smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C(#CC[NH+]1CCCCCC1)CN1CCCCCC1	ZINC000001599826	166226306	/nfs/dbraw/zinc/22/63/06/166226306.db2.gz	SPHPCGYXRFWXPR-UHFFFAOYSA-N	1	3	248.414	2.742	40	30		BFEBHO
C[C@@H]1CC[C@H](C)N1CC#CC[N@H+]1[C@H](C)CC[C@@H]1C	ZINC000005742842	177186455	/nfs/dbraw/zinc/18/64/55/177186455.db2.gz	ZOBJQBSGGXBNDB-GEEKYZPCSA-N	1	3	248.414	2.735	40	30		BFEBHO
C[C@@H]1CC[C@H](C)N1CC#CC[N@@H+]1[C@H](C)CC[C@@H]1C	ZINC000005742842	177186457	/nfs/dbraw/zinc/18/64/57/177186457.db2.gz	ZOBJQBSGGXBNDB-GEEKYZPCSA-N	1	3	248.414	2.735	40	30		BFEBHO
C[C@H]1CCCCN1CC#CC[N@@H+]1CCCC[C@@H]1C	ZINC000005742839	177073753	/nfs/dbraw/zinc/07/37/53/177073753.db2.gz	DTWOOFHEPRSPPW-HOTGVXAUSA-N	1	3	248.414	2.739	40	30		BFEBHO
C[C@H]1CCCCN1CC#CC[N@H+]1CCCC[C@@H]1C	ZINC000005742839	177073754	/nfs/dbraw/zinc/07/37/54/177073754.db2.gz	DTWOOFHEPRSPPW-HOTGVXAUSA-N	1	3	248.414	2.739	40	30		BFEBHO
C[C@@H]1CCCC[N@H+]1CC#CCN1CCCC[C@@H]1C	ZINC000005742837	177074435	/nfs/dbraw/zinc/07/44/35/177074435.db2.gz	DTWOOFHEPRSPPW-IYBDPMFKSA-N	1	3	248.414	2.739	40	30		BFEBHO
C[C@@H]1CCCC[N@@H+]1CC#CCN1CCCC[C@@H]1C	ZINC000005742837	177074437	/nfs/dbraw/zinc/07/44/37/177074437.db2.gz	DTWOOFHEPRSPPW-IYBDPMFKSA-N	1	3	248.414	2.739	40	30		BFEBHO
C[C@@H]1CCCCN1CC#CC[N@@H+]1CCCC[C@@H]1C	ZINC000005742837	177074439	/nfs/dbraw/zinc/07/44/39/177074439.db2.gz	DTWOOFHEPRSPPW-IYBDPMFKSA-N	1	3	248.414	2.739	40	30		BFEBHO
C[C@@H]1CCCCN1CC#CC[N@H+]1CCCC[C@@H]1C	ZINC000005742837	177074440	/nfs/dbraw/zinc/07/44/40/177074440.db2.gz	DTWOOFHEPRSPPW-IYBDPMFKSA-N	1	3	248.414	2.739	40	30		BFEBHO