smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
N#Cc1ccccc1C[C@@]1(c2ccc(Br)cc2)c2ccccc2-c2[nH+]ccn21	ZINC000072110389	563163325	/nfs/dbraw/zinc/16/33/25/563163325.db2.gz	PKEMSKLKHIQVFO-XMMPIXPASA-N	1	2	426.317	5.532	10	30		IKEELO
N#Cc1ccccc1C[C@]1(c2ccc(Br)cc2)c2ccccc2-c2[nH+]ccn21	ZINC000072110388	563163360	/nfs/dbraw/zinc/16/33/60/563163360.db2.gz	PKEMSKLKHIQVFO-DEOSSOPVSA-N	1	2	426.317	5.532	10	30		IKEELO
CCOc1ccc(C=CC(=O)Nc2ccc3[nH+]c(N4CCOCC4)cc(C)c3c2)cc1OC	ZINC000033535765	563084608	/nfs/dbraw/zinc/08/46/08/563084608.db2.gz	RBSRLSNLDOCVBG-POHAHGRESA-N	1	2	447.535	5.089	10	30		IKEELO
C[C@H](O[C@@H]1OCC[NH2+][C@@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000095950580	525922758	/nfs/dbraw/zinc/92/27/58/525922758.db2.gz	AFBDSAJOMZYQAI-PDSMFRHLSA-N	1	2	437.355	5.628	10	30		IKEELO
C[C@H](O[C@H]1OCC[NH2+][C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000022052850	525922915	/nfs/dbraw/zinc/92/29/15/525922915.db2.gz	AFBDSAJOMZYQAI-FJNPEDAXSA-N	1	2	437.355	5.628	10	30		IKEELO
CC[N+](CC)(CCCC(=NO)C(O)(c1ccccc1)c1ccccc1)Cc1ccccc1	ZINC000254430213	717170649	/nfs/dbraw/zinc/17/06/49/717170649.db2.gz	RDRXJUPAAVBLKZ-UHFFFAOYSA-O	1	2	431.600	5.590	10	30		IKEELO
C[C@H](O[C@@H]1OCC[NH2+][C@H]1c1ccc(F)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1	ZINC000090558083	525922801	/nfs/dbraw/zinc/92/28/01/525922801.db2.gz	AFBDSAJOMZYQAI-NBHSMZAVSA-N	1	2	437.355	5.628	10	30		IKEELO