smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131598	1079151249	/nfs/dbraw/zinc/15/12/49/1079151249.db2.gz	WHBIHSIIFRPUSH-HXKBJWFLSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131598	1079151253	/nfs/dbraw/zinc/15/12/53/1079151253.db2.gz	WHBIHSIIFRPUSH-HXKBJWFLSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[N@H+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131598	1079151255	/nfs/dbraw/zinc/15/12/55/1079151255.db2.gz	WHBIHSIIFRPUSH-HXKBJWFLSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[N@@H+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131598	1079151260	/nfs/dbraw/zinc/15/12/60/1079151260.db2.gz	WHBIHSIIFRPUSH-HXKBJWFLSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131600	1079151608	/nfs/dbraw/zinc/15/16/08/1079151608.db2.gz	WHBIHSIIFRPUSH-OUMCCJGNSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@@H+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131600	1079151612	/nfs/dbraw/zinc/15/16/12/1079151612.db2.gz	WHBIHSIIFRPUSH-OUMCCJGNSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[N@H+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131600	1079151615	/nfs/dbraw/zinc/15/16/15/1079151615.db2.gz	WHBIHSIIFRPUSH-OUMCCJGNSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@@H](N1CCC3(C[N@@H+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131600	1079151617	/nfs/dbraw/zinc/15/16/17/1079151617.db2.gz	WHBIHSIIFRPUSH-OUMCCJGNSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131599	1079151478	/nfs/dbraw/zinc/15/14/78/1079151478.db2.gz	WHBIHSIIFRPUSH-MTQWNXOMSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131599	1079151482	/nfs/dbraw/zinc/15/14/82/1079151482.db2.gz	WHBIHSIIFRPUSH-MTQWNXOMSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[N@H+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131599	1079151486	/nfs/dbraw/zinc/15/14/86/1079151486.db2.gz	WHBIHSIIFRPUSH-MTQWNXOMSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[N@@H+](Cc4cccnc4)C[C@]34CCNC4=O)CC1)C2	ZINC001169131599	1079151490	/nfs/dbraw/zinc/15/14/90/1079151490.db2.gz	WHBIHSIIFRPUSH-MTQWNXOMSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131601	1079151355	/nfs/dbraw/zinc/15/13/55/1079151355.db2.gz	WHBIHSIIFRPUSH-WTEVXDJOSA-N	2	3	423.605	2.111	20	0		HEADHP
C[N@@H+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[NH+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131601	1079151362	/nfs/dbraw/zinc/15/13/62/1079151362.db2.gz	WHBIHSIIFRPUSH-WTEVXDJOSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[N@H+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131601	1079151364	/nfs/dbraw/zinc/15/13/64/1079151364.db2.gz	WHBIHSIIFRPUSH-WTEVXDJOSA-N	2	3	423.605	2.111	20	0		HEADHP
C[NH+]1[C@@H]2CC[C@H]1C[C@H](N1CCC3(C[N@@H+](Cc4cccnc4)C[C@@]34CCNC4=O)CC1)C2	ZINC001169131601	1079151368	/nfs/dbraw/zinc/15/13/68/1079151368.db2.gz	WHBIHSIIFRPUSH-WTEVXDJOSA-N	2	3	423.605	2.111	20	0		HEADHP