smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1ccc2nc3c4c(ccc3C(=O)NCCN(C)C)n(CCC[NH+](C)C)[nH]c4c2c1	ZINC000026992389	563038815	/nfs/dbraw/zinc/03/88/15/563038815.db2.gz	OEBGZSGWQMSCBK-UHFFFAOYSA-N	1	3	436.560	2.923	1	5		IFBFHO
CN(C)CCn1c(=O)c2ccc(NCC[NH+](C)C)cc2c2cnc3cc4c(cc3c21)OCO4	ZINC000040421483	563102222	/nfs/dbraw/zinc/10/22/22/563102222.db2.gz	IRCMQKKHKYUNMQ-UHFFFAOYSA-N	1	3	447.539	2.967	1	5		IFBFHO
CN(C)CCn1c(=O)c2cc(NCC[NH+](C)C)ccc2c2cnc3cc4c(cc3c21)OCO4	ZINC000045498525	563134735	/nfs/dbraw/zinc/13/47/35/563134735.db2.gz	APIQRTRDOJMIQH-UHFFFAOYSA-N	1	3	447.539	2.967	1	5		IFBFHO
N[C@H](CCC[NH3+])C(=O)N[C@H](C(=O)Nc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	ZINC000073240157	563171283	/nfs/dbraw/zinc/17/12/83/563171283.db2.gz	HWDAGQMTTHGYOU-RTWAWAEBSA-N	1	3	435.484	2.610	1	5		IFBFHO
CN(C)CCNC(=O)c1ccc2c3c([nH]n2CC[NH+]2CCCC2)c2cc(O)ccc2nc31	ZINC000026995922	563038941	/nfs/dbraw/zinc/03/89/41/563038941.db2.gz	OEZYBIXLAGZEJI-UHFFFAOYSA-N	1	3	434.544	2.764	1	5		IFBFHO
N[C@H](CCC[NH3+])C(=O)N[C@@H](C(=O)Nc1ccc2ccccc2c1)c1ccc([N+](=O)[O-])cc1	ZINC000073240152	563171290	/nfs/dbraw/zinc/17/12/90/563171290.db2.gz	HWDAGQMTTHGYOU-NHCUHLMSSA-N	1	3	435.484	2.610	1	5		IFBFHO