smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCN1C(=O)NC(=O)C(=CN)C1=O	104134368	167198103	/nfs/dbraw/zinc/19/81/03/167198103.db2.gz	DXGPJACBJMOQKD-ONEGZZNKSA-N	0	1	183.167	-1.073	40	10		AACBMN
CCN1C(=O)NC(=O)C(=CN)C1=O	104134364	167198525	/nfs/dbraw/zinc/19/85/25/167198525.db2.gz	DXGPJACBJMOQKD-ARJAWSKDSA-N	0	1	183.167	-1.073	40	10		AACBMN
CN1C(=O)NC(=O)C(=CN)C1=O	104134355	167895715	/nfs/dbraw/zinc/89/57/15/167895715.db2.gz	BDFURBAMTKDIJB-IHWYPQMZSA-N	0	1	169.140	-1.463	40	10		AACBMN
N=C(N=NNN=C(N)N)NNN=O	103569186	169139923	/nfs/dbraw/zinc/13/99/23/169139923.db2.gz	JQSQHAYDQDDZFG-UHFFFAOYSA-N	0	1	188.155	-1.948	40	10		AACBMN
CN(C)C=C1C(=O)NC(=O)NC1=O	1673695	342956802	/nfs/dbraw/zinc/95/68/02/342956802.db2.gz	IFJJJQASQZGSAC-UHFFFAOYSA-N	0	1	183.167	-1.202	40	10		AACBMN
CN1C(=O)NC(=O)C(=CN)C1=O	104134360	343728957	/nfs/dbraw/zinc/72/89/57/343728957.db2.gz	BDFURBAMTKDIJB-NSCUHMNNSA-N	0	1	169.140	-1.463	40	10		AACBMN
O=C1NC(=O)C(=CNCCO)C(=O)N1	6854839	351354133	/nfs/dbraw/zinc/35/41/33/351354133.db2.gz	BPKIUIUGKYPZRQ-UHFFFAOYSA-N	0	1	199.166	-2.182	40	10		AACBMN