smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1CC[NH+](c2ccc(N)cc2)CC1	445022	132178322	/nfs/dbraw/zinc/17/83/22/132178322.db2.gz	UZQJQJNKYMSTCP-UHFFFAOYSA-N	1	1	190.290	2.505	50	10	in-vitro	AFCAMO
C[C@H]1CCC[N@@H+](c2ccc(N)cc2)C1	819577	132178955	/nfs/dbraw/zinc/17/89/55/132178955.db2.gz	IKOVMWFMUDURMX-JTQLQIEISA-N	1	1	190.290	2.505	50	10		AFCAMO
C[C@H]1CCC[N@H+](c2ccc(N)cc2)C1	819577	132178959	/nfs/dbraw/zinc/17/89/59/132178959.db2.gz	IKOVMWFMUDURMX-JTQLQIEISA-N	1	1	190.290	2.505	50	10		AFCAMO
C[C@@H]1CCC[N@@H+](c2ccc(N)cc2)C1	819578	132179392	/nfs/dbraw/zinc/17/93/92/132179392.db2.gz	IKOVMWFMUDURMX-SNVBAGLBSA-N	1	1	190.290	2.505	50	10		AFCAMO
C[C@@H]1CCC[N@H+](c2ccc(N)cc2)C1	819578	132179396	/nfs/dbraw/zinc/17/93/96/132179396.db2.gz	IKOVMWFMUDURMX-SNVBAGLBSA-N	1	1	190.290	2.505	50	10		AFCAMO
C[C@@H]1CCCC[N@@H+]1c1ccc(N)cc1	4384693	132180240	/nfs/dbraw/zinc/18/02/40/132180240.db2.gz	SBFZFFUJVDOEGX-SNVBAGLBSA-N	1	1	190.290	2.648	50	10		AFCAMO
C[C@@H]1CCCC[N@H+]1c1ccc(N)cc1	4384693	132180242	/nfs/dbraw/zinc/18/02/42/132180242.db2.gz	SBFZFFUJVDOEGX-SNVBAGLBSA-N	1	1	190.290	2.648	50	10		AFCAMO
C[C@H]1CCCC[N@@H+]1c1ccc(N)cc1	4384694	132180305	/nfs/dbraw/zinc/18/03/05/132180305.db2.gz	SBFZFFUJVDOEGX-JTQLQIEISA-N	1	1	190.290	2.648	50	10		AFCAMO
C[C@H]1CCCC[N@H+]1c1ccc(N)cc1	4384694	132180309	/nfs/dbraw/zinc/18/03/09/132180309.db2.gz	SBFZFFUJVDOEGX-JTQLQIEISA-N	1	1	190.290	2.648	50	10		AFCAMO
CCCC[N@H+](C)c1ccc(N)cc1	19386099	343053982	/nfs/dbraw/zinc/05/39/82/343053982.db2.gz	YEMIAPOPTRUFTL-UHFFFAOYSA-N	1	1	178.279	2.505	50	10	in-vitro	AFCAMO
CCCC[N@@H+](C)c1ccc(N)cc1	19386099	343053983	/nfs/dbraw/zinc/05/39/83/343053983.db2.gz	YEMIAPOPTRUFTL-UHFFFAOYSA-N	1	1	178.279	2.505	50	10	in-vitro	AFCAMO
CC[N@H+](c1ccc(N)cc1)C(C)C	57546	167195217	/nfs/dbraw/zinc/19/52/17/167195217.db2.gz	HKGOSYWNUBEMMH-UHFFFAOYSA-N	1	1	178.279	2.504	50	10	in-vitro	AFCAMO
Nc1ccc([NH2+]CC2CCCC2)cc1	37258328	169293027	/nfs/dbraw/zinc/29/30/27/169293027.db2.gz	LIVDXLJLKYOKSR-UHFFFAOYSA-N	1	1	190.290	2.871	50	10		AFCAMO