)cc2)CC1	ZINC000892025916	586216466	/nfs/dbraw/zinc/21/64/66/586216466.db2.gz	BAASWWJDPNXTJR-QGZVFWFLSA-N	2	0	331.464	0.975	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3COCC[NH2+]3)cc2)CC1	ZINC000892291728	586243558	/nfs/dbraw/zinc/24/35/58/586243558.db2.gz	ZWNMQPKHZSEVRA-INIZCTEOSA-N	2	0	347.463	0.226	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)C3(C)C[NH2+]C3)CC2)cc1	ZINC000844190603	589101614	/nfs/dbraw/zinc/10/16/14/589101614.db2.gz	CLCYJOJQQRUPIO-UHFFFAOYSA-N	2	0	346.475	0.933	20	10		ECCDRP
COc1cccc(C[N@@H+]2CC[C@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)c1O	ZINC000872255238	590108397	/nfs/dbraw/zinc/10/83/97/590108397.db2.gz	SATASOJTSZBFRK-GUTXKFCHSA-N	2	0	333.388	0.768	20	10		ECCDRP
CN1CCOC[C@@]1(CO)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000922534069	611353727	/nfs/dbraw/zinc/35/37/27/611353727.db2.gz	ULPSUIRWABKKTG-IBGZPJMESA-N	2	0	348.491	0.221	20	10		ECCDRP
C[N@@H+]1CCC[C@H]1C(=O)N1CCN(Cc2cc3c(cc2O)OCO3)CC1	ZINC000271195104	436678690	/nfs/dbraw/zinc/67/86/90/436678690.db2.gz	SEDWCGPDIRQQES-AWEZNQCLSA-N	2	0	347.415	0.859	20	10		ECCDRP
O=C(C[C@@H]1COCC[NH2+]1)NCc1ccc(N2CC[NH2+]CC2)c(F)c1	ZINC000377163973	438303958	/nfs/dbraw/zinc/30/39/58/438303958.db2.gz	FALXOPPGDGMTCC-CQSZACIVSA-N	2	0	336.411	0.230	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cnn(CC[NH+](C)C)c2)cc1	ZINC000876506131	590383409	/nfs/dbraw/zinc/38/34/09/590383409.db2.gz	FUTKVXZJPLPDGF-KRWDZBQOSA-N	2	0	344.463	0.941	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNc3cc[nH+]cc3C(N)=O)cc2)CC1	ZINC000882880137	590595179	/nfs/dbraw/zinc/59/51/79/590595179.db2.gz	CYXBOHXCPHAFDN-UHFFFAOYSA-N	2	0	325.416	0.966	20	10		ECCDRP
C[N@@H+]1CC[C@H]1CNC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000924007527	611382216	/nfs/dbraw/zinc/38/22/16/611382216.db2.gz	NVSKNPHFGVJMSK-KRWDZBQOSA-N	2	0	331.464	0.942	20	10		ECCDRP
C[C@@H](C[NH3+])N(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911581008	609899934	/nfs/dbraw/zinc/89/99/34/609899934.db2.gz	YASZMEOXUGTKRC-BBRMVZONSA-N	2	0	349.479	0.277	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)[C@@H](C)C[NH3+])CC2)cc1	ZINC000923289432	611225528	/nfs/dbraw/zinc/22/55/28/611225528.db2.gz	ILYYKYMRSNXHKO-RDJZCZTQSA-N	2	0	336.480	0.457	20	10		ECCDRP
C[NH2+]CCN(C)C[C@H](O)C[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000923361457	611234351	/nfs/dbraw/zinc/23/43/51/611234351.db2.gz	JYSXMAFDWUBCSS-KRWDZBQOSA-N	2	0	336.480	0.329	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNS(=O)(=O)[C@@H]2CCC[NH2+]C2)cc1	ZINC000923633120	611332892	/nfs/dbraw/zinc/33/28/92/611332892.db2.gz	DCUPHRWVUNEBQT-HUUCEWRRSA-N	2	0	326.466	0.424	20	10		ECCDRP
COc1cc(O)c(C[N@@H+]2CCC[C@@H](C(=O)NCC[NH3+])C2)cc1OC	ZINC000843048093	589047886	/nfs/dbraw/zinc/04/78/86/589047886.db2.gz	MSACJGSWVDYNLQ-GFCCVEGCSA-N	2	0	337.420	0.696	20	10		ECCDRP
COC(=O)[C@@H]1C[C@@H](O)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000843433640	589066894	/nfs/dbraw/zinc/06/68/94/589066894.db2.gz	BQAZSXZXTIFJDP-SJLPKXTDSA-N	2	0	347.459	0.794	20	10		ECCDRP
COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@H+](Cc1cc3c(cc1O)OCO3)C2	ZINC000903978966	586828680	/nfs/dbraw/zinc/82/86/80/586828680.db2.gz	PXDIUYOKRQOHQM-JKDFXYPNSA-N	2	0	334.372	0.833	20	10		ECCDRP
CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@@H](N3CC[NH2+]CC3)C2)cc1	ZINC000844225809	589104109	/nfs/dbraw/zinc/10/41/09/589104109.db2.gz	VNPVSWRABYHDIJ-GOSISDBHSA-N	2	0	345.491	0.348	20	10		ECCDRP
COc1cc(O)c(C[NH2+]CCCN2CCC[C@H]2C(N)=O)cc1OC	ZINC000862465562	589941464	/nfs/dbraw/zinc/94/14/64/589941464.db2.gz	RMGOOHWQRJWOBO-ZDUSSCGKSA-N	2	0	337.420	0.839	20	10		ECCDRP
COc1ccc(O)c(C[N@@H+]2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)c1	ZINC000872254719	590108365	/nfs/dbraw/zinc/10/83/65/590108365.db2.gz	CBKGSSFSSRFNDH-XPKDYRNWSA-N	2	0	333.388	0.768	20	10		ECCDRP
C[C@H]([NH3+])CN(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578192	609899349	/nfs/dbraw/zinc/89/93/49/609899349.db2.gz	KDHAGTSQFQQQQV-BBRMVZONSA-N	2	0	349.479	0.277	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[NH2+][C@H](C)C3)CC2)cc1	ZINC000923290700	611225381	/nfs/dbraw/zinc/22/53/81/611225381.db2.gz	NPLGXJZAPQYCMX-SJLPKXTDSA-N	2	0	348.491	0.472	20	10		ECCDRP
COCCOC[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000905426116	586893827	/nfs/dbraw/zinc/89/38/27/586893827.db2.gz	DGNSZKWDYBVPOF-SFHVURJKSA-N	2	0	337.464	0.552	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[C@H]([NH3+])[C@@H]3C)CC2)cc1	ZINC000923367548	611234158	/nfs/dbraw/zinc/23/41/58/611234158.db2.gz	HHNCSRODBLJVBC-WDYCEAGBSA-N	2	0	348.491	0.600	20	10		ECCDRP
CNC(=O)C1([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)CCOCC1	ZINC000895883370	586210547	/nfs/dbraw/zinc/21/05/47/586210547.db2.gz	AIZNTUVVPFMVLR-UHFFFAOYSA-N	2	0	346.475	0.823	20	10		ECCDRP
COc1ccc(C[NH2+]CCC(=O)N2CCN(C)CC2)c(O)c1OC	ZINC000892926661	586301018	/nfs/dbraw/zinc/30/10/18/586301018.db2.gz	MRTIFUJWWVNFID-UHFFFAOYSA-N	2	0	337.420	0.663	20	10		ECCDRP
C[NH+]1CCN(C[C@H](O)C[NH2+]Cc2ccc(N3CCOCC3)cc2)CC1	ZINC000818973719	587463030	/nfs/dbraw/zinc/46/30/30/587463030.db2.gz	VZIMDFLEJNWDQS-LJQANCHMSA-N	2	0	348.491	0.221	20	10		ECCDRP
C[C@@H](CC[NH3+])NC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911293232	609840547	/nfs/dbraw/zinc/84/05/47/609840547.db2.gz	CPPYHCKRVHPDHG-BBRMVZONSA-N	2	0	349.479	0.325	20	10		ECCDRP
C[C@H]([NH3+])CN(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578195	609899372	/nfs/dbraw/zinc/89/93/72/609899372.db2.gz	KDHAGTSQFQQQQV-XJKSGUPXSA-N	2	0	349.479	0.277	20	10		ECCDRP
COC(=O)[C@]1(O)CC[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000895703713	586199718	/nfs/dbraw/zinc/19/97/18/586199718.db2.gz	NZYQZYIKGAVASU-SFHVURJKSA-N	2	0	333.432	0.548	20	10		ECCDRP
C[NH+]1CCN(C[C@H](O)C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1	ZINC000818953742	587462217	/nfs/dbraw/zinc/46/22/17/587462217.db2.gz	MJVHIVLSUBYZQS-LJQANCHMSA-N	2	0	332.492	0.985	20	10		ECCDRP
CC[NH+]1CCN(c2ccc(CNC(=O)COCC[NH3+])cc2F)CC1	ZINC000828877412	588207469	/nfs/dbraw/zinc/20/74/69/588207469.db2.gz	RUFICZGUPXJYRZ-UHFFFAOYSA-N	2	0	338.427	0.559	20	10		ECCDRP
COc1ccc(N(C)CC[N@H+](C)CCC(=O)N2CC[NH2+]CC2)cc1	ZINC000846225582	589191897	/nfs/dbraw/zinc/19/18/97/589191897.db2.gz	PJINHNXWYRRMSE-UHFFFAOYSA-N	2	0	334.464	0.885	20	10		ECCDRP
CC[NH2+]CCNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911282233	609845727	/nfs/dbraw/zinc/84/57/27/609845727.db2.gz	OXZJNKYKASKXIR-INIZCTEOSA-N	2	0	349.479	0.197	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CC[C@H]([NH3+])C2)[NH+](C)C)cc1	ZINC000911577346	609899443	/nfs/dbraw/zinc/89/94/43/609899443.db2.gz	CAVGHGUZEGLNAG-GOEBONIOSA-N	2	0	347.463	0.031	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CCC([NH3+])CC3)CC2)cc1	ZINC000923277114	611223433	/nfs/dbraw/zinc/22/34/33/611223433.db2.gz	JYDVIECWUUXAET-SFHVURJKSA-N	2	0	348.491	0.601	20	10		ECCDRP
COc1ccc(N2CCN(C[C@@H](O)C[N@@H+]3CC[C@H](C[NH3+])C3)CC2)cc1	ZINC000923280892	611224000	/nfs/dbraw/zinc/22/40/00/611224000.db2.gz	JROJAHXJJPBXNM-SJLPKXTDSA-N	2	0	348.491	0.459	20	10		ECCDRP
O=C(C[C@H]1COCC[NH2+]1)NCc1ccc(N2CC[NH2+]CC2)c(F)c1	ZINC000377163972	438303568	/nfs/dbraw/zinc/30/35/68/438303568.db2.gz	FALXOPPGDGMTCC-AWEZNQCLSA-N	2	0	336.411	0.230	20	10		ECCDRP
[NH3+]CCNC(=O)[C@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)cc2)C1	ZINC000843047925	589047742	/nfs/dbraw/zinc/04/77/42/589047742.db2.gz	BXBYGWKQGOQVKW-KRWDZBQOSA-N	2	0	346.475	0.810	20	10		ECCDRP
COC(=O)[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000843433638	589066923	/nfs/dbraw/zinc/06/69/23/589066923.db2.gz	BQAZSXZXTIFJDP-AEFFLSMTSA-N	2	0	347.459	0.794	20	10		ECCDRP
CN1CCCc2cc(C[NH2+]C[C@@H](O)CN3CC[NH+](C)CC3)ccc21	ZINC000818984525	587463310	/nfs/dbraw/zinc/46/33/10/587463310.db2.gz	ASANZSUUKSZVBV-GOSISDBHSA-N	2	0	332.492	0.767	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CN3CC([N@@H+]4CC[C@@H](O)C4)C3)cc2)CC1	ZINC000846067484	589183618	/nfs/dbraw/zinc/18/36/18/589183618.db2.gz	GITZVWIZLMMKAS-LJQANCHMSA-N	2	0	330.476	0.689	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@H]2[NH2+]CC23CCOCC3)cc1	ZINC000852826313	589515878	/nfs/dbraw/zinc/51/58/78/589515878.db2.gz	SSPMYBUQVFEBFY-JKSUJKDBSA-N	2	0	332.448	0.637	20	10		ECCDRP
CN(C)c1ccc([C@H](CNC(=O)C(=O)N2CC[C@H]([NH3+])C2)[NH+](C)C)cc1	ZINC000911577347	609899337	/nfs/dbraw/zinc/89/93/37/609899337.db2.gz	CAVGHGUZEGLNAG-HOCLYGCPSA-N	2	0	347.463	0.031	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)COC2CC[NH+](C)CC2)cc1	ZINC000911665540	609904462	/nfs/dbraw/zinc/90/44/62/609904462.db2.gz	DHWHMWGQESRISC-KRWDZBQOSA-N	2	0	334.464	0.979	20	10		ECCDRP
C[N@H+](CC(=O)N1CC[NH2+]CC1)Cc1ccc(N2CCOCC2)cc1	ZINC000843047422	589047889	/nfs/dbraw/zinc/04/78/89/589047889.db2.gz	UVOVQSYGCQBNIS-UHFFFAOYSA-N	2	0	332.448	0.387	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+][C@@H]3CCc4nnnn4CC3)cc2)CC1	ZINC000817419034	587341716	/nfs/dbraw/zinc/34/17/16/587341716.db2.gz	OKXMZDOQZAQQLC-MRXNPFEDSA-N	2	0	341.463	0.920	20	10		ECCDRP
COC(=O)[C@@H]1OCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000826967246	588092836	/nfs/dbraw/zinc/09/28/36/588092836.db2.gz	JSFKBTXPOUALJA-DLBZAZTESA-N	2	0	333.432	0.859	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@]3(OCCO)CCOC3)cc2)CC1	ZINC000850358671	589365101	/nfs/dbraw/zinc/36/51/01/589365101.db2.gz	UDVPKLSIWGAGSD-LJQANCHMSA-N	2	0	349.475	0.696	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)[C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000923288308	611225164	/nfs/dbraw/zinc/22/51/64/611225164.db2.gz	VIRYEGDKZPDYPG-MSOLQXFVSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)[C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000923288309	611225180	/nfs/dbraw/zinc/22/51/80/611225180.db2.gz	VIRYEGDKZPDYPG-QZTJIDSGSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CCN(C[C@@H](O)C[N@H+](C)CCC[NH3+])CC2)cc1	ZINC000923290757	611225491	/nfs/dbraw/zinc/22/54/91/611225491.db2.gz	KTTPHXPGBYMUJJ-KRWDZBQOSA-N	2	0	336.480	0.459	20	10		ECCDRP
CN(C)c1ccc([C@H](CN2C(=O)N[C@H](C[NH+](C)C)C2=O)[NH+](C)C)cc1	ZINC000900186314	586529864	/nfs/dbraw/zinc/52/98/64/586529864.db2.gz	XHXRAIYOMIPQEC-CVEARBPZSA-N	2	0	347.463	0.837	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+][C@H]3CCc4nnnn4CC3)cc2)CC1	ZINC000817419030	587341639	/nfs/dbraw/zinc/34/16/39/587341639.db2.gz	OKXMZDOQZAQQLC-INIZCTEOSA-N	2	0	341.463	0.920	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCN3CCC(O)CC3)cc2)CC1	ZINC000825110421	587917359	/nfs/dbraw/zinc/91/73/59/587917359.db2.gz	FQCYIJTWKVIWDJ-UHFFFAOYSA-N	2	0	332.492	0.985	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C2C[C@@H]3C[NH2+]C[C@H](C2)C3=O)cc1	ZINC000832274689	588477520	/nfs/dbraw/zinc/47/75/20/588477520.db2.gz	XIZFURHMGVTXGA-BTFYYFJDSA-N	2	0	344.459	0.683	20	10		ECCDRP
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC2([NH3+])CC2)[NH+](C)C)cc1	ZINC000911506231	609880727	/nfs/dbraw/zinc/88/07/27/609880727.db2.gz	JXHNOAWWJSHABH-HNNXBMFYSA-N	2	0	347.463	0.079	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)C3C[NH2+]C3)CC2)cc1	ZINC000923357361	611232613	/nfs/dbraw/zinc/23/26/13/611232613.db2.gz	YBJUFEUFRKYGPH-KRWDZBQOSA-N	2	0	334.464	0.082	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@H]([NH3+])[C@@H](C)C3)CC2)cc1	ZINC000923365573	611233822	/nfs/dbraw/zinc/23/38/22/611233822.db2.gz	GCJISRBWRBPVBL-IEZWGBDMSA-N	2	0	348.491	0.457	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNS(=O)(=O)[C@@H]2CCC[NH2+]C2)cc1	ZINC000923633116	611332928	/nfs/dbraw/zinc/33/29/28/611332928.db2.gz	DCUPHRWVUNEBQT-CABCVRRESA-N	2	0	326.466	0.424	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NCCOCCC[NH3+])cc2)CC1	ZINC000892289662	586243061	/nfs/dbraw/zinc/24/30/61/586243061.db2.gz	FWUXBFPCBMWBDO-UHFFFAOYSA-N	2	0	349.479	0.603	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCCN3CC[NH2+]CC3)cc2)CC1	ZINC000841029932	586350213	/nfs/dbraw/zinc/35/02/13/586350213.db2.gz	PCMYKTJKWXTATN-UHFFFAOYSA-N	3	0	331.508	0.823	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cn(CCC[NH3+])nn2)cc1	ZINC000832278498	588477557	/nfs/dbraw/zinc/47/75/57/588477557.db2.gz	DBTVLTZUCFUYQR-CQSZACIVSA-N	2	0	331.424	0.123	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@]3(OCCO)CCOC3)cc2)CC1	ZINC000850358669	589364823	/nfs/dbraw/zinc/36/48/23/589364823.db2.gz	UDVPKLSIWGAGSD-IBGZPJMESA-N	2	0	349.475	0.696	20	10		ECCDRP
C[NH+](C)C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@H]3O)C[C@H]1C[NH+](C)C	ZINC000872636075	590136060	/nfs/dbraw/zinc/13/60/60/590136060.db2.gz	HFXFUGUQDRGNCK-IIDMSEBBSA-N	2	0	349.475	0.989	20	10		ECCDRP
C[NH2+][C@H]1CCN(C[C@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000923277048	611223320	/nfs/dbraw/zinc/22/33/20/611223320.db2.gz	BFMPUYMJMIHUDV-FUHWJXTLSA-N	2	0	348.491	0.472	20	10		ECCDRP
O=C(NCc1ccc(N2CC[NH2+]CC2)c(F)c1)[C@@H]1C[C@@]12CC[NH2+]C2	ZINC000377391741	438308616	/nfs/dbraw/zinc/30/86/16/438308616.db2.gz	NGWWUEYCHKXLCM-KBXCAEBGSA-N	2	0	332.423	0.851	20	10		ECCDRP
C[C@H](O)C[NH+]1CCN(Cc2ccc(N3CC[NH+](C)CC3)cc2)CC1	ZINC000775675737	579269812	/nfs/dbraw/zinc/26/98/12/579269812.db2.gz	AQDYPCZAHLFFRP-KRWDZBQOSA-N	2	0	332.492	0.937	20	10		ECCDRP
C[C@@H]1CN(Cc2ccc(N3CC[NH+](C)CC3)cc2)CC[N@@H+]1CCO	ZINC000779213727	579314228	/nfs/dbraw/zinc/31/42/28/579314228.db2.gz	MWCHFYRMYGMOEK-QGZVFWFLSA-N	2	0	332.492	0.937	20	10		ECCDRP
CN(C)c1ccc([C@H](CN2C(=O)N[C@@H](C[NH+](C)C)C2=O)[NH+](C)C)cc1	ZINC000900186315	586529898	/nfs/dbraw/zinc/52/98/98/586529898.db2.gz	XHXRAIYOMIPQEC-HOTGVXAUSA-N	2	0	347.463	0.837	20	10		ECCDRP
CCS(=O)(=O)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000905425743	586893377	/nfs/dbraw/zinc/89/33/77/586893377.db2.gz	AKKNAHRJWNJNMD-UHFFFAOYSA-N	2	0	325.478	0.963	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cn(CCCC[NH3+])nn2)cc1	ZINC000832280206	588477642	/nfs/dbraw/zinc/47/76/42/588477642.db2.gz	NUSQLTOZHVCQSA-HNNXBMFYSA-N	2	0	345.451	0.513	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cn(CCC[NH3+])nn2)cc1	ZINC000832278497	588477677	/nfs/dbraw/zinc/47/76/77/588477677.db2.gz	DBTVLTZUCFUYQR-AWEZNQCLSA-N	2	0	331.424	0.123	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CN3CC[N@@H+]4C[C@H](O)C[C@H]4C3)cc2)CC1	ZINC000848926204	589315892	/nfs/dbraw/zinc/31/58/92/589315892.db2.gz	MZDFPVZGIKGVPE-RBUKOAKNSA-N	2	0	330.476	0.689	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cnn(CC[NH+](C)C)c2)cc1	ZINC000876506132	590383418	/nfs/dbraw/zinc/38/34/18/590383418.db2.gz	FUTKVXZJPLPDGF-QGZVFWFLSA-N	2	0	344.463	0.941	20	10		ECCDRP
C[N@@H+]1CC[C@@H]1CNC(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000924007530	611382127	/nfs/dbraw/zinc/38/21/27/611382127.db2.gz	NVSKNPHFGVJMSK-QGZVFWFLSA-N	2	0	331.464	0.942	20	10		ECCDRP
CCN(CC[NH3+])C[C@H](O)C[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000923400412	611237897	/nfs/dbraw/zinc/23/78/97/611237897.db2.gz	AKNIVQKFQBTURQ-KRWDZBQOSA-N	2	0	336.480	0.459	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@H]([NH3+])C[C@H]3C)CC2)cc1	ZINC000923411264	611240290	/nfs/dbraw/zinc/24/02/90/611240290.db2.gz	BMNXISMOEAULMQ-NUJGCVRESA-N	2	0	348.491	0.600	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2[nH]nc3c2C[NH2+]CC3)cc1	ZINC000841846682	589002748	/nfs/dbraw/zinc/00/27/48/589002748.db2.gz	RZKNISVGZNRVAN-CQSZACIVSA-N	2	0	328.420	0.551	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)Cn3cccn3)cc2)CC1	ZINC000905425666	586893767	/nfs/dbraw/zinc/89/37/67/586893767.db2.gz	ACAXPIGRHRWRED-SFHVURJKSA-N	2	0	329.448	0.786	20	10		ECCDRP
COc1ccc(N2CCN(C[C@H](O)C[NH2+]C[C@@H]3CCN3C)CC2)cc1	ZINC000905547414	586898741	/nfs/dbraw/zinc/89/87/41/586898741.db2.gz	WPCLXBDJMXDIEU-ZWKOTPCHSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[C@H](C[NH3+])CNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911292625	609840489	/nfs/dbraw/zinc/84/04/89/609840489.db2.gz	QVIQOWKMGXLWFC-CZUORRHYSA-N	2	0	349.479	0.183	20	10		ECCDRP
C[NH2+][C@H]1CCN(C[C@@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000923277050	611223244	/nfs/dbraw/zinc/22/32/44/611223244.db2.gz	BFMPUYMJMIHUDV-WMZOPIPTSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[NH2+][C@@H](C)C3)CC2)cc1	ZINC000923290704	611225433	/nfs/dbraw/zinc/22/54/33/611225433.db2.gz	NPLGXJZAPQYCMX-WMZOPIPTSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CCC[C@@H]3C[NH3+])CC2)cc1	ZINC000923292298	611225478	/nfs/dbraw/zinc/22/54/78/611225478.db2.gz	HIQCVEIIAUPEOE-MSOLQXFVSA-N	2	0	348.491	0.601	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)C[C@H](C)[NH3+])CC2)cc1	ZINC000923408932	611239914	/nfs/dbraw/zinc/23/99/14/611239914.db2.gz	KRFMTKLXVMVJHL-RDJZCZTQSA-N	2	0	336.480	0.457	20	10		ECCDRP
CN(C)c1ccc([C@H](CNC(=O)C(=O)NCC(C)(C)[NH3+])[NH+](C)C)cc1	ZINC000911294308	609840908	/nfs/dbraw/zinc/84/09/08/609840908.db2.gz	FCGJUSRQSCKJCB-HNNXBMFYSA-N	2	0	349.479	0.325	20	10		ECCDRP
CCN(CC[NH3+])C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578108	609899448	/nfs/dbraw/zinc/89/94/48/609899448.db2.gz	ICDQKULFWSFEHI-MRXNPFEDSA-N	2	0	349.479	0.279	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)[C@@H]3C[C@@H]3[NH3+])CC2)cc1	ZINC000844190640	589101434	/nfs/dbraw/zinc/10/14/34/589101434.db2.gz	DVHPNZSIXLSGGQ-SJORKVTESA-N	2	0	332.448	0.671	20	10		ECCDRP
C[C@H]1C[N@H+](CCO)CCN1Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000825336870	587933511	/nfs/dbraw/zinc/93/35/11/587933511.db2.gz	AEOQEVIGVQQKOB-KRWDZBQOSA-N	2	0	332.492	0.937	20	10		ECCDRP
C[NH+](C)C[C@@H]1CN(Cc2cc3c(cc2O)OC[C@@H]3O)C[C@H]1C[NH+](C)C	ZINC000872636076	590136284	/nfs/dbraw/zinc/13/62/84/590136284.db2.gz	HFXFUGUQDRGNCK-RKVPGOIHSA-N	2	0	349.475	0.989	20	10		ECCDRP
C[NH2+][C@@H]1CCN(C[C@@H](O)C[NH+]2CCN(c3ccc(OC)cc3)CC2)C1	ZINC000923277047	611223314	/nfs/dbraw/zinc/22/33/14/611223314.db2.gz	BFMPUYMJMIHUDV-AEFFLSMTSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N3C[C@@H]4C[C@H]3C[NH2+]4)cc2)CC1	ZINC000892939413	586302316	/nfs/dbraw/zinc/30/23/16/586302316.db2.gz	KAWOSEJWCVPORL-RDJZCZTQSA-N	2	0	329.448	0.694	20	10		ECCDRP
Cn1nnnc1CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000898040320	586394613	/nfs/dbraw/zinc/39/46/13/586394613.db2.gz	RSYMVHHVHBOMCL-UHFFFAOYSA-N	2	0	329.452	0.684	20	10		ECCDRP
COc1ccc(N2CCN(C[C@@H](O)C[NH2+]C[C@H]3CCN3C)CC2)cc1	ZINC000905547411	586898907	/nfs/dbraw/zinc/89/89/07/586898907.db2.gz	WPCLXBDJMXDIEU-MSOLQXFVSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@@H](C)[C@@H]([NH3+])C3)CC2)cc1	ZINC000923365569	611233756	/nfs/dbraw/zinc/23/37/56/611233756.db2.gz	GCJISRBWRBPVBL-AYBZRNKSSA-N	2	0	348.491	0.457	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCCNS(C)(=O)=O)cc2)CC1	ZINC000771822539	579196179	/nfs/dbraw/zinc/19/61/79/579196179.db2.gz	GJMDXSDKZNWLLH-UHFFFAOYSA-N	2	0	340.493	0.467	20	10		ECCDRP
C[NH2+]CCNC(=O)NCCC[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000841665129	588996935	/nfs/dbraw/zinc/99/69/35/588996935.db2.gz	ILMZDEHKEIHLBT-UHFFFAOYSA-N	2	0	349.479	0.726	20	10		ECCDRP
CN(C)c1ccc([C@@H](CN2C(=O)N[C@H](C[NH+](C)C)C2=O)[NH+](C)C)cc1	ZINC000900186316	586530051	/nfs/dbraw/zinc/53/00/51/586530051.db2.gz	XHXRAIYOMIPQEC-HZPDHXFCSA-N	2	0	347.463	0.837	20	10		ECCDRP
CN1CCCc2cc(C[NH2+]C[C@H](O)CN3CC[NH+](C)CC3)ccc21	ZINC000818984526	587463421	/nfs/dbraw/zinc/46/34/21/587463421.db2.gz	ASANZSUUKSZVBV-SFHVURJKSA-N	2	0	332.492	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)[C@H]3CC[NH2+]3)CC2)cc1	ZINC000844191357	589101810	/nfs/dbraw/zinc/10/18/10/589101810.db2.gz	MWOONWLLFRZCFF-QGZVFWFLSA-N	2	0	332.448	0.685	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)[C@@H]2[NH2+]CC23CCOCC3)cc1	ZINC000852826311	589515597	/nfs/dbraw/zinc/51/55/97/589515597.db2.gz	SSPMYBUQVFEBFY-HOTGVXAUSA-N	2	0	332.448	0.637	20	10		ECCDRP
C[C@@H](C[NH3+])CNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911292623	609840460	/nfs/dbraw/zinc/84/04/60/609840460.db2.gz	QVIQOWKMGXLWFC-BBRMVZONSA-N	2	0	349.479	0.183	20	10		ECCDRP
O=C([C@@H]1CCC[N@@H+](Cc2cc3c(cc2O)OCO3)C1)N1CC[NH2+]CC1	ZINC000843047537	589047778	/nfs/dbraw/zinc/04/77/78/589047778.db2.gz	VIRDCBUCWQRLAU-CYBMUJFWSA-N	2	0	347.415	0.765	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2c[nH]nc2[C@H]2CC[NH2+]C2)cc1	ZINC000852792686	589512097	/nfs/dbraw/zinc/51/20/97/589512097.db2.gz	ZQZNFJRFFNOZAL-BBRMVZONSA-N	2	0	342.447	0.982	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN(C)[C@H]3CC[NH2+]C3)CC2)cc1	ZINC000923288310	611225019	/nfs/dbraw/zinc/22/50/19/611225019.db2.gz	VIRYEGDKZPDYPG-ROUUACIJSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[NH2+]CC3)CC2)cc1	ZINC000325164265	756959963	/nfs/dbraw/zinc/95/99/63/756959963.db2.gz	JIVWTVXGGAKTQW-KRWDZBQOSA-N	2	0	334.464	0.083	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@@H]3C[NH2+]CCO3)cc2)CC1	ZINC000892190243	586228904	/nfs/dbraw/zinc/22/89/04/586228904.db2.gz	XAMKKALXFINHFH-KRWDZBQOSA-N	2	0	347.463	0.226	20	10		ECCDRP
CN(C)S(=O)(=O)CC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000810181871	587191397	/nfs/dbraw/zinc/19/13/97/587191397.db2.gz	VWWHSMYMVCTALE-UHFFFAOYSA-N	2	0	340.493	0.419	20	10		ECCDRP
C[NH2+]CCCNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911270215	609834704	/nfs/dbraw/zinc/83/47/04/609834704.db2.gz	JFONUPMATZPYNP-MRXNPFEDSA-N	2	0	349.479	0.197	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[NH2+]C[C@@H]3C)CC2)cc1	ZINC000923279792	611224333	/nfs/dbraw/zinc/22/43/33/611224333.db2.gz	DAXNQGKOBGOGHK-FUHWJXTLSA-N	2	0	348.491	0.472	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNS(=O)(=O)[C@H]2CCC[NH2+]C2)cc1	ZINC000923633118	611332902	/nfs/dbraw/zinc/33/29/02/611332902.db2.gz	DCUPHRWVUNEBQT-GJZGRUSLSA-N	2	0	326.466	0.424	20	10		ECCDRP
CO[C@@H]1C[NH2+][C@@H](C(=O)NCc2ccc(N3CC[NH2+]CC3)c(F)c2)C1	ZINC000365159146	437867731	/nfs/dbraw/zinc/86/77/31/437867731.db2.gz	XLEZWSGBZTUWIS-DZGCQCFKSA-N	2	0	336.411	0.228	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CC(=O)NCC(F)F)cc2)CC1	ZINC000795596368	578615520	/nfs/dbraw/zinc/61/55/20/578615520.db2.gz	GEOYMTMUJLEXGW-UHFFFAOYSA-N	2	0	326.391	0.909	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)N(C)CC[NH3+])CC2)cc1	ZINC000841665562	588996986	/nfs/dbraw/zinc/99/69/86/588996986.db2.gz	OQYBCSKRFYOESO-UHFFFAOYSA-N	2	0	349.479	0.807	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)NCC[NH3+])CC2)cc1	ZINC000841665474	588997121	/nfs/dbraw/zinc/99/71/21/588997121.db2.gz	MQGTUEFERSQRAS-UHFFFAOYSA-N	2	0	335.452	0.465	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC3CC[NH2+]CC3)cc2)CC1	ZINC000891962391	586209289	/nfs/dbraw/zinc/20/92/89/586209289.db2.gz	RNADPLYJCAKMOC-UHFFFAOYSA-N	2	0	331.464	0.990	20	10		ECCDRP
CCOC(=O)[C@@H]1NCC[C@@H]1[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000925764465	611499164	/nfs/dbraw/zinc/49/91/64/611499164.db2.gz	ZCHOXRDEUSNXRE-ZWKOTPCHSA-N	2	0	346.475	0.822	20	10		ECCDRP
C[NH+](C)C[C@H]1NC(=O)N(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1=O	ZINC000925079578	608736975	/nfs/dbraw/zinc/73/69/75/608736975.db2.gz	LGBHAGRXIRGDPY-MRXNPFEDSA-N	2	0	345.447	0.420	20	10		ECCDRP
CC[NH2+]CCNC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911282234	609845721	/nfs/dbraw/zinc/84/57/21/609845721.db2.gz	OXZJNKYKASKXIR-MRXNPFEDSA-N	2	0	349.479	0.197	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CC3(O)CC[NH+](C)CC3)cc2)CC1	ZINC000771843656	579196707	/nfs/dbraw/zinc/19/67/07/579196707.db2.gz	UMLNTXPXISBGRK-UHFFFAOYSA-N	3	0	332.492	0.985	20	10		ECCDRP
CN1C(=O)CC[C@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1=O	ZINC000818233702	587415348	/nfs/dbraw/zinc/41/53/48/587415348.db2.gz	MQBFLLVBYSHPJM-INIZCTEOSA-N	2	0	330.432	0.675	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNC(=O)C(=O)N2CC[C@@H]([NH3+])C2)[NH+](C)C)cc1	ZINC000911577345	609899114	/nfs/dbraw/zinc/89/91/14/609899114.db2.gz	CAVGHGUZEGLNAG-GDBMZVCRSA-N	2	0	347.463	0.031	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)C2=NO[C@]3(C2)CCC[NH2+]C3)cc1	ZINC000911668549	609905009	/nfs/dbraw/zinc/90/50/09/609905009.db2.gz	ZMBHWUHRRMRTOY-YJBOKZPZSA-N	2	0	345.447	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CC[NH2+][C@@H](C)C3)CC2)cc1	ZINC000923290695	611225539	/nfs/dbraw/zinc/22/55/39/611225539.db2.gz	NPLGXJZAPQYCMX-FUHWJXTLSA-N	2	0	348.491	0.472	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@@H](C)[C@H]([NH3+])C3)CC2)cc1	ZINC000923365571	611233800	/nfs/dbraw/zinc/23/38/00/611233800.db2.gz	GCJISRBWRBPVBL-HHXXYDBFSA-N	2	0	348.491	0.457	20	10		ECCDRP
CCN(CC[NH3+])C[C@@H](O)C[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000923400414	611237841	/nfs/dbraw/zinc/23/78/41/611237841.db2.gz	AKNIVQKFQBTURQ-QGZVFWFLSA-N	2	0	336.480	0.459	20	10		ECCDRP
COCC1(C(=O)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC[NH2+]CC1	ZINC000832272653	588477284	/nfs/dbraw/zinc/47/72/84/588477284.db2.gz	IDERRABSQBMURJ-MRXNPFEDSA-N	2	0	334.464	0.885	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2c[nH]nc2[C@@H]2CC[NH2+]C2)cc1	ZINC000852792690	589512138	/nfs/dbraw/zinc/51/21/38/589512138.db2.gz	ZQZNFJRFFNOZAL-CZUORRHYSA-N	2	0	342.447	0.982	20	10		ECCDRP
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C1	ZINC000872255277	590108442	/nfs/dbraw/zinc/10/84/42/590108442.db2.gz	UHIVBNRQXQIXAO-HSMVNMDESA-N	2	0	347.371	0.488	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)C[C@]3(O)CCOC3)cc2)CC1	ZINC000905427849	586893447	/nfs/dbraw/zinc/89/34/47/586893447.db2.gz	OGPBVIDVEOECCH-RBUKOAKNSA-N	2	0	349.475	0.430	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)C3(O)CCOCC3)cc2)CC1	ZINC000905426775	586893793	/nfs/dbraw/zinc/89/37/93/586893793.db2.gz	JZWNBOLNALBYPU-GOSISDBHSA-N	2	0	349.475	0.430	20	10		ECCDRP
COc1cccc(O)c1C[N@@H+]1CC[C@H](N2C(=O)O[C@H]3C[NH2+]C[C@H]32)C1	ZINC000872255215	590108254	/nfs/dbraw/zinc/10/82/54/590108254.db2.gz	RLCNIGSSEIFLCF-GHJWDPDVSA-N	2	0	333.388	0.768	20	10		ECCDRP
C[C@@H](C[NH3+])N(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911581011	609899905	/nfs/dbraw/zinc/89/99/05/609899905.db2.gz	YASZMEOXUGTKRC-XJKSGUPXSA-N	2	0	349.479	0.277	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)C3C[NH+](C)C3)CC2)cc1	ZINC001142600544	755807818	/nfs/dbraw/zinc/80/78/18/755807818.db2.gz	ZWZYMDZTEVDMJL-UHFFFAOYSA-N	2	0	346.475	0.885	20	10		ECCDRP
Cn1nccc1[C@@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000922973009	611189117	/nfs/dbraw/zinc/18/91/17/611189117.db2.gz	DUBMNQGGNGIFJZ-SFHVURJKSA-N	2	0	329.448	0.995	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)C3C[NH2+]C3)CC2)cc1	ZINC000923357363	611232733	/nfs/dbraw/zinc/23/27/33/611232733.db2.gz	YBJUFEUFRKYGPH-QGZVFWFLSA-N	2	0	334.464	0.082	20	10		ECCDRP
C[NH2+]CCC(=O)NCCC[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000286166732	437089127	/nfs/dbraw/zinc/08/91/27/437089127.db2.gz	QPXWXBNHPJPPTM-UHFFFAOYSA-N	2	0	334.464	0.933	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@@H](O)Cn3cccn3)cc2)CC1	ZINC000905425665	586893035	/nfs/dbraw/zinc/89/30/35/586893035.db2.gz	ACAXPIGRHRWRED-GOSISDBHSA-N	2	0	329.448	0.786	20	10		ECCDRP
C[NH+]1CCN(C[C@@H](O)C[NH2+]Cc2ccc(N3CC=CC3)cc2)CC1	ZINC000819094820	587468275	/nfs/dbraw/zinc/46/82/75/587468275.db2.gz	NGTLOHGSZBSOMC-IBGZPJMESA-N	2	0	330.476	0.761	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)CCNC(=O)[C@H]2CCC[NH2+]2)cc1	ZINC000832274635	588477572	/nfs/dbraw/zinc/47/75/72/588477572.db2.gz	WIOIBJMQACZWGO-HZPDHXFCSA-N	2	0	347.463	0.127	20	10		ECCDRP
O=C(NCc1ccc(N2CC[NH2+]CC2)c(F)c1)[C@@H]1C[C@]12CC[NH2+]C2	ZINC000377391743	254757742	/nfs/dbraw/zinc/75/77/42/254757742.db2.gz	NGWWUEYCHKXLCM-KSSFIOAISA-N	2	0	332.423	0.851	20	10		ECCDRP
C[NH+](C)CCCN(CCC[NH+](C)C)C(=O)C(=O)Nc1ccc(N)cc1	ZINC000841009381	588976149	/nfs/dbraw/zinc/97/61/49/588976149.db2.gz	BMCMKEXXKMNGOV-UHFFFAOYSA-N	2	0	349.479	0.939	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N3CC[C@@H]4C[NH2+]C[C@@H]43)cc2)CC1	ZINC000892939088	586301892	/nfs/dbraw/zinc/30/18/92/586301892.db2.gz	GOQJURGUVOACJB-AEFFLSMTSA-N	2	0	343.475	0.942	20	10		ECCDRP
CN1CCN(C)[C@H](C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1	ZINC000877031095	590434862	/nfs/dbraw/zinc/43/48/62/590434862.db2.gz	MIXOONAVSLXGND-GOSISDBHSA-N	2	0	332.492	0.983	20	10		ECCDRP
C[C@H](C[NH3+])N(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911581010	609899892	/nfs/dbraw/zinc/89/98/92/609899892.db2.gz	YASZMEOXUGTKRC-CZUORRHYSA-N	2	0	349.479	0.277	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3C[C@@H]([NH3+])C3)cc2)CC1	ZINC000892543777	586272884	/nfs/dbraw/zinc/27/28/84/586272884.db2.gz	BVYHLAVSVRCWDW-IYBDPMFKSA-N	2	0	331.464	0.975	20	10		ECCDRP
COc1cc(O)c(C[N@@H+]2CCC[C@H](C(=O)NCC[NH3+])C2)cc1OC	ZINC000843048094	589047844	/nfs/dbraw/zinc/04/78/44/589047844.db2.gz	MSACJGSWVDYNLQ-LBPRGKRZSA-N	2	0	337.420	0.696	20	10		ECCDRP
CN(C)c1ccc([C@@H](CN2C(=O)N[C@@H](C[NH+](C)C)C2=O)[NH+](C)C)cc1	ZINC000900186317	586529951	/nfs/dbraw/zinc/52/99/51/586529951.db2.gz	XHXRAIYOMIPQEC-JKSUJKDBSA-N	2	0	347.463	0.837	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]C[C@H](O)C[C@@]3(O)CCOC3)cc2)CC1	ZINC000905427847	586893644	/nfs/dbraw/zinc/89/36/44/586893644.db2.gz	OGPBVIDVEOECCH-MOPGFXCFSA-N	2	0	349.475	0.430	20	10		ECCDRP
CNS(=O)(=O)CCC[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000865706271	590154836	/nfs/dbraw/zinc/15/48/36/590154836.db2.gz	RAKZPJVNQCDRNL-UHFFFAOYSA-N	2	0	340.493	0.467	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NCC[NH+]3CCC3)cc2)CC1	ZINC000889667053	591070151	/nfs/dbraw/zinc/07/01/51/591070151.db2.gz	YBVWGFSKWUJMHT-UHFFFAOYSA-N	2	0	331.464	0.943	20	10		ECCDRP
CN(C)c1ccc([C@@H]([NH3+])CNC(=O)c2cc([C@@H]3CC[NH2+]C3)n[nH]2)cc1	ZINC000841847123	589002501	/nfs/dbraw/zinc/00/25/01/589002501.db2.gz	ZXEMXYHQAVEWRD-HIFRSBDPSA-N	2	0	342.447	0.982	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3C[NH2+]CCO3)cc2)CC1	ZINC000892190244	586228808	/nfs/dbraw/zinc/22/88/08/586228808.db2.gz	XAMKKALXFINHFH-QGZVFWFLSA-N	2	0	347.463	0.226	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]3C[C@H]([NH3+])C3)cc2)CC1	ZINC000892564681	586273798	/nfs/dbraw/zinc/27/37/98/586273798.db2.gz	BVYHLAVSVRCWDW-WKILWMFISA-N	2	0	331.464	0.975	20	10		ECCDRP
CC[NH+]1CCN(CC(=O)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC1	ZINC000844162996	589097103	/nfs/dbraw/zinc/09/71/03/589097103.db2.gz	QVOLACWYRGFORV-QGZVFWFLSA-N	2	0	333.480	0.506	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)[C@H]2[NH2+]CC23CCOCC3)cc1	ZINC000852826312	589515718	/nfs/dbraw/zinc/51/57/18/589515718.db2.gz	SSPMYBUQVFEBFY-HZPDHXFCSA-N	2	0	332.448	0.637	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)C2=NO[C@@]3(C2)CCC[NH2+]C3)cc1	ZINC000911668546	609904812	/nfs/dbraw/zinc/90/48/12/609904812.db2.gz	ZMBHWUHRRMRTOY-CRAIPNDOSA-N	2	0	345.447	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CNCC3([NH3+])CCC3)CC2)cc1	ZINC000923330346	611229051	/nfs/dbraw/zinc/22/90/51/611229051.db2.gz	CPOJQGRGPUQKOU-QGZVFWFLSA-N	2	0	348.491	0.649	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)N[C@@H](C[NH3+])C3CC3)cc2)CC1	ZINC000892025915	586216377	/nfs/dbraw/zinc/21/63/77/586216377.db2.gz	BAASWWJDPNXTJR-KRWDZBQOSA-N	2	0	331.464	0.975	20	10		ECCDRP
CN(CCOCC[NH3+])C(=O)NCc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000892940599	586302168	/nfs/dbraw/zinc/30/21/68/586302168.db2.gz	YWNVABBDCJPNSI-UHFFFAOYSA-N	2	0	349.479	0.555	20	10		ECCDRP
[NH3+]CCC(=O)NC[C@@H]1CCCC[N@@H+]1Cc1cc2c(cc1O)OCO2	ZINC000843122829	589051809	/nfs/dbraw/zinc/05/18/09/589051809.db2.gz	VNQHJYBXHGSQQA-ZDUSSCGKSA-N	2	0	335.404	0.940	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH+]3CCN([C@H]4CC[NH2+]C4)CC3)cc2)CC1	ZINC000843124451	589051931	/nfs/dbraw/zinc/05/19/31/589051931.db2.gz	AZKIHGKMAQXKJO-FQEVSTJZSA-N	3	0	343.519	0.918	20	10		ECCDRP
COC(=O)[C@H]1C[C@H](O)C[N@H+](Cc2ccc(N3CC[NH+](C)CC3)cc2)C1	ZINC000843433641	589066647	/nfs/dbraw/zinc/06/66/47/589066647.db2.gz	BQAZSXZXTIFJDP-WMZOPIPTSA-N	2	0	347.459	0.794	20	10		ECCDRP
CC[NH2+]CC(=O)NCCC[NH+]1CCN(c2ccc(OC)cc2)CC1	ZINC000844190999	589101863	/nfs/dbraw/zinc/10/18/63/589101863.db2.gz	ISUCWGQFKXTQEP-UHFFFAOYSA-N	2	0	334.464	0.933	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)C2C[C@@H]3C[NH2+]C[C@H](C2)C3=O)cc1	ZINC000832274691	588477554	/nfs/dbraw/zinc/47/75/54/588477554.db2.gz	XIZFURHMGVTXGA-UCMJJCQDSA-N	2	0	344.459	0.683	20	10		ECCDRP
C[C@H](CS(C)(=O)=O)[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000883289555	590611026	/nfs/dbraw/zinc/61/10/26/590611026.db2.gz	SFXXONNOTGUDPZ-CQSZACIVSA-N	2	0	325.478	0.961	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCC2([NH3+])CC2)[NH+](C)C)cc1	ZINC000911506233	609880782	/nfs/dbraw/zinc/88/07/82/609880782.db2.gz	JXHNOAWWJSHABH-OAHLLOKOSA-N	2	0	347.463	0.079	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CN3CCC[C@H]3C[NH3+])CC2)cc1	ZINC000923292301	611225555	/nfs/dbraw/zinc/22/55/55/611225555.db2.gz	HIQCVEIIAUPEOE-ZWKOTPCHSA-N	2	0	348.491	0.601	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)[C@H](C)C[NH3+])CC2)cc1	ZINC000286110591	437089025	/nfs/dbraw/zinc/08/90/25/437089025.db2.gz	OBZVFDRKUMIVAS-OAHLLOKOSA-N	2	0	334.464	0.918	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)CCNC(=O)[C@@H]2CCC[NH2+]2)cc1	ZINC000832274632	588477640	/nfs/dbraw/zinc/47/76/40/588477640.db2.gz	WIOIBJMQACZWGO-CVEARBPZSA-N	2	0	347.463	0.127	20	10		ECCDRP
C[C@H](C[NH3+])CNC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911292624	609840524	/nfs/dbraw/zinc/84/05/24/609840524.db2.gz	QVIQOWKMGXLWFC-CJNGLKHVSA-N	2	0	349.479	0.183	20	10		ECCDRP
C[C@@H]([NH3+])CN(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911578193	609899592	/nfs/dbraw/zinc/89/95/92/609899592.db2.gz	KDHAGTSQFQQQQV-CJNGLKHVSA-N	2	0	349.479	0.277	20	10		ECCDRP
COc1ccc(N2CCN(C[C@H](O)C[N@H+](C)CCC[NH3+])CC2)cc1	ZINC000923290759	611225393	/nfs/dbraw/zinc/22/53/93/611225393.db2.gz	KTTPHXPGBYMUJJ-QGZVFWFLSA-N	2	0	336.480	0.459	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)[C@@H](C)C[NH3+])CC2)cc1	ZINC000286110586	437087616	/nfs/dbraw/zinc/08/76/16/437087616.db2.gz	OBZVFDRKUMIVAS-HNNXBMFYSA-N	2	0	334.464	0.918	20	10		ECCDRP
CN(C)c1ccc(CNC(=O)C[N@@H+]2CC[C@H](N3CC[NH2+]CC3)C2)cc1	ZINC000844225810	589103969	/nfs/dbraw/zinc/10/39/69/589103969.db2.gz	VNPVSWRABYHDIJ-SFHVURJKSA-N	2	0	345.491	0.348	20	10		ECCDRP
COc1cccc(C[N@@H+]2CC[C@@H](N3C(=O)O[C@H]4C[NH2+]C[C@H]43)C2)c1O	ZINC000872255239	590108405	/nfs/dbraw/zinc/10/84/05/590108405.db2.gz	SATASOJTSZBFRK-NFAWXSAZSA-N	2	0	333.388	0.768	20	10		ECCDRP
C[C@@H](CC[NH3+])NC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911293236	609840424	/nfs/dbraw/zinc/84/04/24/609840424.db2.gz	CPPYHCKRVHPDHG-XJKSGUPXSA-N	2	0	349.479	0.325	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)C2=NO[C@]3(C2)CCC[NH2+]C3)cc1	ZINC000911668548	609904880	/nfs/dbraw/zinc/90/48/80/609904880.db2.gz	ZMBHWUHRRMRTOY-QAPCUYQASA-N	2	0	345.447	0.767	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)NCCC[NH3+])CC2)cc1	ZINC000841664865	588996924	/nfs/dbraw/zinc/99/69/24/588996924.db2.gz	DQTCLKQFCQBZTA-UHFFFAOYSA-N	2	0	349.479	0.855	20	10		ECCDRP
C[C@H](CC[NH3+])NC(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911293234	609840487	/nfs/dbraw/zinc/84/04/87/609840487.db2.gz	CPPYHCKRVHPDHG-CJNGLKHVSA-N	2	0	349.479	0.325	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[NH2+]CCC3CS(=O)(=O)C3)cc2)CC1	ZINC000786825694	578794822	/nfs/dbraw/zinc/79/48/22/578794822.db2.gz	YXELYKALHAFENP-UHFFFAOYSA-N	2	0	337.489	0.963	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNS(=O)(=O)C2C[NH2+]C2)[NH+](C)C)cc1	ZINC000903598741	586794402	/nfs/dbraw/zinc/79/44/02/586794402.db2.gz	PVFPVWPJOXEZED-OAHLLOKOSA-N	2	0	326.466	0.247	20	10		ECCDRP
COCCOC[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000905426115	586893349	/nfs/dbraw/zinc/89/33/49/586893349.db2.gz	DGNSZKWDYBVPOF-GOSISDBHSA-N	2	0	337.464	0.552	20	10		ECCDRP
C[NH+](C)C[C@@H]1CN(C(=O)C(=O)Nc2ccc(N)cc2)C[C@H]1C[NH+](C)C	ZINC000868263442	589886824	/nfs/dbraw/zinc/88/68/24/589886824.db2.gz	OHWDUIFJJVFPND-ZIAGYGMSSA-N	2	0	347.463	0.405	20	10		ECCDRP
CN1CCN(C)[C@@H](C[NH2+]Cc2ccc(N3CCC(O)CC3)cc2)C1	ZINC000877031096	590435244	/nfs/dbraw/zinc/43/52/44/590435244.db2.gz	MIXOONAVSLXGND-SFHVURJKSA-N	2	0	332.492	0.983	20	10		ECCDRP
C[C@H](CC[NH3+])NC(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911293235	609840549	/nfs/dbraw/zinc/84/05/49/609840549.db2.gz	CPPYHCKRVHPDHG-CZUORRHYSA-N	2	0	349.479	0.325	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)C3CC([NH3+])C3)CC2)cc1	ZINC000923363317	611233731	/nfs/dbraw/zinc/23/37/31/611233731.db2.gz	RRYYMXAZEAATCU-VMWRSERWSA-N	2	0	348.491	0.600	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN(C)C[C@@H](C)[NH3+])CC2)cc1	ZINC000923408931	611239895	/nfs/dbraw/zinc/23/98/95/611239895.db2.gz	KRFMTKLXVMVJHL-NVXWUHKLSA-N	2	0	336.480	0.457	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3C[C@@H]4C[C@H]3C[NH2+]4)CC2)cc1	ZINC000923409618	611239905	/nfs/dbraw/zinc/23/99/05/611239905.db2.gz	CASOKQYVIQNPTI-SZMVWBNQSA-N	2	0	346.475	0.224	20	10		ECCDRP
C[N@@H+]1CCC[C@@H]1C(=O)N1CCN(Cc2cc3c(cc2O)OCO3)CC1	ZINC000271195110	436679312	/nfs/dbraw/zinc/67/93/12/436679312.db2.gz	SEDWCGPDIRQQES-CQSZACIVSA-N	2	0	347.415	0.859	20	10		ECCDRP
C[NH+]1CCN(c2ccc(CNC(=O)NC[C@H]([NH3+])C3CC3)cc2)CC1	ZINC000892051421	586218118	/nfs/dbraw/zinc/21/81/18/586218118.db2.gz	RWTFXKVFWSJHKR-KRWDZBQOSA-N	2	0	331.464	0.975	20	10		ECCDRP
[NH3+]CCNC(=O)[C@@H]1CCC[N@H+](Cc2ccc(N3CCOCC3)cc2)C1	ZINC000843047926	589047748	/nfs/dbraw/zinc/04/77/48/589047748.db2.gz	BXBYGWKQGOQVKW-QGZVFWFLSA-N	2	0	346.475	0.810	20	10		ECCDRP
COc1ccc(N2CCN(C[C@@H](O)C[NH2+]C[C@@H]3CCN3C)CC2)cc1	ZINC000905547413	586898875	/nfs/dbraw/zinc/89/88/75/586898875.db2.gz	WPCLXBDJMXDIEU-ROUUACIJSA-N	2	0	348.491	0.472	20	10		ECCDRP
C[NH2+]CCN(C)C(=O)C(=O)NC[C@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911577379	609899551	/nfs/dbraw/zinc/89/95/51/609899551.db2.gz	CMXYVIQOEHBFAW-MRXNPFEDSA-N	2	0	349.479	0.149	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNC(=O)C(=O)N(C)CCC[NH3+])[NH+](C)C)cc1	ZINC000911581007	609899953	/nfs/dbraw/zinc/89/99/53/609899953.db2.gz	XZVDNVGUNVFFPZ-MRXNPFEDSA-N	2	0	349.479	0.279	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)C3([NH3+])CC3)CC2)cc1	ZINC000269260068	437475705	/nfs/dbraw/zinc/47/57/05/437475705.db2.gz	METBBJFFEZARDK-UHFFFAOYSA-N	2	0	332.448	0.815	20	10		ECCDRP
COc1ccc(N2CC[NH+](CCCNC(=O)N[C@@H](C)C[NH3+])CC2)cc1	ZINC000841666530	588996912	/nfs/dbraw/zinc/99/69/12/588996912.db2.gz	XQQZVILWYNFKIP-HNNXBMFYSA-N	2	0	349.479	0.854	20	10		ECCDRP
CN1C(=O)CC[C@@H]([NH2+]Cc2ccc(N3CC[NH+](C)CC3)cc2)C1=O	ZINC000818233703	587415873	/nfs/dbraw/zinc/41/58/73/587415873.db2.gz	MQBFLLVBYSHPJM-MRXNPFEDSA-N	2	0	330.432	0.675	20	10		ECCDRP
C[NH+]1CCN(c2ccc(C[N@@H+]3C[C@@H]4C(=O)NC(=O)[C@@H]4C3)cc2)CC1	ZINC000824893600	587901464	/nfs/dbraw/zinc/90/14/64/587901464.db2.gz	WNHQIZKJTRBSOG-IYBDPMFKSA-N	2	0	328.416	0.143	20	10		ECCDRP
CN(C)c1ccc([C@H]([NH3+])CNC(=O)c2cn(CCCC[NH3+])nn2)cc1	ZINC000832280208	588477692	/nfs/dbraw/zinc/47/76/92/588477692.db2.gz	NUSQLTOZHVCQSA-OAHLLOKOSA-N	2	0	345.451	0.513	20	10		ECCDRP
O=C1O[C@H]2C[NH2+]C[C@H]2N1[C@H]1CC[N@@H+](Cc2cc3c(cc2O)OCO3)C1	ZINC000872255278	590108667	/nfs/dbraw/zinc/10/86/67/590108667.db2.gz	UHIVBNRQXQIXAO-OZVIIMIRSA-N	2	0	347.371	0.488	20	10		ECCDRP
CN1CCOC[C@]1(CO)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000922534071	611353778	/nfs/dbraw/zinc/35/37/78/611353778.db2.gz	ULPSUIRWABKKTG-LJQANCHMSA-N	2	0	348.491	0.221	20	10		ECCDRP
C[NH2+]CCN(C)C(=O)C(=O)NC[C@@H](c1ccc(N(C)C)cc1)[NH+](C)C	ZINC000911577378	609899300	/nfs/dbraw/zinc/89/93/00/609899300.db2.gz	CMXYVIQOEHBFAW-INIZCTEOSA-N	2	0	349.479	0.149	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@H](O)CN3CC[NH2+]C[C@@H]3C)CC2)cc1	ZINC000923279796	611224031	/nfs/dbraw/zinc/22/40/31/611224031.db2.gz	DAXNQGKOBGOGHK-WMZOPIPTSA-N	2	0	348.491	0.472	20	10		ECCDRP
CC[NH+]1CCN(CCC(=O)NC[C@@H]([NH3+])c2ccc(N(C)C)cc2)CC1	ZINC000844163319	589097077	/nfs/dbraw/zinc/09/70/77/589097077.db2.gz	YTVMGFBZYWZIKE-GOSISDBHSA-N	2	0	347.507	0.896	20	10		ECCDRP
C[NH+]1CCN(C[C@@H](O)C[NH2+]Cc2ccc(N3CCCC3)cc2)CC1	ZINC000818953741	587462349	/nfs/dbraw/zinc/46/23/49/587462349.db2.gz	MJVHIVLSUBYZQS-IBGZPJMESA-N	2	0	332.492	0.985	20	10		ECCDRP
C[NH+](C)C[C@@H]1NC(=O)N(Cc2ccc(N3CC[NH+](C)CC3)cc2)C1=O	ZINC000925079577	608737004	/nfs/dbraw/zinc/73/70/04/608737004.db2.gz	LGBHAGRXIRGDPY-INIZCTEOSA-N	2	0	345.447	0.420	20	10		ECCDRP
CN(C)c1ccc([C@@H](CNC(=O)C(=O)NCC(C)(C)[NH3+])[NH+](C)C)cc1	ZINC000911294309	609840902	/nfs/dbraw/zinc/84/09/02/609840902.db2.gz	FCGJUSRQSCKJCB-OAHLLOKOSA-N	2	0	349.479	0.325	20	10		ECCDRP
Cn1nccc1[C@H](O)C[NH2+]Cc1ccc(N2CC[NH+](C)CC2)cc1	ZINC000922973008	611189141	/nfs/dbraw/zinc/18/91/41/611189141.db2.gz	DUBMNQGGNGIFJZ-GOSISDBHSA-N	2	0	329.448	0.995	20	10		ECCDRP
C[C@H](C(=O)NCc1cc(NC(=O)[C@@H](C)[NH+](C)C)ccc1O)[NH+](C)C	ZINC000923118957	611204798	/nfs/dbraw/zinc/20/47/98/611204798.db2.gz	YFTKTYQRHVDEAL-VXGBXAGGSA-N	2	0	336.436	0.847	20	10		ECCDRP
COc1ccc(N2CCN(C[C@H](O)C[N@@H+]3CC[C@H](C[NH3+])C3)CC2)cc1	ZINC000923280887	611224036	/nfs/dbraw/zinc/22/40/36/611224036.db2.gz	JROJAHXJJPBXNM-AEFFLSMTSA-N	2	0	348.491	0.459	20	10		ECCDRP
COc1ccc(N2CC[NH+](C[C@@H](O)CNCC3([NH3+])CCC3)CC2)cc1	ZINC000923330345	611229057	/nfs/dbraw/zinc/22/90/57/611229057.db2.gz	CPOJQGRGPUQKOU-KRWDZBQOSA-N	2	0	348.491	0.649	20	10		ECCDRP