smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(OCCCNC(=O)Nc2cccc(S(=O)(=O)F)c2)c(Cl)c1	ZINC000043300474	562647472	/nfs/dbraw/zinc/64/74/72/562647472.db2.gz	QOYHILJOTAVUSU-UHFFFAOYSA-N	1	1	525.994	2.774	1	70		KFIFMO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(OCCCC(=O)Nc2cccc(S(=O)(=O)F)c2)c(Cl)c1	ZINC000043307443	562647507	/nfs/dbraw/zinc/64/75/07/562647507.db2.gz	SWZUTCFHSJAPMQ-UHFFFAOYSA-N	1	1	510.979	2.981	1	70		KFIFMO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(OCCOCCOc2ccc(S(=O)(=O)F)cc2)c(Cl)c1	ZINC000043307513	562647487	/nfs/dbraw/zinc/64/74/87/562647487.db2.gz	CIWZBZQOXHVBCN-UHFFFAOYSA-N	1	1	513.979	2.658	1	70		KFIFMO
CC1(C)NC(=N)NC(=[NH2+])N1c1ccc(OCCCC(=O)Nc2ccc(S(=O)(=O)F)cc2)c(Cl)c1	ZINC000043307534	562647511	/nfs/dbraw/zinc/64/75/11/562647511.db2.gz	MJRLRPCVNKUSQU-UHFFFAOYSA-N	1	1	510.979	2.981	1	70		KFIFMO
COc1cccc2c1C[C@H]1C[C@@H](C(=O)N3CCN(c4ncccc4OS(=O)(=O)C(F)(F)F)CC3)C[N@@H+](C)[C@@H]1C2	ZINC000043589893	562650073	/nfs/dbraw/zinc/65/00/73/562650073.db2.gz	HXSFAPIPSVCGNS-SFHLNBCPSA-N	1	1	568.618	2.703	1	70		KFIFMO
C[N@H+]1C[C@H](C(=O)N2CCN(c3ccc4nsnc4n3)CC2)C[C@@H]2Cc3c(cccc3OS(=O)(=O)C(F)(F)F)C[C@H]21	ZINC000043606289	562650199	/nfs/dbraw/zinc/65/01/99/562650199.db2.gz	IJHTWXFTMOWFMI-MBOZVWFJSA-N	1	1	596.657	2.699	1	70		KFIFMO
Cc1cc(NC(=O)NCCOc2ccc(N3C(=[NH2+])NC(=N)NC3(C)C)cc2Cl)ccc1S(=O)(=O)F	ZINC000043834237	562650953	/nfs/dbraw/zinc/65/09/53/562650953.db2.gz	JAKSRBURFHPDSU-UHFFFAOYSA-N	1	1	525.994	2.693	1	70		KFIFMO
C[N@H+]1C[C@H](C(=O)N2CCN(c3ccccn3)CC2)C[C@@H]2Cc3c(cccc3OS(=O)(=O)C(F)(F)F)C[C@H]21	ZINC000044093871	562652357	/nfs/dbraw/zinc/65/23/57/562652357.db2.gz	WDBNJGNBPAMNLP-SFHLNBCPSA-N	1	1	538.592	2.694	1	70		KFIFMO