smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Nc1c2ccccc2[nH+]c2c1[C@H]([NH+]1CCC(c3ccccc3)CC1)CCC2	ZINC000001913912	206899056	/nfs/dbraw/zinc/89/90/56/206899056.db2.gz	PGVCHVAHRSNQMJ-JOCHJYFZSA-N	2	2	357.501	5.074	1	0		FKAFLP
CCCCC[C@H](c1ccccc1)[N@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941634	211369923	/nfs/dbraw/zinc/36/99/23/211369923.db2.gz	JQEVLYWMVMKITJ-BHIFYINESA-N	2	2	356.941	5.736	1	0		FKAFLP
CCCCC[C@H](c1ccccc1)[N@@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941634	211369918	/nfs/dbraw/zinc/36/99/18/211369918.db2.gz	JQEVLYWMVMKITJ-BHIFYINESA-N	2	2	356.941	5.736	1	0		FKAFLP
CCCCCC[C@H](c1ccccc1)[N@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941646	211371109	/nfs/dbraw/zinc/37/11/09/211371109.db2.gz	PYVYQSFRPHLGSU-XPWALMASSA-N	2	2	370.968	6.126	1	0		FKAFLP
CCCCCC[C@H](c1ccccc1)[N@@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941646	211371106	/nfs/dbraw/zinc/37/11/06/211371106.db2.gz	PYVYQSFRPHLGSU-XPWALMASSA-N	2	2	370.968	6.126	1	0		FKAFLP
CCCCCC[C@@H](c1ccccc1)[N@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941649	211369585	/nfs/dbraw/zinc/36/95/85/211369585.db2.gz	PYVYQSFRPHLGSU-RJGXRXQPSA-N	2	2	370.968	6.126	1	0		FKAFLP
CCCCCC[C@@H](c1ccccc1)[N@@H+]1CC[C@H]1[C@H]([NH3+])c1cccc(Cl)c1	ZINC000022941649	211369582	/nfs/dbraw/zinc/36/95/82/211369582.db2.gz	PYVYQSFRPHLGSU-RJGXRXQPSA-N	2	2	370.968	6.126	1	0		FKAFLP
C[C@@H]([C@@H](c1ccc2cc(OCC(C)(C)C)ccc2c1)n1cc[nH+]c1)[NH+](C)C	ZINC000028344000	581094973	/nfs/dbraw/zinc/09/49/73/581094973.db2.gz	ZZGVWUSRXVYCSC-JTSKRJEESA-N	2	2	365.521	5.001	1	0		FKAFLP
C[C@H]([C@@H](c1ccc2cc(OCC(C)(C)C)ccc2c1)n1cc[nH+]c1)[NH+](C)C	ZINC000028344007	581094970	/nfs/dbraw/zinc/09/49/70/581094970.db2.gz	ZZGVWUSRXVYCSC-VGSWGCGISA-N	2	2	365.521	5.001	1	0		FKAFLP
C[C@@H]([C@H](c1ccc2cc(OCC(C)(C)C)ccc2c1)n1cc[nH+]c1)[NH+](C)C	ZINC000028344015	581094910	/nfs/dbraw/zinc/09/49/10/581094910.db2.gz	ZZGVWUSRXVYCSC-HTAPYJJXSA-N	2	2	365.521	5.001	1	0		FKAFLP
C[C@H]([C@H](c1ccc2cc(OCC(C)(C)C)ccc2c1)n1cc[nH+]c1)[NH+](C)C	ZINC000028344021	581094894	/nfs/dbraw/zinc/09/48/94/581094894.db2.gz	ZZGVWUSRXVYCSC-VGOFRKELSA-N	2	2	365.521	5.001	1	0		FKAFLP
CC(C)(C)[NH2+]Cc1cc(Nc2cc[nH+]c3cc(Cl)ccc23)ccc1Cl	ZINC000040429160	205070741	/nfs/dbraw/zinc/07/07/41/205070741.db2.gz	XOZXBUKMDWEZOX-UHFFFAOYSA-N	2	2	374.315	6.173	1	0		FKAFLP
CC[N@@H+](CCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@@H]1[NH+]1CCCC1	ZINC000040472003	205071485	/nfs/dbraw/zinc/07/14/85/205071485.db2.gz	FBINLPWZDBDJAV-UXHICEINSA-N	2	2	369.380	5.265	1	0		FKAFLP
CC[N@H+](CCc1ccc(Cl)c(Cl)c1)[C@@H]1CCCC[C@@H]1[NH+]1CCCC1	ZINC000040472003	205071482	/nfs/dbraw/zinc/07/14/82/205071482.db2.gz	FBINLPWZDBDJAV-UXHICEINSA-N	2	2	369.380	5.265	1	0		FKAFLP
Clc1ccc2c(Nc3ccc(Cl)c(C[NH+]4CCCC4)c3)cc[nH+]c2c1	ZINC000040953745	208277169	/nfs/dbraw/zinc/27/71/69/208277169.db2.gz	GKIIERMSLWYOBW-UHFFFAOYSA-N	2	2	372.299	5.881	1	0		FKAFLP
CC[NH+](CC)Cc1cc(C)n(Nc2cc[nH+]c3cc(Cl)ccc23)c1C	ZINC000040956395	208277192	/nfs/dbraw/zinc/27/71/92/208277192.db2.gz	ZCQJAXOTYHZSHR-UHFFFAOYSA-N	2	2	356.901	5.024	1	0		FKAFLP
Cc1cc(C[NH2+]C(C)(C)C)c(C)n1Nc1cc[nH+]c2cc(Cl)ccc12	ZINC000040956849	208276274	/nfs/dbraw/zinc/27/62/74/208276274.db2.gz	GQRKHKQUENIFSI-UHFFFAOYSA-N	2	2	356.901	5.070	1	0		FKAFLP
Clc1ccc(C[NH2+][C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)cc2)cc1	ZINC000066080220	205362702	/nfs/dbraw/zinc/36/27/02/205362702.db2.gz	FQHCMJGVOMGZJD-PMACEKPBSA-N	2	2	363.332	5.184	1	0		FKAFLP
Clc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)cc2)cc1	ZINC000066100619	221241676	/nfs/dbraw/zinc/24/16/76/221241676.db2.gz	FQHCMJGVOMGZJD-BGYRXZFFSA-N	2	2	363.332	5.184	1	0		FKAFLP
Clc1ccc(C[NH2+][C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(Cl)cc2)cc1	ZINC000066100620	221241901	/nfs/dbraw/zinc/24/19/01/221241901.db2.gz	FQHCMJGVOMGZJD-WOJBJXKFSA-N	2	2	363.332	5.184	1	0		FKAFLP
c1ccc2c(c1)[nH+]cc1c2N(CC[NH+]2CCCCC2)c2ccccc2S1	ZINC000098082841	132232096	/nfs/dbraw/zinc/23/20/96/132232096.db2.gz	RYZNSCDPERUSMN-UHFFFAOYSA-N	2	2	361.514	5.323	1	0		FKAFLP
CC[NH+]1CCN(C2=[NH+]c3ccc(C(C)C)cc3CC=C2c2ccccc2)CC1	ZINC000100764484	209217145	/nfs/dbraw/zinc/21/71/45/209217145.db2.gz	UDACHYARWVWOKC-UHFFFAOYSA-N	2	2	373.544	5.117	1	0		FKAFLP
C[NH+](C)[C@H]1CC[C@@H](c2c[nH]c3ccc(NC(=[NH2+])c4cccs4)cc32)CC1	ZINC000101509258	222278314	/nfs/dbraw/zinc/27/83/14/222278314.db2.gz	WNDQUNBYWXFFGU-KOMQPUFPSA-N	2	2	366.534	5.255	1	0		FKAFLP
CC[NH2+][C@H]1CC[C@H](c2c[nH]c3ccc(NC(=[NH2+])c4cccs4)cc32)CC1	ZINC000101509274	209227341	/nfs/dbraw/zinc/22/73/41/209227341.db2.gz	WKNJJZDFDCGVSZ-GASCZTMLSA-N	2	2	366.534	5.303	1	0		FKAFLP