smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc([C@@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c(O)c1C	ZINC000273365378	130112769	/nfs/dbraw/zinc/11/27/69/130112769.db2.gz	BELQGXQEURMDQK-OAHLLOKOSA-N	1	0	322.408	4.515	20	10		DJCDRO
CCc1nc([C@H](C)[NH2+][C@H](CC)c2ccc(N(C)C)cc2)cs1	ZINC000162351679	332935346	/nfs/dbraw/zinc/93/53/46/332935346.db2.gz	PTCDXZWOCYKWHM-XJKSGUPXSA-N	1	0	317.502	4.573	20	10		DJCDRO
C[C@@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1cc(F)ccc1O	ZINC000176982868	332967034	/nfs/dbraw/zinc/96/70/34/332967034.db2.gz	WNUHJUNLJGXOIG-MEBBXXQBSA-N	1	0	321.392	4.558	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c(O)c1	ZINC000185691593	333211986	/nfs/dbraw/zinc/21/19/86/333211986.db2.gz	PXNUNGHGRBBWFM-IAGOWNOFSA-N	1	0	324.468	4.713	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c(O)c1	ZINC000185691609	333212019	/nfs/dbraw/zinc/21/20/19/333212019.db2.gz	PXNUNGHGRBBWFM-SJORKVTESA-N	1	0	324.468	4.713	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c1	ZINC000192791654	336262011	/nfs/dbraw/zinc/26/20/11/336262011.db2.gz	YNGKSNGETCAQMW-YWZLYKJASA-N	1	0	307.393	4.734	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)c(O)c1	ZINC000185185319	337202559	/nfs/dbraw/zinc/20/25/59/337202559.db2.gz	CVUGNPRVWWUOPT-LRDDRELGSA-N	1	0	317.816	4.528	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c(O)c1	ZINC000359973274	337441078	/nfs/dbraw/zinc/44/10/78/337441078.db2.gz	KGLVRMSXPABTRL-HRAATJIYSA-N	1	0	318.420	4.536	20	10		DJCDRO
CC[C@H]([NH2+][C@@H](C)c1cccc(N2CCCC2)c1)c1ccccc1O	ZINC000156323684	522699852	/nfs/dbraw/zinc/69/98/52/522699852.db2.gz	KJSUUTHRMKHQHN-JXFKEZNVSA-N	1	0	324.468	4.794	20	10		DJCDRO
Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)CCC2	ZINC000364965978	527109614	/nfs/dbraw/zinc/10/96/14/527109614.db2.gz	UWUTTXICTCOCFC-WFASDCNBSA-N	1	0	316.470	4.502	20	10		DJCDRO
CCN(CC)c1ccc(C[NH2+][C@H](C)CCc2ccccc2)cc1	ZINC000013726263	563662912	/nfs/dbraw/zinc/66/29/12/563662912.db2.gz	AETWRWZGFSRIEN-GOSISDBHSA-N	1	0	310.485	4.644	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1ccc2c(c1)CCO2)c1ccc(Cl)cc1	ZINC000037363249	182884137	/nfs/dbraw/zinc/88/41/37/182884137.db2.gz	BTJIUEMJCQVPBC-QGZVFWFLSA-N	1	0	301.817	4.516	20	10		DJCDRO
Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3ccc(C)cc3O)co2)cc1	ZINC000273590157	130142333	/nfs/dbraw/zinc/14/23/33/130142333.db2.gz	OWMYOTNGQMYHCW-HNNXBMFYSA-N	1	0	322.408	4.515	20	10		DJCDRO
C[C@H]([NH2+][C@@H]1CCSc2ccc(F)cc21)c1cc(F)ccc1O	ZINC000176982849	332966985	/nfs/dbraw/zinc/96/69/85/332966985.db2.gz	WNUHJUNLJGXOIG-ZUZCIYMTSA-N	1	0	321.392	4.558	20	10		DJCDRO
C[C@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1cc(F)ccc1O	ZINC000176982884	332967038	/nfs/dbraw/zinc/96/70/38/332967038.db2.gz	WNUHJUNLJGXOIG-BONVTDFDSA-N	1	0	321.392	4.558	20	10		DJCDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(-c2ccncc2)cc1	ZINC000183540609	337192074	/nfs/dbraw/zinc/19/20/74/337192074.db2.gz	AEIVXCBZUIYQSL-HOTGVXAUSA-N	1	0	318.420	4.866	20	10		DJCDRO
C[C@@H]([NH2+]C(c1cccs1)c1cccs1)c1ccccc1O	ZINC000183610413	337193796	/nfs/dbraw/zinc/19/37/96/337193796.db2.gz	JSUOGJCJGQHYKC-GFCCVEGCSA-N	1	0	315.463	4.955	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)c1	ZINC000185152373	337202415	/nfs/dbraw/zinc/20/24/15/337202415.db2.gz	PHABIWNEZLJPKS-IIBYNOLFSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)CCCC(F)(F)F	ZINC000475196419	339440946	/nfs/dbraw/zinc/44/09/46/339440946.db2.gz	QGOJUAGGVFSTFS-LBPRGKRZSA-N	1	0	312.379	4.697	20	10		DJCDRO
CC[C@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1ccccc1O	ZINC000156837446	522653928	/nfs/dbraw/zinc/65/39/28/522653928.db2.gz	GDTAZZGJEYKSGC-IBGZPJMESA-N	1	0	318.420	4.695	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(OC(F)F)cc2)c1	ZINC000184918686	525365871	/nfs/dbraw/zinc/36/58/71/525365871.db2.gz	MBSBQLMMUQDENA-OLZOCXBDSA-N	1	0	321.367	4.714	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(OC(F)F)c2)c(O)c1	ZINC000192719962	525934493	/nfs/dbraw/zinc/93/44/93/525934493.db2.gz	WIXWNELRARQRKP-STQMWFEESA-N	1	0	321.367	4.714	20	10		DJCDRO
CC[C@H]([NH2+][C@H](C)c1ccccc1OC(F)F)c1ccccc1O	ZINC000274976626	535943447	/nfs/dbraw/zinc/94/34/47/535943447.db2.gz	YSUVZFGGTQLHRQ-DOMZBBRYSA-N	1	0	321.367	4.796	20	10		DJCDRO
Cc1ccc(O)c2c1[C@H](C)C[C@H]2[NH2+]Cc1ccccc1Cl	ZINC000020007372	182176992	/nfs/dbraw/zinc/17/69/92/182176992.db2.gz	OLPPDGYAXJPPPD-IUODEOHRSA-N	1	0	301.817	4.692	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c1	ZINC000185691023	333211907	/nfs/dbraw/zinc/21/19/07/333211907.db2.gz	UKZKWCIISLORFR-IRXDYDNUSA-N	1	0	324.468	4.713	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(C(F)(F)F)cc1)c1ccccc1O	ZINC000192804997	336264764	/nfs/dbraw/zinc/26/47/64/336264764.db2.gz	AWKWULJGZFPURG-NWDGAFQWSA-N	1	0	309.331	4.823	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(-c2cccnc2)cc1)c1ccccc1O	ZINC000183543117	337192134	/nfs/dbraw/zinc/19/21/34/337192134.db2.gz	BDPDJSXKZXXTDD-JKSUJKDBSA-N	1	0	318.420	4.866	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(C)cc1O	ZINC000527964411	337780560	/nfs/dbraw/zinc/78/05/60/337780560.db2.gz	KHDKYQFSGCERBO-YLJYHZDGSA-N	1	0	310.441	4.678	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1ccc(F)cc1)C1CC1	ZINC000479445740	339535428	/nfs/dbraw/zinc/53/54/28/339535428.db2.gz	BUHQBIOBLIPPIS-NRFANRHFSA-N	1	0	322.427	4.867	20	10		DJCDRO
CC[C@@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1ccccc1O	ZINC000155419593	341607398	/nfs/dbraw/zinc/60/73/98/341607398.db2.gz	LDIUQPZJXHQASW-SJORKVTESA-N	1	0	301.817	4.774	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1cccc(-c2ccccn2)c1)c1ccccc1O	ZINC000156837592	522880913	/nfs/dbraw/zinc/88/09/13/522880913.db2.gz	GDTAZZGJEYKSGC-LJQANCHMSA-N	1	0	318.420	4.695	20	10		DJCDRO
C[C@@H]([NH2+]Cc1cccs1)c1ccc(N2CCCCC2)cc1	ZINC000156529364	525543098	/nfs/dbraw/zinc/54/30/98/525543098.db2.gz	YPEGBHURVNSQCT-OAHLLOKOSA-N	1	0	300.471	4.589	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2coc(-c3ccccc3)n2)c(O)c1C	ZINC000273365374	130112146	/nfs/dbraw/zinc/11/21/46/130112146.db2.gz	BELQGXQEURMDQK-HNNXBMFYSA-N	1	0	322.408	4.515	20	10		DJCDRO
[O-]c1c(Cl)cccc1C[NH2+][C@@H](c1ccco1)c1ccccc1	ZINC000181029714	333029531	/nfs/dbraw/zinc/02/95/31/333029531.db2.gz	LAXHPDPGDHMSED-QGZVFWFLSA-N	1	0	313.784	4.518	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c1	ZINC000185691037	333211834	/nfs/dbraw/zinc/21/18/34/333211834.db2.gz	UKZKWCIISLORFR-IAGOWNOFSA-N	1	0	324.468	4.713	20	10		DJCDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(C(F)(F)F)cc1	ZINC000192804982	336264790	/nfs/dbraw/zinc/26/47/90/336264790.db2.gz	AWKWULJGZFPURG-RYUDHWBXSA-N	1	0	309.331	4.823	20	10		DJCDRO
C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(-c2cccnc2)cc1	ZINC000183543134	337192097	/nfs/dbraw/zinc/19/20/97/337192097.db2.gz	BDPDJSXKZXXTDD-HZPDHXFCSA-N	1	0	318.420	4.866	20	10		DJCDRO
Cc1cccc([C@H]([NH2+][C@@H](C)c2ccccc2O)c2ccccn2)c1	ZINC000183633895	337193934	/nfs/dbraw/zinc/19/39/34/337193934.db2.gz	NCNOMLASVQEHGH-KKSFZXQISA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+]Cc2cccc(-c3ccccn3)c2)c(O)c1	ZINC000186150331	337253979	/nfs/dbraw/zinc/25/39/79/337253979.db2.gz	BNXLRRYVSNFQGE-MRXNPFEDSA-N	1	0	318.420	4.613	20	10		DJCDRO
C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1cc(Cl)ccc1O	ZINC000527964372	337780620	/nfs/dbraw/zinc/78/06/20/337780620.db2.gz	KFILTSRFHVILQH-KPZWWZAWSA-N	1	0	316.832	4.633	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cc(F)cc(F)c1	ZINC000479453997	339535863	/nfs/dbraw/zinc/53/58/63/339535863.db2.gz	LNYPZHJXIYBILN-ZDUSSCGKSA-N	1	0	314.379	4.616	20	10		DJCDRO
CC(C)Oc1cccc([C@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1	ZINC000295984428	341715742	/nfs/dbraw/zinc/71/57/42/341715742.db2.gz	NHBKICLXJUXTGD-KBXCAEBGSA-N	1	0	311.425	4.518	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](C)c1nc2ccccc2n1CC)c1ccccc1O	ZINC000156626912	522917731	/nfs/dbraw/zinc/91/77/31/522917731.db2.gz	IEXILKFKLFBUNS-GOEBONIOSA-N	1	0	323.440	4.564	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N2CCCCCC2)cc1	ZINC000158535705	525617879	/nfs/dbraw/zinc/61/78/79/525617879.db2.gz	YPBUHUPDFYYSJF-MSOLQXFVSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1cc(C)c([C@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1	ZINC000285442996	131168736	/nfs/dbraw/zinc/16/87/36/131168736.db2.gz	ZBZYCMDCWNPVDP-ZDUSSCGKSA-N	1	0	305.368	4.797	20	10		DJCDRO
C[C@H]([NH2+][C@@H](c1ccco1)c1ccccc1)c1cc(F)ccc1O	ZINC000176983638	332966976	/nfs/dbraw/zinc/96/69/76/332966976.db2.gz	XOPJQOHSQUDPBS-ORAYPTAESA-N	1	0	311.356	4.565	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)c1	ZINC000185185024	333205336	/nfs/dbraw/zinc/20/53/36/333205336.db2.gz	JPNRXADZTPJTQW-BLLLJJGKSA-N	1	0	317.816	4.528	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)c1	ZINC000192738187	336261105	/nfs/dbraw/zinc/26/11/05/336261105.db2.gz	WKZQOQHGOPGTRR-LRDDRELGSA-N	1	0	317.429	4.727	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2cccc(-c3cccnc3)c2)c(O)c1	ZINC000372095367	336921960	/nfs/dbraw/zinc/92/19/60/336921960.db2.gz	NXRKLDIDECHQSR-INIZCTEOSA-N	1	0	318.420	4.613	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)c1	ZINC000185152342	337202346	/nfs/dbraw/zinc/20/23/46/337202346.db2.gz	PHABIWNEZLJPKS-IERDGZPVSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)c(O)c1	ZINC000185185268	337202655	/nfs/dbraw/zinc/20/26/55/337202655.db2.gz	CVUGNPRVWWUOPT-MLGOLLRUSA-N	1	0	317.816	4.528	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cccc(F)c1F	ZINC000479441373	339535120	/nfs/dbraw/zinc/53/51/20/339535120.db2.gz	VMHLSOIAOJUFIV-CYBMUJFWSA-N	1	0	314.379	4.616	20	10		DJCDRO
CCOc1ccccc1[C@@H](C)[NH2+]Cc1c(C)c2ccccc2n1C	ZINC000479442292	339535261	/nfs/dbraw/zinc/53/52/61/339535261.db2.gz	XLLDOQRGCOIYOJ-MRXNPFEDSA-N	1	0	322.452	4.736	20	10		DJCDRO
C[C@@H]([NH2+][C@H](C)c1cccnc1)c1ccc(N2CCCCCC2)cc1	ZINC000158536014	525664146	/nfs/dbraw/zinc/66/41/46/525664146.db2.gz	YPBUHUPDFYYSJF-QZTJIDSGSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)c(O)c1	ZINC000192736935	525749892	/nfs/dbraw/zinc/74/98/92/525749892.db2.gz	DXOCMNPVPSWAJL-WBMJQRKESA-N	1	0	317.429	4.727	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1ccccc1OC(F)F)c1ccccc1O	ZINC000274976629	535808733	/nfs/dbraw/zinc/80/87/33/535808733.db2.gz	YSUVZFGGTQLHRQ-IUODEOHRSA-N	1	0	321.367	4.796	20	10		DJCDRO
COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)c1	ZINC000188069590	200189789	/nfs/dbraw/zinc/18/97/89/200189789.db2.gz	UHRUYGBJXPNXCU-CHWSQXEVSA-N	1	0	311.381	4.559	20	10		DJCDRO
Cc1ccc(O)c2c1[C@@H](C)C[C@@H]2[NH2+]Cc1ccccc1Cl	ZINC000020007381	182176842	/nfs/dbraw/zinc/17/68/42/182176842.db2.gz	OLPPDGYAXJPPPD-WFASDCNBSA-N	1	0	301.817	4.692	20	10		DJCDRO
Cc1csc(C2([NH2+][C@H](C)c3ccc(C)c(C)c3O)CCC2)n1	ZINC000273497170	130129740	/nfs/dbraw/zinc/12/97/40/130129740.db2.gz	PJHOTALCWWUYKG-CQSZACIVSA-N	1	0	316.470	4.504	20	10		DJCDRO
Cc1ccc(-c2nc(C[NH2+][C@H](C)c3ccc(C)cc3O)co2)cc1	ZINC000273590168	130141675	/nfs/dbraw/zinc/14/16/75/130141675.db2.gz	OWMYOTNGQMYHCW-OAHLLOKOSA-N	1	0	322.408	4.515	20	10		DJCDRO
CCC(CC)c1cc(C[NH2+][C@@H](C)c2c(C)cc(C)cc2O)on1	ZINC000283909686	131032956	/nfs/dbraw/zinc/03/29/56/131032956.db2.gz	DFRGIQIDEJWTAP-AWEZNQCLSA-N	1	0	316.445	4.751	20	10		DJCDRO
Cc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1	ZINC000285442995	131168634	/nfs/dbraw/zinc/16/86/34/131168634.db2.gz	ZBZYCMDCWNPVDP-CYBMUJFWSA-N	1	0	305.368	4.797	20	10		DJCDRO
CC[C@H]([NH2+][C@H](C)c1cccc(OC(F)F)c1)c1ccccc1O	ZINC000192720330	336259175	/nfs/dbraw/zinc/25/91/75/336259175.db2.gz	RWPUEAGLZJOHTB-WBMJQRKESA-N	1	0	321.367	4.796	20	10		DJCDRO
C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1cccc(C(F)(F)F)c1	ZINC000192792938	336261896	/nfs/dbraw/zinc/26/18/96/336261896.db2.gz	RRYNEGZEUYZQRF-VXGBXAGGSA-N	1	0	309.331	4.823	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c1	ZINC000192791681	336261991	/nfs/dbraw/zinc/26/19/91/336261991.db2.gz	YNGKSNGETCAQMW-MGPUTAFESA-N	1	0	307.393	4.734	20	10		DJCDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(-c2cccnc2)cc1	ZINC000183543079	337192116	/nfs/dbraw/zinc/19/21/16/337192116.db2.gz	BDPDJSXKZXXTDD-HOTGVXAUSA-N	1	0	318.420	4.866	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c(O)c1	ZINC000359973275	337441177	/nfs/dbraw/zinc/44/11/77/337441177.db2.gz	KGLVRMSXPABTRL-IERDGZPVSA-N	1	0	318.420	4.536	20	10		DJCDRO
CC(C)Oc1cccc([C@@H](C)[NH2+][C@@H]2CCc3cccc(O)c32)c1	ZINC000295984441	341715744	/nfs/dbraw/zinc/71/57/44/341715744.db2.gz	NHBKICLXJUXTGD-RDTXWAMCSA-N	1	0	311.425	4.518	20	10		DJCDRO
COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cc3ccccc3o2)c1	ZINC000188069567	200189891	/nfs/dbraw/zinc/18/98/91/200189891.db2.gz	UHRUYGBJXPNXCU-QWHCGFSZSA-N	1	0	311.381	4.559	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c(O)c1	ZINC000185691560	333212048	/nfs/dbraw/zinc/21/20/48/333212048.db2.gz	PXNUNGHGRBBWFM-DLBZAZTESA-N	1	0	324.468	4.713	20	10		DJCDRO
CC[C@H]([NH2+][C@@H](C)c1cccc(OC(F)F)c1)c1ccccc1O	ZINC000192720309	336259262	/nfs/dbraw/zinc/25/92/62/336259262.db2.gz	RWPUEAGLZJOHTB-LRDDRELGSA-N	1	0	321.367	4.796	20	10		DJCDRO
C[C@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(C(F)(F)F)c1	ZINC000192792891	336261961	/nfs/dbraw/zinc/26/19/61/336261961.db2.gz	RRYNEGZEUYZQRF-RYUDHWBXSA-N	1	0	309.331	4.823	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](c2ccco2)c2ccccc2)c1	ZINC000192791669	336261968	/nfs/dbraw/zinc/26/19/68/336261968.db2.gz	YNGKSNGETCAQMW-FOIQADDNSA-N	1	0	307.393	4.734	20	10		DJCDRO
C[C@@H]([NH2+][C@H](C)c1ccccc1O)c1ccc(-c2ccncc2)cc1	ZINC000183540660	337192209	/nfs/dbraw/zinc/19/22/09/337192209.db2.gz	AEIVXCBZUIYQSL-HZPDHXFCSA-N	1	0	318.420	4.866	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(F)cc1Cl	ZINC000475201872	339441455	/nfs/dbraw/zinc/44/14/55/339441455.db2.gz	HOCBVBYTENELMF-UHFFFAOYSA-N	1	0	316.807	4.569	20	10		DJCDRO
Cc1ccc(C[NH2+][C@H](C)c2ccc(N3CCCCCC3)cc2)cn1	ZINC000161305670	524604750	/nfs/dbraw/zinc/60/47/50/524604750.db2.gz	HEUKWEPUGXRKPD-GOSISDBHSA-N	1	0	323.484	4.621	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCCC2)cc1)c1cccnc1	ZINC000158535848	525609913	/nfs/dbraw/zinc/60/99/13/525609913.db2.gz	YPBUHUPDFYYSJF-ZWKOTPCHSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1ccc(C)c(C)c1O)CCC2	ZINC000364965977	527113653	/nfs/dbraw/zinc/11/36/53/527113653.db2.gz	UWUTTXICTCOCFC-SWLSCSKDSA-N	1	0	316.470	4.502	20	10		DJCDRO
Cc1csc(C2([NH2+][C@@H](C)c3ccc(C)c(C)c3O)CCC2)n1	ZINC000273497166	130129680	/nfs/dbraw/zinc/12/96/80/130129680.db2.gz	PJHOTALCWWUYKG-AWEZNQCLSA-N	1	0	316.470	4.504	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c(O)c1C	ZINC000273553236	130134887	/nfs/dbraw/zinc/13/48/87/130134887.db2.gz	GHXYYSNUOOTUPC-WMZOPIPTSA-N	1	0	312.457	4.760	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c(O)c1C	ZINC000273553232	130135021	/nfs/dbraw/zinc/13/50/21/130135021.db2.gz	GHXYYSNUOOTUPC-SJLPKXTDSA-N	1	0	312.457	4.760	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)c1	ZINC000192738170	336261157	/nfs/dbraw/zinc/26/11/57/336261157.db2.gz	WKZQOQHGOPGTRR-BLLLJJGKSA-N	1	0	317.429	4.727	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+]Cc2cccc(-c3cccnc3)c2)c(O)c1	ZINC000372095368	336921974	/nfs/dbraw/zinc/92/19/74/336921974.db2.gz	NXRKLDIDECHQSR-MRXNPFEDSA-N	1	0	318.420	4.613	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+]Cc2cccc(-c3ccccn3)c2)c1	ZINC000186150197	337254026	/nfs/dbraw/zinc/25/40/26/337254026.db2.gz	PHNGCSCKIQEPTE-MRXNPFEDSA-N	1	0	318.420	4.613	20	10		DJCDRO
C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cc(Cl)ccc1O	ZINC000527964376	337780518	/nfs/dbraw/zinc/78/05/18/337780518.db2.gz	KFILTSRFHVILQH-XIKOKIGWSA-N	1	0	316.832	4.633	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@H](C)c1cc(F)cc(F)c1	ZINC000479453996	339535762	/nfs/dbraw/zinc/53/57/62/339535762.db2.gz	LNYPZHJXIYBILN-CYBMUJFWSA-N	1	0	314.379	4.616	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCc2c1cccc2C	ZINC000479459376	339536103	/nfs/dbraw/zinc/53/61/03/339536103.db2.gz	YCBOIPPROJKHMC-LJQANCHMSA-N	1	0	304.437	4.572	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc2occc2c1	ZINC000511781601	340338256	/nfs/dbraw/zinc/33/82/56/340338256.db2.gz	QEQZQYZDUITHKY-UHFFFAOYSA-N	1	0	304.393	4.523	20	10		DJCDRO
CC[C@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(N(C)C)cc1	ZINC000128617130	522668109	/nfs/dbraw/zinc/66/81/09/522668109.db2.gz	DNBXSXIXHGEABU-INIZCTEOSA-N	1	0	317.502	4.573	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1nc(C(C)C)cs1)c1ccc(N(C)C)cc1	ZINC000128617346	522893970	/nfs/dbraw/zinc/89/39/70/522893970.db2.gz	DNBXSXIXHGEABU-MRXNPFEDSA-N	1	0	317.502	4.573	20	10		DJCDRO
CC[C@@H]([NH2+][C@H]1CCSc2c(F)cccc21)c1ccccc1O	ZINC000155109589	522950972	/nfs/dbraw/zinc/95/09/72/522950972.db2.gz	LKRFQBRFKMIHAF-CVEARBPZSA-N	1	0	317.429	4.809	20	10		DJCDRO
Cc1ccc(C[NH2+][C@@H](C)c2ccc(N3CCCCCC3)cc2)cn1	ZINC000161305555	524592828	/nfs/dbraw/zinc/59/28/28/524592828.db2.gz	HEUKWEPUGXRKPD-SFHVURJKSA-N	1	0	323.484	4.621	20	10		DJCDRO
Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)CCC2	ZINC000363863144	527108885	/nfs/dbraw/zinc/10/88/85/527108885.db2.gz	ASVPTRXXIAZSLI-ZANVPECISA-N	1	0	322.861	4.539	20	10		DJCDRO
Cc1ccc(O)c2c1[C@H](C)C[C@@H]2[NH2+]Cc1ccccc1Cl	ZINC000020007378	182177331	/nfs/dbraw/zinc/17/73/31/182177331.db2.gz	OLPPDGYAXJPPPD-DOMZBBRYSA-N	1	0	301.817	4.692	20	10		DJCDRO
CCC(CC)c1cc(C[NH2+][C@@H](C)c2ccc(C)c(C)c2O)on1	ZINC000273621764	130146326	/nfs/dbraw/zinc/14/63/26/130146326.db2.gz	ZGXUSWMVIFFRNU-AWEZNQCLSA-N	1	0	316.445	4.751	20	10		DJCDRO
COc1ccc(O)c([C@@H](C)[NH2+][C@H](C)c2ccc(SC)cc2)c1	ZINC000281538300	332784521	/nfs/dbraw/zinc/78/45/21/332784521.db2.gz	IMFKVTPEGOODLW-CHWSQXEVSA-N	1	0	317.454	4.535	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)c1	ZINC000185185060	333205189	/nfs/dbraw/zinc/20/51/89/333205189.db2.gz	JPNRXADZTPJTQW-LRDDRELGSA-N	1	0	317.816	4.528	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c1	ZINC000185691006	333211822	/nfs/dbraw/zinc/21/18/22/333211822.db2.gz	UKZKWCIISLORFR-DLBZAZTESA-N	1	0	324.468	4.713	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+]Cc2ccc(-c3cccnc3)cc2)c1	ZINC000371840656	336914401	/nfs/dbraw/zinc/91/44/01/336914401.db2.gz	KNZBGZGDWARXNT-INIZCTEOSA-N	1	0	318.420	4.613	20	10		DJCDRO
C[C@H]([NH2+]C(c1cccs1)c1cccs1)c1ccccc1O	ZINC000183610396	337193788	/nfs/dbraw/zinc/19/37/88/337193788.db2.gz	JSUOGJCJGQHYKC-LBPRGKRZSA-N	1	0	315.463	4.955	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)c(O)c1	ZINC000185152811	337202401	/nfs/dbraw/zinc/20/24/01/337202401.db2.gz	SSUZLDUHNPRWPK-HRAATJIYSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+]Cc2cccc(-c3ccccn3)c2)c1	ZINC000186150213	337254022	/nfs/dbraw/zinc/25/40/22/337254022.db2.gz	PHNGCSCKIQEPTE-INIZCTEOSA-N	1	0	318.420	4.613	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+]Cc1ccc(OC(C)C)cc1	ZINC000475199954	339441246	/nfs/dbraw/zinc/44/12/46/339441246.db2.gz	XWOFICJFZCIYFL-UHFFFAOYSA-N	1	0	322.452	4.564	20	10		DJCDRO
CCC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccn1	ZINC000479450775	339535658	/nfs/dbraw/zinc/53/56/58/339535658.db2.gz	GKRAAFMOZNIIHP-KRWDZBQOSA-N	1	0	307.441	4.513	20	10		DJCDRO
CC[C@H]([NH2+][C@@H](C)c1nc2ccccc2n1CC)c1ccccc1O	ZINC000156626797	522702185	/nfs/dbraw/zinc/70/21/85/522702185.db2.gz	IEXILKFKLFBUNS-HOCLYGCPSA-N	1	0	323.440	4.564	20	10		DJCDRO
CC[C@H]([NH2+][C@H](C)c1cccc(N2CCCC2)c1)c1ccccc1O	ZINC000156323934	522739849	/nfs/dbraw/zinc/73/98/49/522739849.db2.gz	KJSUUTHRMKHQHN-UZLBHIALSA-N	1	0	324.468	4.794	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1ccccc1O	ZINC000156143193	522871726	/nfs/dbraw/zinc/87/17/26/522871726.db2.gz	LQVPOTLDNNBUIJ-HXUWFJFHSA-N	1	0	318.420	4.695	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1ccc2ccccc2c1O)c1ccncc1	ZINC000185541287	522937502	/nfs/dbraw/zinc/93/75/02/522937502.db2.gz	OONFUGBVWIGVDP-AUUYWEPGSA-N	1	0	306.409	4.742	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1cccc(N2CCCC2)c1)c1ccccc1O	ZINC000156324055	522938914	/nfs/dbraw/zinc/93/89/14/522938914.db2.gz	KJSUUTHRMKHQHN-OXQOHEQNSA-N	1	0	324.468	4.794	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1nc2ccccc2n1CC)c1ccccc1O	ZINC000156627132	522941250	/nfs/dbraw/zinc/94/12/50/522941250.db2.gz	IEXILKFKLFBUNS-GDBMZVCRSA-N	1	0	323.440	4.564	20	10		DJCDRO
Cc1ccc(-c2nc(C[NH2+][C@H](C)c3cc(C)ccc3O)co2)cc1	ZINC000273370073	130112141	/nfs/dbraw/zinc/11/21/41/130112141.db2.gz	CGNARHZLMPPGCX-OAHLLOKOSA-N	1	0	322.408	4.515	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1C	ZINC000273549455	130135734	/nfs/dbraw/zinc/13/57/34/130135734.db2.gz	FRKLZZCYXJXXOA-ZDUSSCGKSA-N	1	0	318.486	4.614	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)c1	ZINC000185185041	333205172	/nfs/dbraw/zinc/20/51/72/333205172.db2.gz	JPNRXADZTPJTQW-WBMJQRKESA-N	1	0	317.816	4.528	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(F)F)cc2)c(O)c1C	ZINC000274168177	334055763	/nfs/dbraw/zinc/05/57/63/334055763.db2.gz	AJKNXPWZZFAMQY-ZDUSSCGKSA-N	1	0	305.368	4.797	20	10		DJCDRO
Cc1cccc([C@@H]([NH2+][C@@H](C)c2ccccc2O)c2ccccn2)c1	ZINC000183633914	337193940	/nfs/dbraw/zinc/19/39/40/337193940.db2.gz	NCNOMLASVQEHGH-HRAATJIYSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)c(O)c1	ZINC000185152791	337202355	/nfs/dbraw/zinc/20/23/55/337202355.db2.gz	SSUZLDUHNPRWPK-IIBYNOLFSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H](c2ccccc2)c2ccncc2)c1	ZINC000185152389	337202397	/nfs/dbraw/zinc/20/23/97/337202397.db2.gz	PHABIWNEZLJPKS-HRAATJIYSA-N	1	0	318.420	4.536	20	10		DJCDRO
C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1cc(Cl)ccc1O	ZINC000527964374	337780591	/nfs/dbraw/zinc/78/05/91/337780591.db2.gz	KFILTSRFHVILQH-SGTLLEGYSA-N	1	0	316.832	4.633	20	10		DJCDRO
CC[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(C)cc1O	ZINC000527964407	337780609	/nfs/dbraw/zinc/78/06/09/337780609.db2.gz	KHDKYQFSGCERBO-PXNSSMCTSA-N	1	0	310.441	4.678	20	10		DJCDRO
C[C@H]([NH2+]Cc1cccs1)c1ccc(N2CCCCC2)cc1	ZINC000156529236	525469748	/nfs/dbraw/zinc/46/97/48/525469748.db2.gz	YPEGBHURVNSQCT-HNNXBMFYSA-N	1	0	300.471	4.589	20	10		DJCDRO
C[C@H]([NH2+][C@@H](C)c1cccnc1)c1ccc(N2CCCCCC2)cc1	ZINC000158535536	525536247	/nfs/dbraw/zinc/53/62/47/525536247.db2.gz	YPBUHUPDFYYSJF-ROUUACIJSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)CCC2	ZINC000364965976	527112956	/nfs/dbraw/zinc/11/29/56/527112956.db2.gz	UWUTTXICTCOCFC-IUODEOHRSA-N	1	0	316.470	4.502	20	10		DJCDRO
Cc1ccc(O)c2c1[C@@H](C)C[C@H]2[NH2+]Cc1ccccc1Cl	ZINC000020007375	182176953	/nfs/dbraw/zinc/17/69/53/182176953.db2.gz	OLPPDGYAXJPPPD-SWLSCSKDSA-N	1	0	301.817	4.692	20	10		DJCDRO
CCC(CC)c1cc(C[NH2+][C@H](C)c2ccc(C)c(C)c2O)on1	ZINC000273621766	130146774	/nfs/dbraw/zinc/14/67/74/130146774.db2.gz	ZGXUSWMVIFFRNU-CQSZACIVSA-N	1	0	316.445	4.751	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)c1	ZINC000185185003	333205240	/nfs/dbraw/zinc/20/52/40/333205240.db2.gz	JPNRXADZTPJTQW-MLGOLLRUSA-N	1	0	317.816	4.528	20	10		DJCDRO
COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2cc3ccccc3o2)c1	ZINC000191633916	335784449	/nfs/dbraw/zinc/78/44/49/335784449.db2.gz	UHRUYGBJXPNXCU-OLZOCXBDSA-N	1	0	311.381	4.559	20	10		DJCDRO
CCC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1cccnc1	ZINC000359001192	336652306	/nfs/dbraw/zinc/65/23/06/336652306.db2.gz	LMSPZEAXWNWWMF-SFHVURJKSA-N	1	0	307.441	4.513	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)c1	ZINC000185152357	337202392	/nfs/dbraw/zinc/20/23/92/337202392.db2.gz	PHABIWNEZLJPKS-KKSFZXQISA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H](C)c1cccc(F)c1F	ZINC000479441376	339535110	/nfs/dbraw/zinc/53/51/10/339535110.db2.gz	VMHLSOIAOJUFIV-ZDUSSCGKSA-N	1	0	314.379	4.616	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H](c1ccc(F)cc1)C1CC1	ZINC000479445741	339535412	/nfs/dbraw/zinc/53/54/12/339535412.db2.gz	BUHQBIOBLIPPIS-OAQYLSRUSA-N	1	0	322.427	4.867	20	10		DJCDRO
CC[C@H]([NH2+][C@H]1CCc2cc(Cl)ccc21)c1ccccc1O	ZINC000155419476	341607385	/nfs/dbraw/zinc/60/73/85/341607385.db2.gz	LDIUQPZJXHQASW-IRXDYDNUSA-N	1	0	301.817	4.774	20	10		DJCDRO
CC[C@H]([NH2+][C@H](C)c1nc2ccccc2n1CC)c1ccccc1O	ZINC000156627021	522745400	/nfs/dbraw/zinc/74/54/00/522745400.db2.gz	IEXILKFKLFBUNS-ZBFHGGJFSA-N	1	0	323.440	4.564	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1	ZINC000163612790	522912282	/nfs/dbraw/zinc/91/22/82/522912282.db2.gz	PLVMZRZQOLRCHQ-LAUBAEHRSA-N	1	0	323.484	4.874	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](C)c1cccc(N2CCCC2)c1)c1ccccc1O	ZINC000156323810	522913431	/nfs/dbraw/zinc/91/34/31/522913431.db2.gz	KJSUUTHRMKHQHN-OXJNMPFZSA-N	1	0	324.468	4.794	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1	ZINC000163613004	522936911	/nfs/dbraw/zinc/93/69/11/522936911.db2.gz	PLVMZRZQOLRCHQ-DYESRHJHSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1cccnc1[C@H]([NH2+][C@@H](C)c1cc(Cl)ccc1O)C(C)C	ZINC000185457556	525556483	/nfs/dbraw/zinc/55/64/83/525556483.db2.gz	UOJCIDXCDOQMRI-SUMWQHHRSA-N	1	0	318.848	4.797	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H](c2ncccc2C)C(C)C)c(O)c1C	ZINC000273553221	130135485	/nfs/dbraw/zinc/13/54/85/130135485.db2.gz	GHXYYSNUOOTUPC-AEFFLSMTSA-N	1	0	312.457	4.760	20	10		DJCDRO
CCC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1cccnc1	ZINC000359001190	336652291	/nfs/dbraw/zinc/65/22/91/336652291.db2.gz	LMSPZEAXWNWWMF-GOSISDBHSA-N	1	0	307.441	4.513	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccncc2)cc1)c1ccccc1O	ZINC000183540642	337192080	/nfs/dbraw/zinc/19/20/80/337192080.db2.gz	AEIVXCBZUIYQSL-JKSUJKDBSA-N	1	0	318.420	4.866	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)c(O)c1	ZINC000185152754	337202318	/nfs/dbraw/zinc/20/23/18/337202318.db2.gz	SSUZLDUHNPRWPK-IERDGZPVSA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2cccc(-c3ccccn3)c2)c(O)c1	ZINC000186150349	337254002	/nfs/dbraw/zinc/25/40/02/337254002.db2.gz	BNXLRRYVSNFQGE-INIZCTEOSA-N	1	0	318.420	4.613	20	10		DJCDRO
CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1cccc(OC)c1	ZINC000479425756	339534527	/nfs/dbraw/zinc/53/45/27/339534527.db2.gz	BFBZTXGJQUMYTF-IBGZPJMESA-N	1	0	322.452	4.736	20	10		DJCDRO
CCC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccn1	ZINC000479450780	339535750	/nfs/dbraw/zinc/53/57/50/339535750.db2.gz	GKRAAFMOZNIIHP-QGZVFWFLSA-N	1	0	307.441	4.513	20	10		DJCDRO
CC[C@H]([NH2+][C@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1	ZINC000163612880	522739564	/nfs/dbraw/zinc/73/95/64/522739564.db2.gz	PLVMZRZQOLRCHQ-UTKZUKDTSA-N	1	0	323.484	4.874	20	10		DJCDRO
Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccc(C)c(C)c1O)CCC2	ZINC000364965552	527109285	/nfs/dbraw/zinc/10/92/85/527109285.db2.gz	UWUTTXICTCOCFC-DOMZBBRYSA-N	1	0	316.470	4.502	20	10		DJCDRO
CCC(CC)c1cc(C[NH2+][C@H](C)c2c(C)cc(C)cc2O)on1	ZINC000283909691	131033414	/nfs/dbraw/zinc/03/34/14/131033414.db2.gz	DFRGIQIDEJWTAP-CQSZACIVSA-N	1	0	316.445	4.751	20	10		DJCDRO
Cc1cc(C)c([C@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1	ZINC000284108145	131049158	/nfs/dbraw/zinc/04/91/58/131049158.db2.gz	NEJYWFJUGQBZKO-ZDUSSCGKSA-N	1	0	318.486	4.614	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H]2CCSc3ccc(F)cc32)c1	ZINC000192738179	336261080	/nfs/dbraw/zinc/26/10/80/336261080.db2.gz	WKZQOQHGOPGTRR-WBMJQRKESA-N	1	0	317.429	4.727	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1cccc(C(F)(F)F)c1	ZINC000192792907	336262003	/nfs/dbraw/zinc/26/20/03/336262003.db2.gz	RRYNEGZEUYZQRF-NEPJUHHUSA-N	1	0	309.331	4.823	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)c2ccncc2)c(O)c1	ZINC000185152772	337202419	/nfs/dbraw/zinc/20/24/19/337202419.db2.gz	SSUZLDUHNPRWPK-KKSFZXQISA-N	1	0	318.420	4.536	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H]2CCOc3c(Cl)cccc32)c(O)c1	ZINC000185185303	337202568	/nfs/dbraw/zinc/20/25/68/337202568.db2.gz	CVUGNPRVWWUOPT-WBMJQRKESA-N	1	0	317.816	4.528	20	10		DJCDRO
CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1OC	ZINC000392577194	337263578	/nfs/dbraw/zinc/26/35/78/337263578.db2.gz	IYYDKHSOLKEPEE-SFHVURJKSA-N	1	0	322.452	4.736	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+][C@H](c2ccccc2)c2ccccn2)c(O)c1	ZINC000359973276	337441237	/nfs/dbraw/zinc/44/12/37/337441237.db2.gz	KGLVRMSXPABTRL-IIBYNOLFSA-N	1	0	318.420	4.536	20	10		DJCDRO
CC[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(C)cc1O	ZINC000527964400	337780578	/nfs/dbraw/zinc/78/05/78/337780578.db2.gz	KHDKYQFSGCERBO-FXAWDEMLSA-N	1	0	310.441	4.678	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](c1ccccc1)c1ccncc1)c1ccccc1O	ZINC000155328713	522921824	/nfs/dbraw/zinc/92/18/24/522921824.db2.gz	OPBFMHJVEZKARV-CTNGQTDRSA-N	1	0	318.420	4.618	20	10		DJCDRO
Cc1ccc([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1C	ZINC000273549444	130135423	/nfs/dbraw/zinc/13/54/23/130135423.db2.gz	FRKLZZCYXJXXOA-CYBMUJFWSA-N	1	0	318.486	4.614	20	10		DJCDRO
COc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2ccc(SC)cc2)c1	ZINC000281538315	332784478	/nfs/dbraw/zinc/78/44/78/332784478.db2.gz	IMFKVTPEGOODLW-OLZOCXBDSA-N	1	0	317.454	4.535	20	10		DJCDRO
COc1ccc(O)c([C@@H](C)[NH2+][C@@H](C)c2ccc(SC)cc2)c1	ZINC000281538330	332784511	/nfs/dbraw/zinc/78/45/11/332784511.db2.gz	IMFKVTPEGOODLW-QWHCGFSZSA-N	1	0	317.454	4.535	20	10		DJCDRO
CC[C@@H]([NH2+][C@@H](C)c1cccc(OC(F)F)c1)c1ccccc1O	ZINC000192720318	336259196	/nfs/dbraw/zinc/25/91/96/336259196.db2.gz	RWPUEAGLZJOHTB-BLLLJJGKSA-N	1	0	321.367	4.796	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@H](c2ccco2)c2ccccc2)c1	ZINC000192791640	336261965	/nfs/dbraw/zinc/26/19/65/336261965.db2.gz	YNGKSNGETCAQMW-QRWLVFNGSA-N	1	0	307.393	4.734	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1cccc(C(F)(F)F)c1)c1ccccc1O	ZINC000192792923	336261998	/nfs/dbraw/zinc/26/19/98/336261998.db2.gz	RRYNEGZEUYZQRF-NWDGAFQWSA-N	1	0	309.331	4.823	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(-c2cccnc2)cc1	ZINC000183543099	337192212	/nfs/dbraw/zinc/19/22/12/337192212.db2.gz	BDPDJSXKZXXTDD-CVEARBPZSA-N	1	0	318.420	4.866	20	10		DJCDRO
Cc1cccc([C@@H]([NH2+][C@H](C)c2ccccc2O)c2ccccn2)c1	ZINC000183633943	337193916	/nfs/dbraw/zinc/19/39/16/337193916.db2.gz	NCNOMLASVQEHGH-IIBYNOLFSA-N	1	0	318.420	4.536	20	10		DJCDRO
CC[C@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc(OC)cc1	ZINC000392239490	337194384	/nfs/dbraw/zinc/19/43/84/337194384.db2.gz	LXEFSVUEUVJRAY-IBGZPJMESA-N	1	0	322.452	4.736	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+]Cc1cc(Cl)ccc1F	ZINC000475193842	339440973	/nfs/dbraw/zinc/44/09/73/339440973.db2.gz	UTHBYHAXEKCZJZ-UHFFFAOYSA-N	1	0	316.807	4.569	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@@H]1CCc2ccc(C)cc21	ZINC000479450031	339535747	/nfs/dbraw/zinc/53/57/47/339535747.db2.gz	FXDFBUBINNXMCD-LJQANCHMSA-N	1	0	304.437	4.572	20	10		DJCDRO
CCN(CC)c1ccc(C[NH2+][C@@H](C)CCc2ccccc2)cc1	ZINC000013726259	563663258	/nfs/dbraw/zinc/66/32/58/563663258.db2.gz	AETWRWZGFSRIEN-SFHVURJKSA-N	1	0	310.485	4.644	20	10		DJCDRO
Cc1cc(C)c([C@@H](C)[NH2+]Cc2nc(C(C)(C)C)cs2)c(O)c1	ZINC000284108143	131049305	/nfs/dbraw/zinc/04/93/05/131049305.db2.gz	NEJYWFJUGQBZKO-CYBMUJFWSA-N	1	0	318.486	4.614	20	10		DJCDRO
C[C@@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1cc(F)ccc1O	ZINC000176982900	332967030	/nfs/dbraw/zinc/96/70/30/332967030.db2.gz	WNUHJUNLJGXOIG-BMIGLBTASA-N	1	0	321.392	4.558	20	10		DJCDRO
[O-]c1c(Cl)cccc1C[NH2+][C@H](c1ccco1)c1ccccc1	ZINC000181029696	333029550	/nfs/dbraw/zinc/02/95/50/333029550.db2.gz	LAXHPDPGDHMSED-KRWDZBQOSA-N	1	0	313.784	4.518	20	10		DJCDRO
Cc1ccc(O)c([C@H](C)[NH2+][C@H](C)c2cccc(N3CCCC3)c2)c1	ZINC000185691057	333211864	/nfs/dbraw/zinc/21/18/64/333211864.db2.gz	UKZKWCIISLORFR-SJORKVTESA-N	1	0	324.468	4.713	20	10		DJCDRO
Cc1ccc(O)c([C@@H](C)[NH2+][C@@H]2CCSc3ccc(F)cc32)c1	ZINC000192738161	336261118	/nfs/dbraw/zinc/26/11/18/336261118.db2.gz	WKZQOQHGOPGTRR-MLGOLLRUSA-N	1	0	317.429	4.727	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](C)c1ccccc1O)c1ccc(-c2ccncc2)cc1	ZINC000183540625	337192088	/nfs/dbraw/zinc/19/20/88/337192088.db2.gz	AEIVXCBZUIYQSL-CVEARBPZSA-N	1	0	318.420	4.866	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccc(OC)cc1	ZINC000392239492	337194479	/nfs/dbraw/zinc/19/44/79/337194479.db2.gz	LXEFSVUEUVJRAY-LJQANCHMSA-N	1	0	322.452	4.736	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@@H]2CCOc3c(Cl)cccc32)c(O)c1	ZINC000185185283	337202593	/nfs/dbraw/zinc/20/25/93/337202593.db2.gz	CVUGNPRVWWUOPT-BLLLJJGKSA-N	1	0	317.816	4.528	20	10		DJCDRO
CC[C@@H]([NH2+]Cc1c(C)c2ccccc2n1C)c1ccccc1OC	ZINC000392577193	337263584	/nfs/dbraw/zinc/26/35/84/337263584.db2.gz	IYYDKHSOLKEPEE-GOSISDBHSA-N	1	0	322.452	4.736	20	10		DJCDRO
C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(Cl)cc1O	ZINC000527968740	337781247	/nfs/dbraw/zinc/78/12/47/337781247.db2.gz	SSJWBQOJPFLIJV-KZULUSFZSA-N	1	0	316.832	4.633	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+]Cc1cccc(Cl)c1F	ZINC000475199129	339441212	/nfs/dbraw/zinc/44/12/12/339441212.db2.gz	SFJOKXIHAQCKBS-UHFFFAOYSA-N	1	0	316.807	4.569	20	10		DJCDRO
CC[C@H]([NH2+]Cc1ccc(-c2cccnc2)cc1)c1ccccc1O	ZINC000156143060	522643042	/nfs/dbraw/zinc/64/30/42/522643042.db2.gz	LQVPOTLDNNBUIJ-FQEVSTJZSA-N	1	0	318.420	4.695	20	10		DJCDRO
CC[C@H]([NH2+][C@@H](C)c1ccc(N2CCCCC2)cc1)c1ccncc1	ZINC000163612668	522695132	/nfs/dbraw/zinc/69/51/32/522695132.db2.gz	PLVMZRZQOLRCHQ-UWJYYQICSA-N	1	0	323.484	4.874	20	10		DJCDRO
CC[C@H]([NH2+][C@H]1CCSc2ccc(F)cc21)c1ccccc1O	ZINC000192737176	522760153	/nfs/dbraw/zinc/76/01/53/522760153.db2.gz	REHBIUXLOGHLBH-HOTGVXAUSA-N	1	0	317.429	4.809	20	10		DJCDRO
Cc1c2ccccc2n(C)c1C[NH2+][C@H](c1ccccc1)C1CC1	ZINC000391536236	334961134	/nfs/dbraw/zinc/96/11/34/334961134.db2.gz	GONCZNOJEVBXRC-OAQYLSRUSA-N	1	0	304.437	4.728	20	10		DJCDRO
Cc1ccc(-c2nc(C[NH2+][C@@H](C)c3cc(C)ccc3O)co2)cc1	ZINC000273370071	130112641	/nfs/dbraw/zinc/11/26/41/130112641.db2.gz	CGNARHZLMPPGCX-HNNXBMFYSA-N	1	0	322.408	4.515	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@@H](c2ncccc2C)C(C)C)c(O)c1C	ZINC000273553226	130135465	/nfs/dbraw/zinc/13/54/65/130135465.db2.gz	GHXYYSNUOOTUPC-FUHWJXTLSA-N	1	0	312.457	4.760	20	10		DJCDRO
CCc1nc([C@H](C)[NH2+][C@@H](CC)c2ccc(N(C)C)cc2)cs1	ZINC000162351454	332935325	/nfs/dbraw/zinc/93/53/25/332935325.db2.gz	PTCDXZWOCYKWHM-BBRMVZONSA-N	1	0	317.502	4.573	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc(N3CCCC3)c2)c(O)c1	ZINC000185691577	333211996	/nfs/dbraw/zinc/21/19/96/333211996.db2.gz	PXNUNGHGRBBWFM-IRXDYDNUSA-N	1	0	324.468	4.713	20	10		DJCDRO
CC[C@@H]([NH2+][C@H](C)c1cccc(OC(F)F)c1)c1ccccc1O	ZINC000192720345	336259231	/nfs/dbraw/zinc/25/92/31/336259231.db2.gz	RWPUEAGLZJOHTB-MLGOLLRUSA-N	1	0	321.367	4.796	20	10		DJCDRO
Cc1ccc([C@H](C)[NH2+]Cc2ccc(-c3cccnc3)cc2)c(O)c1	ZINC000371841257	336914324	/nfs/dbraw/zinc/91/43/24/336914324.db2.gz	QENGBBMQLGUFFX-INIZCTEOSA-N	1	0	318.420	4.613	20	10		DJCDRO
Cc1cccc([C@H]([NH2+][C@H](C)c2ccccc2O)c2ccccn2)c1	ZINC000183633929	337193908	/nfs/dbraw/zinc/19/39/08/337193908.db2.gz	NCNOMLASVQEHGH-IERDGZPVSA-N	1	0	318.420	4.536	20	10		DJCDRO