smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
Oc1ccc(Br)cc1CNc1cc([S-])cc([S-])c1	ZINC001171178325	1048650914	/nfs/dbraw/zinc/65/09/14/1048650914.db2.gz	WVSKEAVYMPYZDJ-UHFFFAOYSA-N	-2	0	342.283	4.344	20	10		EICDRL
Cc1ccc(NCc2cc(Cl)cc(Cl)c2[O-])cc1C(=O)[O-]	ZINC000789902347	1047490498	/nfs/dbraw/zinc/49/04/98/1047490498.db2.gz	MMOHVDLKNYTSQN-UHFFFAOYSA-N	-2	0	326.179	4.318	20	10		EICDRL
COc1ccc(C(=O)[O-])cc1NCc1cc(Cl)cc(Cl)c1[O-]	ZINC000387127811	1053844806	/nfs/dbraw/zinc/84/48/06/1053844806.db2.gz	MOOPCJSRKXVCBD-UHFFFAOYSA-N	-2	0	342.178	4.018	20	10		EICDRL
Nc1ccc(N(c2ccccc2)c2cc(C(=O)[O-])cc(C(=O)[O-])c2)cc1	ZINC001176242261	1051971042	/nfs/dbraw/zinc/97/10/42/1051971042.db2.gz	SNYXUJDEKOGHCG-UHFFFAOYSA-N	-2	0	348.358	4.135	20	10		EICDRL
CC(C)c1cccc(S(=O)(=O)Nc2cc(Cl)c([O-])cc2F)c1	ZINC000808113883	1047608118	/nfs/dbraw/zinc/60/81/18/1047608118.db2.gz	KHZMZNIWJHJPMG-UHFFFAOYSA-N	-2	0	343.807	4.109	20	10		EICDRL