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)c1ccc(N[C@@H](C)c2cccs2)cc1	ZINC000019912407	347317359	/nfs/dbraw/zinc/31/73/59/347317359.db2.gz	NQMAOUKJCINOBK-LBPRGKRZSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1ccc(N[C@H](C)c2cccs2)cc1	ZINC000019912409	347317724	/nfs/dbraw/zinc/31/77/24/347317724.db2.gz	NQMAOUKJCINOBK-GFCCVEGCSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1cccc(N[C@@H](C)c2cccs2)c1	ZINC000021516510	386477186	/nfs/dbraw/zinc/47/71/86/386477186.db2.gz	JPSCMNPOSBDCQA-LBPRGKRZSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1cccc(N[C@H](C)c2cccs2)c1	ZINC000021516511	386474945	/nfs/dbraw/zinc/47/49/45/386474945.db2.gz	JPSCMNPOSBDCQA-GFCCVEGCSA-N	0	0	245.391	5.045	20	0		BKADRN
C[C@H](Nc1ccc2ccccc2c1)c1ccccc1	ZINC000035019058	636392986	/nfs/dbraw/zinc/39/29/86/636392986.db2.gz	GVRPFOISEZNPLT-AWEZNQCLSA-N	0	0	247.341	5.013	20	0		BKADRN
C[C@@H](Nc1ccc2ccccc2c1)c1ccccc1	ZINC000035019059	636392705	/nfs/dbraw/zinc/39/27/05/636392705.db2.gz	GVRPFOISEZNPLT-CQSZACIVSA-N	0	0	247.341	5.013	20	0		BKADRN
CC(C)c1ccc(N[C@@H](C)c2ccsc2)cc1	ZINC000050337862	322850957	/nfs/dbraw/zinc/85/09/57/322850957.db2.gz	WAEPTPJEVUCVIJ-LBPRGKRZSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1ccc(N[C@H](C)c2ccsc2)cc1	ZINC000050337865	322850860	/nfs/dbraw/zinc/85/08/60/322850860.db2.gz	WAEPTPJEVUCVIJ-GFCCVEGCSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1cccc(N[C@@H](C)c2ccsc2)c1	ZINC000050338989	397970998	/nfs/dbraw/zinc/97/09/98/397970998.db2.gz	BEVJXRSWZZJZQM-LBPRGKRZSA-N	0	0	245.391	5.045	20	0		BKADRN
CC(C)c1cccc(N[C@H](C)c2ccsc2)c1	ZINC000050338992	384699567	/nfs/dbraw/zinc/69/95/67/384699567.db2.gz	BEVJXRSWZZJZQM-GFCCVEGCSA-N	0	0	245.391	5.045	20	0		BKADRN
C[C@@H](S[C@@H](C)c1cccs1)c1ccccc1	ZINC000737403798	585031433	/nfs/dbraw/zinc/03/14/33/585031433.db2.gz	LAZIMVSELMRJLW-NEPJUHHUSA-N	0	0	248.416	5.304	20	0		BKADRN
C[C@@H](S[C@@H](C)c1ccccc1)c1cccs1	ZINC000737403799	585031497	/nfs/dbraw/zinc/03/14/97/585031497.db2.gz	LAZIMVSELMRJLW-NWDGAFQWSA-N	0	0	248.416	5.304	20	0		BKADRN
C[C@H](S[C@@H](C)c1ccccc1)c1cccs1	ZINC000737403800	585031502	/nfs/dbraw/zinc/03/15/02/585031502.db2.gz	LAZIMVSELMRJLW-RYUDHWBXSA-N	0	0	248.416	5.304	20	0		BKADRN
C[C@@H](S[C@H](C)c1ccccc1)c1cccs1	ZINC000737403801	585031337	/nfs/dbraw/zinc/03/13/37/585031337.db2.gz	LAZIMVSELMRJLW-VXGBXAGGSA-N	0	0	248.416	5.304	20	0		BKADRN