smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1cccnc1	ZINC000218154937	385896145	/nfs/dbraw/zinc/89/61/45/385896145.db2.gz	HMYLLSTYOSFXFM-SECBINFHSA-N	-1	1	246.270	0.414	50	70		BCIAMM
Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1ccco1	ZINC000218259125	385898742	/nfs/dbraw/zinc/89/87/42/385898742.db2.gz	JEQHABOHMIAOTP-ZETCQYMHSA-N	-1	1	235.243	0.612	50	70		BCIAMM
O=C(N[C@@H]1C[C@@H]2OCC[C@H]12)c1ccncc1[O-]	ZINC000217659870	182317110	/nfs/dbraw/zinc/31/71/10/182317110.db2.gz	IWNDHOVDSMLVMK-ZOFUNIGCSA-N	-1	1	234.255	0.694	50	70		BCIAMM
Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1cccnc1	ZINC000218155014	385896137	/nfs/dbraw/zinc/89/61/37/385896137.db2.gz	HMYLLSTYOSFXFM-VIFPVBQESA-N	-1	1	246.270	0.414	50	70		BCIAMM
Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1ccco1	ZINC000218259087	385898816	/nfs/dbraw/zinc/89/88/16/385898816.db2.gz	JEQHABOHMIAOTP-SSDOTTSWSA-N	-1	1	235.243	0.612	50	70		BCIAMM
Cn1ccnc1CCNC(=O)c1ccc([O-])cn1	ZINC000218657052	188008268	/nfs/dbraw/zinc/00/82/68/188008268.db2.gz	RQHXHZIGNQEFPW-UHFFFAOYSA-N	-1	1	246.270	0.493	50	70		BCIAMM
Cc1[n-][nH]c(=O)c1[C@@H](CC(N)=O)c1ccncc1	ZINC000218135853	411310215	/nfs/dbraw/zinc/31/02/15/411310215.db2.gz	PLHQCNOFBWOCRE-VIFPVBQESA-N	-1	1	246.270	0.414	50	70		BCIAMM
Cc1[n-][nH]c(=O)c1[C@H](CC(N)=O)c1ccncc1	ZINC000218135773	411310154	/nfs/dbraw/zinc/31/01/54/411310154.db2.gz	PLHQCNOFBWOCRE-SECBINFHSA-N	-1	1	246.270	0.414	50	70		BCIAMM