smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Cc1cc(=O)n2nc(CC(=O)N3CCN(Cc4nc[nH]n4)CC3)[n-]c2n1	ZINC000217574949	525339919	/nfs/dbraw/zinc/33/99/19/525339919.db2.gz	OWQGISXTXIJZLL-UHFFFAOYSA-N	-1	0	357.378	-0.857	50	70		FBIARM
Cc1cc(=O)n2nc(CC(=O)N3CCn4nc([C@@H](C)O)cc4C3)[n-]c2n1	ZINC000217597848	206364530	/nfs/dbraw/zinc/36/45/30/206364530.db2.gz	XLEZYKRTSAOSBR-SNVBAGLBSA-N	-1	0	357.374	-0.027	50	70		FBIARM
Cc1cc(=O)n2nc(CC(=O)N3CCn4nc([C@H](C)O)cc4C3)[n-]c2n1	ZINC000217597929	483858743	/nfs/dbraw/zinc/85/87/43/483858743.db2.gz	XLEZYKRTSAOSBR-JTQLQIEISA-N	-1	0	357.374	-0.027	50	70		FBIARM
Cc1nn2c([n-]1)nc(CN1CCCn3nc([C@@H](O)CO)cc3C1)cc2=O	ZINC000217602467	206364117	/nfs/dbraw/zinc/36/41/17/206364117.db2.gz	GNMQDDLYXQONSU-AWEZNQCLSA-N	-1	0	359.390	-0.234	50	70		FBIARM
Cc1nn2c([n-]1)nc(CN1CCCn3nc([C@H](O)CO)cc3C1)cc2=O	ZINC000217602558	527200391	/nfs/dbraw/zinc/20/03/91/527200391.db2.gz	GNMQDDLYXQONSU-CQSZACIVSA-N	-1	0	359.390	-0.234	50	70		FBIARM
Cc1cc(=O)n2nc(CC(=O)NCc3nc(-c4cnccn4)n[nH]3)[n-]c2n1	ZINC000217763119	525339895	/nfs/dbraw/zinc/33/98/95/525339895.db2.gz	ZJFHKXROJSFWAI-UHFFFAOYSA-N	-1	0	366.345	-0.428	50	70		FBIARM
Cc1cc(S(=O)(=O)NCC(=O)N[C@@H](C)c2n[nH]c(=O)[n-]2)ccc1F	ZINC000217801833	483859790	/nfs/dbraw/zinc/85/97/90/483859790.db2.gz	UELTYQZYTQQGSJ-QMMMGPOBSA-N	-1	0	357.367	-0.299	50	70		FBIARM
Cc1cc(S(=O)(=O)NCC(=O)N[C@H](C)c2n[nH]c(=O)[n-]2)ccc1F	ZINC000217801914	525405597	/nfs/dbraw/zinc/40/55/97/525405597.db2.gz	UELTYQZYTQQGSJ-MRVPVSSYSA-N	-1	0	357.367	-0.299	50	70		FBIARM
Nc1nnc(CCC(=O)N2CCn3nc([C@@H](O)C4CC4)cc3C2)c(=O)[n-]1	ZINC000218774436	483864029	/nfs/dbraw/zinc/86/40/29/483864029.db2.gz	IEDSOHZSJNKYON-AWEZNQCLSA-N	-1	0	359.390	-0.638	50	70		FBIARM
Nc1nnc(CCC(=O)N2CCn3nc([C@H](O)C4CC4)cc3C2)c(=O)[n-]1	ZINC000218774512	206374910	/nfs/dbraw/zinc/37/49/10/206374910.db2.gz	IEDSOHZSJNKYON-CQSZACIVSA-N	-1	0	359.390	-0.638	50	70		FBIARM