smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CCCCCCCCC(=O)Nc1ccccc1[O-]	ZINC000001680923	136207354	/nfs/dbraw/zinc/20/73/54/136207354.db2.gz	FZVFPBKSJNLCGF-UHFFFAOYSA-N	-1	3	249.354	4.081	40	30		BIEBHM
[O-]c1ccc2ccccc2c1/C=N\c1ccccc1	ZINC000018156788	183284799	/nfs/dbraw/zinc/28/47/99/183284799.db2.gz	MUFLFHJOVXSNBI-PDGQHHTCSA-N	-1	3	247.297	4.296	40	30		BIEBHM
[O-]c1c(/C=N/c2ccccc2)ccc2ccccc12	ZINC000032101529	183252375	/nfs/dbraw/zinc/25/23/75/183252375.db2.gz	WIUBTEMXECBJSY-LDADJPATSA-N	-1	3	247.297	4.296	40	30		BIEBHM
CCCCCCCCCCCCCC(=O)N[O-]	ZINC000072141055	491122436	/nfs/dbraw/zinc/12/24/36/491122436.db2.gz	XHKBEIYZVFBVAM-UHFFFAOYSA-N	-1	3	243.391	4.193	40	30		BIEBHM
CCCCCCCCCC1=C([O-])CCC1=O	ZINC000100238464	519980161	/nfs/dbraw/zinc/98/01/61/519980161.db2.gz	OGVZVRPGMYZCEE-UHFFFAOYSA-N	-1	3	224.344	4.302	40	30		BIEBHM
[O-]c1c(/C=N\c2ccccc2)ccc2ccccc12	ZINC000100248350	183253109	/nfs/dbraw/zinc/25/31/09/183253109.db2.gz	WIUBTEMXECBJSY-PDGQHHTCSA-N	-1	3	247.297	4.296	40	30		BIEBHM
Cc1cc([O-])c(C(C)C)cc1/N=C/c1ccco1	ZINC000100249815	178194831	/nfs/dbraw/zinc/19/48/31/178194831.db2.gz	IAFPPONTULDQFV-CXUHLZMHSA-N	-1	3	243.306	4.168	40	30		BIEBHM
CCCCCCC/C(=N\[O-])c1cc(C)ccc1O	ZINC000100934557	519959348	/nfs/dbraw/zinc/95/93/48/519959348.db2.gz	NZEHBNVOUUHCJB-JQIJEIRASA-N	-1	3	249.354	4.239	40	30		BIEBHM
Cc1ccccc1/N=C\c1cc(Cl)ccc1[O-]	ZINC000102940797	179244941	/nfs/dbraw/zinc/24/49/41/179244941.db2.gz	FRMHOFWFSFFMTQ-SXGWCWSVSA-N	-1	3	245.709	4.105	40	30		BIEBHM
CCCCCCCCOc1ccc(/C=N\[O-])cc1	ZINC000103878076	384888890	/nfs/dbraw/zinc/88/88/90/384888890.db2.gz	PUFQYBJCWNHCIH-SSZFMOIBSA-N	-1	3	249.354	4.234	40	30		BIEBHM
[O-]/N=C\c1ccc2ccc3cccc4ccc1c2c34	ZINC000216825299	387007173	/nfs/dbraw/zinc/00/71/73/387007173.db2.gz	HGTFSMPWNCYLBE-ZDLGFXPLSA-N	-1	3	245.281	4.392	40	30		BIEBHM
[O-]c1c(C=Nc2ccccc2)ccc2ccccc12	ZINC000260840661	323130181	/nfs/dbraw/zinc/13/01/81/323130181.db2.gz	WIUBTEMXECBJSY-UHFFFAOYSA-N	-1	3	247.297	4.296	40	30		BIEBHM
Cc1c(Cl)cccc1/N=C\c1cccc([O-])c1	ZINC000409200028	385509842	/nfs/dbraw/zinc/50/98/42/385509842.db2.gz	FOAAAZZOAQLVHB-SXGWCWSVSA-N	-1	3	245.709	4.105	40	30		BIEBHM
Cc1ccc(/N=C\c2cccc([O-])c2)cc1Cl	ZINC000409209058	385509939	/nfs/dbraw/zinc/50/99/39/385509939.db2.gz	FLVADVOBBALISF-SXGWCWSVSA-N	-1	3	245.709	4.105	40	30		BIEBHM
Cc1ccc(Cl)cc1/N=C\c1cccc([O-])c1	ZINC000409209843	385510252	/nfs/dbraw/zinc/51/02/52/385510252.db2.gz	HUWJUIOPFZMPEL-SXGWCWSVSA-N	-1	3	245.709	4.105	40	30		BIEBHM