smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
C[C@@H](Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1)C(=O)[O-]	ZINC000059678539	570660928	/nfs/dbraw/zinc/66/09/28/570660928.db2.gz	AFDSZSDXDXRXDY-LKBVRNOZSA-N	-1	2	398.346	2.344	40	10		GECBLM
COc1ccc(/C=C2/C(=O)NC(=O)N(c3ccc(F)cc3)C2=O)cc1C(=O)[O-]	ZINC000409043591	533240442	/nfs/dbraw/zinc/24/04/42/533240442.db2.gz	RTINEZWLTXYGGI-ZROIWOOFSA-N	-1	2	384.319	2.199	40	10		GECBLM
Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCC(=O)[O-])C2=O)cc1	ZINC000408787337	231114513	/nfs/dbraw/zinc/11/45/13/231114513.db2.gz	YBQSBWMOHXYROV-XNTDXEJSSA-N	-1	2	380.356	2.125	40	10		GECBLM
Cc1cc(C)cc(N2C(=O)NC(=O)C(=Cc3ccc(OCC(=O)[O-])cc3)C2=O)c1	ZINC000006188760	204170360	/nfs/dbraw/zinc/17/03/60/204170360.db2.gz	DESHUXGDRNDPKN-LICLKQGHSA-N	-1	2	394.383	2.433	40	10		GECBLM
O=C([O-])c1ccc(N2C(=O)NC(=O)C(=Cc3ccc(O)c(Cl)c3)C2=O)cc1	ZINC000408944705	534544338	/nfs/dbraw/zinc/54/43/38/534544338.db2.gz	UTORRUZDIQGVFU-KPKJPENVSA-N	-1	2	386.747	2.410	40	10		GECBLM
CCOc1ccccc1/C=C1\C(=O)NC(=O)N(c2ccc(C(=O)[O-])cc2)C1=O	ZINC000408939069	231134157	/nfs/dbraw/zinc/13/41/57/231134157.db2.gz	LPHHSNQNDLSBSR-RVDMUPIBSA-N	-1	2	380.356	2.450	40	10		GECBLM
Cc1ccc(N2C(=O)NC(=O)C(=Cc3ccccc3OCC(=O)[O-])C2=O)cc1C	ZINC000408859955	231122356	/nfs/dbraw/zinc/12/23/56/231122356.db2.gz	WBCMKZWFJQJRQS-MHWRWJLKSA-N	-1	2	394.383	2.433	40	10		GECBLM
COc1ccc(N2C(=O)NC(=O)C(=Cc3ccc(OC)c(C(=O)[O-])c3)C2=O)cc1	ZINC000409048846	533995711	/nfs/dbraw/zinc/99/57/11/533995711.db2.gz	UGOPIEPXDTUYOT-GDNBJRDFSA-N	-1	2	396.355	2.068	40	10		GECBLM
Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCC(=O)[O-])c3)C2=O)cc1	ZINC000001200214	209313342	/nfs/dbraw/zinc/31/33/42/209313342.db2.gz	UTYQNKLDCNFWCF-MHWRWJLKSA-N	-1	2	380.356	2.125	40	10		GECBLM
Cc1ccc(N2C(=O)NC(=O)C(=CNc3ccc(O)c(C(=O)[O-])c3)C2=O)c(C)c1	ZINC000408539369	231054972	/nfs/dbraw/zinc/05/49/72/231054972.db2.gz	WAUXINSFIWYJAM-NTEUORMPSA-N	-1	2	395.371	2.286	40	10		GECBLM
Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc(OCC(=O)[O-])c3)C2=O)cc1C	ZINC000409070297	231154450	/nfs/dbraw/zinc/15/44/50/231154450.db2.gz	ZTUZYCKGVMPSCC-YVLHZVERSA-N	-1	2	394.383	2.433	40	10		GECBLM
CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(O)cc3)C2=O)cc1C(=O)[O-]	ZINC000006439738	136196826	/nfs/dbraw/zinc/19/68/26/136196826.db2.gz	VWBZFQFHNRCPMY-XNTDXEJSSA-N	-1	2	396.355	2.156	40	10		GECBLM
CCOc1ccc(/C=C2\C(=O)NC(=O)N(c3ccccc3)C2=O)cc1C(=O)[O-]	ZINC000010038296	136197080	/nfs/dbraw/zinc/19/70/80/136197080.db2.gz	DEDCMYBBYBQICO-RVDMUPIBSA-N	-1	2	380.356	2.450	40	10		GECBLM
C[C@H](Oc1ccc(/C=C2\C(=O)NC(=O)N(c3cccc(F)c3)C2=O)cc1)C(=O)[O-]	ZINC000059678537	570660933	/nfs/dbraw/zinc/66/09/33/570660933.db2.gz	AFDSZSDXDXRXDY-UJFYRASASA-N	-1	2	398.346	2.344	40	10		GECBLM
CCOc1ccc(C(=O)[O-])cc1/C=C1\C(=O)NC(=O)N(c2ccc(O)cc2)C1=O	ZINC000408829417	528407965	/nfs/dbraw/zinc/40/79/65/528407965.db2.gz	NYLRGUAGKAQQLZ-XNTDXEJSSA-N	-1	2	396.355	2.156	40	10		GECBLM