smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
COc1c([N+](=O)[O-])cc([N-]C(=O)c2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-]	ZINC000103933361	508324215	/nfs/dbraw/zinc/32/42/15/508324215.db2.gz	NZUDVGKWYVFPNA-UHFFFAOYSA-N	-1	3	362.254	2.672	40	5		FFBBHM
COc1c([N+](=O)[O-])cc([N-]C(=O)c2cccnc2Cl)cc1[N+](=O)[O-]	ZINC000008560833	263356263	/nfs/dbraw/zinc/35/62/63/263356263.db2.gz	VVLVDBXHLYCMFV-UHFFFAOYSA-N	-1	3	352.690	2.812	40	5		FFBBHM
O=C(NC(=S)[N-]c1ccccc1[N+](=O)[O-])c1ccc2nsnc2c1	ZINC000021595590	263384031	/nfs/dbraw/zinc/38/40/31/263384031.db2.gz	WQAYRXMUGPPYSX-UHFFFAOYSA-N	-1	3	359.392	2.726	40	5		FFBBHM
O=Cc1cc([N+](=O)[O-])ccc1OC1=C([O-])N(c2ccc(Cl)cc2)C(=O)C1	ZINC000001447201	204008121	/nfs/dbraw/zinc/00/81/21/204008121.db2.gz	KHQANEGSTQNJCY-OAHLLOKOSA-N	-1	3	374.736	2.772	40	5		FFBBHM
CCCc1nn(C)c2c1nc(-c1cc([N+](=O)[O-])ccc1OCC)[n-]c2=O	ZINC000077311694	508298487	/nfs/dbraw/zinc/29/84/87/508298487.db2.gz	JMINGHHRIRWKPP-UHFFFAOYSA-N	-1	3	357.370	2.995	40	5	in-vitro	FFBBHM
CCOC(=O)c1cccc([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c1	ZINC000020111650	521545378	/nfs/dbraw/zinc/54/53/78/521545378.db2.gz	OONILGMOLOPTBU-UHFFFAOYSA-N	-1	3	364.379	2.713	40	5		FFBBHM
CC(=O)[N-]n1c(=O)c2cc(Cl)ccc2nc1-c1ccc([N+](=O)[O-])cc1	ZINC000003027564	204073986	/nfs/dbraw/zinc/07/39/86/204073986.db2.gz	SHFIGDJPWUTTIQ-UHFFFAOYSA-N	-1	3	358.741	2.715	40	5		FFBBHM
Cc1ccc(C)c(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000224002668	509352334	/nfs/dbraw/zinc/35/23/34/509352334.db2.gz	SWYJTPZOOFLYQY-UHFFFAOYSA-N	-1	3	350.396	2.569	40	5		FFBBHM
COc1ccc([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1OC	ZINC000014220408	506980130	/nfs/dbraw/zinc/98/01/30/506980130.db2.gz	OEZSHOYXEYWWTN-LLVKDONJSA-N	-1	3	366.395	2.652	40	5		FFBBHM
COc1ccc(OC)c([C@@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000014234019	506982088	/nfs/dbraw/zinc/98/20/88/506982088.db2.gz	AMLLCIZONFYAMK-LLVKDONJSA-N	-1	3	366.395	2.652	40	5		FFBBHM
Cc1nccn1-c1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000020042560	507209335	/nfs/dbraw/zinc/20/93/35/507209335.db2.gz	VYNXNFIKCLTFPR-UHFFFAOYSA-N	-1	3	372.406	2.567	40	5		FFBBHM
CCOc1ccccc1CCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000013669313	506949611	/nfs/dbraw/zinc/94/96/11/506949611.db2.gz	BRVHSAHOJHXGPB-UHFFFAOYSA-N	-1	3	364.423	2.905	40	5		FFBBHM
COc1cc([N+](=O)[O-])cc2sc([N-]C(=O)c3ccc([N+](=O)[O-])o3)nc21	ZINC000010010597	506721449	/nfs/dbraw/zinc/72/14/49/506721449.db2.gz	XEFSOWDKNUREQV-UHFFFAOYSA-N	-1	3	364.295	2.967	40	5		FFBBHM
CS(=O)(=O)[N-]c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1Cl	ZINC000020044724	507209909	/nfs/dbraw/zinc/20/99/09/507209909.db2.gz	HQGNPGMTAISSJI-UHFFFAOYSA-N	-1	3	369.786	2.872	40	5		FFBBHM
CC(C)Oc1cccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000010543827	263366529	/nfs/dbraw/zinc/36/65/29/263366529.db2.gz	FTSIETNLGPNHIB-UHFFFAOYSA-N	-1	3	350.396	2.861	40	5		FFBBHM
COc1ccc(OC)c([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000014234022	506981812	/nfs/dbraw/zinc/98/18/12/506981812.db2.gz	AMLLCIZONFYAMK-NSHDSACASA-N	-1	3	366.395	2.652	40	5		FFBBHM
CC(C)C1=C[C@@]([O-])(C(F)(F)F)N(C(=O)Cc2ccc([N+](=O)[O-])cc2)N1	ZINC000409060551	513098372	/nfs/dbraw/zinc/09/83/72/513098372.db2.gz	XFJWNZALIKKGOP-CQSZACIVSA-N	-1	3	359.304	2.633	40	5		FFBBHM
COC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000409382902	263553437	/nfs/dbraw/zinc/55/34/37/263553437.db2.gz	XOBHRFNFARFGFJ-UHFFFAOYSA-N	-1	3	370.770	2.836	40	5		FFBBHM
COc1cccc(OC)c1C(=O)[N-]c1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC000020496222	526218236	/nfs/dbraw/zinc/21/82/36/526218236.db2.gz	KMODPZDHYRPSIV-UHFFFAOYSA-N	-1	3	370.321	2.914	40	5		FFBBHM
O=[N+]([O-])c1cccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000059132311	212014917	/nfs/dbraw/zinc/01/49/17/212014917.db2.gz	XSWGQJRSSVCQNX-UHFFFAOYSA-N	-1	3	357.731	2.957	40	5		FFBBHM
Cn1c2nc(SCc3ccc([N+](=O)[O-])cc3)[n-]c2c(=S)n(C)c1=O	ZINC000017379734	211185439	/nfs/dbraw/zinc/18/54/39/211185439.db2.gz	MSIAPUQXVAQIMD-UHFFFAOYSA-N	-1	3	363.424	2.530	40	5		FFBBHM
Cn1c2[n-]c(SCc3ccc([N+](=O)[O-])cc3)nc2c(=S)n(C)c1=O	ZINC000017379734	211185442	/nfs/dbraw/zinc/18/54/42/211185442.db2.gz	MSIAPUQXVAQIMD-UHFFFAOYSA-N	-1	3	363.424	2.530	40	5		FFBBHM
CCc1ccc(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000223975588	509350751	/nfs/dbraw/zinc/35/07/51/509350751.db2.gz	FVMIPXMZACEXDT-UHFFFAOYSA-N	-1	3	350.396	2.515	40	5		FFBBHM
Cc1cccc(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1C	ZINC000223923211	509350567	/nfs/dbraw/zinc/35/05/67/509350567.db2.gz	MCIQZQNDFAJKCO-UHFFFAOYSA-N	-1	3	350.396	2.569	40	5		FFBBHM
Cc1ccc(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c(C)c1	ZINC000017333980	220213490	/nfs/dbraw/zinc/21/34/90/220213490.db2.gz	KDBBATDPMYMNIZ-UHFFFAOYSA-N	-1	3	350.396	2.569	40	5		FFBBHM
CC(=O)[N-]C(=O)c1ccc(-c2ccc(Br)cc2[N+](=O)[O-])o1	ZINC000085346810	508303109	/nfs/dbraw/zinc/30/31/09/508303109.db2.gz	NCBGAKFZXXBKFO-UHFFFAOYSA-N	-1	3	353.128	2.894	40	5		FFBBHM
CC(C)Oc1ccc(C[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000020045732	519779729	/nfs/dbraw/zinc/77/97/29/519779729.db2.gz	PWUANHKPVCOINZ-UHFFFAOYSA-N	-1	3	350.396	2.861	40	5		FFBBHM
COC(=O)c1ccc(Cl)c([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000006379890	263345172	/nfs/dbraw/zinc/34/51/72/263345172.db2.gz	DZCBQILSLOWTCI-UHFFFAOYSA-N	-1	3	370.770	2.836	40	5		FFBBHM
Cc1cc(C(=O)Nc2cccc([N+](=O)[O-])c2C)ccc1[N-]S(C)(=O)=O	ZINC000010368175	506741357	/nfs/dbraw/zinc/74/13/57/506741357.db2.gz	VXWZJDCSRJWRDV-UHFFFAOYSA-N	-1	3	363.395	2.835	40	5		FFBBHM
Cc1ccc(NC(=O)CSc2n[n-]c(-c3ccccn3)n2)cc1[N+](=O)[O-]	ZINC000408582093	513087611	/nfs/dbraw/zinc/08/76/11/513087611.db2.gz	LUWXVRAPMQVXGH-UHFFFAOYSA-N	-1	3	370.394	2.814	40	5		FFBBHM
CS(=O)(=O)[N-]c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000218401182	509276341	/nfs/dbraw/zinc/27/63/41/509276341.db2.gz	VHEWKPYRJWMZKJ-UHFFFAOYSA-N	-1	3	369.786	2.872	40	5		FFBBHM
COc1ccc(CCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000013668973	220081895	/nfs/dbraw/zinc/08/18/95/220081895.db2.gz	RSECUHSRDUYISH-UHFFFAOYSA-N	-1	3	350.396	2.515	40	5		FFBBHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCSCc1ccccc1F	ZINC000013670571	220082644	/nfs/dbraw/zinc/08/26/44/220082644.db2.gz	DRYSBYCXDHZWGW-UHFFFAOYSA-N	-1	3	370.427	2.946	40	5		FFBBHM
COC(=O)c1cccc(S(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2Cl)c1	ZINC000223794649	509347704	/nfs/dbraw/zinc/34/77/04/509347704.db2.gz	ZPLZQRZJLATDMA-UHFFFAOYSA-N	-1	3	370.770	2.836	40	5		FFBBHM
CS(=O)(=O)[N-]c1ccc(Cl)c(C(=O)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000044945862	506902122	/nfs/dbraw/zinc/90/21/22/506902122.db2.gz	UTBDQJJMTULPBZ-UHFFFAOYSA-N	-1	3	369.786	2.872	40	5		FFBBHM
COc1c([N+](=O)[O-])cc([N-]C(=O)c2cccc([N+](=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000103933903	508324294	/nfs/dbraw/zinc/32/42/94/508324294.db2.gz	ZAHDDZWIYAQPLD-UHFFFAOYSA-N	-1	3	362.254	2.672	40	5		FFBBHM
O=[N+]([O-])c1ccc(Cl)c([N-]S(=O)(=O)c2ccc3c(c2)OCCO3)c1	ZINC000223645667	509344034	/nfs/dbraw/zinc/34/40/34/509344034.db2.gz	JRKCIGFWCXMDRB-UHFFFAOYSA-N	-1	3	370.770	2.820	40	5		FFBBHM
COc1ccc([N+](=O)[O-])cc1[N-]C(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000100455780	206223919	/nfs/dbraw/zinc/22/39/19/206223919.db2.gz	OGDUHKCNOCZDEA-UHFFFAOYSA-N	-1	3	362.254	2.672	40	5		FFBBHM
Cc1cc(I)cnc1[N-]C(=O)c1ccc([N+](=O)[O-])o1	ZINC000006572489	204254211	/nfs/dbraw/zinc/25/42/11/204254211.db2.gz	VEESCGFXTQAHFO-UHFFFAOYSA-N	-1	3	373.106	2.748	40	5		FFBBHM
Cc1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1[N-]S(C)(=O)=O	ZINC000010315014	263365355	/nfs/dbraw/zinc/36/53/55/263365355.db2.gz	MFGHCIKXEZXRNG-UHFFFAOYSA-N	-1	3	363.395	2.835	40	5		FFBBHM
O=C(c1ccccc1[N+](=O)[O-])N1NC(C(F)(F)F)=C[C@@]1([O-])C(F)(F)F	ZINC000001064072	506245142	/nfs/dbraw/zinc/24/51/42/506245142.db2.gz	GRMPNWKXOWIFQU-SNVBAGLBSA-N	-1	3	371.193	2.610	40	5		FFBBHM
O=C(OCc1ccccc1)c1cc(-c2cnc[n-]c2=O)cc([N+](=O)[O-])c1	ZINC000096312678	508213724	/nfs/dbraw/zinc/21/37/24/508213724.db2.gz	AARHXWLYCQHRLC-UHFFFAOYSA-N	-1	3	351.318	2.702	40	5		FFBBHM
COc1cccc(OC)c1C(=O)[N-]c1nnc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000020496151	526219123	/nfs/dbraw/zinc/21/91/23/526219123.db2.gz	RBKRWKYXNUCMCQ-UHFFFAOYSA-N	-1	3	370.321	2.914	40	5		FFBBHM
O=C([N-]c1nc2ccc(N3CCOCC3)cc2s1)c1ccc([N+](=O)[O-])o1	ZINC000006971522	506522101	/nfs/dbraw/zinc/52/21/01/506522101.db2.gz	FMKZGHSMBAXEJH-UHFFFAOYSA-N	-1	3	374.378	2.886	40	5		FFBBHM
COC(=O)c1ccc(CS(=O)(=O)[N-]c2cccc([N+](=O)[O-])c2C)cc1	ZINC000020453855	522049404	/nfs/dbraw/zinc/04/94/04/522049404.db2.gz	BJWJRXQIXQUZLA-UHFFFAOYSA-N	-1	3	364.379	2.632	40	5		FFBBHM
Cc1ccc(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1C	ZINC000223975665	509350503	/nfs/dbraw/zinc/35/05/03/509350503.db2.gz	LXRDWYCWDFAIJN-UHFFFAOYSA-N	-1	3	350.396	2.569	40	5		FFBBHM
Nc1nc(-c2ccccc2)c(CCCOc2ccc([N+](=O)[O-])cc2)c(=O)[n-]1	ZINC000017040402	507113937	/nfs/dbraw/zinc/11/39/37/507113937.db2.gz	PMALEAKMHWJFCJ-UHFFFAOYSA-N	-1	3	366.377	2.939	40	5		FFBBHM
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cc(Cl)ccc1[O-]	ZINC000408598828	513088606	/nfs/dbraw/zinc/08/86/06/513088606.db2.gz	BLMXEPJUCSECNG-UHFFFAOYSA-N	-1	3	350.714	2.749	40	5		FFBBHM
O=Cc1cc([N+](=O)[O-])ccc1OC1=C([O-])N(c2ccc(Cl)cc2)C(=O)C1	ZINC000100864214	209218827	/nfs/dbraw/zinc/21/88/27/209218827.db2.gz	KHQANEGSTQNJCY-HNNXBMFYSA-N	-1	3	374.736	2.772	40	5		FFBBHM
COc1cccc(OC)c1C(=O)[N-]c1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000020496191	526219108	/nfs/dbraw/zinc/21/91/08/526219108.db2.gz	VGLLKSCLMJULTJ-UHFFFAOYSA-N	-1	3	370.321	2.914	40	5		FFBBHM
COc1cccc(CCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000010543437	207303777	/nfs/dbraw/zinc/30/37/77/207303777.db2.gz	UEMGWVRCQONHTQ-UHFFFAOYSA-N	-1	3	350.396	2.515	40	5		FFBBHM
CCS(=O)(=O)[N-]c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	ZINC000408701145	513090838	/nfs/dbraw/zinc/09/08/38/513090838.db2.gz	SDOFVOKDYWPRSH-UHFFFAOYSA-N	-1	3	363.395	2.917	40	5		FFBBHM
COC(=O)c1ccc(C)c([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c1	ZINC000020036660	521989984	/nfs/dbraw/zinc/98/99/84/521989984.db2.gz	KXUIOXBKQFWOKY-UHFFFAOYSA-N	-1	3	364.379	2.632	40	5		FFBBHM
CC(C)C1=C[C@]([O-])(C(F)(F)F)N(C(=O)Cc2ccc([N+](=O)[O-])cc2)N1	ZINC000409060549	513098669	/nfs/dbraw/zinc/09/86/69/513098669.db2.gz	XFJWNZALIKKGOP-AWEZNQCLSA-N	-1	3	359.304	2.633	40	5		FFBBHM
COc1ccc([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)c(OC)c1	ZINC000020484419	524683879	/nfs/dbraw/zinc/68/38/79/524683879.db2.gz	AJZXJSQJPIUCAI-UHFFFAOYSA-N	-1	3	352.368	2.554	40	5		FFBBHM
Cc1ccc(OCC[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1Cl	ZINC000224141649	509355988	/nfs/dbraw/zinc/35/59/88/509355988.db2.gz	ZRSCFJZHLMAOBQ-UHFFFAOYSA-N	-1	3	370.814	2.914	40	5		FFBBHM
Cc1ccc([N-]C(=S)NC(=O)c2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1	ZINC000408618624	513089805	/nfs/dbraw/zinc/08/98/05/513089805.db2.gz	DRMJJGGLNGYKTI-UHFFFAOYSA-N	-1	3	373.390	2.801	40	5		FFBBHM
COc1cccc(OC)c1C(=O)NC(=S)[N-]c1ccccc1[N+](=O)[O-]	ZINC000006954733	210721511	/nfs/dbraw/zinc/72/15/11/210721511.db2.gz	PUTWEKOBUIYDGF-UHFFFAOYSA-N	-1	3	361.379	2.739	40	5		FFBBHM
O=C(c1ccccc1[N+](=O)[O-])N1NC(C(F)(F)F)=C[C@]1([O-])C(F)(F)F	ZINC000001064070	210311260	/nfs/dbraw/zinc/31/12/60/210311260.db2.gz	GRMPNWKXOWIFQU-JTQLQIEISA-N	-1	3	371.193	2.610	40	5		FFBBHM
COc1c([O-])ccc(C=Cc2cc(C(F)(F)F)nc(=O)[nH]2)c1[N+](=O)[O-]	ZINC000408720448	513092906	/nfs/dbraw/zinc/09/29/06/513092906.db2.gz	PHBOCDNYLREJOQ-DUXPYHPUSA-N	-1	3	357.244	2.994	40	5		FFBBHM
Cc1ccc([N-]C(=S)NC(=O)c2ccc3c(c2)OCO3)c([N+](=O)[O-])c1	ZINC000032127838	506232949	/nfs/dbraw/zinc/23/29/49/506232949.db2.gz	ZYBNVLYHCPQAEQ-UHFFFAOYSA-N	-1	3	359.363	2.759	40	5		FFBBHM
CC(=O)c1ccc(NC(=O)c2n[n-]c([N+](=O)[O-])c2Br)cc1	ZINC000005900509	506461792	/nfs/dbraw/zinc/46/17/92/506461792.db2.gz	XKQPGSKOUOSSQC-UHFFFAOYSA-N	-1	3	353.132	2.535	40	5		FFBBHM
CC(=O)c1ccc(NC(=O)c2[n-]nc([N+](=O)[O-])c2Br)cc1	ZINC000005900509	506461797	/nfs/dbraw/zinc/46/17/97/506461797.db2.gz	XKQPGSKOUOSSQC-UHFFFAOYSA-N	-1	3	353.132	2.535	40	5		FFBBHM
COC(=O)c1ccc(CS(=O)(=O)[N-]c2cc([N+](=O)[O-])ccc2C)cc1	ZINC000030755443	507812788	/nfs/dbraw/zinc/81/27/88/507812788.db2.gz	BTQAVGPHVSISJT-UHFFFAOYSA-N	-1	3	364.379	2.632	40	5		FFBBHM
Cc1c([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)cccc1[N+](=O)[O-]	ZINC000020039586	211266677	/nfs/dbraw/zinc/26/66/77/211266677.db2.gz	HKWBPZIFXFVZQU-UHFFFAOYSA-N	-1	3	351.340	2.753	40	5		FFBBHM
COc1ccc([C@H](C)[N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])cc1OC	ZINC000014220410	211086159	/nfs/dbraw/zinc/08/61/59/211086159.db2.gz	OEZSHOYXEYWWTN-NSHDSACASA-N	-1	3	366.395	2.652	40	5		FFBBHM
O=C([N-]c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)c1ccc([N+](=O)[O-])cc1	ZINC000039741470	263399735	/nfs/dbraw/zinc/39/97/35/263399735.db2.gz	LTLANHLXFSNJTG-UHFFFAOYSA-N	-1	3	355.266	2.805	40	5		FFBBHM
CS(=O)(=O)[N-]c1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(Cl)c1	ZINC000030873655	507814106	/nfs/dbraw/zinc/81/41/06/507814106.db2.gz	DFLJLPRFYHNHTN-UHFFFAOYSA-N	-1	3	369.786	2.872	40	5		FFBBHM
CCOC(=O)c1ccc([N-]S(=O)(=O)Cc2cccc([N+](=O)[O-])c2)cc1	ZINC000030862156	507814239	/nfs/dbraw/zinc/81/42/39/507814239.db2.gz	YKZUCKYQJMJRJN-UHFFFAOYSA-N	-1	3	364.379	2.713	40	5		FFBBHM
CC(=O)[N-]C(=O)c1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1	ZINC000085346796	508303126	/nfs/dbraw/zinc/30/31/26/508303126.db2.gz	INWWPXPAMISEDO-UHFFFAOYSA-N	-1	3	353.128	2.894	40	5		FFBBHM
CCS(=O)(=O)[N-]c1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1	ZINC000408703581	513091122	/nfs/dbraw/zinc/09/11/22/513091122.db2.gz	TYWPRMSIXAXTPS-UHFFFAOYSA-N	-1	3	363.395	2.917	40	5		FFBBHM
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1[O-]	ZINC000409410928	263556718	/nfs/dbraw/zinc/55/67/18/263556718.db2.gz	AQOAIYYAMJCKOM-UHFFFAOYSA-N	-1	3	350.714	2.749	40	5		FFBBHM
Cc1nccn1-c1ccccc1C[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000020106892	527385344	/nfs/dbraw/zinc/38/53/44/527385344.db2.gz	FWDUVYOVHJIVJI-UHFFFAOYSA-N	-1	3	372.406	2.567	40	5		FFBBHM