smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1ccc(C[N@H+]2CCOC3(CCN(c4ncc(S(=O)(=O)F)cc4C)CC3)C2)cc1	ZINC001164944598	721933559	/nfs/dbraw/zinc/93/35/59/721933559.db2.gz	SYOUNKXWGGGCLJ-UHFFFAOYSA-N	1	1	433.549	3.228	20	70		IGIDMO
Cc1cc(S(=O)(=O)F)cnc1N1CCC2(C[C@@H]([N@@H+](C)Cc3ccccc3)CO2)CC1	ZINC001164838643	720729621	/nfs/dbraw/zinc/72/96/21/720729621.db2.gz	VCEZTXSGBISLSW-LJQANCHMSA-N	1	1	433.549	3.308	20	70		IGIDMO
Cc1cc(S(=O)(=O)F)cnc1N1CCC2(C[C@H]([N@@H+](C)Cc3ccccc3)CO2)CC1	ZINC001164838642	720728766	/nfs/dbraw/zinc/72/87/66/720728766.db2.gz	VCEZTXSGBISLSW-IBGZPJMESA-N	1	1	433.549	3.308	20	70		IGIDMO
Cc1cc(S(=O)(=O)F)cnc1N1CCc2c(C[N@H+](C)Cc3ccco3)cncc2C1	ZINC001164911642	721766549	/nfs/dbraw/zinc/76/65/49/721766549.db2.gz	QKMBDGCVJOOXAA-UHFFFAOYSA-N	1	1	430.505	3.231	20	70		IGIDMO
Cc1cc(S(=O)(=O)F)cnc1N1CCc2c(C[N@@H+](C)Cc3ccco3)cncc2C1	ZINC001164911642	721766552	/nfs/dbraw/zinc/76/65/52/721766552.db2.gz	QKMBDGCVJOOXAA-UHFFFAOYSA-N	1	1	430.505	3.231	20	70		IGIDMO