smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C1NC(=O)N(c2ccccc2F)C(=O)/C1=C/c1ccc([O-])c([N+](=O)[O-])c1	ZINC000408904022	570696452	/nfs/dbraw/zinc/69/64/52/570696452.db2.gz	CKQKFXNTKMAZRT-JXMROGBWSA-N	-1	2	371.280	2.106	40	10		FECBLM
Cc1cccc(N2C(=O)NC(=O)C(=CNc3ccccc3C(=O)[O-])C2=O)c1	ZINC000016349469	539630437	/nfs/dbraw/zinc/63/04/37/539630437.db2.gz	GKPDFJAUQJRCRX-UVTDQMKNSA-N	-1	2	365.345	2.272	40	10		FECBLM
O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1ccc([O-])c([N+](=O)[O-])c1	ZINC000408903881	570696530	/nfs/dbraw/zinc/69/65/30/570696530.db2.gz	AUTYYIMRDBJRLA-WUXMJOGZSA-N	-1	2	371.280	2.106	40	10		FECBLM
Cc1ccc(/C=C2\C(=O)NC(=O)N(c3ccc(C(=O)[O-])cc3)C2=O)cc1	ZINC000408942162	570702095	/nfs/dbraw/zinc/70/20/95/570702095.db2.gz	XWEUXNUVGLXXHF-XNTDXEJSSA-N	-1	2	350.330	2.360	40	10		FECBLM
Cc1cccc(N2C(=O)NC(=O)C(=CNc3ccc(C(=O)[O-])cc3)C2=O)c1	ZINC000016349463	539631048	/nfs/dbraw/zinc/63/10/48/539631048.db2.gz	MYENEFUWPYEJJZ-GDNBJRDFSA-N	-1	2	365.345	2.272	40	10		FECBLM
Cc1ccc(N2C(=O)NC(=O)C(=Cc3cccc([N+](=O)[O-])c3[O-])C2=O)cc1	ZINC000408962156	558689744	/nfs/dbraw/zinc/68/97/44/558689744.db2.gz	QLPBQQIAWAFFSK-UKTHLTGXSA-N	-1	2	367.317	2.275	40	10		FECBLM
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)cc([N+](=O)[O-])c1[O-]	ZINC000035351341	539980614	/nfs/dbraw/zinc/98/06/14/539980614.db2.gz	CINMVDORWPSALT-GHXNOFRVSA-N	-1	2	359.725	2.415	40	10		FECBLM
O=C1NN(c2ccccc2)C(=O)/C1=C\c1cc(Cl)c([O-])c([N+](=O)[O-])c1	ZINC000033775911	539975250	/nfs/dbraw/zinc/97/52/50/539975250.db2.gz	BPUXMUMVKUCJGA-WDZFZDKYSA-N	-1	2	359.725	2.415	40	10		FECBLM
O=C1[N-]C(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1O	ZINC000408914165	558690038	/nfs/dbraw/zinc/69/00/38/558690038.db2.gz	ODPFJHKWPYDOBO-NTUHNPAUSA-N	-1	2	371.280	2.106	40	10		FECBLM
O=C1NC(=O)N(c2cccc(F)c2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1[O-]	ZINC000408914165	558690039	/nfs/dbraw/zinc/69/00/39/558690039.db2.gz	ODPFJHKWPYDOBO-NTUHNPAUSA-N	-1	2	371.280	2.106	40	10		FECBLM
O=C1[N-]C(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1O	ZINC000408903634	570697571	/nfs/dbraw/zinc/69/75/71/570697571.db2.gz	VCIAQCRPZKLBKY-MDWZMJQESA-N	-1	2	371.280	2.106	40	10		FECBLM
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1cc([N+](=O)[O-])ccc1[O-]	ZINC000408903634	570697573	/nfs/dbraw/zinc/69/75/73/570697573.db2.gz	VCIAQCRPZKLBKY-MDWZMJQESA-N	-1	2	371.280	2.106	40	10		FECBLM
Cc1nn(C)c(C)c1N=CC1C(=O)N(c2ccc(C(=O)[O-])cc2)N=C1C	ZINC000408756740	558689284	/nfs/dbraw/zinc/68/92/84/558689284.db2.gz	JENJIUSBNVYOSY-OQLLNIDSSA-N	-1	2	353.382	2.454	40	10		FECBLM
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1cccc([N+](=O)[O-])c1[O-]	ZINC000408962960	570703686	/nfs/dbraw/zinc/70/36/86/570703686.db2.gz	WKMWUYBSGYLMMP-XYOKQWHBSA-N	-1	2	371.280	2.106	40	10		FECBLM
Cc1ccc(N2C(=O)[N-]C(=O)C(=Cc3cc([N+](=O)[O-])ccc3O)C2=O)cc1	ZINC000408898398	570696580	/nfs/dbraw/zinc/69/65/80/570696580.db2.gz	MAINTRRUFUEXTF-NTEUORMPSA-N	-1	2	367.317	2.275	40	10		FECBLM
Cc1ccc(C(=O)[O-])cc1NC=C1C(=O)NC(=O)N(c2ccccc2)C1=O	ZINC000016347104	539631119	/nfs/dbraw/zinc/63/11/19/539631119.db2.gz	HKBDQKWPVYIXSB-UVTDQMKNSA-N	-1	2	365.345	2.272	40	10		FECBLM
Cc1ccccc1N1C(=O)NC(=O)C(=CNc2ccc(C(=O)[O-])cc2)C1=O	ZINC000408533940	558686399	/nfs/dbraw/zinc/68/63/99/558686399.db2.gz	UBWWZEWZBMOTQR-GXDHUFHOSA-N	-1	2	365.345	2.272	40	10		FECBLM
O=C1NC(=O)N(c2ccc(F)cc2)C(=O)/C1=C/c1ccc([O-])c([N+](=O)[O-])c1	ZINC000408852500	570692046	/nfs/dbraw/zinc/69/20/46/570692046.db2.gz	GOHBDGNRERGTGK-KPKJPENVSA-N	-1	2	371.280	2.106	40	10		FECBLM