smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCOc1cccc(C[N@@H+](C)C[C@H]2CCC[NH+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109239	849971749	/nfs/dbraw/zinc/97/17/49/849971749.db2.gz	KUZICGMPDPCKQW-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CCOc1cccc(C[NH+](C)C[C@H]2CCC[N@H+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109239	849971754	/nfs/dbraw/zinc/97/17/54/849971754.db2.gz	KUZICGMPDPCKQW-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CCOc1cccc(C[NH+](C)C[C@H]2CCC[N@@H+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109239	849971763	/nfs/dbraw/zinc/97/17/63/849971763.db2.gz	KUZICGMPDPCKQW-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
COc1ccc(CC[N@H+]2CCC[C@@H](C[NH+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061115	558871112	/nfs/dbraw/zinc/87/11/12/558871112.db2.gz	SZSIGUSJAAIMHM-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
COc1ccc(CC[NH+]2CCC[C@@H](C[N@H+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061115	558871115	/nfs/dbraw/zinc/87/11/15/558871115.db2.gz	SZSIGUSJAAIMHM-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
COc1ccc(CC[NH+]2CCC[C@@H](C[N@@H+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061115	558871118	/nfs/dbraw/zinc/87/11/18/558871118.db2.gz	SZSIGUSJAAIMHM-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
Cc1c(O)c(C[N@H+](C)C[C@@H]2CCC[NH+]3CCCC[C@H]23)cc2c3c(c(=O)oc12)CCCC3	ZINC000524731004	569212062	/nfs/dbraw/zinc/21/20/62/569212062.db2.gz	GIUNMUSJRWBYGC-FDDCHVKYSA-N	2	1	424.585	4.382	50	10		HICAMP
Cc1c(O)c(C[N@@H+](C)C[C@@H]2CCC[NH+]3CCCC[C@H]23)cc2c3c(c(=O)oc12)CCCC3	ZINC000524731004	569212063	/nfs/dbraw/zinc/21/20/63/569212063.db2.gz	GIUNMUSJRWBYGC-FDDCHVKYSA-N	2	1	424.585	4.382	50	10		HICAMP
Cc1c(O)c(C[NH+](C)C[C@@H]2CCC[N@@H+]3CCCC[C@H]23)cc2c3c(c(=O)oc12)CCCC3	ZINC000524731004	569212064	/nfs/dbraw/zinc/21/20/64/569212064.db2.gz	GIUNMUSJRWBYGC-FDDCHVKYSA-N	2	1	424.585	4.382	50	10		HICAMP
Cc1c(O)c(C[NH+](C)C[C@@H]2CCC[N@H+]3CCCC[C@H]23)cc2c3c(c(=O)oc12)CCCC3	ZINC000524731004	569212066	/nfs/dbraw/zinc/21/20/66/569212066.db2.gz	GIUNMUSJRWBYGC-FDDCHVKYSA-N	2	1	424.585	4.382	50	10		HICAMP
CCOc1cccc(C[N@@H+](C)CC2CC[NH+](CCc3ccc(OC)cc3)CC2)c1O	ZINC000012459674	568756495	/nfs/dbraw/zinc/75/64/95/568756495.db2.gz	IHHXSMQLSYLJJM-UHFFFAOYSA-N	2	1	412.574	4.186	50	10		HICAMP
CCCc1cc(=O)oc2c(C)c(O)c(C[N@H+](C)C[C@@H]3CCC[NH+]4CCCC[C@H]34)cc12	ZINC000524730576	569051675	/nfs/dbraw/zinc/05/16/75/569051675.db2.gz	NTJKIVSTSXVEIE-SIKLNZKXSA-N	2	1	412.574	4.456	50	10		HICAMP
CCCc1cc(=O)oc2c(C)c(O)c(C[N@@H+](C)C[C@@H]3CCC[NH+]4CCCC[C@H]34)cc12	ZINC000524730576	569051676	/nfs/dbraw/zinc/05/16/76/569051676.db2.gz	NTJKIVSTSXVEIE-SIKLNZKXSA-N	2	1	412.574	4.456	50	10		HICAMP
CCCc1cc(=O)oc2c(C)c(O)c(C[NH+](C)C[C@@H]3CCC[N@@H+]4CCCC[C@H]34)cc12	ZINC000524730576	569051677	/nfs/dbraw/zinc/05/16/77/569051677.db2.gz	NTJKIVSTSXVEIE-SIKLNZKXSA-N	2	1	412.574	4.456	50	10		HICAMP
CCCc1cc(=O)oc2c(C)c(O)c(C[NH+](C)C[C@@H]3CCC[N@H+]4CCCC[C@H]34)cc12	ZINC000524730576	569051678	/nfs/dbraw/zinc/05/16/78/569051678.db2.gz	NTJKIVSTSXVEIE-SIKLNZKXSA-N	2	1	412.574	4.456	50	10		HICAMP
COc1ccc(CC[N@H+]2CCC[C@H](C[NH+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061116	558871187	/nfs/dbraw/zinc/87/11/87/558871187.db2.gz	SZSIGUSJAAIMHM-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1ccc(CC[NH+]2CCC[C@H](C[N@H+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061116	558871191	/nfs/dbraw/zinc/87/11/91/558871191.db2.gz	SZSIGUSJAAIMHM-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1ccc(CC[NH+]2CCC[C@H](C[N@@H+](C)Cc3cc(Cl)ccc3O)C2)cc1	ZINC000055061116	558871194	/nfs/dbraw/zinc/87/11/94/558871194.db2.gz	SZSIGUSJAAIMHM-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1cccc(C[N@@H+](C)CC2CC[NH+](CCc3ccc(Cl)cc3)CC2)c1O	ZINC000011817863	558281205	/nfs/dbraw/zinc/28/12/05/558281205.db2.gz	YSJXSZUFSYXOCG-UHFFFAOYSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1ccc(CC[NH+]2CCC(C[N@@H+](C)Cc3cc(Cl)ccc3O)CC2)cc1	ZINC000012705024	558449548	/nfs/dbraw/zinc/44/95/48/558449548.db2.gz	WPIUPQDCEJEJCK-UHFFFAOYSA-N	2	1	402.966	4.441	50	10		HICAMP
CC[N@@H+](Cc1cc(OC)ccc1O)C[C@@H]1CCC[NH+](CCc2cccc(F)c2)C1	ZINC000055090038	849968203	/nfs/dbraw/zinc/96/82/03/849968203.db2.gz	BUFVIFVPLNFVLS-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[N@H+](Cc1cc(OC)ccc1O)C[C@@H]1CCC[NH+](CCc2cccc(F)c2)C1	ZINC000055090038	849968210	/nfs/dbraw/zinc/96/82/10/849968210.db2.gz	BUFVIFVPLNFVLS-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[NH+](Cc1cc(OC)ccc1O)C[C@@H]1CCC[N@H+](CCc2cccc(F)c2)C1	ZINC000055090038	849968221	/nfs/dbraw/zinc/96/82/21/849968221.db2.gz	BUFVIFVPLNFVLS-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[NH+](Cc1cc(OC)ccc1O)C[C@@H]1CCC[N@@H+](CCc2cccc(F)c2)C1	ZINC000055090038	849968229	/nfs/dbraw/zinc/96/82/29/849968229.db2.gz	BUFVIFVPLNFVLS-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
COc1cccc(C[N@@H+](C)C[C@@H]2CCC[NH+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715180	845885183	/nfs/dbraw/zinc/88/51/83/845885183.db2.gz	CXQHGIZNIXYSES-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
COc1cccc(C[NH+](C)C[C@@H]2CCC[N@H+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715180	845885187	/nfs/dbraw/zinc/88/51/87/845885187.db2.gz	CXQHGIZNIXYSES-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
COc1cccc(C[NH+](C)C[C@@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715180	845885190	/nfs/dbraw/zinc/88/51/90/845885190.db2.gz	CXQHGIZNIXYSES-IBGZPJMESA-N	2	1	402.966	4.441	50	10		HICAMP
CC[N@@H+](Cc1cc(OC)ccc1O)C[C@H]1CCC[NH+](CCc2cccc(F)c2)C1	ZINC000055090042	849967871	/nfs/dbraw/zinc/96/78/71/849967871.db2.gz	BUFVIFVPLNFVLS-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[N@H+](Cc1cc(OC)ccc1O)C[C@H]1CCC[NH+](CCc2cccc(F)c2)C1	ZINC000055090042	849967885	/nfs/dbraw/zinc/96/78/85/849967885.db2.gz	BUFVIFVPLNFVLS-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[NH+](Cc1cc(OC)ccc1O)C[C@H]1CCC[N@H+](CCc2cccc(F)c2)C1	ZINC000055090042	849967903	/nfs/dbraw/zinc/96/79/03/849967903.db2.gz	BUFVIFVPLNFVLS-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CC[NH+](Cc1cc(OC)ccc1O)C[C@H]1CCC[N@@H+](CCc2cccc(F)c2)C1	ZINC000055090042	849967920	/nfs/dbraw/zinc/96/79/20/849967920.db2.gz	BUFVIFVPLNFVLS-HXUWFJFHSA-N	2	1	400.538	4.317	50	10		HICAMP
CCOc1cccc(C[N@@H+](C)C[C@@H]2CCC[NH+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109237	849972111	/nfs/dbraw/zinc/97/21/11/849972111.db2.gz	KUZICGMPDPCKQW-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
CCOc1cccc(C[NH+](C)C[C@@H]2CCC[N@H+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109237	849972115	/nfs/dbraw/zinc/97/21/15/849972115.db2.gz	KUZICGMPDPCKQW-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
CCOc1cccc(C[NH+](C)C[C@@H]2CCC[N@@H+](CCc3ccc(F)cc3)C2)c1O	ZINC000055109237	849972120	/nfs/dbraw/zinc/97/21/20/849972120.db2.gz	KUZICGMPDPCKQW-FQEVSTJZSA-N	2	1	400.538	4.317	50	10		HICAMP
COc1cccc(C[N@@H+](C)C[C@H]2CCC[NH+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715183	845885314	/nfs/dbraw/zinc/88/53/14/845885314.db2.gz	CXQHGIZNIXYSES-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1cccc(C[NH+](C)C[C@H]2CCC[N@H+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715183	845885317	/nfs/dbraw/zinc/88/53/17/845885317.db2.gz	CXQHGIZNIXYSES-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
COc1cccc(C[NH+](C)C[C@H]2CCC[N@@H+](CCc3ccc(Cl)cc3)C2)c1O	ZINC000012715183	845885320	/nfs/dbraw/zinc/88/53/20/845885320.db2.gz	CXQHGIZNIXYSES-LJQANCHMSA-N	2	1	402.966	4.441	50	10		HICAMP
C[N@H+](CC(=O)Nc1ccc(C[NH+]2CCCC2)cc1)Cc1ccc(N2CCCCC2)cc1	ZINC000012554105	132363427	/nfs/dbraw/zinc/36/34/27/132363427.db2.gz	CFLBQIMKANLRSA-UHFFFAOYSA-N	2	1	420.601	4.343	50	10		HICAMP
C[N@@H+](CC(=O)Nc1ccc(C[NH+]2CCCC2)cc1)Cc1ccc(N2CCCCC2)cc1	ZINC000012554105	132363429	/nfs/dbraw/zinc/36/34/29/132363429.db2.gz	CFLBQIMKANLRSA-UHFFFAOYSA-N	2	1	420.601	4.343	50	10		HICAMP