smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
O=C(Nc1nnc(-c2ccco2)[n-]1)c1ccc([N+](=O)[O-])cc1	ZINC000048235283	362250977	/nfs/dbraw/zinc/25/09/77/362250977.db2.gz	CEIOSISNKCFRSI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
O=C(Nc1nc(-c2ccco2)n[n-]1)c1ccc([N+](=O)[O-])cc1	ZINC000048235283	362250980	/nfs/dbraw/zinc/25/09/80/362250980.db2.gz	CEIOSISNKCFRSI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
O=C(Nc1n[n-]c(-c2ccco2)n1)c1ccc([N+](=O)[O-])cc1	ZINC000048235283	362250982	/nfs/dbraw/zinc/25/09/82/362250982.db2.gz	CEIOSISNKCFRSI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
O=C([N-]c1ccncc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000004421274	361315966	/nfs/dbraw/zinc/31/59/66/361315966.db2.gz	ZUYOYUFELXFPKH-UHFFFAOYSA-N	-1	3	288.219	2.150	50	5		CEBAHM
O=[N+]([O-])c1cnc([N-]c2cnn(C[C@@H]3CCCO3)c2)s1	ZINC000253425137	371521345	/nfs/dbraw/zinc/52/13/45/371521345.db2.gz	AZWABRYXQFRIDA-VIFPVBQESA-N	-1	3	295.324	2.170	50	5		CEBAHM
CSC[C@H](C)N(C)Cc1ccc([O-])c([N+](=O)[O-])c1	ZINC000093558354	364199457	/nfs/dbraw/zinc/19/94/57/364199457.db2.gz	ZOJFUCIVXKPUOR-VIFPVBQESA-N	-1	3	270.354	2.484	50	5		CEBAHM
O=[N+]([O-])c1cnc([N-]c2cnn(CC3CC3)c2)s1	ZINC000192472102	369818131	/nfs/dbraw/zinc/81/81/31/369818131.db2.gz	VKCCKZLAPMRKNB-UHFFFAOYSA-N	-1	3	265.298	2.401	50	5		CEBAHM
Cc1ccc(C(=O)[N-]c2nc(C3CC3)no2)cc1[N+](=O)[O-]	ZINC000096407928	394682089	/nfs/dbraw/zinc/68/20/89/394682089.db2.gz	SWJSGRSUQOUENM-UHFFFAOYSA-N	-1	3	288.263	2.416	50	5		CEBAHM
CCOC(=O)[N-]C(=S)Nc1ccc([N+](=O)[O-])cc1	ZINC000005196113	170075234	/nfs/dbraw/zinc/07/52/34/170075234.db2.gz	HJEKLTSBXFXIBD-UHFFFAOYSA-N	-1	3	269.282	2.038	50	5		CEBAHM
O=C([N-]c1ccc(Cl)cn1)c1ccc([N+](=O)[O-])o1	ZINC000000556099	284302729	/nfs/dbraw/zinc/30/27/29/284302729.db2.gz	ALSYYWANOOZBIV-UHFFFAOYSA-N	-1	3	267.628	2.489	50	5		CEBAHM
O=C([N-]c1nccs1)c1ccc([N+](=O)[O-])s1	ZINC000000136937	361133635	/nfs/dbraw/zinc/13/36/35/361133635.db2.gz	CQEIDDDNARWBHT-UHFFFAOYSA-N	-1	3	255.280	2.365	50	5		CEBAHM
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CCC(=O)[O-]	ZINC000105979362	186096073	/nfs/dbraw/zinc/09/60/73/186096073.db2.gz	QUNSUWXVFZIXCM-SECBINFHSA-N	-1	3	252.270	2.062	50	5		CEBAHM
CSc1nnc([N-]C(=O)c2ccccc2[N+](=O)[O-])s1	ZINC000004086604	361299285	/nfs/dbraw/zinc/29/92/85/361299285.db2.gz	JAWZIZYFPSFOJP-UHFFFAOYSA-N	-1	3	296.333	2.421	50	5		CEBAHM
Cc1cc(OC(=O)CCC2CCCC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000004248331	361307313	/nfs/dbraw/zinc/30/73/13/361307313.db2.gz	WUVHOLCYPRUIBA-UHFFFAOYSA-N	-1	3	294.307	2.467	50	5		CEBAHM
O=c1[n-][nH]c(=O)c2ccc(Oc3ccc([N+](=O)[O-])cc3)cc12	ZINC000000267343	169592487	/nfs/dbraw/zinc/59/24/87/169592487.db2.gz	GIJPQCKPHUFJBW-UHFFFAOYSA-N	-1	3	299.242	2.329	50	5		CEBAHM
Cc1csc([N-]C(=O)c2ccc([N+](=O)[O-])o2)n1	ZINC000016989287	279045205	/nfs/dbraw/zinc/04/52/05/279045205.db2.gz	LHPSLTJRUDZCNE-UHFFFAOYSA-N	-1	3	253.239	2.205	50	5		CEBAHM
O=C(NC(=S)[N-]c1ccccc1[N+](=O)[O-])c1ccco1	ZINC000003904002	295590720	/nfs/dbraw/zinc/59/07/20/295590720.db2.gz	NWTAJLXIUHMZNP-UHFFFAOYSA-N	-1	3	291.288	2.315	50	5		CEBAHM
O=[N+]([O-])c1cncc([N+](=O)[O-])c1Nc1cccc([O-])c1	ZINC000005017055	280383469	/nfs/dbraw/zinc/38/34/69/280383469.db2.gz	PNSVEOKQAAHOLS-UHFFFAOYSA-N	-1	3	276.208	2.347	50	5		CEBAHM
CCC(C)(C)[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000046033593	362173038	/nfs/dbraw/zinc/17/30/38/362173038.db2.gz	FQSRMLGCVCPVPP-UHFFFAOYSA-N	-1	3	286.353	2.370	50	5		CEBAHM
Cc1n[nH]cc1[N-]c1nc2ccccn2c1[N+](=O)[O-]	ZINC000049469785	400233502	/nfs/dbraw/zinc/23/35/02/400233502.db2.gz	BOMAWIIEDXPMGS-UHFFFAOYSA-N	-1	3	258.241	2.018	50	5		CEBAHM
Cc1ccc(C(=O)Nc2ncccc2[O-])cc1[N+](=O)[O-]	ZINC000022262065	171383137	/nfs/dbraw/zinc/38/31/37/171383137.db2.gz	FIRGRMMKMHGNFR-UHFFFAOYSA-N	-1	3	273.248	2.256	50	5		CEBAHM
CCC[C@@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000000442358	361175195	/nfs/dbraw/zinc/17/51/95/361175195.db2.gz	FVZKLIUUZLZZFN-SECBINFHSA-N	-1	3	272.326	2.062	50	5		CEBAHM
Cc1ccc([O-])c(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1	ZINC000000435177	361174654	/nfs/dbraw/zinc/17/46/54/361174654.db2.gz	GODXUKJVRHMFBB-UHFFFAOYSA-N	-1	3	298.254	2.409	50	5		CEBAHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]C1CCCCC1	ZINC000000333728	361162585	/nfs/dbraw/zinc/16/25/85/361162585.db2.gz	MLDBPBAIRZLOJF-UHFFFAOYSA-N	-1	3	284.337	2.206	50	5		CEBAHM
CCCc1[nH]nc(C(=O)[N-]c2cc(C)ns2)c1[N+](=O)[O-]	ZINC000089960412	364022943	/nfs/dbraw/zinc/02/29/43/364022943.db2.gz	RONXCARELOGYOT-UHFFFAOYSA-N	-1	3	295.324	2.288	50	5		CEBAHM
Cc1cc(=O)cc(C)n1-c1ccc([O-])cc1[N+](=O)[O-]	ZINC000036714055	301066376	/nfs/dbraw/zinc/06/63/76/301066376.db2.gz	BQIBMOMAIBLDHL-UHFFFAOYSA-N	-1	3	260.249	2.068	50	5		CEBAHM
CCc1[nH]nc(C(=O)Nc2ccc(C)cc2[O-])c1[N+](=O)[O-]	ZINC000097000727	185149996	/nfs/dbraw/zinc/14/99/96/185149996.db2.gz	TYSPFIKFMRDLGH-UHFFFAOYSA-N	-1	3	290.279	2.147	50	5		CEBAHM
CCC(C)(CC)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000071904734	176295650	/nfs/dbraw/zinc/29/56/50/176295650.db2.gz	WPHFCBFNJOMGLJ-UHFFFAOYSA-N	-1	3	286.353	2.452	50	5		CEBAHM
O=C([N-]c1cccnc1-n1cccn1)c1ccc([N+](=O)[O-])o1	ZINC000025013049	361618364	/nfs/dbraw/zinc/61/83/64/361618364.db2.gz	QCTSAQBBFAQJNY-UHFFFAOYSA-N	-1	3	299.246	2.021	50	5		CEBAHM
CSC[C@H](C)N(C)Cc1ccc([N+](=O)[O-])c([O-])c1	ZINC000093558220	364199079	/nfs/dbraw/zinc/19/90/79/364199079.db2.gz	BFYZMCYBMOCKOL-VIFPVBQESA-N	-1	3	270.354	2.484	50	5		CEBAHM
O=[N+]([O-])c1ccc(NC([O-])=NOCc2cccnc2)cc1	ZINC000095467271	364388011	/nfs/dbraw/zinc/38/80/11/364388011.db2.gz	CCVIRVLEOYFZBT-UHFFFAOYSA-N	-1	3	288.263	2.243	50	5		CEBAHM
O=C([N-]OCc1cccnc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000095467271	364388021	/nfs/dbraw/zinc/38/80/21/364388021.db2.gz	CCVIRVLEOYFZBT-UHFFFAOYSA-N	-1	3	288.263	2.243	50	5		CEBAHM
O=C1[N-]C(=O)/C(=C/c2ccc([N+](=O)[O-])cc2)c2ccccc21	ZINC000030058169	284857363	/nfs/dbraw/zinc/85/73/63/284857363.db2.gz	ZMTPWOZLQYWFTI-NTEUORMPSA-N	-1	3	294.266	2.405	50	5		CEBAHM
CCOC(=O)C(Sc1ccccc1[N+](=O)[O-])=C(C)[O-]	ZINC000003122212	361263517	/nfs/dbraw/zinc/26/35/17/361263517.db2.gz	HXBHGDCPTIKIHI-NSHDSACASA-N	-1	3	283.305	2.208	50	5		CEBAHM
CCCCS(=O)(=O)[N-]c1cccc([N+](=O)[O-])c1C	ZINC000008195582	170324018	/nfs/dbraw/zinc/32/40/18/170324018.db2.gz	AMSUEIGEDHQBCG-UHFFFAOYSA-N	-1	3	272.326	2.445	50	5		CEBAHM
O=C1[N-]C(=O)c2cc(Oc3ccc([N+](=O)[O-])cc3)ccc21	ZINC000000432007	361173895	/nfs/dbraw/zinc/17/38/95/361173895.db2.gz	SIYSZMYKSGLGCS-UHFFFAOYSA-N	-1	3	284.227	2.271	50	5		CEBAHM
CCCS(=O)(=O)[N-]c1cc(C)c([N+](=O)[O-])cc1C	ZINC000188594586	369380924	/nfs/dbraw/zinc/38/09/24/369380924.db2.gz	FTGDLLYLTFJBPW-UHFFFAOYSA-N	-1	3	272.326	2.363	50	5		CEBAHM
O=c1ccnc(C=Cc2ccc(F)c([N+](=O)[O-])c2)[n-]1	ZINC000885808660	653053891	/nfs/dbraw/zinc/05/38/91/653053891.db2.gz	LLCRFKSLCMSCLL-RQOWECAXSA-N	-1	3	261.212	2.400	50	5		CEBAHM
O=[N+]([O-])c1cc(CN2CCCC2)c2cccnc2c1[O-]	ZINC000020119324	361580771	/nfs/dbraw/zinc/58/07/71/361580771.db2.gz	ZRJDLIPVEZBXHD-UHFFFAOYSA-N	-1	3	273.292	2.444	50	5		CEBAHM
O=C1[N-]C(=O)/C(=C\c2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000015661951	284858416	/nfs/dbraw/zinc/85/84/16/284858416.db2.gz	VGVYORSHPURIDD-ZROIWOOFSA-N	-1	3	294.266	2.405	50	5		CEBAHM
CCc1ccccc1NC(=O)c1n[n-]c(OC)c1[N+](=O)[O-]	ZINC000006412702	170199659	/nfs/dbraw/zinc/19/96/59/170199659.db2.gz	ZGRNBFGFBYCDHJ-UHFFFAOYSA-N	-1	3	290.279	2.141	50	5		CEBAHM
CCc1ccccc1NC(=O)c1[n-]nc(OC)c1[N+](=O)[O-]	ZINC000006412702	170199662	/nfs/dbraw/zinc/19/96/62/170199662.db2.gz	ZGRNBFGFBYCDHJ-UHFFFAOYSA-N	-1	3	290.279	2.141	50	5		CEBAHM
COc1[n-]nc(C(=O)Nc2cc(C)cc(C)c2)c1[N+](=O)[O-]	ZINC000006694241	170226729	/nfs/dbraw/zinc/22/67/29/170226729.db2.gz	BLVQCOLTMDYJNI-UHFFFAOYSA-N	-1	3	290.279	2.196	50	5		CEBAHM
COc1n[n-]c(C(=O)Nc2cc(C)cc(C)c2)c1[N+](=O)[O-]	ZINC000006694241	170226730	/nfs/dbraw/zinc/22/67/30/170226730.db2.gz	BLVQCOLTMDYJNI-UHFFFAOYSA-N	-1	3	290.279	2.196	50	5		CEBAHM
Cc1[n-]c2n[nH]c(=O)c-2c2c3ccccc3oc(=O)c12	ZINC000020085950	282005882	/nfs/dbraw/zinc/00/58/82/282005882.db2.gz	OBTLGRNZJBTVAB-UHFFFAOYSA-N	-1	3	267.244	2.232	50	5		CEBAHM
O=C([N-]c1nncs1)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000000175109	169564729	/nfs/dbraw/zinc/56/47/29/169564729.db2.gz	PCBKKMATWAZRBJ-UHFFFAOYSA-N	-1	3	284.684	2.352	50	5		CEBAHM
O=Cc1[n-]nc2cc(Br)cc([N+](=O)[O-])c12	ZINC000014983662	285034568	/nfs/dbraw/zinc/03/45/68/285034568.db2.gz	MEBOPKMSYVDVSQ-UHFFFAOYSA-N	-1	3	270.042	2.046	50	5		CEBAHM
CC(=O)c1cccc([N-]C(=O)c2noc(C)c2[N+](=O)[O-])c1	ZINC000004937335	170042558	/nfs/dbraw/zinc/04/25/58/170042558.db2.gz	IFPVQLSXBZKVDW-UHFFFAOYSA-N	-1	3	289.247	2.346	50	5		CEBAHM
Cc1cccc(C(=O)Oc2cc(C)[n-]c(=O)c2[N+](=O)[O-])c1	ZINC000004248337	361307252	/nfs/dbraw/zinc/30/72/52/361307252.db2.gz	LICVOUBUDFKJKT-UHFFFAOYSA-N	-1	3	288.259	2.119	50	5		CEBAHM
COc1ccc(-c2ccc([N+](=O)[O-])c(=O)[n-]2)c(OC)c1	ZINC000261492237	190039280	/nfs/dbraw/zinc/03/92/80/190039280.db2.gz	OEGQAMUWKKADLL-UHFFFAOYSA-N	-1	3	276.248	2.380	50	5		CEBAHM
COc1ccc(-c2ccc([N+](=O)[O-])c([O-])n2)c(OC)c1	ZINC000261492237	190039282	/nfs/dbraw/zinc/03/92/82/190039282.db2.gz	OEGQAMUWKKADLL-UHFFFAOYSA-N	-1	3	276.248	2.380	50	5		CEBAHM
CCCCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000002831362	361254211	/nfs/dbraw/zinc/25/42/11/361254211.db2.gz	FRDMBQIKWIJULT-UHFFFAOYSA-N	-1	3	272.326	2.063	50	5		CEBAHM
COc1ccc([N-]C(=O)c2noc(C)c2C)c([N+](=O)[O-])c1	ZINC000013641132	361434896	/nfs/dbraw/zinc/43/48/96/361434896.db2.gz	MUBPSJUBYYXWBM-UHFFFAOYSA-N	-1	3	291.263	2.461	50	5		CEBAHM
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CCC(=O)[O-]	ZINC000105979359	186095759	/nfs/dbraw/zinc/09/57/59/186095759.db2.gz	QUNSUWXVFZIXCM-VIFPVBQESA-N	-1	3	252.270	2.062	50	5		CEBAHM
CC(C)(C)[N-]S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000003888095	361293422	/nfs/dbraw/zinc/29/34/22/361293422.db2.gz	XNICQKNRODLDEQ-UHFFFAOYSA-N	-1	3	292.744	2.325	50	5		CEBAHM
CC(C)CO[N-]C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000095432582	364374548	/nfs/dbraw/zinc/37/45/48/364374548.db2.gz	ZHHOENRRJITJND-UHFFFAOYSA-N	-1	3	253.258	2.304	50	5		CEBAHM
Cc1cc(C(=O)[N-]c2nncs2)ccc1[N+](=O)[O-]	ZINC000000174760	361140024	/nfs/dbraw/zinc/14/00/24/361140024.db2.gz	QELHVSXHKWYPFE-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
O=C([N-]c1ccncc1[N+](=O)[O-])c1ccccc1F	ZINC000003897582	361293364	/nfs/dbraw/zinc/29/33/64/361293364.db2.gz	JIGKNGZGQGIQSY-UHFFFAOYSA-N	-1	3	261.212	2.381	50	5		CEBAHM
O=C(Nc1nnc(-c2ccco2)[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000012908595	361408148	/nfs/dbraw/zinc/40/81/48/361408148.db2.gz	QKPVBNGWWGQDDI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
O=C(Nc1nc(-c2ccco2)n[n-]1)c1cccc([N+](=O)[O-])c1	ZINC000012908595	361408152	/nfs/dbraw/zinc/40/81/52/361408152.db2.gz	QKPVBNGWWGQDDI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
O=C(Nc1n[n-]c(-c2ccco2)n1)c1cccc([N+](=O)[O-])c1	ZINC000012908595	361408157	/nfs/dbraw/zinc/40/81/57/361408157.db2.gz	QKPVBNGWWGQDDI-UHFFFAOYSA-N	-1	3	299.246	2.225	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000016996551	361500828	/nfs/dbraw/zinc/50/08/28/361500828.db2.gz	UHWVXZUPIKULKG-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
O=c1[n-]nc(SCc2cccc([N+](=O)[O-])c2)n1C1CC1	ZINC000009994341	170393068	/nfs/dbraw/zinc/39/30/68/170393068.db2.gz	YNNWASCZVHELKT-UHFFFAOYSA-N	-1	3	292.320	2.107	50	5		CEBAHM
O=C1[N-]C(=O)c2cc(Oc3cccc([N+](=O)[O-])c3)ccc21	ZINC000004499619	361318566	/nfs/dbraw/zinc/31/85/66/361318566.db2.gz	KMXHZOCQWXKDRH-UHFFFAOYSA-N	-1	3	284.227	2.271	50	5		CEBAHM
CC[C@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000032770500	361755943	/nfs/dbraw/zinc/75/59/43/361755943.db2.gz	KADJUNYDEIPPRZ-ZETCQYMHSA-N	-1	3	292.744	2.325	50	5		CEBAHM
CC1CCC([N-]S(=O)(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000014251820	361454640	/nfs/dbraw/zinc/45/46/40/361454640.db2.gz	POEFUKSILQNHGK-UHFFFAOYSA-N	-1	3	298.364	2.452	50	5		CEBAHM
O=[N+]([O-])c1cnc([N-]c2cnn(C[C@H]3CCCO3)c2)s1	ZINC000253425135	371520940	/nfs/dbraw/zinc/52/09/40/371520940.db2.gz	AZWABRYXQFRIDA-SECBINFHSA-N	-1	3	295.324	2.170	50	5		CEBAHM
CCCCS(=O)(=O)[N-]c1cccc([N+](=O)[O-])c1	ZINC000008195581	170324143	/nfs/dbraw/zinc/32/41/43/170324143.db2.gz	JDZYXKYVENFPEY-UHFFFAOYSA-N	-1	3	258.299	2.137	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2ccccc2[N+](=O)[O-])s1	ZINC000000068066	361123837	/nfs/dbraw/zinc/12/38/37/361123837.db2.gz	OHWAZQSQHHFWQE-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
CSC[C@@H](C)N(C)Cc1ccc([O-])c([N+](=O)[O-])c1	ZINC000093558355	364199587	/nfs/dbraw/zinc/19/95/87/364199587.db2.gz	ZOJFUCIVXKPUOR-SECBINFHSA-N	-1	3	270.354	2.484	50	5		CEBAHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@@H](C)C(C)C	ZINC000040105623	174191365	/nfs/dbraw/zinc/19/13/65/174191365.db2.gz	VJBUZJCRJDSOPU-JTQLQIEISA-N	-1	3	286.353	2.226	50	5		CEBAHM
Cc1cc(OC(=O)CC2CCCC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000004248330	361307404	/nfs/dbraw/zinc/30/74/04/361307404.db2.gz	XVPHFQHVCBTTOL-UHFFFAOYSA-N	-1	3	280.280	2.077	50	5		CEBAHM
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1[O-]	ZINC000004695712	170000223	/nfs/dbraw/zinc/00/02/23/170000223.db2.gz	VJLGNQXAFOBHJH-UHFFFAOYSA-N	-1	3	288.259	2.318	50	5		CEBAHM
Cc1nc2c(sc3nc4ccccc4n32)c(=O)[n-]1	ZINC000005890861	279120168	/nfs/dbraw/zinc/12/01/68/279120168.db2.gz	MVNWPKYQCPZZNH-UHFFFAOYSA-N	-1	3	256.290	2.094	50	5		CEBAHM
O=c1cc(N2CCCCC2)[n-]n1-c1ccc([N+](=O)[O-])cc1	ZINC000004553882	361321020	/nfs/dbraw/zinc/32/10/20/361321020.db2.gz	CXUNUEAZRSAFCQ-UHFFFAOYSA-N	-1	3	288.307	2.131	50	5		CEBAHM
O=[N+]([O-])c1cnc([N-]c2cnn(CC(F)F)c2)s1	ZINC000192457451	395384065	/nfs/dbraw/zinc/38/40/65/395384065.db2.gz	QDECEUSAPRETJH-UHFFFAOYSA-N	-1	3	275.240	2.257	50	5		CEBAHM
Cc1ccc(C(=O)[N-]c2nncs2)cc1[N+](=O)[O-]	ZINC000000175573	361139921	/nfs/dbraw/zinc/13/99/21/361139921.db2.gz	DQDKPOUEEVWBCZ-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
Cc1nnsc1C(=O)[N-]c1ccccc1[N+](=O)[O-]	ZINC000004584520	361323366	/nfs/dbraw/zinc/32/33/66/361323366.db2.gz	YCZVUZPZLJUBBZ-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
Cc1cc([N-]C(=O)COc2cc(C)ccc2[N+](=O)[O-])on1	ZINC000010320591	361349380	/nfs/dbraw/zinc/34/93/80/361349380.db2.gz	YRYNKFZCWUQAFV-UHFFFAOYSA-N	-1	3	291.263	2.217	50	5		CEBAHM
Nc1ncnc([N-]c2ccccc2Cl)c1[N+](=O)[O-]	ZINC000003912549	169924605	/nfs/dbraw/zinc/92/46/05/169924605.db2.gz	WJAGWCTUOUUFCL-UHFFFAOYSA-N	-1	3	265.660	2.364	50	5		CEBAHM
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)[N-][C@H](C)C(C)C	ZINC000040105624	302049468	/nfs/dbraw/zinc/04/94/68/302049468.db2.gz	VJBUZJCRJDSOPU-SNVBAGLBSA-N	-1	3	286.353	2.226	50	5		CEBAHM
CCn1cc([N+](=O)[O-])c(C(=O)[N-]c2ccc(Cl)cn2)n1	ZINC000002762866	361249564	/nfs/dbraw/zinc/24/95/64/361249564.db2.gz	JCVOLLDXJLALIH-UHFFFAOYSA-N	-1	3	295.686	2.112	50	5		CEBAHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1ccccc1	ZINC000000102600	361128790	/nfs/dbraw/zinc/12/87/90/361128790.db2.gz	FCYOCKBPAZXLKH-UHFFFAOYSA-N	-1	3	292.316	2.073	50	5		CEBAHM
CCOC(=O)C(Sc1ccc([N+](=O)[O-])cc1)=C(C)[O-]	ZINC000196461001	370146126	/nfs/dbraw/zinc/14/61/26/370146126.db2.gz	JOVMJRSYKCNHND-NSHDSACASA-N	-1	3	283.305	2.208	50	5		CEBAHM
Cc1cc([O-])ccc1N1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000009543554	414747136	/nfs/dbraw/zinc/74/71/36/414747136.db2.gz	QQSHBYLNNCSBFF-UHFFFAOYSA-N	-1	3	298.254	2.409	50	5		CEBAHM
O=[N+]([O-])c1cccc2n[n-]c(I)c21	ZINC000014983392	280373094	/nfs/dbraw/zinc/37/30/94/280373094.db2.gz	AOTAXYVEONHYHY-UHFFFAOYSA-N	-1	3	289.032	2.076	50	5		CEBAHM
O=[N+]([O-])c1cccc2[n-]nc(I)c21	ZINC000014983392	280373096	/nfs/dbraw/zinc/37/30/96/280373096.db2.gz	AOTAXYVEONHYHY-UHFFFAOYSA-N	-1	3	289.032	2.076	50	5		CEBAHM
COc1c([O-])ccc(CN2CCC=C(F)C2)c1[N+](=O)[O-]	ZINC000585117289	813684039	/nfs/dbraw/zinc/68/40/39/813684039.db2.gz	XJGQOFVKLFMEJJ-UHFFFAOYSA-N	-1	3	282.271	2.368	50	5		CEBAHM
O=[N+]([O-])c1ccc([N-]c2ccn(Cc3ccccn3)n2)nc1	ZINC000068904775	362950370	/nfs/dbraw/zinc/95/03/70/362950370.db2.gz	KMPSHBWZBBGTRW-UHFFFAOYSA-N	-1	3	296.290	2.373	50	5		CEBAHM
CCc1nnc([N-]C(=O)c2ccccc2[N+](=O)[O-])s1	ZINC000000187509	361142790	/nfs/dbraw/zinc/14/27/90/361142790.db2.gz	BKEFWSGDEJNGAL-UHFFFAOYSA-N	-1	3	278.293	2.261	50	5		CEBAHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]Cc1cccs1	ZINC000000475821	361179240	/nfs/dbraw/zinc/17/92/40/361179240.db2.gz	RSNGUGHWITUZDT-UHFFFAOYSA-N	-1	3	298.345	2.135	50	5		CEBAHM
CCCCCC[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000002479026	361235591	/nfs/dbraw/zinc/23/55/91/361235591.db2.gz	WUOCQJDBLLNLPF-UHFFFAOYSA-N	-1	3	286.353	2.453	50	5		CEBAHM
Cc1ccc(C(=O)Oc2cc(C)[n-]c(=O)c2[N+](=O)[O-])cc1	ZINC000013523222	361431510	/nfs/dbraw/zinc/43/15/10/361431510.db2.gz	ZIXIKVPBAWQVSC-UHFFFAOYSA-N	-1	3	288.259	2.119	50	5		CEBAHM
O=C(NCc1ccccc1[N+](=O)[O-])c1ccccc1[O-]	ZINC000040979550	362010108	/nfs/dbraw/zinc/01/01/08/362010108.db2.gz	LCZUBKMGZNAOBL-UHFFFAOYSA-N	-1	3	272.260	2.230	50	5		CEBAHM
COc1[n-]nc(C(=O)Nc2cc(C)ccc2F)c1[N+](=O)[O-]	ZINC000001002374	361196068	/nfs/dbraw/zinc/19/60/68/361196068.db2.gz	ZOUXXIQVMPFEAP-UHFFFAOYSA-N	-1	3	294.242	2.026	50	5		CEBAHM
COc1n[n-]c(C(=O)Nc2cc(C)ccc2F)c1[N+](=O)[O-]	ZINC000001002374	361196072	/nfs/dbraw/zinc/19/60/72/361196072.db2.gz	ZOUXXIQVMPFEAP-UHFFFAOYSA-N	-1	3	294.242	2.026	50	5		CEBAHM
O=[N+]([O-])c1ccc(Sc2nnc(C(F)(F)F)[n-]2)nc1	ZINC000001040671	361197074	/nfs/dbraw/zinc/19/70/74/361197074.db2.gz	TVMKMQQASWRLIW-UHFFFAOYSA-N	-1	3	291.214	2.278	50	5		CEBAHM
O=[N+]([O-])c1ccc(Sc2nc(C(F)(F)F)n[n-]2)nc1	ZINC000001040671	361197079	/nfs/dbraw/zinc/19/70/79/361197079.db2.gz	TVMKMQQASWRLIW-UHFFFAOYSA-N	-1	3	291.214	2.278	50	5		CEBAHM
O=[N+]([O-])c1ccc[n-]c1=NN1Cc2ccccc2C1	ZINC000089865457	364010998	/nfs/dbraw/zinc/01/09/98/364010998.db2.gz	NJRSMHATOFNQSX-UHFFFAOYSA-N	-1	3	256.265	2.333	50	5		CEBAHM
O=c1[n-][nH]c(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc12	ZINC000000226971	169580302	/nfs/dbraw/zinc/58/03/02/169580302.db2.gz	IEWNMNCIZPIAOG-UHFFFAOYSA-N	-1	3	299.242	2.329	50	5		CEBAHM
Cc1cccc([N-]c2c([N+](=O)[O-])cncc2[N+](=O)[O-])n1	ZINC000004433553	302005691	/nfs/dbraw/zinc/00/56/91/302005691.db2.gz	LPNWSBGDTVNYHY-UHFFFAOYSA-N	-1	3	275.224	2.345	50	5		CEBAHM
O=C1[N-]C(=O)/C(=C\c2ccc([N+](=O)[O-])cc2)c2ccccc21	ZINC000015661952	629251185	/nfs/dbraw/zinc/25/11/85/629251185.db2.gz	ZMTPWOZLQYWFTI-ZROIWOOFSA-N	-1	3	294.266	2.405	50	5		CEBAHM
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccccc1[O-]	ZINC000000285184	361156926	/nfs/dbraw/zinc/15/69/26/361156926.db2.gz	LXXSKZBRHCUVEA-UHFFFAOYSA-N	-1	3	284.227	2.101	50	5		CEBAHM
CCC(C)(C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000000620093	361190814	/nfs/dbraw/zinc/19/08/14/361190814.db2.gz	XJYVTKFHTRITJH-UHFFFAOYSA-N	-1	3	272.326	2.062	50	5		CEBAHM
Cc1cc(OC(=O)CC2CCCCC2)c([N+](=O)[O-])c(=O)[n-]1	ZINC000004248329	361307892	/nfs/dbraw/zinc/30/78/92/361307892.db2.gz	PSUKKIILMASMOL-UHFFFAOYSA-N	-1	3	294.307	2.467	50	5		CEBAHM
CC(C)(C)C(=O)NC(=S)[N-]c1ccccc1[N+](=O)[O-]	ZINC000003953444	361296166	/nfs/dbraw/zinc/29/61/66/361296166.db2.gz	VZYNWSUMPDNIOF-UHFFFAOYSA-N	-1	3	281.337	2.454	50	5		CEBAHM
O=[N+]([O-])c1cccc(CS(=O)(=O)c2cccc([O-])c2)c1	ZINC000183994863	368662578	/nfs/dbraw/zinc/66/25/78/368662578.db2.gz	SURFDCFEMCKNTH-UHFFFAOYSA-N	-1	3	293.300	2.274	50	5		CEBAHM
CC(=O)c1ccc([N-]C(=O)c2noc(C)c2[N+](=O)[O-])cc1	ZINC000004937307	170042823	/nfs/dbraw/zinc/04/28/23/170042823.db2.gz	ASSVLJRKUJZRFY-UHFFFAOYSA-N	-1	3	289.247	2.346	50	5		CEBAHM
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]CCC1CCCC1	ZINC000030426929	260140490	/nfs/dbraw/zinc/14/04/90/260140490.db2.gz	VVTZIGNKTOWBFQ-UHFFFAOYSA-N	-1	3	298.364	2.453	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2cccc(C)c2[N+](=O)[O-])s1	ZINC000000463544	361177901	/nfs/dbraw/zinc/17/79/01/361177901.db2.gz	OCXUCVOWSCYDTI-UHFFFAOYSA-N	-1	3	278.293	2.315	50	5		CEBAHM
Cc1cc(OC(=O)c2ccccc2C)c([N+](=O)[O-])c(=O)[n-]1	ZINC000004248336	361308023	/nfs/dbraw/zinc/30/80/23/361308023.db2.gz	CLCNNROVJDUJRH-UHFFFAOYSA-N	-1	3	288.259	2.119	50	5		CEBAHM
NC(=O)c1ccsc1[N-]C(=O)c1ccc([N+](=O)[O-])s1	ZINC000004275734	361308746	/nfs/dbraw/zinc/30/87/46/361308746.db2.gz	STTCSAUYKTXBKI-UHFFFAOYSA-N	-1	3	297.317	2.069	50	5		CEBAHM
O=[N+]([O-])c1cccc(-c2ccc([N+](=O)[O-])c([O-])n2)c1	ZINC000261492254	285152663	/nfs/dbraw/zinc/15/26/63/285152663.db2.gz	PBGXDIRXPKETEZ-UHFFFAOYSA-N	-1	3	261.193	2.271	50	5		CEBAHM
O=c1[n-]c(-c2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-]	ZINC000261492254	285152665	/nfs/dbraw/zinc/15/26/65/285152665.db2.gz	PBGXDIRXPKETEZ-UHFFFAOYSA-N	-1	3	261.193	2.271	50	5		CEBAHM
O=C(Cc1ccccc1[N+](=O)[O-])Nc1ccccc1[O-]	ZINC000008051470	170316740	/nfs/dbraw/zinc/31/67/40/170316740.db2.gz	XCWCKKGJBVZCAD-UHFFFAOYSA-N	-1	3	272.260	2.482	50	5		CEBAHM
CC(=O)NCCCc1oc2ccc([O-])cc2c1[N+](=O)[O-]	ZINC000005073811	343353606	/nfs/dbraw/zinc/35/36/06/343353606.db2.gz	PKJCPXBDORHKCR-UHFFFAOYSA-N	-1	3	278.264	2.115	50	5		CEBAHM
O=C(NCc1ccc([N+](=O)[O-])cc1)c1ccccc1[O-]	ZINC000048737275	362301165	/nfs/dbraw/zinc/30/11/65/362301165.db2.gz	FWIATRIAYGBQSS-UHFFFAOYSA-N	-1	3	272.260	2.230	50	5		CEBAHM
O=C(Cc1ccc([N+](=O)[O-])cc1)c1c(O)cc([O-])cc1O	ZINC000000523501	361183303	/nfs/dbraw/zinc/18/33/03/361183303.db2.gz	JFWOJRCRRTUMLR-UHFFFAOYSA-N	-1	3	289.243	2.137	50	5		CEBAHM
CC(=O)C(Sc1ccccc1[N+](=O)[O-])=C(C)[O-]	ZINC000101403245	364556831	/nfs/dbraw/zinc/55/68/31/364556831.db2.gz	PEOWJYFDVGGZAJ-UHFFFAOYSA-N	-1	3	253.279	2.234	50	5		CEBAHM
CCOC(=O)C(Sc1ccc([N+](=O)[O-])cc1)=C(C)[O-]	ZINC000196460989	370146138	/nfs/dbraw/zinc/14/61/38/370146138.db2.gz	JOVMJRSYKCNHND-LLVKDONJSA-N	-1	3	283.305	2.208	50	5		CEBAHM
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1c1ccc([O-])cc1	ZINC000000225799	285016695	/nfs/dbraw/zinc/01/66/95/285016695.db2.gz	WRPGJNGBYRQQJR-UHFFFAOYSA-N	-1	3	284.227	2.101	50	5		CEBAHM
CCCCS(=O)(=O)[N-]c1ccc(C)c([N+](=O)[O-])c1	ZINC000008195596	170324070	/nfs/dbraw/zinc/32/40/70/170324070.db2.gz	ZKAGVNHGQLMQCW-UHFFFAOYSA-N	-1	3	272.326	2.445	50	5		CEBAHM
Cc1cc([N-]C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)no1	ZINC000002309806	280619363	/nfs/dbraw/zinc/61/93/63/280619363.db2.gz	PTOMBRUVBKDTCF-UHFFFAOYSA-N	-1	3	292.207	2.052	50	5		CEBAHM
CSC[C@@H](C)N(C)Cc1ccc([N+](=O)[O-])c([O-])c1	ZINC000093558221	364199009	/nfs/dbraw/zinc/19/90/09/364199009.db2.gz	BFYZMCYBMOCKOL-SECBINFHSA-N	-1	3	270.354	2.484	50	5		CEBAHM
CCCCC[N-]S(=O)(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000046033613	362172688	/nfs/dbraw/zinc/17/26/88/362172688.db2.gz	KPHBUAVIUWUEIE-UHFFFAOYSA-N	-1	3	286.353	2.372	50	5		CEBAHM
COc1ccc(C(=O)[N-]c2nnc(C)s2)cc1[N+](=O)[O-]	ZINC000000175650	361140385	/nfs/dbraw/zinc/14/03/85/361140385.db2.gz	MWPYRIRCXSMRDN-UHFFFAOYSA-N	-1	3	294.292	2.016	50	5		CEBAHM
Cc1cc(C)[n-]c(=NNc2ccc([N+](=O)[O-])cc2)n1	ZINC000004476897	394455373	/nfs/dbraw/zinc/45/53/73/394455373.db2.gz	LZDOVFZLVULRGK-UHFFFAOYSA-N	-1	3	259.269	2.441	50	5		CEBAHM
COc1cc(C(=O)[N-]c2ccc([N+](=O)[O-])c(Cl)c2)on1	ZINC000097108886	364454050	/nfs/dbraw/zinc/45/40/50/364454050.db2.gz	WSOSIKOVWDTTSD-UHFFFAOYSA-N	-1	3	297.654	2.497	50	5		CEBAHM
Cc1cc([N-]C(=O)c2ccc([N+](=O)[O-])o2)sn1	ZINC000038680714	174152343	/nfs/dbraw/zinc/15/23/43/174152343.db2.gz	FHXLUUKLOPQYAN-UHFFFAOYSA-N	-1	3	253.239	2.205	50	5		CEBAHM
CCCCc1cc([N-]C(=O)c2n[nH]c(C)c2[N+](=O)[O-])on1	ZINC000096449775	529016692	/nfs/dbraw/zinc/01/66/92/529016692.db2.gz	FJQYWUPYQUCCSE-UHFFFAOYSA-N	-1	3	293.283	2.209	50	5		CEBAHM
CCC[C@H](C)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000000442359	361175270	/nfs/dbraw/zinc/17/52/70/361175270.db2.gz	FVZKLIUUZLZZFN-VIFPVBQESA-N	-1	3	272.326	2.062	50	5		CEBAHM
O=[N+]([O-])c1cnc([N-]c2ccc(O)cc2)c([N+](=O)[O-])c1	ZINC000003880509	361291908	/nfs/dbraw/zinc/29/19/08/361291908.db2.gz	NPUBTAPNNPACRY-UHFFFAOYSA-N	-1	3	276.208	2.347	50	5		CEBAHM
Cc1cnc([N-]C(=O)c2ccc([N+](=O)[O-])o2)s1	ZINC000020462267	394472052	/nfs/dbraw/zinc/47/20/52/394472052.db2.gz	HHSOJXZVIBXNQP-UHFFFAOYSA-N	-1	3	253.239	2.205	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2ccc(Cl)c([N+](=O)[O-])c2)o1	ZINC000008878295	170358128	/nfs/dbraw/zinc/35/81/28/170358128.db2.gz	PAQBXUMBFDJQNU-UHFFFAOYSA-N	-1	3	282.643	2.192	50	5		CEBAHM
O=[N+]([O-])c1ccc([N-]c2ccn(CC(F)F)n2)nc1	ZINC000079014919	363565273	/nfs/dbraw/zinc/56/52/73/363565273.db2.gz	YRJFBABHLPBBBF-UHFFFAOYSA-N	-1	3	269.211	2.195	50	5		CEBAHM
O=C([N-]c1nccc2sccc21)c1n[nH]cc1[N+](=O)[O-]	ZINC000097141927	364462765	/nfs/dbraw/zinc/46/27/65/364462765.db2.gz	MBOMFDPMCIDNIW-UHFFFAOYSA-N	-1	3	289.276	2.180	50	5		CEBAHM
Cc1ccc([N+](=O)[O-])cc1[N-]C(=O)c1csnn1	ZINC000011914436	278866441	/nfs/dbraw/zinc/86/64/41/278866441.db2.gz	LOTPYTKCHZTOKL-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
CCCCO[N-]C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000005466052	170101905	/nfs/dbraw/zinc/10/19/05/170101905.db2.gz	BHCKLXGZNBUNKO-UHFFFAOYSA-N	-1	3	253.258	2.448	50	5		CEBAHM
Cc1noc(C)c1C(=O)[N-]c1ccccc1[N+](=O)[O-]	ZINC000061997286	362700127	/nfs/dbraw/zinc/70/01/27/362700127.db2.gz	VWTCJHRLGZRNPF-UHFFFAOYSA-N	-1	3	261.237	2.452	50	5		CEBAHM
CCCC(=O)NC(=S)[N-]c1ccccc1[N+](=O)[O-]	ZINC000004754491	170011790	/nfs/dbraw/zinc/01/17/90/170011790.db2.gz	YAUHOGWECBULSS-UHFFFAOYSA-N	-1	3	267.310	2.208	50	5		CEBAHM
Cc1cccc(NC(=O)c2c[n-]c(=O)c([N+](=O)[O-])c2)c1F	ZINC000193825419	534747541	/nfs/dbraw/zinc/74/75/41/534747541.db2.gz	UIAKOBMICFUHFQ-UHFFFAOYSA-N	-1	3	291.238	2.395	50	5		CEBAHM
O=[N+]([O-])C(=CNCc1ccccc1)c1cc([O-])ccc1O	ZINC000017111220	343372546	/nfs/dbraw/zinc/37/25/46/343372546.db2.gz	NPSRMRWMLLJDIC-UVTDQMKNSA-N	-1	3	286.287	2.463	50	5		CEBAHM
O=[N+]([O-])C(=CNCc1ccccc1)c1cc(O)ccc1[O-]	ZINC000017111220	343372548	/nfs/dbraw/zinc/37/25/48/343372548.db2.gz	NPSRMRWMLLJDIC-UVTDQMKNSA-N	-1	3	286.287	2.463	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000000291334	361157102	/nfs/dbraw/zinc/15/71/02/361157102.db2.gz	XRGKSSUMKQULIB-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
CCOC(=O)C(Sc1ccccc1[N+](=O)[O-])=C(C)[O-]	ZINC000003122211	361263567	/nfs/dbraw/zinc/26/35/67/361263567.db2.gz	HXBHGDCPTIKIHI-LLVKDONJSA-N	-1	3	283.305	2.208	50	5		CEBAHM
Nc1ncnc2sc([N-]c3ccc([N+](=O)[O-])cc3)nc21	ZINC000004053623	361298973	/nfs/dbraw/zinc/29/89/73/361298973.db2.gz	FOBJMMRTOOIGMU-UHFFFAOYSA-N	-1	3	288.292	2.320	50	5		CEBAHM
COc1cc(Br)cc(/C=C\[N+](=O)[O-])c1[O-]	ZINC000006008372	170168131	/nfs/dbraw/zinc/16/81/31/170168131.db2.gz	CARLZVQDCYXBNQ-IHWYPQMZSA-N	-1	3	274.070	2.411	50	5		CEBAHM
Nc1ccc(C(=O)Nc2ccccc2[O-])cc1[N+](=O)[O-]	ZINC000032855794	361760709	/nfs/dbraw/zinc/76/07/09/361760709.db2.gz	TZIIHRNVCVMIJE-UHFFFAOYSA-N	-1	3	273.248	2.135	50	5		CEBAHM
COc1[n-]nc(C(=O)Nc2cc(F)ccc2C)c1[N+](=O)[O-]	ZINC000008684376	170345357	/nfs/dbraw/zinc/34/53/57/170345357.db2.gz	SQBVPYAEGLPVPN-UHFFFAOYSA-N	-1	3	294.242	2.026	50	5		CEBAHM
COc1n[n-]c(C(=O)Nc2cc(F)ccc2C)c1[N+](=O)[O-]	ZINC000008684376	170345358	/nfs/dbraw/zinc/34/53/58/170345358.db2.gz	SQBVPYAEGLPVPN-UHFFFAOYSA-N	-1	3	294.242	2.026	50	5		CEBAHM
CC(C)c1nc([N-]C(=O)c2ccc(F)cc2[N+](=O)[O-])n[nH]1	ZINC000095965220	185045777	/nfs/dbraw/zinc/04/57/77/185045777.db2.gz	ZBFWVGDYUULNIE-UHFFFAOYSA-N	-1	3	293.258	2.228	50	5		CEBAHM
O=[N+]([O-])C(=CNCc1ccccc1)c1cc([O-])ccc1O	ZINC000000333865	343350447	/nfs/dbraw/zinc/35/04/47/343350447.db2.gz	NPSRMRWMLLJDIC-GXDHUFHOSA-N	-1	3	286.287	2.463	50	5		CEBAHM
O=[N+]([O-])C(=CNCc1ccccc1)c1cc(O)ccc1[O-]	ZINC000000333865	343350449	/nfs/dbraw/zinc/35/04/49/343350449.db2.gz	NPSRMRWMLLJDIC-GXDHUFHOSA-N	-1	3	286.287	2.463	50	5		CEBAHM
CCC(CC)[N-]S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000000457197	361177308	/nfs/dbraw/zinc/17/73/08/361177308.db2.gz	MRGMNBFSKOGDKU-UHFFFAOYSA-N	-1	3	272.326	2.062	50	5		CEBAHM
O=C([N-]c1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])o1	ZINC000004015303	361297053	/nfs/dbraw/zinc/29/70/53/361297053.db2.gz	DYIADNLKPBUEDT-UHFFFAOYSA-N	-1	3	277.192	2.348	50	5		CEBAHM
COc1ccc([N-]C(=O)c2ccco2)c([N+](=O)[O-])c1	ZINC000003958665	361295357	/nfs/dbraw/zinc/29/53/57/361295357.db2.gz	YVSLGWKHGUBBCV-UHFFFAOYSA-N	-1	3	262.221	2.449	50	5		CEBAHM
CC[C@@H](C)[N-]S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000032770498	361755908	/nfs/dbraw/zinc/75/59/08/361755908.db2.gz	KADJUNYDEIPPRZ-SSDOTTSWSA-N	-1	3	292.744	2.325	50	5		CEBAHM
CCc1nnc([N-]C(=O)c2cccc([N+](=O)[O-])c2)s1	ZINC000000187512	361142945	/nfs/dbraw/zinc/14/29/45/361142945.db2.gz	FUSAIFWELZGRIK-UHFFFAOYSA-N	-1	3	278.293	2.261	50	5		CEBAHM
O=c1[n-]nc(SCc2ccc([N+](=O)[O-])cc2)n1C1CC1	ZINC000008211997	170324953	/nfs/dbraw/zinc/32/49/53/170324953.db2.gz	QGLCIEMFZVPTSV-UHFFFAOYSA-N	-1	3	292.320	2.107	50	5		CEBAHM
Cc1ccc([N-]C(=O)c2csnn2)cc1[N+](=O)[O-]	ZINC000011915826	361368809	/nfs/dbraw/zinc/36/88/09/361368809.db2.gz	DAPFXYKICWHLTP-UHFFFAOYSA-N	-1	3	264.266	2.007	50	5		CEBAHM
O=C(Nc1ncccc1[O-])c1csc([N+](=O)[O-])c1	ZINC000044948958	362157415	/nfs/dbraw/zinc/15/74/15/362157415.db2.gz	VIHCVEFWFFJFSQ-UHFFFAOYSA-N	-1	3	265.250	2.009	50	5		CEBAHM
CC(=O)C(Sc1ccc([N+](=O)[O-])cc1)=C(C)[O-]	ZINC000100384870	364545469	/nfs/dbraw/zinc/54/54/69/364545469.db2.gz	STQAWVPECAWACE-UHFFFAOYSA-N	-1	3	253.279	2.234	50	5		CEBAHM
CCc1nnc([N-]C(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000096562012	230385682	/nfs/dbraw/zinc/38/56/82/230385682.db2.gz	SVGYDZRJUXYOOI-UHFFFAOYSA-N	-1	3	278.293	2.261	50	5		CEBAHM
Cc1nnc([N-]C(=O)c2ccc(F)c([N+](=O)[O-])c2)s1	ZINC000000995897	361195940	/nfs/dbraw/zinc/19/59/40/361195940.db2.gz	XOYJDCQYVFCVBK-UHFFFAOYSA-N	-1	3	282.256	2.146	50	5		CEBAHM
Cc1onc(C(=O)[N-]c2cccnc2Cl)c1[N+](=O)[O-]	ZINC000004937313	170042720	/nfs/dbraw/zinc/04/27/20/170042720.db2.gz	ZHKMLHZQCZNIQQ-UHFFFAOYSA-N	-1	3	282.643	2.192	50	5		CEBAHM