smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)C(=O)N1CCC[C@H](C(N)=[NH2+])C1	217357389	166424059	/nfs/dbraw/zinc/42/40/59/166424059.db2.gz	OCGLDBMRDMWRMW-QMMMGPOBSA-N	1	0	197.282	0.817	40	70		ACIBRO
CCC(=O)N1CCC(C(N)=[NH2+])CC1	217355619	166761148	/nfs/dbraw/zinc/76/11/48/166761148.db2.gz	IAXRPSGJESBWLT-UHFFFAOYSA-N	1	0	183.255	0.571	40	70		ACIBRO
COc1ccc(C)[n+](C)n1	217766089	168246499	/nfs/dbraw/zinc/24/64/99/168246499.db2.gz	LYNVLRBVJKHHBW-UHFFFAOYSA-N	1	0	139.178	0.223	40	70		ACIBRO
NC(=[NH2+])COc1ccc(NC=O)cc1	217370726	169135678	/nfs/dbraw/zinc/13/56/78/169135678.db2.gz	PUVYCONRFFWYPC-UHFFFAOYSA-N	1	0	193.206	0.570	40	70		ACIBRO
NC(=[NH2+])COc1cccc(NC=O)c1	217369704	169136042	/nfs/dbraw/zinc/13/60/42/169136042.db2.gz	UHGLPUXBUQYTEN-UHFFFAOYSA-N	1	0	193.206	0.570	40	70		ACIBRO
NC(=[NH2+])COc1ccccc1NC=O	217370287	169136183	/nfs/dbraw/zinc/13/61/83/169136183.db2.gz	FKUKUWLUUMYNOL-UHFFFAOYSA-N	1	0	193.206	0.570	40	70		ACIBRO
NC(=[NH2+])C1(COC2CCOCC2)CC1	217796182	169136694	/nfs/dbraw/zinc/13/66/94/169136694.db2.gz	HOQQYZLNPJIHLM-UHFFFAOYSA-N	1	0	198.266	0.898	40	70		ACIBRO
NC(=[NH2+])[C@H]1CCCN(C(=O)C2CC2)C1	217357768	169139329	/nfs/dbraw/zinc/13/93/29/169139329.db2.gz	OPDABJRPLKUJHM-QMMMGPOBSA-N	1	0	195.266	0.571	40	70		ACIBRO
NC(=[NH2+])[C@@H]1CCCN(C(=O)C2CC2)C1	217357687	169139457	/nfs/dbraw/zinc/13/94/57/169139457.db2.gz	OPDABJRPLKUJHM-MRVPVSSYSA-N	1	0	195.266	0.571	40	70		ACIBRO
Cc1[nH]c([SiH2]C(C)C)[nH+]c1C	216114951	344395094	/nfs/dbraw/zinc/39/50/94/344395094.db2.gz	IXMIGNQDEUCJIU-UHFFFAOYSA-N	1	0	168.316	0.649	40	70		ACIBRO
CCC(=O)N1CCC[C@@H](C(N)=[NH2+])C1	217357151	344401269	/nfs/dbraw/zinc/40/12/69/344401269.db2.gz	TYKXMKREDJPGRU-SSDOTTSWSA-N	1	0	183.255	0.571	40	70		ACIBRO
CCC(=O)N1CCC[C@H](C(N)=[NH2+])C1	217357224	344401358	/nfs/dbraw/zinc/40/13/58/344401358.db2.gz	TYKXMKREDJPGRU-ZETCQYMHSA-N	1	0	183.255	0.571	40	70		ACIBRO
CC(C)C(=O)N1CCC[C@@H](C(N)=[NH2+])C1	217357321	371710306	/nfs/dbraw/zinc/71/03/06/371710306.db2.gz	OCGLDBMRDMWRMW-MRVPVSSYSA-N	1	0	197.282	0.817	40	70		ACIBRO
CC(C)C(=O)N1CCC(C(N)=[NH2+])CC1	217355723	371710398	/nfs/dbraw/zinc/71/03/98/371710398.db2.gz	JTSSWZLJOFBPQP-UHFFFAOYSA-N	1	0	197.282	0.817	40	70		ACIBRO