smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC(C)N1[C@H](Cn2cccn2)C[C@H]2CN(c3cc(S(=O)(=O)F)ccn3)CC[C@@H]21	ZINC001164842699	720650453	/nfs/dbraw/zinc/65/04/53/720650453.db2.gz	TXVWFVMRXMHXGK-BQFCYCMXSA-N	0	3	407.515	2.314	20	70		HEIDHN
Cc1cc(S(=O)(=O)F)cnc1N1CC[C@H]2CN(Cc3cccnc3)CCO[C@@H]2C1	ZINC001164976179	722157912	/nfs/dbraw/zinc/15/79/12/722157912.db2.gz	UOSJRYARFDPPHE-PKOBYXMFSA-N	0	3	420.510	2.171	20	70		HEIDHN
CC(C)N1[C@@H]2CCN(c3cc(S(=O)(=O)F)ccn3)C[C@@H]2C[C@H]1Cn1cccn1	ZINC001164842708	720649725	/nfs/dbraw/zinc/64/97/25/720649725.db2.gz	TXVWFVMRXMHXGK-XYJFISCASA-N	0	3	407.515	2.314	20	70		HEIDHN
Cc1cc(S(=O)(=O)F)cnc1N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@H]2C1	ZINC001164976177	722157845	/nfs/dbraw/zinc/15/78/45/722157845.db2.gz	UOSJRYARFDPPHE-MJGOQNOKSA-N	0	3	420.510	2.171	20	70		HEIDHN
Cc1cc(S(=O)(=O)F)cnc1N1CC[C@H]2CN(Cc3cccnc3)CCO[C@H]2C1	ZINC001164976174	722158029	/nfs/dbraw/zinc/15/80/29/722158029.db2.gz	UOSJRYARFDPPHE-HKUYNNGSSA-N	0	3	420.510	2.171	20	70		HEIDHN
CC(C)N1[C@@H]2CCN(c3cc(S(=O)(=O)F)ccn3)C[C@H]2C[C@H]1Cn1cccn1	ZINC001164842705	720649475	/nfs/dbraw/zinc/64/94/75/720649475.db2.gz	TXVWFVMRXMHXGK-SOLBZPMBSA-N	0	3	407.515	2.314	20	70		HEIDHN
Cc1cc(S(=O)(=O)F)cnc1N1CC[C@@H]2CN(Cc3cccnc3)CCO[C@@H]2C1	ZINC001164976175	722158383	/nfs/dbraw/zinc/15/83/83/722158383.db2.gz	UOSJRYARFDPPHE-IEBWSBKVSA-N	0	3	420.510	2.171	20	70		HEIDHN
CC(C)N1[C@H](Cn2cccn2)C[C@@H]2CN(c3cc(S(=O)(=O)F)ccn3)CC[C@@H]21	ZINC001164842702	720649793	/nfs/dbraw/zinc/64/97/93/720649793.db2.gz	TXVWFVMRXMHXGK-RYRKJORJSA-N	0	3	407.515	2.314	20	70		HEIDHN