smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@H+](CCC[NH3+])Cc1ccc(N)cc1	1262487498	1170131215	/nfs/dbraw/zinc/13/12/15/1170131215.db2.gz	VPNFHHPRVCDHCD-UHFFFAOYSA-N	2	0	193.294	1.049	20	10		ADCDRP
C[C@@H](CC[NH3+])[NH2+]Cc1ccc(N)cc1	1334753935	1170344233	/nfs/dbraw/zinc/34/42/33/1170344233.db2.gz	JEQBRQFMGGMVJB-VIFPVBQESA-N	2	0	193.294	1.096	20	10		ADCDRP
C[C@@H]([NH3+])CN(C)Cc1ccc(N)cc1	1334753111	1170344987	/nfs/dbraw/zinc/34/49/87/1170344987.db2.gz	AQBNSPZSQDCYQV-SECBINFHSA-N	2	0	193.294	1.048	20	10		ADCDRP
C[C@H](CC[NH3+])[NH2+]Cc1ccc(N)cc1	1334753934	1170345104	/nfs/dbraw/zinc/34/51/04/1170345104.db2.gz	JEQBRQFMGGMVJB-SECBINFHSA-N	2	0	193.294	1.096	20	10		ADCDRP
Nc1ccc(C[NH2+]CCCC[NH3+])cc1	1352790301	1170532858	/nfs/dbraw/zinc/53/28/58/1170532858.db2.gz	QHQHHJGZKQGVJX-UHFFFAOYSA-N	2	0	193.294	1.097	20	10		ADCDRP
C[NH2+]CCN(C)Cc1ccccc1O	69801185	572140774	/nfs/dbraw/zinc/14/07/74/572140774.db2.gz	ZUMKDMXXCFAFBH-UHFFFAOYSA-N	2	0	194.278	1.043	20	10		ADCDRP
Cc1ccc(O)c([C@H](C)[NH2+]CCN)c1	37712790	572178859	/nfs/dbraw/zinc/17/88/59/572178859.db2.gz	BORVKAZEPDBODR-VIFPVBQESA-N	2	0	194.278	1.310	20	10		ADCDRP
C[C@H]([NH2+]CCN)c1ccccc1O	37712366	572179818	/nfs/dbraw/zinc/17/98/18/572179818.db2.gz	KEDOKCHXSIAHSP-QMMMGPOBSA-N	2	0	180.251	1.002	20	10		ADCDRP
Cc1ccc(O)c([C@@H](C)[NH2+]CCN)c1	37712789	572179987	/nfs/dbraw/zinc/17/99/87/572179987.db2.gz	BORVKAZEPDBODR-SECBINFHSA-N	2	0	194.278	1.310	20	10		ADCDRP
C[C@H](C[NH3+])C[NH2+]Cc1ccccc1O	308560772	573335487	/nfs/dbraw/zinc/33/54/87/573335487.db2.gz	FCKKVHIORDSHNL-SECBINFHSA-N	2	0	194.278	1.077	20	10		ADCDRP
C[C@H]([NH3+])C[NH2+][C@@H](C)c1ccccc1O	817972521	583001079	/nfs/dbraw/zinc/00/10/79/583001079.db2.gz	MKBWHEAURLGGBD-IUCAKERBSA-N	2	0	194.278	1.390	20	10		ADCDRP
C[C@@H]([NH3+])C[NH2+][C@H](C)c1ccccc1O	817972522	583001537	/nfs/dbraw/zinc/00/15/37/583001537.db2.gz	MKBWHEAURLGGBD-RKDXNWHRSA-N	2	0	194.278	1.390	20	10		ADCDRP
C[C@H]([NH3+])C[NH2+][C@H](C)c1ccccc1O	817972520	583001671	/nfs/dbraw/zinc/00/16/71/583001671.db2.gz	MKBWHEAURLGGBD-DTWKUNHWSA-N	2	0	194.278	1.390	20	10		ADCDRP
C[C@H]([NH2+]C[C@@H](C)[NH3+])c1ccccc1O	817972519	583001696	/nfs/dbraw/zinc/00/16/96/583001696.db2.gz	MKBWHEAURLGGBD-BDAKNGLRSA-N	2	0	194.278	1.390	20	10		ADCDRP
CC[C@@H]([NH3+])C[NH2+]Cc1ccccc1O	841071400	583111786	/nfs/dbraw/zinc/11/17/86/583111786.db2.gz	FVZHKKNFLOAZAC-SNVBAGLBSA-N	2	0	194.278	1.219	20	10		ADCDRP
CC[C@H]([NH3+])C[NH2+]Cc1ccccc1O	841071399	583111873	/nfs/dbraw/zinc/11/18/73/583111873.db2.gz	FVZHKKNFLOAZAC-JTQLQIEISA-N	2	0	194.278	1.219	20	10		ADCDRP
C[C@H](CC[NH3+])[NH2+]Cc1ccccc1O	841050005	583112454	/nfs/dbraw/zinc/11/24/54/583112454.db2.gz	CASRBYZAFFWYGK-SECBINFHSA-N	2	0	194.278	1.219	20	10		ADCDRP
C[C@@H](CC[NH3+])[NH2+]Cc1ccccc1O	841050006	583112788	/nfs/dbraw/zinc/11/27/88/583112788.db2.gz	CASRBYZAFFWYGK-VIFPVBQESA-N	2	0	194.278	1.219	20	10		ADCDRP
Nc1ccc(N[C@@H]2CCC[NH2+]C2)cc1	205453414	583326367	/nfs/dbraw/zinc/32/63/67/583326367.db2.gz	OIQNGWBOULPKDR-LLVKDONJSA-N	2	0	191.278	1.433	20	10		ADCDRP
Nc1ccc(N[C@H]2CCC[NH2+]C2)cc1	205453427	583326625	/nfs/dbraw/zinc/32/66/25/583326625.db2.gz	OIQNGWBOULPKDR-NSHDSACASA-N	2	0	191.278	1.433	20	10		ADCDRP
C[C@@H](C[NH3+])C[NH2+]Cc1ccccc1O	308560773	630015740	/nfs/dbraw/zinc/01/57/40/630015740.db2.gz	FCKKVHIORDSHNL-VIFPVBQESA-N	2	0	194.278	1.077	20	10		ADCDRP
C[NH2+]CCC[NH2+]Cc1ccccc1O	83342162	630836541	/nfs/dbraw/zinc/83/65/41/630836541.db2.gz	TYYVIUPTYRAVTD-UHFFFAOYSA-N	2	0	194.278	1.091	20	10		ADCDRP
C[N@H+](CCC[NH3+])Cc1ccccc1O	227743621	630858726	/nfs/dbraw/zinc/85/87/26/630858726.db2.gz	XKQHNWIVVROTKH-UHFFFAOYSA-N	2	0	194.278	1.173	20	10		ADCDRP