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@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1O	ZINC000038038939	213195849	/nfs/dbraw/zinc/19/58/49/213195849.db2.gz	SBFHJEQSKMOJKJ-HNNXBMFYSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+]Cc1cc(F)ccc1Br)c1ccccc1O	ZINC000038038940	202092964	/nfs/dbraw/zinc/09/29/64/202092964.db2.gz	SBFHJEQSKMOJKJ-OAHLLOKOSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+]Cc1ccccc1F)c1cc(Br)ccc1O	ZINC000019950176	212089696	/nfs/dbraw/zinc/08/96/96/212089696.db2.gz	URMOULTXHALTRW-OAHLLOKOSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+]Cc1ccc(F)cc1)c1cc(Br)ccc1O	ZINC000019943843	212088266	/nfs/dbraw/zinc/08/82/66/212088266.db2.gz	QDDRERZJAHOEHA-OAHLLOKOSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+]Cc1ccc(C)cc1)c1cc(Br)ccc1O	ZINC000019962547	212090752	/nfs/dbraw/zinc/09/07/52/212090752.db2.gz	MZTITMIIDDQQBI-MRXNPFEDSA-N	1	0	334.257	4.704	20	10		EJCDRO
CC[C@H]([NH2+][C@H](C)c1ccccc1)c1cc(Br)ccc1O	ZINC000019878462	212078657	/nfs/dbraw/zinc/07/86/57/212078657.db2.gz	RWZNEQYDYXUUGL-WBMJQRKESA-N	1	0	334.257	4.957	20	10		EJCDRO
CC[C@H]([NH2+][C@@H](C)c1ccccc1)c1cc(Br)ccc1O	ZINC000019878460	212078167	/nfs/dbraw/zinc/07/81/67/212078167.db2.gz	RWZNEQYDYXUUGL-LRDDRELGSA-N	1	0	334.257	4.957	20	10		EJCDRO
COc1ccc2ccc(O)c(C[N@H+]3CC=C(c4ccccc4)CC3)c2c1	ZINC000003335418	210010208	/nfs/dbraw/zinc/01/02/08/210010208.db2.gz	UGYXHOTZDBRRKS-UHFFFAOYSA-N	1	0	345.442	4.843	20	10		EJCDRO
Cc1ccc([C@@H](C)[NH2+][C@@H](c2ccccc2)c2ccccn2)c(O)c1C	ZINC000359971382	201120935	/nfs/dbraw/zinc/12/09/35/201120935.db2.gz	BQXSCSFSHZOIRT-UTKZUKDTSA-N	1	0	332.447	4.844	20	10		EJCDRO
CC[C@H]([NH2+]Cc1ccccc1F)c1cc(Br)ccc1O	ZINC000019950180	212089312	/nfs/dbraw/zinc/08/93/12/212089312.db2.gz	URMOULTXHALTRW-HNNXBMFYSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+][C@H](C)c1ccccc1)c1cc(Br)ccc1O	ZINC000019878461	212078673	/nfs/dbraw/zinc/07/86/73/212078673.db2.gz	RWZNEQYDYXUUGL-MLGOLLRUSA-N	1	0	334.257	4.957	20	10		EJCDRO
CC[C@H]([NH2+]Cc1ccc(C)cc1)c1cc(Br)ccc1O	ZINC000019962549	212090905	/nfs/dbraw/zinc/09/09/05/212090905.db2.gz	MZTITMIIDDQQBI-INIZCTEOSA-N	1	0	334.257	4.704	20	10		EJCDRO
CC[C@H]([NH2+]Cc1ccc(F)cc1)c1cc(Br)ccc1O	ZINC000019943846	212088711	/nfs/dbraw/zinc/08/87/11/212088711.db2.gz	QDDRERZJAHOEHA-HNNXBMFYSA-N	1	0	338.220	4.535	20	10		EJCDRO
CC[C@@H]([NH2+][C@@H](C)c1ccccc1)c1cc(Br)ccc1O	ZINC000019878459	212078307	/nfs/dbraw/zinc/07/83/07/212078307.db2.gz	RWZNEQYDYXUUGL-BLLLJJGKSA-N	1	0	334.257	4.957	20	10		EJCDRO