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+](Cc1ccncc1)C1CC2(C1)CCN(c1ncccc1NC(=O)CCl)CC2	ZINC001164795442	721499429	/nfs/dbraw/zinc/49/94/29/721499429.db2.gz	HCGPHRDCMGQYDE-UHFFFAOYSA-N	1	1	413.953	3.535	20	50		HHGDMO
Cc1nc(C[N@H+]2CCCC23CCN(c2ccc(NC(=O)CCl)cn2)CC3)cs1	ZINC001164692777	719815883	/nfs/dbraw/zinc/81/58/83/719815883.db2.gz	RUISHGADNIVHGY-UHFFFAOYSA-N	1	1	419.982	3.659	20	50		HHGDMO
O=C(CCl)Nc1cccnc1N1CCC[C@]2(CC[N@@H+]2Cc2cccc(F)c2)C1	ZINC001164995061	722206992	/nfs/dbraw/zinc/20/69/92/722206992.db2.gz	KUSFIFBRUWYMHU-NRFANRHFSA-N	1	1	402.901	3.643	20	50		HHGDMO
O=C(CCl)Nc1cccnc1N1CCC[C@@]2(CC[N@@H+]2Cc2cccc(F)c2)C1	ZINC001164995064	722207335	/nfs/dbraw/zinc/20/73/35/722207335.db2.gz	KUSFIFBRUWYMHU-OAQYLSRUSA-N	1	1	402.901	3.643	20	50		HHGDMO
C[N@@H+](Cc1ccncc1)C1CC2(C1)CCN(c1ccc(NC(=O)CCl)cn1)CC2	ZINC001164795589	721503097	/nfs/dbraw/zinc/50/30/97/721503097.db2.gz	MEPZETLTVASGNA-UHFFFAOYSA-N	1	1	413.953	3.535	20	50		HHGDMO
O=C(CCl)Nc1ccc(N2CCC[C@@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1	ZINC001164998528	722211732	/nfs/dbraw/zinc/21/17/32/722211732.db2.gz	WPLCHNCLDUVVMA-OAQYLSRUSA-N	1	1	402.901	3.643	20	50		HHGDMO
O=C(CCl)Nc1ccc(N2CCC[C@]3(CC[N@@H+]3Cc3cccc(F)c3)C2)nc1	ZINC001164998527	722211172	/nfs/dbraw/zinc/21/11/72/722211172.db2.gz	WPLCHNCLDUVVMA-NRFANRHFSA-N	1	1	402.901	3.643	20	50		HHGDMO
Cc1nc(C[N@H+]2CCCC23CCN(c2ncccc2NC(=O)CCl)CC3)cs1	ZINC001164693661	719813328	/nfs/dbraw/zinc/81/33/28/719813328.db2.gz	XZBPGUCNBXUYEI-UHFFFAOYSA-N	1	1	419.982	3.659	20	50		HHGDMO