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@H](c1ccccc1O)[N@@H+]1CC[C@H]2[C@@H](CCCN2C)C1	ZINC000251234633	334358623	/nfs/dbraw/zinc/35/86/23/334358623.db2.gz	KZEVYPXGCVHLAO-UAGQMJEPSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@H+]1CC[C@H]2[C@@H](CCCN2C)C1	ZINC000251234633	334358624	/nfs/dbraw/zinc/35/86/24/334358624.db2.gz	KZEVYPXGCVHLAO-UAGQMJEPSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[NH+](CC)CCC[C@@H](C)[NH2+][C@@H](C)c1cc(O)ccc1[O-]	ZINC000019915118	170924589	/nfs/dbraw/zinc/92/45/89/170924589.db2.gz	XHLFGQXFLQTDQV-KGLIPLIRSA-N	1	3	294.439	3.259	10	10		CGCEHO
COc1ccc(C[NH2+]C(C)C)cc1CN1CCCCC1	ZINC000045206458	175328552	/nfs/dbraw/zinc/32/85/52/175328552.db2.gz	CHIBPZXYBHLNNG-UHFFFAOYSA-N	1	3	276.424	3.179	10	10		CGCEHO
CCN(CC)Cc1cc(C[NH2+]C(C)C)ccc1OC	ZINC000045206454	175328313	/nfs/dbraw/zinc/32/83/13/175328313.db2.gz	ODQSXWBAWRYSDT-UHFFFAOYSA-N	1	3	264.413	3.035	10	10		CGCEHO
CC[C@H](c1ccccc1[O-])[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000217915009	333125167	/nfs/dbraw/zinc/12/51/67/333125167.db2.gz	KZEVYPXGCVHLAO-USXIJHARSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1[O-])[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000217915009	333125168	/nfs/dbraw/zinc/12/51/68/333125168.db2.gz	KZEVYPXGCVHLAO-USXIJHARSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@@H+]1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000217915009	333125170	/nfs/dbraw/zinc/12/51/70/333125170.db2.gz	KZEVYPXGCVHLAO-USXIJHARSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H]2[C@@H](CCCN2C)C1	ZINC000217915009	333125171	/nfs/dbraw/zinc/12/51/71/333125171.db2.gz	KZEVYPXGCVHLAO-USXIJHARSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@@H+]1CC[C@@H]2[C@H](CCCN2C)C1	ZINC000211272209	392985357	/nfs/dbraw/zinc/98/53/57/392985357.db2.gz	KZEVYPXGCVHLAO-DJIMGWMZSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@H+]1CC[C@@H]2[C@H](CCCN2C)C1	ZINC000211272209	392985361	/nfs/dbraw/zinc/98/53/61/392985361.db2.gz	KZEVYPXGCVHLAO-DJIMGWMZSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@@H+]1CC[C@H]2[C@H](CCCN2C)C1	ZINC000251234632	334358497	/nfs/dbraw/zinc/35/84/97/334358497.db2.gz	KZEVYPXGCVHLAO-OIISXLGYSA-N	1	3	288.435	3.259	10	10		CGCEHO
CC[C@H](c1ccccc1O)[N@H+]1CC[C@H]2[C@H](CCCN2C)C1	ZINC000251234632	334358499	/nfs/dbraw/zinc/35/84/99/334358499.db2.gz	KZEVYPXGCVHLAO-OIISXLGYSA-N	1	3	288.435	3.259	10	10		CGCEHO
CCCN(CCN(C)C)c1ccc([C@H](C)[NH3+])cc1Cl	ZINC000061698052	521659122	/nfs/dbraw/zinc/65/91/22/521659122.db2.gz	AVFUBMFOCLZZFP-LBPRGKRZSA-N	1	3	283.847	3.138	10	10		CGCEHO