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(NC[C@@H](O)[C@@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600243539	361902133	/nfs/dbraw/zinc/90/21/33/361902133.db2.gz	ULYQLILEXUMOOY-NEPJUHHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN1CCOC[C@H]1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600420109	361955436	/nfs/dbraw/zinc/95/54/36/361955436.db2.gz	JBIAWVVGPZBHGV-SECBINFHSA-N	0	2	295.295	0.361	20	5		CCBDLN
COc1ccc(C(=O)NCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000358359648	232088017	/nfs/dbraw/zinc/08/80/17/232088017.db2.gz	RMDUWSFDVMDAKI-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
O=C(N[C@H]1[C@@H]2COC[C@@H]21)c1ccc([N+](=O)[O-])c(O)c1	ZINC000357899400	303994370	/nfs/dbraw/zinc/99/43/70/303994370.db2.gz	ATJPYJBCMGGKGY-VROVMSAKSA-N	0	2	264.237	0.675	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])cc1C(=O)N=c1cccn[nH]1	ZINC000346070055	137266001	/nfs/dbraw/zinc/26/60/01/137266001.db2.gz	VGTRPYPVADQQDL-UHFFFAOYSA-N	0	2	259.225	0.762	20	5		CCBDLN
CC(C)(C)n1cnc(=NC(=O)c2n[nH]cc2[N+](=O)[O-])[nH]1	ZINC000345767057	137251687	/nfs/dbraw/zinc/25/16/87/137251687.db2.gz	GWBLOAWDDALCEO-UHFFFAOYSA-N	0	2	279.260	0.339	20	5		CCBDLN
COC(=O)[C@@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)[C@H]1C	ZINC000346683150	137298974	/nfs/dbraw/zinc/29/89/74/137298974.db2.gz	FWCOGBCDBUPJST-DTWKUNHWSA-N	0	2	282.300	0.712	20	5		CCBDLN
O=C([O-])[C@H]1COCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000088380326	349366342	/nfs/dbraw/zinc/36/63/42/349366342.db2.gz	XHOLVEAFSVAVAF-GFCCVEGCSA-N	0	2	280.280	0.923	20	5		CCBDLN
O=C([O-])[C@H]1COCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000088380326	349366344	/nfs/dbraw/zinc/36/63/44/349366344.db2.gz	XHOLVEAFSVAVAF-GFCCVEGCSA-N	0	2	280.280	0.923	20	5		CCBDLN
CNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000132286058	350302768	/nfs/dbraw/zinc/30/27/68/350302768.db2.gz	LSXCNIWASLGQDN-LURJTMIESA-N	0	2	267.241	0.165	20	5		CCBDLN
Cn1cnc(CCNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000228545475	352076151	/nfs/dbraw/zinc/07/61/51/352076151.db2.gz	WBWOCBOJCNWGRK-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
CN(C)C(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234228992	352155148	/nfs/dbraw/zinc/15/51/48/352155148.db2.gz	IFCRNIAKAMDPQA-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(NC[C@H]1COCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236561643	352198295	/nfs/dbraw/zinc/19/82/95/352198295.db2.gz	QIUCVHJTTGAWMI-VIFPVBQESA-N	0	2	282.252	0.446	20	5		CCBDLN
O=C1N[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N2CCSC[C@@H]12	ZINC000270777780	352983760	/nfs/dbraw/zinc/98/37/60/352983760.db2.gz	IPHNTNZBBNNEGL-GXSJLCMTSA-N	0	2	295.320	0.846	20	5		CCBDLN
CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000272414084	353061478	/nfs/dbraw/zinc/06/14/78/353061478.db2.gz	PDKIAQNMWIRGBW-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
CCOC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272465141	353066669	/nfs/dbraw/zinc/06/66/69/353066669.db2.gz	YGGBSOWQYOAOPM-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
COC[C@@H](O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274829950	353165693	/nfs/dbraw/zinc/16/56/93/353165693.db2.gz	RSKKPLWAXAVXDG-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
COC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000280066225	353336090	/nfs/dbraw/zinc/33/60/90/353336090.db2.gz	RBLCCQWVKFBFPP-SSDOTTSWSA-N	0	2	270.241	0.038	20	5		CCBDLN
CCOC(=O)CCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280840442	353388110	/nfs/dbraw/zinc/38/81/10/353388110.db2.gz	UYCHKUINGJMPDE-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
CN1CCOC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000330565713	354415534	/nfs/dbraw/zinc/41/55/34/354415534.db2.gz	KFXULIRYVXVWBN-JTQLQIEISA-N	0	2	281.268	0.570	20	5		CCBDLN
CC[C@@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355096971	356576313	/nfs/dbraw/zinc/57/63/13/356576313.db2.gz	CPDLFBGCMMAPOB-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
CCN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000619825327	366361566	/nfs/dbraw/zinc/36/15/66/366361566.db2.gz	MPSCBSUYCNXQJG-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
CCn1nccc1S(=O)(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000359409965	356817239	/nfs/dbraw/zinc/81/72/39/356817239.db2.gz	BLKRLKBGRNCXGM-UHFFFAOYSA-N	0	2	297.296	0.429	20	5		CCBDLN
Nc1noc(CCNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000359561757	356845060	/nfs/dbraw/zinc/84/50/60/356845060.db2.gz	DLTGSIKOKRKSNL-UHFFFAOYSA-N	0	2	293.239	0.068	20	5		CCBDLN
COC[C@@](C)(O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000452784480	236261022	/nfs/dbraw/zinc/26/10/22/236261022.db2.gz	WHIGQFWQORHLFJ-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
CCN1CC[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1=O	ZINC000586824745	359294490	/nfs/dbraw/zinc/29/44/90/359294490.db2.gz	PNGWXULQEGOICP-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
NC(=O)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000588803355	359339169	/nfs/dbraw/zinc/33/91/69/359339169.db2.gz	JHIKUZJGTPOEOO-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
NC(=O)C[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000589942119	359411580	/nfs/dbraw/zinc/41/15/80/359411580.db2.gz	JNXWUFLZHYPBEA-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
C[C@@H]1[C@H](O)CCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000590881522	359534732	/nfs/dbraw/zinc/53/47/32/359534732.db2.gz	FJNBSPPWEOQYFB-VXNVDRBHSA-N	0	2	266.253	0.896	20	5		CCBDLN
CC(=O)NCCN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000563197403	291204466	/nfs/dbraw/zinc/20/44/66/291204466.db2.gz	KENXEDNBFZRGOI-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CC(C)n1cnc(=NC(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]1	ZINC000593784141	360151160	/nfs/dbraw/zinc/15/11/60/360151160.db2.gz	JCGXYMCKULNJJA-UHFFFAOYSA-N	0	2	264.245	0.770	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H]2C[C@H]1C[S@@]2=O	ZINC000593872670	360185897	/nfs/dbraw/zinc/18/58/97/360185897.db2.gz	LZTYYKVKXBLLTA-FRUKKLPWSA-N	0	2	296.304	0.646	20	5		CCBDLN
CO[C@@](C)(CO)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000594396648	360292326	/nfs/dbraw/zinc/29/23/26/360292326.db2.gz	JFROBOGPWPLHQF-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NCC1(CO)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000613991327	364455534	/nfs/dbraw/zinc/45/55/34/364455534.db2.gz	CDYREQFUBUHSMN-UHFFFAOYSA-N	0	2	266.253	0.803	20	5		CCBDLN
C[C@@H](O)CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H](C)CO	ZINC000275947554	193170684	/nfs/dbraw/zinc/17/06/84/193170684.db2.gz	DHXFCPBOSGVEPP-RKDXNWHRSA-N	0	2	298.295	0.504	20	5		CCBDLN
CO[C@@H]1COC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000569004974	291642673	/nfs/dbraw/zinc/64/26/73/291642673.db2.gz	MFFCGNKTVVDXSB-MWLCHTKSSA-N	0	2	282.252	0.444	20	5		CCBDLN
O=C(NCCCn1ccnn1)c1ccc([N+](=O)[O-])cc1O	ZINC000122159119	284684514	/nfs/dbraw/zinc/68/45/14/284684514.db2.gz	ODUHSBZUHNQEEI-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
CCN(CCO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000128599786	284756849	/nfs/dbraw/zinc/75/68/49/284756849.db2.gz	OWRIIKIVUXSWFB-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
C[C@H]1CC(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000364367445	389259169	/nfs/dbraw/zinc/25/91/69/389259169.db2.gz	CUYRNYUAYQYWTC-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
NC(=O)CC1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000421908301	389380935	/nfs/dbraw/zinc/38/09/35/389380935.db2.gz	CNBDVVJUFCWTSL-UHFFFAOYSA-N	0	2	293.279	0.686	20	5		CCBDLN
O=C(NC1(CO)CCOCC1)c1cc([N+](=O)[O-])ccc1O	ZINC000274064814	389481085	/nfs/dbraw/zinc/48/10/85/389481085.db2.gz	UGUIKRVLDDFQDR-UHFFFAOYSA-N	0	2	296.279	0.572	20	5		CCBDLN
C[C@@]1(O)C[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000416281964	389724309	/nfs/dbraw/zinc/72/43/09/389724309.db2.gz	BHHFUTPLUBEXMP-OGXFKERWSA-N	0	2	266.253	0.944	20	5		CCBDLN
NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000182105331	389699957	/nfs/dbraw/zinc/69/99/57/389699957.db2.gz	ZJDYRVYFHGVKCH-UHFFFAOYSA-N	0	2	265.225	0.048	20	5		CCBDLN
CNC(=O)C(C)(C)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182139466	389701668	/nfs/dbraw/zinc/70/16/68/389701668.db2.gz	PRAKAXLNPVKBNY-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)nn1C	ZINC000436731092	389983715	/nfs/dbraw/zinc/98/37/15/389983715.db2.gz	NNVGEAYQRPGDNM-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
COCC[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436982846	389989290	/nfs/dbraw/zinc/98/92/90/389989290.db2.gz	VGADVIKVDFCPAX-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
C[C@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436972816	389989308	/nfs/dbraw/zinc/98/93/08/389989308.db2.gz	PTFRKAJRTGPTJP-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCC1(O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000282992978	195764494	/nfs/dbraw/zinc/76/44/94/195764494.db2.gz	UXERNFNDBLFORM-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
C[C@@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000361654682	533326785	/nfs/dbraw/zinc/32/67/85/533326785.db2.gz	LYBFFGCMNHGMQO-VIFPVBQESA-N	0	2	295.295	0.960	20	5		CCBDLN
O=C(Nc1ccn(-c2ncccc2F)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000371125906	144319320	/nfs/dbraw/zinc/31/93/20/144319320.db2.gz	BQDSUUDEJCOUQS-VXNVDRBHSA-N	0	2	291.242	0.432	20	5		CCBDLN
C[C@@H]1CO[C@@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436885802	397535049	/nfs/dbraw/zinc/53/50/49/397535049.db2.gz	FDOGZRYNWRMBMX-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@@H](O)C2(CC2)C1	ZINC000376050653	304502644	/nfs/dbraw/zinc/50/26/44/304502644.db2.gz	OMOKAXVABLZQDN-LLVKDONJSA-N	0	2	278.264	0.897	20	5		CCBDLN
NC(=O)[C@H]1CC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000576238963	335176361	/nfs/dbraw/zinc/17/63/61/335176361.db2.gz	NPCQKZRHKJZDAB-YUMQZZPRSA-N	0	2	279.252	0.750	20	5		CCBDLN
C[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000384821446	336132035	/nfs/dbraw/zinc/13/20/35/336132035.db2.gz	QBRFLESSWVRDRQ-VXNVDRBHSA-N	0	2	266.253	0.896	20	5		CCBDLN
CCN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000452959038	527949191	/nfs/dbraw/zinc/94/91/91/527949191.db2.gz	QYRNYMVYFNNPKO-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C([O-])[C@@H]1CC12CC[NH+](Cn1nccc1[N+](=O)[O-])CC2	ZINC000739537471	581567997	/nfs/dbraw/zinc/56/79/97/581567997.db2.gz	VAIVGYCUMUHWMM-VIFPVBQESA-N	0	2	280.284	0.936	20	5		CCBDLN
COc1ccc(NC(=O)C[N@H+](C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000739922396	581635076	/nfs/dbraw/zinc/63/50/76/581635076.db2.gz	XSTFQVWBMQJNDT-UHFFFAOYSA-N	0	2	297.267	0.558	20	5		CCBDLN
COc1ccc(NC(=O)C[N@@H+](C)CC(=O)[O-])c([N+](=O)[O-])c1	ZINC000739922396	581635078	/nfs/dbraw/zinc/63/50/78/581635078.db2.gz	XSTFQVWBMQJNDT-UHFFFAOYSA-N	0	2	297.267	0.558	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCCNC(=O)C1	ZINC000772725280	581887044	/nfs/dbraw/zinc/88/70/44/581887044.db2.gz	MAVSELQGLCMMRM-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
O=c1c(-c2nn[nH]n2)cccn1Cc1ccccc1[N+](=O)[O-]	ZINC000738370338	582039956	/nfs/dbraw/zinc/03/99/56/582039956.db2.gz	CVWFFEJLSBQMNC-UHFFFAOYSA-N	0	2	298.262	0.985	20	5		CCBDLN
CSc1ccnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000844843421	617281919	/nfs/dbraw/zinc/28/19/19/617281919.db2.gz	AUAOVKKOBYSRMM-PHDIDXHHSA-N	0	2	254.271	0.802	20	5		CCBDLN
CCOC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])[nH]n1	ZINC000839721878	615177853	/nfs/dbraw/zinc/17/78/53/615177853.db2.gz	UWBTYJPACCUFMW-IYSWYEEDSA-N	0	2	268.229	0.190	20	5		CCBDLN
CCOC(=O)c1cc(NC(=O)[C@@H]2CC2[N+](=O)[O-])[nH]n1	ZINC000839721878	615177855	/nfs/dbraw/zinc/17/78/55/615177855.db2.gz	UWBTYJPACCUFMW-IYSWYEEDSA-N	0	2	268.229	0.190	20	5		CCBDLN
CCOC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n[nH]1	ZINC000839721878	615177857	/nfs/dbraw/zinc/17/78/57/615177857.db2.gz	UWBTYJPACCUFMW-IYSWYEEDSA-N	0	2	268.229	0.190	20	5		CCBDLN
O=C(N[C@H](CO)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000802990353	640712954	/nfs/dbraw/zinc/71/29/54/640712954.db2.gz	WBUIGTGOPSPOMX-SNVBAGLBSA-N	0	2	266.253	0.801	20	5		CCBDLN
C[C@@H]1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C(=O)O1	ZINC000816621768	641179032	/nfs/dbraw/zinc/17/90/32/641179032.db2.gz	ORRAPRQDLKMVAX-MUWHJKNJSA-N	0	2	280.236	0.734	20	5		CCBDLN
Cn1nc(C2CCOCC2)cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000862978353	645054052	/nfs/dbraw/zinc/05/40/52/645054052.db2.gz	POFMECGBVLQITF-MWLCHTKSSA-N	0	2	294.311	0.918	20	5		CCBDLN
COC(=O)c1n[nH]cc1Nc1ncnc(OC)c1[N+](=O)[O-]	ZINC001158632940	801674825	/nfs/dbraw/zinc/67/48/25/801674825.db2.gz	HGGQYDDCTSGCCQ-UHFFFAOYSA-N	0	2	294.227	0.647	20	5		CCBDLN
CC[C@@H](O)C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21	ZINC001227692653	805380839	/nfs/dbraw/zinc/38/08/39/805380839.db2.gz	AMPCDNTXJVVGSO-ZCFIWIBFSA-N	0	2	266.213	0.542	20	5		CCBDLN
COCCn1c(C[N+](=O)[O-])nnc1N1C[C@@H](C)O[C@@H](C)C1	ZINC001122328339	816648606	/nfs/dbraw/zinc/64/86/06/816648606.db2.gz	GJDRVUFOSATZMQ-AOOOYVTPSA-N	0	2	299.331	0.315	20	5		CCBDLN
O=C(Cn1cnc([N+](=O)[O-])n1)Nc1ccc2nn[nH]c2c1	ZINC000337758048	214250262	/nfs/dbraw/zinc/25/02/62/214250262.db2.gz	UPNUPTVCMRYUPA-UHFFFAOYSA-N	0	2	288.227	0.096	20	5		CCBDLN
CN1CCC[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1=O	ZINC000600269510	361910943	/nfs/dbraw/zinc/91/09/43/361910943.db2.gz	WPWQEQXHPJQEMV-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(N[C@H]1COCCC1=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600390059	361939240	/nfs/dbraw/zinc/93/92/40/361939240.db2.gz	MHRLXOBSYUSEET-VIFPVBQESA-N	0	2	280.236	0.388	20	5		CCBDLN
O=C(NC[C@H]1C[C@@H](O)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600512575	361999888	/nfs/dbraw/zinc/99/98/88/361999888.db2.gz	VSKCPTRFYAZUFL-OTSSQURYSA-N	0	2	266.253	0.801	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1	ZINC000600580050	362012812	/nfs/dbraw/zinc/01/28/12/362012812.db2.gz	RDNPWEWQFCJIEI-OCAPTIKFSA-N	0	2	293.279	0.636	20	5		CCBDLN
CCc1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)[nH]1	ZINC000452570164	529739474	/nfs/dbraw/zinc/73/94/74/529739474.db2.gz	BBQCRZHBGIEYFU-UHFFFAOYSA-N	0	2	291.267	0.911	20	5		CCBDLN
O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)N1CCCC1	ZINC000194743061	231917226	/nfs/dbraw/zinc/91/72/26/231917226.db2.gz	RAPZRIYSWGJJLN-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1O)NCC1CC1	ZINC000119076493	349918166	/nfs/dbraw/zinc/91/81/66/349918166.db2.gz	PPOPKMLAMRGGFQ-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
CC(=O)NCCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000031243456	348124880	/nfs/dbraw/zinc/12/48/80/348124880.db2.gz	RQRIBNAYJREOLP-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
O=C(N[C@@H](CO)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000344930974	137222670	/nfs/dbraw/zinc/22/26/70/137222670.db2.gz	YTWPEWABUPUFPX-CABZTGNLSA-N	0	2	296.279	0.570	20	5		CCBDLN
NC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000271321757	191072775	/nfs/dbraw/zinc/07/27/75/191072775.db2.gz	XNYXHBRIQNITNX-SSDOTTSWSA-N	0	2	294.267	0.183	20	5		CCBDLN
CNC(=O)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179490044	351268220	/nfs/dbraw/zinc/26/82/20/351268220.db2.gz	SEKBDUNZZSZAKL-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1CO[C@H](CO)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316023	351945654	/nfs/dbraw/zinc/94/56/54/351945654.db2.gz	NMLLRXHSBPCFKY-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@H]1CO[C@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000231351600	352128059	/nfs/dbraw/zinc/12/80/59/352128059.db2.gz	JLCJRDSISSAJDX-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CNC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272438197	353064247	/nfs/dbraw/zinc/06/42/47/353064247.db2.gz	UIJBKCIPSIELIY-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
COC(=O)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C1CC1	ZINC000272470243	353067467	/nfs/dbraw/zinc/06/74/67/353067467.db2.gz	ZDONGBOHVQKKQD-LLVKDONJSA-N	0	2	294.263	0.982	20	5		CCBDLN
NC(=O)N[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274746943	353158717	/nfs/dbraw/zinc/15/87/17/353158717.db2.gz	DTZRPFZSJQVTEF-SSDOTTSWSA-N	0	2	294.267	0.183	20	5		CCBDLN
COCCN(CCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000275086018	353183869	/nfs/dbraw/zinc/18/38/69/353183869.db2.gz	SXZHRGVTTHEKKS-UHFFFAOYSA-N	0	2	284.268	0.381	20	5		CCBDLN
CN(C)C(=O)CCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280713789	353377987	/nfs/dbraw/zinc/37/79/87/353377987.db2.gz	GNYZDAJPRRXFEZ-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CNC(=O)[C@@H](C)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280759481	353381540	/nfs/dbraw/zinc/38/15/40/353381540.db2.gz	AUDAAKFJPRRMAA-QMMMGPOBSA-N	0	2	295.295	0.755	20	5		CCBDLN
COC(=O)CCCONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000290568631	353734835	/nfs/dbraw/zinc/73/48/35/353734835.db2.gz	ITQPNNQBYLNQNI-UHFFFAOYSA-N	0	2	298.251	0.915	20	5		CCBDLN
COCC[C@](C)(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353404414	356216067	/nfs/dbraw/zinc/21/60/67/356216067.db2.gz	PDSPLCPRZCOSIY-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
CCN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O	ZINC000619825111	366361130	/nfs/dbraw/zinc/36/11/30/366361130.db2.gz	HSFCDUHTGMQBBW-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
Cc1cc(=NC(=O)Cn2ccc([N+](=O)[O-])n2)[nH]nc1C	ZINC000359491196	356831846	/nfs/dbraw/zinc/83/18/46/356831846.db2.gz	HMDMAFBZQPZCQM-UHFFFAOYSA-N	0	2	276.256	0.259	20	5		CCBDLN
C[C@@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000378557507	357692569	/nfs/dbraw/zinc/69/25/69/357692569.db2.gz	ZRHCMKRTWBATKS-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)C1(CO)CC1	ZINC000588857286	359342481	/nfs/dbraw/zinc/34/24/81/359342481.db2.gz	QERAQMNBHPQSPF-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(N[C@H]1CCNC(=O)CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000591231108	359572024	/nfs/dbraw/zinc/57/20/24/359572024.db2.gz	LPUUQKONESLITP-MRVPVSSYSA-N	0	2	293.279	0.699	20	5		CCBDLN
CN(CC(=O)NC1CC1)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179398931	189191343	/nfs/dbraw/zinc/19/13/43/189191343.db2.gz	FQCBUUPZXFUZIC-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[N@@H+]1CCO[C@H](C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000182087298	189313894	/nfs/dbraw/zinc/31/38/94/189313894.db2.gz	AIJDULZMKQWIKW-NSHDSACASA-N	0	2	281.268	0.570	20	5		CCBDLN
C[N@H+]1CCO[C@H](C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000182087298	189313895	/nfs/dbraw/zinc/31/38/95/189313895.db2.gz	AIJDULZMKQWIKW-NSHDSACASA-N	0	2	281.268	0.570	20	5		CCBDLN
CN1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CCC1=O	ZINC000598297806	361384505	/nfs/dbraw/zinc/38/45/05/361384505.db2.gz	XRCDWOWPDJNAGH-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
C[C@H](O)C1(NC(=O)c2cccc(O)c2[N+](=O)[O-])CC1	ZINC000598384750	361401352	/nfs/dbraw/zinc/40/13/52/361401352.db2.gz	RHPMJGNMUYJSND-ZETCQYMHSA-N	0	2	266.253	0.944	20	5		CCBDLN
CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000184668656	189391726	/nfs/dbraw/zinc/39/17/26/189391726.db2.gz	NZZSAYHGNBNXEJ-UHFFFAOYSA-N	0	2	281.268	0.542	20	5		CCBDLN
CCN1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000190535922	189567746	/nfs/dbraw/zinc/56/77/46/189567746.db2.gz	URSFDONYOMUYAU-UHFFFAOYSA-N	0	2	279.252	0.562	20	5		CCBDLN
[NH3+][C@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000565234235	291364439	/nfs/dbraw/zinc/36/44/39/291364439.db2.gz	SHLZIZMBKRWJTO-STQMWFEESA-N	0	2	290.323	0.339	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H](F)C[C@H]1CO	ZINC000330587820	203006888	/nfs/dbraw/zinc/00/68/88/203006888.db2.gz	YMOTWDHTCFWWHY-IUCAKERBSA-N	0	2	284.243	0.845	20	5		CCBDLN
O=C(NCCN1CCCC1=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000574646156	335036881	/nfs/dbraw/zinc/03/68/81/335036881.db2.gz	WVVXLYMXJQEJKI-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCn2nncc2C1	ZINC000516937352	249192257	/nfs/dbraw/zinc/19/22/57/249192257.db2.gz	CRINFWWTFQWSGD-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
COC(=O)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281112439	195109283	/nfs/dbraw/zinc/10/92/83/195109283.db2.gz	HHZBFOMLOQXNKX-UHFFFAOYSA-N	0	2	268.225	0.545	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H]1O	ZINC000396072047	285230551	/nfs/dbraw/zinc/23/05/51/285230551.db2.gz	WHBHJCYEIQJXGL-GHMZBOCLSA-N	0	2	282.252	0.132	20	5		CCBDLN
C[S@](=O)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000282004943	389644440	/nfs/dbraw/zinc/64/44/40/389644440.db2.gz	SEPIYJDOYKZJRU-FQEVSTJZSA-N	0	2	298.320	0.941	20	5		CCBDLN
COC[C@H]1C(=O)N[C@H](c2ccc(O)c([N+](=O)[O-])c2)N1C	ZINC000414202572	389605155	/nfs/dbraw/zinc/60/51/55/389605155.db2.gz	UHULZVQVGRHRPT-ONGXEEELSA-N	0	2	281.268	0.376	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC[S@]1=O	ZINC000436988567	389989841	/nfs/dbraw/zinc/98/98/41/389989841.db2.gz	KQBDDQNYQZIHCU-ZPWHCFADSA-N	0	2	298.320	0.893	20	5		CCBDLN
C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCC(=O)N1	ZINC000457202786	390034189	/nfs/dbraw/zinc/03/41/89/390034189.db2.gz	XOBQZLUATBKMLF-ZDUSSCGKSA-N	0	2	293.279	0.699	20	5		CCBDLN
COC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000540933055	390230063	/nfs/dbraw/zinc/23/00/63/390230063.db2.gz	BQZXQVNMVDAEOL-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
COC(=O)[C@@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000281820918	195395655	/nfs/dbraw/zinc/39/56/55/195395655.db2.gz	OFOBWRSNSWQJFZ-SSDOTTSWSA-N	0	2	282.252	0.934	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCS(=O)CC1	ZINC000066637220	304530410	/nfs/dbraw/zinc/53/04/10/304530410.db2.gz	GKWIXPQJHCVZAP-UHFFFAOYSA-N	0	2	284.293	0.505	20	5		CCBDLN
C[C@@]1(C(N)=O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000280033210	297886912	/nfs/dbraw/zinc/88/69/12/297886912.db2.gz	MVJFYTUHEYXVIP-CYBMUJFWSA-N	0	2	293.279	0.638	20	5		CCBDLN
Cc1cc(C(=O)NCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000358375157	534063486	/nfs/dbraw/zinc/06/34/86/534063486.db2.gz	WYCAGKFYOXNBEQ-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
CCC[C@H](O)[C@@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000412548305	528289040	/nfs/dbraw/zinc/28/90/40/528289040.db2.gz	PBBGWRXFMAQTCS-PWSUYJOCSA-N	0	2	298.295	0.552	20	5		CCBDLN
Cn1cc[nH+]c1C[N-]S(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000779633404	581195956	/nfs/dbraw/zinc/19/59/56/581195956.db2.gz	BQBUCIBMPNSKAS-UHFFFAOYSA-N	0	2	297.296	0.202	20	5		CCBDLN
COc1ccc([N+](=O)[O-])cc1C(=O)NN1CN=NC1=O	ZINC000782126492	581289015	/nfs/dbraw/zinc/28/90/15/581289015.db2.gz	BNMPDRIJRNPXKJ-UHFFFAOYSA-N	0	2	279.212	0.284	20	5		CCBDLN
O=C([O-])[C@H]1CC12CC[NH+](Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000739536614	581568001	/nfs/dbraw/zinc/56/80/01/581568001.db2.gz	NUXVLFOPSLOKOP-SNVBAGLBSA-N	0	2	280.284	0.936	20	5		CCBDLN
O=C(CC[NH+]1CCOCC1)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000770861022	581775371	/nfs/dbraw/zinc/77/53/71/581775371.db2.gz	GBVHNJODFRJAIB-UHFFFAOYSA-N	0	2	295.295	0.961	20	5		CCBDLN
CCc1nc(COC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1	ZINC000760298513	581853407	/nfs/dbraw/zinc/85/34/07/581853407.db2.gz	DCLJDVUGBKAVFF-UHFFFAOYSA-N	0	2	265.229	0.960	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000774950857	582005238	/nfs/dbraw/zinc/00/52/38/582005238.db2.gz	XEJFNTIBKXRUDY-UHFFFAOYSA-N	0	2	282.187	0.915	20	5		CCBDLN
Cc1nn(C[NH+]2CCC(C(=O)[O-])CC2)cc1[N+](=O)[O-]	ZINC000821217273	598225135	/nfs/dbraw/zinc/22/51/35/598225135.db2.gz	VNJZYUBQJDKWNK-UHFFFAOYSA-N	0	2	268.273	0.854	20	5		CCBDLN
C[C@H]1CN(C(=O)[O-])CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000826026195	603996422	/nfs/dbraw/zinc/99/64/22/603996422.db2.gz	KBYXAUQANJYZJF-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@H]1CN(C(=O)[O-])CC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000826026195	603996427	/nfs/dbraw/zinc/99/64/27/603996427.db2.gz	KBYXAUQANJYZJF-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
CON1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000854859004	617090475	/nfs/dbraw/zinc/09/04/75/617090475.db2.gz	WUNBHAHFQMPXHI-UHFFFAOYSA-N	0	2	281.268	0.620	20	5		CCBDLN
Cn1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cc1C1CC1	ZINC000839778457	640365072	/nfs/dbraw/zinc/36/50/72/640365072.db2.gz	VOJWCVQDKSUOHD-VXNVDRBHSA-N	0	2	250.258	0.901	20	5		CCBDLN
O=[N+]([O-])[C@@H]1C[C@H]1c1nc(-c2cccc(-n3cnnn3)c2)no1	ZINC000818426368	641325686	/nfs/dbraw/zinc/32/56/86/641325686.db2.gz	FRHUEJHXYICCGN-NXEZZACHSA-N	0	2	299.250	0.845	20	5		CCBDLN
O=C(CN1C(=O)CCC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC001153455482	800631981	/nfs/dbraw/zinc/63/19/81/800631981.db2.gz	KXFBGCDGOMOQEO-UHFFFAOYSA-N	0	2	293.235	0.388	20	5		CCBDLN
Nc1cccc([N+](=O)[O-])c1C(=O)NN1CCCC1=O	ZINC001116594845	855794185	/nfs/dbraw/zinc/79/41/85/855794185.db2.gz	NZTXLNSFTDJGJL-UHFFFAOYSA-N	0	2	264.241	0.444	20	5		CCBDLN
O=c1[nH]nc(CN2Cc3ccc([N+](=O)[O-])cc3C2)[nH]1	ZINC001320601855	910758249	/nfs/dbraw/zinc/75/82/49/910758249.db2.gz	IJUGKMAARXVOKW-UHFFFAOYSA-N	0	2	261.241	0.934	20	5		CCBDLN
O=C(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])N1CCCO1	ZINC000600057079	361857796	/nfs/dbraw/zinc/85/77/96/361857796.db2.gz	HPYPNZPPCSORCQ-UHFFFAOYSA-N	0	2	295.251	0.194	20	5		CCBDLN
COC(=O)c1cnc(Sc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000337940311	214321598	/nfs/dbraw/zinc/32/15/98/214321598.db2.gz	CHJYWJMZTARLCV-UHFFFAOYSA-N	0	2	297.252	0.751	20	5		CCBDLN
CS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273155838	192060553	/nfs/dbraw/zinc/06/05/53/192060553.db2.gz	APXIVNSVWQYNJV-UHFFFAOYSA-N	0	2	288.281	0.075	20	5		CCBDLN
CC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000127218132	187290143	/nfs/dbraw/zinc/29/01/43/187290143.db2.gz	CUHSGLNZGZKPCL-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
COCC[C@@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355609805	232044394	/nfs/dbraw/zinc/04/43/94/232044394.db2.gz	BPRSXCFPPRSQDH-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
CNC(=O)[C@H](C)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000081467951	349267799	/nfs/dbraw/zinc/26/77/99/349267799.db2.gz	WDXZWRUPFRDDES-MRVPVSSYSA-N	0	2	295.295	0.755	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@@H](O)C1	ZINC000271274466	191043575	/nfs/dbraw/zinc/04/35/75/191043575.db2.gz	MRCCHYPPWKWKIV-MRVPVSSYSA-N	0	2	252.226	0.507	20	5		CCBDLN
CC(=O)NCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000186008170	351471625	/nfs/dbraw/zinc/47/16/25/351471625.db2.gz	IKUFZBTVVITTHG-UHFFFAOYSA-N	0	2	253.214	0.375	20	5		CCBDLN
CCN(C)C(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000191557602	351764166	/nfs/dbraw/zinc/76/41/66/351764166.db2.gz	MDKNQCJHVJEJFD-MRVPVSSYSA-N	0	2	295.295	0.897	20	5		CCBDLN
CN(C)C(=O)NCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316297	351947022	/nfs/dbraw/zinc/94/70/22/351947022.db2.gz	UQEIBNSAFUMBKO-UHFFFAOYSA-N	0	2	296.283	0.301	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000195151434	351899284	/nfs/dbraw/zinc/89/92/84/351899284.db2.gz	SSHYTQDVMKEYGB-HQJQHLMTSA-N	0	2	293.279	0.555	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCO[C@H](CO)C1	ZINC000229972471	352098921	/nfs/dbraw/zinc/09/89/21/352098921.db2.gz	OFVIHFCENVBJSZ-VIFPVBQESA-N	0	2	282.252	0.134	20	5		CCBDLN
C[C@@]1(C(N)=O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000235428611	352183904	/nfs/dbraw/zinc/18/39/04/352183904.db2.gz	TZJRCHFURNSZNX-CYBMUJFWSA-N	0	2	293.279	0.638	20	5		CCBDLN
CC(=O)N1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000232469232	352144151	/nfs/dbraw/zinc/14/41/51/352144151.db2.gz	QMEHCQPSSRGZAS-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CCN(CC(=O)N(C)C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233427276	352149817	/nfs/dbraw/zinc/14/98/17/352149817.db2.gz	ZOOPEIYBZQUSRN-UHFFFAOYSA-N	0	2	295.295	0.851	20	5		CCBDLN
CC(C)(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OCCO	ZINC000292049208	198145044	/nfs/dbraw/zinc/14/50/44/198145044.db2.gz	IYOKBJJVMYCHRI-UHFFFAOYSA-N	0	2	298.295	0.818	20	5		CCBDLN
COC[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272431602	353063580	/nfs/dbraw/zinc/06/35/80/353063580.db2.gz	SFYUOQBAVJQDRI-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
COC(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272332235	353054199	/nfs/dbraw/zinc/05/41/99/353054199.db2.gz	FETKOXQNOOXKIE-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@@H](CO)C1	ZINC000272357223	353055492	/nfs/dbraw/zinc/05/54/92/353055492.db2.gz	DSQTVCXUULAGEA-MRVPVSSYSA-N	0	2	266.253	0.755	20	5		CCBDLN
CCn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274741749	353158222	/nfs/dbraw/zinc/15/82/22/353158222.db2.gz	NRCKAPDTFBXSFN-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
NC(=O)N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274646067	353149071	/nfs/dbraw/zinc/14/90/71/353149071.db2.gz	CFBBPLRRFKGJJU-ZETCQYMHSA-N	0	2	294.267	0.183	20	5		CCBDLN
COC[C@](C)(CCO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274821873	353164807	/nfs/dbraw/zinc/16/48/07/353164807.db2.gz	QFIBWIMHGAHUQV-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
CC(C)NC(=O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280664434	353374056	/nfs/dbraw/zinc/37/40/56/353374056.db2.gz	ASKXNNKRBRFRPJ-UHFFFAOYSA-N	0	2	281.268	0.555	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC[C@H](O)C1	ZINC000280944815	353388902	/nfs/dbraw/zinc/38/89/02/353388902.db2.gz	IFMJRGWMCSTKJB-ZETCQYMHSA-N	0	2	252.226	0.507	20	5		CCBDLN
CC[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)OC	ZINC000336829410	355203989	/nfs/dbraw/zinc/20/39/89/355203989.db2.gz	HPNGVMIDAMZBFV-SECBINFHSA-N	0	2	282.252	0.982	20	5		CCBDLN
NC(=O)N[C@H]1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000354418944	356411192	/nfs/dbraw/zinc/41/11/92/356411192.db2.gz	XIOLOGMJZQFSJR-ZETCQYMHSA-N	0	2	294.267	0.183	20	5		CCBDLN
CC(CO)(CO)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000560802451	291113003	/nfs/dbraw/zinc/11/30/03/291113003.db2.gz	PFODOVOITFJZEF-UHFFFAOYSA-N	0	2	284.268	0.021	20	5		CCBDLN
O=C(NC[C@@H]1CCCNC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000619878802	366367211	/nfs/dbraw/zinc/36/72/11/366367211.db2.gz	CWCHQFUUEOOHLK-QMMMGPOBSA-N	0	2	293.279	0.556	20	5		CCBDLN
CNC(=O)[C@@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182076505	290531512	/nfs/dbraw/zinc/53/15/12/290531512.db2.gz	IOBFCWSZEOQEIG-QMMMGPOBSA-N	0	2	295.295	0.755	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@H](O)C2(CC2)C1	ZINC000376050654	357428065	/nfs/dbraw/zinc/42/80/65/357428065.db2.gz	OMOKAXVABLZQDN-NSHDSACASA-N	0	2	278.264	0.897	20	5		CCBDLN
O=C(NCC[C@@]1(O)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000593813435	360164649	/nfs/dbraw/zinc/16/46/49/360164649.db2.gz	PMSBPWCBBLZZMG-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
COC[C@H]1C[C@@H](O)CN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000593814137	360165741	/nfs/dbraw/zinc/16/57/41/360165741.db2.gz	HCZONNPHQBWITM-RKDXNWHRSA-N	0	2	296.279	0.522	20	5		CCBDLN
CO[C@](C)(CO)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000594398223	360292655	/nfs/dbraw/zinc/29/26/55/360292655.db2.gz	OVSUMTPFARLRGM-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NCCNC(=O)C1CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000074277815	284568425	/nfs/dbraw/zinc/56/84/25/284568425.db2.gz	DKNDIYXIPFISRN-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
CC(C)(O)CONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000279206861	194333161	/nfs/dbraw/zinc/33/31/61/194333161.db2.gz	NLIZQEYAKCSNEG-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
CC(C)(CNC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000281068243	195091043	/nfs/dbraw/zinc/09/10/43/195091043.db2.gz	ZLCUMZYNMPXSKB-UHFFFAOYSA-N	0	2	281.268	0.542	20	5		CCBDLN
CNC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(C)C	ZINC000185273873	388797083	/nfs/dbraw/zinc/79/70/83/388797083.db2.gz	KKWUGENGXHSIOE-NSHDSACASA-N	0	2	295.295	0.801	20	5		CCBDLN
Nc1nccnc1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000183912901	388764547	/nfs/dbraw/zinc/76/45/47/388764547.db2.gz	JSMSPDJAPVJCEF-UHFFFAOYSA-N	0	2	275.224	0.925	20	5		CCBDLN
CC(C)(CC(N)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000186287110	388831752	/nfs/dbraw/zinc/83/17/52/388831752.db2.gz	VIXGNIWETCKJRZ-UHFFFAOYSA-N	0	2	281.268	0.684	20	5		CCBDLN
CCc1n[nH]c(NC(=O)c2n[nH]c(CC)c2[N+](=O)[O-])n1	ZINC000351694405	389658216	/nfs/dbraw/zinc/65/82/16/389658216.db2.gz	PEEMIIGLDOUERZ-UHFFFAOYSA-N	0	2	279.260	0.813	20	5		CCBDLN
CCc1nc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1	ZINC000479190608	390081397	/nfs/dbraw/zinc/08/13/97/390081397.db2.gz	OZBOXKKXVHAMLC-UHFFFAOYSA-N	0	2	250.218	0.856	20	5		CCBDLN
CCc1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])[nH]2)n1	ZINC000479190608	390081398	/nfs/dbraw/zinc/08/13/98/390081398.db2.gz	OZBOXKKXVHAMLC-UHFFFAOYSA-N	0	2	250.218	0.856	20	5		CCBDLN
CO[C@@H]1COC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000458358526	390056324	/nfs/dbraw/zinc/05/63/24/390056324.db2.gz	MFFCGNKTVVDXSB-GXSJLCMTSA-N	0	2	282.252	0.444	20	5		CCBDLN
CO[C@@H]1COC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000458366445	390056584	/nfs/dbraw/zinc/05/65/84/390056584.db2.gz	UWRHYQMGSQGDQU-GXSJLCMTSA-N	0	2	282.252	0.444	20	5		CCBDLN
C[C@@]1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1=O	ZINC000292507575	297915469	/nfs/dbraw/zinc/91/54/69/297915469.db2.gz	POANPDIRWKXHQD-GFCCVEGCSA-N	0	2	280.236	0.736	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000576405625	335199903	/nfs/dbraw/zinc/19/99/03/335199903.db2.gz	QNFVWTFXSAXWNW-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000576405625	335199904	/nfs/dbraw/zinc/19/99/04/335199904.db2.gz	QNFVWTFXSAXWNW-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=c1[nH]nc(Cn2cc(Br)c([N+](=O)[O-])n2)[nH]1	ZINC000340861536	527416818	/nfs/dbraw/zinc/41/68/18/527416818.db2.gz	LSKYHVOPWSQBGN-UHFFFAOYSA-N	0	2	289.049	0.426	20	5		CCBDLN
CCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000425023319	528325583	/nfs/dbraw/zinc/32/55/83/528325583.db2.gz	ZHHKQQPZZBAHTA-UHFFFAOYSA-N	0	2	293.279	0.952	20	5		CCBDLN
COc1c(C(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000356267563	536847822	/nfs/dbraw/zinc/84/78/22/536847822.db2.gz	GXONGFWUXLOBBT-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
C[C@H]1C[N@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@H]1NC(=O)[O-]	ZINC000739192788	581200412	/nfs/dbraw/zinc/20/04/12/581200412.db2.gz	SMYMLPCQHCSVSZ-WCBMZHEXSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@H]1C[N@@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@H]1NC(=O)[O-]	ZINC000739192788	581200415	/nfs/dbraw/zinc/20/04/15/581200415.db2.gz	SMYMLPCQHCSVSZ-WCBMZHEXSA-N	0	2	283.288	0.727	20	5		CCBDLN
O=C([O-])NCC[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000740659755	581709145	/nfs/dbraw/zinc/70/91/45/581709145.db2.gz	VPPBDVMOTHMUGR-UHFFFAOYSA-N	0	2	294.311	0.984	20	5		CCBDLN
CN1C(=O)CN(NC(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000770455073	581744422	/nfs/dbraw/zinc/74/44/22/581744422.db2.gz	LKDSIQXHEZRPQB-UHFFFAOYSA-N	0	2	278.224	0.134	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000774887474	582001100	/nfs/dbraw/zinc/00/11/00/582001100.db2.gz	UTKJDCDWDLRUEJ-UHFFFAOYSA-N	0	2	264.197	0.776	20	5		CCBDLN
CC(C)(CO)ONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000836806129	614123795	/nfs/dbraw/zinc/12/37/95/614123795.db2.gz	RQXCPDHYZXXKSM-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
CN(C)C(=O)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1	ZINC000841136727	615959239	/nfs/dbraw/zinc/95/92/39/615959239.db2.gz	YYBUFTZHGKLYJC-VXGBXAGGSA-N	0	2	291.307	0.773	20	5		CCBDLN
COCCCONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000805042098	616925318	/nfs/dbraw/zinc/92/53/18/616925318.db2.gz	LFQCAMCIEZXIMQ-UHFFFAOYSA-N	0	2	270.241	0.998	20	5		CCBDLN
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000801914981	640673005	/nfs/dbraw/zinc/67/30/05/640673005.db2.gz	ITDIYZYLKCUSCU-UHFFFAOYSA-N	0	2	296.218	0.070	20	5		CCBDLN
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2cccnc2O1	ZINC000840418497	641574167	/nfs/dbraw/zinc/57/41/67/641574167.db2.gz	NZRVQWCXFNZVDD-QXFUBDJGSA-N	0	2	263.253	0.861	20	5		CCBDLN
Cn1nc(C2CC2)nc1Cc1noc([C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC001261481950	808992189	/nfs/dbraw/zinc/99/21/89/808992189.db2.gz	VQKJRNRROUPXCN-HTQZYQBOSA-N	0	2	290.283	0.799	20	5		CCBDLN
COC1(c2noc([C@@H]3C[C@H]3[N+](=O)[O-])n2)CCOCC1	ZINC001327075644	914355960	/nfs/dbraw/zinc/35/59/60/914355960.db2.gz	WIZFKLIWWDDRFB-HTQZYQBOSA-N	0	2	269.257	0.854	20	5		CCBDLN
COC(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC001320433755	910672775	/nfs/dbraw/zinc/67/27/75/910672775.db2.gz	YRIOADWQKQQRIG-UHFFFAOYSA-N	0	2	295.251	0.481	20	5		CCBDLN
C[N@@H+]1CCOC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000600422212	361957387	/nfs/dbraw/zinc/95/73/87/361957387.db2.gz	SZWDNWSWWXPYOR-VIFPVBQESA-N	0	2	295.295	0.361	20	5		CCBDLN
C[N@H+]1CCOC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000600422212	361957391	/nfs/dbraw/zinc/95/73/91/361957391.db2.gz	SZWDNWSWWXPYOR-VIFPVBQESA-N	0	2	295.295	0.361	20	5		CCBDLN
O=C(NC[C@H]1CC[C@H](CO)O1)c1cccc(O)c1[N+](=O)[O-]	ZINC000349577965	137396560	/nfs/dbraw/zinc/39/65/60/137396560.db2.gz	UGDNNGLLZZNSMI-RKDXNWHRSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271251680	191030471	/nfs/dbraw/zinc/03/04/71/191030471.db2.gz	HONVJFYKNVVCPP-MRVPVSSYSA-N	0	2	291.267	0.710	20	5		CCBDLN
CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271263682	191036416	/nfs/dbraw/zinc/03/64/16/191036416.db2.gz	JYXAASAPSLHUPY-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@H]1CO	ZINC000133413123	350335302	/nfs/dbraw/zinc/33/53/02/350335302.db2.gz	UPWQCXAWUIJTFK-VIFPVBQESA-N	0	2	266.253	0.897	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000161457459	350721598	/nfs/dbraw/zinc/72/15/98/350721598.db2.gz	RBXRVGOQECCIOS-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(N[C@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181877256	351340470	/nfs/dbraw/zinc/34/04/70/351340470.db2.gz	PWQAJWXRPRNOQT-JTQLQIEISA-N	0	2	293.279	0.699	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000195178860	351901738	/nfs/dbraw/zinc/90/17/38/351901738.db2.gz	QXKLANGMQHNQRH-RDDDGLTNSA-N	0	2	293.279	0.555	20	5		CCBDLN
C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316020	351946104	/nfs/dbraw/zinc/94/61/04/351946104.db2.gz	NMLLRXHSBPCFKY-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=[N+]([O-])c1ccc(O)c(NS(=O)(=O)c2cn[nH]c2)c1	ZINC000219465726	351967365	/nfs/dbraw/zinc/96/73/65/351967365.db2.gz	DRRWWJNDOXRRKU-UHFFFAOYSA-N	0	2	284.253	0.824	20	5		CCBDLN
COC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000222489319	351982600	/nfs/dbraw/zinc/98/26/00/351982600.db2.gz	AMAZDJMZSARHNM-UHFFFAOYSA-N	0	2	254.198	0.203	20	5		CCBDLN
COC(=O)[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234530267	352159865	/nfs/dbraw/zinc/15/98/65/352159865.db2.gz	SBLQPRMMHGUUJI-ZCFIWIBFSA-N	0	2	268.225	0.592	20	5		CCBDLN
COC(=O)N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000270406166	352930401	/nfs/dbraw/zinc/93/04/01/352930401.db2.gz	LXOKRRUMUIEUDY-UHFFFAOYSA-N	0	2	283.240	0.937	20	5		CCBDLN
CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC	ZINC000272435269	353063928	/nfs/dbraw/zinc/06/39/28/353063928.db2.gz	SZZGMCRTMSWZLP-VIFPVBQESA-N	0	2	282.252	0.982	20	5		CCBDLN
COC(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274668249	353151087	/nfs/dbraw/zinc/15/10/87/353151087.db2.gz	GTALZHWDIILADP-QMMMGPOBSA-N	0	2	294.263	0.936	20	5		CCBDLN
COC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274990159	353177655	/nfs/dbraw/zinc/17/76/55/353177655.db2.gz	UUCDBCLUFQRRPQ-ZCFIWIBFSA-N	0	2	268.225	0.592	20	5		CCBDLN
C[C@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000279641175	353307064	/nfs/dbraw/zinc/30/70/64/353307064.db2.gz	YZTRLPYPIZBTNW-OQPBUACISA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC[C@H](O)C1	ZINC000280857914	353388016	/nfs/dbraw/zinc/38/80/16/353388016.db2.gz	DBXITXBQWWKCNL-QMMMGPOBSA-N	0	2	266.253	0.897	20	5		CCBDLN
CCN(CCOCCO)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000282498183	353429137	/nfs/dbraw/zinc/42/91/37/353429137.db2.gz	MZNYMQSFRQKBGX-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H]1CCN(C)C1=O	ZINC000353269332	356191524	/nfs/dbraw/zinc/19/15/24/356191524.db2.gz	USMYPWDXTGSCPO-LLVKDONJSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@H](CO)[C@H](O)C1	ZINC000560668531	291111239	/nfs/dbraw/zinc/11/12/39/291111239.db2.gz	SDURYYBGCJKSQC-PRHODGIISA-N	0	2	296.279	0.116	20	5		CCBDLN
CC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000355745575	356637947	/nfs/dbraw/zinc/63/79/47/356637947.db2.gz	LFGGWHJJIXSZCB-MRVPVSSYSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H]2COC[C@H](C1)O2	ZINC000619781625	366351508	/nfs/dbraw/zinc/35/15/08/366351508.db2.gz	QZZHHDUPOMKKIC-AOOOYVTPSA-N	0	2	294.263	0.540	20	5		CCBDLN
Cc1sc(C(=O)NCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000359271915	356790284	/nfs/dbraw/zinc/79/02/84/356790284.db2.gz	MAHNNUCMNGLNPL-UHFFFAOYSA-N	0	2	283.269	0.718	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(n2ccnn2)C1	ZINC000367930999	357294192	/nfs/dbraw/zinc/29/41/92/357294192.db2.gz	ODVPYDVWXXCUOP-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000590423781	359458648	/nfs/dbraw/zinc/45/86/48/359458648.db2.gz	YZDDYHOQAMZYOM-URLYPYJESA-N	0	2	278.264	0.611	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)c2cc(F)cc([N+](=O)[O-])c2)[nH][nH]1	ZINC000611141780	363664396	/nfs/dbraw/zinc/66/43/96/363664396.db2.gz	ZGFQCTLYKHDCMF-UHFFFAOYSA-N	0	2	293.214	0.230	20	5		CCBDLN
NC(=O)[C@H]1CC[C@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000594337260	360276276	/nfs/dbraw/zinc/27/62/76/360276276.db2.gz	KIGCTHJQLAXGIJ-JGVFFNPUSA-N	0	2	279.252	0.750	20	5		CCBDLN
CO[C@](C)(CO)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000594394128	360291306	/nfs/dbraw/zinc/29/13/06/360291306.db2.gz	BYMZKGFPMWGXCQ-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
CC(F)(F)CNS(=O)(=O)c1ncccc1[N+](=O)[O-]	ZINC000594776911	360380464	/nfs/dbraw/zinc/38/04/64/360380464.db2.gz	OVTLHBQGOUXJLA-UHFFFAOYSA-N	0	2	281.240	0.923	20	5		CCBDLN
C[C@@H]1CN(CCNc2c([N+](=O)[O-])ncn2C)[C@@H](C)CO1	ZINC000596428123	360891854	/nfs/dbraw/zinc/89/18/54/360891854.db2.gz	HHHZMUIUBFUBNX-VHSXEESVSA-N	0	2	283.332	0.849	20	5		CCBDLN
COC[C@](C)(CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000613534857	364287680	/nfs/dbraw/zinc/28/76/80/364287680.db2.gz	WKUYXFWZCHBSPZ-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NOC[C@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000276471502	193345209	/nfs/dbraw/zinc/34/52/09/193345209.db2.gz	PJJWJHJEWVUICU-QMMMGPOBSA-N	0	2	282.252	0.998	20	5		CCBDLN
O=C(N[C@@H]1CCCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000077280354	284586292	/nfs/dbraw/zinc/58/62/92/284586292.db2.gz	SCOJFESRCCPGQH-SECBINFHSA-N	0	2	293.279	0.699	20	5		CCBDLN
CN1C[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000092549570	389029458	/nfs/dbraw/zinc/02/94/58/389029458.db2.gz	NWALXIWAYWLMBE-SSDOTTSWSA-N	0	2	279.252	0.717	20	5		CCBDLN
COC[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000367617849	389337337	/nfs/dbraw/zinc/33/73/37/389337337.db2.gz	RPCLKVGJKOIZKW-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@H](CO)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000159416375	389366610	/nfs/dbraw/zinc/36/66/10/389366610.db2.gz	LCNFEMACNYMKME-DTWKUNHWSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(NCCCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1	ZINC000174581237	389524818	/nfs/dbraw/zinc/52/48/18/389524818.db2.gz	PHKGTZGIVOZDDR-UHFFFAOYSA-N	0	2	291.267	0.369	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncnn1C	ZINC000276918972	389553878	/nfs/dbraw/zinc/55/38/78/389553878.db2.gz	SIGMWKQIESLYGB-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
COC(=O)[C@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000281934135	389636902	/nfs/dbraw/zinc/63/69/02/389636902.db2.gz	WDUOUQHAGWGBQS-ZETCQYMHSA-N	0	2	282.252	0.934	20	5		CCBDLN
O=C(NC[C@H]1CCCC(=O)N1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000447745127	389963494	/nfs/dbraw/zinc/96/34/94/389963494.db2.gz	MQMWDNLCUQKFCN-SECBINFHSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=c1[nH]nc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)[nH]1	ZINC000436398712	389976048	/nfs/dbraw/zinc/97/60/48/389976048.db2.gz	VXRVLJFSJYDEQV-UHFFFAOYSA-N	0	2	276.256	0.999	20	5		CCBDLN
Cc1noc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000436665052	389981674	/nfs/dbraw/zinc/98/16/74/389981674.db2.gz	MVSNSEOTBRLEBZ-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(NC1(CCO)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000436704705	389983602	/nfs/dbraw/zinc/98/36/02/389983602.db2.gz	MMESUUGJEKVADL-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
CCc1n[nH]c(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])n1	ZINC000479163045	390081191	/nfs/dbraw/zinc/08/11/91/390081191.db2.gz	RSXHXAFBSDJHLM-UHFFFAOYSA-N	0	2	265.233	0.559	20	5		CCBDLN
NC(=O)CCCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000540932293	390229457	/nfs/dbraw/zinc/22/94/57/390229457.db2.gz	JARPQPGJUIINSM-UHFFFAOYSA-N	0	2	281.268	0.686	20	5		CCBDLN
C[C@@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000361652657	533325397	/nfs/dbraw/zinc/32/53/97/533325397.db2.gz	GNUXEOMZKFKOGJ-LURJTMIESA-N	0	2	288.281	0.672	20	5		CCBDLN
Cn1c[nH+]cc1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000356802108	144034621	/nfs/dbraw/zinc/03/46/21/144034621.db2.gz	MLRLYWRRGPDEST-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(n2ccnn2)C1	ZINC000372488104	144369632	/nfs/dbraw/zinc/36/96/32/144369632.db2.gz	XGQUPKCASOWCLH-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@H](O)C1	ZINC000236551045	304501661	/nfs/dbraw/zinc/50/16/61/304501661.db2.gz	GTTRNFUVVVVGOG-MRVPVSSYSA-N	0	2	252.226	0.507	20	5		CCBDLN
O=C1N[C@H](c2ccc([N+](=O)[O-])c(O)c2)N2CCSC[C@H]12	ZINC000270833264	304686234	/nfs/dbraw/zinc/68/62/34/304686234.db2.gz	UCTDMLJMMGXKJS-KOLCDFICSA-N	0	2	295.320	0.846	20	5		CCBDLN
O=C([O-])N[C@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740598576	581375744	/nfs/dbraw/zinc/37/57/44/581375744.db2.gz	NKKFGEFUKVQZGH-ZETCQYMHSA-N	0	2	255.234	0.091	20	5		CCBDLN
O=C([O-])N[C@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740598576	581375745	/nfs/dbraw/zinc/37/57/45/581375745.db2.gz	NKKFGEFUKVQZGH-ZETCQYMHSA-N	0	2	255.234	0.091	20	5		CCBDLN
CCC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000796754919	581449779	/nfs/dbraw/zinc/44/97/79/581449779.db2.gz	BROBSFYLGDNAAK-UHFFFAOYSA-N	0	2	259.243	0.205	20	5		CCBDLN
O=C([O-])[C@@H]1CC12CC[NH+](Cn1cc([N+](=O)[O-])cn1)CC2	ZINC000739536612	581568006	/nfs/dbraw/zinc/56/80/06/581568006.db2.gz	NUXVLFOPSLOKOP-JTQLQIEISA-N	0	2	280.284	0.936	20	5		CCBDLN
COc1cc(C(=O)OCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000774938205	582004305	/nfs/dbraw/zinc/00/43/05/582004305.db2.gz	BVORGIICJRRVCQ-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
CCOCCONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000803117439	615290887	/nfs/dbraw/zinc/29/08/87/615290887.db2.gz	CNNGRTVRUDMSBA-UHFFFAOYSA-N	0	2	270.241	0.998	20	5		CCBDLN
CCOc1cncc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000843666370	615522237	/nfs/dbraw/zinc/52/22/37/615522237.db2.gz	NFTHREXTIQIVNJ-RNFRBKRXSA-N	0	2	252.230	0.479	20	5		CCBDLN
Cc1ccc(-c2nc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])n[nH]2)o1	ZINC000839706805	640355060	/nfs/dbraw/zinc/35/50/60/640355060.db2.gz	VEQAUBYUQJODGV-RNFRBKRXSA-N	0	2	277.240	0.977	20	5		CCBDLN
Cc1ccc(-c2nc(NC(=O)[C@@H]3CC3[N+](=O)[O-])n[nH]2)o1	ZINC000839706805	640355067	/nfs/dbraw/zinc/35/50/67/640355067.db2.gz	VEQAUBYUQJODGV-RNFRBKRXSA-N	0	2	277.240	0.977	20	5		CCBDLN
C[C@H]1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C(=O)O1	ZINC000816621769	641179785	/nfs/dbraw/zinc/17/97/85/641179785.db2.gz	ORRAPRQDLKMVAX-RCOVLWMOSA-N	0	2	280.236	0.734	20	5		CCBDLN
O=C(N[C@@H]1COC(=O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000816677081	641185328	/nfs/dbraw/zinc/18/53/28/641185328.db2.gz	CTCARAQRDKHAOE-LURJTMIESA-N	0	2	266.209	0.346	20	5		CCBDLN
NC(=O)c1ccc2c(n1)N(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCC2	ZINC000857644635	644547896	/nfs/dbraw/zinc/54/78/96/644547896.db2.gz	OYTPQHFNPDIIML-PSASIEDQSA-N	0	2	290.279	0.125	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@@H](CC(=O)[O-])C1	ZINC000091296600	958136262	/nfs/dbraw/zinc/13/62/62/958136262.db2.gz	NHWMVHXKYKPIHO-JTQLQIEISA-N	0	2	298.299	0.275	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@@H](CC(=O)[O-])C1	ZINC000091296600	958136270	/nfs/dbraw/zinc/13/62/70/958136270.db2.gz	NHWMVHXKYKPIHO-JTQLQIEISA-N	0	2	298.299	0.275	20	5		CCBDLN
NC(=O)[C@@H]1CCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600378477	361937917	/nfs/dbraw/zinc/93/79/17/361937917.db2.gz	QJAHJTMIEWMNKI-QMMMGPOBSA-N	0	2	279.252	0.390	20	5		CCBDLN
C[C@@H](CO)N1N=C(c2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000601946411	362433180	/nfs/dbraw/zinc/43/31/80/362433180.db2.gz	YDMXESXPQBOVMW-QMMMGPOBSA-N	0	2	263.253	0.912	20	5		CCBDLN
C[C@@H](CO)n1[nH]c(-c2ccc([N+](=O)[O-])cc2)cc1=O	ZINC000601946411	362433184	/nfs/dbraw/zinc/43/31/84/362433184.db2.gz	YDMXESXPQBOVMW-QMMMGPOBSA-N	0	2	263.253	0.912	20	5		CCBDLN
Cn1cnc(CNC(=O)c2cccc(O)c2[N+](=O)[O-])n1	ZINC000339359865	215119899	/nfs/dbraw/zinc/11/98/99/215119899.db2.gz	WVBIDXNTYQZUNU-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000027477113	348099332	/nfs/dbraw/zinc/09/93/32/348099332.db2.gz	XEIUEDNWVNGLSH-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CC(=O)CNC(=O)[C@H](C)Oc1ncc(C)cc1[N+](=O)[O-]	ZINC000344743286	137210759	/nfs/dbraw/zinc/21/07/59/137210759.db2.gz	ARDDBZJFHQQCEZ-VIFPVBQESA-N	0	2	281.268	0.771	20	5		CCBDLN
CC(=O)CNC(=O)[C@@H](C)Oc1ncc(C)cc1[N+](=O)[O-]	ZINC000344743248	137210965	/nfs/dbraw/zinc/21/09/65/137210965.db2.gz	ARDDBZJFHQQCEZ-SECBINFHSA-N	0	2	281.268	0.771	20	5		CCBDLN
O=C(N[C@@H](CO)[C@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000344930975	137222554	/nfs/dbraw/zinc/22/25/54/137222554.db2.gz	YTWPEWABUPUFPX-JOYOIKCWSA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)[C@H](CNC(=O)c1cc(O)ccc1[N+](=O)[O-])OC	ZINC000347860374	137361031	/nfs/dbraw/zinc/36/10/31/137361031.db2.gz	JQWQBOSXIZWZSZ-JTQLQIEISA-N	0	2	298.251	0.218	20	5		CCBDLN
O=C(NCCn1ccnn1)c1ccc([N+](=O)[O-])cc1O	ZINC000121198255	350026958	/nfs/dbraw/zinc/02/69/58/350026958.db2.gz	IYGNHGUZOMTVAV-UHFFFAOYSA-N	0	2	277.240	0.322	20	5		CCBDLN
O=C(NCCNC(=O)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316535	351946644	/nfs/dbraw/zinc/94/66/44/351946644.db2.gz	CFGDZDSKYYEQOA-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
O=C(NC[C@H]1COCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000226561119	352029073	/nfs/dbraw/zinc/02/90/73/352029073.db2.gz	YMHOORHMQOAKDC-VIFPVBQESA-N	0	2	282.252	0.446	20	5		CCBDLN
CCn1cnnc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000230757130	352119333	/nfs/dbraw/zinc/11/93/33/352119333.db2.gz	ALGPWVWZXWQYQZ-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1COCCO1	ZINC000230303028	352110556	/nfs/dbraw/zinc/11/05/56/352110556.db2.gz	FNXVVSVOFRLCBT-SNVBAGLBSA-N	0	2	268.225	0.654	20	5		CCBDLN
C[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)N(C)C	ZINC000235506203	352185455	/nfs/dbraw/zinc/18/54/55/352185455.db2.gz	JTAHDJDBFPDWFK-ZETCQYMHSA-N	0	2	281.268	0.507	20	5		CCBDLN
COC[C@@H](O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270849906	352995865	/nfs/dbraw/zinc/99/58/65/352995865.db2.gz	PQNUEFLPRGDUPI-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCNC(=O)CC1	ZINC000272418497	353061660	/nfs/dbraw/zinc/06/16/60/353061660.db2.gz	PVMQYDWITFUGBS-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
Cc1cccc(C(=O)NN2CCCNC2=O)c1[N+](=O)[O-]	ZINC000272615546	353080053	/nfs/dbraw/zinc/08/00/53/353080053.db2.gz	SLMULNPYYHAKKM-UHFFFAOYSA-N	0	2	278.268	0.963	20	5		CCBDLN
O=C(N[C@@]1(CCO)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000278017409	353278038	/nfs/dbraw/zinc/27/80/38/353278038.db2.gz	FZRWZYZXENINQL-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=C(NCCCc1nc(=O)[nH][nH]1)c1csc([N+](=O)[O-])c1	ZINC000176758257	137679258	/nfs/dbraw/zinc/67/92/58/137679258.db2.gz	XFDPLISJAWIWPW-UHFFFAOYSA-N	0	2	297.296	0.430	20	5		CCBDLN
CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000292721760	198389169	/nfs/dbraw/zinc/38/91/69/198389169.db2.gz	FXHMBKXGVIDANR-MRVPVSSYSA-N	0	2	267.241	0.294	20	5		CCBDLN
COCCCONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000287629037	353658568	/nfs/dbraw/zinc/65/85/68/353658568.db2.gz	BGUMUOFFOUPJAH-UHFFFAOYSA-N	0	2	270.241	0.998	20	5		CCBDLN
CC[C@@H](C)CONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	ZINC000293733319	353835440	/nfs/dbraw/zinc/83/54/40/353835440.db2.gz	NMUANCYLNOMFHY-SECBINFHSA-N	0	2	283.284	0.850	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCO1	ZINC000618915623	366120302	/nfs/dbraw/zinc/12/03/02/366120302.db2.gz	DKNJADUMBMEGGR-NSHDSACASA-N	0	2	282.252	0.745	20	5		CCBDLN
O=c1[nH]nc(CCCNc2ccncc2[N+](=O)[O-])[nH]1	ZINC000360991009	138018216	/nfs/dbraw/zinc/01/82/16/138018216.db2.gz	PWKMUQVGVOBXCZ-UHFFFAOYSA-N	0	2	264.245	0.280	20	5		CCBDLN
C[S@@](=O)C1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000355837159	356657340	/nfs/dbraw/zinc/65/73/40/356657340.db2.gz	GJLDEABUDIKUNX-HXUWFJFHSA-N	0	2	298.320	0.941	20	5		CCBDLN
CCN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O	ZINC000619824919	366361421	/nfs/dbraw/zinc/36/14/21/366361421.db2.gz	CHKKTVBMNHRGKF-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NC[C@@H]1CCCNC1=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000590333715	359440959	/nfs/dbraw/zinc/44/09/59/359440959.db2.gz	VYWBVKGXNLDSAU-QMMMGPOBSA-N	0	2	293.279	0.556	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000590335734	359441696	/nfs/dbraw/zinc/44/16/96/359441696.db2.gz	YFDKHZBSZOIFIN-NSHDSACASA-N	0	2	282.252	0.745	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000594337261	360275907	/nfs/dbraw/zinc/27/59/07/360275907.db2.gz	KIGCTHJQLAXGIJ-SFYZADRCSA-N	0	2	279.252	0.750	20	5		CCBDLN
CC(C)(CNC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000179435217	189194597	/nfs/dbraw/zinc/19/45/97/189194597.db2.gz	CGCSVJXVRUPLQC-UHFFFAOYSA-N	0	2	281.268	0.542	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CCO1	ZINC000597540753	361133037	/nfs/dbraw/zinc/13/30/37/361133037.db2.gz	OYTQOGMQCSPTEB-SNVBAGLBSA-N	0	2	282.252	0.745	20	5		CCBDLN
C[C@@H](C[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181684651	189304299	/nfs/dbraw/zinc/30/42/99/189304299.db2.gz	PAJFFILMJMQKIE-IIYDVTGLSA-N	0	2	286.309	0.797	20	5		CCBDLN
CN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCC1=O	ZINC000598294558	361382929	/nfs/dbraw/zinc/38/29/29/361382929.db2.gz	VZOVYJRKGZFWDA-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CCCN(CC(=O)NC)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184685238	189392792	/nfs/dbraw/zinc/39/27/92/189392792.db2.gz	SUDPHRAIWWEOHX-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
O=C(NOC[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000276471498	193345682	/nfs/dbraw/zinc/34/56/82/193345682.db2.gz	PJJWJHJEWVUICU-MRVPVSSYSA-N	0	2	282.252	0.998	20	5		CCBDLN
CCNC(=O)CN(CC)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000063093027	284537896	/nfs/dbraw/zinc/53/78/96/284537896.db2.gz	SVKANACZXXHMPU-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CC1(C)C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000183563796	388758223	/nfs/dbraw/zinc/75/82/23/388758223.db2.gz	KBDVYQOMZBQUJR-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2O)n[nH]1	ZINC000185145582	388789371	/nfs/dbraw/zinc/78/93/71/388789371.db2.gz	MNJWBSFNLAUDGK-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)O1	ZINC000288740293	388865304	/nfs/dbraw/zinc/86/53/04/388865304.db2.gz	XFZVVWRCCXICKZ-POYBYMJQSA-N	0	2	280.236	0.734	20	5		CCBDLN
NC(=O)CC1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000421912469	389382180	/nfs/dbraw/zinc/38/21/80/389382180.db2.gz	ICXFLFUVDMYYKO-UHFFFAOYSA-N	0	2	293.279	0.686	20	5		CCBDLN
CCC[C@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000414024426	389595059	/nfs/dbraw/zinc/59/50/59/389595059.db2.gz	UCVPRDFHYBRVKQ-PWSUYJOCSA-N	0	2	298.295	0.552	20	5		CCBDLN
CCNC(=O)C(C)(C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000457294513	390037760	/nfs/dbraw/zinc/03/77/60/390037760.db2.gz	IQRFSOJZKAUVFQ-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
O=C(NCCOCCO)c1ccc([N+](=O)[O-])cc1O	ZINC000436519344	389978721	/nfs/dbraw/zinc/97/87/21/389978721.db2.gz	WPVZOKKZSUDGHH-UHFFFAOYSA-N	0	2	270.241	0.039	20	5		CCBDLN
O=C(N[C@H](CO)[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000436804508	389984583	/nfs/dbraw/zinc/98/45/83/389984583.db2.gz	BMNHLBYCURBEQB-ZYHUDNBSSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@H](NS(=O)(=O)c1cccnc1[N+](=O)[O-])c1nnc[nH]1	ZINC000537561325	390178358	/nfs/dbraw/zinc/17/83/58/390178358.db2.gz	LPIQGHVCTLGLEZ-LURJTMIESA-N	0	2	298.284	0.147	20	5		CCBDLN
CCN(CCO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000283089263	195789447	/nfs/dbraw/zinc/78/94/47/195789447.db2.gz	WGRBRIRJFGUDOI-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
NC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000357655471	144109399	/nfs/dbraw/zinc/10/93/99/144109399.db2.gz	PXAYUHVOXRRUHC-UHFFFAOYSA-N	0	2	265.225	0.048	20	5		CCBDLN
CN1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000312722731	290308543	/nfs/dbraw/zinc/30/85/43/290308543.db2.gz	RSUAPRDRDYVLBF-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@H]1O	ZINC000450543781	300197942	/nfs/dbraw/zinc/19/79/42/300197942.db2.gz	YDHBKXZKIUOBEM-OIBJUYFYSA-N	0	2	266.253	0.753	20	5		CCBDLN
CCC[C@@H](O)[C@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000412548303	529070963	/nfs/dbraw/zinc/07/09/63/529070963.db2.gz	PBBGWRXFMAQTCS-CMPLNLGQSA-N	0	2	298.295	0.552	20	5		CCBDLN
COc1c(C(=O)NN2CN=NC2=O)cccc1[N+](=O)[O-]	ZINC000795225476	581401958	/nfs/dbraw/zinc/40/19/58/581401958.db2.gz	GLOCPTIKDDLVMR-UHFFFAOYSA-N	0	2	279.212	0.284	20	5		CCBDLN
C[S@@](=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772866747	581894203	/nfs/dbraw/zinc/89/42/03/581894203.db2.gz	JOXJZBHYECWVAS-GOSISDBHSA-N	0	2	272.282	0.409	20	5		CCBDLN
Cc1nonc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000773053779	581906593	/nfs/dbraw/zinc/90/65/93/581906593.db2.gz	WDCZDIVQHYPKBG-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
COCCONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000748859762	581991030	/nfs/dbraw/zinc/99/10/30/581991030.db2.gz	QZQZLLMSQNBRQH-UHFFFAOYSA-N	0	2	256.214	0.608	20	5		CCBDLN
CC(C)(O)c1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000839777170	614223216	/nfs/dbraw/zinc/22/32/16/614223216.db2.gz	OVRKFMRFSMMPOA-PHDIDXHHSA-N	0	2	271.298	0.974	20	5		CCBDLN
CCOC(=O)c1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c[nH]1	ZINC000839737038	615194676	/nfs/dbraw/zinc/19/46/76/615194676.db2.gz	RPCQZCYZIYQIKR-PHDIDXHHSA-N	0	2	268.229	0.190	20	5		CCBDLN
CN(C)C(=O)OCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000855646624	615990552	/nfs/dbraw/zinc/99/05/52/615990552.db2.gz	DXRDEUSSOLHCJB-UHFFFAOYSA-N	0	2	297.267	0.728	20	5		CCBDLN
C[N@H+](CC(=O)[O-])[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000130153621	616050055	/nfs/dbraw/zinc/05/00/55/616050055.db2.gz	JFOQLDZHCYOTQD-LLVKDONJSA-N	0	2	293.279	0.717	20	5		CCBDLN
C[N@@H+](CC(=O)[O-])[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000130153621	616050056	/nfs/dbraw/zinc/05/00/56/616050056.db2.gz	JFOQLDZHCYOTQD-LLVKDONJSA-N	0	2	293.279	0.717	20	5		CCBDLN
O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001473750376	926838737	/nfs/dbraw/zinc/83/87/37/926838737.db2.gz	NNEAHJJYNXLIEE-MRVPVSSYSA-N	0	2	290.283	0.803	20	5		CCBDLN
O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CC[C@@H](c2nn[nH]n2)C1	ZINC001473750376	926838747	/nfs/dbraw/zinc/83/87/47/926838747.db2.gz	NNEAHJJYNXLIEE-MRVPVSSYSA-N	0	2	290.283	0.803	20	5		CCBDLN
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CCn1nncc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600155434	361878097	/nfs/dbraw/zinc/87/80/97/361878097.db2.gz	FHFTWFPFKAIQOV-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
COC(=O)COCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000600395053	361943796	/nfs/dbraw/zinc/94/37/96/361943796.db2.gz	BRTBUOIZRABDBH-UHFFFAOYSA-N	0	2	298.251	0.220	20	5		CCBDLN
O=C(NC[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000600509178	361999059	/nfs/dbraw/zinc/99/90/59/361999059.db2.gz	CQJQGLAHLVZUKO-OTSSQURYSA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(N[C@H]1CC[S@@](=O)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000334079196	303983678	/nfs/dbraw/zinc/98/36/78/303983678.db2.gz	QIAFDZSCYMNINP-WPCRTTGESA-N	0	2	284.293	0.551	20	5		CCBDLN
O=C(NCc1[nH]cc[nH+]1)c1cccc([O-])c1[N+](=O)[O-]	ZINC000343427940	137134349	/nfs/dbraw/zinc/13/43/49/137134349.db2.gz	LAADJALMWVJOJA-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
CCN(C)C(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000191567332	351764349	/nfs/dbraw/zinc/76/43/49/351764349.db2.gz	WUGTVDUSYVPCDF-QMMMGPOBSA-N	0	2	295.295	0.897	20	5		CCBDLN
C[C@@H](C[S@](C)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000122167938	187018563	/nfs/dbraw/zinc/01/85/63/187018563.db2.gz	JFNGMMCGZGDDTD-ZDVLTJLQSA-N	0	2	286.309	0.797	20	5		CCBDLN
COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000219484110	351968539	/nfs/dbraw/zinc/96/85/39/351968539.db2.gz	ZOILGYSWOJXANJ-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
CO[C@]1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1	ZINC000231221841	352126733	/nfs/dbraw/zinc/12/67/33/352126733.db2.gz	PQQHFDYSSFSKGN-ZDUSSCGKSA-N	0	2	296.279	0.836	20	5		CCBDLN
CCNC(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233500447	352151365	/nfs/dbraw/zinc/15/13/65/352151365.db2.gz	PLRLJIMGBPDZNY-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CNC(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272371981	353057360	/nfs/dbraw/zinc/05/73/60/353057360.db2.gz	HFGVOKRGYUQEKE-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
COCC(=O)N(C)CC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000274856171	353168125	/nfs/dbraw/zinc/16/81/25/353168125.db2.gz	BUHNFFGOHKPWGQ-UHFFFAOYSA-N	0	2	297.267	0.344	20	5		CCBDLN
CNC(=O)[C@H]1CCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280766866	353382367	/nfs/dbraw/zinc/38/23/67/353382367.db2.gz	BLHXNQHJGBPPLN-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NCCn1cc([N+](=O)[O-])cn1)[C@H](F)C(F)(F)F	ZINC000291329209	353779954	/nfs/dbraw/zinc/77/99/54/353779954.db2.gz	QFCHPVBYRJKGJQ-LURJTMIESA-N	0	2	284.169	0.808	20	5		CCBDLN
O=C(NCCn1cc([N+](=O)[O-])cn1)C(F)C(F)(F)F	ZINC000291329209	353779956	/nfs/dbraw/zinc/77/99/56/353779956.db2.gz	QFCHPVBYRJKGJQ-LURJTMIESA-N	0	2	284.169	0.808	20	5		CCBDLN
O=C(NC[C@H]1CC[C@@H](CO)O1)c1ccc([N+](=O)[O-])cc1O	ZINC000293687448	353830485	/nfs/dbraw/zinc/83/04/85/353830485.db2.gz	NUGHHPZOLIMTNU-ZJUUUORDSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN1CCOC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000330565714	354415857	/nfs/dbraw/zinc/41/58/57/354415857.db2.gz	KFXULIRYVXVWBN-SNVBAGLBSA-N	0	2	281.268	0.570	20	5		CCBDLN
C[S@](=O)C1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000355837157	356657749	/nfs/dbraw/zinc/65/77/49/356657749.db2.gz	GJLDEABUDIKUNX-FQEVSTJZSA-N	0	2	298.320	0.941	20	5		CCBDLN
CCN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000619825328	366361098	/nfs/dbraw/zinc/36/10/98/366361098.db2.gz	MPSCBSUYCNXQJG-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O	ZINC000619824920	366361581	/nfs/dbraw/zinc/36/15/81/366361581.db2.gz	CHKKTVBMNHRGKF-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NC[C@H]1CCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000619867761	366364050	/nfs/dbraw/zinc/36/40/50/366364050.db2.gz	HKEHXWILZQBZHX-SECBINFHSA-N	0	2	293.279	0.556	20	5		CCBDLN
COc1cc(C(=O)NCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000359273532	356791317	/nfs/dbraw/zinc/79/13/17/356791317.db2.gz	OVSVWFWMHLIBQA-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
COC[C@@](C)(O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000452354021	236235181	/nfs/dbraw/zinc/23/51/81/236235181.db2.gz	FOEPSQCZOURWNM-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC12COC2	ZINC000597730908	361214986	/nfs/dbraw/zinc/21/49/86/361214986.db2.gz	LVBDPFUAMYTIBV-UHFFFAOYSA-N	0	2	264.237	0.915	20	5		CCBDLN
O=c1[nH]nc(CNc2ccc(F)cc2[N+](=O)[O-])[nH]1	ZINC000301540120	201056649	/nfs/dbraw/zinc/05/66/49/201056649.db2.gz	BWPYJTDAWZAKHT-UHFFFAOYSA-N	0	2	253.193	0.757	20	5		CCBDLN
CC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000184580516	189389631	/nfs/dbraw/zinc/38/96/31/189389631.db2.gz	PIDAHBJMYHJUNZ-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
C[C@@H]1C(=O)NCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280989327	296261925	/nfs/dbraw/zinc/26/19/25/296261925.db2.gz	QEJGQPLYMIUCRD-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@@H]1CC(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000363572668	296270131	/nfs/dbraw/zinc/27/01/31/296270131.db2.gz	HWIQWOWDSJWZEY-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(N[C@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000185515157	388806621	/nfs/dbraw/zinc/80/66/21/388806621.db2.gz	XDRXQJWNWZRHNU-ZETCQYMHSA-N	0	2	252.226	0.819	20	5		CCBDLN
O=C(NCCc1ncc[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC000185814815	388814822	/nfs/dbraw/zinc/81/48/22/388814822.db2.gz	UCFLRWFEOGJIDI-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000194204068	389090717	/nfs/dbraw/zinc/09/07/17/389090717.db2.gz	YGBVSZJEFPROLE-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCCNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000132646197	389226204	/nfs/dbraw/zinc/22/62/04/389226204.db2.gz	BRZAVWBVXAGHNG-UHFFFAOYSA-N	0	2	295.295	0.947	20	5		CCBDLN
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccc2nn[nH]c2c1	ZINC000177843344	389592192	/nfs/dbraw/zinc/59/21/92/389592192.db2.gz	PYHGONOVAXVYBN-UHFFFAOYSA-N	0	2	287.239	0.701	20	5		CCBDLN
CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000414024584	389595468	/nfs/dbraw/zinc/59/54/68/389595468.db2.gz	UCVPRDFHYBRVKQ-ZYHUDNBSSA-N	0	2	298.295	0.552	20	5		CCBDLN
CCN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@H]1CCNC1=O	ZINC000282068458	389653853	/nfs/dbraw/zinc/65/38/53/389653853.db2.gz	DJMNEDIWQIOWDS-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182029520	389698188	/nfs/dbraw/zinc/69/81/88/389698188.db2.gz	OAZFRPMONKJQKB-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC(n2cncn2)C1	ZINC000375684515	389700277	/nfs/dbraw/zinc/70/02/77/389700277.db2.gz	FUBMDXFBPDIWKL-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
O=C(N[C@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000436970671	389988928	/nfs/dbraw/zinc/98/89/28/389988928.db2.gz	FPOJFUCZZJVDGZ-IIYDVTGLSA-N	0	2	284.293	0.551	20	5		CCBDLN
CCOC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436973363	389988979	/nfs/dbraw/zinc/98/89/79/389988979.db2.gz	RZOBSYCJCRKHSU-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(CN1CCCNC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000538870728	390200099	/nfs/dbraw/zinc/20/00/99/390200099.db2.gz	WJPNALQGVHFCSE-UHFFFAOYSA-N	0	2	294.267	0.654	20	5		CCBDLN
C[C@H](CO)N(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000285605879	196341358	/nfs/dbraw/zinc/34/13/58/196341358.db2.gz	BZDGFGLEBIKLJT-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@H]1O	ZINC000450543771	296925151	/nfs/dbraw/zinc/92/51/51/296925151.db2.gz	YDHBKXZKIUOBEM-GMSGAONNSA-N	0	2	266.253	0.753	20	5		CCBDLN
CNC(=O)CCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272446684	290379605	/nfs/dbraw/zinc/37/96/05/290379605.db2.gz	VOBYBEYEUVERKN-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC(=O)N1C	ZINC000330630830	300188304	/nfs/dbraw/zinc/18/83/04/300188304.db2.gz	DPBNOYDMCKXJHK-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
C[C@H]1OCCN2[C@H](c3ccc(O)c([N+](=O)[O-])c3)NC(=O)[C@H]12	ZINC000284929456	300604670	/nfs/dbraw/zinc/60/46/70/300604670.db2.gz	CHTMNYKZXPJKNM-VSYUYLJXSA-N	0	2	293.279	0.518	20	5		CCBDLN
C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1=O	ZINC000794088321	581339013	/nfs/dbraw/zinc/33/90/13/581339013.db2.gz	ZFKIYKPSHGOQEO-GFCCVEGCSA-N	0	2	280.236	0.736	20	5		CCBDLN
CN(C[C@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1)C(=O)[O-]	ZINC000739664758	581646148	/nfs/dbraw/zinc/64/61/48/581646148.db2.gz	NYSAVENXRXRZCO-SECBINFHSA-N	0	2	283.288	0.681	20	5		CCBDLN
CN(C[C@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1)C(=O)[O-]	ZINC000739664758	581646152	/nfs/dbraw/zinc/64/61/52/581646152.db2.gz	NYSAVENXRXRZCO-SECBINFHSA-N	0	2	283.288	0.681	20	5		CCBDLN
O=C([O-])[C@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000821513397	598194376	/nfs/dbraw/zinc/19/43/76/598194376.db2.gz	VLFAOBZUPBLZQS-VXGBXAGGSA-N	0	2	296.279	0.414	20	5		CCBDLN
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COc1cc(C)nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000841167835	617178216	/nfs/dbraw/zinc/17/82/16/617178216.db2.gz	MTVFVBMLFTXPER-RNFRBKRXSA-N	0	2	252.230	0.397	20	5		CCBDLN
CN1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2cccnc21	ZINC000840382208	616227737	/nfs/dbraw/zinc/22/77/37/616227737.db2.gz	OHBGGWDQZUBTMT-PSASIEDQSA-N	0	2	262.269	0.530	20	5		CCBDLN
COCCOc1ccnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000841256645	616597551	/nfs/dbraw/zinc/59/75/51/616597551.db2.gz	ZGBFWSHETKQPNE-HTQZYQBOSA-N	0	2	282.256	0.106	20	5		CCBDLN
O=C(NN1CCOC1=O)c1csc([N+](=O)[O-])c1	ZINC000862700069	645024996	/nfs/dbraw/zinc/02/49/96/645024996.db2.gz	YZBGGEAGMLQMIB-UHFFFAOYSA-N	0	2	257.227	0.753	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC=C[C@@H]1CO	ZINC001153291563	800617582	/nfs/dbraw/zinc/61/75/82/800617582.db2.gz	FSIXODKNCHDFJT-SECBINFHSA-N	0	2	264.237	0.673	20	5		CCBDLN
O=C(NCCNc1ncc([N+](=O)[O-])cn1)C(F)(F)F	ZINC001164236967	802692988	/nfs/dbraw/zinc/69/29/88/802692988.db2.gz	UBQBLBXJQJBMKE-UHFFFAOYSA-N	0	2	279.178	0.475	20	5		CCBDLN
CSc1nc(OC[C@@H]2COCO2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624979	805373300	/nfs/dbraw/zinc/37/33/00/805373300.db2.gz	LRHRCGBXOAOCOI-YFKPBYRVSA-N	0	2	289.269	0.564	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(C(=O)Nc2nncs2)n1	ZINC001324622222	912947140	/nfs/dbraw/zinc/94/71/40/912947140.db2.gz	XOEHWVDQJAJWNZ-UHFFFAOYSA-N	0	2	254.231	0.432	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000600240786	361901593	/nfs/dbraw/zinc/90/15/93/361901593.db2.gz	HLVMBCZKDSSMGC-VXGBXAGGSA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)COCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600396298	361944962	/nfs/dbraw/zinc/94/49/62/361944962.db2.gz	KJRWWSOHCMYSGN-UHFFFAOYSA-N	0	2	298.251	0.220	20	5		CCBDLN
C[C@H](C(=O)NCc1n[nH]c(=O)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000617744734	365752443	/nfs/dbraw/zinc/75/24/43/365752443.db2.gz	KJDFMLSRYLJDFK-ZETCQYMHSA-N	0	2	291.267	0.838	20	5		CCBDLN
COC(=O)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273170136	192064298	/nfs/dbraw/zinc/06/42/98/192064298.db2.gz	BULREEJIOVRUIT-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
CCOC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273206076	192074974	/nfs/dbraw/zinc/07/49/74/192074974.db2.gz	KRTRFGMFDPWCSD-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
Cc1[nH]nc(C(=O)N=c2ncn(C(C)(C)C)[nH]2)c1[N+](=O)[O-]	ZINC000345763025	137251455	/nfs/dbraw/zinc/25/14/55/137251455.db2.gz	AOEZFQGACVNVJN-UHFFFAOYSA-N	0	2	293.287	0.647	20	5		CCBDLN
CCn1[nH]c(C)nc1=NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000412869611	233267676	/nfs/dbraw/zinc/26/76/76/233267676.db2.gz	RXGYCWQXZOARFA-UHFFFAOYSA-N	0	2	291.267	0.894	20	5		CCBDLN
CNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000132496631	350309511	/nfs/dbraw/zinc/30/95/11/350309511.db2.gz	VMEQQGKUDWCRNR-LURJTMIESA-N	0	2	267.241	0.165	20	5		CCBDLN
COC[C@H](CNC(=O)c1cc(O)ccc1[N+](=O)[O-])OC	ZINC000234753062	352168816	/nfs/dbraw/zinc/16/88/16/352168816.db2.gz	YFAJYJVDYFEHOV-VIFPVBQESA-N	0	2	284.268	0.692	20	5		CCBDLN
C[C@@H](O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157968627	188349426	/nfs/dbraw/zinc/34/94/26/188349426.db2.gz	VKJIGFHELRXEIW-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(CCc1nnc[nH]1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000340542982	355569759	/nfs/dbraw/zinc/56/97/59/355569759.db2.gz	PQKZDRFFKNULFQ-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
COC[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1	ZINC000272411112	191704772	/nfs/dbraw/zinc/70/47/72/191704772.db2.gz	ORWSRFGWRTWYFH-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
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O=C(COc1ccccc1[N+](=O)[O-])N=c1cccn[nH]1	ZINC000346039106	355864851	/nfs/dbraw/zinc/86/48/51/355864851.db2.gz	OBIAWHAEZDTLFL-UHFFFAOYSA-N	0	2	274.236	0.824	20	5		CCBDLN
CN(Cc1nnnn1C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353764790	356289652	/nfs/dbraw/zinc/28/96/52/356289652.db2.gz	AGGNBEVISIQNHO-UHFFFAOYSA-N	0	2	292.255	0.096	20	5		CCBDLN
COC[C@](C)(O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000452338843	236233282	/nfs/dbraw/zinc/23/32/82/236233282.db2.gz	CYUKWNJPDSMOHD-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
O=C(NCCCc1nnc[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC000569392119	358761030	/nfs/dbraw/zinc/76/10/30/358761030.db2.gz	VAFBMZBBWHGRNV-UHFFFAOYSA-N	0	2	291.267	0.781	20	5		CCBDLN
O=C(NCCCc1nc[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC000569392119	358761034	/nfs/dbraw/zinc/76/10/34/358761034.db2.gz	VAFBMZBBWHGRNV-UHFFFAOYSA-N	0	2	291.267	0.781	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)Cc2ccc([N+](=O)[O-])cc2)[nH][nH]1	ZINC000610872406	363625224	/nfs/dbraw/zinc/62/52/24/363625224.db2.gz	USDDHKMNZQHLAR-UHFFFAOYSA-N	0	2	289.251	0.020	20	5		CCBDLN
Nc1cc(NCc2n[nH]c(=O)[nH]2)cc(CO)c1[N+](=O)[O-]	ZINC000587994318	359304587	/nfs/dbraw/zinc/30/45/87/359304587.db2.gz	SPJQDPPTGVYANN-UHFFFAOYSA-N	0	2	280.244	0.105	20	5		CCBDLN
CO[C@]1(CO)CCCN(c2cccnc2[N+](=O)[O-])C1	ZINC000596431294	360892060	/nfs/dbraw/zinc/89/20/60/360892060.db2.gz	XTAPNLPQERLCFT-GFCCVEGCSA-N	0	2	267.285	0.968	20	5		CCBDLN
O=C(NCCNC(=O)C1CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000179457453	189195675	/nfs/dbraw/zinc/19/56/75/189195675.db2.gz	FLKUCZQBDPPYCO-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
C[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179474772	189196810	/nfs/dbraw/zinc/19/68/10/189196810.db2.gz	KSTPWWKQQCKFMD-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CCC1=O	ZINC000179510335	189198811	/nfs/dbraw/zinc/19/88/11/189198811.db2.gz	RBUAFBYLXRTECR-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000276573294	193386429	/nfs/dbraw/zinc/38/64/29/193386429.db2.gz	IUNPKFUUVFMTHI-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC(CO)C1	ZINC000332017508	204392373	/nfs/dbraw/zinc/39/23/73/204392373.db2.gz	UYQBTGWWLNYYRC-UHFFFAOYSA-N	0	2	252.226	0.365	20	5		CCBDLN
COC(=O)C1(C)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000425163406	533181407	/nfs/dbraw/zinc/18/14/07/533181407.db2.gz	PDOOIRIHWMNABB-UHFFFAOYSA-N	0	2	294.263	0.936	20	5		CCBDLN
CCN(C)C(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000218447735	389136635	/nfs/dbraw/zinc/13/66/35/389136635.db2.gz	YQZWSONWKFDMJX-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
C[C@@H](Cn1cncn1)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000350015695	389478114	/nfs/dbraw/zinc/47/81/14/389478114.db2.gz	LSBJZWTYRKUEMA-QMMMGPOBSA-N	0	2	291.267	0.710	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@](F)(CO)C1	ZINC000436719033	389983703	/nfs/dbraw/zinc/98/37/03/389983703.db2.gz	YOPNVQMXPXNHDD-GFCCVEGCSA-N	0	2	284.243	0.847	20	5		CCBDLN
NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000123250117	303298825	/nfs/dbraw/zinc/29/88/25/303298825.db2.gz	YJELEXAFYPLMCK-VIFPVBQESA-N	0	2	279.252	0.390	20	5		CCBDLN
Cc1cccc(C(=O)NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000358350803	534610603	/nfs/dbraw/zinc/61/06/03/534610603.db2.gz	DPGNQJCVZNYBAX-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
CCN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000452959035	527989391	/nfs/dbraw/zinc/98/93/91/527989391.db2.gz	QYRNYMVYFNNPKO-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)OC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779663540	581198284	/nfs/dbraw/zinc/19/82/84/581198284.db2.gz	NKQNKXSLVKUTMV-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
CCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779665601	581198800	/nfs/dbraw/zinc/19/88/00/581198800.db2.gz	ZCEWRGOHWYHZBG-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@H](NC(=O)[O-])C2)c(C)c1[N+](=O)[O-]	ZINC000740253778	581652033	/nfs/dbraw/zinc/65/20/33/581652033.db2.gz	QUCTZZAOUZWIKO-VIFPVBQESA-N	0	2	283.288	0.708	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@H](NC(=O)[O-])C2)c(C)c1[N+](=O)[O-]	ZINC000740253778	581652035	/nfs/dbraw/zinc/65/20/35/581652035.db2.gz	QUCTZZAOUZWIKO-VIFPVBQESA-N	0	2	283.288	0.708	20	5		CCBDLN
CC[S@](=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316577	616016224	/nfs/dbraw/zinc/01/62/24/616016224.db2.gz	VALKECDZJASMKS-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
CSc1nc(OC[C@H]2COCO2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624977	805373543	/nfs/dbraw/zinc/37/35/43/805373543.db2.gz	LRHRCGBXOAOCOI-RXMQYKEDSA-N	0	2	289.269	0.564	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1O[C@@H]1CCS(=O)(=O)C1	ZINC001228969840	805494649	/nfs/dbraw/zinc/49/46/49/805494649.db2.gz	DDCRORAGAYKHMI-SSDOTTSWSA-N	0	2	289.265	0.572	20	5		CCBDLN
Nc1c2c(=O)nccc-2[nH]n1[C@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169001064	836096104	/nfs/dbraw/zinc/09/61/04/836096104.db2.gz	CREAJRZFAGNRQI-SFYZADRCSA-N	0	2	277.284	0.876	20	5		CCBDLN
O=C(NC[C@H](O)[C@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600236762	361898730	/nfs/dbraw/zinc/89/87/30/361898730.db2.gz	AZJBVYLPQCKBPT-NWDGAFQWSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN1CCOC[C@@H]1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600421359	361956795	/nfs/dbraw/zinc/95/67/95/361956795.db2.gz	NFGMMWNSXTXDOI-VIFPVBQESA-N	0	2	295.295	0.361	20	5		CCBDLN
CC(C)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000017811043	348055543	/nfs/dbraw/zinc/05/55/43/348055543.db2.gz	CNWSWYMKHCATTM-UHFFFAOYSA-N	0	2	281.268	0.555	20	5		CCBDLN
Cn1cnc(NC(=O)c2cccc(O)c2[N+](=O)[O-])n1	ZINC000349407209	137393141	/nfs/dbraw/zinc/39/31/41/137393141.db2.gz	CWOLEZGKUJVBJY-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000124885873	350110866	/nfs/dbraw/zinc/11/08/66/350110866.db2.gz	RGBMURXWXJVNFX-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c([O-])c1)N1CC[NH+](CCO)CC1	ZINC000124212625	350091643	/nfs/dbraw/zinc/09/16/43/350091643.db2.gz	IPTKBJXWZHEUAD-UHFFFAOYSA-N	0	2	295.295	0.051	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1nncn1C	ZINC000271305471	191063629	/nfs/dbraw/zinc/06/36/29/191063629.db2.gz	UEQFCYVYKMETRX-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
C[C@@H]1CO[C@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000231351595	352128351	/nfs/dbraw/zinc/12/83/51/352128351.db2.gz	JLCJRDSISSAJDX-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H](CO)O1	ZINC000230419517	352115891	/nfs/dbraw/zinc/11/58/91/352115891.db2.gz	BJYZCRKSHRCQGG-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
Cn1cnnc1-n1[nH]c(-c2ccc([N+](=O)[O-])cc2)cc1=O	ZINC000603921535	363171956	/nfs/dbraw/zinc/17/19/56/363171956.db2.gz	UOAXBMFVXCWWPF-UHFFFAOYSA-N	0	2	286.251	0.864	20	5		CCBDLN
Cc1nnc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)o1	ZINC000603921472	363171973	/nfs/dbraw/zinc/17/19/73/363171973.db2.gz	SLYHTAJJRCTMDZ-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
COC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272411088	353061655	/nfs/dbraw/zinc/06/16/55/353061655.db2.gz	ORFMWPKBQLJQHN-QMMMGPOBSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=C(N[C@@]1(CO)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274819654	353164721	/nfs/dbraw/zinc/16/47/21/353164721.db2.gz	XBUKOSLVYREAEU-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
COC(=O)N[C@@H](C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000275177780	353192263	/nfs/dbraw/zinc/19/22/63/353192263.db2.gz	YFEBBMZHPQRTEC-LURJTMIESA-N	0	2	283.240	0.983	20	5		CCBDLN
Cn1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)nn1	ZINC000336813428	355187672	/nfs/dbraw/zinc/18/76/72/355187672.db2.gz	UMUKWWPHYOPVDZ-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(N[C@@]1(CO)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000273564529	192206324	/nfs/dbraw/zinc/20/63/24/192206324.db2.gz	JAVMCTRFWQHYOY-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
CN1C(=O)CC[C@@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000355895972	356666521	/nfs/dbraw/zinc/66/65/21/356666521.db2.gz	LNQGCMBAXGPCHQ-MRVPVSSYSA-N	0	2	279.252	0.860	20	5		CCBDLN
O=C(N=c1cc2n([nH]1)CCCC2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000376202054	357444051	/nfs/dbraw/zinc/44/40/51/357444051.db2.gz	YAEWHYQDCJDCQH-RKDXNWHRSA-N	0	2	250.258	0.245	20	5		CCBDLN
O=C(N=c1cc2n([nH]1)CCCC2)[C@@H]1CC1[N+](=O)[O-]	ZINC000376202054	357444058	/nfs/dbraw/zinc/44/40/58/357444058.db2.gz	YAEWHYQDCJDCQH-RKDXNWHRSA-N	0	2	250.258	0.245	20	5		CCBDLN
C[C@H](C[S@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181684673	189304536	/nfs/dbraw/zinc/30/45/36/189304536.db2.gz	PAJFFILMJMQKIE-XJZHNMMOSA-N	0	2	286.309	0.797	20	5		CCBDLN
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCC1=O	ZINC000598296928	361383329	/nfs/dbraw/zinc/38/33/29/361383329.db2.gz	RCHQPQJJSVYJBH-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
Cn1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)nn1	ZINC000611984970	363821826	/nfs/dbraw/zinc/82/18/26/363821826.db2.gz	RTHLTZVBAHMMKZ-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
[NH3+][C@@H]1C[C@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000565234234	291364488	/nfs/dbraw/zinc/36/44/88/291364488.db2.gz	SHLZIZMBKRWJTO-QWHCGFSZSA-N	0	2	290.323	0.339	20	5		CCBDLN
C[C@@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])c1nc[nH]n1	ZINC000339517930	296105705	/nfs/dbraw/zinc/10/57/05/296105705.db2.gz	TYCJLKCXBSPWJT-ZCFIWIBFSA-N	0	2	277.240	0.910	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@H](CO)O1	ZINC000331317572	203713987	/nfs/dbraw/zinc/71/39/87/203713987.db2.gz	JRXJUYWUBVYTSB-RKDXNWHRSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=c1[nH]nc(Cn2cc([N+](=O)[O-])c(C3CC3)n2)[nH]1	ZINC000436186019	249023892	/nfs/dbraw/zinc/02/38/92/249023892.db2.gz	HZTCUIJZDPXOKG-UHFFFAOYSA-N	0	2	250.218	0.541	20	5		CCBDLN
COC(=O)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267350843	190323212	/nfs/dbraw/zinc/32/32/12/190323212.db2.gz	UZSQJRDGMCGZPM-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
Nc1ccnc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000131572386	284805812	/nfs/dbraw/zinc/80/58/12/284805812.db2.gz	JHHCWHQFHJVZFV-UHFFFAOYSA-N	0	2	289.251	0.603	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)OC	ZINC000267885887	190360869	/nfs/dbraw/zinc/36/08/69/190360869.db2.gz	SYXCXJUDQIJUJZ-MRVPVSSYSA-N	0	2	282.252	0.982	20	5		CCBDLN
COc1cc([N+](=O)[O-])ccc1C(=O)N=c1ccc(=O)[nH][nH]1	ZINC000427334230	533135662	/nfs/dbraw/zinc/13/56/62/533135662.db2.gz	HJAOGXGHPVWDRR-UHFFFAOYSA-N	0	2	290.235	0.773	20	5		CCBDLN
CN(Cc1nncn1C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000288213406	197028485	/nfs/dbraw/zinc/02/84/85/197028485.db2.gz	JBBGENHLAKYFRO-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O	ZINC000186882697	388858099	/nfs/dbraw/zinc/85/80/99/388858099.db2.gz	SCJCTVPCIKHEHL-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@@H](O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000187635809	388888499	/nfs/dbraw/zinc/88/84/99/388888499.db2.gz	JWUDMFPWMCAMAU-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000292859795	388963850	/nfs/dbraw/zinc/96/38/50/388963850.db2.gz	OKDKJMMWNYDAHH-SSDOTTSWSA-N	0	2	267.241	0.294	20	5		CCBDLN
CCc1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)[nH]1	ZINC000295250728	388997398	/nfs/dbraw/zinc/99/73/98/388997398.db2.gz	FBYAKWHHMFCGIZ-UHFFFAOYSA-N	0	2	291.267	0.911	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(C(=O)N=c2ccc(C3CC3)n[nH]2)n1	ZINC000355512377	389087662	/nfs/dbraw/zinc/08/76/62/389087662.db2.gz	SMGCICSRTIYJAT-UHFFFAOYSA-N	0	2	288.267	0.670	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000194204054	389090922	/nfs/dbraw/zinc/09/09/22/389090922.db2.gz	YGBVSZJEFPROLE-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncn(C)n1	ZINC000275570826	389512008	/nfs/dbraw/zinc/51/20/08/389512008.db2.gz	NPFFFERUQBUAJX-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
C[C@]1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000182079691	389699195	/nfs/dbraw/zinc/69/91/95/389699195.db2.gz	SEFUUXHPRWFWEX-LBPRGKRZSA-N	0	2	266.253	0.897	20	5		CCBDLN
Nc1noc(CCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1	ZINC000447673156	389962412	/nfs/dbraw/zinc/96/24/12/389962412.db2.gz	WXFHUVMTKIGANG-UHFFFAOYSA-N	0	2	289.255	0.343	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H](CO)O1	ZINC000436818567	389985296	/nfs/dbraw/zinc/98/52/96/389985296.db2.gz	FVTLBIADBYXREO-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
COCCOC1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000436980803	389988787	/nfs/dbraw/zinc/98/87/87/389988787.db2.gz	PEXPEQGULGHWRC-UHFFFAOYSA-N	0	2	296.279	0.788	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC[S@@]1=O	ZINC000436971829	389989261	/nfs/dbraw/zinc/98/92/61/389989261.db2.gz	LFXUCHOOCBNJNI-FHZGZLOMSA-N	0	2	298.320	0.893	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC[S@]1=O	ZINC000436971832	389989374	/nfs/dbraw/zinc/98/93/74/389989374.db2.gz	LFXUCHOOCBNJNI-ZPWHCFADSA-N	0	2	298.320	0.893	20	5		CCBDLN
O=C(NCCc1nc[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356623036	144020134	/nfs/dbraw/zinc/02/01/34/144020134.db2.gz	SLVOABOZBLHNTD-UHFFFAOYSA-N	0	2	277.240	0.391	20	5		CCBDLN
O=C(NC[C@H](O)C(F)F)c1ccc([N+](=O)[O-])c(O)c1	ZINC000437597946	397535892	/nfs/dbraw/zinc/53/58/92/397535892.db2.gz	FEYQWJPDFFVFOJ-QMMMGPOBSA-N	0	2	276.195	0.656	20	5		CCBDLN
C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)O1	ZINC000288740297	300519958	/nfs/dbraw/zinc/51/99/58/300519958.db2.gz	XFZVVWRCCXICKZ-XPUUQOCRSA-N	0	2	280.236	0.734	20	5		CCBDLN
C[C@]1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1=O	ZINC000292507580	300830666	/nfs/dbraw/zinc/83/06/66/300830666.db2.gz	POANPDIRWKXHQD-LBPRGKRZSA-N	0	2	280.236	0.736	20	5		CCBDLN
CN(CCC(N)=O)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000343474767	536318938	/nfs/dbraw/zinc/31/89/38/536318938.db2.gz	FVLXPRIPVVDZGJ-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H]2C[C@]2(CO)C1	ZINC000783791256	581362391	/nfs/dbraw/zinc/36/23/91/581362391.db2.gz	XAYRJYACWUJYEG-ISVAXAHUSA-N	0	2	278.264	0.755	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCOC[C@@H]1CCO	ZINC000773520046	581930992	/nfs/dbraw/zinc/93/09/92/581930992.db2.gz	DJLDQSPVXSDBBM-JTQLQIEISA-N	0	2	296.279	0.524	20	5		CCBDLN
Cn1cc([C@H](O)C(=O)Nc2cc([N+](=O)[O-])ccc2O)cn1	ZINC000774083509	581957009	/nfs/dbraw/zinc/95/70/09/581957009.db2.gz	YTYCOEIWGCVZHS-NSHDSACASA-N	0	2	292.251	0.706	20	5		CCBDLN
CC(C)[C@H](CO)ONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000836893583	614214812	/nfs/dbraw/zinc/21/48/12/614214812.db2.gz	XZENKFSAIIZHEC-NSHDSACASA-N	0	2	284.268	0.979	20	5		CCBDLN
COC(=O)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1	ZINC000840357316	616582244	/nfs/dbraw/zinc/58/22/44/616582244.db2.gz	HNFSFEVRKZWPOA-GHMZBOCLSA-N	0	2	278.264	0.858	20	5		CCBDLN
NC(=O)[C@H]1Cc2ccccc2N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000840314897	641057944	/nfs/dbraw/zinc/05/79/44/641057944.db2.gz	PADYSIKNXZFISW-HOSYDEDBSA-N	0	2	289.291	0.342	20	5		CCBDLN
COC(=O)c1c[nH]c(O[C@@H](C[N+](=O)[O-])C2CC2)n1	ZINC001230282051	805590814	/nfs/dbraw/zinc/59/08/14/805590814.db2.gz	OENKPODVSSHXSL-QMMMGPOBSA-N	0	2	255.230	0.630	20	5		CCBDLN
COC(=O)c1n[nH]cc1Nc1c(C)c([N+](=O)[O-])cc[n+]1[O-]	ZINC001158634551	801675582	/nfs/dbraw/zinc/67/55/82/801675582.db2.gz	ALPDSDYTNMCZNF-UHFFFAOYSA-N	0	2	293.239	0.790	20	5		CCBDLN
COC(=O)c1n[nH]cc1Nc1ncc([N+](=O)[O-])c(C)n1	ZINC001158641511	801677582	/nfs/dbraw/zinc/67/75/82/801677582.db2.gz	XPFRLXNWEDRIDT-UHFFFAOYSA-N	0	2	278.228	0.947	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)C(C)(C)C(N)=O	ZINC001159435216	801804251	/nfs/dbraw/zinc/80/42/51/801804251.db2.gz	XEVNXOZNEBDLHS-UHFFFAOYSA-N	0	2	281.268	0.636	20	5		CCBDLN
CSc1nc(O[C@@H]2CCOC2=O)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624854	805374669	/nfs/dbraw/zinc/37/46/69/805374669.db2.gz	HGYIWOVPGXKCFA-SCSAIBSYSA-N	0	2	287.253	0.507	20	5		CCBDLN
C[C@@H](O)CC(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21	ZINC001227692762	805378738	/nfs/dbraw/zinc/37/87/38/805378738.db2.gz	CHCYKVMEQUBZOO-RXMQYKEDSA-N	0	2	266.213	0.542	20	5		CCBDLN
Cc1nc(O[C@H]2CCc3nccn3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229382605	805526998	/nfs/dbraw/zinc/52/69/98/805526998.db2.gz	VAWOSQPLGSGPQZ-QMMMGPOBSA-N	0	2	291.267	0.989	20	5		CCBDLN
C[C@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])c1nn(C)cc1O	ZINC001179926749	843080082	/nfs/dbraw/zinc/08/00/82/843080082.db2.gz	LRMXIAZAEGOMFU-LURJTMIESA-N	0	2	294.271	0.258	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1nn(C)cc1O	ZINC001304543258	908170850	/nfs/dbraw/zinc/17/08/50/908170850.db2.gz	DFOVDSHTRKDERN-SSDOTTSWSA-N	0	2	293.283	0.863	20	5		CCBDLN
Cn1ncc([N+](=O)[O-])c1N1CCC[C@H](c2n[nH]c(=O)[nH]2)C1	ZINC001307118076	908280813	/nfs/dbraw/zinc/28/08/13/908280813.db2.gz	IPBNERKHAZIOCU-ZETCQYMHSA-N	0	2	293.287	0.536	20	5		CCBDLN
CN1CCOC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600418640	361954768	/nfs/dbraw/zinc/95/47/68/361954768.db2.gz	DPEBMSVMOSAXCS-JTQLQIEISA-N	0	2	295.295	0.361	20	5		CCBDLN
C[C@H](CCO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000127231351	187290953	/nfs/dbraw/zinc/29/09/53/187290953.db2.gz	QJWLMCOZMAOATJ-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
C[C@@H](CCO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000127231090	187291414	/nfs/dbraw/zinc/29/14/14/187291414.db2.gz	QJWLMCOZMAOATJ-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(NC[C@@H]1CCC(=O)N1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000077009676	349097362	/nfs/dbraw/zinc/09/73/62/349097362.db2.gz	SAUUEONVYUHPTM-QMMMGPOBSA-N	0	2	279.252	0.309	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)N(C)C	ZINC000186251731	351487438	/nfs/dbraw/zinc/48/74/38/351487438.db2.gz	PFJYSSWQICZZTQ-ZETCQYMHSA-N	0	2	281.268	0.507	20	5		CCBDLN
CN1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CCC1=O	ZINC000217315792	351946061	/nfs/dbraw/zinc/94/60/61/351946061.db2.gz	BKELBCVLBYHYRT-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@@H]1CO[C@@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000231351587	352128083	/nfs/dbraw/zinc/12/80/83/352128083.db2.gz	JLCJRDSISSAJDX-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCOC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233674753	352151138	/nfs/dbraw/zinc/15/11/38/352151138.db2.gz	TVAYRRRMWUXQBC-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@H](O)C1	ZINC000236551680	352197451	/nfs/dbraw/zinc/19/74/51/352197451.db2.gz	GTTRNFUVVVVGOG-QMMMGPOBSA-N	0	2	252.226	0.507	20	5		CCBDLN
O=C(N[C@@H]1CCC(=O)NC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236562255	352197903	/nfs/dbraw/zinc/19/79/03/352197903.db2.gz	ZLBYXUKSROTOAP-SSDOTTSWSA-N	0	2	279.252	0.309	20	5		CCBDLN
C[C@@H](O)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000292211790	198203271	/nfs/dbraw/zinc/20/32/71/198203271.db2.gz	YRKKGGGXRSSIGP-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)(F)F)c1cc([N+](=O)[O-])ccc1O	ZINC000272448417	353065315	/nfs/dbraw/zinc/06/53/15/353065315.db2.gz	VUZMBAUEGJDUQD-MRVPVSSYSA-N	0	2	294.185	0.953	20	5		CCBDLN
CNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272368235	353057556	/nfs/dbraw/zinc/05/75/56/353057556.db2.gz	OWBBQHOYEBFLIU-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
O=C(NN1CCCNC1=O)c1csc([N+](=O)[O-])c1	ZINC000272814565	353096797	/nfs/dbraw/zinc/09/67/97/353096797.db2.gz	BFVGIRLEQIRGHR-UHFFFAOYSA-N	0	2	270.270	0.716	20	5		CCBDLN
Cc1nc(NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)nn1C	ZINC000427630843	235374104	/nfs/dbraw/zinc/37/41/04/235374104.db2.gz	OODUROKLXKDCEB-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
O=C(Nc1nn[nH]n1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000352978189	356126072	/nfs/dbraw/zinc/12/60/72/356126072.db2.gz	UIKGEJKEOGAWSB-UHFFFAOYSA-N	0	2	250.174	0.066	20	5		CCBDLN
O=C(NC[C@H](O)C(F)F)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354060023	356338487	/nfs/dbraw/zinc/33/84/87/356338487.db2.gz	ZNIQZJBEGWKJKL-QMMMGPOBSA-N	0	2	276.195	0.656	20	5		CCBDLN
CNC(=O)NCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000356298167	356743026	/nfs/dbraw/zinc/74/30/26/356743026.db2.gz	SECGPJPGUBDAGS-UHFFFAOYSA-N	0	2	268.229	0.168	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H]1O	ZINC000456408631	236387212	/nfs/dbraw/zinc/38/72/12/236387212.db2.gz	XJFSSKSHXHEIJU-GHMZBOCLSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCO[C@@H]2C[C@@H]21	ZINC000590426156	359459721	/nfs/dbraw/zinc/45/97/21/359459721.db2.gz	GVRFUIUIROPXLY-GXSJLCMTSA-N	0	2	264.237	0.914	20	5		CCBDLN
NC(=O)C1(C(=O)Nc2cc([N+](=O)[O-])ccc2O)CC1	ZINC000611294761	363703277	/nfs/dbraw/zinc/70/32/77/363703277.db2.gz	DUKUYRZCVQWFTJ-UHFFFAOYSA-N	0	2	265.225	0.504	20	5		CCBDLN
CN(Cc1cn(C)nn1)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000598225664	361357565	/nfs/dbraw/zinc/35/75/65/361357565.db2.gz	KOCGVINWIQSXFQ-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
CN(Cc1cn(C)nn1)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000598224280	361358003	/nfs/dbraw/zinc/35/80/03/361358003.db2.gz	CXOWYJZIBMTSTH-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
C[C@H](CO)N(C[C@H](C)O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000275947549	193170953	/nfs/dbraw/zinc/17/09/53/193170953.db2.gz	DHXFCPBOSGVEPP-BDAKNGLRSA-N	0	2	298.295	0.504	20	5		CCBDLN
NC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000130199383	284781555	/nfs/dbraw/zinc/78/15/55/284781555.db2.gz	OVLBSHGZCWPXNT-UHFFFAOYSA-N	0	2	267.241	0.296	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)O1	ZINC000279734131	194547228	/nfs/dbraw/zinc/54/72/28/194547228.db2.gz	AAYIGTVWIBIDHO-UWVGGRQHSA-N	0	2	295.251	0.272	20	5		CCBDLN
O=C(NC[C@H](O)C1CC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000280716050	194941454	/nfs/dbraw/zinc/94/14/54/194941454.db2.gz	BTTXAWWBDWVMNL-JTQLQIEISA-N	0	2	266.253	0.801	20	5		CCBDLN
CCN1CC(=O)N[C@H]1c1ccc([N+](=O)[O-])c(O)c1	ZINC000189857837	285182492	/nfs/dbraw/zinc/18/24/92/285182492.db2.gz	VNVRKBCDCZWCLO-LLVKDONJSA-N	0	2	251.242	0.751	20	5		CCBDLN
O=C(N[C@@H](CO)[C@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355457128	389080793	/nfs/dbraw/zinc/08/07/93/389080793.db2.gz	NVFFUYQGIRGTKI-CMPLNLGQSA-N	0	2	296.279	0.570	20	5		CCBDLN
CCN1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000391569391	389773364	/nfs/dbraw/zinc/77/33/64/389773364.db2.gz	KVZLKGLBYUDNAH-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)[C@](C)(NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000436608270	389980543	/nfs/dbraw/zinc/98/05/43/389980543.db2.gz	PULJSVIJAGNRLC-ZDUSSCGKSA-N	0	2	295.295	0.930	20	5		CCBDLN
O=C(NC[C@@H](O)[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000436962956	389988252	/nfs/dbraw/zinc/98/82/52/389988252.db2.gz	GCPDDPYFPXLSRA-PRHODGIISA-N	0	2	296.279	0.428	20	5		CCBDLN
C[C@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436972817	389988857	/nfs/dbraw/zinc/98/88/57/389988857.db2.gz	PTFRKAJRTGPTJP-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CCC(=O)N1	ZINC000457177781	390033732	/nfs/dbraw/zinc/03/37/32/390033732.db2.gz	GWNADSXXZORDQQ-CYBMUJFWSA-N	0	2	293.279	0.699	20	5		CCBDLN
C[C@H]1OC(=O)N[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000497167166	390429760	/nfs/dbraw/zinc/42/97/60/390429760.db2.gz	JVTOLZMLYHLZFG-MLUIRONXSA-N	0	2	281.224	0.736	20	5		CCBDLN
COC(=O)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000412752731	533536333	/nfs/dbraw/zinc/53/63/33/533536333.db2.gz	RNDLLICUXNJBPS-OCAPTIKFSA-N	0	2	294.263	0.982	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H]1O	ZINC000351868451	296921328	/nfs/dbraw/zinc/92/13/28/296921328.db2.gz	FLGSRSUUKJWXNT-RDDDGLTNSA-N	0	2	266.253	0.753	20	5		CCBDLN
CN(C)c1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000340980383	289431299	/nfs/dbraw/zinc/43/12/99/289431299.db2.gz	PTMMKQCJIJDHEM-UHFFFAOYSA-N	0	2	292.255	0.737	20	5		CCBDLN
O=c1[nH]nc(Cn2cc(Cl)cc([N+](=O)[O-])c2=O)[nH]1	ZINC000340855193	527455130	/nfs/dbraw/zinc/45/51/30/527455130.db2.gz	WUNJRQUWDZGMKT-UHFFFAOYSA-N	0	2	271.620	0.282	20	5		CCBDLN
CC(C)NC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412855546	527708287	/nfs/dbraw/zinc/70/82/87/527708287.db2.gz	LUDDEJZZPQQGCH-QMMMGPOBSA-N	0	2	295.295	0.943	20	5		CCBDLN
C[C@H]1C[N@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1NC(=O)[O-]	ZINC000739192791	581200403	/nfs/dbraw/zinc/20/04/03/581200403.db2.gz	SMYMLPCQHCSVSZ-WPRPVWTQSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@H]1C[N@@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1NC(=O)[O-]	ZINC000739192791	581200405	/nfs/dbraw/zinc/20/04/05/581200405.db2.gz	SMYMLPCQHCSVSZ-WPRPVWTQSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000783756439	581359193	/nfs/dbraw/zinc/35/91/93/581359193.db2.gz	QDYXKAOFVZVDES-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C([O-])NC[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000740646984	581706126	/nfs/dbraw/zinc/70/61/26/581706126.db2.gz	VIXHBKQEPBPDEN-MRVPVSSYSA-N	0	2	269.261	0.338	20	5		CCBDLN
O=C([O-])NC[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000740646984	581706129	/nfs/dbraw/zinc/70/61/29/581706129.db2.gz	VIXHBKQEPBPDEN-MRVPVSSYSA-N	0	2	269.261	0.338	20	5		CCBDLN
Cn1cc([C@@H](O)C(=O)Nc2cc([N+](=O)[O-])ccc2O)cn1	ZINC000774083506	581957075	/nfs/dbraw/zinc/95/70/75/581957075.db2.gz	YTYCOEIWGCVZHS-LLVKDONJSA-N	0	2	292.251	0.706	20	5		CCBDLN
CC(C)(C(=O)OCc1n[nH]c(=O)[nH]1)n1cc([N+](=O)[O-])cn1	ZINC000774940505	582004470	/nfs/dbraw/zinc/00/44/70/582004470.db2.gz	CRYCYFLRQXPEDQ-UHFFFAOYSA-N	0	2	296.243	0.094	20	5		CCBDLN
CCn1ncc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000862381303	615707177	/nfs/dbraw/zinc/70/71/77/615707177.db2.gz	CBRKSHHOWMMECT-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=c1[nH]nc(CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])[nH]1	ZINC000804539346	640771473	/nfs/dbraw/zinc/77/14/73/640771473.db2.gz	DSTSWXFHSMSWDF-UHFFFAOYSA-N	0	2	280.200	0.939	20	5		CCBDLN
Cc1c(F)ccc([N+](=O)[O-])c1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC001149296273	800244705	/nfs/dbraw/zinc/24/47/05/800244705.db2.gz	CVMSUZQEKSYXBG-UHFFFAOYSA-N	0	2	295.230	0.796	20	5		CCBDLN
O=C(C[C@H]1CC(=O)NC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC001153455575	800631469	/nfs/dbraw/zinc/63/14/69/800631469.db2.gz	NVXYBVJZYHZDDA-LURJTMIESA-N	0	2	293.235	0.292	20	5		CCBDLN
CCn1cc([N+](=O)[O-])c(C(=O)Nc2nncs2)n1	ZINC001349192051	924903663	/nfs/dbraw/zinc/90/36/63/924903663.db2.gz	OLGRTWXPEHZNFV-UHFFFAOYSA-N	0	2	268.258	0.915	20	5		CCBDLN
COCC[N@H+](CCC(=O)[O-])Cc1onc(C)c1[N+](=O)[O-]	ZINC001594011332	957000078	/nfs/dbraw/zinc/00/00/78/957000078.db2.gz	IRBOBTHFQNTXAJ-UHFFFAOYSA-N	0	2	287.272	0.814	20	5		CCBDLN
COCC[N@@H+](CCC(=O)[O-])Cc1onc(C)c1[N+](=O)[O-]	ZINC001594011332	957000092	/nfs/dbraw/zinc/00/00/92/957000092.db2.gz	IRBOBTHFQNTXAJ-UHFFFAOYSA-N	0	2	287.272	0.814	20	5		CCBDLN
O=c1[nH]nc(CSc2ncccc2[N+](=O)[O-])[nH]1	ZINC000091582963	349468293	/nfs/dbraw/zinc/46/82/93/349468293.db2.gz	QUQFHKDUYUQPJL-UHFFFAOYSA-N	0	2	253.243	0.694	20	5		CCBDLN
COC(=O)COCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600398676	361946487	/nfs/dbraw/zinc/94/64/87/361946487.db2.gz	ZCBQZYHDCATZDY-UHFFFAOYSA-N	0	2	298.251	0.220	20	5		CCBDLN
COC(=O)[C@@H](CNC(=O)c1cc(O)ccc1[N+](=O)[O-])OC	ZINC000347860378	137361054	/nfs/dbraw/zinc/36/10/54/137361054.db2.gz	JQWQBOSXIZWZSZ-SNVBAGLBSA-N	0	2	298.251	0.218	20	5		CCBDLN
C[C@@H](Cn1cncn1)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271251682	191028757	/nfs/dbraw/zinc/02/87/57/191028757.db2.gz	HONVJFYKNVVCPP-QMMMGPOBSA-N	0	2	291.267	0.710	20	5		CCBDLN
Nc1ncncc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000339720324	215312585	/nfs/dbraw/zinc/31/25/85/215312585.db2.gz	FEGYAALUHTZWQH-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
CC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181873617	351340287	/nfs/dbraw/zinc/34/02/87/351340287.db2.gz	MUESAIOUXUUTPQ-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(N[C@@H]1CCCCNC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181877237	351340496	/nfs/dbraw/zinc/34/04/96/351340496.db2.gz	PWQAJWXRPRNOQT-SNVBAGLBSA-N	0	2	293.279	0.699	20	5		CCBDLN
C[C@H](C[S@@](C)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000122168586	187018836	/nfs/dbraw/zinc/01/88/36/187018836.db2.gz	JFNGMMCGZGDDTD-XJZHNMMOSA-N	0	2	286.309	0.797	20	5		CCBDLN
CNC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000219735687	351969568	/nfs/dbraw/zinc/96/95/68/351969568.db2.gz	PNUVRTLZESDGEL-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1nncn1C	ZINC000231361045	352128341	/nfs/dbraw/zinc/12/83/41/352128341.db2.gz	OBXNMZVUXPRBSU-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(NC[C@@H]1COCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236561484	352197883	/nfs/dbraw/zinc/19/78/83/352197883.db2.gz	QIUCVHJTTGAWMI-SECBINFHSA-N	0	2	282.252	0.446	20	5		CCBDLN
NC(=O)N[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000270792966	352986592	/nfs/dbraw/zinc/98/65/92/352986592.db2.gz	VKTKLMBMWMTNIG-MRVPVSSYSA-N	0	2	294.267	0.183	20	5		CCBDLN
COC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1O)OC	ZINC000274947378	353174705	/nfs/dbraw/zinc/17/47/05/353174705.db2.gz	QUKUSRKWXZTFHM-SECBINFHSA-N	0	2	284.268	0.692	20	5		CCBDLN
COC(=O)[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1O)OC	ZINC000294072151	353865926	/nfs/dbraw/zinc/86/59/26/353865926.db2.gz	QJZWFKNFVSRZOF-JTQLQIEISA-N	0	2	298.251	0.218	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)C1CC(O)C1	ZINC000332415945	354666040	/nfs/dbraw/zinc/66/60/40/354666040.db2.gz	BYZDSUXEYXRLEO-UHFFFAOYSA-N	0	2	266.253	0.896	20	5		CCBDLN
COC[C@H](CCO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354056928	356336908	/nfs/dbraw/zinc/33/69/08/356336908.db2.gz	OGSVEHZPLXVTCC-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@H]1CO[C@H](CO)CN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000450199745	236073670	/nfs/dbraw/zinc/07/36/70/236073670.db2.gz	VHEANQCQVGUTMC-IUCAKERBSA-N	0	2	296.279	0.522	20	5		CCBDLN
NC(=O)C[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000588803236	359338161	/nfs/dbraw/zinc/33/81/61/359338161.db2.gz	FQHVMXJXIKOQOE-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
COC[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000593810313	360162484	/nfs/dbraw/zinc/16/24/84/360162484.db2.gz	CPBAVZSROSFWTA-VHSXEESVSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@@H](CO)N(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000180189308	189242441	/nfs/dbraw/zinc/24/24/41/189242441.db2.gz	LGJYHTOAWPDFBD-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
CN(C[C@H]1COCCO1)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000598185846	361350855	/nfs/dbraw/zinc/35/08/55/361350855.db2.gz	ZCUXYJDWLRIVRN-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
C[C@@H](O)C1(NC(=O)c2cccc(O)c2[N+](=O)[O-])CC1	ZINC000598384749	361401824	/nfs/dbraw/zinc/40/18/24/361401824.db2.gz	RHPMJGNMUYJSND-SSDOTTSWSA-N	0	2	266.253	0.944	20	5		CCBDLN
Cc1noc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])n1	ZINC000569897985	291717923	/nfs/dbraw/zinc/71/79/23/291717923.db2.gz	UMQMMXGLXQGDBJ-UHFFFAOYSA-N	0	2	299.268	0.160	20	5		CCBDLN
CC(C)NC(=O)CCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280939945	195039289	/nfs/dbraw/zinc/03/92/89/195039289.db2.gz	LHFKOQDHOBDNLD-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
CC(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000023327561	388803056	/nfs/dbraw/zinc/80/30/56/388803056.db2.gz	JQDRGAGAQFQVDJ-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
CC(C)(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000185516195	388806775	/nfs/dbraw/zinc/80/67/75/388806775.db2.gz	LJXPSAGKYPEZJX-JTQLQIEISA-N	0	2	295.295	0.930	20	5		CCBDLN
C[C@@H](CO)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000159617465	389370801	/nfs/dbraw/zinc/37/08/01/389370801.db2.gz	JMLWYPPDHODGJA-SSDOTTSWSA-N	0	2	254.242	0.659	20	5		CCBDLN
NC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000422017538	389390908	/nfs/dbraw/zinc/39/09/08/389390908.db2.gz	PUQHTANSBWJBCR-BDAKNGLRSA-N	0	2	293.279	0.684	20	5		CCBDLN
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2cccnc2O1	ZINC000372233389	389446326	/nfs/dbraw/zinc/44/63/26/389446326.db2.gz	NZRVQWCXFNZVDD-NQMVMOMDSA-N	0	2	263.253	0.861	20	5		CCBDLN
NC(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181882855	389695975	/nfs/dbraw/zinc/69/59/75/389695975.db2.gz	JHZYNNFZSXPXHT-UHFFFAOYSA-N	0	2	267.241	0.296	20	5		CCBDLN
O=C(N[C@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000182152013	389702232	/nfs/dbraw/zinc/70/22/32/389702232.db2.gz	DSJRTQOQWFPDHL-ZETCQYMHSA-N	0	2	252.226	0.819	20	5		CCBDLN
Nc1ccnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000182180178	389702276	/nfs/dbraw/zinc/70/22/76/389702276.db2.gz	VKLNUOFWDOHKAO-UHFFFAOYSA-N	0	2	289.251	0.603	20	5		CCBDLN
CO[C@@H]1COC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000458340083	390055818	/nfs/dbraw/zinc/05/58/18/390055818.db2.gz	JOAOOVCNCSUEQB-GZMMTYOYSA-N	0	2	282.252	0.444	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000592903405	390365256	/nfs/dbraw/zinc/36/52/56/390365256.db2.gz	WOBBUKBCFIBVLE-SSDOTTSWSA-N	0	2	279.252	0.561	20	5		CCBDLN
C[C@H]1C(=O)N(C)CN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000592903406	390365485	/nfs/dbraw/zinc/36/54/85/390365485.db2.gz	WOBBUKBCFIBVLE-ZETCQYMHSA-N	0	2	279.252	0.561	20	5		CCBDLN
Cn1ccc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])n1	ZINC000554389829	390426061	/nfs/dbraw/zinc/42/60/61/390426061.db2.gz	LONKVIZWHPWZPX-IHWYPQMZSA-N	0	2	263.213	0.700	20	5		CCBDLN
Cc1cnc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])o1	ZINC000530931653	285666331	/nfs/dbraw/zinc/66/63/31/285666331.db2.gz	HAHBBXHAOAGZBH-UHFFFAOYSA-N	0	2	298.280	0.765	20	5		CCBDLN
O=C(N[C@@H]1CCC(=O)NC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000221977688	544818694	/nfs/dbraw/zinc/81/86/94/544818694.db2.gz	QHQDXOMNDSWBGN-MRVPVSSYSA-N	0	2	279.252	0.309	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2O)n(C)n1	ZINC000166538862	302609951	/nfs/dbraw/zinc/60/99/51/302609951.db2.gz	DXEHFQUPKXJYOX-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
NC(=O)[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436969395	303329333	/nfs/dbraw/zinc/32/93/33/303329333.db2.gz	XZXLJOZQLBYONF-SECBINFHSA-N	0	2	279.252	0.390	20	5		CCBDLN
Cn1cnnc1CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000227770780	527521918	/nfs/dbraw/zinc/52/19/18/527521918.db2.gz	PWRIQDWIUCEEHE-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
CCC(=O)N1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000425037457	528324079	/nfs/dbraw/zinc/32/40/79/528324079.db2.gz	NNZWYIVSUKYNKX-UHFFFAOYSA-N	0	2	293.279	0.952	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000780069223	581218119	/nfs/dbraw/zinc/21/81/19/581218119.db2.gz	PPGIAFOZLGRUEE-UHFFFAOYSA-N	0	2	280.196	0.481	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H]2C[C@]2(CO)C1	ZINC000783792325	581362754	/nfs/dbraw/zinc/36/27/54/581362754.db2.gz	YTWJCCIFBCRXAZ-ISVAXAHUSA-N	0	2	278.264	0.755	20	5		CCBDLN
C[C@@H]1CN(C(=O)[O-])CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000826026605	603705752	/nfs/dbraw/zinc/70/57/52/603705752.db2.gz	MNHAEBWJLUIAII-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@@H]1CN(C(=O)[O-])CC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000826026605	603705753	/nfs/dbraw/zinc/70/57/53/603705753.db2.gz	MNHAEBWJLUIAII-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
COc1ccnc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000846919863	617325763	/nfs/dbraw/zinc/32/57/63/617325763.db2.gz	ITLRNDQWZSQDDP-RNFRBKRXSA-N	0	2	252.230	0.113	20	5		CCBDLN
CCOC(=O)c1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])oc1C	ZINC000841188635	615194535	/nfs/dbraw/zinc/19/45/35/615194535.db2.gz	SZAPZCUQWUCHIC-RNFRBKRXSA-N	0	2	283.240	0.763	20	5		CCBDLN
CSc1nc(O[C@H]2C[C@@H](O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218416845	803954976	/nfs/dbraw/zinc/95/49/76/803954976.db2.gz	HBQUVEYRCZXKMC-SYDPRGILSA-N	0	2	273.270	0.714	20	5		CCBDLN
CSc1nc(OC(=O)C[C@@H](C)O)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625536	805374775	/nfs/dbraw/zinc/37/47/75/805374775.db2.gz	ZXHMDJZTHKKOKY-SCSAIBSYSA-N	0	2	289.269	0.489	20	5		CCBDLN
COc1cc(=O)[nH]c(O[C@@H](C[N+](=O)[O-])C2CC2)n1	ZINC001228919441	814859966	/nfs/dbraw/zinc/85/99/66/814859966.db2.gz	XSINIWUGKVMLQQ-ZETCQYMHSA-N	0	2	255.230	0.625	20	5		CCBDLN
COC(=O)c1n[nH]cc1Nc1nc(OC)ncc1[N+](=O)[O-]	ZINC001169571607	836359688	/nfs/dbraw/zinc/35/96/88/836359688.db2.gz	ONGWSGHUIQDIBK-UHFFFAOYSA-N	0	2	294.227	0.647	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCCO1)c1cccc(O)c1[N+](=O)[O-]	ZINC000600241417	361901315	/nfs/dbraw/zinc/90/13/15/361901315.db2.gz	KCBIGRHIIWPDJZ-GHMZBOCLSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[N@@H+]1CCOC[C@@H]1CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000600421370	361957064	/nfs/dbraw/zinc/95/70/64/361957064.db2.gz	NJLXTALNUAEBTH-JTQLQIEISA-N	0	2	295.295	0.361	20	5		CCBDLN
C[N@H+]1CCOC[C@@H]1CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000600421370	361957070	/nfs/dbraw/zinc/95/70/70/361957070.db2.gz	NJLXTALNUAEBTH-JTQLQIEISA-N	0	2	295.295	0.361	20	5		CCBDLN
C[C@H](O)CN1N=C(c2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000601943232	362432203	/nfs/dbraw/zinc/43/22/03/362432203.db2.gz	BVYXFERYZLQZGX-QMMMGPOBSA-N	0	2	263.253	0.912	20	5		CCBDLN
C[C@H](O)Cn1[nH]c(-c2ccc([N+](=O)[O-])cc2)cc1=O	ZINC000601943232	362432207	/nfs/dbraw/zinc/43/22/07/362432207.db2.gz	BVYXFERYZLQZGX-QMMMGPOBSA-N	0	2	263.253	0.912	20	5		CCBDLN
CC[C@@H](O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000344426041	137194277	/nfs/dbraw/zinc/19/42/77/137194277.db2.gz	IPYGZSRMMMYEEZ-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
Cc1nc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])nn1C	ZINC000344581669	137202576	/nfs/dbraw/zinc/20/25/76/137202576.db2.gz	BIXXSBGVWMGGGV-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
O=C(NC[C@H](O)[C@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000347086646	137319291	/nfs/dbraw/zinc/31/92/91/137319291.db2.gz	DNKBDQHGDMHBIJ-CABZTGNLSA-N	0	2	296.279	0.428	20	5		CCBDLN
COC(=O)N(C)CC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000273352294	192124130	/nfs/dbraw/zinc/12/41/30/192124130.db2.gz	NDWKZNKAWPBJNL-UHFFFAOYSA-N	0	2	283.240	0.937	20	5		CCBDLN
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O=C(NCC[NH+]1CCOCC1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000163979899	350775037	/nfs/dbraw/zinc/77/50/37/350775037.db2.gz	YZZUYDFGVGLMOU-UHFFFAOYSA-N	0	2	295.295	0.362	20	5		CCBDLN
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C[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])c1nc[nH]n1	ZINC000227882724	352061524	/nfs/dbraw/zinc/06/15/24/352061524.db2.gz	AWNYJMUOWXWKKA-ZCFIWIBFSA-N	0	2	277.240	0.910	20	5		CCBDLN
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C[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])c1nc[nH]n1	ZINC000227882728	352061963	/nfs/dbraw/zinc/06/19/63/352061963.db2.gz	AWNYJMUOWXWKKA-LURJTMIESA-N	0	2	277.240	0.910	20	5		CCBDLN
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CCOC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000226387135	352024618	/nfs/dbraw/zinc/02/46/18/352024618.db2.gz	DTBHEANZGVFCHH-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
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COCCOCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000230303074	352110882	/nfs/dbraw/zinc/11/08/82/352110882.db2.gz	ZODFFDWJDJEVFM-UHFFFAOYSA-N	0	2	270.241	0.902	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H](CO)O1	ZINC000230419513	352115414	/nfs/dbraw/zinc/11/54/14/352115414.db2.gz	BJYZCRKSHRCQGG-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CC(C)CONC(=O)Cn1cc([N+](=O)[O-])ccc1=O	ZINC000153464514	188083214	/nfs/dbraw/zinc/08/32/14/188083214.db2.gz	JJPJPPWBFRWXMR-UHFFFAOYSA-N	0	2	269.257	0.460	20	5		CCBDLN
CC(=O)N1CC(NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000332454667	354676180	/nfs/dbraw/zinc/67/61/80/354676180.db2.gz	OBZCXGAYSDNREW-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
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COC(=O)[C@H]1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000217315996	291868031	/nfs/dbraw/zinc/86/80/31/291868031.db2.gz	PZNJFXBQCVFTPV-QMMMGPOBSA-N	0	2	294.263	0.936	20	5		CCBDLN
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CCC[C@H](O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412534929	528324218	/nfs/dbraw/zinc/32/42/18/528324218.db2.gz	PPNPSXODCWNIHZ-QWRGUYRKSA-N	0	2	298.295	0.552	20	5		CCBDLN
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CC[N@@H+](CC(=O)[O-])Cn1c(=O)oc2ccc([N+](=O)[O-])cc21	ZINC000737075282	581896579	/nfs/dbraw/zinc/89/65/79/581896579.db2.gz	OSEMAZYNUDEPRB-UHFFFAOYSA-N	0	2	295.251	0.867	20	5		CCBDLN
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CC[S@](=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772945981	581902057	/nfs/dbraw/zinc/90/20/57/581902057.db2.gz	FSKRVWCWMVIDLM-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
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CS(C)(=O)=NS(=O)(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000821116051	617199222	/nfs/dbraw/zinc/19/92/22/617199222.db2.gz	HWOGRLLCNPIUTD-UHFFFAOYSA-N	0	2	293.326	0.979	20	5		CCBDLN
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CCCNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001337490354	921260384	/nfs/dbraw/zinc/26/03/84/921260384.db2.gz	MHXMRSLOXYLJKL-MRVPVSSYSA-N	0	2	295.295	0.945	20	5		CCBDLN
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CCCc1n[nH]c(C(=O)N(C)Cc2nnc[nH]2)c1[N+](=O)[O-]	ZINC000172617231	350998668	/nfs/dbraw/zinc/99/86/68/350998668.db2.gz	IUOALUIXPTYBLC-UHFFFAOYSA-N	0	2	293.287	0.661	20	5		CCBDLN
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COC(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000299320303	354008633	/nfs/dbraw/zinc/00/86/33/354008633.db2.gz	BZCLLVJAMQIKLT-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
O=C(NC1COCCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000313446371	354215027	/nfs/dbraw/zinc/21/50/27/354215027.db2.gz	BHEIDEWCTKXQSV-UHFFFAOYSA-N	0	2	282.252	0.446	20	5		CCBDLN
CCNC(=O)C1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000353587409	356254876	/nfs/dbraw/zinc/25/48/76/356254876.db2.gz	YUVFXVCDLDYWMO-UHFFFAOYSA-N	0	2	293.279	0.509	20	5		CCBDLN
O=C(NCC(F)(F)CO)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354751601	356489595	/nfs/dbraw/zinc/48/95/95/356489595.db2.gz	BZFFTPSJUCQGEJ-UHFFFAOYSA-N	0	2	276.195	0.658	20	5		CCBDLN
COCCCN(CCO)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355032130	356555163	/nfs/dbraw/zinc/55/51/63/356555163.db2.gz	OQCFGKQMIVNHFM-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
O=C(N[C@H](CO)CCF)c1cc([N+](=O)[O-])ccc1O	ZINC000593861074	360179584	/nfs/dbraw/zinc/17/95/84/360179584.db2.gz	PFMZLZWOBQUEGW-ZETCQYMHSA-N	0	2	272.232	0.751	20	5		CCBDLN
O=C(N[C@H](CO)CCF)c1cc(O)ccc1[N+](=O)[O-]	ZINC000593862288	360179972	/nfs/dbraw/zinc/17/99/72/360179972.db2.gz	VOMKZRNERXELGU-ZETCQYMHSA-N	0	2	272.232	0.751	20	5		CCBDLN
C[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179474762	189196916	/nfs/dbraw/zinc/19/69/16/189196916.db2.gz	KSTPWWKQQCKFMD-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
CNC(=O)C1(C(=O)Nc2cc([N+](=O)[O-])ccc2O)CC1	ZINC000180777591	189274721	/nfs/dbraw/zinc/27/47/21/189274721.db2.gz	IQBKAYUSHKBKOA-UHFFFAOYSA-N	0	2	279.252	0.765	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCOCCN1	ZINC000597706340	361202597	/nfs/dbraw/zinc/20/25/97/361202597.db2.gz	SUOSPSIOARWYAE-UHFFFAOYSA-N	0	2	267.241	0.277	20	5		CCBDLN
COCc1nnc(CNC(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]1	ZINC000598056505	361326296	/nfs/dbraw/zinc/32/62/96/361326296.db2.gz	YQDBCVMWOVWVMR-UHFFFAOYSA-N	0	2	280.244	0.117	20	5		CCBDLN
O=C(N[C@H]1C[C@H](O)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000598527582	361438271	/nfs/dbraw/zinc/43/82/71/361438271.db2.gz	DMVRTICFKNJCPI-FKQCQYRASA-N	0	2	252.226	0.554	20	5		CCBDLN
O=c1[nH]nc(CNc2c(F)cc([N+](=O)[O-])cc2F)[nH]1	ZINC000301802172	201205758	/nfs/dbraw/zinc/20/57/58/201205758.db2.gz	UHUVDOFFPJOOSZ-UHFFFAOYSA-N	0	2	271.183	0.897	20	5		CCBDLN
CC(C)(C)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000073067726	284561830	/nfs/dbraw/zinc/56/18/30/284561830.db2.gz	CBEAAZAUBSJPHF-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184944081	296262037	/nfs/dbraw/zinc/26/20/37/296262037.db2.gz	IFYDSXRRYMMWJJ-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
COC(=O)C[C@@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280888521	195015940	/nfs/dbraw/zinc/01/59/40/195015940.db2.gz	BKUJNELPGJNGOX-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCO[C@H](CO)C1	ZINC000280963261	195047802	/nfs/dbraw/zinc/04/78/02/195047802.db2.gz	JWHJLCWZYCKMDQ-QMMMGPOBSA-N	0	2	282.252	0.134	20	5		CCBDLN
CCN1CC(=O)N[C@@H]1c1ccc([N+](=O)[O-])c(O)c1	ZINC000189857813	285182432	/nfs/dbraw/zinc/18/24/32/285182432.db2.gz	VNVRKBCDCZWCLO-NSHDSACASA-N	0	2	251.242	0.751	20	5		CCBDLN
CC[C@@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])C(=O)OC	ZINC000281397355	195224380	/nfs/dbraw/zinc/22/43/80/195224380.db2.gz	YHXYGUYTFOUDNQ-MRVPVSSYSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(NC1(CO)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000185587056	388809542	/nfs/dbraw/zinc/80/95/42/388809542.db2.gz	RHZNTRRHBDTWJN-UHFFFAOYSA-N	0	2	252.226	0.555	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC[C@H](CO)C1	ZINC000283049897	388762083	/nfs/dbraw/zinc/76/20/83/388762083.db2.gz	AGKXJEDCZIPKAQ-QMMMGPOBSA-N	0	2	266.253	0.755	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC(=O)N1	ZINC000295833155	389008800	/nfs/dbraw/zinc/00/88/00/389008800.db2.gz	CRQFSLDYJAPGBK-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000195151716	389116933	/nfs/dbraw/zinc/11/69/33/389116933.db2.gz	FXHACFMCOVCHIU-CPCISQLKSA-N	0	2	293.279	0.555	20	5		CCBDLN
O=C(NCc1[nH]cc[nH+]1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000164612001	389435652	/nfs/dbraw/zinc/43/56/52/389435652.db2.gz	WCIGJWHEXRYFSO-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ncnn1C	ZINC000276915965	389553957	/nfs/dbraw/zinc/55/39/57/389553957.db2.gz	RWLNHBPVZMQPQT-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
C[C@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000177431803	389584055	/nfs/dbraw/zinc/58/40/55/389584055.db2.gz	GWZMUEBNNSRFHA-LBPRGKRZSA-N	0	2	266.253	0.897	20	5		CCBDLN
COC(=O)[C@H]1C[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000413969760	389586727	/nfs/dbraw/zinc/58/67/27/389586727.db2.gz	FFQGEIANDSKPKA-OCAPTIKFSA-N	0	2	294.263	0.982	20	5		CCBDLN
CCC[C@@H](O)[C@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000414013936	389592244	/nfs/dbraw/zinc/59/22/44/389592244.db2.gz	HBNGNWOJURMOBI-VHSXEESVSA-N	0	2	298.295	0.552	20	5		CCBDLN
COC[C@H]1C(=O)N[C@H](c2ccc([N+](=O)[O-])c(O)c2)N1C	ZINC000414199804	389605182	/nfs/dbraw/zinc/60/51/82/389605182.db2.gz	RKXLSVCGYHTWSX-ONGXEEELSA-N	0	2	281.268	0.376	20	5		CCBDLN
CCOC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000433363080	389910629	/nfs/dbraw/zinc/91/06/29/389910629.db2.gz	KSWJRXVDBJEAED-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H](CO)O1	ZINC000436818568	389985150	/nfs/dbraw/zinc/98/51/50/389985150.db2.gz	FVTLBIADBYXREO-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
CN(C)c1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436854151	389985909	/nfs/dbraw/zinc/98/59/09/389985909.db2.gz	MWQJTGGHAJPZMR-UHFFFAOYSA-N	0	2	292.255	0.737	20	5		CCBDLN
CO[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1	ZINC000436938795	389987805	/nfs/dbraw/zinc/98/78/05/389987805.db2.gz	MXHPWSYCDQXCHH-CYBMUJFWSA-N	0	2	296.279	0.836	20	5		CCBDLN
O=C(NCc1c[nH+]c[nH]1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000436970415	389988221	/nfs/dbraw/zinc/98/82/21/389988221.db2.gz	DPNPANWXXDQFDG-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
O=C(N[C@@H]1CC[S@](=O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000436979263	389989227	/nfs/dbraw/zinc/98/92/27/389989227.db2.gz	KIBIHPGLJLATFJ-XJZHNMMOSA-N	0	2	284.293	0.551	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@@H]1O	ZINC000450543784	389997647	/nfs/dbraw/zinc/99/76/47/389997647.db2.gz	YDHBKXZKIUOBEM-XCBNKYQSSA-N	0	2	266.253	0.753	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)NC	ZINC000457012886	390024353	/nfs/dbraw/zinc/02/43/53/390024353.db2.gz	OVBLHOSNNYLCCT-MRVPVSSYSA-N	0	2	281.268	0.555	20	5		CCBDLN
Cn1ccnc1-c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n(C)n1	ZINC000370728716	144314010	/nfs/dbraw/zinc/31/40/10/144314010.db2.gz	PBAXCOAXIIZLNI-VXNVDRBHSA-N	0	2	290.283	0.424	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC(n2ccnn2)C1	ZINC000371672674	144340310	/nfs/dbraw/zinc/34/03/10/144340310.db2.gz	URLPDXFBTPKAGA-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000195151417	296572537	/nfs/dbraw/zinc/57/25/37/296572537.db2.gz	SSHYTQDVMKEYGB-RDDDGLTNSA-N	0	2	293.279	0.555	20	5		CCBDLN
CNC(=O)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000323267439	260756822	/nfs/dbraw/zinc/75/68/22/260756822.db2.gz	ZGHRDBXRUYRFFJ-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
C[C@H]1OCC[C@@]1(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000279425926	300614015	/nfs/dbraw/zinc/61/40/15/300614015.db2.gz	IRJODUNMZXOUAZ-AMIZOPFISA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C([O-])C[C@@H]1CSCC[N@@H+]1Cn1cc([N+](=O)[O-])cn1	ZINC000739657188	581587710	/nfs/dbraw/zinc/58/77/10/581587710.db2.gz	DNEUVWCGRNVUJS-MRVPVSSYSA-N	0	2	286.313	0.641	20	5		CCBDLN
O=C([O-])C[C@@H]1CSCC[N@H+]1Cn1cc([N+](=O)[O-])cn1	ZINC000739657188	581587713	/nfs/dbraw/zinc/58/77/13/581587713.db2.gz	DNEUVWCGRNVUJS-MRVPVSSYSA-N	0	2	286.313	0.641	20	5		CCBDLN
C[N@H+](CCCNC(=O)[O-])Cn1cc([N+](=O)[O-])cn1	ZINC000739678885	581591659	/nfs/dbraw/zinc/59/16/59/581591659.db2.gz	KYVQOAUGHFDZQG-UHFFFAOYSA-N	0	2	257.250	0.338	20	5		CCBDLN
C[N@@H+](CCCNC(=O)[O-])Cn1cc([N+](=O)[O-])cn1	ZINC000739678885	581591662	/nfs/dbraw/zinc/59/16/62/581591662.db2.gz	KYVQOAUGHFDZQG-UHFFFAOYSA-N	0	2	257.250	0.338	20	5		CCBDLN
O=C(N[C@@H](CO)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000773589889	581935355	/nfs/dbraw/zinc/93/53/55/581935355.db2.gz	RMNDEMMUJPBCKT-JTQLQIEISA-N	0	2	266.253	0.801	20	5		CCBDLN
CC[C@H](C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750757730	582058355	/nfs/dbraw/zinc/05/83/55/582058355.db2.gz	SDYJZAONOORTNC-ZETCQYMHSA-N	0	2	287.297	0.841	20	5		CCBDLN
O=C(NS(=O)(=O)c1ccc([N+](=O)[O-])nc1)C1CCCC1	ZINC000750762298	582058547	/nfs/dbraw/zinc/05/85/47/582058547.db2.gz	WEEIDKLFMCCVRL-UHFFFAOYSA-N	0	2	299.308	0.985	20	5		CCBDLN
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CC(=O)[O-]	ZINC000130173490	605803239	/nfs/dbraw/zinc/80/32/39/605803239.db2.gz	WOSYKGXCFIASER-MRVPVSSYSA-N	0	2	281.268	0.938	20	5		CCBDLN
C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(=O)[O-]	ZINC000130173490	605803244	/nfs/dbraw/zinc/80/32/44/605803244.db2.gz	WOSYKGXCFIASER-MRVPVSSYSA-N	0	2	281.268	0.938	20	5		CCBDLN
O=C([O-])N1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cn1cc([N+](=O)[O-])cn1	ZINC000834096022	605945520	/nfs/dbraw/zinc/94/55/20/605945520.db2.gz	RJOCTFPCIFEVKD-ZJUUUORDSA-N	0	2	295.299	0.966	20	5		CCBDLN
O=C([O-])N1CC[C@H]2CC[C@@H](C1)[N@H+]2Cn1cc([N+](=O)[O-])cn1	ZINC000834096022	605945525	/nfs/dbraw/zinc/94/55/25/605945525.db2.gz	RJOCTFPCIFEVKD-ZJUUUORDSA-N	0	2	295.299	0.966	20	5		CCBDLN
CC(C)Oc1cncc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000847146210	614058709	/nfs/dbraw/zinc/05/87/09/614058709.db2.gz	ZINPNCLPAVAZPE-HTQZYQBOSA-N	0	2	266.257	0.868	20	5		CCBDLN
COCc1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000839762237	616913557	/nfs/dbraw/zinc/91/35/57/616913557.db2.gz	BIODFHPSARBFGK-RNFRBKRXSA-N	0	2	257.271	0.893	20	5		CCBDLN
COC(=O)c1c[nH]c(O[C@@H](C[N+](=O)[O-])c2cccnc2)n1	ZINC001230281858	805591698	/nfs/dbraw/zinc/59/16/98/805591698.db2.gz	JLSDIEZUPPFJEA-JTQLQIEISA-N	0	2	292.251	0.988	20	5		CCBDLN
CCOC(=O)c1coc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC001129578067	837530618	/nfs/dbraw/zinc/53/06/18/837530618.db2.gz	LBTNKAVYWFPWML-HTRCEHHLSA-N	0	2	283.240	0.479	20	5		CCBDLN
COc1cc([N+](=O)[O-])cnc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001288216561	906018025	/nfs/dbraw/zinc/01/80/25/906018025.db2.gz	YIFYDOXHFOWPPA-RNFRBKRXSA-N	0	2	282.212	0.602	20	5		CCBDLN
O=C([O-])c1ccc([N+](=O)[O-])c(NCCn2cc[nH+]c2)n1	ZINC000166708604	959318640	/nfs/dbraw/zinc/31/86/40/959318640.db2.gz	UEVSRZADQHXYRW-UHFFFAOYSA-N	0	2	277.240	0.997	20	5		CCBDLN
O=C(NC[C@H](O)[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000600240784	361901070	/nfs/dbraw/zinc/90/10/70/361901070.db2.gz	HLVMBCZKDSSMGC-NWDGAFQWSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000600242290	361902052	/nfs/dbraw/zinc/90/20/52/361902052.db2.gz	OOBVPDGFDQPXMU-RYUDHWBXSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN1CCOC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600418643	361955246	/nfs/dbraw/zinc/95/52/46/361955246.db2.gz	DPEBMSVMOSAXCS-SNVBAGLBSA-N	0	2	295.295	0.361	20	5		CCBDLN
COC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273240342	192084211	/nfs/dbraw/zinc/08/42/11/192084211.db2.gz	QCNKGOVXAJHCCJ-MRVPVSSYSA-N	0	2	270.241	0.038	20	5		CCBDLN
COCCOCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273253142	192088496	/nfs/dbraw/zinc/08/84/96/192088496.db2.gz	RYIWLJFVWAOJQU-UHFFFAOYSA-N	0	2	284.268	0.693	20	5		CCBDLN
Cc1cccc(C(=O)NN2CC(=O)N(C)C2=O)c1[N+](=O)[O-]	ZINC000271269949	191039381	/nfs/dbraw/zinc/03/93/81/191039381.db2.gz	IIJUZLMIDUZMNO-UHFFFAOYSA-N	0	2	292.251	0.442	20	5		CCBDLN
C[C@@H](CO)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182117550	351347416	/nfs/dbraw/zinc/34/74/16/351347416.db2.gz	QZLCXQFHLUWIQR-SSDOTTSWSA-N	0	2	254.242	0.659	20	5		CCBDLN
CNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000186111583	351477330	/nfs/dbraw/zinc/47/73/30/351477330.db2.gz	ONNISCDAQVZBIO-UHFFFAOYSA-N	0	2	279.252	0.118	20	5		CCBDLN
CCN(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000187245050	351534798	/nfs/dbraw/zinc/53/47/98/351534798.db2.gz	PVSKFCSQKQBRQX-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
NC(=O)N1CCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000271546250	191205679	/nfs/dbraw/zinc/20/56/79/191205679.db2.gz	OQNTZWBLNXJION-VIFPVBQESA-N	0	2	294.267	0.782	20	5		CCBDLN
COC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270135616	352905993	/nfs/dbraw/zinc/90/59/93/352905993.db2.gz	UDGGWODEEVJNIH-MRVPVSSYSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=[N+]([O-])c1cccc(F)c1S(=O)(=O)NCCF	ZINC000280486468	353365076	/nfs/dbraw/zinc/36/50/76/353365076.db2.gz	ARTPLGIENXXFIE-UHFFFAOYSA-N	0	2	266.225	0.982	20	5		CCBDLN
O=C(NCCn1cc([N+](=O)[O-])cn1)[C@@H](F)C(F)(F)F	ZINC000291329214	353779778	/nfs/dbraw/zinc/77/97/78/353779778.db2.gz	QFCHPVBYRJKGJQ-ZCFIWIBFSA-N	0	2	284.169	0.808	20	5		CCBDLN
O=C(NCCn1cc([N+](=O)[O-])cn1)C(F)C(F)(F)F	ZINC000291329214	353779781	/nfs/dbraw/zinc/77/97/81/353779781.db2.gz	QFCHPVBYRJKGJQ-ZCFIWIBFSA-N	0	2	284.169	0.808	20	5		CCBDLN
CCCN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000336833034	355205830	/nfs/dbraw/zinc/20/58/30/355205830.db2.gz	NBPPPUMQVIVMNQ-UHFFFAOYSA-N	0	2	281.268	0.638	20	5		CCBDLN
COCC(COC)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000456229757	236374173	/nfs/dbraw/zinc/37/41/73/236374173.db2.gz	MTCDFXVEBHSDAW-UHFFFAOYSA-N	0	2	284.268	0.692	20	5		CCBDLN
O=C(N[C@@H](CO)CCF)c1ccc([N+](=O)[O-])cc1O	ZINC000593858470	360178924	/nfs/dbraw/zinc/17/89/24/360178924.db2.gz	AGKHOTLTSNZHLK-SSDOTTSWSA-N	0	2	272.232	0.751	20	5		CCBDLN
O=C(N[C@@H](CO)CCF)c1ccc([N+](=O)[O-])c(O)c1	ZINC000593861935	360179340	/nfs/dbraw/zinc/17/93/40/360179340.db2.gz	JQIWYLNXURRSCD-MRVPVSSYSA-N	0	2	272.232	0.751	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H]2C[C@H]1C[S@@]2=O	ZINC000593875648	360188161	/nfs/dbraw/zinc/18/81/61/360188161.db2.gz	XJOYIZLELWAZSY-FRUKKLPWSA-N	0	2	296.304	0.646	20	5		CCBDLN
O=C(NCc1c[nH]nn1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000611558132	363738085	/nfs/dbraw/zinc/73/80/85/363738085.db2.gz	RGUOTTFIROMFTM-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
O=c1[nH]nc(CCCNc2cc[nH]c(=O)c2[N+](=O)[O-])[nH]1	ZINC000596144625	360810695	/nfs/dbraw/zinc/81/06/95/360810695.db2.gz	GRHFRDQHNPTWEF-UHFFFAOYSA-N	0	2	280.244	0.564	20	5		CCBDLN
C[C@H](CO)N(C[C@H](C)O)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000276080440	193207653	/nfs/dbraw/zinc/20/76/53/193207653.db2.gz	WVLOUTWGKCHMNV-BDAKNGLRSA-N	0	2	298.295	0.504	20	5		CCBDLN
Nc1ccnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000159448849	389366236	/nfs/dbraw/zinc/36/62/36/389366236.db2.gz	AQSVQOKMBCZTEM-UHFFFAOYSA-N	0	2	289.251	0.603	20	5		CCBDLN
Cn1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)cn1	ZINC000179449764	389656277	/nfs/dbraw/zinc/65/62/77/389656277.db2.gz	HGXTWNIPBBRGJP-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)OC	ZINC000351857954	389701162	/nfs/dbraw/zinc/70/11/62/389701162.db2.gz	ZDANGTHHRCKNDQ-MRVPVSSYSA-N	0	2	298.251	0.218	20	5		CCBDLN
Cc1nn(C)c(NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000392628794	389774749	/nfs/dbraw/zinc/77/47/49/389774749.db2.gz	GNDRNRSEQGGFSN-UHFFFAOYSA-N	0	2	253.222	0.073	20	5		CCBDLN
O=c1[nH]c(=O)c([N+](=O)[O-])c(C=Cc2csnn2)[nH]1	ZINC000352021702	389737070	/nfs/dbraw/zinc/73/70/70/389737070.db2.gz	RCBMDKLDPFIQSG-OWOJBTEDSA-N	0	2	267.226	0.818	20	5		CCBDLN
Cn1nncc1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000436488515	389977662	/nfs/dbraw/zinc/97/76/62/389977662.db2.gz	RSUFQOIGGRDPAQ-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000436972713	389988759	/nfs/dbraw/zinc/98/87/59/389988759.db2.gz	PKLSOBZKEBRTPP-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC[S@]1=O	ZINC000436988566	389989537	/nfs/dbraw/zinc/98/95/37/389989537.db2.gz	KQBDDQNYQZIHCU-FFVOIRBGSA-N	0	2	298.320	0.893	20	5		CCBDLN
C[C@@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000437004811	389990152	/nfs/dbraw/zinc/99/01/52/389990152.db2.gz	XGEKLUSBMDDZBN-LURJTMIESA-N	0	2	267.241	0.294	20	5		CCBDLN
COC(=O)C1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000487187598	390084919	/nfs/dbraw/zinc/08/49/19/390084919.db2.gz	MZGVCAQQWKMCGK-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
C[C@@H](NS(=O)(=O)c1cccnc1[N+](=O)[O-])c1nnc[nH]1	ZINC000537561346	390178340	/nfs/dbraw/zinc/17/83/40/390178340.db2.gz	LPIQGHVCTLGLEZ-ZCFIWIBFSA-N	0	2	298.284	0.147	20	5		CCBDLN
COC(=O)[C@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000281820919	195396054	/nfs/dbraw/zinc/39/60/54/195396054.db2.gz	OFOBWRSNSWQJFZ-ZETCQYMHSA-N	0	2	282.252	0.934	20	5		CCBDLN
Cc1nc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])no1	ZINC000525185371	390660531	/nfs/dbraw/zinc/66/05/31/390660531.db2.gz	ORJVKOKLCIRAER-UHFFFAOYSA-N	0	2	299.268	0.160	20	5		CCBDLN
O=C([O-])[C@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000567117116	390673079	/nfs/dbraw/zinc/67/30/79/390673079.db2.gz	XRLDJJGAPMFJDZ-GFCCVEGCSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=C([O-])[C@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000567117116	390673081	/nfs/dbraw/zinc/67/30/81/390673081.db2.gz	XRLDJJGAPMFJDZ-GFCCVEGCSA-N	0	2	296.279	0.759	20	5		CCBDLN
Cc1nc(=NC(=O)NCc2cccc([N+](=O)[O-])c2)[nH]n1C	ZINC000578115885	390864743	/nfs/dbraw/zinc/86/47/43/390864743.db2.gz	LPOLISHCNXPXOT-UHFFFAOYSA-N	0	2	290.283	0.775	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H]1O	ZINC000436890136	397534607	/nfs/dbraw/zinc/53/46/07/397534607.db2.gz	DSMDSTQBSKNSNN-CPCISQLKSA-N	0	2	266.253	0.753	20	5		CCBDLN
CC1(O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000277748813	281598751	/nfs/dbraw/zinc/59/87/51/281598751.db2.gz	NFJLYYYCENHVMI-UHFFFAOYSA-N	0	2	252.226	0.507	20	5		CCBDLN
NC(=O)N[C@@H]1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000354418917	303280531	/nfs/dbraw/zinc/28/05/31/303280531.db2.gz	XIOLOGMJZQFSJR-SSDOTTSWSA-N	0	2	294.267	0.183	20	5		CCBDLN
NC(=O)[C@@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181875055	303293960	/nfs/dbraw/zinc/29/39/60/303293960.db2.gz	JDCCLRJQAIRQPO-JTQLQIEISA-N	0	2	293.279	0.780	20	5		CCBDLN
O=C(N[C@@H]1CC[C@H]1O)c1ccc([N+](=O)[O-])cc1O	ZINC000425050034	534771411	/nfs/dbraw/zinc/77/14/11/534771411.db2.gz	NFAVLWDUECKFFX-RKDXNWHRSA-N	0	2	252.226	0.554	20	5		CCBDLN
O=C(N[C@H](CO)C1CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000779679089	581199128	/nfs/dbraw/zinc/19/91/28/581199128.db2.gz	PMGCHEXPIDDHIF-SNVBAGLBSA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(NCC1OCCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000787957614	581483244	/nfs/dbraw/zinc/48/32/44/581483244.db2.gz	LYPANDCCHAZTTL-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
O=C(COc1ccccc1[N+](=O)[O-])OCc1n[nH]c(=O)[nH]1	ZINC000774884728	582000762	/nfs/dbraw/zinc/00/07/62/582000762.db2.gz	CVRGOEKBNVPVLD-UHFFFAOYSA-N	0	2	294.223	0.541	20	5		CCBDLN
Cc1cc(C(=O)OCc2n[nH]c(=O)[nH]2)c(N)c([N+](=O)[O-])c1	ZINC000774944770	582004461	/nfs/dbraw/zinc/00/44/61/582004461.db2.gz	RIDJSXZHFLILKB-UHFFFAOYSA-N	0	2	293.239	0.666	20	5		CCBDLN
CC(C)Oc1cnccc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000889954714	614053780	/nfs/dbraw/zinc/05/37/80/614053780.db2.gz	AOATUHAUBZHBGG-PSASIEDQSA-N	0	2	265.269	0.894	20	5		CCBDLN
CC(=O)c1csc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000107659844	614269244	/nfs/dbraw/zinc/26/92/44/614269244.db2.gz	UUBGDPKJXFNZLI-IYSWYEEDSA-N	0	2	255.255	0.949	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H](CO)c2ccccc21	ZINC000840462435	641581416	/nfs/dbraw/zinc/58/14/16/641581416.db2.gz	BCAFWULZJIZKHI-HLUHBDAQSA-N	0	2	262.265	0.774	20	5		CCBDLN
O=C(Nc1n[nH]c2[nH]c(=O)ccc12)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000854565592	644226959	/nfs/dbraw/zinc/22/69/59/644226959.db2.gz	ZDPBZXPFSHMGKR-PHDIDXHHSA-N	0	2	263.213	0.267	20	5		CCBDLN
COC(=O)[C@H](CCO)Oc1cc(O)cc(O)c1[N+](=O)[O-]	ZINC001218219120	803940649	/nfs/dbraw/zinc/94/06/49/803940649.db2.gz	NQERCSUYJWMKIZ-QMMMGPOBSA-N	0	2	287.224	0.309	20	5		CCBDLN
O=C(NC1C[NH+](CCC2CCOCC2)C1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001030293861	815962528	/nfs/dbraw/zinc/96/25/28/815962528.db2.gz	SSSHBRNKDOFGIY-CHWSQXEVSA-N	0	2	297.355	0.269	20	5		CCBDLN
O=C(NCC[NH+]1CC=CC1)c1cc([O-])cc([N+](=O)[O-])c1	ZINC001116511374	855779501	/nfs/dbraw/zinc/77/95/01/855779501.db2.gz	QJPWWXXVNIYSCP-UHFFFAOYSA-N	0	2	277.280	0.902	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1nn(C)cc1O	ZINC001304542758	908170821	/nfs/dbraw/zinc/17/08/21/908170821.db2.gz	BAIABRFFFGKJAS-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
CO[C@]1(C(=O)[O-])CC[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC001599079061	996951948	/nfs/dbraw/zinc/95/19/48/996951948.db2.gz	NNFDCBMZTNSKAP-GFCCVEGCSA-N	0	2	298.299	0.541	20	5		CCBDLN
CO[C@]1(C(=O)[O-])CC[N@@H+](Cn2nc(C)c([N+](=O)[O-])c2C)C1	ZINC001599079061	996951966	/nfs/dbraw/zinc/95/19/66/996951966.db2.gz	NNFDCBMZTNSKAP-GFCCVEGCSA-N	0	2	298.299	0.541	20	5		CCBDLN
CC(C)(C(=O)NOCC(N)=O)c1ccc([N+](=O)[O-])cc1F	ZINC000273829023	192323834	/nfs/dbraw/zinc/32/38/34/192323834.db2.gz	GZMBHPMLTDSRGO-UHFFFAOYSA-N	0	2	299.258	0.545	20	5		CCBDLN
C[N@@H+]1CCOC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000600422210	361956786	/nfs/dbraw/zinc/95/67/86/361956786.db2.gz	SZWDNWSWWXPYOR-SECBINFHSA-N	0	2	295.295	0.361	20	5		CCBDLN
C[N@H+]1CCOC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000600422210	361956789	/nfs/dbraw/zinc/95/67/89/361956789.db2.gz	SZWDNWSWWXPYOR-SECBINFHSA-N	0	2	295.295	0.361	20	5		CCBDLN
C[S@@](=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184769960	231836186	/nfs/dbraw/zinc/83/61/86/231836186.db2.gz	UUKDZNHGMUTFIW-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
CN(Cc1nnnn1C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000343765614	137155620	/nfs/dbraw/zinc/15/56/20/137155620.db2.gz	CUTGCXPRYHKYJG-UHFFFAOYSA-N	0	2	292.255	0.096	20	5		CCBDLN
CCC[C@@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000343397741	137132168	/nfs/dbraw/zinc/13/21/68/137132168.db2.gz	CCPKJHGJKDXXQO-MRVPVSSYSA-N	0	2	281.268	0.684	20	5		CCBDLN
C[S@](=O)CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000346639964	137296255	/nfs/dbraw/zinc/29/62/55/137296255.db2.gz	UNFMFMRNGTVEJG-IBGZPJMESA-N	0	2	286.313	0.269	20	5		CCBDLN
CC(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000181991215	351344541	/nfs/dbraw/zinc/34/45/41/351344541.db2.gz	FDZCQFFSTAPRKS-SNVBAGLBSA-N	0	2	281.268	0.540	20	5		CCBDLN
C[C@@H](O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186177344	351481691	/nfs/dbraw/zinc/48/16/91/351481691.db2.gz	XEALTQJZKYGKDF-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
COC[C@@H](CNC(=O)c1cc(O)ccc1[N+](=O)[O-])OC	ZINC000234753073	352168643	/nfs/dbraw/zinc/16/86/43/352168643.db2.gz	YFAJYJVDYFEHOV-SECBINFHSA-N	0	2	284.268	0.692	20	5		CCBDLN
CCCNC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233025040	352149078	/nfs/dbraw/zinc/14/90/78/352149078.db2.gz	FEBJNVHCQCMVMB-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
COCC[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267065391	352741827	/nfs/dbraw/zinc/74/18/27/352741827.db2.gz	CMVIFQSCEUZNSA-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
CN1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000156736379	188279146	/nfs/dbraw/zinc/27/91/46/188279146.db2.gz	PLCOOGILWFVJHE-UHFFFAOYSA-N	0	2	279.252	0.215	20	5		CCBDLN
COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1O)OC	ZINC000294207026	353878887	/nfs/dbraw/zinc/87/88/87/353878887.db2.gz	YBNCJOGAPDPVSU-JTQLQIEISA-N	0	2	298.251	0.218	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC[C@H]1CO	ZINC000330457660	354366734	/nfs/dbraw/zinc/36/67/34/354366734.db2.gz	OQZKOUQQCLZPFI-QMMMGPOBSA-N	0	2	266.253	0.897	20	5		CCBDLN
CCN1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000354782320	356497698	/nfs/dbraw/zinc/49/76/98/356497698.db2.gz	DTEJPMBLPOQEPL-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CC(CO)(CO)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000560799046	291112946	/nfs/dbraw/zinc/11/29/46/291112946.db2.gz	CWFDISCTIAXFHU-UHFFFAOYSA-N	0	2	284.268	0.021	20	5		CCBDLN
COC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274578048	192663460	/nfs/dbraw/zinc/66/34/60/192663460.db2.gz	AYKKMSJATAEQPD-UHFFFAOYSA-N	0	2	268.225	0.545	20	5		CCBDLN
O=C(NC1(c2nn[nH]n2)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000436999279	358236759	/nfs/dbraw/zinc/23/67/59/358236759.db2.gz	QSTCNJREOSEXIS-UHFFFAOYSA-N	0	2	290.239	0.233	20	5		CCBDLN
O=C(Nc1nnc2nc[nH]n21)c1cc(O)ccc1[N+](=O)[O-]	ZINC000590378033	359446626	/nfs/dbraw/zinc/44/66/26/359446626.db2.gz	XQCOOXXJYXVEPE-UHFFFAOYSA-N	0	2	289.211	0.319	20	5		CCBDLN
O=C(Nc1n[nH]c2ncnn12)c1cc(O)ccc1[N+](=O)[O-]	ZINC000590378033	359446632	/nfs/dbraw/zinc/44/66/32/359446632.db2.gz	XQCOOXXJYXVEPE-UHFFFAOYSA-N	0	2	289.211	0.319	20	5		CCBDLN
O=c1[nH]nc(CNc2ccc([N+](=O)[O-])cc2F)[nH]1	ZINC000301569910	201073722	/nfs/dbraw/zinc/07/37/22/201073722.db2.gz	NISUZHFJKDEEMQ-UHFFFAOYSA-N	0	2	253.193	0.757	20	5		CCBDLN
CC(C)NC(=O)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281260129	195171291	/nfs/dbraw/zinc/17/12/91/195171291.db2.gz	VFBAPXUHEJXRJV-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
CCN(CCOCCO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000295256415	388997625	/nfs/dbraw/zinc/99/76/25/388997625.db2.gz	KVRJLMWEDMIUBK-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
CCCNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000194740594	389103379	/nfs/dbraw/zinc/10/33/79/389103379.db2.gz	WAGJOHWYYFVQDK-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
Cn1nncc1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000352027422	389737956	/nfs/dbraw/zinc/73/79/56/389737956.db2.gz	OTKPFBKYJQGYJS-IHWYPQMZSA-N	0	2	264.201	0.095	20	5		CCBDLN
O=C(N[C@H](CO)[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000436806013	389984929	/nfs/dbraw/zinc/98/49/29/389984929.db2.gz	FGJMYVVWLQROIM-ZYHUDNBSSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H]1O	ZINC000436958495	389987766	/nfs/dbraw/zinc/98/77/66/389987766.db2.gz	HRQBKAQSLHVMFP-CPCISQLKSA-N	0	2	266.253	0.753	20	5		CCBDLN
C[C@]1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCC(=O)N1	ZINC000457202784	390034164	/nfs/dbraw/zinc/03/41/64/390034164.db2.gz	XOBQZLUATBKMLF-CYBMUJFWSA-N	0	2	293.279	0.699	20	5		CCBDLN
COC[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000530880936	285660438	/nfs/dbraw/zinc/66/04/38/285660438.db2.gz	KSCYAEDSTDPIAG-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(O)(C2CC2)C1	ZINC000368957329	304532053	/nfs/dbraw/zinc/53/20/53/304532053.db2.gz	BLRTVXIEUCNMMD-UHFFFAOYSA-N	0	2	278.264	0.897	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@H]1O	ZINC000436890150	300194603	/nfs/dbraw/zinc/19/46/03/300194603.db2.gz	DSMDSTQBSKNSNN-WRWORJQWSA-N	0	2	266.253	0.753	20	5		CCBDLN
C[C@H](CO)N(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182155680	524540105	/nfs/dbraw/zinc/54/01/05/524540105.db2.gz	OXGVGEOMFCJEOV-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
CCCc1[nH]nc(C(=O)OCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000796264874	581435511	/nfs/dbraw/zinc/43/55/11/581435511.db2.gz	DMECVWDZZPIINM-UHFFFAOYSA-N	0	2	296.243	0.451	20	5		CCBDLN
O=C(Cn1ccc(=O)c([N+](=O)[O-])c1)NOC1CCCC1	ZINC000775599306	582031142	/nfs/dbraw/zinc/03/11/42/582031142.db2.gz	WUDMPQYGAQUEBT-UHFFFAOYSA-N	0	2	281.268	0.747	20	5		CCBDLN
O=C(Nn1ccccc1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000776188861	582056904	/nfs/dbraw/zinc/05/69/04/582056904.db2.gz	PUWFOZFQRKFOBD-UHFFFAOYSA-N	0	2	275.220	0.846	20	5		CCBDLN
CC(C)(C(=O)NOCC(N)=O)c1ccccc1[N+](=O)[O-]	ZINC000815937451	614299770	/nfs/dbraw/zinc/29/97/70/614299770.db2.gz	XBVUWEGPDDKJNB-UHFFFAOYSA-N	0	2	281.268	0.406	20	5		CCBDLN
O=C(Nc1ccn(Cc2ccncc2)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839615100	640346335	/nfs/dbraw/zinc/34/63/35/640346335.db2.gz	STARMNHRUMYFJF-GHMZBOCLSA-N	0	2	287.279	0.930	20	5		CCBDLN
C[C@@H]1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C(=O)O1	ZINC000816621766	641178996	/nfs/dbraw/zinc/17/89/96/641178996.db2.gz	ORRAPRQDLKMVAX-HZGVNTEJSA-N	0	2	280.236	0.734	20	5		CCBDLN
C[C@H](C[NH+]1CCOCC1)Oc1nc(=O)[n-]cc1[N+](=O)[O-]	ZINC001226333104	805220491	/nfs/dbraw/zinc/22/04/91/805220491.db2.gz	XTJMKTGWQMNKDF-MRVPVSSYSA-N	0	2	284.272	0.190	20	5		CCBDLN
O=C1OC[C@H](COc2cc(O)cc(O)c2[N+](=O)[O-])O1	ZINC001228970825	805493866	/nfs/dbraw/zinc/49/38/66/805493866.db2.gz	KVXCOFOKTZOFBX-LURJTMIESA-N	0	2	271.181	0.920	20	5		CCBDLN
Cn1cc(C[N@@H+]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])n1	ZINC001594542788	955665150	/nfs/dbraw/zinc/66/51/50/955665150.db2.gz	IIKRVSRENSCQLJ-QMMMGPOBSA-N	0	2	254.246	0.377	20	5		CCBDLN
Cn1cc(C[N@H+]2CCC[C@H]2C(=O)[O-])c([N+](=O)[O-])n1	ZINC001594542788	955665156	/nfs/dbraw/zinc/66/51/56/955665156.db2.gz	IIKRVSRENSCQLJ-QMMMGPOBSA-N	0	2	254.246	0.377	20	5		CCBDLN
O=C(N[C@H]1CCCNC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436969494	303957944	/nfs/dbraw/zinc/95/79/44/303957944.db2.gz	ZBZPDFIHAJNRTH-VIFPVBQESA-N	0	2	279.252	0.309	20	5		CCBDLN
CO[C@@H](C)c1nsc(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000337882001	214298478	/nfs/dbraw/zinc/29/84/78/214298478.db2.gz	VHRQYNVBPQHROC-ZETCQYMHSA-N	0	2	298.328	0.884	20	5		CCBDLN
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1n[nH]c(=O)[nH]1	ZINC000358350853	232085282	/nfs/dbraw/zinc/08/52/82/232085282.db2.gz	FNGVQYOQNDCBBA-UHFFFAOYSA-N	0	2	293.239	0.114	20	5		CCBDLN
Cc1nc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])no1	ZINC000227881208	136956750	/nfs/dbraw/zinc/95/67/50/136956750.db2.gz	LGSYHNSXOXKOPV-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000347086650	137319297	/nfs/dbraw/zinc/31/92/97/137319297.db2.gz	DNKBDQHGDMHBIJ-SKDRFNHKSA-N	0	2	296.279	0.428	20	5		CCBDLN
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000122168340	187018596	/nfs/dbraw/zinc/01/85/96/187018596.db2.gz	JFNGMMCGZGDDTD-IIYDVTGLSA-N	0	2	286.309	0.797	20	5		CCBDLN
CCOC(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233678510	352151408	/nfs/dbraw/zinc/15/14/08/352151408.db2.gz	JFRYCNYKTCUYRU-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
COC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000234530817	352159768	/nfs/dbraw/zinc/15/97/68/352159768.db2.gz	OFUDBEGATWNXRS-ZCFIWIBFSA-N	0	2	268.225	0.592	20	5		CCBDLN
CCN(CC(=O)OC)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233461617	352149821	/nfs/dbraw/zinc/14/98/21/352149821.db2.gz	WUGAFCYTHWHTTO-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
O=C([O-])CNC(=O)c1ccc(-n2cc[nH+]c2)c([N+](=O)[O-])c1	ZINC000237929704	352289676	/nfs/dbraw/zinc/28/96/76/352289676.db2.gz	VMISNOFOAUCMQP-UHFFFAOYSA-N	0	2	290.235	0.595	20	5		CCBDLN
COCC(=O)N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000271545110	191203780	/nfs/dbraw/zinc/20/37/80/191203780.db2.gz	OMVSNBOCBNMOOM-UHFFFAOYSA-N	0	2	297.267	0.344	20	5		CCBDLN
CC(C)(CNC(=O)c1ccc([N+](=O)[O-])cc1O)OCCO	ZINC000292184432	198193189	/nfs/dbraw/zinc/19/31/89/198193189.db2.gz	XCHSDCRJIAAWLG-UHFFFAOYSA-N	0	2	298.295	0.818	20	5		CCBDLN
CCNC(=O)CN(CC)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280804310	353384601	/nfs/dbraw/zinc/38/46/01/353384601.db2.gz	PTRBPCVYZNAMFF-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
COC[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272339783	191664350	/nfs/dbraw/zinc/66/43/50/191664350.db2.gz	ADQMPATZOIYCHV-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cn1c[nH+]cc1CNC(=O)c1cccc([O-])c1[N+](=O)[O-]	ZINC000426487674	235337977	/nfs/dbraw/zinc/33/79/77/235337977.db2.gz	RMZMRAQAKMOPKQ-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CC[C@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355748774	356638663	/nfs/dbraw/zinc/63/86/63/356638663.db2.gz	PLWPENYJTYRCJI-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
NC(=O)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000588803356	359339227	/nfs/dbraw/zinc/33/92/27/359339227.db2.gz	JHIKUZJGTPOEOO-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
Nc1ccc(N2CC[C@@H](O)C(F)(F)C2)nc1[N+](=O)[O-]	ZINC000596428741	360891938	/nfs/dbraw/zinc/89/19/38/360891938.db2.gz	CLIHPJGFFIYOOS-SSDOTTSWSA-N	0	2	274.227	0.778	20	5		CCBDLN
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)C1(n2cnnn2)CC1	ZINC000597490981	361112980	/nfs/dbraw/zinc/11/29/80/361112980.db2.gz	BQRSXRRGGOMANX-UHFFFAOYSA-N	0	2	290.239	0.415	20	5		CCBDLN
C[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])c1ncnn1C	ZINC000597569172	361141853	/nfs/dbraw/zinc/14/18/53/361141853.db2.gz	ZHEMWYKISKJCPD-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
CN(C[C@H]1COCCO1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000598177430	361348783	/nfs/dbraw/zinc/34/87/83/361348783.db2.gz	RMBNNRRICKAJPQ-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC(CO)C1	ZINC000331891519	204267711	/nfs/dbraw/zinc/26/77/11/204267711.db2.gz	DFSSHLFPJJJFDS-UHFFFAOYSA-N	0	2	252.226	0.365	20	5		CCBDLN
Cc1nn(CCC(=O)N=c2cccn[nH]2)c(C)c1[N+](=O)[O-]	ZINC000346038128	285190823	/nfs/dbraw/zinc/19/08/23/285190823.db2.gz	MIWVGPCHTGMBGH-UHFFFAOYSA-N	0	2	290.283	0.649	20	5		CCBDLN
Cn1ncc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c1N	ZINC000183616486	388759918	/nfs/dbraw/zinc/75/99/18/388759918.db2.gz	GQFHYLVKOVGMMR-UHFFFAOYSA-N	0	2	277.240	0.868	20	5		CCBDLN
CC(C)N(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000119519742	389140241	/nfs/dbraw/zinc/14/02/41/389140241.db2.gz	LSXMWQUOGINTKS-UHFFFAOYSA-N	0	2	281.268	0.636	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1COC[C@@H]1O	ZINC000342367494	389216850	/nfs/dbraw/zinc/21/68/50/389216850.db2.gz	DLPAZRKRDXCKQE-ONGXEEELSA-N	0	2	282.252	0.132	20	5		CCBDLN
COC(=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000350017527	389478285	/nfs/dbraw/zinc/47/82/85/389478285.db2.gz	QDYJDRKTKZZAQI-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
CC(C)CN(CC(N)=O)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281272239	389613105	/nfs/dbraw/zinc/61/31/05/389613105.db2.gz	WFVPCRMVSHUVCS-UHFFFAOYSA-N	0	2	295.295	0.884	20	5		CCBDLN
COC[C@H]1C(=O)N[C@@H](c2ccc([N+](=O)[O-])c(O)c2)N1C	ZINC000414199803	389605118	/nfs/dbraw/zinc/60/51/18/389605118.db2.gz	RKXLSVCGYHTWSX-GXSJLCMTSA-N	0	2	281.268	0.376	20	5		CCBDLN
O=C(NC[C@]1(O)CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000351874500	389705185	/nfs/dbraw/zinc/70/51/85/389705185.db2.gz	JULDDAKEZBZXQX-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
Cn1c[nH+]cc1CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436926247	389986992	/nfs/dbraw/zinc/98/69/92/389986992.db2.gz	IYYMBHHWQSSWED-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CCOC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000437004249	389990545	/nfs/dbraw/zinc/99/05/45/389990545.db2.gz	VAWGTCFSOAQFJB-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H]1COC[C@@H]1O	ZINC000342408630	288919191	/nfs/dbraw/zinc/91/91/91/288919191.db2.gz	HIBGLMZSVUVWLI-MNOVXSKESA-N	0	2	282.252	0.132	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CCN(C)C1=O	ZINC000272373733	288919558	/nfs/dbraw/zinc/91/95/58/288919558.db2.gz	HQLDZWDBNQSQSB-SNVBAGLBSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCOCC1	ZINC000184580299	304533905	/nfs/dbraw/zinc/53/39/05/304533905.db2.gz	VSFMFIXAPHRLER-UHFFFAOYSA-N	0	2	252.226	0.773	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC(=O)N1C	ZINC000282373244	300194121	/nfs/dbraw/zinc/19/41/21/300194121.db2.gz	NEZJXPDOUXNWJF-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
CCC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000425041526	528325811	/nfs/dbraw/zinc/32/58/11/528325811.db2.gz	YYJVFAFKVRETHM-UHFFFAOYSA-N	0	2	293.279	0.952	20	5		CCBDLN
O=C(NN1CN=NC1=O)c1csc([N+](=O)[O-])c1	ZINC000782127340	581289098	/nfs/dbraw/zinc/28/90/98/581289098.db2.gz	OZSCLQULBNYDMQ-UHFFFAOYSA-N	0	2	255.215	0.337	20	5		CCBDLN
O=c1[nH]nc(CNc2nc3ccccn3c2[N+](=O)[O-])[nH]1	ZINC000754250632	581582932	/nfs/dbraw/zinc/58/29/32/581582932.db2.gz	LALSWUCADJCHNV-UHFFFAOYSA-N	0	2	275.228	0.678	20	5		CCBDLN
O=C([O-])NC[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000740646985	581706359	/nfs/dbraw/zinc/70/63/59/581706359.db2.gz	VIXHBKQEPBPDEN-QMMMGPOBSA-N	0	2	269.261	0.338	20	5		CCBDLN
O=C([O-])NC[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000740646985	581706362	/nfs/dbraw/zinc/70/63/62/581706362.db2.gz	VIXHBKQEPBPDEN-QMMMGPOBSA-N	0	2	269.261	0.338	20	5		CCBDLN
CCOC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772356303	581854847	/nfs/dbraw/zinc/85/48/47/581854847.db2.gz	KVUFHGMHLFPXRY-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])c(F)c1	ZINC000774942394	582004322	/nfs/dbraw/zinc/00/43/22/582004322.db2.gz	BWRHWLCVUNDYMI-UHFFFAOYSA-N	0	2	282.187	0.915	20	5		CCBDLN
CC(=O)Nc1ccncc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840415641	613684833	/nfs/dbraw/zinc/68/48/33/613684833.db2.gz	IVRYFALYSOWCMT-GMSGAONNSA-N	0	2	264.241	0.066	20	5		CCBDLN
O=C(NCC1OCCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000816313584	641159047	/nfs/dbraw/zinc/15/90/47/641159047.db2.gz	UBALSSZQTNASSN-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
O=C(Nc1nc(CCO)cs1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000854583961	644229553	/nfs/dbraw/zinc/22/95/53/644229553.db2.gz	QVZJAMCASUUSMY-RNFRBKRXSA-N	0	2	257.271	0.282	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CCOC(=O)N1	ZINC000860439703	644802066	/nfs/dbraw/zinc/80/20/66/644802066.db2.gz	GAHHGPIJPXLOSC-SSDOTTSWSA-N	0	2	281.224	0.737	20	5		CCBDLN
COc1nc(O[C@@H](C[N+](=O)[O-])C2CC2)cc(=O)[nH]1	ZINC001227001013	805308247	/nfs/dbraw/zinc/30/82/47/805308247.db2.gz	WPDRIBIOJNHNKH-ZETCQYMHSA-N	0	2	255.230	0.625	20	5		CCBDLN
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NC(=O)Cn1ccc(Nc2ncccc2[N+](=O)[O-])n1	ZINC000068426619	348809843	/nfs/dbraw/zinc/80/98/43/348809843.db2.gz	QYGQCCMTAAWKPY-UHFFFAOYSA-N	0	2	262.229	0.415	20	5		CCBDLN
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CN(C)C(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000124976164	350112140	/nfs/dbraw/zinc/11/21/40/350112140.db2.gz	WFTKJPUWBXJQHM-UHFFFAOYSA-N	0	2	281.268	0.461	20	5		CCBDLN
C[C@@H](C[S@@](C)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000181676226	351332229	/nfs/dbraw/zinc/33/22/29/351332229.db2.gz	PHXIOHPYVPDKAB-ZDVLTJLQSA-N	0	2	286.309	0.797	20	5		CCBDLN
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CNC(=O)[C@@H](C)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316964	351946697	/nfs/dbraw/zinc/94/66/97/351946697.db2.gz	ZREWFJYSLXGJNP-QMMMGPOBSA-N	0	2	295.295	0.755	20	5		CCBDLN
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CC(C)(CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000185619661	388810420	/nfs/dbraw/zinc/81/04/20/388810420.db2.gz	DHOBBJAYOFIKOL-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
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CCOC(=O)[C@H](N)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000233712672	352152060	/nfs/dbraw/zinc/15/20/60/352152060.db2.gz	RAHIDYDWVRTAGM-SECBINFHSA-N	0	2	283.240	0.129	20	5		CCBDLN
O=C(N[C@H]1CCC(=O)NC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236562372	352197951	/nfs/dbraw/zinc/19/79/51/352197951.db2.gz	ZLBYXUKSROTOAP-ZETCQYMHSA-N	0	2	279.252	0.309	20	5		CCBDLN
C[C@H](O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000235533356	352185179	/nfs/dbraw/zinc/18/51/79/352185179.db2.gz	KUXDMEIDKIJTSL-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
COCCS(=O)(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000265593063	352648375	/nfs/dbraw/zinc/64/83/75/352648375.db2.gz	BHRQJZWAANVCRA-UHFFFAOYSA-N	0	2	290.297	0.992	20	5		CCBDLN
CCNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274639707	353148310	/nfs/dbraw/zinc/14/83/10/353148310.db2.gz	YXWPIGSZDZWOAT-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H]1OC	ZINC000277168088	353228197	/nfs/dbraw/zinc/22/81/97/353228197.db2.gz	XRNOTYQAOSTVDQ-TXEJJXNPSA-N	0	2	296.279	0.786	20	5		CCBDLN
O=C(N[C@]1(CCO)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000278237854	353289074	/nfs/dbraw/zinc/28/90/74/353289074.db2.gz	ZAMURBAWENRHDG-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
CO[C@H]1COC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000292537442	198325078	/nfs/dbraw/zinc/32/50/78/198325078.db2.gz	MFFCGNKTVVDXSB-ONGXEEELSA-N	0	2	282.252	0.444	20	5		CCBDLN
CN(CC(=O)NC1CC1)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000282839640	353456196	/nfs/dbraw/zinc/45/61/96/353456196.db2.gz	BAUGRLFCCRLJHS-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)[C@](C)(NC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000287962310	353678576	/nfs/dbraw/zinc/67/85/76/353678576.db2.gz	QZSUFFHMJQPBOZ-ZDUSSCGKSA-N	0	2	295.295	0.930	20	5		CCBDLN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NOCC1CC1	ZINC000293863440	353846027	/nfs/dbraw/zinc/84/60/27/353846027.db2.gz	WFFURPUKMQPPOP-UHFFFAOYSA-N	0	2	267.241	0.214	20	5		CCBDLN
C[C@@H](CO)N(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000295505460	353898988	/nfs/dbraw/zinc/89/89/88/353898988.db2.gz	BZDGFGLEBIKLJT-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
CC(C)C(=O)NCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000348649147	355960787	/nfs/dbraw/zinc/96/07/87/355960787.db2.gz	AAEYXUKYZZYBMS-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)Nc1cccc([N+](=O)[O-])c1	ZINC000353761668	356288799	/nfs/dbraw/zinc/28/87/99/356288799.db2.gz	UHZPEBAAMFMJOK-UHFFFAOYSA-N	0	2	278.228	0.740	20	5		CCBDLN
NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000436862906	235709896	/nfs/dbraw/zinc/70/98/96/235709896.db2.gz	RCDBHGHONKDIRR-UHFFFAOYSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(NCc1c[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC000590379684	359447068	/nfs/dbraw/zinc/44/70/68/359447068.db2.gz	WOOOQUBDYJOIIP-UHFFFAOYSA-N	0	2	278.224	0.659	20	5		CCBDLN
CO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000563197869	291204439	/nfs/dbraw/zinc/20/44/39/291204439.db2.gz	UWRHYQMGSQGDQU-MWLCHTKSSA-N	0	2	282.252	0.444	20	5		CCBDLN
NC(=O)[C@H]1C[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000593811237	360162972	/nfs/dbraw/zinc/16/29/72/360162972.db2.gz	AAVQLWUBYIGUNI-KNVOCYPGSA-N	0	2	279.252	0.294	20	5		CCBDLN
CCNC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000611534618	363734979	/nfs/dbraw/zinc/73/49/79/363734979.db2.gz	BOPCIASJJPUDSN-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC12COC2	ZINC000597731329	361215234	/nfs/dbraw/zinc/21/52/34/361215234.db2.gz	VWXIDBKUEFZWTF-UHFFFAOYSA-N	0	2	264.237	0.915	20	5		CCBDLN
COC(=O)[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000598520211	361436892	/nfs/dbraw/zinc/43/68/92/361436892.db2.gz	GLDKTGTZMKPLLM-KYZUINATSA-N	0	2	294.263	0.982	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(CO)C1	ZINC000331909252	204282723	/nfs/dbraw/zinc/28/27/23/204282723.db2.gz	ASJDCUUHGPHTOD-UHFFFAOYSA-N	0	2	252.226	0.365	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1ccc([N+](=O)[O-])cc1[O-]	ZINC000129924241	284777830	/nfs/dbraw/zinc/77/78/30/284777830.db2.gz	QJPWWKMIKXFJDP-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
CN(C)C(=O)NCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281103546	195105264	/nfs/dbraw/zinc/10/52/64/195105264.db2.gz	WCJFCBJHDNVNNA-UHFFFAOYSA-N	0	2	296.283	0.301	20	5		CCBDLN
O=C(NCCn1cccn1)c1ccc([N+](=O)[O-])cc1O	ZINC000159314286	389364326	/nfs/dbraw/zinc/36/43/26/389364326.db2.gz	ITSAFHQRSHGCOF-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
Cc1n[nH]c(C(=O)N(C)C[C@H](C)c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000352465198	389814431	/nfs/dbraw/zinc/81/44/31/389814431.db2.gz	FPBDECQBHPXURN-YFKPBYRVSA-N	0	2	294.275	0.015	20	5		CCBDLN
Cc1[nH]nc(C(=O)N(C)C[C@H](C)c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000352465198	389814434	/nfs/dbraw/zinc/81/44/34/389814434.db2.gz	FPBDECQBHPXURN-YFKPBYRVSA-N	0	2	294.275	0.015	20	5		CCBDLN
Cn1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)nn1	ZINC000436644534	389981293	/nfs/dbraw/zinc/98/12/93/389981293.db2.gz	ACUCQVPAPUDPHE-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H]1OC	ZINC000436746286	389984115	/nfs/dbraw/zinc/98/41/15/389984115.db2.gz	XRNOTYQAOSTVDQ-VXGBXAGGSA-N	0	2	296.279	0.786	20	5		CCBDLN
C[C@@H]1C[C@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436891581	389986660	/nfs/dbraw/zinc/98/66/60/389986660.db2.gz	HAPGWCQWNPNSOM-APPZFPTMSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(NCCn1cncn1)c1cc([N+](=O)[O-])ccc1O	ZINC000436960962	389988482	/nfs/dbraw/zinc/98/84/82/389988482.db2.gz	SRERJLOAIPPAMW-UHFFFAOYSA-N	0	2	277.240	0.322	20	5		CCBDLN
COC1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000436970968	389988873	/nfs/dbraw/zinc/98/88/73/389988873.db2.gz	GYYUDZJKCIGCLR-UHFFFAOYSA-N	0	2	252.226	0.771	20	5		CCBDLN
COC(=O)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000494573942	390182613	/nfs/dbraw/zinc/18/26/13/390182613.db2.gz	VLPYCDKHUCSKQA-UHFFFAOYSA-N	0	2	283.240	0.985	20	5		CCBDLN
Cc1ccc2c(n1)OCCN2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000373214394	144396986	/nfs/dbraw/zinc/39/69/86/144396986.db2.gz	FMHCPAMJHJUBEU-PSASIEDQSA-N	0	2	263.253	0.781	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC(O)CC1	ZINC000236472647	304500768	/nfs/dbraw/zinc/50/07/68/304500768.db2.gz	SPXPSDWHWLAERE-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@H]1O	ZINC000354379253	300188409	/nfs/dbraw/zinc/18/84/09/300188409.db2.gz	GXGMMBVCDUZKEI-WRWORJQWSA-N	0	2	266.253	0.753	20	5		CCBDLN
COc1cc(=NC(=O)c2ccc([N+](=O)[O-])c(O)c2)[nH]n1C	ZINC000385736245	336155375	/nfs/dbraw/zinc/15/53/75/336155375.db2.gz	ZJXDAFYDUFATGV-UHFFFAOYSA-N	0	2	292.251	0.717	20	5		CCBDLN
Nc1ccnc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000354479967	526844324	/nfs/dbraw/zinc/84/43/24/526844324.db2.gz	PSXWEWKMGMBWPO-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
CN(C[C@@H]1CC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1)C(=O)[O-]	ZINC000739665831	581589317	/nfs/dbraw/zinc/58/93/17/581589317.db2.gz	VTKRUFQZQWCFII-VIFPVBQESA-N	0	2	283.288	0.681	20	5		CCBDLN
CN(C[C@@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1)C(=O)[O-]	ZINC000739665831	581589318	/nfs/dbraw/zinc/58/93/18/581589318.db2.gz	VTKRUFQZQWCFII-VIFPVBQESA-N	0	2	283.288	0.681	20	5		CCBDLN
COc1cc([N+](=O)[O-])ccc1C(=O)NN1CN=NC1=O	ZINC000757671354	581706259	/nfs/dbraw/zinc/70/62/59/581706259.db2.gz	LGHLIERNMXFMGQ-UHFFFAOYSA-N	0	2	279.212	0.284	20	5		CCBDLN
CCOC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000770486468	581747089	/nfs/dbraw/zinc/74/70/89/581747089.db2.gz	KOQNQRFCVGAJKJ-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC2(C1)OCCO2	ZINC000770483094	581747127	/nfs/dbraw/zinc/74/71/27/581747127.db2.gz	IOMXLKBZQYUEFJ-UHFFFAOYSA-N	0	2	294.263	0.889	20	5		CCBDLN
Cc1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n(-c2ccccc2)n1	ZINC000839699750	640352275	/nfs/dbraw/zinc/35/22/75/640352275.db2.gz	MFSDLCSTIPBOGY-GHMZBOCLSA-N	0	2	287.279	0.601	20	5		CCBDLN
Cc1nc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ccc1[N+](=O)[O-]	ZINC000841141196	642804026	/nfs/dbraw/zinc/80/40/26/642804026.db2.gz	GHTNCLCRQUVCBG-HTRCEHHLSA-N	0	2	266.213	0.902	20	5		CCBDLN
Cc1[nH+][n-]c2nnc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])c-2c1C	ZINC000854409270	644198197	/nfs/dbraw/zinc/19/81/97/644198197.db2.gz	VGWWHGZNDIRIGS-RNFRBKRXSA-N	0	2	276.256	0.573	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCOC(=O)N1	ZINC000860439704	644801953	/nfs/dbraw/zinc/80/19/53/644801953.db2.gz	GAHHGPIJPXLOSC-ZETCQYMHSA-N	0	2	281.224	0.737	20	5		CCBDLN
O=C(NC/C=C\CO)c1ccc([N+](=O)[O-])cc1O	ZINC001165974088	802878942	/nfs/dbraw/zinc/87/89/42/802878942.db2.gz	RILIFDSAGFDEGZ-UPHRSURJSA-N	0	2	252.226	0.579	20	5		CCBDLN
CC(C)[NH+]1CC(Oc2nc(=O)[n-]cc2[N+](=O)[O-])C1	ZINC001226332454	805220139	/nfs/dbraw/zinc/22/01/39/805220139.db2.gz	UWTPAQPGXIHSTE-UHFFFAOYSA-N	0	2	254.246	0.562	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC1CS(=O)(=O)C1	ZINC001228972875	805494622	/nfs/dbraw/zinc/49/46/22/805494622.db2.gz	FGJSZPJBHQTFQW-UHFFFAOYSA-N	0	2	275.238	0.182	20	5		CCBDLN
CC(=O)Nc1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc1	ZINC001325526696	913457416	/nfs/dbraw/zinc/45/74/16/913457416.db2.gz	PQRSXSRPWZUISY-RKDXNWHRSA-N	0	2	264.241	0.644	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])cn1C)c1nn(C)cc1O	ZINC001304543259	908170876	/nfs/dbraw/zinc/17/08/76/908170876.db2.gz	DFOVDSHTRKDERN-ZETCQYMHSA-N	0	2	293.283	0.863	20	5		CCBDLN
CC(C)c1nc(CNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n[nH]1	ZINC001450150073	931239130	/nfs/dbraw/zinc/23/91/30/931239130.db2.gz	HKRPJDNWGVALHK-RNFRBKRXSA-N	0	2	253.262	0.210	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1F	ZINC000358350846	232085932	/nfs/dbraw/zinc/08/59/32/232085932.db2.gz	FMUGBTGDVJVUSP-UHFFFAOYSA-N	0	2	281.203	0.488	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@H](CO)C1	ZINC000217316322	136951668	/nfs/dbraw/zinc/95/16/68/136951668.db2.gz	IFYIXWQRRSXKIS-MRVPVSSYSA-N	0	2	266.253	0.755	20	5		CCBDLN
CCCN(CC(N)=O)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000346887763	137310351	/nfs/dbraw/zinc/31/03/51/137310351.db2.gz	QDFARSPQDWEJLP-UHFFFAOYSA-N	0	2	281.268	0.638	20	5		CCBDLN
CN(C)C(=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181923626	351342152	/nfs/dbraw/zinc/34/21/52/351342152.db2.gz	XYEWFNQDVCBXHZ-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
C[C@H](CC(N)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316589	351946507	/nfs/dbraw/zinc/94/65/07/351946507.db2.gz	XOIWWSMMFQQYJC-ZCFIWIBFSA-N	0	2	267.241	0.294	20	5		CCBDLN
CCOC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000227451873	352050911	/nfs/dbraw/zinc/05/09/11/352050911.db2.gz	AYKDFFWLRXBQPN-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
CC(C)(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])C(N)=O	ZINC000229978768	352099145	/nfs/dbraw/zinc/09/91/45/352099145.db2.gz	GFPUHWAQYQISAL-UHFFFAOYSA-N	0	2	281.268	0.542	20	5		CCBDLN
COC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234530036	352159741	/nfs/dbraw/zinc/15/97/41/352159741.db2.gz	UQAGWYPDMVQDKV-UHFFFAOYSA-N	0	2	254.198	0.203	20	5		CCBDLN
O=C1N[C@@H](c2ccc([N+](=O)[O-])c(O)c2)N2CCSC[C@H]12	ZINC000270833268	352993010	/nfs/dbraw/zinc/99/30/10/352993010.db2.gz	UCTDMLJMMGXKJS-MWLCHTKSSA-N	0	2	295.320	0.846	20	5		CCBDLN
CCNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274639709	353148427	/nfs/dbraw/zinc/14/84/27/353148427.db2.gz	YXWPIGSZDZWOAT-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
CNC(=O)C1(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CC1	ZINC000274848715	353167479	/nfs/dbraw/zinc/16/74/79/353167479.db2.gz	AOOHNHVRHMZPEJ-UHFFFAOYSA-N	0	2	279.252	0.765	20	5		CCBDLN
COC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000275115409	353186538	/nfs/dbraw/zinc/18/65/38/353186538.db2.gz	YTHCKAVFSVBMOB-UHFFFAOYSA-N	0	2	295.251	0.481	20	5		CCBDLN
C[C@]1(C(N)=O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000280233063	353348575	/nfs/dbraw/zinc/34/85/75/353348575.db2.gz	ZFDAQMUKFSKEOA-ZDUSSCGKSA-N	0	2	293.279	0.638	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000359274793	356791472	/nfs/dbraw/zinc/79/14/72/356791472.db2.gz	PKJBZZJNFDUJIK-UHFFFAOYSA-N	0	2	278.228	0.052	20	5		CCBDLN
CCn1nc(C)c([N+](=O)[O-])c1NCCc1nc(N)no1	ZINC000359546845	356841968	/nfs/dbraw/zinc/84/19/68/356841968.db2.gz	MJVWYBRDQZECDD-UHFFFAOYSA-N	0	2	281.276	0.570	20	5		CCBDLN
NC(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c[nH]1	ZINC000611294685	363703712	/nfs/dbraw/zinc/70/37/12/363703712.db2.gz	PFRNXJSFVGGKDU-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
NC(=O)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000593813486	360164431	/nfs/dbraw/zinc/16/44/31/360164431.db2.gz	GDSYOZYUDFKZOB-KNVOCYPGSA-N	0	2	279.252	0.294	20	5		CCBDLN
Cc1ccnc(NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000301591401	201085615	/nfs/dbraw/zinc/08/56/15/201085615.db2.gz	YDROSSAPMLDXJW-UHFFFAOYSA-N	0	2	250.218	0.322	20	5		CCBDLN
Cc1cccc([N+](=O)[O-])c1C(=O)NN1CCCNC1=O	ZINC000278887602	194196890	/nfs/dbraw/zinc/19/68/90/194196890.db2.gz	ZCSZWHPNWUESLP-UHFFFAOYSA-N	0	2	278.268	0.963	20	5		CCBDLN
C[C@@H]1OCC[C@]1(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000279503293	194458395	/nfs/dbraw/zinc/45/83/95/194458395.db2.gz	NZWLBSXTYCLRHA-SDBXPKJASA-N	0	2	296.279	0.570	20	5		CCBDLN
CN(CC(C)(CO)CO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281158616	195128527	/nfs/dbraw/zinc/12/85/27/195128527.db2.gz	HXIRACOCXMXWNB-UHFFFAOYSA-N	0	2	298.295	0.363	20	5		CCBDLN
CCNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000187708663	388893665	/nfs/dbraw/zinc/89/36/65/388893665.db2.gz	MYVRQBZMJRNVKS-UHFFFAOYSA-N	0	2	293.279	0.509	20	5		CCBDLN
CCc1nc(CNC(=O)c2cc(O)cc([N+](=O)[O-])c2)n[nH]1	ZINC000295321048	389002171	/nfs/dbraw/zinc/00/21/71/389002171.db2.gz	LBVOQKAXHYXHLP-UHFFFAOYSA-N	0	2	291.267	0.911	20	5		CCBDLN
O=C(NCCOCCO)c1ccc([N+](=O)[O-])c(O)c1	ZINC000298349065	389013170	/nfs/dbraw/zinc/01/31/70/389013170.db2.gz	RJZPDZZMQSQXFC-UHFFFAOYSA-N	0	2	270.241	0.039	20	5		CCBDLN
C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355495170	389085182	/nfs/dbraw/zinc/08/51/82/389085182.db2.gz	AMPKTENMAXNSTI-SDBXPKJASA-N	0	2	296.279	0.570	20	5		CCBDLN
CC(=O)N1CC(NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000179515528	389658001	/nfs/dbraw/zinc/65/80/01/389658001.db2.gz	UKXJCXONMNYLSQ-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
COC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436671680	389982453	/nfs/dbraw/zinc/98/24/53/389982453.db2.gz	BFBCBMPPTKJMJZ-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
O=C(N[C@@H](CO)[C@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000436806004	389984586	/nfs/dbraw/zinc/98/45/86/389984586.db2.gz	FGJMYVVWLQROIM-CMPLNLGQSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H]1CCNC1=O	ZINC000436904715	389986577	/nfs/dbraw/zinc/98/65/77/389986577.db2.gz	ZIMHXKMDBUBIDJ-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2OCC[N@@H+](C)[C@H]2C1	ZINC000342127265	130285654	/nfs/dbraw/zinc/28/56/54/130285654.db2.gz	KMEWEIURASFOEX-CMPLNLGQSA-N	0	2	295.343	0.233	20	5		CCBDLN
O=C(NCC1(O)CCOCC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267225155	131838591	/nfs/dbraw/zinc/83/85/91/131838591.db2.gz	VDDOVPABIDKRPF-UHFFFAOYSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=C(NC[C@@H]1CC[C@@H](CO)O1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000356506600	144008997	/nfs/dbraw/zinc/00/89/97/144008997.db2.gz	LHUDBXCDLCUUKK-UWVGGRQHSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H]1O	ZINC000436890141	397534319	/nfs/dbraw/zinc/53/43/19/397534319.db2.gz	DSMDSTQBSKNSNN-HQJQHLMTSA-N	0	2	266.253	0.753	20	5		CCBDLN
NC(=O)[C@@H]1CCCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000281093435	303298130	/nfs/dbraw/zinc/29/81/30/303298130.db2.gz	FCVZBYLCICHMJO-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000576238960	335176345	/nfs/dbraw/zinc/17/63/45/335176345.db2.gz	NPCQKZRHKJZDAB-HTQZYQBOSA-N	0	2	279.252	0.750	20	5		CCBDLN
CCOC[C@@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354358796	520101061	/nfs/dbraw/zinc/10/10/61/520101061.db2.gz	NAFGGPFJNUAQQH-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NN1CCCC1=O)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000780699885	581127349	/nfs/dbraw/zinc/12/73/49/581127349.db2.gz	FKHSXJLBMXNFNV-UHFFFAOYSA-N	0	2	289.251	0.738	20	5		CCBDLN
O=C(NN1CCCC1=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000780699885	581127350	/nfs/dbraw/zinc/12/73/50/581127350.db2.gz	FKHSXJLBMXNFNV-UHFFFAOYSA-N	0	2	289.251	0.738	20	5		CCBDLN
Cn1nncc1S(=O)(=O)Nc1ccc(N)c([N+](=O)[O-])c1	ZINC000790005878	581170298	/nfs/dbraw/zinc/17/02/98/581170298.db2.gz	YUQWNLUNYMAOMK-UHFFFAOYSA-N	0	2	298.284	0.106	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCOC[C@@H]1CCO	ZINC000779674745	581198856	/nfs/dbraw/zinc/19/88/56/581198856.db2.gz	MTVUMSIPZIXIQS-JTQLQIEISA-N	0	2	296.279	0.524	20	5		CCBDLN
C=CC(=O)NCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000791360335	581217348	/nfs/dbraw/zinc/21/73/48/581217348.db2.gz	QRJKOUAQMCAAHH-UHFFFAOYSA-N	0	2	279.252	0.332	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC2(C1)OCCO2	ZINC000753817208	581559026	/nfs/dbraw/zinc/55/90/26/581559026.db2.gz	CFRRHQIHTMLXKZ-UHFFFAOYSA-N	0	2	294.263	0.889	20	5		CCBDLN
CON(C)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000788150183	581720554	/nfs/dbraw/zinc/72/05/54/581720554.db2.gz	SIJQJNNBUDACAQ-UHFFFAOYSA-N	0	2	269.257	0.523	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cn1	ZINC000774969668	582006568	/nfs/dbraw/zinc/00/65/68/582006568.db2.gz	SZYFTXZSMVAAHW-UHFFFAOYSA-N	0	2	265.185	0.171	20	5		CCBDLN
O=C([O-])N1CC[NH+](CCn2cc([N+](=O)[O-])cn2)CC1	ZINC000738643538	582067850	/nfs/dbraw/zinc/06/78/50/582067850.db2.gz	BPJMZRNHMXJTDS-UHFFFAOYSA-N	0	2	269.261	0.087	20	5		CCBDLN
O=C(NCCOC(=O)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000816518168	641170617	/nfs/dbraw/zinc/17/06/17/641170617.db2.gz	RDTKWKSCVAPNBL-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
COc1cnc(F)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000876021102	646571230	/nfs/dbraw/zinc/57/12/30/646571230.db2.gz	HWMNRXWEPORJKH-HTRCEHHLSA-N	0	2	255.205	0.833	20	5		CCBDLN
CCN=c1ncc(N)cn1-c1ccc(O)c([N+](=O)[O-])c1	ZINC001210396259	803649185	/nfs/dbraw/zinc/64/91/85/803649185.db2.gz	PMUGNDXKIJFVSZ-UHFFFAOYSA-N	0	2	275.268	0.989	20	5		CCBDLN
COc1cc(=O)[nH]c(O[C@H](C[N+](=O)[O-])c2cccnc2)n1	ZINC001228917597	805489827	/nfs/dbraw/zinc/48/98/27/805489827.db2.gz	HAUMIYQTLWJFQY-SECBINFHSA-N	0	2	292.251	0.983	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC[C@H]1COCCO1	ZINC001228971202	805493659	/nfs/dbraw/zinc/49/36/59/805493659.db2.gz	LXCVLUGHCCTGSU-MRVPVSSYSA-N	0	2	271.225	0.800	20	5		CCBDLN
CSc1n[nH]c(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC001323393248	912317474	/nfs/dbraw/zinc/31/74/74/912317474.db2.gz	YJKPACNTNXCGNB-UHFFFAOYSA-N	0	2	283.273	0.421	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000600240785	361901468	/nfs/dbraw/zinc/90/14/68/361901468.db2.gz	HLVMBCZKDSSMGC-RYUDHWBXSA-N	0	2	296.279	0.570	20	5		CCBDLN
NC(=O)[C@H]1C[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000600314399	361926073	/nfs/dbraw/zinc/92/60/73/361926073.db2.gz	AAVQLWUBYIGUNI-LJGSYFOKSA-N	0	2	279.252	0.294	20	5		CCBDLN
COC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273240343	192084621	/nfs/dbraw/zinc/08/46/21/192084621.db2.gz	QCNKGOVXAJHCCJ-QMMMGPOBSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=C(NC[C@]1(O)CCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000339350151	215113863	/nfs/dbraw/zinc/11/38/63/215113863.db2.gz	RTGHNXWNUMAUNS-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
COC[C@@](C)(O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000537767380	290876023	/nfs/dbraw/zinc/87/60/23/290876023.db2.gz	NXBZVYXXPQIGEP-LLVKDONJSA-N	0	2	270.241	0.636	20	5		CCBDLN
CC(=O)N(C)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000089531685	349392936	/nfs/dbraw/zinc/39/29/36/349392936.db2.gz	XKFVOUIPQUQSQS-UHFFFAOYSA-N	0	2	267.241	0.717	20	5		CCBDLN
C[C@H]1CO[C@@H](CO)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316021	351945832	/nfs/dbraw/zinc/94/58/32/351945832.db2.gz	NMLLRXHSBPCFKY-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(NC[C@@]1(O)CCSC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267123743	352746146	/nfs/dbraw/zinc/74/61/46/352746146.db2.gz	QCDGXDKTVPDQEG-LBPRGKRZSA-N	0	2	298.320	0.898	20	5		CCBDLN
CN1N=C(C(=O)Nc2cc([N+](=O)[O-])ccc2O)CCC1=O	ZINC000270418270	352931335	/nfs/dbraw/zinc/93/13/35/352931335.db2.gz	QHVQVBKENLMQKJ-UHFFFAOYSA-N	0	2	292.251	0.847	20	5		CCBDLN
COC[C@@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272339785	353053806	/nfs/dbraw/zinc/05/38/06/353053806.db2.gz	ADQMPATZOIYCHV-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
NC(=O)N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274646062	353149257	/nfs/dbraw/zinc/14/92/57/353149257.db2.gz	CFBBPLRRFKGJJU-SSDOTTSWSA-N	0	2	294.267	0.183	20	5		CCBDLN
CC1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)OCCO1	ZINC000275079528	353183799	/nfs/dbraw/zinc/18/37/99/353183799.db2.gz	RMVIABZDQAROIL-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
C[C@H](O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157968484	188350178	/nfs/dbraw/zinc/35/01/78/188350178.db2.gz	VKJIGFHELRXEIW-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
CCC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000286445916	353586560	/nfs/dbraw/zinc/58/65/60/353586560.db2.gz	SWUYAHCPEBVTBS-VIFPVBQESA-N	0	2	281.268	0.684	20	5		CCBDLN
CC(C)[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000287819903	353669268	/nfs/dbraw/zinc/66/92/68/353669268.db2.gz	KEJBSHMFPNGZFX-CYBMUJFWSA-N	0	2	295.295	0.930	20	5		CCBDLN
CC(C)[C@@](C)(NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000288019741	353682244	/nfs/dbraw/zinc/68/22/44/353682244.db2.gz	SQUORGZLGXFZSN-CYBMUJFWSA-N	0	2	295.295	0.930	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H](CO)O1	ZINC000331234194	354499953	/nfs/dbraw/zinc/49/99/53/354499953.db2.gz	KIKHWDDPNSRWPE-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
CC(C)(CO)ONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000297258152	200127627	/nfs/dbraw/zinc/12/76/27/200127627.db2.gz	QXFJDDYARVRPFO-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
C[C@@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1O)NC(N)=O	ZINC000594337502	360275991	/nfs/dbraw/zinc/27/59/91/360275991.db2.gz	WIDJOLQUHKXXFR-LURJTMIESA-N	0	2	282.256	0.686	20	5		CCBDLN
CC(C)(CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186285192	388831128	/nfs/dbraw/zinc/83/11/28/388831128.db2.gz	RHHRIYTXFBYXHW-UHFFFAOYSA-N	0	2	281.268	0.684	20	5		CCBDLN
CCN1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000190560951	388994607	/nfs/dbraw/zinc/99/46/07/388994607.db2.gz	FMPSXZJJEVFFQJ-UHFFFAOYSA-N	0	2	279.252	0.562	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCOCC1	ZINC000194738858	389102568	/nfs/dbraw/zinc/10/25/68/389102568.db2.gz	VPUZEKCAAPXMLD-UHFFFAOYSA-N	0	2	252.226	0.773	20	5		CCBDLN
Cn1nccc1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000352022079	389737467	/nfs/dbraw/zinc/73/74/67/389737467.db2.gz	VAOFGZJIGJNNLS-IHWYPQMZSA-N	0	2	263.213	0.700	20	5		CCBDLN
COC(=O)NCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000495269385	390231822	/nfs/dbraw/zinc/23/18/22/390231822.db2.gz	DJENQHKNZVQGON-UHFFFAOYSA-N	0	2	269.213	0.595	20	5		CCBDLN
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2c[nH+]cn2C)n1	ZINC000583633616	390301550	/nfs/dbraw/zinc/30/15/50/390301550.db2.gz	OBXPCZQIEVAHCY-UHFFFAOYSA-N	0	2	291.267	0.764	20	5		CCBDLN
CCN(C)C(=O)[C@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000283445041	195859957	/nfs/dbraw/zinc/85/99/57/195859957.db2.gz	NNBXNZJMVYMVEG-QMMMGPOBSA-N	0	2	295.295	0.897	20	5		CCBDLN
CC1(C(N)=O)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000571764060	390751948	/nfs/dbraw/zinc/75/19/48/390751948.db2.gz	REHFCQSFJPUKQT-UHFFFAOYSA-N	0	2	279.252	0.248	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@@H](CO)[C@@H](O)C1	ZINC000546697922	285917499	/nfs/dbraw/zinc/91/74/99/285917499.db2.gz	PFYQVMXTUOKIFR-UFBFGSQYSA-N	0	2	296.279	0.116	20	5		CCBDLN
CCc1n[nH]c(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC000479190205	420307050	/nfs/dbraw/zinc/30/70/50/420307050.db2.gz	JCEDDDWVHIJCDK-UHFFFAOYSA-N	0	2	265.233	0.261	20	5		CCBDLN
CC(=O)NCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000581193580	336022603	/nfs/dbraw/zinc/02/26/03/336022603.db2.gz	WMJBGOUBWTVOHR-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(COc1cccc([N+](=O)[O-])c1)NCc1n[nH]c(=O)[nH]1	ZINC000358361842	534631048	/nfs/dbraw/zinc/63/10/48/534631048.db2.gz	URKAKRLEOPAURX-UHFFFAOYSA-N	0	2	293.239	0.114	20	5		CCBDLN
CCc1nn(C)c(Sc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000340850337	522671986	/nfs/dbraw/zinc/67/19/86/522671986.db2.gz	IHGDMSDYAZIZFV-UHFFFAOYSA-N	0	2	270.274	0.866	20	5		CCBDLN
C[C@]1(NC(=O)c2cccc(O)c2[N+](=O)[O-])CCOC1=O	ZINC000794099846	581343340	/nfs/dbraw/zinc/34/33/40/581343340.db2.gz	PKNHJKUOJRSMMS-LBPRGKRZSA-N	0	2	280.236	0.736	20	5		CCBDLN
O=C([O-])C1CC[NH+](Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000740481634	581683933	/nfs/dbraw/zinc/68/39/33/581683933.db2.gz	DHABVBPROVPPRC-UHFFFAOYSA-N	0	2	254.246	0.545	20	5		CCBDLN
COCCONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000773268587	581918958	/nfs/dbraw/zinc/91/89/58/581918958.db2.gz	HYRZJHXGUATSHO-UHFFFAOYSA-N	0	2	256.214	0.608	20	5		CCBDLN
O=C([O-])c1cc(NC(=O)[C@@H]2CCC[NH2+]2)cc([N+](=O)[O-])c1	ZINC000833301175	600975252	/nfs/dbraw/zinc/97/52/52/600975252.db2.gz	QQVTVMGCJHXMPX-JTQLQIEISA-N	0	2	279.252	0.984	20	5		CCBDLN
CCOC(=O)c1nnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000839726370	615195655	/nfs/dbraw/zinc/19/56/55/615195655.db2.gz	OLZZDLXJHDQDTN-RFZPGFLSSA-N	0	2	286.269	0.319	20	5		CCBDLN
CCON(C)C(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000846507086	615334839	/nfs/dbraw/zinc/33/48/39/615334839.db2.gz	KZHFEKGSVBAXAC-UHFFFAOYSA-N	0	2	297.267	0.440	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1c2ccccc2C[C@@H]1CO	ZINC000912310476	636550662	/nfs/dbraw/zinc/55/06/62/636550662.db2.gz	XIYVOOPDEGBFTN-CKYFFXLPSA-N	0	2	262.265	0.602	20	5		CCBDLN
O=C(N[C@@H]1COC(=O)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000816676853	641185355	/nfs/dbraw/zinc/18/53/55/641185355.db2.gz	SKGLYOSZEUDHIR-LURJTMIESA-N	0	2	266.209	0.346	20	5		CCBDLN
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O=C(C[C@H]1CCC(=O)N1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000831242997	642336037	/nfs/dbraw/zinc/33/60/37/642336037.db2.gz	BJEPPEWXDUYLLC-SSDOTTSWSA-N	0	2	279.252	0.908	20	5		CCBDLN
Cc1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n2ncnc2n1	ZINC000847034568	643482967	/nfs/dbraw/zinc/48/29/67/643482967.db2.gz	JJKACIVNOBCTNG-RNFRBKRXSA-N	0	2	262.229	0.036	20	5		CCBDLN
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C[C@@H](NC(=O)c1nn(C)cc1[N+](=O)[O-])c1nn(C)cc1O	ZINC001179926750	843081159	/nfs/dbraw/zinc/08/11/59/843081159.db2.gz	LRMXIAZAEGOMFU-ZCFIWIBFSA-N	0	2	294.271	0.258	20	5		CCBDLN
COC(=O)[C@@H]1CCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001304094151	908141979	/nfs/dbraw/zinc/14/19/79/908141979.db2.gz	NUXJVEGCIGUOEM-VIFPVBQESA-N	0	2	280.236	0.688	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(C(=O)Nc2nc(C3CC3)no2)n1	ZINC001331267971	917233238	/nfs/dbraw/zinc/23/32/38/917233238.db2.gz	LTGKNZIXMOZFFC-UHFFFAOYSA-N	0	2	278.228	0.841	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)NN2CCCNC2=O)c1	ZINC000273150839	192058219	/nfs/dbraw/zinc/05/82/19/192058219.db2.gz	YTJPDLJUMXVRNE-UHFFFAOYSA-N	0	2	278.268	0.963	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H]1C[C@@H](C(N)=O)C1	ZINC000600580765	362012764	/nfs/dbraw/zinc/01/27/64/362012764.db2.gz	XHKTUOZBRVGNOU-OTSSQURYSA-N	0	2	293.279	0.636	20	5		CCBDLN
CSc1n[nH]c(NC(=O)c2n[nH]cc2[N+](=O)[O-])n1	ZINC000343351114	137130326	/nfs/dbraw/zinc/13/03/26/137130326.db2.gz	DEGNKIFRLWZYCK-UHFFFAOYSA-N	0	2	269.246	0.410	20	5		CCBDLN
COC(=O)[C@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)[C@H]1C	ZINC000346683152	137298743	/nfs/dbraw/zinc/29/87/43/137298743.db2.gz	FWCOGBCDBUPJST-IUCAKERBSA-N	0	2	282.300	0.712	20	5		CCBDLN
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Cn1cc(C(=O)C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)cn1	ZINC000186010447	351471911	/nfs/dbraw/zinc/47/19/11/351471911.db2.gz	IYFZDNPQWBYOGM-UHFFFAOYSA-N	0	2	290.235	0.855	20	5		CCBDLN
C[C@H](O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000187635793	351549719	/nfs/dbraw/zinc/54/97/19/351549719.db2.gz	JWUDMFPWMCAMAU-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
C[C@H](C[S@](C)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000122168149	187018541	/nfs/dbraw/zinc/01/85/41/187018541.db2.gz	JFNGMMCGZGDDTD-QOLSBQFWSA-N	0	2	286.309	0.797	20	5		CCBDLN
C[C@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000231676942	352132349	/nfs/dbraw/zinc/13/23/49/352132349.db2.gz	XOZJGNYAMLRNAJ-ZCFIWIBFSA-N	0	2	267.241	0.294	20	5		CCBDLN
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COC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1	ZINC000266826717	352723623	/nfs/dbraw/zinc/72/36/23/352723623.db2.gz	YGHSKINUUZYOCZ-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
C[C@H](O)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000292211792	198203368	/nfs/dbraw/zinc/20/33/68/198203368.db2.gz	YRKKGGGXRSSIGP-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
CNC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274694740	353154235	/nfs/dbraw/zinc/15/42/35/353154235.db2.gz	RSTNXBCZIWXLOT-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
C[S@@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000282237013	353406019	/nfs/dbraw/zinc/40/60/19/353406019.db2.gz	RNPVNTXQGFRZPV-HXUWFJFHSA-N	0	2	298.320	0.941	20	5		CCBDLN
CC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000293655207	353827259	/nfs/dbraw/zinc/82/72/59/353827259.db2.gz	BSXXIEBRGCMONF-QMMMGPOBSA-N	0	2	254.242	0.801	20	5		CCBDLN
COCCCN(CCO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000295422103	353892910	/nfs/dbraw/zinc/89/29/10/353892910.db2.gz	CNFJQGPQDDUKHZ-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
CC(=O)NCCN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000308299871	354183183	/nfs/dbraw/zinc/18/31/83/354183183.db2.gz	LKIMREYVDYYAPW-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC[S@]1=O	ZINC000353227049	356183183	/nfs/dbraw/zinc/18/31/83/356183183.db2.gz	FGDZODYDGWJWAC-FFVOIRBGSA-N	0	2	298.320	0.893	20	5		CCBDLN
CCN1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000273513055	192181338	/nfs/dbraw/zinc/18/13/38/192181338.db2.gz	SBOWRSXGLXXIPO-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)nn1C	ZINC000355816282	356654208	/nfs/dbraw/zinc/65/42/08/356654208.db2.gz	ZMVOVHPMXKUXIT-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
CCN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O	ZINC000619825110	366361392	/nfs/dbraw/zinc/36/13/92/366361392.db2.gz	HSFCDUHTGMQBBW-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
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CO[C@](C)(CO)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000594396649	360292335	/nfs/dbraw/zinc/29/23/35/360292335.db2.gz	JFROBOGPWPLHQF-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
COC(=O)COCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597441175	361095381	/nfs/dbraw/zinc/09/53/81/361095381.db2.gz	DNPBNAPISFANKA-UHFFFAOYSA-N	0	2	284.224	0.429	20	5		CCBDLN
CN(C[C@@H]1COCCO1)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000598185847	361351206	/nfs/dbraw/zinc/35/12/06/361351206.db2.gz	ZCUXYJDWLRIVRN-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
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CNC(=O)C1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000331911341	204285207	/nfs/dbraw/zinc/28/52/07/204285207.db2.gz	GHUQDYSZTZZLBO-UHFFFAOYSA-N	0	2	279.252	0.118	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000186842116	296255995	/nfs/dbraw/zinc/25/59/95/296255995.db2.gz	ZIXUXRYBHHPNFY-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
CC(=O)NCCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281113843	195109294	/nfs/dbraw/zinc/10/92/94/195109294.db2.gz	HJXWDQZPRMVSOV-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
C[S@](=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184769980	388778237	/nfs/dbraw/zinc/77/82/37/388778237.db2.gz	UUKDZNHGMUTFIW-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@H]1O	ZINC000354379251	389022622	/nfs/dbraw/zinc/02/26/22/389022622.db2.gz	GXGMMBVCDUZKEI-RDDDGLTNSA-N	0	2	266.253	0.753	20	5		CCBDLN
Cc1n[nH]c(NC(=O)c2c[nH]c(=O)c([N+](=O)[O-])c2)n1	ZINC000193612520	389074947	/nfs/dbraw/zinc/07/49/47/389074947.db2.gz	HINRNKMWHBOSLB-UHFFFAOYSA-N	0	2	264.201	0.374	20	5		CCBDLN
C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355495168	389084912	/nfs/dbraw/zinc/08/49/12/389084912.db2.gz	AMPKTENMAXNSTI-ISVAXAHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
CCNC(=O)C(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000313195803	389111762	/nfs/dbraw/zinc/11/17/62/389111762.db2.gz	GXUSZSGTXLIVIS-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
Cn1nncc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436747371	389984311	/nfs/dbraw/zinc/98/43/11/389984311.db2.gz	LNHAMWCRGZMJRH-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CCCN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436838898	389985761	/nfs/dbraw/zinc/98/57/61/389985761.db2.gz	RZUFNLKHMIKIEU-UHFFFAOYSA-N	0	2	281.268	0.638	20	5		CCBDLN
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CN(Cc1ncon1)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436957283	389987618	/nfs/dbraw/zinc/98/76/18/389987618.db2.gz	TYEBWSWLGICXGO-UHFFFAOYSA-N	0	2	278.224	0.956	20	5		CCBDLN
COCC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000281543590	195282005	/nfs/dbraw/zinc/28/20/05/195282005.db2.gz	JXRZNPJUNQJAQQ-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
CN(CCCO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000281728370	195354802	/nfs/dbraw/zinc/35/48/02/195354802.db2.gz	HLUAILNKBYJHHV-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
Cn1c(=[NH2+])[n-]nc1SCCn1cc([N+](=O)[O-])ccc1=O	ZINC000565960506	390562660	/nfs/dbraw/zinc/56/26/60/390562660.db2.gz	HOWYIAXICUMRJM-UHFFFAOYSA-N	0	2	296.312	0.090	20	5		CCBDLN
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COC(=O)N(C)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000855942326	616790905	/nfs/dbraw/zinc/79/09/05/616790905.db2.gz	IFAKCYVPUWWDEA-UHFFFAOYSA-N	0	2	297.267	0.728	20	5		CCBDLN
COCc1csc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839684459	616919137	/nfs/dbraw/zinc/91/91/37/616919137.db2.gz	WUVNSYYHYLPALC-RNFRBKRXSA-N	0	2	257.271	0.893	20	5		CCBDLN
COCc1nccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000857660077	616960336	/nfs/dbraw/zinc/96/03/36/616960336.db2.gz	SVJUNFWOUAWELV-RNFRBKRXSA-N	0	2	252.230	0.227	20	5		CCBDLN
O=C(Nc1ccn(CC(F)F)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839698971	640351138	/nfs/dbraw/zinc/35/11/38/640351138.db2.gz	TZAFXGQSLWZIHZ-PHDIDXHHSA-N	0	2	260.200	0.752	20	5		CCBDLN
O=C(Nc1cc(CSCCO)ccn1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839711109	640355861	/nfs/dbraw/zinc/35/58/61/640355861.db2.gz	YLGVBQGCPOAADX-NXEZZACHSA-N	0	2	297.336	0.911	20	5		CCBDLN
O=C(Nc1ccnn1[C@@H]1CCCOC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000890328463	648292631	/nfs/dbraw/zinc/29/26/31/648292631.db2.gz	GWLHHPJZZQIZQE-OPRDCNLKSA-N	0	2	280.284	0.838	20	5		CCBDLN
Cc1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)[nH]1	ZINC001158431966	801647473	/nfs/dbraw/zinc/64/74/73/801647473.db2.gz	CSGAIDCRPIZLAO-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1O[C@H]1CCS(=O)(=O)C1	ZINC001228969844	805493966	/nfs/dbraw/zinc/49/39/66/805493966.db2.gz	DDCRORAGAYKHMI-ZETCQYMHSA-N	0	2	289.265	0.572	20	5		CCBDLN
CN1CCO[C@H](COc2cc(O)cc(O)c2[N+](=O)[O-])C1=O	ZINC001228973804	805494482	/nfs/dbraw/zinc/49/44/82/805494482.db2.gz	MKEOIGOIVVHQIS-SNVBAGLBSA-N	0	2	298.251	0.242	20	5		CCBDLN
Cc1nnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1C1CC1	ZINC001297683889	907100728	/nfs/dbraw/zinc/10/07/28/907100728.db2.gz	YNUWUPPBJGONOG-HTQZYQBOSA-N	0	2	251.246	0.525	20	5		CCBDLN
C[C@]1(CO)C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001301121001	907954857	/nfs/dbraw/zinc/95/48/57/907954857.db2.gz	AFNRQSBJFMMARH-NOZJJQNGSA-N	0	2	296.279	0.258	20	5		CCBDLN
CNC(=O)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000456524626	529869100	/nfs/dbraw/zinc/86/91/00/529869100.db2.gz	YLWPWTLXGGZCOK-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
CNC(=O)[C@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000346814397	137305819	/nfs/dbraw/zinc/30/58/19/137305819.db2.gz	WLVOVPUANFEVHL-LURJTMIESA-N	0	2	267.241	0.165	20	5		CCBDLN
C[C@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])c1nc[nH]n1	ZINC000339517929	215225748	/nfs/dbraw/zinc/22/57/48/215225748.db2.gz	TYCJLKCXBSPWJT-LURJTMIESA-N	0	2	277.240	0.910	20	5		CCBDLN
O=C(c1cccc([N+](=O)[O-])c1[O-])N1CC[NH+](CCO)CC1	ZINC000153692631	350561893	/nfs/dbraw/zinc/56/18/93/350561893.db2.gz	WDFSXOUPCNNGSX-UHFFFAOYSA-N	0	2	295.295	0.051	20	5		CCBDLN
C[C@@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182074158	351346498	/nfs/dbraw/zinc/34/64/98/351346498.db2.gz	MHIJFVNFTZLUMY-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
COC(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000226559538	352029367	/nfs/dbraw/zinc/02/93/67/352029367.db2.gz	PANFMGAQZAPVTR-SECBINFHSA-N	0	2	294.263	0.936	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC[C@@H](O)C1	ZINC000236524576	352196576	/nfs/dbraw/zinc/19/65/76/352196576.db2.gz	QNWUKXFOECXCFH-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
COC(=O)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267350841	352761852	/nfs/dbraw/zinc/76/18/52/352761852.db2.gz	UZSQJRDGMCGZPM-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(NC[C@]1(O)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270089189	352902693	/nfs/dbraw/zinc/90/26/93/352902693.db2.gz	ICGLXSGSFYLLBM-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
NC(=O)N[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000270792967	352986303	/nfs/dbraw/zinc/98/63/03/352986303.db2.gz	VKTKLMBMWMTNIG-QMMMGPOBSA-N	0	2	294.267	0.183	20	5		CCBDLN
NC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272367452	353056473	/nfs/dbraw/zinc/05/64/73/353056473.db2.gz	GJZAEKWFKFQVAD-SSDOTTSWSA-N	0	2	279.252	0.248	20	5		CCBDLN
C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000279641171	353307331	/nfs/dbraw/zinc/30/73/31/353307331.db2.gz	YZTRLPYPIZBTNW-AMIZOPFISA-N	0	2	296.279	0.570	20	5		CCBDLN
Cc1nncn1CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353002648	356133762	/nfs/dbraw/zinc/13/37/62/356133762.db2.gz	JJYJUWYLHHIANJ-UHFFFAOYSA-N	0	2	291.267	0.630	20	5		CCBDLN
O=c1[nH]nc(Cn2cc([N+](=O)[O-])cc(Cl)c2=O)[nH]1	ZINC000353207049	356178783	/nfs/dbraw/zinc/17/87/83/356178783.db2.gz	XGJZIBXCWIKCGD-UHFFFAOYSA-N	0	2	271.620	0.282	20	5		CCBDLN
Cc1nc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n[nH]1	ZINC000354027372	356332123	/nfs/dbraw/zinc/33/21/23/356332123.db2.gz	HPPUVUZJJNKORD-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
Cc1nnc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])[nH]1	ZINC000354027372	356332125	/nfs/dbraw/zinc/33/21/25/356332125.db2.gz	HPPUVUZJJNKORD-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
COC[C@](C)(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000560514875	291106511	/nfs/dbraw/zinc/10/65/11/291106511.db2.gz	FPXBXOYDAAJPBB-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NC1(c2nn[nH]n2)CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000560665959	291110912	/nfs/dbraw/zinc/11/09/12/291110912.db2.gz	CFBBGJPAEIVIJN-UHFFFAOYSA-N	0	2	290.239	0.233	20	5		CCBDLN
O=C(NCc1nnc[nH]1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356346276	356749780	/nfs/dbraw/zinc/74/97/80/356749780.db2.gz	RSYLOUBCWVYYHA-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
Cn1cnc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000562186113	291138566	/nfs/dbraw/zinc/13/85/66/291138566.db2.gz	HLGJRDADBMDAHT-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CSc1n[n-]c(=[NH2+])n1C	ZINC000570661306	358880036	/nfs/dbraw/zinc/88/00/36/358880036.db2.gz	LBSBIABPQAPIJV-UHFFFAOYSA-N	0	2	269.290	0.162	20	5		CCBDLN
CN(CC(C)(CO)CO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000297420893	200184155	/nfs/dbraw/zinc/18/41/55/200184155.db2.gz	HDSSFJCHZIQNDF-UHFFFAOYSA-N	0	2	298.295	0.363	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1N1CC[C@@H](O)C(F)(F)C1	ZINC000596431327	360891869	/nfs/dbraw/zinc/89/18/69/360891869.db2.gz	XYLWOBWCWCOEOS-ZCFIWIBFSA-N	0	2	262.216	0.535	20	5		CCBDLN
C[C@H]1CN(CCNc2c([N+](=O)[O-])ncn2C)[C@@H](C)CO1	ZINC000596428122	360891998	/nfs/dbraw/zinc/89/19/98/360891998.db2.gz	HHHZMUIUBFUBNX-UWVGGRQHSA-N	0	2	283.332	0.849	20	5		CCBDLN
COCc1cc([N+](=O)[O-])ccc1NCc1n[nH]c(=O)[nH]1	ZINC000301779946	201192601	/nfs/dbraw/zinc/19/26/01/201192601.db2.gz	MYAHJHARYSTCAC-UHFFFAOYSA-N	0	2	279.256	0.765	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@H](CO)[C@H](O)C1	ZINC000567159647	291462625	/nfs/dbraw/zinc/46/26/25/291462625.db2.gz	SHFVBXVFDMADMN-QPUJVOFHSA-N	0	2	296.279	0.116	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000456888765	249038161	/nfs/dbraw/zinc/03/81/61/249038161.db2.gz	PZYKNJDKSIGYQB-APPZFPTMSA-N	0	2	293.279	0.684	20	5		CCBDLN
CCc1nnc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)[nH]1	ZINC000295240093	388996617	/nfs/dbraw/zinc/99/66/17/388996617.db2.gz	CUNRUYXDIVIXBO-UHFFFAOYSA-N	0	2	291.267	0.911	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000163701272	389429352	/nfs/dbraw/zinc/42/93/52/389429352.db2.gz	SQEOLWHPLJKACP-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
O=C(c1ccc([O-])c([N+](=O)[O-])c1)N1CC[NH+](CCO)CC1	ZINC000164166425	389432205	/nfs/dbraw/zinc/43/22/05/389432205.db2.gz	OZIDXHVIXZDZJP-UHFFFAOYSA-N	0	2	295.295	0.051	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H]1CCN(C)C1=O	ZINC000274758833	389505180	/nfs/dbraw/zinc/50/51/80/389505180.db2.gz	WZXQCOMCKJDADT-JTQLQIEISA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(N[C@@H]1CCCc2cn[nH]c21)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000374459476	389582028	/nfs/dbraw/zinc/58/20/28/389582028.db2.gz	DIRSDUOTMHRJAK-IWSPIJDZSA-N	0	2	250.258	0.569	20	5		CCBDLN
C[C@@]1(C(N)=O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000280233062	389599168	/nfs/dbraw/zinc/59/91/68/389599168.db2.gz	ZFDAQMUKFSKEOA-CYBMUJFWSA-N	0	2	293.279	0.638	20	5		CCBDLN
C[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182118996	389700452	/nfs/dbraw/zinc/70/04/52/389700452.db2.gz	HSPUNUNNTZBJJU-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
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O=C(N[C@@H]1CC[S@](=O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000436970674	389989159	/nfs/dbraw/zinc/98/91/59/389989159.db2.gz	FPOJFUCZZJVDGZ-XJZHNMMOSA-N	0	2	284.293	0.551	20	5		CCBDLN
Cn1c(C(=O)N=c2nc3n([nH]2)CCCC3)ccc1[N+](=O)[O-]	ZINC000457154265	390033007	/nfs/dbraw/zinc/03/30/07/390033007.db2.gz	PDLIVDOEGSTZST-UHFFFAOYSA-N	0	2	290.283	0.535	20	5		CCBDLN
Nc1c(C(=O)NCc2n[nH]c(=O)[nH]2)cc(F)cc1[N+](=O)[O-]	ZINC000358950921	144188230	/nfs/dbraw/zinc/18/82/30/144188230.db2.gz	LCJBGSFVWKAYQK-UHFFFAOYSA-N	0	2	296.218	0.070	20	5		CCBDLN
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1n[nH]c(=O)[nH]1	ZINC000358960579	144188273	/nfs/dbraw/zinc/18/82/73/144188273.db2.gz	ZHTGCRPJNRCPND-UHFFFAOYSA-N	0	2	277.240	0.277	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H](O)C2(CC2)C1	ZINC000368786898	304531385	/nfs/dbraw/zinc/53/13/85/304531385.db2.gz	PXIWSVLGDVIVNJ-LLVKDONJSA-N	0	2	278.264	0.897	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC[C@@H]1CO	ZINC000154065278	304532982	/nfs/dbraw/zinc/53/29/82/304532982.db2.gz	SWQUSEFSPGPMFD-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
NC(=O)[C@@H]1CCCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000282963862	303294235	/nfs/dbraw/zinc/29/42/35/303294235.db2.gz	LZCGUMNVNHTEQD-VIFPVBQESA-N	0	2	293.279	0.780	20	5		CCBDLN
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CO[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCOC1	ZINC000231221835	536833743	/nfs/dbraw/zinc/83/37/43/536833743.db2.gz	PQQHFDYSSFSKGN-CYBMUJFWSA-N	0	2	296.279	0.836	20	5		CCBDLN
O=C(NCCn1ccnn1)c1cc([N+](=O)[O-])ccc1O	ZINC000782827946	581321404	/nfs/dbraw/zinc/32/14/04/581321404.db2.gz	KLQLRCHMUJWRAU-UHFFFAOYSA-N	0	2	277.240	0.322	20	5		CCBDLN
C[C@@H]1CN(C)C(=O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000783756437	581359189	/nfs/dbraw/zinc/35/91/89/581359189.db2.gz	QDYXKAOFVZVDES-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
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CN(C(=O)C[N@H+](C)CC(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000739631053	581584423	/nfs/dbraw/zinc/58/44/23/581584423.db2.gz	BQLQISOMLHOIBF-UHFFFAOYSA-N	0	2	281.268	0.574	20	5		CCBDLN
CN(C(=O)C[N@@H+](C)CC(=O)[O-])c1ccc([N+](=O)[O-])cc1	ZINC000739631053	581584425	/nfs/dbraw/zinc/58/44/25/581584425.db2.gz	BQLQISOMLHOIBF-UHFFFAOYSA-N	0	2	281.268	0.574	20	5		CCBDLN
O=C([O-])C[C@H]1CSCC[N@@H+]1Cn1nccc1[N+](=O)[O-]	ZINC000739657111	581587921	/nfs/dbraw/zinc/58/79/21/581587921.db2.gz	BJSIVULVDNKDPT-QMMMGPOBSA-N	0	2	286.313	0.641	20	5		CCBDLN
O=C([O-])C[C@H]1CSCC[N@H+]1Cn1nccc1[N+](=O)[O-]	ZINC000739657111	581587923	/nfs/dbraw/zinc/58/79/23/581587923.db2.gz	BJSIVULVDNKDPT-QMMMGPOBSA-N	0	2	286.313	0.641	20	5		CCBDLN
CONC(=O)CNC(=O)c1c(Cl)cccc1[N+](=O)[O-]	ZINC000731051480	581752055	/nfs/dbraw/zinc/75/20/55/581752055.db2.gz	OAXNIAQVZXMNKM-UHFFFAOYSA-N	0	2	287.659	0.656	20	5		CCBDLN
COC(=O)CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1cccc(C)n1	ZINC000841121473	616582341	/nfs/dbraw/zinc/58/23/41/616582341.db2.gz	RFCNEUQZZVTXPP-NXEZZACHSA-N	0	2	293.279	0.561	20	5		CCBDLN
Cc1nn(C)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1Cl	ZINC000892127146	622602071	/nfs/dbraw/zinc/60/20/71/622602071.db2.gz	PTZDSXLZGHGKDC-PHDIDXHHSA-N	0	2	258.665	0.986	20	5		CCBDLN
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C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@@H](CO)C1	ZINC001149360283	800252428	/nfs/dbraw/zinc/25/24/28/800252428.db2.gz	XUWHHTAOYSHIKE-SNVBAGLBSA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@@H](CO)C1	ZINC001149360283	800252430	/nfs/dbraw/zinc/25/24/30/800252430.db2.gz	XUWHHTAOYSHIKE-SNVBAGLBSA-N	0	2	295.295	0.049	20	5		CCBDLN
CSc1nc(O[C@@H]2COC(=O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625211	805373559	/nfs/dbraw/zinc/37/35/59/805373559.db2.gz	SMPSBOCSDWTFFZ-BYPYZUCNSA-N	0	2	287.253	0.507	20	5		CCBDLN
Nc1c2c(=O)nccc-2[nH]n1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1	ZINC001169001062	836095888	/nfs/dbraw/zinc/09/58/88/836095888.db2.gz	CREAJRZFAGNRQI-HTQZYQBOSA-N	0	2	277.284	0.876	20	5		CCBDLN
CC(C)CNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001116651809	855805732	/nfs/dbraw/zinc/80/57/32/855805732.db2.gz	KIWAXJANXCRPQK-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
CCN1C[C@H](c2noc([C@@H]3C[C@H]3[N+](=O)[O-])n2)CC1=O	ZINC001326221306	913833107	/nfs/dbraw/zinc/83/31/07/913833107.db2.gz	GRHVUGPVIQHVGR-BWZBUEFSSA-N	0	2	266.257	0.538	20	5		CCBDLN
Cn1cc[nH+]c1Cn1cc([N+](=O)[O-])c(C(=O)[O-])n1	ZINC000229735870	960090758	/nfs/dbraw/zinc/09/07/58/960090758.db2.gz	DPKIZHVKWGDNHT-UHFFFAOYSA-N	0	2	251.202	0.271	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600236764	361899190	/nfs/dbraw/zinc/89/91/90/361899190.db2.gz	AZJBVYLPQCKBPT-VXGBXAGGSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(N[C@H]1COCCC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600394269	361942471	/nfs/dbraw/zinc/94/24/71/361942471.db2.gz	ZLKLTLLVUFRFFM-QMMMGPOBSA-N	0	2	280.236	0.388	20	5		CCBDLN
CNC(=O)C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000127303041	187295529	/nfs/dbraw/zinc/29/55/29/187295529.db2.gz	YFEFPMMUTUOQMN-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
Cn1nccc1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000339434089	215167237	/nfs/dbraw/zinc/16/72/37/215167237.db2.gz	PMKBRMOKBRYLTD-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCNC(=O)CC1	ZINC000185099099	351433079	/nfs/dbraw/zinc/43/30/79/351433079.db2.gz	QBZYSMUWGGWWJX-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
CC(C)NC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000217316396	351946862	/nfs/dbraw/zinc/94/68/62/351946862.db2.gz	BNXJDMIZDVBONE-QMMMGPOBSA-N	0	2	295.295	0.943	20	5		CCBDLN
O=C(NC[C@]1(O)CCSC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267123742	352746196	/nfs/dbraw/zinc/74/61/96/352746196.db2.gz	QCDGXDKTVPDQEG-GFCCVEGCSA-N	0	2	298.320	0.898	20	5		CCBDLN
O=C(NC[C@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267145462	352746849	/nfs/dbraw/zinc/74/68/49/352746849.db2.gz	VGWLMSVSVNTOIQ-QMMMGPOBSA-N	0	2	294.185	0.953	20	5		CCBDLN
O=C1N[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N2CCSC[C@H]12	ZINC000270777785	352983939	/nfs/dbraw/zinc/98/39/39/352983939.db2.gz	IPHNTNZBBNNEGL-MWLCHTKSSA-N	0	2	295.320	0.846	20	5		CCBDLN
CCN(CC(=O)OC)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272392793	353059147	/nfs/dbraw/zinc/05/91/47/353059147.db2.gz	LOFFFHUWJZKGAX-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
COC(=O)[C@@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272473621	353067079	/nfs/dbraw/zinc/06/70/79/353067079.db2.gz	ZOKYMJTUDDYDKD-ZETCQYMHSA-N	0	2	282.252	0.839	20	5		CCBDLN
O=C(NN1CCCNC1=O)c1ccc(F)cc1[N+](=O)[O-]	ZINC000272951375	353108746	/nfs/dbraw/zinc/10/87/46/353108746.db2.gz	OAQANOUXNONCLF-UHFFFAOYSA-N	0	2	282.231	0.794	20	5		CCBDLN
O=C(CN1CCOCC1=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000279684507	353309212	/nfs/dbraw/zinc/30/92/12/353309212.db2.gz	ATMGWQXEBMVEOG-UHFFFAOYSA-N	0	2	295.251	0.098	20	5		CCBDLN
C[C@@H]1OCC[C@@]1(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000279641173	353307384	/nfs/dbraw/zinc/30/73/84/353307384.db2.gz	YZTRLPYPIZBTNW-ISVAXAHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NCC(F)(F)CO)c1cccc(O)c1[N+](=O)[O-]	ZINC000295460012	353895587	/nfs/dbraw/zinc/89/55/87/353895587.db2.gz	XDXIHEPVGOMRMX-UHFFFAOYSA-N	0	2	276.195	0.658	20	5		CCBDLN
O=C(c1c[nH]c(=O)c([N+](=O)[O-])c1)N1CCc2[nH]nnc2C1	ZINC000346063148	355867715	/nfs/dbraw/zinc/86/77/15/355867715.db2.gz	JRCSSNIXRTXSCL-UHFFFAOYSA-N	0	2	290.239	0.012	20	5		CCBDLN
Cc1nc(NCCc2nc(N)no2)ccc1[N+](=O)[O-]	ZINC000348370667	355921032	/nfs/dbraw/zinc/92/10/32/355921032.db2.gz	WJNCTBWOWZBAHU-UHFFFAOYSA-N	0	2	264.245	0.170	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)(F)F)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353567539	356251073	/nfs/dbraw/zinc/25/10/73/356251073.db2.gz	JSZMNSVAVFBBND-MRVPVSSYSA-N	0	2	294.185	0.953	20	5		CCBDLN
O=C(N=c1cccn[nH]1)c1cc2c(c([N+](=O)[O-])c1)OCO2	ZINC000353742088	356284857	/nfs/dbraw/zinc/28/48/57/356284857.db2.gz	FSSBORZMSINGLW-UHFFFAOYSA-N	0	2	288.219	0.788	20	5		CCBDLN
CC(C)(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346377737	535310073	/nfs/dbraw/zinc/31/00/73/535310073.db2.gz	FHJTVLDRNCDPKT-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])s1	ZINC000359269113	356789932	/nfs/dbraw/zinc/78/99/32/356789932.db2.gz	ISFCLWAULAECNK-UHFFFAOYSA-N	0	2	269.242	0.410	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](O)C2(CC2)C1	ZINC000375981226	357422945	/nfs/dbraw/zinc/42/29/45/357422945.db2.gz	PHYKUHCQAMUSDK-LLVKDONJSA-N	0	2	278.264	0.897	20	5		CCBDLN
O=C(NCC[C@]1(O)CCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000593813364	360164390	/nfs/dbraw/zinc/16/43/90/360164390.db2.gz	NKAUWRZGEJTHMT-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=C(N[C@H](CO)CCF)c1cccc(O)c1[N+](=O)[O-]	ZINC000593862173	360179506	/nfs/dbraw/zinc/17/95/06/360179506.db2.gz	UOUVHUQCCCQHAV-ZETCQYMHSA-N	0	2	272.232	0.751	20	5		CCBDLN
CCCN(CC(=O)NC)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179445390	189194991	/nfs/dbraw/zinc/19/49/91/189194991.db2.gz	IKKOFEPEPRLDDS-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CN1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CCC1=O	ZINC000179510329	189198741	/nfs/dbraw/zinc/19/87/41/189198741.db2.gz	RBUAFBYLXRTECR-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC[C@@H](OC)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597441190	361095654	/nfs/dbraw/zinc/09/56/54/361095654.db2.gz	DXELXVTWMYJMLH-SNVBAGLBSA-N	0	2	270.241	0.900	20	5		CCBDLN
CN(Cc1cn(C)nn1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000598224326	361357423	/nfs/dbraw/zinc/35/74/23/361357423.db2.gz	FMLVJNWHMRJQQK-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC[C@@]2(O)C[C@H]2C1	ZINC000598228716	361358550	/nfs/dbraw/zinc/35/85/50/361358550.db2.gz	VZHJHDOCBPKJID-ISVAXAHUSA-N	0	2	278.264	0.897	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1	ZINC000615925283	365132749	/nfs/dbraw/zinc/13/27/49/365132749.db2.gz	XDBUMAZWRUIDSW-LLVKDONJSA-N	0	2	282.252	0.745	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1ncn(C)n1	ZINC000275708328	193110581	/nfs/dbraw/zinc/11/05/81/193110581.db2.gz	ZFEKBJIYKHIMMM-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
COC(=O)C[C@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280888528	195016492	/nfs/dbraw/zinc/01/64/92/195016492.db2.gz	BKUJNELPGJNGOX-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@H](O)CCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281040246	195080581	/nfs/dbraw/zinc/08/05/81/195080581.db2.gz	WHDDZMKCPHYYIC-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
Nc1nccnc1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000089531174	389016999	/nfs/dbraw/zinc/01/69/99/389016999.db2.gz	UOYZNXFKQQCBSL-UHFFFAOYSA-N	0	2	275.224	0.925	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000193168975	389063035	/nfs/dbraw/zinc/06/30/35/389063035.db2.gz	DHHHPPCRNBUTGF-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCNC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233472231	389162956	/nfs/dbraw/zinc/16/29/56/389162956.db2.gz	XOTJLXDJQARXGZ-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
O=C(NCc1nc[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC000133201497	389232259	/nfs/dbraw/zinc/23/22/59/389232259.db2.gz	TVLLSIIFUTYJHA-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
O=C(NCc1nnc[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC000133201497	389232262	/nfs/dbraw/zinc/23/22/62/389232262.db2.gz	TVLLSIIFUTYJHA-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
CCNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000182080908	389699008	/nfs/dbraw/zinc/69/90/08/389699008.db2.gz	FORBVUITPITPCP-UHFFFAOYSA-N	0	2	293.279	0.509	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H]1O	ZINC000436958497	389987601	/nfs/dbraw/zinc/98/76/01/389987601.db2.gz	HRQBKAQSLHVMFP-RDDDGLTNSA-N	0	2	266.253	0.753	20	5		CCBDLN
Cn1cnc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)n1	ZINC000437003362	389990380	/nfs/dbraw/zinc/99/03/80/389990380.db2.gz	SVYXRKPLKFVZJB-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000456909619	390020945	/nfs/dbraw/zinc/02/09/45/390020945.db2.gz	WVJATNRANCSYIL-SFYZADRCSA-N	0	2	293.279	0.684	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@H](CO)[C@H](O)C1	ZINC000567159646	390675200	/nfs/dbraw/zinc/67/52/00/390675200.db2.gz	SHFVBXVFDMADMN-PRHODGIISA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OCC1CC1	ZINC000263778738	131328826	/nfs/dbraw/zinc/32/88/26/131328826.db2.gz	VAOFGRWCLXKAST-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
O=C(NC[C@H]1CC[C@@H](CO)O1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000356516262	144009918	/nfs/dbraw/zinc/00/99/18/144009918.db2.gz	NTHSCOPSHDFLKO-ZJUUUORDSA-N	0	2	296.279	0.570	20	5		CCBDLN
CCn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000222635423	544822982	/nfs/dbraw/zinc/82/29/82/544822982.db2.gz	ATZFNUOJCVYYCQ-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
Cn1ncnc1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000162947405	303099536	/nfs/dbraw/zinc/09/95/36/303099536.db2.gz	UOFWPRGFLINCHY-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(N[C@H]1CCC(=O)NC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274711450	303940236	/nfs/dbraw/zinc/94/02/36/303940236.db2.gz	YBBBKKIOVFDUHM-ZETCQYMHSA-N	0	2	279.252	0.309	20	5		CCBDLN
C[C@@H]1C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000384821443	336131945	/nfs/dbraw/zinc/13/19/45/336131945.db2.gz	QBRFLESSWVRDRQ-APPZFPTMSA-N	0	2	266.253	0.896	20	5		CCBDLN
CC[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184761501	522987413	/nfs/dbraw/zinc/98/74/13/522987413.db2.gz	YJBSHEXGFDCIEY-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
COCCOCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000067861887	524008806	/nfs/dbraw/zinc/00/88/06/524008806.db2.gz	MKNVQSFHAQPQSO-UHFFFAOYSA-N	0	2	284.268	0.693	20	5		CCBDLN
O=C(N[C@@H]1CC[C@H]1O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000425040164	534770390	/nfs/dbraw/zinc/77/03/90/534770390.db2.gz	DKIPGGUAMVHTMW-PSASIEDQSA-N	0	2	252.226	0.554	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)NN2CN=NC2=O)c1	ZINC000782125557	581288598	/nfs/dbraw/zinc/28/85/98/581288598.db2.gz	KOPVJGVDQXAUJU-UHFFFAOYSA-N	0	2	263.213	0.584	20	5		CCBDLN
O=C(Cc1cccc([N+](=O)[O-])c1)OCc1n[nH]c(=O)[nH]1	ZINC000774960002	582005554	/nfs/dbraw/zinc/00/55/54/582005554.db2.gz	FUFFJAWVPYFRPA-UHFFFAOYSA-N	0	2	278.224	0.704	20	5		CCBDLN
CC(C)(NC(=O)C(F)(F)F)C(=O)OCCC[N+](=O)[O-]	ZINC000860920827	614164271	/nfs/dbraw/zinc/16/42/71/614164271.db2.gz	JIZDHQBRXMRQDT-UHFFFAOYSA-N	0	2	286.206	0.654	20	5		CCBDLN
COCCN1[C@H](C)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C[C@@H]1C	ZINC000844022211	616478311	/nfs/dbraw/zinc/47/83/11/616478311.db2.gz	LPAYZISGRPLJBG-WRWGMCAJSA-N	0	2	285.344	0.219	20	5		CCBDLN
COC(=O)N(C)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000855942399	616790189	/nfs/dbraw/zinc/79/01/89/616790189.db2.gz	DPKSEAXAUVBYQX-UHFFFAOYSA-N	0	2	297.267	0.728	20	5		CCBDLN
O=C(NCCc1n[nH]c(=S)o1)c1ccc([N+](=O)[O-])[nH]1	ZINC001154901087	800865184	/nfs/dbraw/zinc/86/51/84/800865184.db2.gz	RZTFFCOJBMTZQS-UHFFFAOYSA-N	0	2	283.269	0.567	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC[C@H]1COCO1	ZINC001228970199	805494294	/nfs/dbraw/zinc/49/42/94/805494294.db2.gz	HDRDMTVCNSZYNU-SSDOTTSWSA-N	0	2	257.198	0.758	20	5		CCBDLN
C[C@@]1(CO)C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001301121002	907955437	/nfs/dbraw/zinc/95/54/37/907955437.db2.gz	AFNRQSBJFMMARH-RNCFNFMXSA-N	0	2	296.279	0.258	20	5		CCBDLN
CCc1nn(C)c(NCCCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000091729734	349474178	/nfs/dbraw/zinc/47/41/78/349474178.db2.gz	PMJIZRBQDXBFSB-UHFFFAOYSA-N	0	2	295.303	0.347	20	5		CCBDLN
O=C(NC[C@@H](O)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600236761	361898703	/nfs/dbraw/zinc/89/87/03/361898703.db2.gz	AZJBVYLPQCKBPT-NEPJUHHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
Cn1nc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)ccc1=O	ZINC000302000411	232007066	/nfs/dbraw/zinc/00/70/66/232007066.db2.gz	VLAARODRCCNESU-UHFFFAOYSA-N	0	2	290.235	0.646	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1O	ZINC000273237535	192083813	/nfs/dbraw/zinc/08/38/13/192083813.db2.gz	PRAXMUOCLSLHPJ-MRVPVSSYSA-N	0	2	294.185	0.953	20	5		CCBDLN
C[C@@H](C(=O)[O-])[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000054069590	348539947	/nfs/dbraw/zinc/53/99/47/348539947.db2.gz	FUBGRQVWPVSLED-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
C[C@@H](C(=O)[O-])[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000054069590	348539949	/nfs/dbraw/zinc/53/99/49/348539949.db2.gz	FUBGRQVWPVSLED-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
CCOC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000065309830	348710785	/nfs/dbraw/zinc/71/07/85/348710785.db2.gz	CDNCCVQFAHJYRE-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
COC[C@](C)(O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000537767381	290875938	/nfs/dbraw/zinc/87/59/38/290875938.db2.gz	NXBZVYXXPQIGEP-NSHDSACASA-N	0	2	270.241	0.636	20	5		CCBDLN
O=C([O-])[C@@H]1COCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000088380328	349366503	/nfs/dbraw/zinc/36/65/03/349366503.db2.gz	XHOLVEAFSVAVAF-LBPRGKRZSA-N	0	2	280.280	0.923	20	5		CCBDLN
O=C([O-])[C@@H]1COCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1	ZINC000088380328	349366506	/nfs/dbraw/zinc/36/65/06/349366506.db2.gz	XHOLVEAFSVAVAF-LBPRGKRZSA-N	0	2	280.280	0.923	20	5		CCBDLN
C[C@H](C[S@](C)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000181676211	351331987	/nfs/dbraw/zinc/33/19/87/351331987.db2.gz	PHXIOHPYVPDKAB-XJZHNMMOSA-N	0	2	286.309	0.797	20	5		CCBDLN
COC[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OC	ZINC000227699081	352057519	/nfs/dbraw/zinc/05/75/19/352057519.db2.gz	QDIFBWKSOPHMOY-SECBINFHSA-N	0	2	284.268	0.692	20	5		CCBDLN
O=C(NC[C@@H]1CCC(=O)N1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236561316	352198097	/nfs/dbraw/zinc/19/80/97/352198097.db2.gz	HNUCYWUIDCNHPK-ZETCQYMHSA-N	0	2	279.252	0.309	20	5		CCBDLN
Cc1nnc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n1C	ZINC000354619624	137584329	/nfs/dbraw/zinc/58/43/29/137584329.db2.gz	LSAUTCINCNZVNM-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
COC[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1	ZINC000272411114	353061490	/nfs/dbraw/zinc/06/14/90/353061490.db2.gz	ORWSRFGWRTWYFH-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@H](CO)C1	ZINC000272357227	353055825	/nfs/dbraw/zinc/05/58/25/353055825.db2.gz	DSQTVCXUULAGEA-QMMMGPOBSA-N	0	2	266.253	0.755	20	5		CCBDLN
COC(=O)[C@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280809888	353385083	/nfs/dbraw/zinc/38/50/83/353385083.db2.gz	QKWKUFBHDGXUHU-LURJTMIESA-N	0	2	268.225	0.592	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@H](CO)O1	ZINC000331234195	354500309	/nfs/dbraw/zinc/50/03/09/354500309.db2.gz	KIKHWDDPNSRWPE-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])c1ncn(C)n1	ZINC000355033481	356554795	/nfs/dbraw/zinc/55/47/95/356554795.db2.gz	QKZQWHHOLRBOIX-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(Cn1cccnc1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000356317347	356745986	/nfs/dbraw/zinc/74/59/86/356745986.db2.gz	DOYTXTSWTWSRPS-UHFFFAOYSA-N	0	2	290.235	0.496	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1cc(F)cc([N+](=O)[O-])c1	ZINC000359816878	356902218	/nfs/dbraw/zinc/90/22/18/356902218.db2.gz	LRUYBWQMNITEAW-UHFFFAOYSA-N	0	2	281.203	0.488	20	5		CCBDLN
Nc1noc(CCNc2ncccc2[N+](=O)[O-])n1	ZINC000360238613	356974531	/nfs/dbraw/zinc/97/45/31/356974531.db2.gz	NYRYGTQCFRGDCR-UHFFFAOYSA-N	0	2	250.218	0.440	20	5		CCBDLN
CCn1cc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)nn1	ZINC000404450701	357821042	/nfs/dbraw/zinc/82/10/42/357821042.db2.gz	GJJXTNCWROCAKC-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(N[C@H]1CCNC(=O)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000591100982	359559240	/nfs/dbraw/zinc/55/92/40/359559240.db2.gz	SERFQBBRILMMJW-MRVPVSSYSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[S@@]2=O	ZINC000593876783	360189033	/nfs/dbraw/zinc/18/90/33/360189033.db2.gz	DSSVJPFMMWFPAP-VQXVYSPMSA-N	0	2	296.304	0.646	20	5		CCBDLN
O=C(C[C@H]1CC(=O)N1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597441342	361095615	/nfs/dbraw/zinc/09/56/15/361095615.db2.gz	GROGSZMAHMEKSV-ZCFIWIBFSA-N	0	2	265.225	0.518	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCOCCN1	ZINC000597706753	361203234	/nfs/dbraw/zinc/20/32/34/361203234.db2.gz	ZJAHNCCNFORDRP-UHFFFAOYSA-N	0	2	267.241	0.277	20	5		CCBDLN
COCCCN(CCO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000276056162	193200763	/nfs/dbraw/zinc/20/07/63/193200763.db2.gz	UUZZYWHALLLIRI-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
O=C(Nc1n[nH]c(-c2ccncc2)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000366590717	389305295	/nfs/dbraw/zinc/30/52/95/389305295.db2.gz	JCEIVYSOTMWRNM-HTQZYQBOSA-N	0	2	274.240	0.470	20	5		CCBDLN
CCC[C@H](O)[C@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000414013935	389592532	/nfs/dbraw/zinc/59/25/32/389592532.db2.gz	HBNGNWOJURMOBI-UWVGGRQHSA-N	0	2	298.295	0.552	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(=O)Nc2c(F)cccc21	ZINC000374675073	389599869	/nfs/dbraw/zinc/59/98/69/389599869.db2.gz	CJDJMPXDDZNYBK-HZGVNTEJSA-N	0	2	279.227	0.776	20	5		CCBDLN
O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1C[NH2+]CCO1	ZINC000415091878	389657493	/nfs/dbraw/zinc/65/74/93/389657493.db2.gz	DGOOXDGBHBVVPL-LLVKDONJSA-N	0	2	251.286	0.673	20	5		CCBDLN
O=C(NCCn1cncn1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000351830800	389693946	/nfs/dbraw/zinc/69/39/46/389693946.db2.gz	HMQCSCSFAIJGFR-UHFFFAOYSA-N	0	2	277.240	0.322	20	5		CCBDLN
CCN1CCOC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000367486377	285349423	/nfs/dbraw/zinc/34/94/23/285349423.db2.gz	RBDJEULCHCPEKJ-LLVKDONJSA-N	0	2	295.295	0.960	20	5		CCBDLN
CCn1ncnc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436917999	389987075	/nfs/dbraw/zinc/98/70/75/389987075.db2.gz	ZLUGOFFHPGHDMV-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000567117117	390673023	/nfs/dbraw/zinc/67/30/23/390673023.db2.gz	XRLDJJGAPMFJDZ-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)CCO1	ZINC000567117117	390673025	/nfs/dbraw/zinc/67/30/25/390673025.db2.gz	XRLDJJGAPMFJDZ-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
COC(=O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000358301538	533535153	/nfs/dbraw/zinc/53/51/53/533535153.db2.gz	PWFWDVHQTIJKCS-UHFFFAOYSA-N	0	2	254.198	0.203	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC[S@]1=O	ZINC000352753226	300193875	/nfs/dbraw/zinc/19/38/75/300193875.db2.gz	OFTGXXYLNXCGEA-FHZGZLOMSA-N	0	2	298.320	0.893	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC(=O)N1	ZINC000295833157	300194177	/nfs/dbraw/zinc/19/41/77/300194177.db2.gz	CRQFSLDYJAPGBK-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC1=O	ZINC000553650896	334394555	/nfs/dbraw/zinc/39/45/55/334394555.db2.gz	CXMJTEPQWWDMME-UHFFFAOYSA-N	0	2	279.252	0.215	20	5		CCBDLN
O=C(NCCc1cn[nH]c1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000379961309	335281956	/nfs/dbraw/zinc/28/19/56/335281956.db2.gz	KUCCWWMAUZNNOR-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
C[C@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436969829	533759779	/nfs/dbraw/zinc/75/97/79/533759779.db2.gz	ARSOOGMZXYQWQA-ZCFIWIBFSA-N	0	2	267.241	0.294	20	5		CCBDLN
CC(C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184834875	519360724	/nfs/dbraw/zinc/36/07/24/519360724.db2.gz	VMBDNNMTIWRPHT-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
CC(C)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184664280	519703798	/nfs/dbraw/zinc/70/37/98/519703798.db2.gz	MOIPFJNKYBSCTK-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1CCNC1=O	ZINC000340708201	523938008	/nfs/dbraw/zinc/93/80/08/523938008.db2.gz	HDVDYYDRUZRFEX-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CC[S@](=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779663359	581198190	/nfs/dbraw/zinc/19/81/90/581198190.db2.gz	FPWXJIVPJCJPOR-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
Cn1nc(COC(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]c1=O	ZINC000765495514	581520282	/nfs/dbraw/zinc/52/02/82/581520282.db2.gz	SRLBBQLLIIQMIJ-UHFFFAOYSA-N	0	2	294.223	0.079	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@@H](NC(=O)[O-])C2)c(C)c1[N+](=O)[O-]	ZINC000740253670	581652100	/nfs/dbraw/zinc/65/21/00/581652100.db2.gz	QUCTZZAOUZWIKO-SECBINFHSA-N	0	2	283.288	0.708	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@@H](NC(=O)[O-])C2)c(C)c1[N+](=O)[O-]	ZINC000740253670	581652104	/nfs/dbraw/zinc/65/21/04/581652104.db2.gz	QUCTZZAOUZWIKO-SECBINFHSA-N	0	2	283.288	0.708	20	5		CCBDLN
Cn1cc([N+](=O)[O-])cc1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774908420	582001849	/nfs/dbraw/zinc/00/18/49/582001849.db2.gz	GDDHRQZFCDVGFJ-UHFFFAOYSA-N	0	2	267.201	0.114	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1cc([N+](=O)[O-])ccc1F	ZINC000774925315	582002945	/nfs/dbraw/zinc/00/29/45/582002945.db2.gz	YXDVHXHSAJWVEO-UHFFFAOYSA-N	0	2	282.187	0.915	20	5		CCBDLN
O=C(CNc1ccccc1[N+](=O)[O-])NOCCO	ZINC000776580574	582079976	/nfs/dbraw/zinc/07/99/76/582079976.db2.gz	XPTMCTDBTXJEJE-UHFFFAOYSA-N	0	2	255.230	0.047	20	5		CCBDLN
O=C([O-])c1cc(NC(=O)[C@H]2CCC[NH2+]2)cc([N+](=O)[O-])c1	ZINC000833301177	600975119	/nfs/dbraw/zinc/97/51/19/600975119.db2.gz	QQVTVMGCJHXMPX-SNVBAGLBSA-N	0	2	279.252	0.984	20	5		CCBDLN
CC(C)(C(=O)NOCCO)c1ccccc1[N+](=O)[O-]	ZINC000816175479	614299683	/nfs/dbraw/zinc/29/96/83/614299683.db2.gz	ZIDWZXIIVUUNJX-UHFFFAOYSA-N	0	2	268.269	0.913	20	5		CCBDLN
CC(C)(C)n1[nH]cnc1=NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839759314	614058891	/nfs/dbraw/zinc/05/88/91/614058891.db2.gz	NGFSYYKZOUXXGG-RNFRBKRXSA-N	0	2	253.262	0.059	20	5		CCBDLN
CC(C)(C)n1[nH]cnc1=NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839759314	614058892	/nfs/dbraw/zinc/05/88/92/614058892.db2.gz	NGFSYYKZOUXXGG-RNFRBKRXSA-N	0	2	253.262	0.059	20	5		CCBDLN
CC1(C)COC(=O)[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000808106768	614713472	/nfs/dbraw/zinc/71/34/72/614713472.db2.gz	HENNGDFEJBZRTI-JTQLQIEISA-N	0	2	294.263	0.982	20	5		CCBDLN
Cc1nn(C)c(N2CCC2)c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000913245770	636785022	/nfs/dbraw/zinc/78/50/22/636785022.db2.gz	ZTUYWRLEFVCRDD-RKDXNWHRSA-N	0	2	279.300	0.542	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@H]2C[C@@]2(CO)C1	ZINC000803154783	640718619	/nfs/dbraw/zinc/71/86/19/640718619.db2.gz	AVJWRBOACKXFKR-OQPBUACISA-N	0	2	278.264	0.755	20	5		CCBDLN
NC(=O)[C@@H]1Cc2ccccc2N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000840314896	641058176	/nfs/dbraw/zinc/05/81/76/641058176.db2.gz	PADYSIKNXZFISW-CKYFFXLPSA-N	0	2	289.291	0.342	20	5		CCBDLN
O=C(Nc1nc2ccc(Cl)cn2n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841157600	642806007	/nfs/dbraw/zinc/80/60/07/642806007.db2.gz	HJTKMDXTTNMYHV-RNFRBKRXSA-N	0	2	281.659	0.986	20	5		CCBDLN
O=[N+]([O-])c1c(O)cccc1O[C@H]1CCS(=O)(=O)C1	ZINC001225621027	805144971	/nfs/dbraw/zinc/14/49/71/805144971.db2.gz	ZIKMCGCEYUFQMG-ZETCQYMHSA-N	0	2	273.266	0.866	20	5		CCBDLN
CCN1CC(Oc2nc(SC)[nH]c(=O)c2[N+](=O)[O-])C1	ZINC001227625227	805373734	/nfs/dbraw/zinc/37/37/34/805373734.db2.gz	SXGQXLSGXMTSIG-UHFFFAOYSA-N	0	2	286.313	0.895	20	5		CCBDLN
CSc1nc(OC2COCOC2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624799	805374394	/nfs/dbraw/zinc/37/43/94/805374394.db2.gz	FLNYEEDAAZHGOY-UHFFFAOYSA-N	0	2	289.269	0.564	20	5		CCBDLN
O=C(NCc1nnc([C@@H]2C[C@H]2[N+](=O)[O-])o1)c1cccnc1	ZINC001261577260	809023535	/nfs/dbraw/zinc/02/35/35/809023535.db2.gz	RFUSAAHHLXKEOG-RKDXNWHRSA-N	0	2	289.251	0.527	20	5		CCBDLN
C[NH+]1CCN(C(=O)c2ccc([O-])c([N+](=O)[O-])c2)CC1	ZINC000183287513	290031520	/nfs/dbraw/zinc/03/15/20/290031520.db2.gz	SNCKEJZGECBWHL-UHFFFAOYSA-N	0	2	265.269	0.688	20	5		CCBDLN
O=C(N[C@@H]1CCOC[C@H]1O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600585128	362013853	/nfs/dbraw/zinc/01/38/53/362013853.db2.gz	GPBCWGYGAQFDEE-LDYMZIIASA-N	0	2	282.252	0.180	20	5		CCBDLN
CNC(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000456494695	529872099	/nfs/dbraw/zinc/87/20/99/529872099.db2.gz	CZLRPPWVGRAQIH-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
CN(CC(=O)N[C@H]1C[C@@H](CO)C1)c1ccccc1[N+](=O)[O-]	ZINC000601712812	362361506	/nfs/dbraw/zinc/36/15/06/362361506.db2.gz	DVEJJWDIHSYLDK-PHIMTYICSA-N	0	2	293.323	0.918	20	5		CCBDLN
CN(Cc1nncn1C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000315134109	137079134	/nfs/dbraw/zinc/07/91/34/137079134.db2.gz	RYEISNRSCDBZBF-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H]1COC[C@H]1O	ZINC000342408627	137092637	/nfs/dbraw/zinc/09/26/37/137092637.db2.gz	HIBGLMZSVUVWLI-GHMZBOCLSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=c1[nH]nc(SCCn2cc([N+](=O)[O-])ccc2=O)[nH]1	ZINC000187629308	351549672	/nfs/dbraw/zinc/54/96/72/351549672.db2.gz	XJROIZLMZOAERR-UHFFFAOYSA-N	0	2	283.269	0.373	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000217316826	351946603	/nfs/dbraw/zinc/94/66/03/351946603.db2.gz	GNPUCGJFRIWGQL-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
CC(=O)NCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000218152477	351954865	/nfs/dbraw/zinc/95/48/65/351954865.db2.gz	TZASRDXXGHMFBN-UHFFFAOYSA-N	0	2	253.214	0.375	20	5		CCBDLN
COC(=O)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000271650992	191260417	/nfs/dbraw/zinc/26/04/17/191260417.db2.gz	ZPNAVDTZQRKDKO-LURJTMIESA-N	0	2	283.240	0.983	20	5		CCBDLN
COC[C@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272431603	353063373	/nfs/dbraw/zinc/06/33/73/353063373.db2.gz	SFYUOQBAVJQDRI-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(N[C@]1(CO)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274819655	353165001	/nfs/dbraw/zinc/16/50/01/353165001.db2.gz	XBUKOSLVYREAEU-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
C[C@@H]1OCC[C@@]1(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000279503281	353305011	/nfs/dbraw/zinc/30/50/11/353305011.db2.gz	NZWLBSXTYCLRHA-ISVAXAHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN(CC(=O)NC1CC1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157464523	188319059	/nfs/dbraw/zinc/31/90/59/188319059.db2.gz	QJPPINRKUGGTPN-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NC1COCCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000313629979	354216903	/nfs/dbraw/zinc/21/69/03/354216903.db2.gz	ZFPWGCMTXBNVCS-UHFFFAOYSA-N	0	2	282.252	0.446	20	5		CCBDLN
Cc1nc(NS(=O)(=O)c2ccccc2[N+](=O)[O-])nn1C	ZINC000427649278	235374839	/nfs/dbraw/zinc/37/48/39/235374839.db2.gz	WQYPWIHCFVZBQU-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
Cc1nn(C)c(NCCc2nc(N)no2)c1[N+](=O)[O-]	ZINC000360236780	137984536	/nfs/dbraw/zinc/98/45/36/137984536.db2.gz	DDQZPJUOGWOBER-UHFFFAOYSA-N	0	2	267.249	0.087	20	5		CCBDLN
C[C@@H](CCO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354475313	356420221	/nfs/dbraw/zinc/42/02/21/356420221.db2.gz	IOBZPNKNGXNZPC-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCn2ncnc2C1	ZINC000354486117	356423169	/nfs/dbraw/zinc/42/31/69/356423169.db2.gz	BOQRBOLTPJICPN-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
O=C(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])NCC1CC1	ZINC000354709097	356479468	/nfs/dbraw/zinc/47/94/68/356479468.db2.gz	FNLNMZAPKHQBCG-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
COCCOC1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000359477952	356829531	/nfs/dbraw/zinc/82/95/31/356829531.db2.gz	GKRMZJLNKIVTKU-UHFFFAOYSA-N	0	2	296.279	0.788	20	5		CCBDLN
COCC1(O)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000456074692	236360338	/nfs/dbraw/zinc/36/03/38/236360338.db2.gz	DNCAAEUWFDWUKF-UHFFFAOYSA-N	0	2	282.252	0.134	20	5		CCBDLN
CC(C)(CO)ONC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000297123518	200091142	/nfs/dbraw/zinc/09/11/42/200091142.db2.gz	HDSYXBAMGWTORC-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
CC[C@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281043136	195082041	/nfs/dbraw/zinc/08/20/41/195082041.db2.gz	WPELQNLAXJSJPM-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
COC(=O)[C@H](CF)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000288173891	197019427	/nfs/dbraw/zinc/01/94/27/197019427.db2.gz	GRUKFGYFMYPFFS-QMMMGPOBSA-N	0	2	286.215	0.541	20	5		CCBDLN
CCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184605205	388775837	/nfs/dbraw/zinc/77/58/37/388775837.db2.gz	UYZRAWDBAOVGRE-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
CCn1ncnc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355495675	389085104	/nfs/dbraw/zinc/08/51/04/389085104.db2.gz	JCADSDYOVRASMN-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
C[C@]1(O)CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000280874460	389604465	/nfs/dbraw/zinc/60/44/65/389604465.db2.gz	BXYCMOMKYZOPES-LBPRGKRZSA-N	0	2	266.253	0.897	20	5		CCBDLN
CN(C)C(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179434932	389655927	/nfs/dbraw/zinc/65/59/27/389655927.db2.gz	RQTQNUGSHRADJT-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=c1[nH]c(=O)c([N+](=O)[O-])c(C=Cc2cocn2)[nH]1	ZINC000352013815	389735413	/nfs/dbraw/zinc/73/54/13/389735413.db2.gz	MPKYIDIUKZHBFI-OWOJBTEDSA-N	0	2	250.170	0.954	20	5		CCBDLN
CCCN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436836484	389986108	/nfs/dbraw/zinc/98/61/08/389986108.db2.gz	YWGBUYSFYLWTAS-UHFFFAOYSA-N	0	2	281.268	0.638	20	5		CCBDLN
O=C(NC[C@@H]1COCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000436965639	389988140	/nfs/dbraw/zinc/98/81/40/389988140.db2.gz	LDWIJEYJOKQORL-SECBINFHSA-N	0	2	282.252	0.446	20	5		CCBDLN
Nc1ncncc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436967569	389988247	/nfs/dbraw/zinc/98/82/47/389988247.db2.gz	QARVWWFSCYXLGX-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
NC(=O)CC1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCC1	ZINC000436964505	389988577	/nfs/dbraw/zinc/98/85/77/389988577.db2.gz	GSTJOJKPHVEBHV-UHFFFAOYSA-N	0	2	293.279	0.828	20	5		CCBDLN
O=C(N[C@@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000436970673	389989364	/nfs/dbraw/zinc/98/93/64/389989364.db2.gz	FPOJFUCZZJVDGZ-QOLSBQFWSA-N	0	2	284.293	0.551	20	5		CCBDLN
CCN(C)C(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000191675055	130275909	/nfs/dbraw/zinc/27/59/09/130275909.db2.gz	BKGVKYYVPUNQLM-MRVPVSSYSA-N	0	2	295.295	0.897	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CSc1n[n-]c(=[NH2+])n1C1CC1	ZINC000356567235	144014895	/nfs/dbraw/zinc/01/48/95/144014895.db2.gz	PJDSTFGEZCLUQJ-UHFFFAOYSA-N	0	2	295.328	0.960	20	5		CCBDLN
C[C@@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1nnc[nH]1	ZINC000356623165	144019944	/nfs/dbraw/zinc/01/99/44/144019944.db2.gz	TUBRUBDIOPCCPH-ZCFIWIBFSA-N	0	2	277.240	0.910	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000161457604	290142973	/nfs/dbraw/zinc/14/29/73/290142973.db2.gz	RBXRVGOQECCIOS-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1=O	ZINC000230262118	290143331	/nfs/dbraw/zinc/14/33/31/290143331.db2.gz	FSSQEBMTRRPZLO-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000263821086	290277178	/nfs/dbraw/zinc/27/71/78/290277178.db2.gz	UPNMFKPNUCWGMW-QMMMGPOBSA-N	0	2	279.252	0.261	20	5		CCBDLN
NC(=O)[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436969398	303298868	/nfs/dbraw/zinc/29/88/68/303298868.db2.gz	XZXLJOZQLBYONF-VIFPVBQESA-N	0	2	279.252	0.390	20	5		CCBDLN
Cn1nncc1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000493637207	534362414	/nfs/dbraw/zinc/36/24/14/534362414.db2.gz	WGDGAQDDXXPNHP-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1csc([N+](=O)[O-])c1	ZINC000358358566	534702432	/nfs/dbraw/zinc/70/24/32/534702432.db2.gz	PKJBUNSRHXASDV-UHFFFAOYSA-N	0	2	269.242	0.410	20	5		CCBDLN
CCN(CC)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779659282	581197404	/nfs/dbraw/zinc/19/74/04/581197404.db2.gz	QZBFVPZPCHXRCR-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
C[N@H+](CC(=O)[O-])CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000739631093	581584382	/nfs/dbraw/zinc/58/43/82/581584382.db2.gz	HMYWBWTYOSTTBB-UHFFFAOYSA-N	0	2	293.279	0.500	20	5		CCBDLN
C[N@@H+](CC(=O)[O-])CC(=O)N1CCc2cc([N+](=O)[O-])ccc21	ZINC000739631093	581584384	/nfs/dbraw/zinc/58/43/84/581584384.db2.gz	HMYWBWTYOSTTBB-UHFFFAOYSA-N	0	2	293.279	0.500	20	5		CCBDLN
Cn1cc[nH+]c1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000229003863	581904592	/nfs/dbraw/zinc/90/45/92/581904592.db2.gz	SLNMGECPSLXMTG-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1csc([N+](=O)[O-])c1	ZINC000774929244	582002924	/nfs/dbraw/zinc/00/29/24/582002924.db2.gz	ASONXYIUTGMUSX-UHFFFAOYSA-N	0	2	270.226	0.837	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1F	ZINC000774932364	582003224	/nfs/dbraw/zinc/00/32/24/582003224.db2.gz	DUKXKYFBONYFGK-UHFFFAOYSA-N	0	2	282.187	0.915	20	5		CCBDLN
C[C@@H]1C[C@H]1C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750764027	582058587	/nfs/dbraw/zinc/05/85/87/582058587.db2.gz	REYOHZWFCPMBSN-HTRCEHHLSA-N	0	2	285.281	0.451	20	5		CCBDLN
CON(C)C(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000863629576	617067046	/nfs/dbraw/zinc/06/70/46/617067046.db2.gz	TYNVCDZQKQCZOO-ZETCQYMHSA-N	0	2	297.267	0.439	20	5		CCBDLN
C[C@@H]1Cn2nccc2N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000893880566	631479771	/nfs/dbraw/zinc/47/97/71/631479771.db2.gz	JWIWAPUJELBBRH-DJLDLDEBSA-N	0	2	250.258	0.531	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H](CO)Cc2cccc(F)c21	ZINC000911686144	636340564	/nfs/dbraw/zinc/34/05/64/636340564.db2.gz	HIICOVCAZNVTLQ-MKPLZMMCSA-N	0	2	294.282	0.989	20	5		CCBDLN
CCN(CC(=O)NC)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233422746	638199489	/nfs/dbraw/zinc/19/94/89/638199489.db2.gz	GUXSWJVXRMYVKL-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(Nn1cc(Br)cn1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839711404	640357314	/nfs/dbraw/zinc/35/73/14/640357314.db2.gz	VOSCNGVDSNSPMJ-PHDIDXHHSA-N	0	2	275.062	0.381	20	5		CCBDLN
Cc1cc2nccc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])n2n1	ZINC000856466107	644420787	/nfs/dbraw/zinc/42/07/87/644420787.db2.gz	FSAXGTBEDMGQTD-HTQZYQBOSA-N	0	2	261.241	0.641	20	5		CCBDLN
O=C(C[C@@H]1CC(=O)NC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC001153455785	800631263	/nfs/dbraw/zinc/63/12/63/800631263.db2.gz	NVXYBVJZYHZDDA-ZCFIWIBFSA-N	0	2	293.235	0.292	20	5		CCBDLN
CN1CCO[C@@H](COc2cccc(O)c2[N+](=O)[O-])C1=O	ZINC001225620153	805145149	/nfs/dbraw/zinc/14/51/49/805145149.db2.gz	NXWRENRUHAFMGU-JTQLQIEISA-N	0	2	282.252	0.536	20	5		CCBDLN
CC(=O)N1CC(Oc2cc(O)cc(O)c2[N+](=O)[O-])C1	ZINC001228970117	805494144	/nfs/dbraw/zinc/49/41/44/805494144.db2.gz	GDRWTGYQXWEQQU-UHFFFAOYSA-N	0	2	268.225	0.616	20	5		CCBDLN
CC(=O)N[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC001299651521	904071985	/nfs/dbraw/zinc/07/19/85/904071985.db2.gz	WJHXOPXCIFUCDN-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
Cn1nnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1C(F)F	ZINC001289530850	906080751	/nfs/dbraw/zinc/08/07/51/906080751.db2.gz	DMSOLQLAKONWDH-QWWZWVQMSA-N	0	2	261.188	0.356	20	5		CCBDLN
COC(=O)[C@H]1CCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001304094150	908142243	/nfs/dbraw/zinc/14/22/43/908142243.db2.gz	NUXJVEGCIGUOEM-SECBINFHSA-N	0	2	280.236	0.688	20	5		CCBDLN
O=C(N[C@@H]1COCCC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600393670	361942621	/nfs/dbraw/zinc/94/26/21/361942621.db2.gz	VHABBUNHTQFZQC-SECBINFHSA-N	0	2	280.236	0.388	20	5		CCBDLN
CN1CCOC[C@H]1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600421358	361956804	/nfs/dbraw/zinc/95/68/04/361956804.db2.gz	NFGMMWNSXTXDOI-SECBINFHSA-N	0	2	295.295	0.361	20	5		CCBDLN
COC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600396732	361945005	/nfs/dbraw/zinc/94/50/05/361945005.db2.gz	VWOUWHNYLNAVDQ-UHFFFAOYSA-N	0	2	298.251	0.220	20	5		CCBDLN
O=C(NC[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600504231	361997529	/nfs/dbraw/zinc/99/75/29/361997529.db2.gz	FKKFYEATFJBRHG-OTSSQURYSA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(N[C@H]1[C@@H]2COC[C@@H]21)c1cc([N+](=O)[O-])ccc1O	ZINC000436915661	303994511	/nfs/dbraw/zinc/99/45/11/303994511.db2.gz	RSIJNINBEXXGEM-JZYVYDRUSA-N	0	2	264.237	0.675	20	5		CCBDLN
Cn1cc(CNC(=O)c2cccc(O)c2[N+](=O)[O-])cn1	ZINC000343155064	137118459	/nfs/dbraw/zinc/11/84/59/137118459.db2.gz	RYAQXMRYOJEGHN-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CC[N@@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000089531333	349392424	/nfs/dbraw/zinc/39/24/24/349392424.db2.gz	FXVXFENCJYPEAG-LBPRGKRZSA-N	0	2	295.295	0.960	20	5		CCBDLN
CC[N@H+]1CCO[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000089531333	349392429	/nfs/dbraw/zinc/39/24/29/349392429.db2.gz	FXVXFENCJYPEAG-LBPRGKRZSA-N	0	2	295.295	0.960	20	5		CCBDLN
O=C(NC[C@@]1(O)CCSC1)c1cc([N+](=O)[O-])ccc1O	ZINC000271284325	191050369	/nfs/dbraw/zinc/05/03/69/191050369.db2.gz	ORINEQPLRGBJDM-LBPRGKRZSA-N	0	2	298.320	0.898	20	5		CCBDLN
CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCC1=O	ZINC000132346024	350305327	/nfs/dbraw/zinc/30/53/27/350305327.db2.gz	XLWRVZHBTMFASJ-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C([O-])c1cnc(NCC[NH+]2CCOCC2)c([N+](=O)[O-])c1	ZINC000107272995	186164692	/nfs/dbraw/zinc/16/46/92/186164692.db2.gz	HNHCCAGLGARVIS-UHFFFAOYSA-N	0	2	296.283	0.432	20	5		CCBDLN
CC(=O)N1CC(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)C1	ZINC000188434394	351595326	/nfs/dbraw/zinc/59/53/26/351595326.db2.gz	LGFWTSVZIINDJE-UHFFFAOYSA-N	0	2	279.252	0.717	20	5		CCBDLN
C[C@@H](C[S@@](C)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316547	351946891	/nfs/dbraw/zinc/94/68/91/351946891.db2.gz	QECCTFNWFZTTPP-ZDVLTJLQSA-N	0	2	286.309	0.797	20	5		CCBDLN
CS(=O)(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000226385980	352025052	/nfs/dbraw/zinc/02/50/52/352025052.db2.gz	GNQXPXNLYFHWMP-UHFFFAOYSA-N	0	2	288.281	0.075	20	5		CCBDLN
CNC(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234352058	352158006	/nfs/dbraw/zinc/15/80/06/352158006.db2.gz	QPECTBMQVNANMT-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
O=C(NCC1(CO)COC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272434187	353064141	/nfs/dbraw/zinc/06/41/41/353064141.db2.gz	SQZGAVQHXSKABN-UHFFFAOYSA-N	0	2	282.252	0.039	20	5		CCBDLN
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@@H]1COCCO1	ZINC000275174845	353192165	/nfs/dbraw/zinc/19/21/65/353192165.db2.gz	XREKULNSXSLHSE-JTQLQIEISA-N	0	2	268.225	0.654	20	5		CCBDLN
CCN(CCOCCO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000282366274	353417677	/nfs/dbraw/zinc/41/76/77/353417677.db2.gz	FZSCUMXWWMNUHO-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
CC(=O)NCCN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000308251675	354183204	/nfs/dbraw/zinc/18/32/04/354183204.db2.gz	BLLDMQTYZYHEEI-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H](CO)O1	ZINC000331234196	354500443	/nfs/dbraw/zinc/50/04/43/354500443.db2.gz	KIKHWDDPNSRWPE-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCNC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000294235715	198963646	/nfs/dbraw/zinc/96/36/46/198963646.db2.gz	ZJCRPRDVPUUQAZ-UHFFFAOYSA-N	0	2	296.283	0.349	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCO[C@@H]2C[C@@H]21	ZINC000590435231	359461271	/nfs/dbraw/zinc/46/12/71/359461271.db2.gz	PZDGJTPRDPADAK-GXSJLCMTSA-N	0	2	264.237	0.914	20	5		CCBDLN
COC[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000593810813	360162358	/nfs/dbraw/zinc/16/23/58/360162358.db2.gz	RDMHXVOGHLTUFN-VHSXEESVSA-N	0	2	296.279	0.522	20	5		CCBDLN
CO[C@](C)(CO)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000594398802	360292355	/nfs/dbraw/zinc/29/23/55/360292355.db2.gz	QKDSURCOOTXQCZ-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
CN(C[C@@H]1COCCO1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000598174212	361347672	/nfs/dbraw/zinc/34/76/72/361347672.db2.gz	CKYRNSKHNYDVKD-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
CN(C[C@H]1COCCO1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000598174211	361347983	/nfs/dbraw/zinc/34/79/83/361347983.db2.gz	CKYRNSKHNYDVKD-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
Cc1cc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])on1	ZINC000564765465	291298144	/nfs/dbraw/zinc/29/81/44/291298144.db2.gz	YMPYDVBKRYABHD-UHFFFAOYSA-N	0	2	298.280	0.765	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1	ZINC000615925286	365132305	/nfs/dbraw/zinc/13/23/05/365132305.db2.gz	XDBUMAZWRUIDSW-NSHDSACASA-N	0	2	282.252	0.745	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC(CO)C1	ZINC000331985107	204360875	/nfs/dbraw/zinc/36/08/75/204360875.db2.gz	OERPGHDKJHZYGX-UHFFFAOYSA-N	0	2	252.226	0.365	20	5		CCBDLN
O=C(N[C@H]1CCCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000077280355	284586780	/nfs/dbraw/zinc/58/67/80/284586780.db2.gz	SCOJFESRCCPGQH-VIFPVBQESA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@H](CO)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000281072699	195092547	/nfs/dbraw/zinc/09/25/47/195092547.db2.gz	FEMFOXRIMRFJLC-DTWKUNHWSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(N[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000185515140	388807260	/nfs/dbraw/zinc/80/72/60/388807260.db2.gz	XDRXQJWNWZRHNU-SSDOTTSWSA-N	0	2	252.226	0.819	20	5		CCBDLN
CC1(C)C(=O)NCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280899153	389605710	/nfs/dbraw/zinc/60/57/10/389605710.db2.gz	HMBFJDONACQXDU-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NC[C@@]1(O)CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000351874504	389705650	/nfs/dbraw/zinc/70/56/50/389705650.db2.gz	JULDDAKEZBZXQX-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
O=C(NCc1[nH]cc[nH+]1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000436668476	389982384	/nfs/dbraw/zinc/98/23/84/389982384.db2.gz	CMDZPCUXHDHVIF-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
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CC(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000191490989	130244349	/nfs/dbraw/zinc/24/43/49/130244349.db2.gz	MYMUQLKYPGYTED-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
CCNC(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000357415263	144089358	/nfs/dbraw/zinc/08/93/58/144089358.db2.gz	ZUMSYKPJMWXPPJ-UHFFFAOYSA-N	0	2	267.241	0.765	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@H]1O	ZINC000436890145	397534694	/nfs/dbraw/zinc/53/46/94/397534694.db2.gz	DSMDSTQBSKNSNN-RDDDGLTNSA-N	0	2	266.253	0.753	20	5		CCBDLN
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C[C@@H]1CO[C@H](CO)CN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000450199740	297165807	/nfs/dbraw/zinc/16/58/07/297165807.db2.gz	VHEANQCQVGUTMC-BDAKNGLRSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC(=O)N1C	ZINC000282336057	296920840	/nfs/dbraw/zinc/92/08/40/296920840.db2.gz	KTMLHILPDJLUQS-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
CCN(CCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184641288	521094889	/nfs/dbraw/zinc/09/48/89/521094889.db2.gz	LGJWYHNVVGXRBN-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
Cc1c(C(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000358358615	533798908	/nfs/dbraw/zinc/79/89/08/533798908.db2.gz	QBZPWLFCFCLNIX-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
COC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000269322725	536404912	/nfs/dbraw/zinc/40/49/12/536404912.db2.gz	FQCCNMWZPJCUAB-UHFFFAOYSA-N	0	2	295.251	0.481	20	5		CCBDLN
O=C([O-])C[C@@H]1CSCC[N@@H+]1Cn1nccc1[N+](=O)[O-]	ZINC000739657109	581587517	/nfs/dbraw/zinc/58/75/17/581587517.db2.gz	BJSIVULVDNKDPT-MRVPVSSYSA-N	0	2	286.313	0.641	20	5		CCBDLN
O=C([O-])C[C@@H]1CSCC[N@H+]1Cn1nccc1[N+](=O)[O-]	ZINC000739657109	581587519	/nfs/dbraw/zinc/58/75/19/581587519.db2.gz	BJSIVULVDNKDPT-MRVPVSSYSA-N	0	2	286.313	0.641	20	5		CCBDLN
Cc1nc(COC(=O)c2ccc([N+](=O)[O-])[nH]2)n[nH]1	ZINC000770641533	581759140	/nfs/dbraw/zinc/75/91/40/581759140.db2.gz	YBAQCOALQKKJKK-UHFFFAOYSA-N	0	2	251.202	0.706	20	5		CCBDLN
COc1ccc([N+](=O)[O-])c(C(=O)OCc2n[nH]c(=O)[nH]2)c1	ZINC000774926831	582003254	/nfs/dbraw/zinc/00/32/54/582003254.db2.gz	QVIFCPZTSHUDER-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
COc1ccnc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000824036666	617325712	/nfs/dbraw/zinc/32/57/12/617325712.db2.gz	UHFBQLALIIKPBQ-RKDXNWHRSA-N	0	2	251.242	0.718	20	5		CCBDLN
COC(=O)[C@@H](F)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000838073176	616999022	/nfs/dbraw/zinc/99/90/22/616999022.db2.gz	BAJFOEIBYRSPBS-QMMMGPOBSA-N	0	2	286.215	0.541	20	5		CCBDLN
C[C@@H](C[N+](=O)[O-])OC(=O)C(C)(C)NC(=O)C(F)(F)F	ZINC000814038453	641053986	/nfs/dbraw/zinc/05/39/86/641053986.db2.gz	CRSOJGNPHHLITK-YFKPBYRVSA-N	0	2	286.206	0.652	20	5		CCBDLN
Cc1nn(C)c2c1N(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2	ZINC000841145970	642804814	/nfs/dbraw/zinc/80/48/14/642804814.db2.gz	PMXJAVWLGQSMFU-HTQZYQBOSA-N	0	2	266.257	0.119	20	5		CCBDLN
NC(=O)[C@H]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC001161560506	802181935	/nfs/dbraw/zinc/18/19/35/802181935.db2.gz	FFKZIEXSONWQBH-JGVFFNPUSA-N	0	2	293.279	0.684	20	5		CCBDLN
O=C(NC[C@H](O)[C@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600243544	361902851	/nfs/dbraw/zinc/90/28/51/361902851.db2.gz	ULYQLILEXUMOOY-NWDGAFQWSA-N	0	2	296.279	0.570	20	5		CCBDLN
CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000117985912	349894637	/nfs/dbraw/zinc/89/46/37/349894637.db2.gz	IICQKKDLWKODCL-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CNC(=O)c1ccc(Sc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000429310049	529944351	/nfs/dbraw/zinc/94/43/51/529944351.db2.gz	VTWHLTZBRUNPSO-UHFFFAOYSA-N	0	2	295.280	0.929	20	5		CCBDLN
NC(=O)[C@H]1CCCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000236246695	136965419	/nfs/dbraw/zinc/96/54/19/136965419.db2.gz	WHSBKUNUINAFFV-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
C[C@H](CO)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346851403	137308698	/nfs/dbraw/zinc/30/86/98/137308698.db2.gz	JPHMQQMWDFNFQN-ZETCQYMHSA-N	0	2	254.242	0.659	20	5		CCBDLN
O=C(NC1(CCO)CC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000349227361	137390376	/nfs/dbraw/zinc/39/03/76/137390376.db2.gz	VAJSHVDKHSSRGS-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@H](O)C1	ZINC000068010178	348793890	/nfs/dbraw/zinc/79/38/90/348793890.db2.gz	BJKJFGPHUSMBOI-VIFPVBQESA-N	0	2	266.253	0.897	20	5		CCBDLN
CCNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000126236612	350141501	/nfs/dbraw/zinc/14/15/01/350141501.db2.gz	ZIEJRSYVQXIIDL-UHFFFAOYSA-N	0	2	293.279	0.509	20	5		CCBDLN
CN(C)C(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000133179141	350327855	/nfs/dbraw/zinc/32/78/55/350327855.db2.gz	BWZQORYMRQQXCI-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CNC(=O)[C@H](C)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316966	351946541	/nfs/dbraw/zinc/94/65/41/351946541.db2.gz	ZREWFJYSLXGJNP-MRVPVSSYSA-N	0	2	295.295	0.755	20	5		CCBDLN
C[C@@H](CC(N)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316588	351946782	/nfs/dbraw/zinc/94/67/82/351946782.db2.gz	XOIWWSMMFQQYJC-LURJTMIESA-N	0	2	267.241	0.294	20	5		CCBDLN
O=C(NCc1csc(=O)[nH]1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000227882246	352061773	/nfs/dbraw/zinc/06/17/73/352061773.db2.gz	GBXKASCRFMWYAK-UHFFFAOYSA-N	0	2	295.276	0.980	20	5		CCBDLN
NC(=O)N[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274746947	353158699	/nfs/dbraw/zinc/15/86/99/353158699.db2.gz	DTZRPFZSJQVTEF-ZETCQYMHSA-N	0	2	294.267	0.183	20	5		CCBDLN
CN(CC(C)(CO)CO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274749278	353158747	/nfs/dbraw/zinc/15/87/47/353158747.db2.gz	FFRLUUKTYDQYJQ-UHFFFAOYSA-N	0	2	298.295	0.363	20	5		CCBDLN
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CNC(=O)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000293554382	353820506	/nfs/dbraw/zinc/82/05/06/353820506.db2.gz	UOWMDKHRJMHUAR-UHFFFAOYSA-N	0	2	282.256	0.558	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC[S@@]1=O	ZINC000353227051	356182651	/nfs/dbraw/zinc/18/26/51/356182651.db2.gz	FGDZODYDGWJWAC-SQFXPLBJSA-N	0	2	298.320	0.893	20	5		CCBDLN
CC(C)(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])OCCO	ZINC000354180857	356360798	/nfs/dbraw/zinc/36/07/98/356360798.db2.gz	PVNSWNQMIDLMHY-UHFFFAOYSA-N	0	2	298.295	0.818	20	5		CCBDLN
CCn1nc(C)c([N+](=O)[O-])c1NCc1n[nH]c(=O)[nH]1	ZINC000359532697	356839615	/nfs/dbraw/zinc/83/96/15/356839615.db2.gz	OKSACOMHFCDFLK-UHFFFAOYSA-N	0	2	267.249	0.555	20	5		CCBDLN
COC[C@@](C)(O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000452338844	236232850	/nfs/dbraw/zinc/23/28/50/236232850.db2.gz	CYUKWNJPDSMOHD-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
O=C(N[C@H]1CC[S@@](=O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000436979264	358236246	/nfs/dbraw/zinc/23/62/46/358236246.db2.gz	KIBIHPGLJLATFJ-ZDVLTJLQSA-N	0	2	284.293	0.551	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)Cc2cccc([N+](=O)[O-])c2)[nH][nH]1	ZINC000610872304	363623942	/nfs/dbraw/zinc/62/39/42/363623942.db2.gz	CUVLKXJUBZYRGR-UHFFFAOYSA-N	0	2	289.251	0.020	20	5		CCBDLN
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CN(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274729407	192744410	/nfs/dbraw/zinc/74/44/10/192744410.db2.gz	AXTKLMWQPQHEOK-UHFFFAOYSA-N	0	2	296.283	0.301	20	5		CCBDLN
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CONC(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000298082639	200329744	/nfs/dbraw/zinc/32/97/44/200329744.db2.gz	GIZWPXRVSMCXIC-UHFFFAOYSA-N	0	2	283.240	0.011	20	5		CCBDLN
Cc1noc(CCNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000179462710	189195295	/nfs/dbraw/zinc/19/52/95/189195295.db2.gz	ZPBMBGMQWHCXMV-UHFFFAOYSA-N	0	2	292.251	0.964	20	5		CCBDLN
CC(CO)(CO)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000563904625	291258063	/nfs/dbraw/zinc/25/80/63/291258063.db2.gz	IBBQGIOEXFNWIZ-UHFFFAOYSA-N	0	2	284.268	0.021	20	5		CCBDLN
COC(=O)[C@@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281045898	195081691	/nfs/dbraw/zinc/08/16/91/195081691.db2.gz	QKWKUFBHDGXUHU-ZCFIWIBFSA-N	0	2	268.225	0.592	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@H](CO)C1	ZINC000185624988	388810188	/nfs/dbraw/zinc/81/01/88/388810188.db2.gz	HQOGLLICWGWIIO-QMMMGPOBSA-N	0	2	266.253	0.755	20	5		CCBDLN
O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)NC1CC1	ZINC000194741134	389103301	/nfs/dbraw/zinc/10/33/01/389103301.db2.gz	YXJWVYOUZHILLR-UHFFFAOYSA-N	0	2	279.252	0.309	20	5		CCBDLN
CC(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000194740931	389103434	/nfs/dbraw/zinc/10/34/34/389103434.db2.gz	KDSIQWKBRIQKTM-UHFFFAOYSA-N	0	2	281.268	0.555	20	5		CCBDLN
Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000421780722	389376197	/nfs/dbraw/zinc/37/61/97/389376197.db2.gz	VJFWLUMSMGPKQE-UHFFFAOYSA-N	0	2	291.267	0.965	20	5		CCBDLN
COC(=O)[C@@H](C)N(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000281934131	389636911	/nfs/dbraw/zinc/63/69/11/389636911.db2.gz	WDUOUQHAGWGBQS-SSDOTTSWSA-N	0	2	282.252	0.934	20	5		CCBDLN
NC(=O)c1ccc(NCCc2nc(N)no2)c([N+](=O)[O-])c1	ZINC000433444689	389913609	/nfs/dbraw/zinc/91/36/09/389913609.db2.gz	VGXVETKFQSZKIV-UHFFFAOYSA-N	0	2	292.255	0.144	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2O)c[nH]1	ZINC000436997271	389989677	/nfs/dbraw/zinc/98/96/77/389989677.db2.gz	FABLBZVVFJVYMY-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
COC(=O)[C@@H](CF)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000489646154	390101713	/nfs/dbraw/zinc/10/17/13/390101713.db2.gz	APEAFSCOMLFUOV-SSDOTTSWSA-N	0	2	286.215	0.541	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CN1CC[C@@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000342127321	130284906	/nfs/dbraw/zinc/28/49/06/130284906.db2.gz	KMEWEIURASFOEX-PWSUYJOCSA-N	0	2	295.343	0.233	20	5		CCBDLN
O=C(Cc1cccc([N+](=O)[O-])c1)N=c1cccn[nH]1	ZINC000358542761	144161193	/nfs/dbraw/zinc/16/11/93/144161193.db2.gz	WPJYWRSFITXKPH-UHFFFAOYSA-N	0	2	258.237	0.988	20	5		CCBDLN
O=C(NC1CCS(=O)CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000436980127	303746453	/nfs/dbraw/zinc/74/64/53/303746453.db2.gz	OJXMVBSNNMXTPX-UHFFFAOYSA-N	0	2	298.320	0.941	20	5		CCBDLN
COCC(COC)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000388446015	327882341	/nfs/dbraw/zinc/88/23/41/327882341.db2.gz	KERBZZOANNSPFL-UHFFFAOYSA-N	0	2	284.268	0.692	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H]1O	ZINC000436958496	534405393	/nfs/dbraw/zinc/40/53/93/534405393.db2.gz	HRQBKAQSLHVMFP-HQJQHLMTSA-N	0	2	266.253	0.753	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(O)(C(F)F)C1	ZINC000425025549	534719713	/nfs/dbraw/zinc/71/97/13/534719713.db2.gz	SKIKGDVAOKLNEW-UHFFFAOYSA-N	0	2	288.206	0.752	20	5		CCBDLN
CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)NC	ZINC000457049128	535799638	/nfs/dbraw/zinc/79/96/38/535799638.db2.gz	LTBKPRHGIWVCKO-SECBINFHSA-N	0	2	281.268	0.555	20	5		CCBDLN
CC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)NC	ZINC000457049129	535868012	/nfs/dbraw/zinc/86/80/12/535868012.db2.gz	LTBKPRHGIWVCKO-VIFPVBQESA-N	0	2	281.268	0.555	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])cc1C(=O)Nn1ccccc1=O	ZINC000777784774	581133760	/nfs/dbraw/zinc/13/37/60/581133760.db2.gz	VZWXCHFQBLICEA-UHFFFAOYSA-N	0	2	274.236	0.844	20	5		CCBDLN
NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCCC1	ZINC000779666049	581198620	/nfs/dbraw/zinc/19/86/20/581198620.db2.gz	IVCXRRQLFJCSAE-UHFFFAOYSA-N	0	2	293.279	0.828	20	5		CCBDLN
CCOC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772356305	581854878	/nfs/dbraw/zinc/85/48/78/581854878.db2.gz	KVUFHGMHLFPXRY-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC(=O)[O-]	ZINC000130153398	605806303	/nfs/dbraw/zinc/80/63/03/605806303.db2.gz	NYQFBJNRUNCXDF-MRVPVSSYSA-N	0	2	281.268	0.938	20	5		CCBDLN
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CNC(=O)[C@@H]1Cc2ccccc2N1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841240211	616832234	/nfs/dbraw/zinc/83/22/34/616832234.db2.gz	FMRGOQCFSMFAPM-JLLWLGSASA-N	0	2	289.291	0.356	20	5		CCBDLN
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CSc1nc(OC2CC(=O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227626938	805373718	/nfs/dbraw/zinc/37/37/18/805373718.db2.gz	CMOMIPNVKPMUKO-UHFFFAOYSA-N	0	2	271.254	0.923	20	5		CCBDLN
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CC(C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000175960023	351151757	/nfs/dbraw/zinc/15/17/57/351151757.db2.gz	GVKUXXAGPDBJEJ-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
C[C@H]1C(=O)NCCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000188087268	351572366	/nfs/dbraw/zinc/57/23/66/351572366.db2.gz	XVGSSLUZPPDBED-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000121717974	186991847	/nfs/dbraw/zinc/99/18/47/186991847.db2.gz	BLMXVPZAZPSUGY-MRVPVSSYSA-N	0	2	254.242	0.801	20	5		CCBDLN
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NC(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000225897211	352017726	/nfs/dbraw/zinc/01/77/26/352017726.db2.gz	LKIRAGYQQJAVMO-QMMMGPOBSA-N	0	2	279.252	0.248	20	5		CCBDLN
CCNC(=O)[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233494550	352151225	/nfs/dbraw/zinc/15/12/25/352151225.db2.gz	ZLEPKPRQNCTCPI-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
Cc1noc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000235973606	352190321	/nfs/dbraw/zinc/19/03/21/352190321.db2.gz	OKKOJGKXSTWYNW-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
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O=C(NC[C@@]1(O)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272394273	353059081	/nfs/dbraw/zinc/05/90/81/353059081.db2.gz	LSXQMILDSROSGU-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
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C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)NCCF	ZINC000282530083	353432166	/nfs/dbraw/zinc/43/21/66/353432166.db2.gz	BXTWOBMWBAIUQM-SSDOTTSWSA-N	0	2	299.258	0.504	20	5		CCBDLN
CCC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000286406469	353583892	/nfs/dbraw/zinc/58/38/92/353583892.db2.gz	PYXOMSMNFZWJML-QMMMGPOBSA-N	0	2	281.268	0.684	20	5		CCBDLN
CN(Cc1ncon1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354727687	356484504	/nfs/dbraw/zinc/48/45/04/356484504.db2.gz	KOWIZKOBWGZRDQ-UHFFFAOYSA-N	0	2	278.224	0.956	20	5		CCBDLN
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Nc1noc(CCNC(=O)c2ccccc2[N+](=O)[O-])n1	ZINC000359761813	356887706	/nfs/dbraw/zinc/88/77/06/356887706.db2.gz	KWTAZGYGGBIREG-UHFFFAOYSA-N	0	2	277.240	0.363	20	5		CCBDLN
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CN(Cc1n[nH]c(=O)o1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000588848958	359341143	/nfs/dbraw/zinc/34/11/43/359341143.db2.gz	HXRHBMYUXCQXDL-UHFFFAOYSA-N	0	2	294.223	0.661	20	5		CCBDLN
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C[C@H](CCO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280886162	195015345	/nfs/dbraw/zinc/01/53/45/195015345.db2.gz	CSMAPTORAPIBIT-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
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COC(=O)[C@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000281458392	195247578	/nfs/dbraw/zinc/24/75/78/195247578.db2.gz	BWQZPZKRLVUOIE-ZETCQYMHSA-N	0	2	282.252	0.934	20	5		CCBDLN
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C[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)O1	ZINC000288422143	388861498	/nfs/dbraw/zinc/86/14/98/388861498.db2.gz	CRWKYIDLAPTMFS-IMTBSYHQSA-N	0	2	280.236	0.734	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@@H]1O	ZINC000354379250	389022856	/nfs/dbraw/zinc/02/28/56/389022856.db2.gz	GXGMMBVCDUZKEI-HQJQHLMTSA-N	0	2	266.253	0.753	20	5		CCBDLN
O=[N+]([O-])c1ccc(-c2nc(Cn3cncn3)no2)cc1O	ZINC000350765245	389541701	/nfs/dbraw/zinc/54/17/01/389541701.db2.gz	TYEDBBHVQYIMFS-UHFFFAOYSA-N	0	2	288.223	0.990	20	5		CCBDLN
Cn1cnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000182176646	389702417	/nfs/dbraw/zinc/70/24/17/389702417.db2.gz	WWCSIUIBAYOZAV-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC[S@]1=O	ZINC000352753228	389835693	/nfs/dbraw/zinc/83/56/93/389835693.db2.gz	OFTGXXYLNXCGEA-ZPWHCFADSA-N	0	2	298.320	0.893	20	5		CCBDLN
O=C(N[C@@H](CO)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000436804506	389984542	/nfs/dbraw/zinc/98/45/42/389984542.db2.gz	BMNHLBYCURBEQB-JQWIXIFHSA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)[C@H](C)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436963231	389988517	/nfs/dbraw/zinc/98/85/17/389988517.db2.gz	GGZFDSBROIPMAR-SSDOTTSWSA-N	0	2	282.252	0.839	20	5		CCBDLN
C[C@@H]1OC(=O)N[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000497167167	390429933	/nfs/dbraw/zinc/42/99/33/390429933.db2.gz	JVTOLZMLYHLZFG-SSDLBLMSSA-N	0	2	281.224	0.736	20	5		CCBDLN
COC(=O)[C@H]1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000412754297	533535429	/nfs/dbraw/zinc/53/54/29/533535429.db2.gz	XKAFNCBZHDTNHM-OCAPTIKFSA-N	0	2	294.263	0.982	20	5		CCBDLN
CCN(C)C(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000191675072	130276616	/nfs/dbraw/zinc/27/66/16/130276616.db2.gz	BKGVKYYVPUNQLM-QMMMGPOBSA-N	0	2	295.295	0.897	20	5		CCBDLN
NC(=O)c1ccnc(Sc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000357688883	144112810	/nfs/dbraw/zinc/11/28/10/144112810.db2.gz	VWASQIGUTUIXEP-UHFFFAOYSA-N	0	2	282.241	0.064	20	5		CCBDLN
O=C(N=c1cc(-c2ccncc2)[nH][nH]1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000372552696	144372667	/nfs/dbraw/zinc/37/26/67/144372667.db2.gz	LDHOFOQHWFYSQY-PSASIEDQSA-N	0	2	273.252	0.497	20	5		CCBDLN
O=C(N=c1cc(-c2ccncc2)[nH][nH]1)[C@@H]1CC1[N+](=O)[O-]	ZINC000372552696	144372668	/nfs/dbraw/zinc/37/26/68/144372668.db2.gz	LDHOFOQHWFYSQY-PSASIEDQSA-N	0	2	273.252	0.497	20	5		CCBDLN
O=C(NCCOCCO)c1cc(O)ccc1[N+](=O)[O-]	ZINC000551920320	286136233	/nfs/dbraw/zinc/13/62/33/286136233.db2.gz	KIFUJRZISQNSOL-UHFFFAOYSA-N	0	2	270.241	0.039	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@H]1O	ZINC000456393701	293826385	/nfs/dbraw/zinc/82/63/85/293826385.db2.gz	KYAHONRBPLUQEO-NXEZZACHSA-N	0	2	282.252	0.132	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC[S@@]1=O	ZINC000352753227	300194096	/nfs/dbraw/zinc/19/40/96/300194096.db2.gz	OFTGXXYLNXCGEA-FFVOIRBGSA-N	0	2	298.320	0.893	20	5		CCBDLN
O=[N+]([O-])c1cnc(Nc2ccn(CCO)n2)s1	ZINC000565931020	327088978	/nfs/dbraw/zinc/08/89/78/327088978.db2.gz	XUUBCPFIPQTLJT-UHFFFAOYSA-N	0	2	255.259	0.406	20	5		CCBDLN
COC(=O)N1CC(NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000495689768	533927971	/nfs/dbraw/zinc/92/79/71/533927971.db2.gz	JKZIXKREBPMGKM-UHFFFAOYSA-N	0	2	295.251	0.481	20	5		CCBDLN
CC1(C)C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184749599	520241496	/nfs/dbraw/zinc/24/14/96/520241496.db2.gz	DSGMGFWZLFXSHC-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C([O-])NC[C@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740647227	581528504	/nfs/dbraw/zinc/52/85/04/581528504.db2.gz	ZEURRQQESVFRIX-MRVPVSSYSA-N	0	2	269.261	0.338	20	5		CCBDLN
O=C([O-])NC[C@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740647227	581528506	/nfs/dbraw/zinc/52/85/06/581528506.db2.gz	ZEURRQQESVFRIX-MRVPVSSYSA-N	0	2	269.261	0.338	20	5		CCBDLN
O=C(COc1ccc([N+](=O)[O-])cc1)OCc1n[nH]c(=O)[nH]1	ZINC000774876854	582000788	/nfs/dbraw/zinc/00/07/88/582000788.db2.gz	VXHRHZJJMHDLHJ-UHFFFAOYSA-N	0	2	294.223	0.541	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@H](CN(C)C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920377	605751092	/nfs/dbraw/zinc/75/10/92/605751092.db2.gz	IDWLEGFKDMEWMM-SNVBAGLBSA-N	0	2	297.315	0.989	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@H](CN(C)C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920377	605751096	/nfs/dbraw/zinc/75/10/96/605751096.db2.gz	IDWLEGFKDMEWMM-SNVBAGLBSA-N	0	2	297.315	0.989	20	5		CCBDLN
CCOC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1C	ZINC000839734404	615187898	/nfs/dbraw/zinc/18/78/98/615187898.db2.gz	OQNUOKBNCFWPCX-RNFRBKRXSA-N	0	2	282.256	0.201	20	5		CCBDLN
CN(C[C@H]1CCC[N@@H+]1Cn1nccc1[N+](=O)[O-])C(=O)[O-]	ZINC000828229724	616154175	/nfs/dbraw/zinc/15/41/75/616154175.db2.gz	HPPAEBQMTLZHJO-SECBINFHSA-N	0	2	283.288	0.823	20	5		CCBDLN
CN(C[C@H]1CCC[N@H+]1Cn1nccc1[N+](=O)[O-])C(=O)[O-]	ZINC000828229724	616154176	/nfs/dbraw/zinc/15/41/76/616154176.db2.gz	HPPAEBQMTLZHJO-SECBINFHSA-N	0	2	283.288	0.823	20	5		CCBDLN
CCOC(=O)[C@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233688808	638205255	/nfs/dbraw/zinc/20/52/55/638205255.db2.gz	MVGXIAVQIGGJDR-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(=O)Nc2cnccc21	ZINC000840371107	641373155	/nfs/dbraw/zinc/37/31/55/641373155.db2.gz	LLKVUXDZENMXBZ-HZGVNTEJSA-N	0	2	262.225	0.032	20	5		CCBDLN
COC(=O)c1c[nH]c(O[C@H](C[N+](=O)[O-])C2CC2)n1	ZINC001230282049	805591582	/nfs/dbraw/zinc/59/15/82/805591582.db2.gz	OENKPODVSSHXSL-MRVPVSSYSA-N	0	2	255.230	0.630	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC=C[C@H]1CO	ZINC001153291564	800617944	/nfs/dbraw/zinc/61/79/44/800617944.db2.gz	FSIXODKNCHDFJT-VIFPVBQESA-N	0	2	264.237	0.673	20	5		CCBDLN
O=c1cc(O)nc(O[C@@H](C[N+](=O)[O-])c2cccnc2)[nH]1	ZINC001228388054	805442934	/nfs/dbraw/zinc/44/29/34/805442934.db2.gz	FZICZDYZQUZJHI-QMMMGPOBSA-N	0	2	278.224	0.680	20	5		CCBDLN
C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])[C@@H](CO)C1	ZINC001301605628	907978865	/nfs/dbraw/zinc/97/88/65/907978865.db2.gz	SNHZHHJKFMVXJB-SECBINFHSA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])[C@@H](CO)C1	ZINC001301605628	907978873	/nfs/dbraw/zinc/97/88/73/907978873.db2.gz	SNHZHHJKFMVXJB-SECBINFHSA-N	0	2	295.295	0.049	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@H](O)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000228609829	960029762	/nfs/dbraw/zinc/02/97/62/960029762.db2.gz	NFVWPBNSCVRZGN-ONGXEEELSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000228609829	960029773	/nfs/dbraw/zinc/02/97/73/960029773.db2.gz	NFVWPBNSCVRZGN-ONGXEEELSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCCO1)c1cccc(O)c1[N+](=O)[O-]	ZINC000600241422	361901131	/nfs/dbraw/zinc/90/11/31/361901131.db2.gz	KCBIGRHIIWPDJZ-QWRGUYRKSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(N[C@@H]1COCCC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600394118	361942648	/nfs/dbraw/zinc/94/26/48/361942648.db2.gz	ZLKLTLLVUFRFFM-MRVPVSSYSA-N	0	2	280.236	0.388	20	5		CCBDLN
COC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270135619	190602510	/nfs/dbraw/zinc/60/25/10/190602510.db2.gz	UDGGWODEEVJNIH-QMMMGPOBSA-N	0	2	270.241	0.038	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nncn1C	ZINC000273162784	192062850	/nfs/dbraw/zinc/06/28/50/192062850.db2.gz	CLHGSZXDSXDPEO-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
Cc1c(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)nnn1C	ZINC000361654505	232179611	/nfs/dbraw/zinc/17/96/11/232179611.db2.gz	LETTZLNUBIMJHH-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@H]1OC	ZINC000217316921	351946661	/nfs/dbraw/zinc/94/66/61/351946661.db2.gz	UORJJJOYOWHKDP-VXGBXAGGSA-N	0	2	296.279	0.786	20	5		CCBDLN
NC(=O)CCCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000230071843	352101624	/nfs/dbraw/zinc/10/16/24/352101624.db2.gz	ZYHZGUJMIJRDSC-UHFFFAOYSA-N	0	2	281.268	0.686	20	5		CCBDLN
CCNC(=O)[C@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233486162	352149794	/nfs/dbraw/zinc/14/97/94/352149794.db2.gz	ZLEPKPRQNCTCPI-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
COC[C@](C)(CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272422974	353062576	/nfs/dbraw/zinc/06/25/76/353062576.db2.gz	QNWSROCIWKHVKW-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
NC(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274717386	353156154	/nfs/dbraw/zinc/15/61/54/353156154.db2.gz	BKNMUBNCTDGDTR-ZETCQYMHSA-N	0	2	279.252	0.248	20	5		CCBDLN
O=C(NCC1(CO)COC1)c1ccc([N+](=O)[O-])cc1O	ZINC000275035827	353181199	/nfs/dbraw/zinc/18/11/99/353181199.db2.gz	JCQDULVSYWBLDR-UHFFFAOYSA-N	0	2	282.252	0.039	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCOCC1	ZINC000280658898	353374172	/nfs/dbraw/zinc/37/41/72/353374172.db2.gz	AFTTWKAOXYERGD-UHFFFAOYSA-N	0	2	252.226	0.773	20	5		CCBDLN
C[C@H]1OCCN2[C@H](c3ccc([N+](=O)[O-])c(O)c3)NC(=O)[C@H]12	ZINC000285064666	353558326	/nfs/dbraw/zinc/55/83/26/353558326.db2.gz	KGTJVDNFUKYJCU-VSYUYLJXSA-N	0	2	293.279	0.518	20	5		CCBDLN
CCn1c(C)nc([N+](=O)[O-])c1NCCCc1n[nH]c(=O)[nH]1	ZINC000360990028	138018337	/nfs/dbraw/zinc/01/83/37/138018337.db2.gz	IOEFVRMVGANDCB-UHFFFAOYSA-N	0	2	295.303	0.988	20	5		CCBDLN
COC[C@@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354059700	356337629	/nfs/dbraw/zinc/33/76/29/356337629.db2.gz	VTMJWFHFDLZVHZ-QMMMGPOBSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC(CCO)C1	ZINC000354526381	356432589	/nfs/dbraw/zinc/43/25/89/356432589.db2.gz	ODICBJRECQFRBJ-UHFFFAOYSA-N	0	2	266.253	0.755	20	5		CCBDLN
O=C(NC1(CCO)CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000356390397	356758390	/nfs/dbraw/zinc/75/83/90/356758390.db2.gz	IXUBIWDTIWPABY-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H](O)C2(CC2)C1	ZINC000375981227	357422891	/nfs/dbraw/zinc/42/28/91/357422891.db2.gz	PHYKUHCQAMUSDK-NSHDSACASA-N	0	2	278.264	0.897	20	5		CCBDLN
NC(=O)C[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000588803237	359337924	/nfs/dbraw/zinc/33/79/24/359337924.db2.gz	FQHVMXJXIKOQOE-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000590421249	359457142	/nfs/dbraw/zinc/45/71/42/359457142.db2.gz	LCJGVAGYPYMGNM-MYJAWHEDSA-N	0	2	278.264	0.611	20	5		CCBDLN
O=C(NC1COCCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000590427580	359459501	/nfs/dbraw/zinc/45/95/01/359459501.db2.gz	LCWQULBXIZYOOZ-UHFFFAOYSA-N	0	2	282.252	0.446	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1	ZINC000296903729	200030471	/nfs/dbraw/zinc/03/04/71/200030471.db2.gz	HHGIWZDBUABFOX-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000592900135	359972836	/nfs/dbraw/zinc/97/28/36/359972836.db2.gz	FTTYVVKUTJJOCY-SSDOTTSWSA-N	0	2	279.252	0.561	20	5		CCBDLN
COC[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000593813191	360164811	/nfs/dbraw/zinc/16/48/11/360164811.db2.gz	CPBAVZSROSFWTA-NXEZZACHSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1[C@@H]2CO[C@H]3[C@@H]2OC[C@H]31	ZINC000611535794	363735750	/nfs/dbraw/zinc/73/57/50/363735750.db2.gz	CLQCFENGBULQNS-CNVPUSNMSA-N	0	2	292.247	0.291	20	5		CCBDLN
COC[C@](C)(CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000614044053	364472512	/nfs/dbraw/zinc/47/25/12/364472512.db2.gz	XODBUVLGPHLQKW-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])cc1NC(=O)NCc1n[nH]c(=O)[nH]1	ZINC000128439964	284755400	/nfs/dbraw/zinc/75/54/00/284755400.db2.gz	VJRJHWOJBMJPHG-UHFFFAOYSA-N	0	2	292.255	0.636	20	5		CCBDLN
CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000185576058	388809004	/nfs/dbraw/zinc/80/90/04/388809004.db2.gz	CFROOHDOAXJJHR-JTQLQIEISA-N	0	2	281.268	0.540	20	5		CCBDLN
CC(=O)N[C@@H](C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000155959900	389322232	/nfs/dbraw/zinc/32/22/32/389322232.db2.gz	ZYVYGZFAHHXHJP-LURJTMIESA-N	0	2	267.241	0.764	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncnn1C	ZINC000276918970	389553838	/nfs/dbraw/zinc/55/38/38/389553838.db2.gz	SIGMWKQIESLYGB-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
CCN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1CCNC1=O	ZINC000282045830	389650308	/nfs/dbraw/zinc/65/03/08/389650308.db2.gz	BWTUWWNDFYSSOA-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC(=O)[C@H](C)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000351831577	389694290	/nfs/dbraw/zinc/69/42/90/389694290.db2.gz	KZHRSBOCGORMJE-SSDOTTSWSA-N	0	2	282.252	0.839	20	5		CCBDLN
Cn1nncc1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000352027423	389738272	/nfs/dbraw/zinc/73/82/72/389738272.db2.gz	OTKPFBKYJQGYJS-NSCUHMNNSA-N	0	2	264.201	0.095	20	5		CCBDLN
NC(=O)C1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000436672536	389982358	/nfs/dbraw/zinc/98/23/58/389982358.db2.gz	DWWDLBGVBFNDPD-UHFFFAOYSA-N	0	2	293.279	0.638	20	5		CCBDLN
Cn1nncc1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000436768410	389984429	/nfs/dbraw/zinc/98/44/29/389984429.db2.gz	KKJZJCVECREBIY-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CN1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000436891240	389986422	/nfs/dbraw/zinc/98/64/22/389986422.db2.gz	FJUOAUWHDKJGJP-UHFFFAOYSA-N	0	2	265.225	0.172	20	5		CCBDLN
O=C(N=c1nc2n([nH]1)CCCC2)c1ccc([N+](=O)[O-])[nH]1	ZINC000457140125	390032804	/nfs/dbraw/zinc/03/28/04/390032804.db2.gz	GAEQRUZZLSRJLY-UHFFFAOYSA-N	0	2	276.256	0.525	20	5		CCBDLN
COC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000496023257	390284351	/nfs/dbraw/zinc/28/43/51/390284351.db2.gz	UJVXDEVYNAUNLM-UHFFFAOYSA-N	0	2	283.240	0.386	20	5		CCBDLN
CCN1CC(=O)N[C@@H]1c1ccc(O)c([N+](=O)[O-])c1	ZINC000189896690	130036335	/nfs/dbraw/zinc/03/63/35/130036335.db2.gz	FFCHGYFVSDFQND-NSHDSACASA-N	0	2	251.242	0.751	20	5		CCBDLN
CCN1CC(=O)N[C@H]1c1ccc(O)c([N+](=O)[O-])c1	ZINC000189896710	130036494	/nfs/dbraw/zinc/03/64/94/130036494.db2.gz	FFCHGYFVSDFQND-LLVKDONJSA-N	0	2	251.242	0.751	20	5		CCBDLN
CN(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000227489380	130844847	/nfs/dbraw/zinc/84/48/47/130844847.db2.gz	VMVRUGGXTCJVNW-UHFFFAOYSA-N	0	2	296.283	0.301	20	5		CCBDLN
COc1nn(C)cc1Nc1nccc(C(N)=O)c1[N+](=O)[O-]	ZINC000357658149	144110004	/nfs/dbraw/zinc/11/00/04/144110004.db2.gz	HSIIQQWPISVVSS-UHFFFAOYSA-N	0	2	292.255	0.574	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H](O)C2(CC2)C1	ZINC000368754041	144243475	/nfs/dbraw/zinc/24/34/75/144243475.db2.gz	OXGIFTFQTMPKPF-LLVKDONJSA-N	0	2	278.264	0.897	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(n2cncn2)C1	ZINC000371606729	144338846	/nfs/dbraw/zinc/33/88/46/144338846.db2.gz	LIXPJPITQWCDEZ-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
COC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)OC	ZINC000436887033	397535071	/nfs/dbraw/zinc/53/50/71/397535071.db2.gz	IOHMRAYAVRIERC-SECBINFHSA-N	0	2	298.251	0.218	20	5		CCBDLN
CC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000022759371	171398030	/nfs/dbraw/zinc/39/80/30/171398030.db2.gz	JQXXHQSMTDSTPE-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
CN1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000436971257	289946828	/nfs/dbraw/zinc/94/68/28/289946828.db2.gz	HYZJJBFOQRHMFI-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000263821085	290308765	/nfs/dbraw/zinc/30/87/65/290308765.db2.gz	UPNMFKPNUCWGMW-MRVPVSSYSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NN1CCOCC1)c1ccc([N+](=O)[O-])cc1O	ZINC000161662276	303816990	/nfs/dbraw/zinc/81/69/90/303816990.db2.gz	KAKNNVQBZFBOGL-UHFFFAOYSA-N	0	2	267.241	0.277	20	5		CCBDLN
O=c1[nH]nc([C@H]2CCCN(c3ncc([N+](=O)[O-])cn3)C2)o1	ZINC000290984002	304815197	/nfs/dbraw/zinc/81/51/97/304815197.db2.gz	SDJMIBQGAILXBB-ZETCQYMHSA-N	0	2	292.255	0.445	20	5		CCBDLN
CCCc1n[nH]c(C(=O)NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000358359458	528547564	/nfs/dbraw/zinc/54/75/64/528547564.db2.gz	CDACZBBHTBYJAD-UHFFFAOYSA-N	0	2	295.259	0.024	20	5		CCBDLN
C[C@]1(O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000217316891	581170283	/nfs/dbraw/zinc/17/02/83/581170283.db2.gz	NXXGYRKQMGKLKB-LBPRGKRZSA-N	0	2	266.253	0.897	20	5		CCBDLN
C[S@](=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772866748	581894258	/nfs/dbraw/zinc/89/42/58/581894258.db2.gz	JOXJZBHYECWVAS-SFHVURJKSA-N	0	2	272.282	0.409	20	5		CCBDLN
Nc1cc(F)c([N+](=O)[O-])cc1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774968718	582006336	/nfs/dbraw/zinc/00/63/36/582006336.db2.gz	HGVPUOUMCCWVRM-UHFFFAOYSA-N	0	2	297.202	0.497	20	5		CCBDLN
C[C@@H](C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1)C1CC1	ZINC000750758061	582058340	/nfs/dbraw/zinc/05/83/40/582058340.db2.gz	WDSLPXMDMSKVKM-SSDOTTSWSA-N	0	2	299.308	0.841	20	5		CCBDLN
CN1C(=O)CN(NC(=O)c2csc([N+](=O)[O-])c2)C1=O	ZINC000776245370	582064680	/nfs/dbraw/zinc/06/46/80/582064680.db2.gz	WKLNQPVGKOHONL-UHFFFAOYSA-N	0	2	284.253	0.195	20	5		CCBDLN
COc1ccc2c(n1)N(C)CCN2C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000928399423	617287154	/nfs/dbraw/zinc/28/71/54/617287154.db2.gz	MAAXVDJRAMLPMJ-PSASIEDQSA-N	0	2	292.295	0.538	20	5		CCBDLN
CC(=O)c1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000839686859	614264838	/nfs/dbraw/zinc/26/48/38/614264838.db2.gz	QZKNKGLEUQZKKY-PHDIDXHHSA-N	0	2	255.255	0.949	20	5		CCBDLN
CCOC(=O)c1cn(C)nc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841171978	615184803	/nfs/dbraw/zinc/18/48/03/615184803.db2.gz	WNJHCPYRTJFXNH-HTRCEHHLSA-N	0	2	282.256	0.201	20	5		CCBDLN
CCON(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000846507173	615335329	/nfs/dbraw/zinc/33/53/29/615335329.db2.gz	RRHFWQKKHZJNHO-UHFFFAOYSA-N	0	2	297.267	0.440	20	5		CCBDLN
CN(C)c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ncn1	ZINC000841202219	616009388	/nfs/dbraw/zinc/00/93/88/616009388.db2.gz	COEZIWNHMBNUFE-RNFRBKRXSA-N	0	2	251.246	0.146	20	5		CCBDLN
O=C(Nc1n[nH]cc1Br)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839768262	640360710	/nfs/dbraw/zinc/36/07/10/640360710.db2.gz	QUEAPZOPEPINMN-NQXXGFSBSA-N	0	2	275.062	0.776	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCNC(=O)c2ccccc21	ZINC000841177819	642806797	/nfs/dbraw/zinc/80/67/97/642806797.db2.gz	XRLGZVPFPNTRIZ-MWLCHTKSSA-N	0	2	275.264	0.428	20	5		CCBDLN
O=C(Nc1ccnn1C[C@@H]1CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001125534997	791263732	/nfs/dbraw/zinc/26/37/32/791263732.db2.gz	BKNLEYJUKXECDA-IVZWLZJFSA-N	0	2	280.284	0.523	20	5		CCBDLN
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@H](CO)C1	ZINC001149360282	800251827	/nfs/dbraw/zinc/25/18/27/800251827.db2.gz	XUWHHTAOYSHIKE-JTQLQIEISA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])[C@H](CO)C1	ZINC001149360282	800251830	/nfs/dbraw/zinc/25/18/30/800251830.db2.gz	XUWHHTAOYSHIKE-JTQLQIEISA-N	0	2	295.295	0.049	20	5		CCBDLN
CSc1nc(O[C@@H]2CCOC2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624774	805373772	/nfs/dbraw/zinc/37/37/72/805373772.db2.gz	DQZSYGHKQXFEDY-RXMQYKEDSA-N	0	2	273.270	0.980	20	5		CCBDLN
O=C1OC[C@@H](COc2cc(O)cc(O)c2[N+](=O)[O-])O1	ZINC001228970851	805493566	/nfs/dbraw/zinc/49/35/66/805493566.db2.gz	KVXCOFOKTZOFBX-ZCFIWIBFSA-N	0	2	271.181	0.920	20	5		CCBDLN
Cc1noc(CCNC(=O)c2cccc(O)c2[N+](=O)[O-])n1	ZINC000343285261	137125046	/nfs/dbraw/zinc/12/50/46/137125046.db2.gz	WIEKVGGPLBNSHE-UHFFFAOYSA-N	0	2	292.251	0.964	20	5		CCBDLN
C[C@H](Cn1cncn1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000068087246	348797387	/nfs/dbraw/zinc/79/73/87/348797387.db2.gz	JQGODODEZNICJL-MRVPVSSYSA-N	0	2	291.267	0.710	20	5		CCBDLN
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@H]1CCNC(=O)C1	ZINC000183899465	351395474	/nfs/dbraw/zinc/39/54/74/351395474.db2.gz	AHPKFUHCDLUOQA-ZETCQYMHSA-N	0	2	279.252	0.765	20	5		CCBDLN
C[C@H](O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182074143	351346524	/nfs/dbraw/zinc/34/65/24/351346524.db2.gz	MHIJFVNFTZLUMY-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
COC(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234530013	352159796	/nfs/dbraw/zinc/15/97/96/352159796.db2.gz	AWHGJPJGDHCBLT-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
O=C(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])NC1CC1	ZINC000236560613	352198038	/nfs/dbraw/zinc/19/80/38/352198038.db2.gz	BZJSJYXDYAPNQQ-UHFFFAOYSA-N	0	2	279.252	0.309	20	5		CCBDLN
COC[C@H](CCO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270391163	352927918	/nfs/dbraw/zinc/92/79/18/352927918.db2.gz	GYTCCFUWSDNDCO-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NC[C@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272424723	353062449	/nfs/dbraw/zinc/06/24/49/353062449.db2.gz	QVBBZILBZBNWCK-NSHDSACASA-N	0	2	266.253	0.801	20	5		CCBDLN
Cc1nnc(CCNC(=O)c2cc([N+](=O)[O-])ccc2O)[nH]1	ZINC000272446676	353064956	/nfs/dbraw/zinc/06/49/56/353064956.db2.gz	VNZIYYNKQYWOKL-UHFFFAOYSA-N	0	2	291.267	0.699	20	5		CCBDLN
Cc1nnc(CCNC(=O)c2ccc([N+](=O)[O-])cc2O)[nH]1	ZINC000274819932	353165035	/nfs/dbraw/zinc/16/50/35/353165035.db2.gz	WDGGBWFKGGCRNI-UHFFFAOYSA-N	0	2	291.267	0.699	20	5		CCBDLN
O=C(NCCNC(=O)C1CC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000280672975	353375025	/nfs/dbraw/zinc/37/50/25/353375025.db2.gz	BPJCZENUQFDAKY-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
C[S@](=O)C1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000282236998	353406050	/nfs/dbraw/zinc/40/60/50/353406050.db2.gz	RNPVNTXQGFRZPV-FQEVSTJZSA-N	0	2	298.320	0.941	20	5		CCBDLN
COC(=O)c1ccc(OCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000353217861	356181206	/nfs/dbraw/zinc/18/12/06/356181206.db2.gz	HYHRQWAKAYQGOY-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
O=C(N[C@@]1(CO)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000273617899	192232986	/nfs/dbraw/zinc/23/29/86/192232986.db2.gz	YDZGJTXFOXGENJ-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
O=C(NC[C@@H]1CCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000619867766	366363914	/nfs/dbraw/zinc/36/39/14/366363914.db2.gz	HKEHXWILZQBZHX-VIFPVBQESA-N	0	2	293.279	0.556	20	5		CCBDLN
C[C@H]1CC(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000378557508	357692509	/nfs/dbraw/zinc/69/25/09/357692509.db2.gz	ZRHCMKRTWBATKS-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000530880937	358429315	/nfs/dbraw/zinc/42/93/15/358429315.db2.gz	KSCYAEDSTDPIAG-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(N[C@@H](CO)CCF)c1cc(O)ccc1[N+](=O)[O-]	ZINC000593862287	360179368	/nfs/dbraw/zinc/17/93/68/360179368.db2.gz	VOMKZRNERXELGU-SSDOTTSWSA-N	0	2	272.232	0.751	20	5		CCBDLN
COC[C@H](OC)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597441185	361095472	/nfs/dbraw/zinc/09/54/72/361095472.db2.gz	DXELXVTWMYJMLH-JTQLQIEISA-N	0	2	270.241	0.900	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1	ZINC000597541953	361132999	/nfs/dbraw/zinc/13/29/99/361132999.db2.gz	XDDWCRMALQTAQZ-NSHDSACASA-N	0	2	282.252	0.745	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)C1(CO)CC1	ZINC000597644477	361171434	/nfs/dbraw/zinc/17/14/34/361171434.db2.gz	NOIWJFZCKIVZKZ-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCOCCN1	ZINC000597705918	361202497	/nfs/dbraw/zinc/20/24/97/361202497.db2.gz	LBMQFKAFPOTCPR-UHFFFAOYSA-N	0	2	267.241	0.277	20	5		CCBDLN
O=c1[nH]nc(CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[nH]1	ZINC000301561849	201069835	/nfs/dbraw/zinc/06/98/35/201069835.db2.gz	KNACHROIZRDLAM-UHFFFAOYSA-N	0	2	280.200	0.527	20	5		CCBDLN
CCOC(=O)NCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000281355091	195209084	/nfs/dbraw/zinc/20/90/84/195209084.db2.gz	XAHXXISVQBKBDD-UHFFFAOYSA-N	0	2	283.240	0.985	20	5		CCBDLN
Cc1nc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)no1	ZINC000184786976	388778338	/nfs/dbraw/zinc/77/83/38/388778338.db2.gz	PRJSGZGRDDFUMQ-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=c1[nH]nc(SCCn2ccc([N+](=O)[O-])n2)[nH]1	ZINC000188096849	388913484	/nfs/dbraw/zinc/91/34/84/388913484.db2.gz	WXKYGYSYBBPXHZ-UHFFFAOYSA-N	0	2	256.247	0.407	20	5		CCBDLN
O=C(CCn1ccnn1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000180772325	389675226	/nfs/dbraw/zinc/67/52/26/389675226.db2.gz	DNGADLKXCAACQR-UHFFFAOYSA-N	0	2	277.240	0.921	20	5		CCBDLN
Cn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436512256	389978484	/nfs/dbraw/zinc/97/84/84/389978484.db2.gz	JCHPNCZNHMXYMY-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H]1OC	ZINC000436731822	389984246	/nfs/dbraw/zinc/98/42/46/389984246.db2.gz	QVOJCEUCHZGTEG-RYUDHWBXSA-N	0	2	296.279	0.786	20	5		CCBDLN
Cn1ccc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436897065	389986505	/nfs/dbraw/zinc/98/65/05/389986505.db2.gz	QGHIFSOIZIZHCJ-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC[S@@]1=O	ZINC000436971834	389988907	/nfs/dbraw/zinc/98/89/07/389988907.db2.gz	LFXUCHOOCBNJNI-SQFXPLBJSA-N	0	2	298.320	0.893	20	5		CCBDLN
CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nn[nH]n1	ZINC000436977342	389989171	/nfs/dbraw/zinc/98/91/71/389989171.db2.gz	DEIKQCGLVAZQTM-UHFFFAOYSA-N	0	2	292.255	0.479	20	5		CCBDLN
Nc1ncncc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000437000426	389989428	/nfs/dbraw/zinc/98/94/28/389989428.db2.gz	NSUCDWVMEFOGCL-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
Cc1noc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436872429	397533880	/nfs/dbraw/zinc/53/38/80/397533880.db2.gz	WKTZTNQTPKSWSC-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
Cn1cnc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000356430834	303016424	/nfs/dbraw/zinc/01/64/24/303016424.db2.gz	PGACRXGWFAVRCO-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
Cc1nonc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779665997	581198535	/nfs/dbraw/zinc/19/85/35/581198535.db2.gz	HXSAEEYXIAIEAF-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(N[C@@H](CO)C1CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000779679088	581198974	/nfs/dbraw/zinc/19/89/74/581198974.db2.gz	PMGCHEXPIDDHIF-JTQLQIEISA-N	0	2	266.253	0.801	20	5		CCBDLN
Cc1nonc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000796521802	581442938	/nfs/dbraw/zinc/44/29/38/581442938.db2.gz	QGZAVINHZIZEOA-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
C[C@@H]1C[N@H+](Cn2nccc2[N+](=O)[O-])CC[C@H]1NC(=O)[O-]	ZINC000739191801	581520688	/nfs/dbraw/zinc/52/06/88/581520688.db2.gz	QMEYGARIEHIDDE-RKDXNWHRSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@@H]1C[N@@H+](Cn2nccc2[N+](=O)[O-])CC[C@H]1NC(=O)[O-]	ZINC000739191801	581520689	/nfs/dbraw/zinc/52/06/89/581520689.db2.gz	QMEYGARIEHIDDE-RKDXNWHRSA-N	0	2	283.288	0.727	20	5		CCBDLN
CCOC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000770486470	581747035	/nfs/dbraw/zinc/74/70/35/581747035.db2.gz	KOQNQRFCVGAJKJ-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@@H]1CN(C(=O)[O-])CC[N@@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000826026194	603996125	/nfs/dbraw/zinc/99/61/25/603996125.db2.gz	KBYXAUQANJYZJF-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@@H]1CN(C(=O)[O-])CC[N@H+]1CCn1cc([N+](=O)[O-])cn1	ZINC000826026194	603996126	/nfs/dbraw/zinc/99/61/26/603996126.db2.gz	KBYXAUQANJYZJF-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
CC(C)Oc1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nn1	ZINC000841188331	614056229	/nfs/dbraw/zinc/05/62/29/614056229.db2.gz	KFXCRHPWAOKNMK-HTQZYQBOSA-N	0	2	266.257	0.868	20	5		CCBDLN
CCN(OC)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000844069726	615075064	/nfs/dbraw/zinc/07/50/64/615075064.db2.gz	ZEOXGTIALBLMIK-UHFFFAOYSA-N	0	2	297.267	0.440	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N(C[C@H]1CCCO1)c1ccnnc1	ZINC000893109250	625326329	/nfs/dbraw/zinc/32/63/29/625326329.db2.gz	RGGPBBCWTSVMPO-IJLUTSLNSA-N	0	2	292.295	0.654	20	5		CCBDLN
O=C(Nc1ccn(Cc2ccccn2)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839614360	640346281	/nfs/dbraw/zinc/34/62/81/640346281.db2.gz	NMPKJUHQPZOWPS-GHMZBOCLSA-N	0	2	287.279	0.930	20	5		CCBDLN
C[C@H](COC(=O)C(C)(C)NC(=O)C(F)(F)F)[N+](=O)[O-]	ZINC000813103043	641022593	/nfs/dbraw/zinc/02/25/93/641022593.db2.gz	MDUUNWQHMZFOFR-RXMQYKEDSA-N	0	2	286.206	0.652	20	5		CCBDLN
O=C(C[C@@H]1CCC(=O)N1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000831242998	642335677	/nfs/dbraw/zinc/33/56/77/642335677.db2.gz	BJEPPEWXDUYLLC-ZETCQYMHSA-N	0	2	279.252	0.908	20	5		CCBDLN
O=C(O[C@H]1CNOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000848058435	643580104	/nfs/dbraw/zinc/58/01/04/643580104.db2.gz	YSEXOJKXRYLQSI-LURJTMIESA-N	0	2	254.198	0.361	20	5		CCBDLN
CN1CCO[C@H](COc2cccc(O)c2[N+](=O)[O-])C1=O	ZINC001225620154	805144872	/nfs/dbraw/zinc/14/48/72/805144872.db2.gz	NXWRENRUHAFMGU-SNVBAGLBSA-N	0	2	282.252	0.536	20	5		CCBDLN
C[C@@H](C[NH+]1CCOCC1)Oc1nc(=O)[n-]cc1[N+](=O)[O-]	ZINC001226333105	805220635	/nfs/dbraw/zinc/22/06/35/805220635.db2.gz	XTJMKTGWQMNKDF-QMMMGPOBSA-N	0	2	284.272	0.190	20	5		CCBDLN
[NH3+]Cc1nc(=O)[nH]n1-c1ccc(C(=O)[O-])c([N+](=O)[O-])c1	ZINC001168762775	820078349	/nfs/dbraw/zinc/07/83/49/820078349.db2.gz	OOEKZIUZSAZRTP-UHFFFAOYSA-N	0	2	279.212	0.038	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC2(C1)CNC(=O)O2	ZINC001299649133	904072850	/nfs/dbraw/zinc/07/28/50/904072850.db2.gz	GRHGHOPLAUORFG-UHFFFAOYSA-N	0	2	293.235	0.235	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CC(=O)N1	ZINC001447265380	930595764	/nfs/dbraw/zinc/59/57/64/930595764.db2.gz	LHVKPBWWCJPHRZ-ZETCQYMHSA-N	0	2	251.198	0.127	20	5		CCBDLN
CC(C)(CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000124828759	187156477	/nfs/dbraw/zinc/15/64/77/187156477.db2.gz	TTZPFCFCTWCHPK-UHFFFAOYSA-N	0	2	281.268	0.684	20	5		CCBDLN
O=C(N[C@@H]1CCCCNC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000128876100	187395584	/nfs/dbraw/zinc/39/55/84/187395584.db2.gz	KWNYLWIMGQRXAA-SNVBAGLBSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(NC[C@@H]1CC[C@H](CO)O1)c1cccc(O)c1[N+](=O)[O-]	ZINC000349577962	137396535	/nfs/dbraw/zinc/39/65/35/137396535.db2.gz	UGDNNGLLZZNSMI-DTWKUNHWSA-N	0	2	296.279	0.570	20	5		CCBDLN
Cc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2O)n1C	ZINC000122157505	350062619	/nfs/dbraw/zinc/06/26/19/350062619.db2.gz	UOGNUKQCXCYMQP-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
NC(=O)N1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000271321758	191072545	/nfs/dbraw/zinc/07/25/45/191072545.db2.gz	XNYXHBRIQNITNX-ZETCQYMHSA-N	0	2	294.267	0.183	20	5		CCBDLN
CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000107355665	186171192	/nfs/dbraw/zinc/17/11/92/186171192.db2.gz	OYPRZZQFYZZFKE-SNVBAGLBSA-N	0	2	281.268	0.540	20	5		CCBDLN
CC(C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182066154	351346462	/nfs/dbraw/zinc/34/64/62/351346462.db2.gz	CGGYDFYFOBVAEK-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
CNC(=O)[C@@H](C)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000187660454	351551257	/nfs/dbraw/zinc/55/12/57/351551257.db2.gz	MGMNDRBLPLLPNP-QMMMGPOBSA-N	0	2	295.295	0.755	20	5		CCBDLN
O=C(NC[C@@H]1COCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000226561114	352029161	/nfs/dbraw/zinc/02/91/61/352029161.db2.gz	YMHOORHMQOAKDC-SECBINFHSA-N	0	2	282.252	0.446	20	5		CCBDLN
NC(=O)CCCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000228874990	352085146	/nfs/dbraw/zinc/08/51/46/352085146.db2.gz	NEHSTAKSYFYJDK-UHFFFAOYSA-N	0	2	281.268	0.686	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@H](CO)O1	ZINC000331234193	354500280	/nfs/dbraw/zinc/50/02/80/354500280.db2.gz	KIKHWDDPNSRWPE-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
Cn1cc(NS(=O)(=O)Cc2ccccc2[N+](=O)[O-])nn1	ZINC000359464780	137951185	/nfs/dbraw/zinc/95/11/85/137951185.db2.gz	DMSSSYGXQACGBP-UHFFFAOYSA-N	0	2	297.296	0.665	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H]1CCN(C)C1=O	ZINC000353269333	356191609	/nfs/dbraw/zinc/19/16/09/356191609.db2.gz	USMYPWDXTGSCPO-NSHDSACASA-N	0	2	293.279	0.603	20	5		CCBDLN
C[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)NCCF	ZINC000355801491	356651572	/nfs/dbraw/zinc/65/15/72/356651572.db2.gz	HOMPLUWIXFBHIV-ZETCQYMHSA-N	0	2	299.258	0.504	20	5		CCBDLN
Cc1noc(CSc2n[n-]c(=[NH2+])n2C)c1[N+](=O)[O-]	ZINC000596014320	360774786	/nfs/dbraw/zinc/77/47/86/360774786.db2.gz	NPAZXUJLDZHBBB-UHFFFAOYSA-N	0	2	270.274	0.725	20	5		CCBDLN
Cc1nn(C)c(N2CC[C@H](O)C(F)(F)C2)c1[N+](=O)[O-]	ZINC000596429958	360892073	/nfs/dbraw/zinc/89/20/73/360892073.db2.gz	PVZLJTCKGDGSIW-ZETCQYMHSA-N	0	2	276.243	0.843	20	5		CCBDLN
COc1cc(F)c([N+](=O)[O-])c(NCc2n[nH]c(=O)[nH]2)c1	ZINC000301786226	201196254	/nfs/dbraw/zinc/19/62/54/201196254.db2.gz	PMKQNZJRMZGFJN-UHFFFAOYSA-N	0	2	283.219	0.766	20	5		CCBDLN
O=C(NCCCn1cncn1)c1ccc([N+](=O)[O-])cc1O	ZINC000613895827	364434619	/nfs/dbraw/zinc/43/46/19/364434619.db2.gz	NAWVQMIMEHQUSE-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ncn(C)n1	ZINC000275478701	193053590	/nfs/dbraw/zinc/05/35/90/193053590.db2.gz	FTQSPNSMYMZCAT-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
Cc1nc([N+](=O)[O-])cn1CC(=O)N1CCC(C)(CO)CC1	ZINC000330871976	203336290	/nfs/dbraw/zinc/33/62/90/203336290.db2.gz	GPRUHRFRMXRHBY-UHFFFAOYSA-N	0	2	296.327	0.721	20	5		CCBDLN
O=C(NOC[C@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000276299722	193276240	/nfs/dbraw/zinc/27/62/40/193276240.db2.gz	AECYCCGXMDYKCT-QMMMGPOBSA-N	0	2	282.252	0.998	20	5		CCBDLN
Cc1nnc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n1C	ZINC000119813807	284666677	/nfs/dbraw/zinc/66/66/77/284666677.db2.gz	MZBYYFOZKZYDKT-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
C[C@@H](CCO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280886163	195014609	/nfs/dbraw/zinc/01/46/09/195014609.db2.gz	CSMAPTORAPIBIT-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
COC[C@H]1C(=O)N[C@@H](c2ccc(O)c([N+](=O)[O-])c2)N1C	ZINC000414202230	533121174	/nfs/dbraw/zinc/12/11/74/533121174.db2.gz	UHULZVQVGRHRPT-GXSJLCMTSA-N	0	2	281.268	0.376	20	5		CCBDLN
COC(=O)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000412755187	291931573	/nfs/dbraw/zinc/93/15/73/291931573.db2.gz	GLDKTGTZMKPLLM-DTORHVGOSA-N	0	2	294.263	0.982	20	5		CCBDLN
O=C(NN1CCCCC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184727992	388778141	/nfs/dbraw/zinc/77/81/41/388778141.db2.gz	IKWGBWFVLLNHFI-UHFFFAOYSA-N	0	2	279.252	0.958	20	5		CCBDLN
NC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000188116889	388914245	/nfs/dbraw/zinc/91/42/45/388914245.db2.gz	SKNCGODZFOFUIH-UHFFFAOYSA-N	0	2	265.225	0.048	20	5		CCBDLN
Cc1cc(=NC(=O)c2nn(C)cc2[N+](=O)[O-])[nH]nc1C	ZINC000355495757	389085169	/nfs/dbraw/zinc/08/51/69/389085169.db2.gz	AXDZKJJSBPJOFT-UHFFFAOYSA-N	0	2	276.256	0.409	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1CCN(C)C1=O	ZINC000265840116	389361595	/nfs/dbraw/zinc/36/15/95/389361595.db2.gz	WYSSGZSGXXRCKW-SNVBAGLBSA-N	0	2	293.279	0.603	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n(C)n1	ZINC000166537880	389442527	/nfs/dbraw/zinc/44/25/27/389442527.db2.gz	TXSSLICVPBNFEI-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
CNC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(C)C	ZINC000179125965	389639379	/nfs/dbraw/zinc/63/93/79/389639379.db2.gz	ZPHBJSKTZCWHRH-NSHDSACASA-N	0	2	295.295	0.801	20	5		CCBDLN
CCCNC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179445076	389656331	/nfs/dbraw/zinc/65/63/31/389656331.db2.gz	ICBQCKNBGBPZHL-UHFFFAOYSA-N	0	2	295.295	0.947	20	5		CCBDLN
Cn1c[nH+]cc1CNC(=O)c1cccc([N+](=O)[O-])c1[O-]	ZINC000388443191	389770118	/nfs/dbraw/zinc/77/01/18/389770118.db2.gz	HNNWBGUMJZJOFO-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
Cc1cccc([N+](=O)[O-])c1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000446235450	389932198	/nfs/dbraw/zinc/93/21/98/389932198.db2.gz	BVOBKZVMFJGPPH-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
COC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436857645	389986074	/nfs/dbraw/zinc/98/60/74/389986074.db2.gz	BIMDTFTVFYENKK-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
O=C(NCCc1cn[nH]c1)c1ccc([N+](=O)[O-])cc1O	ZINC000436980269	389989145	/nfs/dbraw/zinc/98/91/45/389989145.db2.gz	MVDFFPKXXQOIFI-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
O=C(NC[C@@H]1CC[C@H](CO)O1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000356506601	144008722	/nfs/dbraw/zinc/00/87/22/144008722.db2.gz	LHUDBXCDLCUUKK-VHSXEESVSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NCc1cc[nH]n1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000548082303	286003482	/nfs/dbraw/zinc/00/34/82/286003482.db2.gz	NHTRQDMUKYLPKM-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@@H]1COC[C@@H]1O	ZINC000342400793	288924001	/nfs/dbraw/zinc/92/40/01/288924001.db2.gz	KUPRAPAUCLSPKD-SCZZXKLOSA-N	0	2	282.252	0.132	20	5		CCBDLN
CNC(=O)[C@H](C)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182076522	290596834	/nfs/dbraw/zinc/59/68/34/290596834.db2.gz	IOBFCWSZEOQEIG-MRVPVSSYSA-N	0	2	295.295	0.755	20	5		CCBDLN
Cn1cc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)nn1	ZINC000573249691	334921513	/nfs/dbraw/zinc/92/15/13/334921513.db2.gz	VJTCMPNKJVRESG-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CC(C)CN(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181868738	519714407	/nfs/dbraw/zinc/71/44/07/519714407.db2.gz	ZDZGPQNCWJDGAC-UHFFFAOYSA-N	0	2	295.295	0.884	20	5		CCBDLN
O=C(N[C@H](CO)C1CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000778510675	581158656	/nfs/dbraw/zinc/15/86/56/581158656.db2.gz	LUETVSTYERSTAK-SECBINFHSA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@H]2C[C@@]2(CO)C1	ZINC000783792326	581362746	/nfs/dbraw/zinc/36/27/46/581362746.db2.gz	YTWJCCIFBCRXAZ-OQPBUACISA-N	0	2	278.264	0.755	20	5		CCBDLN
O=C(NN1CCCC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000773691083	581937852	/nfs/dbraw/zinc/93/78/52/581937852.db2.gz	DOUPMFRWGGLREC-UHFFFAOYSA-N	0	2	265.225	0.568	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@@H]2C[C@]2(CO)C1	ZINC000803154782	640718290	/nfs/dbraw/zinc/71/82/90/640718290.db2.gz	AVJWRBOACKXFKR-ISVAXAHUSA-N	0	2	278.264	0.755	20	5		CCBDLN
COc1ncccc1N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840356649	641318885	/nfs/dbraw/zinc/31/88/85/641318885.db2.gz	DOPORDJZPQDHEV-VXNVDRBHSA-N	0	2	251.242	0.718	20	5		CCBDLN
O=C(NC[C@H]1COCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000861979585	644961781	/nfs/dbraw/zinc/96/17/81/644961781.db2.gz	XBLVJGRFKQVLKA-QMMMGPOBSA-N	0	2	268.225	0.403	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1cccc(Cl)c1[N+](=O)[O-]	ZINC000119903983	651059635	/nfs/dbraw/zinc/05/96/35/651059635.db2.gz	RPLNEVYDNFCCAN-UHFFFAOYSA-N	0	2	297.658	0.590	20	5		CCBDLN
CC[C@H](C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC001155294063	800948406	/nfs/dbraw/zinc/94/84/06/800948406.db2.gz	SKHKRGRROSKILH-CPCISQLKSA-N	0	2	295.295	0.930	20	5		CCBDLN
CSc1nc(O[C@H]2C[C@H](O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218359061	811514456	/nfs/dbraw/zinc/51/44/56/811514456.db2.gz	HBQUVEYRCZXKMC-URHBZAFASA-N	0	2	273.270	0.714	20	5		CCBDLN
Cc1cncc([N+](=O)[O-])c1NCc1n[nH]c(=O)[nH]1	ZINC001326425751	913950946	/nfs/dbraw/zinc/95/09/46/913950946.db2.gz	GMJXFECZZMZICM-UHFFFAOYSA-N	0	2	250.218	0.156	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCO[C@H](CC(=O)[O-])C1	ZINC000091296599	958135793	/nfs/dbraw/zinc/13/57/93/958135793.db2.gz	NHWMVHXKYKPIHO-SNVBAGLBSA-N	0	2	298.299	0.275	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCO[C@H](CC(=O)[O-])C1	ZINC000091296599	958135802	/nfs/dbraw/zinc/13/58/02/958135802.db2.gz	NHWMVHXKYKPIHO-SNVBAGLBSA-N	0	2	298.299	0.275	20	5		CCBDLN
O=C([O-])[C@H]1C[C@H](O)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000132032293	958761946	/nfs/dbraw/zinc/76/19/46/958761946.db2.gz	NFVWPBNSCVRZGN-GXSJLCMTSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@H]1C[C@H](O)C[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000132032293	958761967	/nfs/dbraw/zinc/76/19/67/958761967.db2.gz	NFVWPBNSCVRZGN-GXSJLCMTSA-N	0	2	266.253	0.615	20	5		CCBDLN
Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)nn1	ZINC000092023425	349481306	/nfs/dbraw/zinc/48/13/06/349481306.db2.gz	HEGBRPZHHIZBEL-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
Cc1cnc(OCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000092870380	349509016	/nfs/dbraw/zinc/50/90/16/349509016.db2.gz	MTZSPRWZIRSKQW-UHFFFAOYSA-N	0	2	251.202	0.289	20	5		CCBDLN
CCn1nncc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600159620	361880850	/nfs/dbraw/zinc/88/08/50/361880850.db2.gz	WNPDZQVXKBYMHW-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
COC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273272962	192094746	/nfs/dbraw/zinc/09/47/46/192094746.db2.gz	OVHOHDCUEAJDIY-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
Cc1ccc(NC(=O)NCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000128437401	350192506	/nfs/dbraw/zinc/19/25/06/350192506.db2.gz	DNRNTZSXKCXALJ-UHFFFAOYSA-N	0	2	292.255	0.636	20	5		CCBDLN
CNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000132286243	350302347	/nfs/dbraw/zinc/30/23/47/350302347.db2.gz	LSXCNIWASLGQDN-ZCFIWIBFSA-N	0	2	267.241	0.165	20	5		CCBDLN
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1ccc2nn[nH]c2c1	ZINC000153107931	350553608	/nfs/dbraw/zinc/55/36/08/350553608.db2.gz	HAKCTHNVTXWAMV-UHFFFAOYSA-N	0	2	287.239	0.701	20	5		CCBDLN
C[C@H](O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186177330	351481701	/nfs/dbraw/zinc/48/17/01/351481701.db2.gz	XEALTQJZKYGKDF-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
NC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000221193677	351977178	/nfs/dbraw/zinc/97/71/78/351977178.db2.gz	VOCPWHMHYFYAGJ-SECBINFHSA-N	0	2	293.279	0.638	20	5		CCBDLN
CN(Cc1nc[nH]n1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234315751	352157000	/nfs/dbraw/zinc/15/70/00/352157000.db2.gz	RAALIAIVKCSRJT-UHFFFAOYSA-N	0	2	277.240	0.691	20	5		CCBDLN
CN(Cc1nnc[nH]1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234315751	352157004	/nfs/dbraw/zinc/15/70/04/352157004.db2.gz	RAALIAIVKCSRJT-UHFFFAOYSA-N	0	2	277.240	0.691	20	5		CCBDLN
O=C(Nc1nn2cnnc2s1)c1ccc([N+](=O)[O-])o1	ZINC000603467489	363135397	/nfs/dbraw/zinc/13/53/97/363135397.db2.gz	NDHPZICYKXTTDC-UHFFFAOYSA-N	0	2	280.225	0.361	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCn2cnnc2C1	ZINC000274718742	353156197	/nfs/dbraw/zinc/15/61/97/353156197.db2.gz	CZDBHHVFDWUCNZ-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
CC(C)NC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157456274	188318527	/nfs/dbraw/zinc/31/85/27/188318527.db2.gz	RSJKARWBBQCNBV-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
COC(=O)[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OC	ZINC000294110342	353869959	/nfs/dbraw/zinc/86/99/59/353869959.db2.gz	SEDKQTGGNJMQRQ-JTQLQIEISA-N	0	2	298.251	0.218	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000295756680	353916918	/nfs/dbraw/zinc/91/69/18/353916918.db2.gz	IABOSGGOYOJWSY-MRVPVSSYSA-N	0	2	267.241	0.294	20	5		CCBDLN
NC(=O)CSCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000340546006	355570466	/nfs/dbraw/zinc/57/04/66/355570466.db2.gz	IXDLNIYXIUQTGY-UHFFFAOYSA-N	0	2	285.281	0.457	20	5		CCBDLN
Cn1nncc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000360671387	138005702	/nfs/dbraw/zinc/00/57/02/138005702.db2.gz	CJVLVHOJKMQXQY-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
O=C(N[C@]1(CO)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000273617901	192233270	/nfs/dbraw/zinc/23/32/70/192233270.db2.gz	YDZGJTXFOXGENJ-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])C1CC(O)C1	ZINC000354775548	356495932	/nfs/dbraw/zinc/49/59/32/356495932.db2.gz	CIUBDUPKBVORSQ-UHFFFAOYSA-N	0	2	266.253	0.896	20	5		CCBDLN
CC[C@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355096967	356576516	/nfs/dbraw/zinc/57/65/16/356576516.db2.gz	CPDLFBGCMMAPOB-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
CC[C@@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355748772	356639354	/nfs/dbraw/zinc/63/93/54/356639354.db2.gz	PLWPENYJTYRCJI-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@@H]2C[C@H]1C[S@@]2=O	ZINC000593873336	360186066	/nfs/dbraw/zinc/18/60/66/360186066.db2.gz	ZAFSLAVPHWMERQ-FRUKKLPWSA-N	0	2	296.304	0.646	20	5		CCBDLN
Nc1ccc(N2CC[C@H](O)C(F)(F)C2)nc1[N+](=O)[O-]	ZINC000596428742	360891895	/nfs/dbraw/zinc/89/18/95/360891895.db2.gz	CLIHPJGFFIYOOS-ZETCQYMHSA-N	0	2	274.227	0.778	20	5		CCBDLN
COC(=O)[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000598516051	361433687	/nfs/dbraw/zinc/43/36/87/361433687.db2.gz	RNDLLICUXNJBPS-ZKCHVHJHSA-N	0	2	294.263	0.982	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCC(C)(F)F)n1	ZINC000599313653	361648327	/nfs/dbraw/zinc/64/83/27/361648327.db2.gz	MZIVJKBEMGBGKR-UHFFFAOYSA-N	0	2	284.244	0.262	20	5		CCBDLN
COCCCN(CCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000275822941	193138568	/nfs/dbraw/zinc/13/85/68/193138568.db2.gz	FJXQYEULICJUHW-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
C[C@@H]1CC(=O)NCCN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000375802861	296270024	/nfs/dbraw/zinc/27/00/24/296270024.db2.gz	XJUJHGLYXZLCED-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)O1	ZINC000288740294	388865738	/nfs/dbraw/zinc/86/57/38/388865738.db2.gz	XFZVVWRCCXICKZ-SVRRBLITSA-N	0	2	280.236	0.734	20	5		CCBDLN
O=C(NCCCCO)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355561134	389093438	/nfs/dbraw/zinc/09/34/38/389093438.db2.gz	XFAIPIRXKDLCRI-UHFFFAOYSA-N	0	2	254.242	0.803	20	5		CCBDLN
COC[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000367617852	389337142	/nfs/dbraw/zinc/33/71/42/389337142.db2.gz	RPCLKVGJKOIZKW-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
COC(=O)[C@H]1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000413971381	389587906	/nfs/dbraw/zinc/58/79/06/389587906.db2.gz	IEVKAMQKTGLIIA-OCAPTIKFSA-N	0	2	294.263	0.982	20	5		CCBDLN
Cn1cc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cn1	ZINC000352014309	389735372	/nfs/dbraw/zinc/73/53/72/389735372.db2.gz	PCSONWNYUGYGOJ-NSCUHMNNSA-N	0	2	263.213	0.700	20	5		CCBDLN
O=C(N[C@H](CO)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000436804507	389984964	/nfs/dbraw/zinc/98/49/64/389984964.db2.gz	BMNHLBYCURBEQB-PWSUYJOCSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000436962961	389988646	/nfs/dbraw/zinc/98/86/46/389988646.db2.gz	GCPDDPYFPXLSRA-QPUJVOFHSA-N	0	2	296.279	0.428	20	5		CCBDLN
COCC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000281640593	195318991	/nfs/dbraw/zinc/31/89/91/195318991.db2.gz	NDDZGEMKFMVYLH-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@H](CO)[C@@H](O)C1	ZINC000567159648	390675483	/nfs/dbraw/zinc/67/54/83/390675483.db2.gz	SHFVBXVFDMADMN-UFBFGSQYSA-N	0	2	296.279	0.116	20	5		CCBDLN
C[C@H](C(=O)[O-])[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000262649047	131247529	/nfs/dbraw/zinc/24/75/29/131247529.db2.gz	KTIIMVQMUDLKES-SECBINFHSA-N	0	2	295.295	0.963	20	5		CCBDLN
C[C@H](C(=O)[O-])[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000262649047	131247531	/nfs/dbraw/zinc/24/75/31/131247531.db2.gz	KTIIMVQMUDLKES-SECBINFHSA-N	0	2	295.295	0.963	20	5		CCBDLN
COC(=O)C(C)(C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436864564	397533757	/nfs/dbraw/zinc/53/37/57/397533757.db2.gz	NGDCZVZBJHFUIU-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H]1O	ZINC000351868450	296921336	/nfs/dbraw/zinc/92/13/36/296921336.db2.gz	FLGSRSUUKJWXNT-HQJQHLMTSA-N	0	2	266.253	0.753	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000576238962	335176172	/nfs/dbraw/zinc/17/61/72/335176172.db2.gz	NPCQKZRHKJZDAB-SFYZADRCSA-N	0	2	279.252	0.750	20	5		CCBDLN
CCC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000425042021	528325573	/nfs/dbraw/zinc/32/55/73/528325573.db2.gz	ZZBJUKCXJSSKHD-UHFFFAOYSA-N	0	2	293.279	0.952	20	5		CCBDLN
CCN(CC)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772410225	581862932	/nfs/dbraw/zinc/86/29/32/581862932.db2.gz	FPCPFSUQLFGNCU-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])s1	ZINC000774878330	582000451	/nfs/dbraw/zinc/00/04/51/582000451.db2.gz	LANKGYOWNQCABY-UHFFFAOYSA-N	0	2	270.226	0.837	20	5		CCBDLN
O=C(COc1cccc([N+](=O)[O-])c1)OCc1n[nH]c(=O)[nH]1	ZINC000774918073	582002353	/nfs/dbraw/zinc/00/23/53/582002353.db2.gz	CFSLXJWPXHPRSF-UHFFFAOYSA-N	0	2	294.223	0.541	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000821513392	598194358	/nfs/dbraw/zinc/19/43/58/598194358.db2.gz	VLFAOBZUPBLZQS-NEPJUHHUSA-N	0	2	296.279	0.414	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000821513392	598194359	/nfs/dbraw/zinc/19/43/59/598194359.db2.gz	VLFAOBZUPBLZQS-NEPJUHHUSA-N	0	2	296.279	0.414	20	5		CCBDLN
Cn1c[nH+]cc1Cn1cc([N+](=O)[O-])cc(C(=O)[O-])c1=O	ZINC000833058961	601786808	/nfs/dbraw/zinc/78/68/08/601786808.db2.gz	UDQJPTMPMXYCKI-UHFFFAOYSA-N	0	2	278.224	0.237	20	5		CCBDLN
O=C([O-])N1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000834113713	606030173	/nfs/dbraw/zinc/03/01/73/606030173.db2.gz	ZZZZXFCKTHMOEG-GFCCVEGCSA-N	0	2	295.295	0.924	20	5		CCBDLN
COC(=O)Cc1cccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839735074	616719163	/nfs/dbraw/zinc/71/91/63/616719163.db2.gz	XGAIJEMHKGVDLN-RKDXNWHRSA-N	0	2	279.252	0.401	20	5		CCBDLN
COCc1ccnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000845023818	616909704	/nfs/dbraw/zinc/90/97/04/616909704.db2.gz	ZDAYPIZKWHFXIF-RKDXNWHRSA-N	0	2	251.242	0.832	20	5		CCBDLN
COC(=O)c1ccnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000839685037	616948480	/nfs/dbraw/zinc/94/84/80/616948480.db2.gz	ZWXGHSGNMWBNBV-HTQZYQBOSA-N	0	2	265.225	0.472	20	5		CCBDLN
O=C(Nc1nnc(C2CCC2)[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839727084	640358036	/nfs/dbraw/zinc/35/80/36/640358036.db2.gz	VCEMLYMNEOUSBH-RNFRBKRXSA-N	0	2	251.246	0.676	20	5		CCBDLN
Cc1cnc2c(c1)N(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCN2	ZINC000858000462	644591067	/nfs/dbraw/zinc/59/10/67/644591067.db2.gz	HCOAMYAWNZQPGV-RKDXNWHRSA-N	0	2	262.269	0.814	20	5		CCBDLN
COc1nc(O[C@H](C[N+](=O)[O-])c2cccnc2)cc(=O)[nH]1	ZINC001227000636	805306694	/nfs/dbraw/zinc/30/66/94/805306694.db2.gz	OTZOQDAAFWFNNY-SECBINFHSA-N	0	2	292.251	0.983	20	5		CCBDLN
Cn1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(Br)n1	ZINC001130977768	837965575	/nfs/dbraw/zinc/96/55/75/837965575.db2.gz	YPWZPSZKVGKIHA-INEUFUBQSA-N	0	2	289.089	0.786	20	5		CCBDLN
O=C(NC[C@@H](O)[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000600240783	361901602	/nfs/dbraw/zinc/90/16/02/361901602.db2.gz	HLVMBCZKDSSMGC-NEPJUHHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600243548	361902253	/nfs/dbraw/zinc/90/22/53/361902253.db2.gz	ULYQLILEXUMOOY-VXGBXAGGSA-N	0	2	296.279	0.570	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@H]1C[C@@H](C(N)=O)C1	ZINC000600580048	362012657	/nfs/dbraw/zinc/01/26/57/362012657.db2.gz	RBIFJIMIFDFLEA-OTSSQURYSA-N	0	2	293.279	0.636	20	5		CCBDLN
C[C@H](O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182029502	231831157	/nfs/dbraw/zinc/83/11/57/231831157.db2.gz	OAZFRPMONKJQKB-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
CC(C)(C(N)=O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000618237883	365953258	/nfs/dbraw/zinc/95/32/58/365953258.db2.gz	AHJNWFMWJZSLLS-UHFFFAOYSA-N	0	2	267.241	0.750	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@@H](CO)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346814585	137305803	/nfs/dbraw/zinc/30/58/03/137305803.db2.gz	BTYFMRWHCJFQCO-RKDXNWHRSA-N	0	2	278.264	0.967	20	5		CCBDLN
CC[C@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181988822	351343428	/nfs/dbraw/zinc/34/34/28/351343428.db2.gz	PVHDBXHNROLSGR-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N(CCO)C1CC1	ZINC000182118537	351347965	/nfs/dbraw/zinc/34/79/65/351347965.db2.gz	PWWXDYDAMCXUMO-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Cc1cccc([N+](=O)[O-])c1C(=O)N=c1cc(C(N)=O)[nH][nH]1	ZINC000618466621	366026336	/nfs/dbraw/zinc/02/63/36/366026336.db2.gz	OSJLAEUTFHSHBW-UHFFFAOYSA-N	0	2	289.251	0.399	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1=O	ZINC000230262121	352109294	/nfs/dbraw/zinc/10/92/94/352109294.db2.gz	FSSQEBMTRRPZLO-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
CNC(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234396239	352158828	/nfs/dbraw/zinc/15/88/28/352158828.db2.gz	YGNOWNLLVLNVSX-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
COC(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234526118	352159239	/nfs/dbraw/zinc/15/92/39/352159239.db2.gz	QEZAAYYUAOMFHG-UHFFFAOYSA-N	0	2	268.225	0.545	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1[O-])[C@H]1CSC[NH2+]1	ZINC000236583207	352199053	/nfs/dbraw/zinc/19/90/53/352199053.db2.gz	DCCLFBRZWWMSEH-MRVPVSSYSA-N	0	2	269.282	0.901	20	5		CCBDLN
CC1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)OCCO1	ZINC000272446628	353064689	/nfs/dbraw/zinc/06/46/89/353064689.db2.gz	VKWUEDWNFZHGTN-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
CCOC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273160717	353110634	/nfs/dbraw/zinc/11/06/34/353110634.db2.gz	BJRJJBMBQGISNQ-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
O=C(NC[C@@]1(O)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000273246353	353110686	/nfs/dbraw/zinc/11/06/86/353110686.db2.gz	QZZQSULURPUQKB-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC[C@H]1CO	ZINC000154065402	188120562	/nfs/dbraw/zinc/12/05/62/188120562.db2.gz	SWQUSEFSPGPMFD-VIFPVBQESA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC[C@@H](O)C1	ZINC000157538297	188324300	/nfs/dbraw/zinc/32/43/00/188324300.db2.gz	ATAPIAPJNHVIKJ-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(CCn1cc([N+](=O)[O-])cn1)N=c1cccn[nH]1	ZINC000346065901	355867353	/nfs/dbraw/zinc/86/73/53/355867353.db2.gz	PNSCZJQDAOIJDM-UHFFFAOYSA-N	0	2	262.229	0.032	20	5		CCBDLN
O=C(N[C@]1(CO)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000273564530	192206769	/nfs/dbraw/zinc/20/67/69/192206769.db2.gz	JAVMCTRFWQHYOY-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
CCn1c(C)nc([N+](=O)[O-])c1NCc1n[nH]c(=O)[nH]1	ZINC000361042908	138020036	/nfs/dbraw/zinc/02/00/36/138020036.db2.gz	BUKFSTNBJAGJIB-UHFFFAOYSA-N	0	2	267.249	0.555	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@H]1CCNC1=O	ZINC000436958240	235711220	/nfs/dbraw/zinc/71/12/20/235711220.db2.gz	FLWPSTIQQXARRH-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NC[C@H]1CCCNC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000619878801	366368305	/nfs/dbraw/zinc/36/83/05/366368305.db2.gz	CWCHQFUUEOOHLK-MRVPVSSYSA-N	0	2	293.279	0.556	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@@H](CO)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000359470462	356827609	/nfs/dbraw/zinc/82/76/09/356827609.db2.gz	FESYGAUEFGSPMS-PSASIEDQSA-N	0	2	278.264	0.967	20	5		CCBDLN
COC[C@](C)(O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000452784474	236261434	/nfs/dbraw/zinc/26/14/34/236261434.db2.gz	WHIGQFWQORHLFJ-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)c2ccc(F)cc2[N+](=O)[O-])[nH][nH]1	ZINC000611141428	363664730	/nfs/dbraw/zinc/66/47/30/363664730.db2.gz	AWMRAHMOUGDNNY-UHFFFAOYSA-N	0	2	293.214	0.230	20	5		CCBDLN
O=C(N[C@H]1C[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000597410233	361088748	/nfs/dbraw/zinc/08/87/48/361088748.db2.gz	PJKCRKQEHNYGCQ-WRXNHJIOSA-N	0	2	252.226	0.554	20	5		CCBDLN
CCn1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)nn1	ZINC000598141055	361343544	/nfs/dbraw/zinc/34/35/44/361343544.db2.gz	ATPKYIYJXBMKJK-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(NC[C@@H]1CCC(=O)N1)c1ccc([N+](=O)[O-])cc1O	ZINC000598299654	361384327	/nfs/dbraw/zinc/38/43/27/361384327.db2.gz	PVMCTYOPALADNQ-ZETCQYMHSA-N	0	2	279.252	0.309	20	5		CCBDLN
COC(=O)[C@H]1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000598517588	361434523	/nfs/dbraw/zinc/43/45/23/361434523.db2.gz	XKAFNCBZHDTNHM-ZKCHVHJHSA-N	0	2	294.263	0.982	20	5		CCBDLN
COC[C@@](C)(CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000613534856	364287718	/nfs/dbraw/zinc/28/77/18/364287718.db2.gz	WKUYXFWZCHBSPZ-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1c(NS(=O)(=O)c2cnnn2C)cccc1[N+](=O)[O-]	ZINC000616169895	365201459	/nfs/dbraw/zinc/20/14/59/365201459.db2.gz	XVIFLISNENOOKF-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
O=[N+]([O-])c1ccc(O)cc1CN1CCc2n[nH]nc2C1	ZINC000339119021	285137490	/nfs/dbraw/zinc/13/74/90/285137490.db2.gz	PCDCULQDYPOVGP-UHFFFAOYSA-N	0	2	275.268	0.977	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nc[nH]n1	ZINC000187525848	388884887	/nfs/dbraw/zinc/88/48/87/388884887.db2.gz	TUSWRMGZPVIFRL-ZCFIWIBFSA-N	0	2	277.240	0.910	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nnc[nH]1	ZINC000187525848	388884891	/nfs/dbraw/zinc/88/48/91/388884891.db2.gz	TUSWRMGZPVIFRL-ZCFIWIBFSA-N	0	2	277.240	0.910	20	5		CCBDLN
COC[C@@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355515787	389087922	/nfs/dbraw/zinc/08/79/22/389087922.db2.gz	WMZJWZNZORUBHT-SSDOTTSWSA-N	0	2	270.241	0.038	20	5		CCBDLN
COCC[C@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355609804	389101417	/nfs/dbraw/zinc/10/14/17/389101417.db2.gz	BPRSXCFPPRSQDH-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=c1[nH]c(=O)c([N+](=O)[O-])c(C=Cc2cocn2)[nH]1	ZINC000352013816	389735572	/nfs/dbraw/zinc/73/55/72/389735572.db2.gz	MPKYIDIUKZHBFI-UPHRSURJSA-N	0	2	250.170	0.954	20	5		CCBDLN
COCCOC1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000436969580	389988295	/nfs/dbraw/zinc/98/82/95/389988295.db2.gz	ZCBBQGXDJIIODT-UHFFFAOYSA-N	0	2	296.279	0.788	20	5		CCBDLN
Cn1cc[nH+]c1CNC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000436962955	389988372	/nfs/dbraw/zinc/98/83/72/389988372.db2.gz	CMBZLEAWWCFWFM-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CN1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000436971255	389988850	/nfs/dbraw/zinc/98/88/50/389988850.db2.gz	HYZJJBFOQRHMFI-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
CCOC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000437004252	389990514	/nfs/dbraw/zinc/99/05/14/389990514.db2.gz	VAWGTCFSOAQFJB-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
CN(Cc1nnnn1C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436884393	397535056	/nfs/dbraw/zinc/53/50/56/397535056.db2.gz	BTXXDOWELUZULX-UHFFFAOYSA-N	0	2	292.255	0.096	20	5		CCBDLN
O=C(N[C@@H]1CC[C@H]1O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000425058479	534771648	/nfs/dbraw/zinc/77/16/48/534771648.db2.gz	JKPDEZWCWWMFFV-VXNVDRBHSA-N	0	2	252.226	0.554	20	5		CCBDLN
CC[S@@](=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772945983	581901827	/nfs/dbraw/zinc/90/18/27/581901827.db2.gz	FSKRVWCWMVIDLM-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
CC(=O)Nc1cccnc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840419809	614208633	/nfs/dbraw/zinc/20/86/33/614208633.db2.gz	CLRYJDPEGBPJRT-VXNVDRBHSA-N	0	2	264.241	0.644	20	5		CCBDLN
CN(C)c1cccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839720354	616022629	/nfs/dbraw/zinc/02/26/29/616022629.db2.gz	BDFKAGOSHHAQJZ-HTQZYQBOSA-N	0	2	250.258	0.751	20	5		CCBDLN
CON(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000817665809	617036576	/nfs/dbraw/zinc/03/65/76/617036576.db2.gz	CKQSBAAODSHCBG-UHFFFAOYSA-N	0	2	283.240	0.050	20	5		CCBDLN
COc1cc(-c2noc([C@@H]3C[C@H]3[N+](=O)[O-])n2)ncn1	ZINC000904786651	617151223	/nfs/dbraw/zinc/15/12/23/617151223.db2.gz	FOKAXPUFNRRKRY-IYSWYEEDSA-N	0	2	263.213	0.668	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H](O)Cc2ccccc21	ZINC000839748273	640360350	/nfs/dbraw/zinc/36/03/50/640360350.db2.gz	YSTVRTAIHZCWLJ-HOSYDEDBSA-N	0	2	262.265	0.602	20	5		CCBDLN
O=C(N[C@@H](CO)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000802990352	640712654	/nfs/dbraw/zinc/71/26/54/640712654.db2.gz	WBUIGTGOPSPOMX-JTQLQIEISA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(Nc1ccc2c(n1)OCCO2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000855572396	644335010	/nfs/dbraw/zinc/33/50/10/644335010.db2.gz	TZLWFOZOPPPEOR-RNFRBKRXSA-N	0	2	265.225	0.457	20	5		CCBDLN
CSc1nc(OC2CC(O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218256956	803943568	/nfs/dbraw/zinc/94/35/68/803943568.db2.gz	HBQUVEYRCZXKMC-UHFFFAOYSA-N	0	2	273.270	0.714	20	5		CCBDLN
Cn1cnc2nc(=O)[nH]c(O[C@H](C[N+](=O)[O-])C3CC3)c21	ZINC001228674208	805468380	/nfs/dbraw/zinc/46/83/80/805468380.db2.gz	LWLKPAPFCHXMQY-SSDOTTSWSA-N	0	2	279.256	0.503	20	5		CCBDLN
CCN(CCNCc1cnns1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001268449971	812578420	/nfs/dbraw/zinc/57/84/20/812578420.db2.gz	MAFJVTBLQKYUNN-NXEZZACHSA-N	0	2	299.356	0.141	20	5		CCBDLN
C[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])[C@H](CO)C1	ZINC001301605629	907979005	/nfs/dbraw/zinc/97/90/05/907979005.db2.gz	SNHZHHJKFMVXJB-VIFPVBQESA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2[O-])[C@H](CO)C1	ZINC001301605629	907979015	/nfs/dbraw/zinc/97/90/15/907979015.db2.gz	SNHZHHJKFMVXJB-VIFPVBQESA-N	0	2	295.295	0.049	20	5		CCBDLN
CN(C)c1cc(Cn2cc([N+](=O)[O-])c(C(=O)[O-])n2)cc[nH+]1	ZINC001598305802	991262976	/nfs/dbraw/zinc/26/29/76/991262976.db2.gz	OIMVKNOULBYYTA-UHFFFAOYSA-N	0	2	291.267	0.999	20	5		CCBDLN
O=C(NC[C@@H](O)[C@@H]1CCCO1)c1cccc(O)c1[N+](=O)[O-]	ZINC000600241419	361901103	/nfs/dbraw/zinc/90/11/03/361901103.db2.gz	KCBIGRHIIWPDJZ-MNOVXSKESA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)COCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000600402705	361950575	/nfs/dbraw/zinc/95/05/75/361950575.db2.gz	KISFSGKUDPMRAW-UHFFFAOYSA-N	0	2	298.251	0.220	20	5		CCBDLN
O=C(Nc1n[nH]c(C(F)(F)F)n1)c1n[nH]cc1[N+](=O)[O-]	ZINC000343174675	137118967	/nfs/dbraw/zinc/11/89/67/137118967.db2.gz	OLXFPKPQZPKXCH-UHFFFAOYSA-N	0	2	291.149	0.707	20	5		CCBDLN
O=C(N[C@H]1C=C[C@H](CO)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346814583	137305960	/nfs/dbraw/zinc/30/59/60/137305960.db2.gz	BTYFMRWHCJFQCO-IUCAKERBSA-N	0	2	278.264	0.967	20	5		CCBDLN
CCN(CC(=O)N(C)C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000077495816	349111865	/nfs/dbraw/zinc/11/18/65/349111865.db2.gz	IWTHNOQNPOOANN-UHFFFAOYSA-N	0	2	295.295	0.851	20	5		CCBDLN
Cc1c(CC(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000127295603	350165579	/nfs/dbraw/zinc/16/55/79/350165579.db2.gz	JGXGMIYIMKWCGE-UHFFFAOYSA-N	0	2	291.267	0.174	20	5		CCBDLN
CS(=O)(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271292191	191054905	/nfs/dbraw/zinc/05/49/05/191054905.db2.gz	QJVWRDVGTADZJK-UHFFFAOYSA-N	0	2	288.281	0.075	20	5		CCBDLN
CC(C)CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000122501168	187035515	/nfs/dbraw/zinc/03/55/15/187035515.db2.gz	YVIBECCPKMDQIO-UHFFFAOYSA-N	0	2	295.295	0.884	20	5		CCBDLN
CCN(C)C(=O)[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316872	351946580	/nfs/dbraw/zinc/94/65/80/351946580.db2.gz	INLFNJDZSNYNEP-MRVPVSSYSA-N	0	2	295.295	0.897	20	5		CCBDLN
CO[C@]1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])CCOC1	ZINC000217316467	351946637	/nfs/dbraw/zinc/94/66/37/351946637.db2.gz	LQCVVHZCXHERLK-ZDUSSCGKSA-N	0	2	296.279	0.836	20	5		CCBDLN
COC1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000223647508	351988500	/nfs/dbraw/zinc/98/85/00/351988500.db2.gz	OSUYXDAMPAJBAU-UHFFFAOYSA-N	0	2	252.226	0.771	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCO[C@@H](CO)C1	ZINC000274936354	353174283	/nfs/dbraw/zinc/17/42/83/353174283.db2.gz	MQLADOKIHICHRZ-SECBINFHSA-N	0	2	282.252	0.134	20	5		CCBDLN
CO[C@H]1COC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000291920966	353781792	/nfs/dbraw/zinc/78/17/92/353781792.db2.gz	UWRHYQMGSQGDQU-ONGXEEELSA-N	0	2	282.252	0.444	20	5		CCBDLN
CC[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)OC	ZINC000336829411	355203694	/nfs/dbraw/zinc/20/36/94/355203694.db2.gz	HPNGVMIDAMZBFV-VIFPVBQESA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC(O)(C(F)F)C1	ZINC000425016098	235251301	/nfs/dbraw/zinc/25/13/01/235251301.db2.gz	DZRSKOIVFASCOO-UHFFFAOYSA-N	0	2	288.206	0.752	20	5		CCBDLN
C[C@@H]1[C@H](O)CCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000590881632	359534415	/nfs/dbraw/zinc/53/44/15/359534415.db2.gz	UCXKZYJCFVNOIX-GMSGAONNSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(NCCCn1cncn1)c1cc([N+](=O)[O-])ccc1O	ZINC000611534560	363734438	/nfs/dbraw/zinc/73/44/38/363734438.db2.gz	YOFRFDHJCSHUQD-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC(O)(CO)CC1	ZINC000598179438	361348886	/nfs/dbraw/zinc/34/88/86/361348886.db2.gz	ZONGJZVOEQFNKH-UHFFFAOYSA-N	0	2	296.279	0.260	20	5		CCBDLN
CN(Cc1cn(C)nn1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000598224856	361357602	/nfs/dbraw/zinc/35/76/02/361357602.db2.gz	GPMXYFKIBLFCGH-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000598226482	361358917	/nfs/dbraw/zinc/35/89/17/361358917.db2.gz	LTVNIVWSXLPCPK-ISVAXAHUSA-N	0	2	278.264	0.897	20	5		CCBDLN
CN1CC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000614008393	364458781	/nfs/dbraw/zinc/45/87/81/364458781.db2.gz	KGJZRRMATDCXML-QMMMGPOBSA-N	0	2	279.252	0.717	20	5		CCBDLN
NC(=O)C1(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CC1	ZINC000614271664	364556395	/nfs/dbraw/zinc/55/63/95/364556395.db2.gz	COTWHPVBAITWQW-UHFFFAOYSA-N	0	2	265.225	0.504	20	5		CCBDLN
NC(=O)[C@H]1CC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)O1	ZINC000276658234	193418473	/nfs/dbraw/zinc/41/84/73/193418473.db2.gz	XPPIRFLZOXKXGJ-ZJUUUORDSA-N	0	2	295.251	0.272	20	5		CCBDLN
CN(C)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000080356017	284603991	/nfs/dbraw/zinc/60/39/91/284603991.db2.gz	MXQSDGMGSNCGKD-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(NCCN1CCCC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000571814025	291839521	/nfs/dbraw/zinc/83/95/21/291839521.db2.gz	ZRPAVVBTJQYUFV-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
C[C@]1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1=O	ZINC000292459208	388950345	/nfs/dbraw/zinc/95/03/45/388950345.db2.gz	LQKOQAFMHPEWTO-LBPRGKRZSA-N	0	2	280.236	0.736	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000195178868	389118649	/nfs/dbraw/zinc/11/86/49/389118649.db2.gz	QXKLANGMQHNQRH-WRWORJQWSA-N	0	2	293.279	0.555	20	5		CCBDLN
Cc1nc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)no1	ZINC000173625520	389506404	/nfs/dbraw/zinc/50/64/04/389506404.db2.gz	JLJXUTVRELWJCJ-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)O1	ZINC000276658231	389524112	/nfs/dbraw/zinc/52/41/12/389524112.db2.gz	XPPIRFLZOXKXGJ-VHSXEESVSA-N	0	2	295.251	0.272	20	5		CCBDLN
O=C(NCCc1[nH]cc[nH+]1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000175351300	389539747	/nfs/dbraw/zinc/53/97/47/389539747.db2.gz	KNJOWFFOSPSTNP-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
O=C(N[C@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000178955434	389631063	/nfs/dbraw/zinc/63/10/63/389631063.db2.gz	YLIQOVXTOLHVSV-QMMMGPOBSA-N	0	2	252.226	0.819	20	5		CCBDLN
COC[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)OC	ZINC000351857955	389700741	/nfs/dbraw/zinc/70/07/41/389700741.db2.gz	ZDANGTHHRCKNDQ-QMMMGPOBSA-N	0	2	298.251	0.218	20	5		CCBDLN
Cc1cnc(NCCc2nc(N)no2)c([N+](=O)[O-])c1	ZINC000444070129	389889652	/nfs/dbraw/zinc/88/96/52/389889652.db2.gz	AHWWBPUEQMADDO-UHFFFAOYSA-N	0	2	264.245	0.748	20	5		CCBDLN
COc1cccc(C(=O)N=c2ccc(=O)[nH][nH]2)c1[N+](=O)[O-]	ZINC000436022426	389969263	/nfs/dbraw/zinc/96/92/63/389969263.db2.gz	ZBNDARSCZDMMKQ-UHFFFAOYSA-N	0	2	290.235	0.773	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCc2n[nH]nc2C1	ZINC000436830947	389985439	/nfs/dbraw/zinc/98/54/39/389985439.db2.gz	DTOGTYNMHILMLZ-UHFFFAOYSA-N	0	2	289.251	0.617	20	5		CCBDLN
NC(=O)OCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000495276555	390231427	/nfs/dbraw/zinc/23/14/27/390231427.db2.gz	NWRDWIQDNZTTAA-UHFFFAOYSA-N	0	2	269.213	0.540	20	5		CCBDLN
CCn1ncnc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000357924198	144134069	/nfs/dbraw/zinc/13/40/69/144134069.db2.gz	AWYKEZZTJVCAFI-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
C[C@H]1CO[C@@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436885805	397534503	/nfs/dbraw/zinc/53/45/03/397534503.db2.gz	FDOGZRYNWRMBMX-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H]1COC[C@H]1O	ZINC000342408651	288919370	/nfs/dbraw/zinc/91/93/70/288919370.db2.gz	HIBGLMZSVUVWLI-WDEREUQCSA-N	0	2	282.252	0.132	20	5		CCBDLN
NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000182146135	303329373	/nfs/dbraw/zinc/32/93/73/303329373.db2.gz	GWPZMUGWVYVYMP-SECBINFHSA-N	0	2	279.252	0.390	20	5		CCBDLN
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C[C@H]1C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000384821444	336131830	/nfs/dbraw/zinc/13/18/30/336131830.db2.gz	QBRFLESSWVRDRQ-CBAPKCEASA-N	0	2	266.253	0.896	20	5		CCBDLN
CCC[C@@H](O)[C@@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000412548593	529052338	/nfs/dbraw/zinc/05/23/38/529052338.db2.gz	PBBGWRXFMAQTCS-ZYHUDNBSSA-N	0	2	298.295	0.552	20	5		CCBDLN
COCCONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000796964249	581456600	/nfs/dbraw/zinc/45/66/00/581456600.db2.gz	HBKHRYOGWTXLEU-UHFFFAOYSA-N	0	2	256.214	0.608	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCOC[C@H]1CCO	ZINC000773520047	581931085	/nfs/dbraw/zinc/93/10/85/581931085.db2.gz	DJLDQSPVXSDBBM-SNVBAGLBSA-N	0	2	296.279	0.524	20	5		CCBDLN
Nc1ccc(C(=O)OCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000774886396	582000575	/nfs/dbraw/zinc/00/05/75/582000575.db2.gz	MUHGYJYWEZDHBR-UHFFFAOYSA-N	0	2	279.212	0.358	20	5		CCBDLN
CON(C)C(=O)[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000863709028	617051577	/nfs/dbraw/zinc/05/15/77/617051577.db2.gz	HMDYPIWKQWWGFP-SSDOTTSWSA-N	0	2	297.267	0.439	20	5		CCBDLN
CC(C)OC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000312265408	625408999	/nfs/dbraw/zinc/40/89/99/625408999.db2.gz	DNHTVBGBLNYLGE-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(Nc1nncn1-c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839717016	640357206	/nfs/dbraw/zinc/35/72/06/640357206.db2.gz	JWLNOWNUQMEROE-NXEZZACHSA-N	0	2	273.252	0.871	20	5		CCBDLN
Cn1cc(-c2nn(C)cc2NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1	ZINC000847905808	643565723	/nfs/dbraw/zinc/56/57/23/643565723.db2.gz	ZEKDTPGTMLMRAG-PSASIEDQSA-N	0	2	290.283	0.424	20	5		CCBDLN
O=C(NCc1cc(=O)cc[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC001161045573	802076818	/nfs/dbraw/zinc/07/68/18/802076818.db2.gz	SFYUKCYERWUTFH-UHFFFAOYSA-N	0	2	289.247	0.919	20	5		CCBDLN
C[C@H](O)C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21	ZINC001227692855	805382524	/nfs/dbraw/zinc/38/25/24/805382524.db2.gz	GHCCHRWIDCSRCR-BYPYZUCNSA-N	0	2	252.186	0.152	20	5		CCBDLN
COc1cc(=O)[nH]c(O[C@@H](C[N+](=O)[O-])c2cccnc2)n1	ZINC001228917598	805489470	/nfs/dbraw/zinc/48/94/70/805489470.db2.gz	HAUMIYQTLWJFQY-VIFPVBQESA-N	0	2	292.251	0.983	20	5		CCBDLN
NN1CCC(Oc2cc(O)cc(O)c2[N+](=O)[O-])CC1	ZINC001228970625	805493581	/nfs/dbraw/zinc/49/35/81/805493581.db2.gz	JOHMHJJRWLOUPL-UHFFFAOYSA-N	0	2	269.257	0.723	20	5		CCBDLN
O=C([O-])c1cnc(NCCn2cc[nH+]c2)c([N+](=O)[O-])c1	ZINC000162382308	959213381	/nfs/dbraw/zinc/21/33/81/959213381.db2.gz	GDHOJFGZQUTONB-UHFFFAOYSA-N	0	2	277.240	0.997	20	5		CCBDLN
O=C(NCC1COC1)c1cc([N+](=O)[O-])ccc1O	ZINC000600573194	362011815	/nfs/dbraw/zinc/01/18/15/362011815.db2.gz	XZQRSRKEIVNNIL-UHFFFAOYSA-N	0	2	252.226	0.677	20	5		CCBDLN
O=C(NCC(F)(F)CO)c1ccc([N+](=O)[O-])cc1O	ZINC000187543326	231857553	/nfs/dbraw/zinc/85/75/53/231857553.db2.gz	JVWJNPRNEXIQJI-UHFFFAOYSA-N	0	2	276.195	0.658	20	5		CCBDLN
O=C(N[C@H]1[C@@H]2COC[C@@H]21)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355528219	232042094	/nfs/dbraw/zinc/04/20/94/232042094.db2.gz	SJAIDRLNORKEPI-JZYVYDRUSA-N	0	2	264.237	0.675	20	5		CCBDLN
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COC(=O)[C@H](CF)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000291607631	198048604	/nfs/dbraw/zinc/04/86/04/198048604.db2.gz	ARWNCWWDZPCJFS-QMMMGPOBSA-N	0	2	286.215	0.541	20	5		CCBDLN
C[C@H](C[S@](C)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316550	351946759	/nfs/dbraw/zinc/94/67/59/351946759.db2.gz	QECCTFNWFZTTPP-XJZHNMMOSA-N	0	2	286.309	0.797	20	5		CCBDLN
COCCN(CCO)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000217316495	351946854	/nfs/dbraw/zinc/94/68/54/351946854.db2.gz	AUXQBWJJVGQTEK-UHFFFAOYSA-N	0	2	284.268	0.381	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H](CO)O1	ZINC000230419511	352115487	/nfs/dbraw/zinc/11/54/87/352115487.db2.gz	BJYZCRKSHRCQGG-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCN(CCO)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233458797	352149849	/nfs/dbraw/zinc/14/98/49/352149849.db2.gz	NEEFLKSCKSKTQU-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
O=C(N[C@@H]1CCC(=O)NC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272352721	353055755	/nfs/dbraw/zinc/05/57/55/353055755.db2.gz	CTJNGTHMWWBCFT-SSDOTTSWSA-N	0	2	279.252	0.309	20	5		CCBDLN
COC(=O)[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272371393	353057492	/nfs/dbraw/zinc/05/74/92/353057492.db2.gz	POYCUVPHKGEKKA-MRVPVSSYSA-N	0	2	294.263	0.936	20	5		CCBDLN
CNC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274565030	353141336	/nfs/dbraw/zinc/14/13/36/353141336.db2.gz	AVGBELSLGZZHMN-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
COC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCO1	ZINC000274661788	353150507	/nfs/dbraw/zinc/15/05/07/353150507.db2.gz	DYZUJGMDMMNMLP-JTQLQIEISA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(Nc1ccc(O)c([N+](=O)[O-])c1)[C@H]1COCCO1	ZINC000275174846	353192343	/nfs/dbraw/zinc/19/23/43/353192343.db2.gz	XREKULNSXSLHSE-SNVBAGLBSA-N	0	2	268.225	0.654	20	5		CCBDLN
C[C@@H](CCO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000158217486	188364236	/nfs/dbraw/zinc/36/42/36/188364236.db2.gz	APHUVVUNUUTFDQ-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
C[C@H]1OCCN2[C@@H](c3ccc([N+](=O)[O-])c(O)c3)NC(=O)[C@H]12	ZINC000285064664	353558305	/nfs/dbraw/zinc/55/83/05/353558305.db2.gz	KGTJVDNFUKYJCU-MKCWBWRRSA-N	0	2	293.279	0.518	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@](F)(CO)C1	ZINC000338740144	355409111	/nfs/dbraw/zinc/40/91/11/355409111.db2.gz	AMOKHLDCJXVKKU-LBPRGKRZSA-N	0	2	284.243	0.847	20	5		CCBDLN
CCS(=O)(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000340546268	355570315	/nfs/dbraw/zinc/57/03/15/355570315.db2.gz	OUXASOUXUUKJLX-UHFFFAOYSA-N	0	2	288.281	0.674	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC[S@]1=O	ZINC000353227050	356183177	/nfs/dbraw/zinc/18/31/77/356183177.db2.gz	FGDZODYDGWJWAC-ZPWHCFADSA-N	0	2	298.320	0.893	20	5		CCBDLN
CCc1[nH]nc(C(=O)Nc2nc(C)n[nH]2)c1[N+](=O)[O-]	ZINC000355820554	356655011	/nfs/dbraw/zinc/65/50/11/356655011.db2.gz	XGWCTWYMAGNSJW-UHFFFAOYSA-N	0	2	265.233	0.559	20	5		CCBDLN
COC(=O)[C@H](CF)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000360479899	357022249	/nfs/dbraw/zinc/02/22/49/357022249.db2.gz	RYQKEIFDRKTZRR-QMMMGPOBSA-N	0	2	286.215	0.541	20	5		CCBDLN
CCN1CC[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1=O	ZINC000586824746	359295455	/nfs/dbraw/zinc/29/54/55/359295455.db2.gz	PNGWXULQEGOICP-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC[C@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000593813788	360164579	/nfs/dbraw/zinc/16/45/79/360164579.db2.gz	FYSHLQFGEKZXKM-NXEZZACHSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(N[C@H](CO)CCF)c1ccc([N+](=O)[O-])cc1O	ZINC000593858471	360178161	/nfs/dbraw/zinc/17/81/61/360178161.db2.gz	AGKHOTLTSNZHLK-ZETCQYMHSA-N	0	2	272.232	0.751	20	5		CCBDLN
CCNC(=O)CN(CC)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179443468	189194806	/nfs/dbraw/zinc/19/48/06/189194806.db2.gz	ICDSOCVKJFFIHY-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)C1(n2cnnn2)CC1	ZINC000597440683	361094876	/nfs/dbraw/zinc/09/48/76/361094876.db2.gz	BXTUUXBZKZOXEB-UHFFFAOYSA-N	0	2	290.239	0.415	20	5		CCBDLN
COC[C@](C)(CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000613534364	364285635	/nfs/dbraw/zinc/28/56/35/364285635.db2.gz	MEXVTCGEMGVRKD-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@@H](C(=O)[O-])[N@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000262649048	190059766	/nfs/dbraw/zinc/05/97/66/190059766.db2.gz	KTIIMVQMUDLKES-VIFPVBQESA-N	0	2	295.295	0.963	20	5		CCBDLN
C[C@@H](C(=O)[O-])[N@@H+](C)CC(=O)N(C)c1ccc([N+](=O)[O-])cc1	ZINC000262649048	190059767	/nfs/dbraw/zinc/05/97/67/190059767.db2.gz	KTIIMVQMUDLKES-VIFPVBQESA-N	0	2	295.295	0.963	20	5		CCBDLN
Cn1cnc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000091869134	389025030	/nfs/dbraw/zinc/02/50/30/389025030.db2.gz	GYFVOBNHVLMJEG-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000193168964	389062927	/nfs/dbraw/zinc/06/29/27/389062927.db2.gz	DHHHPPCRNBUTGF-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(=O)NCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000355577711	389096651	/nfs/dbraw/zinc/09/66/51/389096651.db2.gz	ZQSHRFCYZXPEHY-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)C	ZINC000194747256	389103009	/nfs/dbraw/zinc/10/30/09/389103009.db2.gz	BCSBTLOJZUDZDS-ZETCQYMHSA-N	0	2	281.268	0.507	20	5		CCBDLN
O=C(NCCCCO)c1ccc([N+](=O)[O-])cc1O	ZINC000194994306	389113178	/nfs/dbraw/zinc/11/31/78/389113178.db2.gz	HDYXRUDJICHVQB-UHFFFAOYSA-N	0	2	254.242	0.803	20	5		CCBDLN
O=C(NCC[NH+]1CCOCC1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000130323163	389203613	/nfs/dbraw/zinc/20/36/13/389203613.db2.gz	OKIUOQYEIBPUDI-UHFFFAOYSA-N	0	2	295.295	0.362	20	5		CCBDLN
Cn1cnnc1NC(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000156958514	389329224	/nfs/dbraw/zinc/32/92/24/389329224.db2.gz	CFHNBEBLAFTOQG-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)Nc1ccc([N+](=O)[O-])cc1F	ZINC000351605734	389630344	/nfs/dbraw/zinc/63/03/44/389630344.db2.gz	QOUPEUZREQUVKW-UHFFFAOYSA-N	0	2	296.218	0.879	20	5		CCBDLN
O=C(NC[C@@H]1CCCC(=O)N1)c1cc([N+](=O)[O-])ccc1O	ZINC000447748510	389963698	/nfs/dbraw/zinc/96/36/98/389963698.db2.gz	XXVVLNKMNJFLQD-QMMMGPOBSA-N	0	2	293.279	0.699	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CSc1n[nH]c(=O)[nH]1	ZINC000446073426	389930478	/nfs/dbraw/zinc/93/04/78/389930478.db2.gz	SVGRFBAQORHHNG-UHFFFAOYSA-N	0	2	256.247	0.444	20	5		CCBDLN
Cn1cc[nH+]c1CNC(=O)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000436965231	389988306	/nfs/dbraw/zinc/98/83/06/389988306.db2.gz	STLGXKKFHBJHHJ-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
C[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CCC(=O)N1	ZINC000457186194	390033688	/nfs/dbraw/zinc/03/36/88/390033688.db2.gz	LSMMOCPXMRPCMN-CYBMUJFWSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(NC[C@@H]1CC[C@@H](CO)O1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000356516258	144009837	/nfs/dbraw/zinc/00/98/37/144009837.db2.gz	NTHSCOPSHDFLKO-UWVGGRQHSA-N	0	2	296.279	0.570	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)n[nH]1	ZINC000611141436	420495196	/nfs/dbraw/zinc/49/51/96/420495196.db2.gz	BMBNQINZGMGLJP-UHFFFAOYSA-N	0	2	291.223	0.375	20	5		CCBDLN
CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000186945921	290031428	/nfs/dbraw/zinc/03/14/28/290031428.db2.gz	RHPCPSPRTPLVET-UHFFFAOYSA-N	0	2	279.252	0.215	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1=O	ZINC000186882721	290143129	/nfs/dbraw/zinc/14/31/29/290143129.db2.gz	SCJCTVPCIKHEHL-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)O1	ZINC000288422147	300519783	/nfs/dbraw/zinc/51/97/83/300519783.db2.gz	CRWKYIDLAPTMFS-RCOVLWMOSA-N	0	2	280.236	0.734	20	5		CCBDLN
CCC(=O)N1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000425038630	528325286	/nfs/dbraw/zinc/32/52/86/528325286.db2.gz	QNYPBOCPGAWVCK-UHFFFAOYSA-N	0	2	293.279	0.952	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCOC[C@H]1CCO	ZINC000779674746	581198931	/nfs/dbraw/zinc/19/89/31/581198931.db2.gz	MTVUMSIPZIXIQS-SNVBAGLBSA-N	0	2	296.279	0.524	20	5		CCBDLN
CN(CC(=O)NOCCO)c1ccccc1[N+](=O)[O-]	ZINC000787284807	581464479	/nfs/dbraw/zinc/46/44/79/581464479.db2.gz	YNKIGKXZWVOSJT-UHFFFAOYSA-N	0	2	269.257	0.071	20	5		CCBDLN
CNc1ccc(C(=O)OCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000774880354	582000290	/nfs/dbraw/zinc/00/02/90/582000290.db2.gz	XRHOWDKSQHZIBK-UHFFFAOYSA-N	0	2	293.239	0.817	20	5		CCBDLN
Nc1cc([N+](=O)[O-])ccc1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774876126	582000539	/nfs/dbraw/zinc/00/05/39/582000539.db2.gz	PTBXRXGOWYBRHP-UHFFFAOYSA-N	0	2	279.212	0.358	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@@H](CNC(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920830	605750638	/nfs/dbraw/zinc/75/06/38/605750638.db2.gz	NQBYQKVMRMTCPU-VIFPVBQESA-N	0	2	283.288	0.647	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@@H](CNC(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920830	605750643	/nfs/dbraw/zinc/75/06/43/605750643.db2.gz	NQBYQKVMRMTCPU-VIFPVBQESA-N	0	2	283.288	0.647	20	5		CCBDLN
COc1ccc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])cn1	ZINC000839577170	617266959	/nfs/dbraw/zinc/26/69/59/617266959.db2.gz	BONNVSUYBFPCFN-RKDXNWHRSA-N	0	2	251.242	0.718	20	5		CCBDLN
CCn1ncc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000862381645	615707202	/nfs/dbraw/zinc/70/72/02/615707202.db2.gz	GJRSWUOWRDFAHB-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
C[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2ccccc2C(=O)N1	ZINC000840410288	641569581	/nfs/dbraw/zinc/56/95/81/641569581.db2.gz	YJUKMZUXNLLFKB-MKPLZMMCSA-N	0	2	289.291	0.817	20	5		CCBDLN
O=C(Nc1cc([C@@H]2CCCO2)[nH]n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000855105139	644288293	/nfs/dbraw/zinc/28/82/93/644288293.db2.gz	KCFXIKSDCIEHBJ-VDAHYXPESA-N	0	2	266.257	0.865	20	5		CCBDLN
O=C1OCC[C@H]1Oc1cc(O)cc(O)c1[N+](=O)[O-]	ZINC001228971503	805493686	/nfs/dbraw/zinc/49/36/86/805493686.db2.gz	PQFAXBKWXHLSRW-SSDOTTSWSA-N	0	2	255.182	0.700	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC[C@@H]1COCCO1	ZINC001228971205	805493921	/nfs/dbraw/zinc/49/39/21/805493921.db2.gz	LXCVLUGHCCTGSU-QMMMGPOBSA-N	0	2	271.225	0.800	20	5		CCBDLN
CN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccc(Cl)nn1	ZINC001126299395	812226737	/nfs/dbraw/zinc/22/67/37/812226737.db2.gz	IDGNFLFGFQAQGK-PHDIDXHHSA-N	0	2	256.649	0.758	20	5		CCBDLN
CC(C)[N@H+](CC(N)=O)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001591574002	992780732	/nfs/dbraw/zinc/78/07/32/992780732.db2.gz	XTCGWZIMGGZUKA-UHFFFAOYSA-N	0	2	295.295	0.989	20	5		CCBDLN
CC(C)[N@@H+](CC(N)=O)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001591574002	992780735	/nfs/dbraw/zinc/78/07/35/992780735.db2.gz	XTCGWZIMGGZUKA-UHFFFAOYSA-N	0	2	295.295	0.989	20	5		CCBDLN
O=C(Nc1ccc(-c2nn[nH]n2)cc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000095233133	349598470	/nfs/dbraw/zinc/59/84/70/349598470.db2.gz	RTXJHHRJCNVVRR-RKDXNWHRSA-N	0	2	274.240	0.470	20	5		CCBDLN
CC1(c2nc(=NC(=O)c3n[nH]cc3[N+](=O)[O-])s[nH]2)CC1	ZINC000600228255	361896414	/nfs/dbraw/zinc/89/64/14/361896414.db2.gz	UDFMCNXGNNOJNZ-UHFFFAOYSA-N	0	2	294.296	0.895	20	5		CCBDLN
O=C(N[C@H]1COCCC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000600393672	361942815	/nfs/dbraw/zinc/94/28/15/361942815.db2.gz	VHABBUNHTQFZQC-VIFPVBQESA-N	0	2	280.236	0.388	20	5		CCBDLN
Cc1n[nH]c(NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)n1	ZINC000103258409	349695096	/nfs/dbraw/zinc/69/50/96/349695096.db2.gz	IHSUQBJHIFBOGY-UHFFFAOYSA-N	0	2	293.287	0.863	20	5		CCBDLN
O=C(N[C@@H]1CCOC[C@H]1O)c1cc([N+](=O)[O-])ccc1O	ZINC000600594405	362019446	/nfs/dbraw/zinc/01/94/46/362019446.db2.gz	XQDPYWZGCUGPLU-MWLCHTKSSA-N	0	2	282.252	0.180	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1C[C@@H](C(N)=O)C1	ZINC000600583168	362013058	/nfs/dbraw/zinc/01/30/58/362013058.db2.gz	RQZSNHQOJLMQIO-DTORHVGOSA-N	0	2	293.279	0.636	20	5		CCBDLN
C[C@@H](C(=O)NCc1n[nH]c(=O)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000617744733	365752981	/nfs/dbraw/zinc/75/29/81/365752981.db2.gz	KJDFMLSRYLJDFK-SSDOTTSWSA-N	0	2	291.267	0.838	20	5		CCBDLN
COCC1(O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000295595378	199579526	/nfs/dbraw/zinc/57/95/26/199579526.db2.gz	RUZHNNCKEXWSSH-UHFFFAOYSA-N	0	2	282.252	0.134	20	5		CCBDLN
CCNC(=O)NCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000314092263	137078697	/nfs/dbraw/zinc/07/86/97/137078697.db2.gz	ZSZNLDIQLHICBD-UHFFFAOYSA-N	0	2	296.283	0.349	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@H]1COC[C@@H]1O	ZINC000342408642	137092550	/nfs/dbraw/zinc/09/25/50/137092550.db2.gz	HIBGLMZSVUVWLI-QWRGUYRKSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(N[C@H](CO)[C@@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000344930976	137222710	/nfs/dbraw/zinc/22/27/10/137222710.db2.gz	YTWPEWABUPUFPX-SKDRFNHKSA-N	0	2	296.279	0.570	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)n(C)n1	ZINC000186932796	351522408	/nfs/dbraw/zinc/52/24/08/351522408.db2.gz	FGNKHGGKBMLRPK-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
Cn1cc[nH+]c1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000221055897	351975788	/nfs/dbraw/zinc/97/57/88/351975788.db2.gz	ZHFNNUULEFMRRL-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
Cc1noc(CCNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000227880662	352062123	/nfs/dbraw/zinc/06/21/23/352062123.db2.gz	DEYBYLJAULCDRW-UHFFFAOYSA-N	0	2	292.251	0.964	20	5		CCBDLN
CNC(=O)C(C)(C)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000230399003	352115690	/nfs/dbraw/zinc/11/56/90/352115690.db2.gz	GNIDMWHKJKDEBI-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
NC(=O)N[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272344791	353054894	/nfs/dbraw/zinc/05/48/94/353054894.db2.gz	BGZSLEPEPOJHHA-ZETCQYMHSA-N	0	2	294.267	0.183	20	5		CCBDLN
O=C(N[C@@H]1CCC(=O)NC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274711449	353155396	/nfs/dbraw/zinc/15/53/96/353155396.db2.gz	YBBBKKIOVFDUHM-SSDOTTSWSA-N	0	2	279.252	0.309	20	5		CCBDLN
COC[C@H](CNC(=O)c1ccc([N+](=O)[O-])cc1O)OC	ZINC000274947379	353174881	/nfs/dbraw/zinc/17/48/81/353174881.db2.gz	QUKUSRKWXZTFHM-VIFPVBQESA-N	0	2	284.268	0.692	20	5		CCBDLN
NC(=O)[C@H]1CC[C@@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)O1	ZINC000279734134	353312593	/nfs/dbraw/zinc/31/25/93/353312593.db2.gz	AAYIGTVWIBIDHO-ZJUUUORDSA-N	0	2	295.251	0.272	20	5		CCBDLN
COC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000280121376	353339722	/nfs/dbraw/zinc/33/97/22/353339722.db2.gz	VUADLQIUJWFDCF-QMMMGPOBSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=C(NC[C@@H](O)C1CC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000280716053	353377814	/nfs/dbraw/zinc/37/78/14/353377814.db2.gz	BTTXAWWBDWVMNL-SNVBAGLBSA-N	0	2	266.253	0.801	20	5		CCBDLN
CC[C@H](C)CONC(=O)Cn1ccc(=O)c([N+](=O)[O-])c1	ZINC000293733321	353835437	/nfs/dbraw/zinc/83/54/37/353835437.db2.gz	NMUANCYLNOMFHY-VIFPVBQESA-N	0	2	283.284	0.850	20	5		CCBDLN
COC(=O)[C@@H](CNC(=O)c1cccc(O)c1[N+](=O)[O-])OC	ZINC000293988598	353857300	/nfs/dbraw/zinc/85/73/00/353857300.db2.gz	LILHCQOIWRGRTL-SECBINFHSA-N	0	2	298.251	0.218	20	5		CCBDLN
O=c1[nH]nc(CCCNc2ccc([N+](=O)[O-])nc2)[nH]1	ZINC000427365807	235360780	/nfs/dbraw/zinc/36/07/80/235360780.db2.gz	JMRVWMCXJSNCNQ-UHFFFAOYSA-N	0	2	264.245	0.858	20	5		CCBDLN
Cc1nc([N+](=O)[O-])cn1CCC(=O)N=c1cccn[nH]1	ZINC000346046645	355865778	/nfs/dbraw/zinc/86/57/78/355865778.db2.gz	DVQDKWXEXVKLAE-UHFFFAOYSA-N	0	2	276.256	0.340	20	5		CCBDLN
CNC(=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000352842198	356094549	/nfs/dbraw/zinc/09/45/49/356094549.db2.gz	KSLYSPVAAZMJQU-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
Cn1cnnc1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354694307	356476464	/nfs/dbraw/zinc/47/64/64/356476464.db2.gz	OJBQSNUIXNCQHK-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CCc1ccc(C(=O)NCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000359839689	356907686	/nfs/dbraw/zinc/90/76/86/356907686.db2.gz	GQIUANQHXLMJJJ-UHFFFAOYSA-N	0	2	291.267	0.911	20	5		CCBDLN
O=C(NC[C@H]1CC[C@@H](CO)O1)c1cccc(O)c1[N+](=O)[O-]	ZINC000294687967	199135744	/nfs/dbraw/zinc/13/57/44/199135744.db2.gz	UGDNNGLLZZNSMI-BDAKNGLRSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NCCCc1nc[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000573976866	359017533	/nfs/dbraw/zinc/01/75/33/359017533.db2.gz	KRDVREHOIRPHSS-UHFFFAOYSA-N	0	2	291.267	0.781	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCO[C@H]2C[C@H]21	ZINC000590426170	359459593	/nfs/dbraw/zinc/45/95/93/359459593.db2.gz	GVRFUIUIROPXLY-KOLCDFICSA-N	0	2	264.237	0.914	20	5		CCBDLN
C[C@H]1C(=O)N(C)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000592901517	359972667	/nfs/dbraw/zinc/97/26/67/359972667.db2.gz	LLYVZSDVHYUXQJ-ZETCQYMHSA-N	0	2	279.252	0.561	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H]2C[C@H]1C[S@]2=O	ZINC000593875646	360188442	/nfs/dbraw/zinc/18/84/42/360188442.db2.gz	XJOYIZLELWAZSY-MMXNHZJYSA-N	0	2	296.304	0.646	20	5		CCBDLN
CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179389954	189190299	/nfs/dbraw/zinc/19/02/99/189190299.db2.gz	NBBNFFCBPCUOJN-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
CC(CO)(CO)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000565098019	291344743	/nfs/dbraw/zinc/34/47/43/291344743.db2.gz	HKHIDXHABCAXCX-UHFFFAOYSA-N	0	2	284.268	0.021	20	5		CCBDLN
COC(=O)[C@@H](CF)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000288246065	197035105	/nfs/dbraw/zinc/03/51/05/197035105.db2.gz	KWFQIMRLGKLYED-SSDOTTSWSA-N	0	2	286.215	0.541	20	5		CCBDLN
Cc1nncn1CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000186784982	388850868	/nfs/dbraw/zinc/85/08/68/388850868.db2.gz	FJQMZXIBSIBNCD-UHFFFAOYSA-N	0	2	291.267	0.630	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000195151691	389117074	/nfs/dbraw/zinc/11/70/74/389117074.db2.gz	FXHACFMCOVCHIU-WRWORJQWSA-N	0	2	293.279	0.555	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC[S@@]1=O	ZINC000352753229	389835951	/nfs/dbraw/zinc/83/59/51/389835951.db2.gz	OFTGXXYLNXCGEA-SQFXPLBJSA-N	0	2	298.320	0.893	20	5		CCBDLN
O=C(NCC1(O)CCC1)c1cc([N+](=O)[O-])ccc1O	ZINC000436668946	389982562	/nfs/dbraw/zinc/98/25/62/389982562.db2.gz	GEBZEZNKNSGXPG-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)NC	ZINC000457056783	390025879	/nfs/dbraw/zinc/02/58/79/390025879.db2.gz	RAYWWIJKJXLIFY-SECBINFHSA-N	0	2	281.268	0.555	20	5		CCBDLN
C[C@@H]1OC(=O)N[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000497167165	390429767	/nfs/dbraw/zinc/42/97/67/390429767.db2.gz	JVTOLZMLYHLZFG-CDUCUWFYSA-N	0	2	281.224	0.736	20	5		CCBDLN
Cc1n[nH]c(NC(=O)c2ccnc(N)c2[N+](=O)[O-])n1	ZINC000548741650	286064178	/nfs/dbraw/zinc/06/41/78/286064178.db2.gz	IIBFJCNHPLLRMU-UHFFFAOYSA-N	0	2	263.217	0.081	20	5		CCBDLN
CCNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000035739256	172393217	/nfs/dbraw/zinc/39/32/17/172393217.db2.gz	PRTXACXUANIIBU-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
NC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000123249894	303329314	/nfs/dbraw/zinc/32/93/14/303329314.db2.gz	YJELEXAFYPLMCK-SECBINFHSA-N	0	2	279.252	0.390	20	5		CCBDLN
NC(=O)[C@H]1CC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000576238961	335176289	/nfs/dbraw/zinc/17/62/89/335176289.db2.gz	NPCQKZRHKJZDAB-JGVFFNPUSA-N	0	2	279.252	0.750	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC(=O)N1	ZINC000387106967	336185175	/nfs/dbraw/zinc/18/51/75/336185175.db2.gz	GMNMEEOWMWQNFU-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NN1CCCC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000780707469	581242136	/nfs/dbraw/zinc/24/21/36/581242136.db2.gz	XUWBTMQZNZEKKG-UHFFFAOYSA-N	0	2	265.225	0.568	20	5		CCBDLN
Cc1cc(S(=O)(=O)Nc2cnnn2C)ccc1[N+](=O)[O-]	ZINC000788206684	581485646	/nfs/dbraw/zinc/48/56/46/581485646.db2.gz	YMMVUQGADHAISX-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
Cc1cc(F)cc(C(=O)NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000758510755	581752065	/nfs/dbraw/zinc/75/20/65/581752065.db2.gz	XLAKORZOYBQRAH-UHFFFAOYSA-N	0	2	295.230	0.796	20	5		CCBDLN
Cn1c(C(=O)OCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000774909301	582001917	/nfs/dbraw/zinc/00/19/17/582001917.db2.gz	NYEOJMWJDBEERN-UHFFFAOYSA-N	0	2	267.201	0.114	20	5		CCBDLN
O=C([O-])N1CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1	ZINC000832036949	603707583	/nfs/dbraw/zinc/70/75/83/603707583.db2.gz	POJADKCZCRRXBV-UHFFFAOYSA-N	0	2	269.261	0.087	20	5		CCBDLN
CC(C)(O)CONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000816381238	614197613	/nfs/dbraw/zinc/19/76/13/614197613.db2.gz	HDPPXNBKEJMVCK-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H](CO)Cc2ccccc21	ZINC000840461414	641581206	/nfs/dbraw/zinc/58/12/06/641581206.db2.gz	DCTORYNSRSVRNI-UFGOTCBOSA-N	0	2	276.292	0.849	20	5		CCBDLN
CSc1nc(OC[C@@H]2CCO2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625053	805373749	/nfs/dbraw/zinc/37/37/49/805373749.db2.gz	NOHDFGVIAGNDGM-YFKPBYRVSA-N	0	2	273.270	0.980	20	5		CCBDLN
C[S@@](=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316527	839076709	/nfs/dbraw/zinc/07/67/09/839076709.db2.gz	ZDDOXDDQDJUVOX-GOSISDBHSA-N	0	2	272.282	0.409	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(Nc2ccn(CCO)n2)n1	ZINC001185299574	844398785	/nfs/dbraw/zinc/39/87/85/844398785.db2.gz	QNPIOBQFNBJMKM-UHFFFAOYSA-N	0	2	252.234	0.261	20	5		CCBDLN
CNC(=O)c1ccc(NCC(=O)NOC)c([N+](=O)[O-])c1	ZINC001187783009	844776009	/nfs/dbraw/zinc/77/60/09/844776009.db2.gz	LDALGWBPTOEDLR-UHFFFAOYSA-N	0	2	282.256	0.044	20	5		CCBDLN
COCc1nsc(NC(=O)c2n[nH]cc2[N+](=O)[O-])n1	ZINC001116573653	855790923	/nfs/dbraw/zinc/79/09/23/855790923.db2.gz	NCOSVMFEBYQROI-UHFFFAOYSA-N	0	2	284.257	0.568	20	5		CCBDLN
O=C([O-])[C@H]1C[C@@H](O)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000132015721	958760332	/nfs/dbraw/zinc/76/03/32/958760332.db2.gz	SCOISFSSGQJITG-GHMZBOCLSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@H]1C[C@@H](O)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000132015721	958760347	/nfs/dbraw/zinc/76/03/47/958760347.db2.gz	SCOISFSSGQJITG-GHMZBOCLSA-N	0	2	266.253	0.615	20	5		CCBDLN
Cc1n[nH]c(NC(=O)CCn2cc([N+](=O)[O-])cn2)n1	ZINC000103257567	349693864	/nfs/dbraw/zinc/69/38/64/349693864.db2.gz	SZXCGMDYGBGOAW-UHFFFAOYSA-N	0	2	265.233	0.247	20	5		CCBDLN
O=C(NC[C@@]1(O)CCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000339350154	215113429	/nfs/dbraw/zinc/11/34/29/215113429.db2.gz	RTGHNXWNUMAUNS-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
O=c1[nH]nc(CN2CCc3ncc([N+](=O)[O-])cc3C2)[nH]1	ZINC000347778397	137356719	/nfs/dbraw/zinc/35/67/19/137356719.db2.gz	CSJGHMVBPONHPB-UHFFFAOYSA-N	0	2	276.256	0.372	20	5		CCBDLN
CNC(=O)[C@@H](C)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000081467950	349267572	/nfs/dbraw/zinc/26/75/72/349267572.db2.gz	WDXZWRUPFRDDES-QMMMGPOBSA-N	0	2	295.295	0.755	20	5		CCBDLN
CNC(=O)CCN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271228825	191016532	/nfs/dbraw/zinc/01/65/32/191016532.db2.gz	ANLHCPRIQBJNOB-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
C[C@H](C[S@@](C)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316548	351946678	/nfs/dbraw/zinc/94/66/78/351946678.db2.gz	QECCTFNWFZTTPP-QOLSBQFWSA-N	0	2	286.309	0.797	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H](CO)O1	ZINC000230419519	352115585	/nfs/dbraw/zinc/11/55/85/352115585.db2.gz	BJYZCRKSHRCQGG-WCBMZHEXSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCOC(=O)[C@@H](N)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000233681002	352152056	/nfs/dbraw/zinc/15/20/56/352152056.db2.gz	RAHIDYDWVRTAGM-VIFPVBQESA-N	0	2	283.240	0.129	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H]1OC	ZINC000234772515	352170483	/nfs/dbraw/zinc/17/04/83/352170483.db2.gz	AMBOLHZQBMQQLL-TXEJJXNPSA-N	0	2	296.279	0.786	20	5		CCBDLN
NC(=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236232464	352192512	/nfs/dbraw/zinc/19/25/12/352192512.db2.gz	HTRPKIRLWVDPQV-UHFFFAOYSA-N	0	2	267.241	0.296	20	5		CCBDLN
NC(=O)N[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272344788	353054585	/nfs/dbraw/zinc/05/45/85/353054585.db2.gz	BGZSLEPEPOJHHA-SSDOTTSWSA-N	0	2	294.267	0.183	20	5		CCBDLN
COC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000274807025	353163410	/nfs/dbraw/zinc/16/34/10/353163410.db2.gz	ODNAAQQLDJJWJC-UHFFFAOYSA-N	0	2	280.236	0.736	20	5		CCBDLN
CC[C@H](O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000293654980	353827411	/nfs/dbraw/zinc/82/74/11/353827411.db2.gz	IPYGZSRMMMYEEZ-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H](F)C[C@H]1CO	ZINC000331228930	354498604	/nfs/dbraw/zinc/49/86/04/354498604.db2.gz	GUKASBNPMPHLGK-CBAPKCEASA-N	0	2	284.243	0.845	20	5		CCBDLN
CNc1c(C(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000360942131	138016872	/nfs/dbraw/zinc/01/68/72/138016872.db2.gz	GMZVJFXZCGAIAV-UHFFFAOYSA-N	0	2	292.255	0.390	20	5		CCBDLN
COC[C@H](O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354377375	356401797	/nfs/dbraw/zinc/40/17/97/356401797.db2.gz	BSKMNJFCAFNGAU-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cn1c(C(=O)NCCCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000359527518	356838445	/nfs/dbraw/zinc/83/84/45/356838445.db2.gz	SAWFFUCEZHCLTO-UHFFFAOYSA-N	0	2	294.271	0.120	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])cc1C(=O)N=c1cc(C(N)=O)[nH][nH]1	ZINC000610872352	363623267	/nfs/dbraw/zinc/62/32/67/363623267.db2.gz	MCTCPTPNIAUCDJ-UHFFFAOYSA-N	0	2	289.251	0.399	20	5		CCBDLN
Cc1c(C(=O)N=c2cc(C(N)=O)[nH][nH]2)cccc1[N+](=O)[O-]	ZINC000610872314	363623715	/nfs/dbraw/zinc/62/37/15/363623715.db2.gz	FBPLOVFCVWZMRQ-UHFFFAOYSA-N	0	2	289.251	0.399	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000590420901	359457196	/nfs/dbraw/zinc/45/71/96/359457196.db2.gz	HZINBMPUALJDOK-MYJAWHEDSA-N	0	2	278.264	0.611	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000592901516	359972695	/nfs/dbraw/zinc/97/26/95/359972695.db2.gz	LLYVZSDVHYUXQJ-SSDOTTSWSA-N	0	2	279.252	0.561	20	5		CCBDLN
O=C(NCC[C@]1(O)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000593811439	360163462	/nfs/dbraw/zinc/16/34/62/360163462.db2.gz	ABHLMEORYLBOAA-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
C[C@H](CO)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182117534	189314520	/nfs/dbraw/zinc/31/45/20/189314520.db2.gz	QZLCXQFHLUWIQR-ZETCQYMHSA-N	0	2	254.242	0.659	20	5		CCBDLN
CCN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000456159015	249033749	/nfs/dbraw/zinc/03/37/49/249033749.db2.gz	FAOSBHHNLQQTSI-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCCNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184684937	388776454	/nfs/dbraw/zinc/77/64/54/388776454.db2.gz	IQVOCWRDRPLTNN-UHFFFAOYSA-N	0	2	295.295	0.947	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000190091331	388982505	/nfs/dbraw/zinc/98/25/05/388982505.db2.gz	SEGAILGFYGGTTQ-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1OCC[C@]1(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000279425933	389574964	/nfs/dbraw/zinc/57/49/64/389574964.db2.gz	IRJODUNMZXOUAZ-OQPBUACISA-N	0	2	296.279	0.570	20	5		CCBDLN
CCN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000391558017	389773308	/nfs/dbraw/zinc/77/33/08/389773308.db2.gz	DRZLKUJVTMCHJM-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(N[C@H]1CCCCNC1=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000391622941	389773877	/nfs/dbraw/zinc/77/38/77/389773877.db2.gz	OCQZXAVZLBHQGB-JTQLQIEISA-N	0	2	293.279	0.699	20	5		CCBDLN
Cn1cc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])cn1	ZINC000352014307	389735561	/nfs/dbraw/zinc/73/55/61/389735561.db2.gz	PCSONWNYUGYGOJ-IHWYPQMZSA-N	0	2	263.213	0.700	20	5		CCBDLN
CCN1CCOC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000367486378	285353886	/nfs/dbraw/zinc/35/38/86/285353886.db2.gz	RBDJEULCHCPEKJ-NSHDSACASA-N	0	2	295.295	0.960	20	5		CCBDLN
O=C(NC[C@@H]1CCCC(=O)N1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000447745129	389963251	/nfs/dbraw/zinc/96/32/51/389963251.db2.gz	MQMWDNLCUQKFCN-VIFPVBQESA-N	0	2	293.279	0.699	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H]1CCNC1=O	ZINC000436904714	389986477	/nfs/dbraw/zinc/98/64/77/389986477.db2.gz	ZIMHXKMDBUBIDJ-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NC[C@H](O)C(F)F)c1cc([N+](=O)[O-])ccc1O	ZINC000436970923	389988797	/nfs/dbraw/zinc/98/87/97/389988797.db2.gz	GNRLHPMUZFJOME-QMMMGPOBSA-N	0	2	276.195	0.656	20	5		CCBDLN
CN(Cc1nnnn1C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436974157	389988902	/nfs/dbraw/zinc/98/89/02/389988902.db2.gz	WUALWIHSLHAZON-UHFFFAOYSA-N	0	2	292.255	0.096	20	5		CCBDLN
C[C@H]1C(=O)N(C)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000592903398	390365415	/nfs/dbraw/zinc/36/54/15/390365415.db2.gz	WKYPZJZLTBFDDL-ZETCQYMHSA-N	0	2	279.252	0.561	20	5		CCBDLN
C[C@@H](CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182118980	533638225	/nfs/dbraw/zinc/63/82/25/533638225.db2.gz	HSPUNUNNTZBJJU-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCC(=O)NC1	ZINC000216040142	544813672	/nfs/dbraw/zinc/81/36/72/544813672.db2.gz	SPVKQRGQALJRDA-SSDOTTSWSA-N	0	2	279.252	0.765	20	5		CCBDLN
C[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])CC1	ZINC000179379209	290030048	/nfs/dbraw/zinc/03/00/48/290030048.db2.gz	DKRLEJXOPAFKAP-UHFFFAOYSA-N	0	2	265.269	0.688	20	5		CCBDLN
C[C@@H]1CO[C@H](CO)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316022	297165908	/nfs/dbraw/zinc/16/59/08/297165908.db2.gz	NMLLRXHSBPCFKY-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=c1[nH]nc([C@@H]2CCCN(c3ncc([N+](=O)[O-])cn3)C2)o1	ZINC000290984000	304815293	/nfs/dbraw/zinc/81/52/93/304815293.db2.gz	SDJMIBQGAILXBB-SSDOTTSWSA-N	0	2	292.255	0.445	20	5		CCBDLN
Cc1n[nH]cc1-c1nnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000368731372	526541782	/nfs/dbraw/zinc/54/17/82/526541782.db2.gz	DHMNECNLZIECRK-IYSWYEEDSA-N	0	2	294.296	0.840	20	5		CCBDLN
CCC[C@H](O)[C@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000412548304	528321890	/nfs/dbraw/zinc/32/18/90/528321890.db2.gz	PBBGWRXFMAQTCS-JQWIXIFHSA-N	0	2	298.295	0.552	20	5		CCBDLN
Cc1sc(C(=O)NN2CN=NC2=O)cc1[N+](=O)[O-]	ZINC000777768388	581132903	/nfs/dbraw/zinc/13/29/03/581132903.db2.gz	MORJMITYFFYLLY-UHFFFAOYSA-N	0	2	269.242	0.646	20	5		CCBDLN
O=C(N[C@@H](CO)C1CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000778510678	581158664	/nfs/dbraw/zinc/15/86/64/581158664.db2.gz	LUETVSTYERSTAK-VIFPVBQESA-N	0	2	266.253	0.801	20	5		CCBDLN
COc1ccc([N+](=O)[O-])cc1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774896161	582001133	/nfs/dbraw/zinc/00/11/33/582001133.db2.gz	YGTFHKCBUZJWSH-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
Nc1c(C(=O)OCc2n[nH]c(=O)[nH]2)cc(F)cc1[N+](=O)[O-]	ZINC000774936771	582004019	/nfs/dbraw/zinc/00/40/19/582004019.db2.gz	WXKRMAWMNLJDCO-UHFFFAOYSA-N	0	2	297.202	0.497	20	5		CCBDLN
O=C([O-])N1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000834113714	606030162	/nfs/dbraw/zinc/03/01/62/606030162.db2.gz	ZZZZXFCKTHMOEG-LBPRGKRZSA-N	0	2	295.295	0.924	20	5		CCBDLN
CON(C)C(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000863708884	617052178	/nfs/dbraw/zinc/05/21/78/617052178.db2.gz	TYNVCDZQKQCZOO-SSDOTTSWSA-N	0	2	297.267	0.439	20	5		CCBDLN
O=C(Nc1cnn(Cc2ccncc2)c1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839619469	640346543	/nfs/dbraw/zinc/34/65/43/640346543.db2.gz	WYTNLGPGPKUSQK-VXGBXAGGSA-N	0	2	287.279	0.930	20	5		CCBDLN
Cn1cnc2nc(=O)[nH]c(O[C@@H](C[N+](=O)[O-])C3CC3)c21	ZINC001228674209	805467347	/nfs/dbraw/zinc/46/73/47/805467347.db2.gz	LWLKPAPFCHXMQY-ZETCQYMHSA-N	0	2	279.256	0.503	20	5		CCBDLN
C[C@H](CO)N1N=C(c2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000601946410	362433421	/nfs/dbraw/zinc/43/34/21/362433421.db2.gz	YDMXESXPQBOVMW-MRVPVSSYSA-N	0	2	263.253	0.912	20	5		CCBDLN
C[C@H](CO)n1[nH]c(-c2ccc([N+](=O)[O-])cc2)cc1=O	ZINC000601946410	362433429	/nfs/dbraw/zinc/43/34/29/362433429.db2.gz	YDMXESXPQBOVMW-MRVPVSSYSA-N	0	2	263.253	0.912	20	5		CCBDLN
Cn1nc([N+](=O)[O-])cc1C(=O)N=c1ccc(C2CC2)n[nH]1	ZINC000361852865	232262569	/nfs/dbraw/zinc/26/25/69/232262569.db2.gz	YZQGLCKOJGUJAT-UHFFFAOYSA-N	0	2	288.267	0.670	20	5		CCBDLN
C[C@H](O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000127579505	187317280	/nfs/dbraw/zinc/31/72/80/187317280.db2.gz	FYNXJHNRIIQRDH-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(NC[C@@]1(O)CCSC1)c1ccc([N+](=O)[O-])cc1O	ZINC000273296061	192102483	/nfs/dbraw/zinc/10/24/83/192102483.db2.gz	YVPWPTFMFYYRDP-LBPRGKRZSA-N	0	2	298.320	0.898	20	5		CCBDLN
C[C@]1(C(N)=O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000235734365	352187514	/nfs/dbraw/zinc/18/75/14/352187514.db2.gz	IZOSQDPCLUYWTM-ZDUSSCGKSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(NCC1(O)CCOCC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272422981	353062465	/nfs/dbraw/zinc/06/24/65/353062465.db2.gz	QODPWPYSCQRIMM-UHFFFAOYSA-N	0	2	296.279	0.572	20	5		CCBDLN
COC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C1CC1	ZINC000272470247	353067489	/nfs/dbraw/zinc/06/74/89/353067489.db2.gz	ZDONGBOHVQKKQD-NSHDSACASA-N	0	2	294.263	0.982	20	5		CCBDLN
COC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CCO1	ZINC000274661789	353150495	/nfs/dbraw/zinc/15/04/95/353150495.db2.gz	DYZUJGMDMMNMLP-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(NCCOC(=O)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000283793534	353530248	/nfs/dbraw/zinc/53/02/48/353530248.db2.gz	WKGNGZYTZYBJSX-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OC	ZINC000294110346	353870042	/nfs/dbraw/zinc/87/00/42/353870042.db2.gz	SEDKQTGGNJMQRQ-SNVBAGLBSA-N	0	2	298.251	0.218	20	5		CCBDLN
CC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000299332933	354010016	/nfs/dbraw/zinc/01/00/16/354010016.db2.gz	HCGJSRFUKNOJBR-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
Cc1ccnc(NCCc2nc(N)no2)c1[N+](=O)[O-]	ZINC000348347850	355915546	/nfs/dbraw/zinc/91/55/46/355915546.db2.gz	FENKMOCOFMQYRP-UHFFFAOYSA-N	0	2	264.245	0.748	20	5		CCBDLN
O=C(N[C@H]1CC[S@](=O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000436979258	235713260	/nfs/dbraw/zinc/71/32/60/235713260.db2.gz	KIBIHPGLJLATFJ-IIYDVTGLSA-N	0	2	284.293	0.551	20	5		CCBDLN
Cc1nc([N+](=O)[O-])cn1CC(=O)N=c1cc(C)c(C)n[nH]1	ZINC000359506439	356834046	/nfs/dbraw/zinc/83/40/46/356834046.db2.gz	UCFSISADXLIMCO-UHFFFAOYSA-N	0	2	290.283	0.567	20	5		CCBDLN
CN(Cc1n[nH]c(=O)o1)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000588849200	359341338	/nfs/dbraw/zinc/34/13/38/359341338.db2.gz	KHFWBLOBDIAERO-UHFFFAOYSA-N	0	2	294.223	0.661	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCC12COC2	ZINC000597731310	361215203	/nfs/dbraw/zinc/21/52/03/361215203.db2.gz	UPBVJGGVTLHBJG-UHFFFAOYSA-N	0	2	264.237	0.915	20	5		CCBDLN
O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)NCC1CC1	ZINC000182191174	189316802	/nfs/dbraw/zinc/31/68/02/189316802.db2.gz	MWKYQVZPOCZKEH-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
CC[C@@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000598196696	361354111	/nfs/dbraw/zinc/35/41/11/361354111.db2.gz	HDUXSFKMZUIQRU-MRVPVSSYSA-N	0	2	254.242	0.801	20	5		CCBDLN
COC(=O)[C@H]1C[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000598516750	361434714	/nfs/dbraw/zinc/43/47/14/361434714.db2.gz	FFQGEIANDSKPKA-ZKCHVHJHSA-N	0	2	294.263	0.982	20	5		CCBDLN
CC(C)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184602427	189390471	/nfs/dbraw/zinc/39/04/71/189390471.db2.gz	WLYGTXGVGDOEHK-UHFFFAOYSA-N	0	2	281.268	0.555	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1ncn(C)n1	ZINC000275708332	193109654	/nfs/dbraw/zinc/10/96/54/193109654.db2.gz	ZFEKBJIYKHIMMM-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
CNC(=O)C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000185303929	388799056	/nfs/dbraw/zinc/79/90/56/388799056.db2.gz	YTKMNXDHNZDGED-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
C[C@H](CO)N(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000185587303	388808995	/nfs/dbraw/zinc/80/89/95/388808995.db2.gz	LMEQJCUKMVZZFE-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
O=C(NCCn1cc([N+](=O)[O-])cn1)C(F)(F)F	ZINC000130018485	389196831	/nfs/dbraw/zinc/19/68/31/389196831.db2.gz	GBQWNUXWMQGILO-UHFFFAOYSA-N	0	2	252.152	0.470	20	5		CCBDLN
CN(C)C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157586281	389332278	/nfs/dbraw/zinc/33/22/78/389332278.db2.gz	ZXAXYLXXEUFZCK-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
COc1cccc(C(=O)NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000444281887	389899752	/nfs/dbraw/zinc/89/97/52/389899752.db2.gz	NKRBREZBBASNLX-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
C[C@@H]1CO[C@@H](CO)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436972814	389989322	/nfs/dbraw/zinc/98/93/22/389989322.db2.gz	PTFRKAJRTGPTJP-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC[S@@]1=O	ZINC000436988565	389989716	/nfs/dbraw/zinc/98/97/16/389989716.db2.gz	KQBDDQNYQZIHCU-FHZGZLOMSA-N	0	2	298.320	0.893	20	5		CCBDLN
CN(C)C(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000542791640	390270613	/nfs/dbraw/zinc/27/06/13/390270613.db2.gz	GFHZXENFUADFSH-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
C[S@@](=O)C1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000282130012	195514268	/nfs/dbraw/zinc/51/42/68/195514268.db2.gz	IKWFUXWLFOHOPM-HXUWFJFHSA-N	0	2	298.320	0.941	20	5		CCBDLN
NC(=O)[C@@H]1CCCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000236208052	303298139	/nfs/dbraw/zinc/29/81/39/303298139.db2.gz	WHSBKUNUINAFFV-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
CC1(C(N)=O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000582548685	329105744	/nfs/dbraw/zinc/10/57/44/329105744.db2.gz	SXGYEZVFPKVCBB-UHFFFAOYSA-N	0	2	279.252	0.248	20	5		CCBDLN
CCOC[C@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354358795	520158868	/nfs/dbraw/zinc/15/88/68/520158868.db2.gz	NAFGGPFJNUAQQH-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1cccc([N+](=O)[O-])c1	ZINC000358369952	534702332	/nfs/dbraw/zinc/70/23/32/534702332.db2.gz	OIFFGLXGFZWJBE-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC2(C1)OCCO2	ZINC000788301672	581104687	/nfs/dbraw/zinc/10/46/87/581104687.db2.gz	RPTJDJWUNZILHY-UHFFFAOYSA-N	0	2	294.263	0.889	20	5		CCBDLN
O=C([O-])C[C@H]1CSCC[N@@H+]1Cn1cc([N+](=O)[O-])cn1	ZINC000739657189	581587925	/nfs/dbraw/zinc/58/79/25/581587925.db2.gz	DNEUVWCGRNVUJS-QMMMGPOBSA-N	0	2	286.313	0.641	20	5		CCBDLN
O=C([O-])C[C@H]1CSCC[N@H+]1Cn1cc([N+](=O)[O-])cn1	ZINC000739657189	581587926	/nfs/dbraw/zinc/58/79/26/581587926.db2.gz	DNEUVWCGRNVUJS-QMMMGPOBSA-N	0	2	286.313	0.641	20	5		CCBDLN
CN(C[C@@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1)C(=O)[O-]	ZINC000739664760	581646482	/nfs/dbraw/zinc/64/64/82/581646482.db2.gz	NYSAVENXRXRZCO-VIFPVBQESA-N	0	2	283.288	0.681	20	5		CCBDLN
CN(C[C@@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1)C(=O)[O-]	ZINC000739664760	581646484	/nfs/dbraw/zinc/64/64/84/581646484.db2.gz	NYSAVENXRXRZCO-VIFPVBQESA-N	0	2	283.288	0.681	20	5		CCBDLN
Cc1cc(C(=O)NCc2n[nH]c(=O)[nH]2)c(N)c([N+](=O)[O-])c1	ZINC000748006330	581959124	/nfs/dbraw/zinc/95/91/24/581959124.db2.gz	FXYLLVQWAWTJKP-UHFFFAOYSA-N	0	2	292.255	0.239	20	5		CCBDLN
CC(C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750760593	582058608	/nfs/dbraw/zinc/05/86/08/582058608.db2.gz	ADADQULZKXLSGQ-UHFFFAOYSA-N	0	2	273.270	0.451	20	5		CCBDLN
C[C@H]1CN(C(=O)[O-])CC[N@@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000826026606	603705703	/nfs/dbraw/zinc/70/57/03/603705703.db2.gz	MNHAEBWJLUIAII-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@H]1CN(C(=O)[O-])CC[N@H+]1CCn1ccc([N+](=O)[O-])n1	ZINC000826026606	603705704	/nfs/dbraw/zinc/70/57/04/603705704.db2.gz	MNHAEBWJLUIAII-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
CC(=O)N1CC(Oc2cccc(O)c2[N+](=O)[O-])C1	ZINC001225620762	805144167	/nfs/dbraw/zinc/14/41/67/805144167.db2.gz	UOKQWHWNPMATFU-UHFFFAOYSA-N	0	2	252.226	0.910	20	5		CCBDLN
CC[C@H](O)C(=O)Oc1ncc([N+](=O)[O-])c2[nH]cnc21	ZINC001227692647	805380544	/nfs/dbraw/zinc/38/05/44/805380544.db2.gz	AMPCDNTXJVVGSO-LURJTMIESA-N	0	2	266.213	0.542	20	5		CCBDLN
CNC(=O)[C@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184660763	290613114	/nfs/dbraw/zinc/61/31/14/290613114.db2.gz	QXNJHIHWOHMJGZ-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000104890355	349719182	/nfs/dbraw/zinc/71/91/82/349719182.db2.gz	MEIIRCJLPBVTKA-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NC1(CO)CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000182155638	231830897	/nfs/dbraw/zinc/83/08/97/231830897.db2.gz	SRUDSOLMXBBYQF-UHFFFAOYSA-N	0	2	252.226	0.555	20	5		CCBDLN
CCOC(=O)C[C@H](O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000339352227	215114998	/nfs/dbraw/zinc/11/49/98/215114998.db2.gz	KLVLGEPRXKLMDF-JTQLQIEISA-N	0	2	298.251	0.553	20	5		CCBDLN
O=C(N[C@H]1C=C[C@@H](CO)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346814579	137305782	/nfs/dbraw/zinc/30/57/82/137305782.db2.gz	BTYFMRWHCJFQCO-BDAKNGLRSA-N	0	2	278.264	0.967	20	5		CCBDLN
C[C@H]1C(=O)NCCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000188084342	351572931	/nfs/dbraw/zinc/57/29/31/351572931.db2.gz	CAAYANCLENLFQV-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC[C@H](CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)OC	ZINC000227699084	352057740	/nfs/dbraw/zinc/05/77/40/352057740.db2.gz	QDIFBWKSOPHMOY-VIFPVBQESA-N	0	2	284.268	0.692	20	5		CCBDLN
O=C(NCCN1CCOCC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236560899	352198010	/nfs/dbraw/zinc/19/80/10/352198010.db2.gz	WWVHNHFYZYWTDB-UHFFFAOYSA-N	0	2	295.295	0.362	20	5		CCBDLN
Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)n1C	ZINC000272460080	353066506	/nfs/dbraw/zinc/06/65/06/353066506.db2.gz	XOCQBQWAYNZICD-UHFFFAOYSA-N	0	2	291.267	0.667	20	5		CCBDLN
COC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272366768	353056344	/nfs/dbraw/zinc/05/63/44/353056344.db2.gz	ONSULBXSNOBNNC-UHFFFAOYSA-N	0	2	268.225	0.545	20	5		CCBDLN
COC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272371397	353057568	/nfs/dbraw/zinc/05/75/68/353057568.db2.gz	POYCUVPHKGEKKA-QMMMGPOBSA-N	0	2	294.263	0.936	20	5		CCBDLN
COC[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CCO1	ZINC000280693387	353376101	/nfs/dbraw/zinc/37/61/01/353376101.db2.gz	DPPAKCIUMHDERV-VIFPVBQESA-N	0	2	296.279	0.788	20	5		CCBDLN
COC(=O)CCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280816460	353385037	/nfs/dbraw/zinc/38/50/37/353385037.db2.gz	RUENMIJJYUZYRP-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1C	ZINC000282466811	353426858	/nfs/dbraw/zinc/42/68/58/353426858.db2.gz	ULFVUMPVNPFYMX-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(NCCn1cncn1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000338750229	355411733	/nfs/dbraw/zinc/41/17/33/355411733.db2.gz	PWJQVBAKUSTONC-UHFFFAOYSA-N	0	2	277.240	0.322	20	5		CCBDLN
C[C@H](CCO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354475312	356420528	/nfs/dbraw/zinc/42/05/28/356420528.db2.gz	IOBZPNKNGXNZPC-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@H](CO)[C@@H](O)C1	ZINC000560668525	291111363	/nfs/dbraw/zinc/11/13/63/291111363.db2.gz	SDURYYBGCJKSQC-PELKAZGASA-N	0	2	296.279	0.116	20	5		CCBDLN
CN1C(=O)CC[C@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000355896002	356666550	/nfs/dbraw/zinc/66/65/50/356666550.db2.gz	LNQGCMBAXGPCHQ-QMMMGPOBSA-N	0	2	279.252	0.860	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC(O)(C2CC2)C1	ZINC000364969175	357133917	/nfs/dbraw/zinc/13/39/17/357133917.db2.gz	FTJDZWUFGCHNBD-UHFFFAOYSA-N	0	2	278.264	0.897	20	5		CCBDLN
O=CN1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000294624100	199112461	/nfs/dbraw/zinc/11/24/61/199112461.db2.gz	QSQDOQZXCZTUIR-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])CCO1	ZINC000569347487	358756647	/nfs/dbraw/zinc/75/66/47/358756647.db2.gz	DZAVAXROZRXKFB-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])CCO1	ZINC000569347487	358756651	/nfs/dbraw/zinc/75/66/51/358756651.db2.gz	DZAVAXROZRXKFB-LBPRGKRZSA-N	0	2	296.279	0.759	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CCO1	ZINC000597541952	361133011	/nfs/dbraw/zinc/13/30/11/361133011.db2.gz	XDDWCRMALQTAQZ-LLVKDONJSA-N	0	2	282.252	0.745	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CCO1	ZINC000597540752	361133088	/nfs/dbraw/zinc/13/30/88/361133088.db2.gz	OYTQOGMQCSPTEB-JTQLQIEISA-N	0	2	282.252	0.745	20	5		CCBDLN
C[C@H](O)C1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000598383968	361402123	/nfs/dbraw/zinc/40/21/23/361402123.db2.gz	AJOSBHHHLPSSIR-ZETCQYMHSA-N	0	2	266.253	0.944	20	5		CCBDLN
CC(=O)NC1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000332010304	204386607	/nfs/dbraw/zinc/38/66/07/204386607.db2.gz	SBPIEQFWMNWCSR-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
COC(=O)C(C)(C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280871911	195009426	/nfs/dbraw/zinc/00/94/26/195009426.db2.gz	FGWYSBSHTGKLIG-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
CC[C@@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281043139	195081902	/nfs/dbraw/zinc/08/19/02/195081902.db2.gz	WPELQNLAXJSJPM-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCS(=O)CC1	ZINC000185201562	388792966	/nfs/dbraw/zinc/79/29/66/388792966.db2.gz	ZWPXIXZOWJIEBB-UHFFFAOYSA-N	0	2	284.293	0.505	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)N(C)C	ZINC000194747272	389103104	/nfs/dbraw/zinc/10/31/04/389103104.db2.gz	BCSBTLOJZUDZDS-SSDOTTSWSA-N	0	2	281.268	0.507	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1ncn(C)n1	ZINC000275570824	389511695	/nfs/dbraw/zinc/51/16/95/389511695.db2.gz	NPFFFERUQBUAJX-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
CN(C)C(=O)C1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000413917051	389581950	/nfs/dbraw/zinc/58/19/50/389581950.db2.gz	BOOXIFNFJMTUTD-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
COC[C@H](CCO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436891316	389986412	/nfs/dbraw/zinc/98/64/12/389986412.db2.gz	WZZVLYXOTBACPY-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
Nc1noc(CCNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000436969229	389988473	/nfs/dbraw/zinc/98/84/73/389988473.db2.gz	XOCHGUPHNSTMMJ-UHFFFAOYSA-N	0	2	293.239	0.068	20	5		CCBDLN
CCO[C@@H]1COC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000456789368	390018493	/nfs/dbraw/zinc/01/84/93/390018493.db2.gz	FKOMDRZTQMLQQE-BXKDBHETSA-N	0	2	296.279	0.834	20	5		CCBDLN
Cn1ccc(=NC(=O)c2cccc(O)c2[N+](=O)[O-])[nH]1	ZINC000358004866	144141568	/nfs/dbraw/zinc/14/15/68/144141568.db2.gz	LNKVMAOCDRLESI-UHFFFAOYSA-N	0	2	262.225	0.708	20	5		CCBDLN
Nc1nccc(C(=O)Nc2ccc3nn[nH]c3c2)c1[N+](=O)[O-]	ZINC000548386079	286031771	/nfs/dbraw/zinc/03/17/71/286031771.db2.gz	ZDMYFDGHLIRLTK-UHFFFAOYSA-N	0	2	299.250	0.926	20	5		CCBDLN
COC[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000548514697	286044669	/nfs/dbraw/zinc/04/46/69/286044669.db2.gz	IRBXHYBHCIZJSJ-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC(=O)N1	ZINC000297049327	296924987	/nfs/dbraw/zinc/92/49/87/296924987.db2.gz	OUNLEWCPOSDMKM-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCn2cnnc2C1	ZINC000217315785	304502682	/nfs/dbraw/zinc/50/26/82/304502682.db2.gz	JRKRSDINBJDTEX-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
O=C(N[C@@H]1CC[C@H]1O)c1cccc(O)c1[N+](=O)[O-]	ZINC000425039296	534771143	/nfs/dbraw/zinc/77/11/43/534771143.db2.gz	AVLRQJDIYNSVIG-HTQZYQBOSA-N	0	2	252.226	0.554	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(NCc2n[nH]c(=O)[nH]2)n1	ZINC000129352447	526062374	/nfs/dbraw/zinc/06/23/74/526062374.db2.gz	FVTGBFMISGCJPM-UHFFFAOYSA-N	0	2	250.218	0.322	20	5		CCBDLN
CCN1C[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])CC1=O	ZINC000456176653	527989638	/nfs/dbraw/zinc/98/96/38/527989638.db2.gz	YLRUYIZEPPGKGP-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
COCCONC(=O)CN(C)c1ccccc1[N+](=O)[O-]	ZINC000748772683	581986199	/nfs/dbraw/zinc/98/61/99/581986199.db2.gz	MIYGPFUIYLASQV-UHFFFAOYSA-N	0	2	283.284	0.725	20	5		CCBDLN
COC(=O)[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2ccccc21	ZINC000839680055	616380148	/nfs/dbraw/zinc/38/01/48/616380148.db2.gz	NOBWTKIETARUME-CKYFFXLPSA-N	0	2	290.275	0.955	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N(C[C@@H]1CCCO1)c1ccnnc1	ZINC000893109251	625326217	/nfs/dbraw/zinc/32/62/17/625326217.db2.gz	RGGPBBCWTSVMPO-QJPTWQEYSA-N	0	2	292.295	0.654	20	5		CCBDLN
Nc1ccc([N+](=O)[O-])c(NCc2n[nH]c(=O)[nH]2)c1	ZINC000800857585	640622808	/nfs/dbraw/zinc/62/28/08/640622808.db2.gz	YDAJWGYJOHDRGI-UHFFFAOYSA-N	0	2	250.218	0.613	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](C2N=NC(=O)O2)C1	ZINC000819967733	641443675	/nfs/dbraw/zinc/44/36/75/641443675.db2.gz	NBIWQBPOWYBJSJ-BWZBUEFSSA-N	0	2	282.256	0.146	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCC[C@@H](c2n[nH]c(=O)o2)C1	ZINC000819967733	641443680	/nfs/dbraw/zinc/44/36/80/641443680.db2.gz	NBIWQBPOWYBJSJ-BWZBUEFSSA-N	0	2	282.256	0.146	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCc2nc(F)ccc21	ZINC000857892402	644574331	/nfs/dbraw/zinc/57/43/31/644574331.db2.gz	RAMSSZPSNCUBLF-HZGVNTEJSA-N	0	2	251.217	0.775	20	5		CCBDLN
O=C(Nc1ccnn1[C@@H]1CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000888596641	646222684	/nfs/dbraw/zinc/22/26/84/646222684.db2.gz	JXRPJPTZPUOCOJ-IWSPIJDZSA-N	0	2	266.257	0.448	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCSC[C@H]1CO	ZINC001137625771	799678348	/nfs/dbraw/zinc/67/83/48/799678348.db2.gz	QYJHLGJFEYGPIO-SECBINFHSA-N	0	2	298.320	0.850	20	5		CCBDLN
Nc1cccc([N+](=O)[O-])c1C(=O)NN1CCOC1=O	ZINC001166863857	802971635	/nfs/dbraw/zinc/97/16/35/802971635.db2.gz	NJVOPTBGGBEIIJ-UHFFFAOYSA-N	0	2	266.213	0.274	20	5		CCBDLN
O=C1C[C@H](Oc2cc(O)cc(O)c2[N+](=O)[O-])CO1	ZINC001228972186	805494084	/nfs/dbraw/zinc/49/40/84/805494084.db2.gz	UBBSRWJKYVMEON-LURJTMIESA-N	0	2	255.182	0.700	20	5		CCBDLN
Cc1nc(O[C@@H]2CCc3nccn3C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001229382603	805527422	/nfs/dbraw/zinc/52/74/22/805527422.db2.gz	VAWOSQPLGSGPQZ-MRVPVSSYSA-N	0	2	291.267	0.989	20	5		CCBDLN
Cc1noc(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC001319766881	910285205	/nfs/dbraw/zinc/28/52/05/910285205.db2.gz	IFLKNSHNYAXYSY-UHFFFAOYSA-N	0	2	252.190	0.272	20	5		CCBDLN
COCc1nnc(CNc2c(C)cncc2[N+](=O)[O-])[nH]1	ZINC001330077895	916401623	/nfs/dbraw/zinc/40/16/23/916401623.db2.gz	GRDHAYGFNQFGQZ-UHFFFAOYSA-N	0	2	278.272	0.597	20	5		CCBDLN
C[C@](CO)([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001592750684	979314934	/nfs/dbraw/zinc/31/49/34/979314934.db2.gz	NRLWYBMNVUZRHI-LLVKDONJSA-N	0	2	270.241	0.226	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)N1CCCC1	ZINC000078581465	136787361	/nfs/dbraw/zinc/78/73/61/136787361.db2.gz	MVFNETOOZXBCDJ-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
CN(CCCO)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000310664151	137071993	/nfs/dbraw/zinc/07/19/93/137071993.db2.gz	YIOGIARNJZVSKM-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
C[C@@H](CO)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346851402	137308773	/nfs/dbraw/zinc/30/87/73/137308773.db2.gz	JPHMQQMWDFNFQN-SSDOTTSWSA-N	0	2	254.242	0.659	20	5		CCBDLN
CCN1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000273466535	192162589	/nfs/dbraw/zinc/16/25/89/192162589.db2.gz	IZJVDIKZEJUDNT-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
Cn1cnnc1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000125400349	350121207	/nfs/dbraw/zinc/12/12/07/350121207.db2.gz	DDYULXRTMOCTTR-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(Cc1ccc([N+](=O)[O-])cc1F)NCc1n[nH]c(=O)[nH]1	ZINC000159184836	350671927	/nfs/dbraw/zinc/67/19/27/350671927.db2.gz	YMODHGLEMRMAMK-UHFFFAOYSA-N	0	2	295.230	0.004	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@H](CO)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000176034261	351155197	/nfs/dbraw/zinc/15/51/97/351155197.db2.gz	FESYGAUEFGSPMS-WCBMZHEXSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(N[C@@]1(CCO)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000278058057	353280118	/nfs/dbraw/zinc/28/01/18/353280118.db2.gz	JXTUIMFUQXJUGG-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
CN(CCC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000286305512	353576343	/nfs/dbraw/zinc/57/63/43/353576343.db2.gz	WKBKGJGVHJRMSY-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
COCCCONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000287898283	353674625	/nfs/dbraw/zinc/67/46/25/353674625.db2.gz	RZXOCSBKLRQRDK-UHFFFAOYSA-N	0	2	270.241	0.998	20	5		CCBDLN
COC[C@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000428083972	235393481	/nfs/dbraw/zinc/39/34/81/235393481.db2.gz	MBEASGAFOBUFMK-ZETCQYMHSA-N	0	2	270.241	0.038	20	5		CCBDLN
COCC[C@@](C)(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353404413	356216036	/nfs/dbraw/zinc/21/60/36/356216036.db2.gz	PDSPLCPRZCOSIY-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
O=C(COc1cccc([N+](=O)[O-])c1)N=c1ccc(=O)[nH][nH]1	ZINC000361959019	138039988	/nfs/dbraw/zinc/03/99/88/138039988.db2.gz	WLUGJMYMJSOQIV-UHFFFAOYSA-N	0	2	290.235	0.530	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCn2ncnc2C1	ZINC000354888218	356522034	/nfs/dbraw/zinc/52/20/34/356522034.db2.gz	FWXYJOLPXHVABO-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
NC(=O)N1CCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000356322311	356746324	/nfs/dbraw/zinc/74/63/24/356746324.db2.gz	OQNTZWBLNXJION-SECBINFHSA-N	0	2	294.267	0.782	20	5		CCBDLN
O=C(NC1COCCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000590434641	359461461	/nfs/dbraw/zinc/46/14/61/359461461.db2.gz	LSJHVGSSNHPORI-UHFFFAOYSA-N	0	2	282.252	0.446	20	5		CCBDLN
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O=C(NC[C@H]1CCCC(=O)N1)c1cc([N+](=O)[O-])ccc1O	ZINC000447748509	389963916	/nfs/dbraw/zinc/96/39/16/389963916.db2.gz	XXVVLNKMNJFLQD-MRVPVSSYSA-N	0	2	293.279	0.699	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@H]1OC	ZINC000436731824	389984325	/nfs/dbraw/zinc/98/43/25/389984325.db2.gz	QVOJCEUCHZGTEG-VXGBXAGGSA-N	0	2	296.279	0.786	20	5		CCBDLN
CCn1ncnc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436914964	389987039	/nfs/dbraw/zinc/98/70/39/389987039.db2.gz	LYCRJVWSKCYRBZ-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCS(=O)CC1	ZINC000436961239	389988510	/nfs/dbraw/zinc/98/85/10/389988510.db2.gz	AXBUHUVPQBJOCI-UHFFFAOYSA-N	0	2	284.293	0.505	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC[S@]1=O	ZINC000436971831	389988818	/nfs/dbraw/zinc/98/88/18/389988818.db2.gz	LFXUCHOOCBNJNI-FFVOIRBGSA-N	0	2	298.320	0.893	20	5		CCBDLN
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Cn1cnc(CCNC(=O)c2cc([N+](=O)[O-])ccc2O)n1	ZINC000436971308	389989221	/nfs/dbraw/zinc/98/92/21/389989221.db2.gz	IOMOTSDHJOXMBV-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
COC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000540933052	390229959	/nfs/dbraw/zinc/22/99/59/390229959.db2.gz	BQZXQVNMVDAEOL-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@H]1OC(=O)N[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000497167162	390429671	/nfs/dbraw/zinc/42/96/71/390429671.db2.gz	JVTOLZMLYHLZFG-ANLVUFKYSA-N	0	2	281.224	0.736	20	5		CCBDLN
CCOC(=O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000343079125	285762010	/nfs/dbraw/zinc/76/20/10/285762010.db2.gz	OPDOGURAZBZNJH-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
COCC[C@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272343574	292722633	/nfs/dbraw/zinc/72/26/33/292722633.db2.gz	AWWAHWVIWPRRSB-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@H]1O	ZINC000351868452	300194150	/nfs/dbraw/zinc/19/41/50/300194150.db2.gz	FLGSRSUUKJWXNT-WRWORJQWSA-N	0	2	266.253	0.753	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C[C@@H]1O	ZINC000351868449	300193997	/nfs/dbraw/zinc/19/39/97/300193997.db2.gz	FLGSRSUUKJWXNT-CPCISQLKSA-N	0	2	266.253	0.753	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC(=O)N1C	ZINC000282336062	300194019	/nfs/dbraw/zinc/19/40/19/300194019.db2.gz	KTMLHILPDJLUQS-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
COC[C@@H](CCO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354056927	536608171	/nfs/dbraw/zinc/60/81/71/536608171.db2.gz	OGSVEHZPLXVTCC-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
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CCOC(=O)Cn1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000847238673	615220323	/nfs/dbraw/zinc/22/03/23/615220323.db2.gz	LSFKAQYRLURVAZ-HTQZYQBOSA-N	0	2	282.256	0.050	20	5		CCBDLN
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Cn1c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nnc1C1CC1	ZINC000855253475	644298109	/nfs/dbraw/zinc/29/81/09/644298109.db2.gz	LAXZGTGLRSOCFD-RNFRBKRXSA-N	0	2	251.246	0.296	20	5		CCBDLN
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CC[N@@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000089531335	349392455	/nfs/dbraw/zinc/39/24/55/349392455.db2.gz	FXVXFENCJYPEAG-GFCCVEGCSA-N	0	2	295.295	0.960	20	5		CCBDLN
CC[N@H+]1CCO[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2[O-])C1	ZINC000089531335	349392460	/nfs/dbraw/zinc/39/24/60/349392460.db2.gz	FXVXFENCJYPEAG-GFCCVEGCSA-N	0	2	295.295	0.960	20	5		CCBDLN
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CC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181873597	351340401	/nfs/dbraw/zinc/34/04/01/351340401.db2.gz	MUESAIOUXUUTPQ-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
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COC(=O)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000226559543	352029231	/nfs/dbraw/zinc/02/92/31/352029231.db2.gz	PANFMGAQZAPVTR-VIFPVBQESA-N	0	2	294.263	0.936	20	5		CCBDLN
C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1O)S(C)(=O)=O	ZINC000230302993	352110851	/nfs/dbraw/zinc/11/08/51/352110851.db2.gz	IIJZNVDZRAQADY-ZCFIWIBFSA-N	0	2	288.281	0.672	20	5		CCBDLN
Cn1ccnc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236083380	352191058	/nfs/dbraw/zinc/19/10/58/352191058.db2.gz	ZDGVSMLVZRTOLO-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CC(C)(CNC(=O)c1cc([N+](=O)[O-])ccc1O)OCCO	ZINC000292155509	198183914	/nfs/dbraw/zinc/18/39/14/198183914.db2.gz	URMBAQYPQZUBTC-UHFFFAOYSA-N	0	2	298.295	0.818	20	5		CCBDLN
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CN(CC(=O)NOC(C)(C)CO)c1ccccc1[N+](=O)[O-]	ZINC000297356136	200160765	/nfs/dbraw/zinc/16/07/65/200160765.db2.gz	YOESKGHYJNYJBQ-UHFFFAOYSA-N	0	2	297.311	0.850	20	5		CCBDLN
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CCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000159201028	389361385	/nfs/dbraw/zinc/36/13/85/389361385.db2.gz	PCUCWGNDGIHYCT-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
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CC1(O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000277709345	281598774	/nfs/dbraw/zinc/59/87/74/281598774.db2.gz	IVSMXQFKDDSMFA-UHFFFAOYSA-N	0	2	252.226	0.507	20	5		CCBDLN
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Cn1cnnc1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000157101455	303033548	/nfs/dbraw/zinc/03/35/48/303033548.db2.gz	BGWWHVOEUUBEJM-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CC(C)(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000183423164	519264038	/nfs/dbraw/zinc/26/40/38/519264038.db2.gz	IVEWAQAHUJXSNZ-UHFFFAOYSA-N	0	2	281.268	0.542	20	5		CCBDLN
CC(C)CN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184636760	519714614	/nfs/dbraw/zinc/71/46/14/519714614.db2.gz	YZXMRJGTMVVRMV-UHFFFAOYSA-N	0	2	295.295	0.884	20	5		CCBDLN
CC(C)NC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412855544	529144078	/nfs/dbraw/zinc/14/40/78/529144078.db2.gz	LUDDEJZZPQQGCH-MRVPVSSYSA-N	0	2	295.295	0.943	20	5		CCBDLN
CC1(CC(=O)NS(=O)(=O)c2ccc([N+](=O)[O-])nc2)CC1	ZINC000759557629	581806770	/nfs/dbraw/zinc/80/67/70/581806770.db2.gz	MCOFTYKMCYHQTE-UHFFFAOYSA-N	0	2	299.308	0.985	20	5		CCBDLN
C[C@@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CCN1C(=O)[O-]	ZINC000826056394	603709839	/nfs/dbraw/zinc/70/98/39/603709839.db2.gz	CGDLFNXNJHHJTG-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CCN1C(=O)[O-]	ZINC000826056394	603709843	/nfs/dbraw/zinc/70/98/43/603709843.db2.gz	CGDLFNXNJHHJTG-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
Cn1[nH]c(-c2ccccc2)nc1=NC(=O)[C@@H]1CC1[N+](=O)[O-]	ZINC000839748805	640361044	/nfs/dbraw/zinc/36/10/44/640361044.db2.gz	VTYSKXBBHOLBHB-NXEZZACHSA-N	0	2	287.279	0.508	20	5		CCBDLN
Cn1[nH]c(-c2ccccc2)nc1=NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839748805	640361049	/nfs/dbraw/zinc/36/10/49/640361049.db2.gz	VTYSKXBBHOLBHB-NXEZZACHSA-N	0	2	287.279	0.508	20	5		CCBDLN
O=c1nc2nc[nH]c2c(O[C@H](C[N+](=O)[O-])C2CC2)[nH]1	ZINC001227070317	805318130	/nfs/dbraw/zinc/31/81/30/805318130.db2.gz	NLSVLCPCSOVTDD-ZCFIWIBFSA-N	0	2	265.229	0.493	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC[C@@H]1COCO1	ZINC001228970200	805494337	/nfs/dbraw/zinc/49/43/37/805494337.db2.gz	HDRDMTVCNSZYNU-ZETCQYMHSA-N	0	2	257.198	0.758	20	5		CCBDLN
C[S@](=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316528	839076718	/nfs/dbraw/zinc/07/67/18/839076718.db2.gz	ZDDOXDDQDJUVOX-SFHVURJKSA-N	0	2	272.282	0.409	20	5		CCBDLN
Cc1nc(=NC(=O)c2ccc([N+](=O)[O-])[nH]2)[nH]n1C	ZINC000344531726	137199393	/nfs/dbraw/zinc/19/93/93/137199393.db2.gz	MIJFITADDCCMIG-UHFFFAOYSA-N	0	2	250.218	0.034	20	5		CCBDLN
COC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000022751232	348082414	/nfs/dbraw/zinc/08/24/14/348082414.db2.gz	VVCHCZIZMGVMLE-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)cn1	ZINC000065421515	348715100	/nfs/dbraw/zinc/71/51/00/348715100.db2.gz	CGFXKFLVDLCJJL-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
NC(=O)[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000271266674	191038253	/nfs/dbraw/zinc/03/82/53/191038253.db2.gz	KWVMTWUJLGKOFL-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(NCC1(CO)CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000130672714	350244471	/nfs/dbraw/zinc/24/44/71/350244471.db2.gz	DRTCOPNDLTYXON-UHFFFAOYSA-N	0	2	266.253	0.803	20	5		CCBDLN
CC[C@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000106921332	186151121	/nfs/dbraw/zinc/15/11/21/186151121.db2.gz	LNVBBKIWQXYXPJ-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1COCCO1	ZINC000230303025	352110433	/nfs/dbraw/zinc/11/04/33/352110433.db2.gz	FNXVVSVOFRLCBT-JTQLQIEISA-N	0	2	268.225	0.654	20	5		CCBDLN
C[C@]1(C(N)=O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000235735458	352187614	/nfs/dbraw/zinc/18/76/14/352187614.db2.gz	TZJRCHFURNSZNX-ZDUSSCGKSA-N	0	2	293.279	0.638	20	5		CCBDLN
COC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272411086	353061881	/nfs/dbraw/zinc/06/18/81/353061881.db2.gz	ORFMWPKBQLJQHN-MRVPVSSYSA-N	0	2	270.241	0.038	20	5		CCBDLN
COC(=O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000272468578	353067382	/nfs/dbraw/zinc/06/73/82/353067382.db2.gz	YUQDSNPXGPJJNA-UHFFFAOYSA-N	0	2	280.236	0.736	20	5		CCBDLN
COC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000280003134	353331201	/nfs/dbraw/zinc/33/12/01/353331201.db2.gz	MNCBNZCFXJGUPL-SSDOTTSWSA-N	0	2	270.241	0.038	20	5		CCBDLN
CC(C)C(=O)NCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280844986	353387627	/nfs/dbraw/zinc/38/76/27/353387627.db2.gz	VMMSDQKYIBLVNJ-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
COC(=O)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1O)OC	ZINC000294207031	353878797	/nfs/dbraw/zinc/87/87/97/353878797.db2.gz	YBNCJOGAPDPVSU-SNVBAGLBSA-N	0	2	298.251	0.218	20	5		CCBDLN
O=C(COc1ccccc1[N+](=O)[O-])N=c1ccc(=O)[nH][nH]1	ZINC000361967887	138040259	/nfs/dbraw/zinc/04/02/59/138040259.db2.gz	NSSDKOKURIVENT-UHFFFAOYSA-N	0	2	290.235	0.530	20	5		CCBDLN
CC[C@H](O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000294145034	198926151	/nfs/dbraw/zinc/92/61/51/198926151.db2.gz	LFGGWHJJIXSZCB-QMMMGPOBSA-N	0	2	254.242	0.801	20	5		CCBDLN
CC1(C)C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179479299	189197316	/nfs/dbraw/zinc/19/73/16/189197316.db2.gz	FTXZFNWCIVFBQI-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)[C@@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000280857965	195004486	/nfs/dbraw/zinc/00/44/86/195004486.db2.gz	DDBDVAQPCFCVIN-SECBINFHSA-N	0	2	281.268	0.540	20	5		CCBDLN
COCC1(O)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000394904791	285219382	/nfs/dbraw/zinc/21/93/82/285219382.db2.gz	IIMDOKDGWSLKAT-UHFFFAOYSA-N	0	2	282.252	0.134	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)NCCF	ZINC000282646375	388755811	/nfs/dbraw/zinc/75/58/11/388755811.db2.gz	XLCNVARCCFUSRA-SSDOTTSWSA-N	0	2	299.258	0.504	20	5		CCBDLN
NC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000421994098	389389201	/nfs/dbraw/zinc/38/92/01/389389201.db2.gz	BJBGTXMCECWTAF-SCZZXKLOSA-N	0	2	293.279	0.684	20	5		CCBDLN
Cn1cnnc1CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272386966	389467023	/nfs/dbraw/zinc/46/70/23/389467023.db2.gz	KIBYBVKFMJFXEV-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
CC(C)N(CC(N)=O)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281162602	389610144	/nfs/dbraw/zinc/61/01/44/389610144.db2.gz	LWODBUXVJADZQY-UHFFFAOYSA-N	0	2	281.268	0.636	20	5		CCBDLN
O=C(N[C@@H](CO)[C@@H]1CCCO1)c1cc([N+](=O)[O-])ccc1O	ZINC000436806006	389984533	/nfs/dbraw/zinc/98/45/33/389984533.db2.gz	FGJMYVVWLQROIM-JQWIXIFHSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCn2ncnc2C1	ZINC000436935947	389987259	/nfs/dbraw/zinc/98/72/59/389987259.db2.gz	FFJHPUFWVQQIOT-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
COC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC	ZINC000436960031	389987723	/nfs/dbraw/zinc/98/77/23/389987723.db2.gz	OYIMFJNSJNJDNS-SECBINFHSA-N	0	2	298.251	0.218	20	5		CCBDLN
Cn1ccc(C=Cc2[nH]c(=O)[nH]c(=O)c2[N+](=O)[O-])n1	ZINC000554389832	390426092	/nfs/dbraw/zinc/42/60/92/390426092.db2.gz	LONKVIZWHPWZPX-NSCUHMNNSA-N	0	2	263.213	0.700	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@H](O)C2(CC2)C1	ZINC000368754042	144243169	/nfs/dbraw/zinc/24/31/69/144243169.db2.gz	OXGIFTFQTMPKPF-NSHDSACASA-N	0	2	278.264	0.897	20	5		CCBDLN
C[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2[O-])CC1	ZINC000184574370	290031369	/nfs/dbraw/zinc/03/13/69/290031369.db2.gz	DEIFAGSNXXEFAY-UHFFFAOYSA-N	0	2	265.269	0.688	20	5		CCBDLN
C[NH+]1CCN(C(=O)c2cccc([O-])c2[N+](=O)[O-])CC1	ZINC000281262415	290031905	/nfs/dbraw/zinc/03/19/05/290031905.db2.gz	VMCWXSGVGXDQRQ-UHFFFAOYSA-N	0	2	265.269	0.688	20	5		CCBDLN
C[C@H]1CO[C@H](CO)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436885806	300367283	/nfs/dbraw/zinc/36/72/83/300367283.db2.gz	FDOGZRYNWRMBMX-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCn2nncc2C1	ZINC000581081156	336006112	/nfs/dbraw/zinc/00/61/12/336006112.db2.gz	FITOIENVUMWOAS-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
CC(C)C(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184755921	527508095	/nfs/dbraw/zinc/50/80/95/527508095.db2.gz	WCILOPIJJQNABI-UHFFFAOYSA-N	0	2	295.295	0.802	20	5		CCBDLN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1cnnn1C	ZINC000788205512	581485415	/nfs/dbraw/zinc/48/54/15/581485415.db2.gz	NIEYIHMAGKWCDM-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
CCCCNC(=O)Cc1noc([C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000904256001	614421933	/nfs/dbraw/zinc/42/19/33/614421933.db2.gz	YXMRDQADUYQVIY-HTQZYQBOSA-N	0	2	268.273	0.661	20	5		CCBDLN
O=C(Nc1cc([C@H]2CCCOC2)[nH]n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839750045	640361115	/nfs/dbraw/zinc/36/11/15/640361115.db2.gz	XTRFVHJWENCAMR-QXFUBDJGSA-N	0	2	280.284	0.907	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(=O)Nc2ccccc21	ZINC000840238896	640989763	/nfs/dbraw/zinc/98/97/63/640989763.db2.gz	STURADCSXDALMF-GMSGAONNSA-N	0	2	261.237	0.637	20	5		CCBDLN
C[C@H](C[N+](=O)[O-])OC(=O)C(C)(C)NC(=O)C(F)(F)F	ZINC000814038438	641053648	/nfs/dbraw/zinc/05/36/48/641053648.db2.gz	CRSOJGNPHHLITK-RXMQYKEDSA-N	0	2	286.206	0.652	20	5		CCBDLN
CONC(=O)CNc1cc(C(=O)OC)ccc1[N+](=O)[O-]	ZINC001164270689	802700486	/nfs/dbraw/zinc/70/04/86/802700486.db2.gz	LQUWCKUGBYPVBU-UHFFFAOYSA-N	0	2	283.240	0.471	20	5		CCBDLN
CSc1nc(OC[C@H]2C[C@H](O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218425913	803955735	/nfs/dbraw/zinc/95/57/35/803955735.db2.gz	VBWKRRKZTVTQCP-IZLXSQMJSA-N	0	2	287.297	0.962	20	5		CCBDLN
CC[C@@H](O)C(=O)Oc1nc(SC)[nH]c(=O)c1[N+](=O)[O-]	ZINC001227625187	805374235	/nfs/dbraw/zinc/37/42/35/805374235.db2.gz	RZHJMODQAOHNPN-SCSAIBSYSA-N	0	2	289.269	0.489	20	5		CCBDLN
Cn1nnc(C(=O)Nc2cc([N+](=O)[O-])c(F)cc2F)n1	ZINC001349543286	924986227	/nfs/dbraw/zinc/98/62/27/924986227.db2.gz	GHFKXSLLYYEASB-UHFFFAOYSA-N	0	2	284.182	0.649	20	5		CCBDLN
O=C(NC[C@H]1C[C@@H](O)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000600511961	361999672	/nfs/dbraw/zinc/99/96/72/361999672.db2.gz	SEMGOKMPRDWHOS-OCAPTIKFSA-N	0	2	266.253	0.801	20	5		CCBDLN
CC(C)(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000125884523	187203642	/nfs/dbraw/zinc/20/36/42/187203642.db2.gz	YTZNRCANLPJNDP-JTQLQIEISA-N	0	2	295.295	0.930	20	5		CCBDLN
O=C(N[C@H]1[C@@H]2COC[C@@H]21)c1ccc([N+](=O)[O-])cc1O	ZINC000436914282	303994554	/nfs/dbraw/zinc/99/45/54/303994554.db2.gz	YKPUQUSURYARFD-JZYVYDRUSA-N	0	2	264.237	0.675	20	5		CCBDLN
C[S@](=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316552	136951518	/nfs/dbraw/zinc/95/15/18/136951518.db2.gz	BBTOALNPKAKXSH-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
Cc1nc(NC(=O)c2cccc(O)c2[N+](=O)[O-])nn1C	ZINC000344535673	137200200	/nfs/dbraw/zinc/20/02/00/137200200.db2.gz	IIJVHXDSSZVASE-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
CN(CC(=O)NC1CC1)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000124902293	350110874	/nfs/dbraw/zinc/11/08/74/350110874.db2.gz	ZCBWZIZHPMLYEB-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
NC(=O)[C@@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000271266672	191037297	/nfs/dbraw/zinc/03/72/97/191037297.db2.gz	KWVMTWUJLGKOFL-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
COC(=O)C[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271281797	191048902	/nfs/dbraw/zinc/04/89/02/191048902.db2.gz	OFMJQXNZMXFDOG-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(NCCCc1nc(=O)[nH][nH]1)c1ccc([N+](=O)[O-])s1	ZINC000176252313	351164919	/nfs/dbraw/zinc/16/49/19/351164919.db2.gz	JOYBEQQBJQBMGS-UHFFFAOYSA-N	0	2	297.296	0.430	20	5		CCBDLN
Cc1nncn1CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182032713	351344980	/nfs/dbraw/zinc/34/49/80/351344980.db2.gz	ONVGCWGTFLITFS-UHFFFAOYSA-N	0	2	291.267	0.630	20	5		CCBDLN
C[C@H]1C(=O)NCCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000188087925	351572710	/nfs/dbraw/zinc/57/27/10/351572710.db2.gz	OCWBQVHIPOVJBP-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)c1nncn1C	ZINC000231361048	352128205	/nfs/dbraw/zinc/12/82/05/352128205.db2.gz	OBXNMZVUXPRBSU-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(NCc1cc[nH]n1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000603893667	363167396	/nfs/dbraw/zinc/16/73/96/363167396.db2.gz	VYKKPQZQDZDESY-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
CC(C)(CNC(=O)c1cccc(O)c1[N+](=O)[O-])OCCO	ZINC000292068809	198152044	/nfs/dbraw/zinc/15/20/44/198152044.db2.gz	KWYOCIWCRWXERR-UHFFFAOYSA-N	0	2	298.295	0.818	20	5		CCBDLN
COC[C@@](C)(CCO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274820442	353164861	/nfs/dbraw/zinc/16/48/61/353164861.db2.gz	QFIBWIMHGAHUQV-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1ncnn1C	ZINC000276963789	353214073	/nfs/dbraw/zinc/21/40/73/353214073.db2.gz	ZPBOKXGLMKDUOK-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(N[C@H]1CCCNC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000295796451	353918544	/nfs/dbraw/zinc/91/85/44/353918544.db2.gz	NDJXFGXWBQCASD-VIFPVBQESA-N	0	2	279.252	0.309	20	5		CCBDLN
O=C(NCCCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cn1	ZINC000531889258	358487541	/nfs/dbraw/zinc/48/75/41/358487541.db2.gz	ZYHYHYKRJYLSKI-UHFFFAOYSA-N	0	2	292.255	0.176	20	5		CCBDLN
O=C(Cc1ccccc1[N+](=O)[O-])N=c1cccn[nH]1	ZINC000346064646	355867448	/nfs/dbraw/zinc/86/74/48/355867448.db2.gz	PDQNZQIDLIGXJL-UHFFFAOYSA-N	0	2	258.237	0.988	20	5		CCBDLN
COCCOC1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000353698672	356276057	/nfs/dbraw/zinc/27/60/57/356276057.db2.gz	OACHTLPIDHSTHI-UHFFFAOYSA-N	0	2	296.279	0.788	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])c[nH]1	ZINC000353931694	356317560	/nfs/dbraw/zinc/31/75/60/356317560.db2.gz	JMSSTCAZDVBBRS-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H]2COC[C@H](C1)O2	ZINC000619781593	366351802	/nfs/dbraw/zinc/35/18/02/366351802.db2.gz	FYMFDWDUBKNKLY-AOOOYVTPSA-N	0	2	294.263	0.540	20	5		CCBDLN
Cc1c(C(=O)Nc2cc([N+](=O)[O-])ccc2O)nnn1C	ZINC000356289616	356741352	/nfs/dbraw/zinc/74/13/52/356741352.db2.gz	DNSOSRNFKZLWNJ-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
Cc1nc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)n[nH]1	ZINC000356578996	356763856	/nfs/dbraw/zinc/76/38/56/356763856.db2.gz	PKLFAUXAZGPOSH-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
Cc1nnc(NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[nH]1	ZINC000356578996	356763858	/nfs/dbraw/zinc/76/38/58/356763858.db2.gz	PKLFAUXAZGPOSH-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
C[C@H]1CC(=O)NCCN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000375802862	357413454	/nfs/dbraw/zinc/41/34/54/357413454.db2.gz	XJUJHGLYXZLCED-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(N[C@H]1C[C@@H](O)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000597408946	361088554	/nfs/dbraw/zinc/08/85/54/361088554.db2.gz	DMVRTICFKNJCPI-WRXNHJIOSA-N	0	2	252.226	0.554	20	5		CCBDLN
CS(=O)(=O)CCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597442013	361096064	/nfs/dbraw/zinc/09/60/64/361096064.db2.gz	JMILHFALFRALQR-UHFFFAOYSA-N	0	2	288.281	0.674	20	5		CCBDLN
CO[C@@H]1COC[C@H]1NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000571213296	291799468	/nfs/dbraw/zinc/79/94/68/291799468.db2.gz	ANCQLCOHRLBFKQ-PSASIEDQSA-N	0	2	282.252	0.444	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCO[C@@H](CO)C1	ZINC000280963257	195047481	/nfs/dbraw/zinc/04/74/81/195047481.db2.gz	JWHJLCWZYCKMDQ-MRVPVSSYSA-N	0	2	282.252	0.134	20	5		CCBDLN
CC(C)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000185576077	388809245	/nfs/dbraw/zinc/80/92/45/388809245.db2.gz	CFROOHDOAXJJHR-SNVBAGLBSA-N	0	2	281.268	0.540	20	5		CCBDLN
Nc1ncncc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354369348	389021305	/nfs/dbraw/zinc/02/13/05/389021305.db2.gz	AVISYHUHLJQOLX-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
C[C@H](Cn1cncn1)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000350015694	389477778	/nfs/dbraw/zinc/47/77/78/389477778.db2.gz	LSBJZWTYRKUEMA-MRVPVSSYSA-N	0	2	291.267	0.710	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ncnn1C	ZINC000276915968	389553912	/nfs/dbraw/zinc/55/39/12/389553912.db2.gz	RWLNHBPVZMQPQT-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
CCN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CCNC1=O	ZINC000282068460	389653941	/nfs/dbraw/zinc/65/39/41/389653941.db2.gz	DJMNEDIWQIOWDS-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
Cc1nnc(CCNC(=O)c2cc(O)ccc2[N+](=O)[O-])[nH]1	ZINC000352278880	389782769	/nfs/dbraw/zinc/78/27/69/389782769.db2.gz	BAKKXQPXACDJOJ-UHFFFAOYSA-N	0	2	291.267	0.699	20	5		CCBDLN
CC(=O)N1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000436972709	389989133	/nfs/dbraw/zinc/98/91/33/389989133.db2.gz	PKLSOBZKEBRTPP-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000035739254	172393629	/nfs/dbraw/zinc/39/36/29/172393629.db2.gz	PRTXACXUANIIBU-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])cc2O)n[nH]1	ZINC000613996602	420495744	/nfs/dbraw/zinc/49/57/44/420495744.db2.gz	BDZKYZWCSATEGY-UHFFFAOYSA-N	0	2	291.223	0.375	20	5		CCBDLN
CC1(O)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000331875209	281598692	/nfs/dbraw/zinc/59/86/92/281598692.db2.gz	BJXUAROBXYDQQU-UHFFFAOYSA-N	0	2	252.226	0.507	20	5		CCBDLN
CN(C)c1n[nH]c(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n1	ZINC000436851634	289430973	/nfs/dbraw/zinc/43/09/73/289430973.db2.gz	FGCOLNADNBEJNZ-UHFFFAOYSA-N	0	2	292.255	0.737	20	5		CCBDLN
NC(=O)[C@@H]1CCCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184643768	303294459	/nfs/dbraw/zinc/29/44/59/303294459.db2.gz	WKSHFFKQNLCSII-JTQLQIEISA-N	0	2	293.279	0.780	20	5		CCBDLN
CC(=O)NCCN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000583502086	328584394	/nfs/dbraw/zinc/58/43/94/328584394.db2.gz	ABGFEGLMDLTHPR-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
C[C@H](CO)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184877738	524529706	/nfs/dbraw/zinc/52/97/06/524529706.db2.gz	PHDLBHGVVJDMTH-ZETCQYMHSA-N	0	2	254.242	0.659	20	5		CCBDLN
CCN1C[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])CC1=O	ZINC000456176654	527949327	/nfs/dbraw/zinc/94/93/27/527949327.db2.gz	YLRUYIZEPPGKGP-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCC[C@@H](O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412534930	529073140	/nfs/dbraw/zinc/07/31/40/529073140.db2.gz	PPNPSXODCWNIHZ-WDEREUQCSA-N	0	2	298.295	0.552	20	5		CCBDLN
C[C@@H]1C[N@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1NC(=O)[O-]	ZINC000739192784	581200466	/nfs/dbraw/zinc/20/04/66/581200466.db2.gz	SMYMLPCQHCSVSZ-SCZZXKLOSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@@H]1C[N@@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@@H]1NC(=O)[O-]	ZINC000739192784	581200469	/nfs/dbraw/zinc/20/04/69/581200469.db2.gz	SMYMLPCQHCSVSZ-SCZZXKLOSA-N	0	2	283.288	0.727	20	5		CCBDLN
CCc1[nH]nc(C(=O)OCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000795611957	581415423	/nfs/dbraw/zinc/41/54/23/581415423.db2.gz	AMTIAEHASUYLFQ-UHFFFAOYSA-N	0	2	282.216	0.061	20	5		CCBDLN
COCCONC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000748859705	581990964	/nfs/dbraw/zinc/99/09/64/581990964.db2.gz	NMWWYMUALLTWGU-UHFFFAOYSA-N	0	2	297.267	0.019	20	5		CCBDLN
CC(C)CC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750758394	582058591	/nfs/dbraw/zinc/05/85/91/582058591.db2.gz	YTHBHDFBMFEPDV-UHFFFAOYSA-N	0	2	287.297	0.841	20	5		CCBDLN
COc1ncnc(N(C)C)c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841145741	642804395	/nfs/dbraw/zinc/80/43/95/642804395.db2.gz	IGCVSAZBFYIQSQ-RNFRBKRXSA-N	0	2	281.272	0.155	20	5		CCBDLN
CCn1nncc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600159641	361880637	/nfs/dbraw/zinc/88/06/37/361880637.db2.gz	XBYZZCAYDMFKFG-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(N[C@H]1COCCC1=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600389260	361939674	/nfs/dbraw/zinc/93/96/74/361939674.db2.gz	JECNXSOHOOCVQY-QMMMGPOBSA-N	0	2	280.236	0.388	20	5		CCBDLN
O=[N+]([O-])c1cnccc1NS(=O)(=O)c1cccnc1	ZINC000347304909	137330000	/nfs/dbraw/zinc/33/00/00/137330000.db2.gz	JBVFPEQERAMTPM-UHFFFAOYSA-N	0	2	280.265	0.608	20	5		CCBDLN
CCCN(CC(=O)NC)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000063783398	348693075	/nfs/dbraw/zinc/69/30/75/348693075.db2.gz	IJJVEFRDLHWJSG-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCNC(=O)CC1	ZINC000068465508	348811192	/nfs/dbraw/zinc/81/11/92/348811192.db2.gz	LQZPSOKGJPMTER-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000117985911	186761723	/nfs/dbraw/zinc/76/17/23/186761723.db2.gz	IICQKKDLWKODCL-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)N(CC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181780614	351337041	/nfs/dbraw/zinc/33/70/41/351337041.db2.gz	RWEOSKRDRCCLFS-UHFFFAOYSA-N	0	2	281.268	0.636	20	5		CCBDLN
O=C(N[C@@H]1CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316004	351945637	/nfs/dbraw/zinc/94/56/37/351945637.db2.gz	RTQHUWZWHAOKRK-SSDOTTSWSA-N	0	2	252.226	0.819	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1cc([O-])ccc1[N+](=O)[O-]	ZINC000236561290	352198258	/nfs/dbraw/zinc/19/82/58/352198258.db2.gz	NZSUCYMKXGSLKW-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
CNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000542791321	290959172	/nfs/dbraw/zinc/95/91/72/290959172.db2.gz	MIJPDGDGDQOFRZ-ZCFIWIBFSA-N	0	2	267.241	0.165	20	5		CCBDLN
O=C(NC[C@H](O)C1CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000269818686	352877647	/nfs/dbraw/zinc/87/76/47/352877647.db2.gz	FSPKAGFYVMNVEF-NSHDSACASA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C1N[C@H](c2ccc(O)c([N+](=O)[O-])c2)N2CCSC[C@H]12	ZINC000270777783	352983615	/nfs/dbraw/zinc/98/36/15/352983615.db2.gz	IPHNTNZBBNNEGL-KOLCDFICSA-N	0	2	295.320	0.846	20	5		CCBDLN
O=C(NC[C@@H](O)C1CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272424716	353062588	/nfs/dbraw/zinc/06/25/88/353062588.db2.gz	QVBBZILBZBNWCK-LLVKDONJSA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC[C@@H]1CO	ZINC000153926587	188112506	/nfs/dbraw/zinc/11/25/06/188112506.db2.gz	ZXQOQQNIEVSPLT-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@@H]1CCN(C)C1=O	ZINC000286223558	353570032	/nfs/dbraw/zinc/57/00/32/353570032.db2.gz	HASWOUUTCYCCJA-SECBINFHSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(NCC1(O)CCC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000332481652	354684206	/nfs/dbraw/zinc/68/42/06/354684206.db2.gz	QCCOTDJSHKRAPF-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
COC[C@@](C)(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000560514876	291106828	/nfs/dbraw/zinc/10/68/28/291106828.db2.gz	FPXBXOYDAAJPBB-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
COCC(COC)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000456223267	236372899	/nfs/dbraw/zinc/37/28/99/236372899.db2.gz	DBWAOXYMKVOAKE-UHFFFAOYSA-N	0	2	284.268	0.692	20	5		CCBDLN
O=C(/C=C\C1CC1)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000492060286	237065647	/nfs/dbraw/zinc/06/56/47/237065647.db2.gz	WBQGLXIPGKFJHI-UTCJRWHESA-N	0	2	297.292	0.761	20	5		CCBDLN
C[C@@H]1[C@H](O)CCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000590881002	359534006	/nfs/dbraw/zinc/53/40/06/359534006.db2.gz	FNGPWQBUTFEZTA-GMSGAONNSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(N[C@@H]1CCNC(=O)CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000591100983	359558816	/nfs/dbraw/zinc/55/88/16/359558816.db2.gz	SERFQBBRILMMJW-QMMMGPOBSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(CN1CCCC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000180763486	189274271	/nfs/dbraw/zinc/27/42/71/189274271.db2.gz	RJLHZOYBTUFOCG-UHFFFAOYSA-N	0	2	279.252	0.861	20	5		CCBDLN
C[C@@H](O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000598386039	361401387	/nfs/dbraw/zinc/40/13/87/361401387.db2.gz	ZVNZTZSVGQZMMO-SSDOTTSWSA-N	0	2	266.253	0.944	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC(=O)N(C2CC2)C1	ZINC000279448946	194437560	/nfs/dbraw/zinc/43/75/60/194437560.db2.gz	FAKODLXQVNEQHI-UHFFFAOYSA-N	0	2	291.263	0.705	20	5		CCBDLN
CNC(=O)CCN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184745052	388778215	/nfs/dbraw/zinc/77/82/15/388778215.db2.gz	OSOMQRXDPXCHHM-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
O=C(N[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1O	ZINC000185112806	388786488	/nfs/dbraw/zinc/78/64/88/388786488.db2.gz	GGLNSDAHKJFNQL-NXEZZACHSA-N	0	2	266.253	0.944	20	5		CCBDLN
O=C(N[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000298462665	389022143	/nfs/dbraw/zinc/02/21/43/389022143.db2.gz	QSIOXDKINOMPMK-WRXNHJIOSA-N	0	2	252.226	0.554	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1COC[C@H]1O	ZINC000342367488	389216862	/nfs/dbraw/zinc/21/68/62/389216862.db2.gz	DLPAZRKRDXCKQE-GXSJLCMTSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000181881333	389695721	/nfs/dbraw/zinc/69/57/21/389695721.db2.gz	WXQKBCSWFNVYOY-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
Cc1n[nH]c(C(=O)N(C)C[C@@H](C)c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000352465197	389815018	/nfs/dbraw/zinc/81/50/18/389815018.db2.gz	FPBDECQBHPXURN-RXMQYKEDSA-N	0	2	294.275	0.015	20	5		CCBDLN
Cc1[nH]nc(C(=O)N(C)C[C@@H](C)c2nn[nH]n2)c1[N+](=O)[O-]	ZINC000352465197	389815022	/nfs/dbraw/zinc/81/50/22/389815022.db2.gz	FPBDECQBHPXURN-RXMQYKEDSA-N	0	2	294.275	0.015	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCn2ncnc2C1	ZINC000436929363	389987135	/nfs/dbraw/zinc/98/71/35/389987135.db2.gz	VETLMSJIVQDABJ-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
C[C@@H]1CO[C@H](CO)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436972815	389989070	/nfs/dbraw/zinc/98/90/70/389989070.db2.gz	PTFRKAJRTGPTJP-SCZZXKLOSA-N	0	2	296.279	0.522	20	5		CCBDLN
Cn1ccnc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436987869	389989474	/nfs/dbraw/zinc/98/94/74/389989474.db2.gz	KJYPISQDWKHYGP-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
COC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000496798973	390366265	/nfs/dbraw/zinc/36/62/65/390366265.db2.gz	XKRNIDTXZYSIAE-UHFFFAOYSA-N	0	2	283.240	0.386	20	5		CCBDLN
CCN(C)C(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000191567318	130256188	/nfs/dbraw/zinc/25/61/88/130256188.db2.gz	WUGTVDUSYVPCDF-MRVPVSSYSA-N	0	2	295.295	0.897	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000195151683	296572825	/nfs/dbraw/zinc/57/28/25/296572825.db2.gz	FXHACFMCOVCHIU-RDDDGLTNSA-N	0	2	293.279	0.555	20	5		CCBDLN
CC(=O)N1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC1	ZINC000280748465	278039488	/nfs/dbraw/zinc/03/94/88/278039488.db2.gz	KREAZLRXJZESFE-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)O1	ZINC000288422141	297282344	/nfs/dbraw/zinc/28/23/44/297282344.db2.gz	CRWKYIDLAPTMFS-HZGVNTEJSA-N	0	2	280.236	0.734	20	5		CCBDLN
Cn1ncnc1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000182144947	303099560	/nfs/dbraw/zinc/09/95/60/303099560.db2.gz	SQJIQWPTFIRHNP-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000184813564	519498434	/nfs/dbraw/zinc/49/84/34/519498434.db2.gz	OLERMVQZJQYODS-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
COc1ccc(C(=O)OCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000774891007	582001067	/nfs/dbraw/zinc/00/10/67/582001067.db2.gz	VJNQDRIZXCQOQH-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
O=c1c(-c2nn[nH]n2)cccn1Cc1ccc([N+](=O)[O-])cc1	ZINC000738372048	582040574	/nfs/dbraw/zinc/04/05/74/582040574.db2.gz	MXEQNHSBXWGWDA-UHFFFAOYSA-N	0	2	298.262	0.985	20	5		CCBDLN
Nc1ccc(NCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000804539751	640770845	/nfs/dbraw/zinc/77/08/45/640770845.db2.gz	LPXIWPDEEVNTFH-UHFFFAOYSA-N	0	2	250.218	0.613	20	5		CCBDLN
C[C@@H](COC(=O)C(C)(C)NC(=O)C(F)(F)F)[N+](=O)[O-]	ZINC000813103044	641022794	/nfs/dbraw/zinc/02/27/94/641022794.db2.gz	MDUUNWQHMZFOFR-YFKPBYRVSA-N	0	2	286.206	0.652	20	5		CCBDLN
COc1c(C(=O)NN2CCOC2=O)cccc1[N+](=O)[O-]	ZINC000862703752	645027730	/nfs/dbraw/zinc/02/77/30/645027730.db2.gz	SUXPSZBOHHKIMF-UHFFFAOYSA-N	0	2	281.224	0.700	20	5		CCBDLN
Nc1ccc(NS(=O)(=O)c2cn[nH]c2)cc1[N+](=O)[O-]	ZINC000194019972	649566642	/nfs/dbraw/zinc/56/66/42/649566642.db2.gz	MPTUANMEQDIPPH-UHFFFAOYSA-N	0	2	283.269	0.701	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@]1(O)CCOC1	ZINC001295970283	906830001	/nfs/dbraw/zinc/83/00/01/906830001.db2.gz	BJSMXNXYAICRQQ-LLVKDONJSA-N	0	2	268.225	0.390	20	5		CCBDLN
O=C(N[C@@H]1COCCC1=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600390057	361939603	/nfs/dbraw/zinc/93/96/03/361939603.db2.gz	MHRLXOBSYUSEET-SECBINFHSA-N	0	2	280.236	0.388	20	5		CCBDLN
O=C(NCCN1CCCC1=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000405875175	290767242	/nfs/dbraw/zinc/76/72/42/290767242.db2.gz	VNICJJNIMVFMKL-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N(CCO)C1CC1	ZINC000128342351	187364601	/nfs/dbraw/zinc/36/46/01/187364601.db2.gz	ZMUVKSXUOWGCBA-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=c1nc(Cn2cnc([N+](=O)[O-])n2)[nH]c2ccsc21	ZINC000048603072	348417990	/nfs/dbraw/zinc/41/79/90/348417990.db2.gz	ZKRFBQVIEPDMDL-UHFFFAOYSA-N	0	2	278.253	0.945	20	5		CCBDLN
CCN(C)C(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000187283465	351537274	/nfs/dbraw/zinc/53/72/74/351537274.db2.gz	FKPOJYFRKJFYGH-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CCN(C)C(=O)[C@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316874	351947162	/nfs/dbraw/zinc/94/71/62/351947162.db2.gz	INLFNJDZSNYNEP-QMMMGPOBSA-N	0	2	295.295	0.897	20	5		CCBDLN
O=C(NCCn1cccn1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236561270	352198074	/nfs/dbraw/zinc/19/80/74/352198074.db2.gz	LSVABBPRIAJEQH-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
Cn1nccc1CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000236084165	352190945	/nfs/dbraw/zinc/19/09/45/352190945.db2.gz	WAKGBRCVGFACLJ-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CCCC(=O)N1	ZINC000271490218	191168871	/nfs/dbraw/zinc/16/88/71/191168871.db2.gz	KFNJHHHTYLPPTC-MRVPVSSYSA-N	0	2	279.252	0.908	20	5		CCBDLN
O=C(NC[C@]1(O)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000272392947	353059233	/nfs/dbraw/zinc/05/92/33/353059233.db2.gz	LSXQMILDSROSGU-GFCCVEGCSA-N	0	2	282.252	0.182	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC(O)CC1	ZINC000154070061	188121959	/nfs/dbraw/zinc/12/19/59/188121959.db2.gz	OESXWWYXGVMVMN-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC(O)(C(F)F)C1	ZINC000425021485	235251938	/nfs/dbraw/zinc/25/19/38/235251938.db2.gz	UFAGMLSDCXKICG-UHFFFAOYSA-N	0	2	288.206	0.752	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@](F)(CO)C1	ZINC000355860410	356661493	/nfs/dbraw/zinc/66/14/93/356661493.db2.gz	RCHJGBILDVMSPF-GFCCVEGCSA-N	0	2	284.243	0.847	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000436887765	235709883	/nfs/dbraw/zinc/70/98/83/235709883.db2.gz	PMHHMXUHWHXGEG-PELKAZGASA-N	0	2	296.279	0.428	20	5		CCBDLN
C[C@@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000408410291	358078919	/nfs/dbraw/zinc/07/89/19/358078919.db2.gz	NGFZOKSIONUVSO-VXNVDRBHSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=[N+]([O-])c1cc(Cl)cnc1Nc1ccn(CCO)n1	ZINC000532934556	358520078	/nfs/dbraw/zinc/52/00/78/358520078.db2.gz	DWDAYNPPAJCPQB-UHFFFAOYSA-N	0	2	283.675	0.998	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CCO1	ZINC000590335731	359441414	/nfs/dbraw/zinc/44/14/14/359441414.db2.gz	YFDKHZBSZOIFIN-LLVKDONJSA-N	0	2	282.252	0.745	20	5		CCBDLN
C[C@@H]1[C@H](O)CCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000590881568	359534562	/nfs/dbraw/zinc/53/45/62/359534562.db2.gz	NASOGDITJZPRDD-GMSGAONNSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(NCC[C@]1(O)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000593812013	360163866	/nfs/dbraw/zinc/16/38/66/360163866.db2.gz	GOIATQPTKZNMGY-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
CO[C@](C)(CO)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000594382529	360288672	/nfs/dbraw/zinc/28/86/72/360288672.db2.gz	XFBLCLILVNNTQN-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
CO[C@@](C)(CO)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000594398801	360292315	/nfs/dbraw/zinc/29/23/15/360292315.db2.gz	QKDSURCOOTXQCZ-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1cc(NCc2n[nH]c(=O)[nH]2)ncc1[N+](=O)[O-]	ZINC000301617135	201098261	/nfs/dbraw/zinc/09/82/61/201098261.db2.gz	KGYUYITVBHVEKP-UHFFFAOYSA-N	0	2	250.218	0.322	20	5		CCBDLN
CC(=O)N1CC[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000598906578	361529468	/nfs/dbraw/zinc/52/94/68/361529468.db2.gz	QDWHAUQKMSMCFV-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)O1	ZINC000279734132	194547384	/nfs/dbraw/zinc/54/73/84/194547384.db2.gz	AAYIGTVWIBIDHO-VHSXEESVSA-N	0	2	295.251	0.272	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@@H]1COC[C@H]1O	ZINC000288364854	197059195	/nfs/dbraw/zinc/05/91/95/197059195.db2.gz	KUPRAPAUCLSPKD-PSASIEDQSA-N	0	2	282.252	0.132	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@H]1O	ZINC000396067117	285230611	/nfs/dbraw/zinc/23/06/11/285230611.db2.gz	SIZHTTWFKVPFMA-GHMZBOCLSA-N	0	2	282.252	0.132	20	5		CCBDLN
CC(=O)NCCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000350617233	389521141	/nfs/dbraw/zinc/52/11/41/389521141.db2.gz	BJPIUOHKVCXQJE-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
O=C(NCCc1[nH]cc[nH+]1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000178338537	389603162	/nfs/dbraw/zinc/60/31/62/389603162.db2.gz	OASPICJQDGGYQJ-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
O=C(N[C@@H]1CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000182151992	389702158	/nfs/dbraw/zinc/70/21/58/389702158.db2.gz	DSJRTQOQWFPDHL-SSDOTTSWSA-N	0	2	252.226	0.819	20	5		CCBDLN
CCN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000391558016	389773338	/nfs/dbraw/zinc/77/33/38/389773338.db2.gz	DRZLKUJVTMCHJM-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
Cn1cnc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)n1	ZINC000436707564	389983669	/nfs/dbraw/zinc/98/36/69/389983669.db2.gz	VDGGQQCBDOVUJB-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCc2n[nH]nc2C1	ZINC000436833109	389985105	/nfs/dbraw/zinc/98/51/05/389985105.db2.gz	LDRAVLKBXDJRTE-UHFFFAOYSA-N	0	2	289.251	0.617	20	5		CCBDLN
O=c1[nH]nc(Cn2cc([N+](=O)[O-])c(=O)c3ccccc32)[nH]1	ZINC000487900146	390090321	/nfs/dbraw/zinc/09/03/21/390090321.db2.gz	SAYNTYIERDGWDQ-UHFFFAOYSA-N	0	2	287.235	0.782	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CN1C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000592903397	390365136	/nfs/dbraw/zinc/36/51/36/390365136.db2.gz	WKYPZJZLTBFDDL-SSDOTTSWSA-N	0	2	279.252	0.561	20	5		CCBDLN
CC(CO)(CO)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000578076580	390862928	/nfs/dbraw/zinc/86/29/28/390862928.db2.gz	PXTBOUNROXWQDF-UHFFFAOYSA-N	0	2	284.268	0.021	20	5		CCBDLN
COc1ccc([N+](=O)[O-])c(C(=O)NCc2n[nH]c(=O)[nH]2)c1	ZINC000358954974	144188499	/nfs/dbraw/zinc/18/84/99/144188499.db2.gz	PCKNPWDPTSTZOD-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000195151705	296575307	/nfs/dbraw/zinc/57/53/07/296575307.db2.gz	FXHACFMCOVCHIU-HQJQHLMTSA-N	0	2	293.279	0.555	20	5		CCBDLN
O=c1nc(CCCNc2ncc([N+](=O)[O-])s2)[nH][nH]1	ZINC000192472846	262204163	/nfs/dbraw/zinc/20/41/63/262204163.db2.gz	IPELRIAORIISRU-UHFFFAOYSA-N	0	2	270.274	0.507	20	5		CCBDLN
CN1C[C@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])CCC1=O	ZINC000283049059	290309081	/nfs/dbraw/zinc/30/90/81/290309081.db2.gz	LWRZFNPWTVWQAZ-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@@H]1O	ZINC000354379249	300188403	/nfs/dbraw/zinc/18/84/03/300188403.db2.gz	GXGMMBVCDUZKEI-CPCISQLKSA-N	0	2	266.253	0.753	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@H](O)C2(CC2)C1	ZINC000518692113	304551048	/nfs/dbraw/zinc/55/10/48/304551048.db2.gz	VSQHZJSDTSKVNY-JTQLQIEISA-N	0	2	278.264	0.897	20	5		CCBDLN
CN1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000217315793	326867510	/nfs/dbraw/zinc/86/75/10/326867510.db2.gz	LWLOSMWKDAUPFO-UHFFFAOYSA-N	0	2	279.252	0.215	20	5		CCBDLN
O=C([O-])[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000576405614	335199934	/nfs/dbraw/zinc/19/99/34/335199934.db2.gz	QNFVWTFXSAXWNW-GFCCVEGCSA-N	0	2	296.279	0.759	20	5		CCBDLN
O=C([O-])[C@H]1C[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CCO1	ZINC000576405614	335199936	/nfs/dbraw/zinc/19/99/36/335199936.db2.gz	QNFVWTFXSAXWNW-GFCCVEGCSA-N	0	2	296.279	0.759	20	5		CCBDLN
CC[S@@](=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779663388	581198133	/nfs/dbraw/zinc/19/81/33/581198133.db2.gz	FPWXJIVPJCJPOR-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
CCONC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000790925790	581202424	/nfs/dbraw/zinc/20/24/24/581202424.db2.gz	FCSVKYODVVZHRI-UHFFFAOYSA-N	0	2	299.308	0.854	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)NN2CC(=O)NC2=O)c1	ZINC000743288742	581807129	/nfs/dbraw/zinc/80/71/29/581807129.db2.gz	YOJXFQDSIWJGAF-UHFFFAOYSA-N	0	2	278.224	0.100	20	5		CCBDLN
CC(C)=CC(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750757509	582058627	/nfs/dbraw/zinc/05/86/27/582058627.db2.gz	PMQLJGBNPFMVNJ-UHFFFAOYSA-N	0	2	285.281	0.761	20	5		CCBDLN
O=C(NCCC1N=NC(=S)O1)c1ccc([N+](=O)[O-])o1	ZINC000776541794	582076794	/nfs/dbraw/zinc/07/67/94/582076794.db2.gz	LDUFGSCGXNFUOT-UHFFFAOYSA-N	0	2	284.253	0.832	20	5		CCBDLN
O=C(NCCc1n[nH]c(=S)o1)c1ccc([N+](=O)[O-])o1	ZINC000776541794	582076796	/nfs/dbraw/zinc/07/67/96/582076796.db2.gz	LDUFGSCGXNFUOT-UHFFFAOYSA-N	0	2	284.253	0.832	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000821513395	598194339	/nfs/dbraw/zinc/19/43/39/598194339.db2.gz	VLFAOBZUPBLZQS-RYUDHWBXSA-N	0	2	296.279	0.414	20	5		CCBDLN
O=C([O-])[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCO1	ZINC000821513395	598194340	/nfs/dbraw/zinc/19/43/40/598194340.db2.gz	VLFAOBZUPBLZQS-RYUDHWBXSA-N	0	2	296.279	0.414	20	5		CCBDLN
C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])cn2)CCN1C(=O)[O-]	ZINC000826058455	603996087	/nfs/dbraw/zinc/99/60/87/603996087.db2.gz	ODOPIJUPOJKPGC-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])cn2)CCN1C(=O)[O-]	ZINC000826058455	603996089	/nfs/dbraw/zinc/99/60/89/603996089.db2.gz	ODOPIJUPOJKPGC-SECBINFHSA-N	0	2	283.288	0.475	20	5		CCBDLN
O=C([O-])NCC[NH+]1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000832642190	604358642	/nfs/dbraw/zinc/35/86/42/604358642.db2.gz	VGKCTANSIFYULE-UHFFFAOYSA-N	0	2	295.299	0.379	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@@H](CN(C)C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920375	605750710	/nfs/dbraw/zinc/75/07/10/605750710.db2.gz	IDWLEGFKDMEWMM-JTQLQIEISA-N	0	2	297.315	0.989	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@@H](CN(C)C(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920375	605750713	/nfs/dbraw/zinc/75/07/13/605750713.db2.gz	IDWLEGFKDMEWMM-JTQLQIEISA-N	0	2	297.315	0.989	20	5		CCBDLN
CCN(OC)C(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000844064514	615074888	/nfs/dbraw/zinc/07/48/88/615074888.db2.gz	XMKIWVCXXACYQN-UHFFFAOYSA-N	0	2	297.267	0.440	20	5		CCBDLN
CCOC(=O)c1ncc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000841154651	615194706	/nfs/dbraw/zinc/19/47/06/615194706.db2.gz	CUIKUWDCCOLFPY-PHDIDXHHSA-N	0	2	285.281	0.924	20	5		CCBDLN
CN(C)Cc1csc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839793985	615959863	/nfs/dbraw/zinc/95/98/63/615959863.db2.gz	RUYHOHPJVIOBIF-HTQZYQBOSA-N	0	2	270.314	0.808	20	5		CCBDLN
C[N@H+](CC(=O)[O-])[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000130153871	616050003	/nfs/dbraw/zinc/05/00/03/616050003.db2.gz	JFOQLDZHCYOTQD-NSHDSACASA-N	0	2	293.279	0.717	20	5		CCBDLN
C[N@@H+](CC(=O)[O-])[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000130153871	616050004	/nfs/dbraw/zinc/05/00/04/616050004.db2.gz	JFOQLDZHCYOTQD-NSHDSACASA-N	0	2	293.279	0.717	20	5		CCBDLN
CNC(=O)c1cccc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000928690500	616919144	/nfs/dbraw/zinc/91/91/44/616919144.db2.gz	RRCKUQLNJKTGKA-GHMZBOCLSA-N	0	2	277.280	0.674	20	5		CCBDLN
O=C(Nc1ccc(N2CCCC2=O)cn1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839711132	640356281	/nfs/dbraw/zinc/35/62/81/640356281.db2.gz	YPTSZKVZHQYVJQ-NXEZZACHSA-N	0	2	290.279	0.812	20	5		CCBDLN
O=C(Nc1cncnc1N1CCCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840396467	641428008	/nfs/dbraw/zinc/42/80/08/641428008.db2.gz	PSLSIPLIUWGFBB-PSASIEDQSA-N	0	2	277.284	0.681	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@@H](CO)c2ccccc21	ZINC000840462436	641581660	/nfs/dbraw/zinc/58/16/60/641581660.db2.gz	BCAFWULZJIZKHI-MKPLZMMCSA-N	0	2	262.265	0.774	20	5		CCBDLN
O=C(Nc1nc2cc(Cl)ccn2n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841236712	642807985	/nfs/dbraw/zinc/80/79/85/642807985.db2.gz	IATUKBQNBRNBCY-RNFRBKRXSA-N	0	2	281.659	0.986	20	5		CCBDLN
Cn1c(=O)c2ccccc2n1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000875945306	646564261	/nfs/dbraw/zinc/56/42/61/646564261.db2.gz	XWOYLSJDYRTOTI-PSASIEDQSA-N	0	2	261.237	0.645	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)C1=CCS(=O)(=O)C1	ZINC001138013003	799698258	/nfs/dbraw/zinc/69/82/58/799698258.db2.gz	AQTBYMBGFBFPJF-UHFFFAOYSA-N	0	2	298.276	0.594	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)NN2CC(=O)NC2=O)c1C	ZINC001160530396	801963377	/nfs/dbraw/zinc/96/33/77/801963377.db2.gz	PTHJSQZNEJITTC-UHFFFAOYSA-N	0	2	292.251	0.408	20	5		CCBDLN
CN1CCO[C@@H](COc2cc(O)cc(O)c2[N+](=O)[O-])C1=O	ZINC001228973803	805494009	/nfs/dbraw/zinc/49/40/09/805494009.db2.gz	MKEOIGOIVVHQIS-JTQLQIEISA-N	0	2	298.251	0.242	20	5		CCBDLN
COC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc1	ZINC001117954985	856118061	/nfs/dbraw/zinc/11/80/61/856118061.db2.gz	IOWKWKACTZJBFT-HTQZYQBOSA-N	0	2	265.225	0.472	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCNC1=O	ZINC001295971185	906828874	/nfs/dbraw/zinc/82/88/74/906828874.db2.gz	UZFJMRXTUBBMPX-MRVPVSSYSA-N	0	2	279.252	0.765	20	5		CCBDLN
O=C(N[C@H]1COCCC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000600392028	361941944	/nfs/dbraw/zinc/94/19/44/361941944.db2.gz	POEGWAFTURIRSG-VIFPVBQESA-N	0	2	280.236	0.388	20	5		CCBDLN
O=C(N[C@H]1C=C[C@H](CO)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000343833266	137160290	/nfs/dbraw/zinc/16/02/90/137160290.db2.gz	FEMFOXRIMRFJLC-IUCAKERBSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=c1[nH]nc(CNc2ncnc3cccc([N+](=O)[O-])c32)[nH]1	ZINC000347411529	137335334	/nfs/dbraw/zinc/33/53/34/137335334.db2.gz	IOSHXNWOVVSGGP-UHFFFAOYSA-N	0	2	287.239	0.396	20	5		CCBDLN
O=C(CCc1cccc([N+](=O)[O-])c1)NCc1n[nH]c(=O)[nH]1	ZINC000126965470	350158407	/nfs/dbraw/zinc/15/84/07/350158407.db2.gz	AVBPRPZKXXQZCF-UHFFFAOYSA-N	0	2	291.267	0.255	20	5		CCBDLN
O=c1[nH]nc(CCCNc2ncc([N+](=O)[O-])cc2F)[nH]1	ZINC000413161899	233364089	/nfs/dbraw/zinc/36/40/89/233364089.db2.gz	CBAKJCJFXHNJAY-UHFFFAOYSA-N	0	2	282.235	0.997	20	5		CCBDLN
CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000107355664	186171152	/nfs/dbraw/zinc/17/11/52/186171152.db2.gz	OYPRZZQFYZZFKE-JTQLQIEISA-N	0	2	281.268	0.540	20	5		CCBDLN
CC[C@@H]1C(=O)NCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181988803	351342892	/nfs/dbraw/zinc/34/28/92/351342892.db2.gz	PVHDBXHNROLSGR-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@@]1(O)CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000182079710	351346080	/nfs/dbraw/zinc/34/60/80/351346080.db2.gz	SEFUUXHPRWFWEX-GFCCVEGCSA-N	0	2	266.253	0.897	20	5		CCBDLN
CNC(=O)C1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000186194807	351482552	/nfs/dbraw/zinc/48/25/52/351482552.db2.gz	ZFDNDEJGOADYDS-UHFFFAOYSA-N	0	2	279.252	0.118	20	5		CCBDLN
Cn1ccc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000217316230	351945687	/nfs/dbraw/zinc/94/56/87/351945687.db2.gz	MTTKMNJTTJTRLR-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CCC1=O	ZINC000217315791	351946235	/nfs/dbraw/zinc/94/62/35/351946235.db2.gz	BKELBCVLBYHYRT-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
Cn1ccc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000231621965	352130805	/nfs/dbraw/zinc/13/08/05/352130805.db2.gz	RYZBQBWJEXDMHU-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
COC[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCO1	ZINC000266826719	352723705	/nfs/dbraw/zinc/72/37/05/352723705.db2.gz	YGHSKINUUZYOCZ-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(NN1CCCNC1=O)c1ccccc1[N+](=O)[O-]	ZINC000272564637	353074446	/nfs/dbraw/zinc/07/44/46/353074446.db2.gz	KACANFQFSXQYJA-UHFFFAOYSA-N	0	2	264.241	0.655	20	5		CCBDLN
COC[C@H](O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274829948	353165649	/nfs/dbraw/zinc/16/56/49/353165649.db2.gz	RSKKPLWAXAVXDG-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
NC(=O)[C@H]1CC[C@H](C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)O1	ZINC000279734128	353313025	/nfs/dbraw/zinc/31/30/25/353313025.db2.gz	AAYIGTVWIBIDHO-NXEZZACHSA-N	0	2	295.251	0.272	20	5		CCBDLN
CN(CCC(N)=O)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000286154709	353566062	/nfs/dbraw/zinc/56/60/62/353566062.db2.gz	GENCPAITWUIKQF-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
CN(CCC(N)=O)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000286216290	353570048	/nfs/dbraw/zinc/57/00/48/353570048.db2.gz	MQQFRNJOFOHMEC-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCS(=O)CC1	ZINC000330692113	354426157	/nfs/dbraw/zinc/42/61/57/354426157.db2.gz	RMFXUEWNYHEXQY-UHFFFAOYSA-N	0	2	284.293	0.505	20	5		CCBDLN
CSc1n[nH]c(NC(=O)c2n[nH]c(C)c2[N+](=O)[O-])n1	ZINC000340265195	355540867	/nfs/dbraw/zinc/54/08/67/355540867.db2.gz	DCAOUOLRMZLKOL-UHFFFAOYSA-N	0	2	283.273	0.719	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(NCCc2nc(N)no2)n1	ZINC000360884244	138015247	/nfs/dbraw/zinc/01/52/47/138015247.db2.gz	RCDGJYODLZPMQM-UHFFFAOYSA-N	0	2	264.245	0.748	20	5		CCBDLN
O=C(NC[C@H]1CC[C@@H](CO)O1)c1cc([N+](=O)[O-])ccc1O	ZINC000294380828	199018328	/nfs/dbraw/zinc/01/83/28/199018328.db2.gz	CWSOJFQMZQRXKI-ZJUUUORDSA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)[C@H](C)CN(C)c1ncc([N+](=O)[O-])c(C)n1	ZINC000297546523	200224140	/nfs/dbraw/zinc/22/41/40/200224140.db2.gz	QKZYTAQYXQKPHH-SSDOTTSWSA-N	0	2	268.273	0.939	20	5		CCBDLN
CO[C@@H]1COC[C@H]1NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000563197396	291204501	/nfs/dbraw/zinc/20/45/01/291204501.db2.gz	JOAOOVCNCSUEQB-LDYMZIIASA-N	0	2	282.252	0.444	20	5		CCBDLN
NC(=O)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000593816515	360166889	/nfs/dbraw/zinc/16/68/89/360166889.db2.gz	SOVOBPQGWZZVKY-OCAPTIKFSA-N	0	2	279.252	0.294	20	5		CCBDLN
O=C(N[C@@H](CO)CCF)c1cc([N+](=O)[O-])ccc1O	ZINC000593861073	360179822	/nfs/dbraw/zinc/17/98/22/360179822.db2.gz	PFMZLZWOBQUEGW-SSDOTTSWSA-N	0	2	272.232	0.751	20	5		CCBDLN
Cn1ncnc1C(=O)NCCc1ccccc1[N+](=O)[O-]	ZINC000596428473	360891975	/nfs/dbraw/zinc/89/19/75/360891975.db2.gz	HSWHYMCUQHNTDZ-UHFFFAOYSA-N	0	2	275.268	0.696	20	5		CCBDLN
COC(=O)[C@H]1C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000598515004	361432522	/nfs/dbraw/zinc/43/25/22/361432522.db2.gz	IEVKAMQKTGLIIA-ZKCHVHJHSA-N	0	2	294.263	0.982	20	5		CCBDLN
COC[C@@](C)(CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000614044052	364472892	/nfs/dbraw/zinc/47/28/92/364472892.db2.gz	XODBUVLGPHLQKW-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
COC1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000331962423	204339290	/nfs/dbraw/zinc/33/92/90/204339290.db2.gz	LZCFKDGKQJCGKW-UHFFFAOYSA-N	0	2	252.226	0.771	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@H](CO)C1	ZINC000185625011	388811426	/nfs/dbraw/zinc/81/14/26/388811426.db2.gz	HQOGLLICWGWIIO-MRVPVSSYSA-N	0	2	266.253	0.755	20	5		CCBDLN
Cc1noc(CCNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000184716978	388777683	/nfs/dbraw/zinc/77/76/83/388777683.db2.gz	GJCMDNBYWWDLOW-UHFFFAOYSA-N	0	2	292.251	0.964	20	5		CCBDLN
CCCNC(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000025391604	388814690	/nfs/dbraw/zinc/81/46/90/388814690.db2.gz	YMZJWIWTYGFLAA-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
CC(C)NC(=O)CN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000073067610	388974222	/nfs/dbraw/zinc/97/42/22/388974222.db2.gz	YJFFDLXZCSEDKI-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
O=C(N[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000178955421	389630553	/nfs/dbraw/zinc/63/05/53/389630553.db2.gz	YLIQOVXTOLHVSV-MRVPVSSYSA-N	0	2	252.226	0.819	20	5		CCBDLN
NC(=O)c1ccc(NCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000392462398	389774310	/nfs/dbraw/zinc/77/43/10/389774310.db2.gz	MTZYDPHIBKGWGE-UHFFFAOYSA-N	0	2	278.228	0.130	20	5		CCBDLN
C[C@@H](CC(N)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436969827	389988341	/nfs/dbraw/zinc/98/83/41/389988341.db2.gz	ARSOOGMZXYQWQA-LURJTMIESA-N	0	2	267.241	0.294	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000456900012	390020607	/nfs/dbraw/zinc/02/06/07/390020607.db2.gz	FFKZIEXSONWQBH-SFYZADRCSA-N	0	2	293.279	0.684	20	5		CCBDLN
COc1n[nH]c(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000552139184	286154926	/nfs/dbraw/zinc/15/49/26/286154926.db2.gz	YXNAFWQWIXANPX-UHFFFAOYSA-N	0	2	279.212	0.679	20	5		CCBDLN
NC(=O)OCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000228878899	269748316	/nfs/dbraw/zinc/74/83/16/269748316.db2.gz	DBMSNOFIXNVHLQ-UHFFFAOYSA-N	0	2	269.213	0.126	20	5		CCBDLN
Cc1nn(C)c(Sc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000192749820	227277964	/nfs/dbraw/zinc/27/79/64/227277964.db2.gz	KMEQMJKFETYVAN-UHFFFAOYSA-N	0	2	256.247	0.612	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1CCNC1=O	ZINC000340708230	523937983	/nfs/dbraw/zinc/93/79/83/523937983.db2.gz	HDVDYYDRUZRFEX-VIFPVBQESA-N	0	2	279.252	0.261	20	5		CCBDLN
Cc1cccc(C(=O)NN2CN=NC2=O)c1[N+](=O)[O-]	ZINC000777767448	581132958	/nfs/dbraw/zinc/13/29/58/581132958.db2.gz	JFCFRUSYFLUYJJ-UHFFFAOYSA-N	0	2	263.213	0.584	20	5		CCBDLN
O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)OCC1CC1	ZINC000770485084	581747092	/nfs/dbraw/zinc/74/70/92/581747092.db2.gz	IHMFDWJYJMLAIE-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
CONC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000748220292	581966343	/nfs/dbraw/zinc/96/63/43/581966343.db2.gz	ZUQWPSMXIAYFBP-UHFFFAOYSA-N	0	2	282.256	0.072	20	5		CCBDLN
COc1ccc(N(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc1	ZINC000841183397	617266888	/nfs/dbraw/zinc/26/68/88/617266888.db2.gz	RZSVWYHCPSPCLU-RKDXNWHRSA-N	0	2	251.242	0.718	20	5		CCBDLN
O=C(Nc1ncnn1-c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841141710	642804158	/nfs/dbraw/zinc/80/41/58/642804158.db2.gz	IDBHGZPNRGUZJO-NXEZZACHSA-N	0	2	273.252	0.293	20	5		CCBDLN
CONC(=O)CNc1c(Cl)cncc1[N+](=O)[O-]	ZINC001187782322	844775486	/nfs/dbraw/zinc/77/54/86/844775486.db2.gz	DKZCJCFBSSVRIT-UHFFFAOYSA-N	0	2	260.637	0.155	20	5		CCBDLN
C[C@@](CO)([NH2+]Cc1cc(O)ccc1[N+](=O)[O-])C(=O)[O-]	ZINC001592750685	979314144	/nfs/dbraw/zinc/31/41/44/979314144.db2.gz	NRLWYBMNVUZRHI-NSHDSACASA-N	0	2	270.241	0.226	20	5		CCBDLN
CN1CCC[C@@H](NC(=O)c2cccc(O)c2[N+](=O)[O-])C1=O	ZINC000600269509	361911168	/nfs/dbraw/zinc/91/11/68/361911168.db2.gz	WPWQEQXHPJQEMV-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@H]1C[C@@H](C(N)=O)C1	ZINC000600577979	362011588	/nfs/dbraw/zinc/01/15/88/362011588.db2.gz	AHKMSHJHMIIFFQ-OCAPTIKFSA-N	0	2	293.279	0.636	20	5		CCBDLN
COC(=O)C[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000312812626	137077944	/nfs/dbraw/zinc/07/79/44/137077944.db2.gz	RZAZKYYYFBQMPA-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=c1[nH]nc(CN2CCc3c(cccc3[N+](=O)[O-])C2)[nH]1	ZINC000089267227	349381565	/nfs/dbraw/zinc/38/15/65/349381565.db2.gz	ABSQXXYOCGWLAH-UHFFFAOYSA-N	0	2	275.268	0.565	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC(O)CC1	ZINC000271271003	191041657	/nfs/dbraw/zinc/04/16/57/191041657.db2.gz	LUFAWJOVEMMDDZ-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Cc1noc(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000104859335	186028243	/nfs/dbraw/zinc/02/82/43/186028243.db2.gz	FRNBUPUCRPQOEN-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)c1ccc(=O)[nH]n1	ZINC000170565696	350845826	/nfs/dbraw/zinc/84/58/26/350845826.db2.gz	VJECWSIFTOFUJJ-UHFFFAOYSA-N	0	2	276.208	0.636	20	5		CCBDLN
O=C(Cn1cncn1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000221013565	351975391	/nfs/dbraw/zinc/97/53/91/351975391.db2.gz	YXIHJBXQAMVIBC-UHFFFAOYSA-N	0	2	263.213	0.531	20	5		CCBDLN
NC(=O)[C@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000221193734	351977249	/nfs/dbraw/zinc/97/72/49/351977249.db2.gz	VOCPWHMHYFYAGJ-VIFPVBQESA-N	0	2	293.279	0.638	20	5		CCBDLN
CN(CC(=O)NC1CC1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234258490	352156062	/nfs/dbraw/zinc/15/60/62/352156062.db2.gz	UJGGXFDARRXIGJ-UHFFFAOYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@@H](O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000235241183	352181144	/nfs/dbraw/zinc/18/11/44/352181144.db2.gz	KUXDMEIDKIJTSL-SSDOTTSWSA-N	0	2	254.242	0.753	20	5		CCBDLN
NC(=O)[C@H]1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000236273577	352193210	/nfs/dbraw/zinc/19/32/10/352193210.db2.gz	PNNHMWKXGKQMQL-ZETCQYMHSA-N	0	2	279.252	0.248	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CCC1=O	ZINC000132346211	187623008	/nfs/dbraw/zinc/62/30/08/187623008.db2.gz	XLWRVZHBTMFASJ-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
CC[C@H](C)CONC(=O)Cn1cc([N+](=O)[O-])ccc1=O	ZINC000292203566	198201044	/nfs/dbraw/zinc/20/10/44/198201044.db2.gz	XUVFYCWHSLRTIH-VIFPVBQESA-N	0	2	283.284	0.850	20	5		CCBDLN
O=C(NC[C@@]1(O)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270089192	352903222	/nfs/dbraw/zinc/90/32/22/352903222.db2.gz	ICGLXSGSFYLLBM-LBPRGKRZSA-N	0	2	282.252	0.182	20	5		CCBDLN
CC1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)OCCO1	ZINC000270990366	353011379	/nfs/dbraw/zinc/01/13/79/353011379.db2.gz	GEKSKQCPQZHLFZ-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
Nc1cccc([N+](=O)[O-])c1C(=O)NN1CCCNC1=O	ZINC000272819556	353097247	/nfs/dbraw/zinc/09/72/47/353097247.db2.gz	CFCKXSIFUKKOQQ-UHFFFAOYSA-N	0	2	279.256	0.237	20	5		CCBDLN
CCNC(=O)CN(CC)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157616606	188327683	/nfs/dbraw/zinc/32/76/83/188327683.db2.gz	JJUYKNKFZWVJPN-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CCN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H]1CCNC1=O	ZINC000282236550	353405835	/nfs/dbraw/zinc/40/58/35/353405835.db2.gz	RLPOGDVXEIRMQD-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC(O)(CO)CC1	ZINC000313687688	354219698	/nfs/dbraw/zinc/21/96/98/354219698.db2.gz	VADCVTGUMPJGCQ-UHFFFAOYSA-N	0	2	296.279	0.260	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)NN2CC(=O)N(C)C2=O)c1	ZINC000271803209	191337798	/nfs/dbraw/zinc/33/77/98/191337798.db2.gz	JLILJYAGAIFIQU-UHFFFAOYSA-N	0	2	292.251	0.442	20	5		CCBDLN
CNC(=O)[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(C)C	ZINC000354242072	356372458	/nfs/dbraw/zinc/37/24/58/356372458.db2.gz	MAAMNEWYTUFCAD-LLVKDONJSA-N	0	2	295.295	0.801	20	5		CCBDLN
C[C@H]1OCC[C@@]1(O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355495167	356626640	/nfs/dbraw/zinc/62/66/40/356626640.db2.gz	AMPKTENMAXNSTI-AMIZOPFISA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CCC(=O)N1	ZINC000457186196	236441460	/nfs/dbraw/zinc/44/14/60/236441460.db2.gz	LSMMOCPXMRPCMN-ZDUSSCGKSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(NC[C@H]1CCCNC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000591173655	359564976	/nfs/dbraw/zinc/56/49/76/359564976.db2.gz	PBCGLVMIMHGBJW-MRVPVSSYSA-N	0	2	293.279	0.556	20	5		CCBDLN
O=C(NCCCOCCO)c1ccc([N+](=O)[O-])cc1O	ZINC000274885629	192826951	/nfs/dbraw/zinc/82/69/51/192826951.db2.gz	BQGMKXWBTUKMRR-UHFFFAOYSA-N	0	2	284.268	0.429	20	5		CCBDLN
C[C@H]1C(=O)N(C)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000592900138	359972878	/nfs/dbraw/zinc/97/28/78/359972878.db2.gz	FTTYVVKUTJJOCY-ZETCQYMHSA-N	0	2	279.252	0.561	20	5		CCBDLN
CO[C@@](C)(CO)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000594394127	360291313	/nfs/dbraw/zinc/29/13/13/360291313.db2.gz	BYMZKGFPMWGXCQ-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@H](O)C1	ZINC000177985401	189083923	/nfs/dbraw/zinc/08/39/23/189083923.db2.gz	KDMJWBGIYTZEPP-MRVPVSSYSA-N	0	2	252.226	0.507	20	5		CCBDLN
Cc1nn(C)c(N2CC[C@@H](O)C(F)(F)C2)c1[N+](=O)[O-]	ZINC000596429947	360892094	/nfs/dbraw/zinc/89/20/94/360892094.db2.gz	PVZLJTCKGDGSIW-SSDOTTSWSA-N	0	2	276.243	0.843	20	5		CCBDLN
C[C@@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])c1ncnn1C	ZINC000597566507	361139819	/nfs/dbraw/zinc/13/98/19/361139819.db2.gz	NDVWTVFWBXEOQV-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=c1[nH]nc(CNc2cccc(F)c2[N+](=O)[O-])[nH]1	ZINC000301763262	201181993	/nfs/dbraw/zinc/18/19/93/201181993.db2.gz	GXLIKCVGQOWMFT-UHFFFAOYSA-N	0	2	253.193	0.757	20	5		CCBDLN
CN1CC[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)C1=O	ZINC000614008392	364459687	/nfs/dbraw/zinc/45/96/87/364459687.db2.gz	KGJZRRMATDCXML-MRVPVSSYSA-N	0	2	279.252	0.717	20	5		CCBDLN
[NH3+][C@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000565234233	291364543	/nfs/dbraw/zinc/36/45/43/291364543.db2.gz	SHLZIZMBKRWJTO-OLZOCXBDSA-N	0	2	290.323	0.339	20	5		CCBDLN
C[C@@H](O)CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H](C)CO	ZINC000276080441	193206982	/nfs/dbraw/zinc/20/69/82/193206982.db2.gz	WVLOUTWGKCHMNV-DTWKUNHWSA-N	0	2	298.295	0.504	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)C1CC(O)C1	ZINC000332473381	204731424	/nfs/dbraw/zinc/73/14/24/204731424.db2.gz	SSISYDJLVMTWND-UHFFFAOYSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(NCc1c[nH+]c[nH]1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000225816321	389146760	/nfs/dbraw/zinc/14/67/60/389146760.db2.gz	TVLZTZVBSGGQOC-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
O=C(NCc1c[nH]c[nH+]1)c1cccc([N+](=O)[O-])c1[O-]	ZINC000225816321	389146761	/nfs/dbraw/zinc/14/67/61/389146761.db2.gz	TVLZTZVBSGGQOC-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
CN(C)c1n[nH]c(NC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000340997857	389177734	/nfs/dbraw/zinc/17/77/34/389177734.db2.gz	PZVNOUCDNVAQOJ-UHFFFAOYSA-N	0	2	292.255	0.737	20	5		CCBDLN
Cc1cnc2c(c1)N(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCO2	ZINC000362467798	389237132	/nfs/dbraw/zinc/23/71/32/389237132.db2.gz	IDFXNOLVCDFPRY-RKDXNWHRSA-N	0	2	263.253	0.781	20	5		CCBDLN
Cn1nccc1C=Cc1[nH]c(=O)[nH]c(=O)c1[N+](=O)[O-]	ZINC000352022080	389737625	/nfs/dbraw/zinc/73/76/25/389737625.db2.gz	VAOFGZJIGJNNLS-NSCUHMNNSA-N	0	2	263.213	0.700	20	5		CCBDLN
COC[C@@H](CCO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436891315	389986439	/nfs/dbraw/zinc/98/64/39/389986439.db2.gz	WZZVLYXOTBACPY-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cn1cncc1CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436925956	389987026	/nfs/dbraw/zinc/98/70/26/389987026.db2.gz	HXWVHDHPVYNCIG-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1CCNC1=O	ZINC000436958239	389987986	/nfs/dbraw/zinc/98/79/86/389987986.db2.gz	FLWPSTIQQXARRH-SECBINFHSA-N	0	2	279.252	0.261	20	5		CCBDLN
COCC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000281543589	195282349	/nfs/dbraw/zinc/28/23/49/195282349.db2.gz	JXRZNPJUNQJAQQ-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@H]1CC(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000363572669	299705112	/nfs/dbraw/zinc/70/51/12/299705112.db2.gz	HWIQWOWDSJWZEY-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(CNC(=O)C1CC1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000548518783	286045061	/nfs/dbraw/zinc/04/50/61/286045061.db2.gz	CZFVTQPQWODJAM-UHFFFAOYSA-N	0	2	279.252	0.765	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)N(C)C	ZINC000077498139	177275707	/nfs/dbraw/zinc/27/57/07/177275707.db2.gz	HFNJPUVOPJOUOW-ZETCQYMHSA-N	0	2	281.268	0.507	20	5		CCBDLN
C[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000408410290	300443050	/nfs/dbraw/zinc/44/30/50/300443050.db2.gz	NGFZOKSIONUVSO-IONNQARKSA-N	0	2	266.253	0.896	20	5		CCBDLN
C[C@H]1OCC[NH2+][C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1[O-]	ZINC000380977130	336041837	/nfs/dbraw/zinc/04/18/37/336041837.db2.gz	ZFCNKKOQZNRULK-HQJQHLMTSA-N	0	2	281.268	0.616	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@H](O)C1	ZINC000184844051	526716567	/nfs/dbraw/zinc/71/65/67/526716567.db2.gz	UKECFDXEJNITNF-MRVPVSSYSA-N	0	2	252.226	0.507	20	5		CCBDLN
CC[C@@H](O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000422126810	529232168	/nfs/dbraw/zinc/23/21/68/529232168.db2.gz	BSXXIEBRGCMONF-MRVPVSSYSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(NN1CCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000783606699	581352827	/nfs/dbraw/zinc/35/28/27/581352827.db2.gz	WOHRPTXIIGODRJ-UHFFFAOYSA-N	0	2	280.240	0.361	20	5		CCBDLN
C[C@@H]1CN(C)C(=O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000783757435	581359155	/nfs/dbraw/zinc/35/91/55/581359155.db2.gz	NALBZBAFRIFQSI-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCO[C@H](CO)C1	ZINC000274937918	581529632	/nfs/dbraw/zinc/52/96/32/581529632.db2.gz	MQLADOKIHICHRZ-VIFPVBQESA-N	0	2	282.252	0.134	20	5		CCBDLN
O=C([O-])[C@@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000739582417	581600638	/nfs/dbraw/zinc/60/06/38/581600638.db2.gz	FEDWBWNYHDRIEN-MRVPVSSYSA-N	0	2	254.246	0.545	20	5		CCBDLN
O=C([O-])[C@@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000739582417	581600639	/nfs/dbraw/zinc/60/06/39/581600639.db2.gz	FEDWBWNYHDRIEN-MRVPVSSYSA-N	0	2	254.246	0.545	20	5		CCBDLN
Cc1ncc([N+](=O)[O-])cc1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774906254	582001881	/nfs/dbraw/zinc/00/18/81/582001881.db2.gz	ALCGGYFJVSPEKO-UHFFFAOYSA-N	0	2	279.212	0.479	20	5		CCBDLN
O=C(CNc1ccccc1[N+](=O)[O-])OCc1n[nH]c(=O)[nH]1	ZINC000774927183	582003295	/nfs/dbraw/zinc/00/32/95/582003295.db2.gz	UMDXYRZUGAZQHT-UHFFFAOYSA-N	0	2	293.239	0.574	20	5		CCBDLN
C[C@H](C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1)C1CC1	ZINC000750758062	582058635	/nfs/dbraw/zinc/05/86/35/582058635.db2.gz	WDSLPXMDMSKVKM-ZETCQYMHSA-N	0	2	299.308	0.841	20	5		CCBDLN
CNC(=O)c1ccccc1N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000894129292	616922896	/nfs/dbraw/zinc/92/28/96/616922896.db2.gz	XXMTZDNYKGNNIX-MWLCHTKSSA-N	0	2	277.280	0.674	20	5		CCBDLN
O=CN1CCC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000831244168	642335732	/nfs/dbraw/zinc/33/57/32/642335732.db2.gz	ZLFQEHZGWUKRBE-JTQLQIEISA-N	0	2	279.252	0.860	20	5		CCBDLN
Cn1nc(Br)cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841242101	642808923	/nfs/dbraw/zinc/80/89/23/642808923.db2.gz	WIRLKLXDSKCYDX-RFZPGFLSSA-N	0	2	289.089	0.786	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CCSC[C@@H]1CO	ZINC001137625772	799678496	/nfs/dbraw/zinc/67/84/96/799678496.db2.gz	QYJHLGJFEYGPIO-VIFPVBQESA-N	0	2	298.320	0.850	20	5		CCBDLN
COC(=O)c1n[nH]cc1Nc1ncc([N+](=O)[O-])cn1	ZINC001169571020	836359770	/nfs/dbraw/zinc/35/97/70/836359770.db2.gz	BGHJVTHERSSHTB-UHFFFAOYSA-N	0	2	264.201	0.638	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nnnn1C	ZINC001336717945	920949844	/nfs/dbraw/zinc/94/98/44/920949844.db2.gz	YFPJUUTVMPQDPW-LURJTMIESA-N	0	2	292.255	0.315	20	5		CCBDLN
O=[N+]([O-])[C@@H]1C[C@H]1c1nc(COC[C@@H]2CCOC2)no1	ZINC001345944090	924018791	/nfs/dbraw/zinc/01/87/91/924018791.db2.gz	KFLZUODMSPMHBR-IWSPIJDZSA-N	0	2	269.257	0.755	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CC(=O)N1	ZINC001447265364	930595991	/nfs/dbraw/zinc/59/59/91/930595991.db2.gz	LHVKPBWWCJPHRZ-SSDOTTSWSA-N	0	2	251.198	0.127	20	5		CCBDLN
CN1CCOC[C@@H]1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600420110	361955373	/nfs/dbraw/zinc/95/53/73/361955373.db2.gz	JBIAWVVGPZBHGV-VIFPVBQESA-N	0	2	295.295	0.361	20	5		CCBDLN
O=C(NCC1COC1)c1ccc([N+](=O)[O-])cc1O	ZINC000600570651	362010529	/nfs/dbraw/zinc/01/05/29/362010529.db2.gz	QQICWESTWPFZQK-UHFFFAOYSA-N	0	2	252.226	0.677	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nncn1C	ZINC000273162786	192062461	/nfs/dbraw/zinc/06/24/61/192062461.db2.gz	CLHGSZXDSXDPEO-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
CNC(=O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000456494680	529869029	/nfs/dbraw/zinc/86/90/29/529869029.db2.gz	CZLRPPWVGRAQIH-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
O=C(Nc1nnc2n1CCCC2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000374749112	232623685	/nfs/dbraw/zinc/62/36/85/232623685.db2.gz	CEKXXYNLQKKMEL-RNFRBKRXSA-N	0	2	251.246	0.218	20	5		CCBDLN
CC(C)NC(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316430	136951623	/nfs/dbraw/zinc/95/16/23/136951623.db2.gz	MJAOCEGUSOCASH-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
CCC[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000343478372	137137640	/nfs/dbraw/zinc/13/76/40/137137640.db2.gz	PYXOMSMNFZWJML-MRVPVSSYSA-N	0	2	281.268	0.684	20	5		CCBDLN
CCOC(=O)C[C@@H](O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000339352228	215115474	/nfs/dbraw/zinc/11/54/74/215115474.db2.gz	KLVLGEPRXKLMDF-SNVBAGLBSA-N	0	2	298.251	0.553	20	5		CCBDLN
O=C(NC[C@@H](O)[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000347086639	137319174	/nfs/dbraw/zinc/31/91/74/137319174.db2.gz	DNKBDQHGDMHBIJ-BXKDBHETSA-N	0	2	296.279	0.428	20	5		CCBDLN
COCCOCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271276545	191045487	/nfs/dbraw/zinc/04/54/87/191045487.db2.gz	NBIGLKRXNOIQEP-UHFFFAOYSA-N	0	2	284.268	0.693	20	5		CCBDLN
Cc1c(NC(=O)NCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000128556396	350195123	/nfs/dbraw/zinc/19/51/23/350195123.db2.gz	YITXMFPSOWAGFA-UHFFFAOYSA-N	0	2	292.255	0.636	20	5		CCBDLN
CNC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184660741	351417944	/nfs/dbraw/zinc/41/79/44/351417944.db2.gz	QXNJHIHWOHMJGZ-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
CNC(=O)[C@H](C)CN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000187660473	351551274	/nfs/dbraw/zinc/55/12/74/351551274.db2.gz	MGMNDRBLPLLPNP-MRVPVSSYSA-N	0	2	295.295	0.755	20	5		CCBDLN
COC(=O)[C@@H](CF)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000291607629	198049491	/nfs/dbraw/zinc/04/94/91/198049491.db2.gz	ARWNCWWDZPCJFS-MRVPVSSYSA-N	0	2	286.215	0.541	20	5		CCBDLN
C[S@@](=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316551	351947087	/nfs/dbraw/zinc/94/70/87/351947087.db2.gz	BBTOALNPKAKXSH-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C1CC1	ZINC000267841697	352793560	/nfs/dbraw/zinc/79/35/60/352793560.db2.gz	NXTLNWWNEUUITQ-NSHDSACASA-N	0	2	294.263	0.982	20	5		CCBDLN
O=C(NC[C@@H](O)C1CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000269818685	352877565	/nfs/dbraw/zinc/87/75/65/352877565.db2.gz	FSPKAGFYVMNVEF-LLVKDONJSA-N	0	2	266.253	0.801	20	5		CCBDLN
CCc1[nH]nc(C(=O)Nc2nc(SC)n[nH]2)c1[N+](=O)[O-]	ZINC000278069558	353281120	/nfs/dbraw/zinc/28/11/20/353281120.db2.gz	VXBVFZBBSMEPAF-UHFFFAOYSA-N	0	2	297.300	0.973	20	5		CCBDLN
COCCOCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280776056	353383059	/nfs/dbraw/zinc/38/30/59/353383059.db2.gz	MYWAXLQBXNKHQZ-UHFFFAOYSA-N	0	2	284.268	0.693	20	5		CCBDLN
CCC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000286506057	353592246	/nfs/dbraw/zinc/59/22/46/353592246.db2.gz	YODJHIMNCLZBLK-VIFPVBQESA-N	0	2	281.268	0.684	20	5		CCBDLN
Nc1noc(CCNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000353513205	356243580	/nfs/dbraw/zinc/24/35/80/356243580.db2.gz	WGJCBCZIPQQRAX-UHFFFAOYSA-N	0	2	293.239	0.068	20	5		CCBDLN
COC(=O)C1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000354835033	356509418	/nfs/dbraw/zinc/50/94/18/356509418.db2.gz	GRSIOYYNASASKG-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCO[C@H]2C[C@H]21	ZINC000590429023	359459439	/nfs/dbraw/zinc/45/94/39/359459439.db2.gz	FFISOXPGLYWCNO-KOLCDFICSA-N	0	2	264.237	0.914	20	5		CCBDLN
O=C(NCC[C@@]1(O)CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000593812964	360164638	/nfs/dbraw/zinc/16/46/38/360164638.db2.gz	MRUXEVZSLCDCQO-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
NC(=O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CCC1	ZINC000611535731	363736111	/nfs/dbraw/zinc/73/61/11/363736111.db2.gz	ZPGJAIGMDFXYTL-UHFFFAOYSA-N	0	2	279.252	0.438	20	5		CCBDLN
CC(=O)NCCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179415341	189192562	/nfs/dbraw/zinc/19/25/62/189192562.db2.gz	IETSKBLRHJJVNL-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1[O-])N1CC[NH+](CCO)CC1	ZINC000179420197	189193286	/nfs/dbraw/zinc/19/32/86/189193286.db2.gz	ZFHACSGKMCTPNX-UHFFFAOYSA-N	0	2	295.295	0.051	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1Cc2cnnn2Cc2ccccc21	ZINC000375501984	296073708	/nfs/dbraw/zinc/07/37/08/296073708.db2.gz	PCRMTQJMIXOOQQ-DGCLKSJQSA-N	0	2	299.290	0.838	20	5		CCBDLN
O=C(NCCN1CCOCC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000280826283	194990401	/nfs/dbraw/zinc/99/04/01/194990401.db2.gz	SURVJTIRRHMJEC-UHFFFAOYSA-N	0	2	295.295	0.362	20	5		CCBDLN
C[C@@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C(=O)O1	ZINC000288422146	197074117	/nfs/dbraw/zinc/07/41/17/197074117.db2.gz	CRWKYIDLAPTMFS-MUWHJKNJSA-N	0	2	280.236	0.734	20	5		CCBDLN
Cn1nc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)ccc1=O	ZINC000183904998	388764759	/nfs/dbraw/zinc/76/47/59/388764759.db2.gz	MJZILLCWOMHXKX-UHFFFAOYSA-N	0	2	290.235	0.646	20	5		CCBDLN
O=C(Nc1nn[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC000039350353	388851249	/nfs/dbraw/zinc/85/12/49/388851249.db2.gz	KCHADLMYBILUDA-UHFFFAOYSA-N	0	2	250.174	0.066	20	5		CCBDLN
CC(C)(C)NC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000194744489	389103272	/nfs/dbraw/zinc/10/32/72/389103272.db2.gz	UXLQMVRXKZQAES-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
Cn1cc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])cn1	ZINC000236109991	389167678	/nfs/dbraw/zinc/16/76/78/389167678.db2.gz	JFRLGITYTJIEEX-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000134491391	389246470	/nfs/dbraw/zinc/24/64/70/389246470.db2.gz	QLEBZXSZPACCHK-UHFFFAOYSA-N	0	2	281.203	0.075	20	5		CCBDLN
NC(=O)c1cccc(NCCc2nc(N)no2)c1[N+](=O)[O-]	ZINC000342292021	389207436	/nfs/dbraw/zinc/20/74/36/389207436.db2.gz	HKYNJNRCTLSGEJ-UHFFFAOYSA-N	0	2	292.255	0.144	20	5		CCBDLN
COC(=O)[C@@H](C)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000351831578	389694520	/nfs/dbraw/zinc/69/45/20/389694520.db2.gz	KZHRSBOCGORMJE-ZETCQYMHSA-N	0	2	282.252	0.839	20	5		CCBDLN
O=c1[nH]c(=O)c([N+](=O)[O-])c(C=Cc2csnn2)[nH]1	ZINC000352021703	389737177	/nfs/dbraw/zinc/73/71/77/389737177.db2.gz	RCBMDKLDPFIQSG-UPHRSURJSA-N	0	2	267.226	0.818	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H](CO)O1	ZINC000436818569	389985427	/nfs/dbraw/zinc/98/54/27/389985427.db2.gz	FVTLBIADBYXREO-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CN(Cc1ncon1)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436894379	389986544	/nfs/dbraw/zinc/98/65/44/389986544.db2.gz	QXEBHFMOJOTWKV-UHFFFAOYSA-N	0	2	278.224	0.956	20	5		CCBDLN
O=C(N[C@H]1CC[S@@](=O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000436970676	389989337	/nfs/dbraw/zinc/98/93/37/389989337.db2.gz	FPOJFUCZZJVDGZ-ZDVLTJLQSA-N	0	2	284.293	0.551	20	5		CCBDLN
CN(Cc1nnc[nH]1)C(=O)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356600045	144017974	/nfs/dbraw/zinc/01/79/74/144017974.db2.gz	SADZAMATMIJGBC-UHFFFAOYSA-N	0	2	277.240	0.691	20	5		CCBDLN
CC(C)(NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1nn[nH]n1	ZINC000356802047	144034613	/nfs/dbraw/zinc/03/46/13/144034613.db2.gz	GFGWVLFQTRTOAG-UHFFFAOYSA-N	0	2	292.255	0.479	20	5		CCBDLN
NC(=O)CCCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000548463167	286039070	/nfs/dbraw/zinc/03/90/70/286039070.db2.gz	PRGAAAWOFZUJLB-UHFFFAOYSA-N	0	2	281.268	0.686	20	5		CCBDLN
NC(=O)[C@@H]1CCCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000182146156	303298726	/nfs/dbraw/zinc/29/87/26/303298726.db2.gz	GWPZMUGWVYVYMP-VIFPVBQESA-N	0	2	279.252	0.390	20	5		CCBDLN
NC(=O)[C@H]1CCCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000282963856	303326643	/nfs/dbraw/zinc/32/66/43/303326643.db2.gz	LZCGUMNVNHTEQD-SECBINFHSA-N	0	2	293.279	0.780	20	5		CCBDLN
O=c1[nH]nc(CN2CCOc3ccc([N+](=O)[O-])cc3C2)[nH]1	ZINC000352708682	304804823	/nfs/dbraw/zinc/80/48/23/304804823.db2.gz	HLQRBEHGZPSDHQ-UHFFFAOYSA-N	0	2	291.267	0.813	20	5		CCBDLN
CC1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])OCCO1	ZINC000791392837	581219787	/nfs/dbraw/zinc/21/97/87/581219787.db2.gz	SXLWYOJIJWHFIK-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000774888490	582001038	/nfs/dbraw/zinc/00/10/38/582001038.db2.gz	ZTMPQOFKRMIZCH-UHFFFAOYSA-N	0	2	264.197	0.776	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1	ZINC000774908457	582001701	/nfs/dbraw/zinc/00/17/01/582001701.db2.gz	GXDJWLGEBZVGDJ-UHFFFAOYSA-N	0	2	264.197	0.776	20	5		CCBDLN
CC[C@@H](C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750757724	582058378	/nfs/dbraw/zinc/05/83/78/582058378.db2.gz	SDYJZAONOORTNC-SSDOTTSWSA-N	0	2	287.297	0.841	20	5		CCBDLN
CC(C)(C)n1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839723770	614064937	/nfs/dbraw/zinc/06/49/37/614064937.db2.gz	LCLJDQFQVCCOLA-RNFRBKRXSA-N	0	2	253.262	0.637	20	5		CCBDLN
CC(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000798138569	614223306	/nfs/dbraw/zinc/22/33/06/614223306.db2.gz	NXDABXMSKMQLQS-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
CCOC(=O)Cc1cnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])s1	ZINC000839792346	615219316	/nfs/dbraw/zinc/21/93/16/615219316.db2.gz	LPGWWXDRPUTVSC-HTQZYQBOSA-N	0	2	299.308	0.852	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CC(=O)Nc2cc(F)c(F)cc21	ZINC000906256328	634971326	/nfs/dbraw/zinc/97/13/26/634971326.db2.gz	VMCGWIQTJHLSGQ-MLUIRONXSA-N	0	2	297.217	0.915	20	5		CCBDLN
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CN=c1ncc(N)cn1-c1ccc(O)c([N+](=O)[O-])c1	ZINC001210395911	803648888	/nfs/dbraw/zinc/64/88/88/803648888.db2.gz	IRXMPUQHWYKBTG-UHFFFAOYSA-N	0	2	261.241	0.599	20	5		CCBDLN
O=C(Nc1cnn(Cc2cccnc2)c1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001125773279	811318117	/nfs/dbraw/zinc/31/81/17/811318117.db2.gz	LSUSJXBSSXSLAS-VXGBXAGGSA-N	0	2	287.279	0.930	20	5		CCBDLN
Nc1c2c(=O)nccc-2[nH]n1[C@@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169001063	836096185	/nfs/dbraw/zinc/09/61/85/836096185.db2.gz	CREAJRZFAGNRQI-JGVFFNPUSA-N	0	2	277.284	0.876	20	5		CCBDLN
CCN1C[C@@H](c2noc([C@@H]3C[C@H]3[N+](=O)[O-])n2)CC1=O	ZINC001326221308	913832290	/nfs/dbraw/zinc/83/22/90/913832290.db2.gz	GRHVUGPVIQHVGR-XLPZGREQSA-N	0	2	266.257	0.538	20	5		CCBDLN
CCCNC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001337490355	921260405	/nfs/dbraw/zinc/26/04/05/921260405.db2.gz	MHXMRSLOXYLJKL-QMMMGPOBSA-N	0	2	295.295	0.945	20	5		CCBDLN
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CCOC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273201699	192073465	/nfs/dbraw/zinc/07/34/65/192073465.db2.gz	JYAWGRCCJWMMOS-UHFFFAOYSA-N	0	2	282.252	0.983	20	5		CCBDLN
CCC1(O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000283745052	282527946	/nfs/dbraw/zinc/52/79/46/282527946.db2.gz	PLXMTELJTXVXKA-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(Cc1ccc([N+](=O)[O-])cc1)N=c1cccn[nH]1	ZINC000346048508	137265534	/nfs/dbraw/zinc/26/55/34/137265534.db2.gz	GJRRQAFWYVBEON-UHFFFAOYSA-N	0	2	258.237	0.988	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCC[C@@H](O)C1	ZINC000068010181	348794089	/nfs/dbraw/zinc/79/40/89/348794089.db2.gz	BJKJFGPHUSMBOI-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(Nc1nc2c(s1)COCC2)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000075440774	349033499	/nfs/dbraw/zinc/03/34/99/349033499.db2.gz	ZRROQHHFMQXUHQ-IYSWYEEDSA-N	0	2	269.282	0.820	20	5		CCBDLN
C[N@@H+]1CCO[C@@H](C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000182087323	351346355	/nfs/dbraw/zinc/34/63/55/351346355.db2.gz	AIJDULZMKQWIKW-LLVKDONJSA-N	0	2	281.268	0.570	20	5		CCBDLN
C[N@H+]1CCO[C@@H](C(=O)Nc2ccc([O-])c([N+](=O)[O-])c2)C1	ZINC000182087323	351346360	/nfs/dbraw/zinc/34/63/60/351346360.db2.gz	AIJDULZMKQWIKW-LLVKDONJSA-N	0	2	281.268	0.570	20	5		CCBDLN
O=C(NCCCn1ccnn1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316444	351946527	/nfs/dbraw/zinc/94/65/27/351946527.db2.gz	OWXFXLRRGISEIK-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
COCCOCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234655572	352164747	/nfs/dbraw/zinc/16/47/47/352164747.db2.gz	LALWNEDOPQSSNV-UHFFFAOYSA-N	0	2	284.268	0.693	20	5		CCBDLN
CN1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000354549851	137580255	/nfs/dbraw/zinc/58/02/55/137580255.db2.gz	XELYZDSIAHWBHG-UHFFFAOYSA-N	0	2	265.225	0.172	20	5		CCBDLN
O=C(NC[C@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274746518	353159080	/nfs/dbraw/zinc/15/90/80/353159080.db2.gz	GPINGUBOPCUFCP-NSHDSACASA-N	0	2	266.253	0.801	20	5		CCBDLN
O=C(NCC1(O)CCOCC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274705516	353154607	/nfs/dbraw/zinc/15/46/07/353154607.db2.gz	ROORXIRPZDLZRT-UHFFFAOYSA-N	0	2	296.279	0.572	20	5		CCBDLN
C[C@@H](Cn1cncn1)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157683618	188333038	/nfs/dbraw/zinc/33/30/38/188333038.db2.gz	PZPICGNGTIWKOF-QMMMGPOBSA-N	0	2	291.267	0.710	20	5		CCBDLN
C[C@H]1C(=O)NCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280989328	353388884	/nfs/dbraw/zinc/38/88/84/353388884.db2.gz	QEJGQPLYMIUCRD-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000312722732	354209867	/nfs/dbraw/zinc/20/98/67/354209867.db2.gz	RSUAPRDRDYVLBF-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CC(=O)N1CC(NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000332418028	354666358	/nfs/dbraw/zinc/66/63/58/354666358.db2.gz	DDGXXRBVHAZLSV-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
CCn1c(C)nc([N+](=O)[O-])c1NCCc1nc(N)no1	ZINC000361003504	138018656	/nfs/dbraw/zinc/01/86/56/138018656.db2.gz	UDJNUQDKQWAWOS-UHFFFAOYSA-N	0	2	281.276	0.570	20	5		CCBDLN
COC(=O)C(C)(C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000294362725	199013699	/nfs/dbraw/zinc/01/36/99/199013699.db2.gz	MLKQZGJHAJGZST-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)C1(CO)CC1	ZINC000588857151	359342109	/nfs/dbraw/zinc/34/21/09/359342109.db2.gz	ICQMCTAZTGIDTI-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Cc1cc(C(=O)N=c2cc(C(N)=O)[nH][nH]2)cc([N+](=O)[O-])c1	ZINC000611141767	363664333	/nfs/dbraw/zinc/66/43/33/363664333.db2.gz	YGMRTYFMXNWIMJ-UHFFFAOYSA-N	0	2	289.251	0.399	20	5		CCBDLN
O=C(N[C@H](CO)CCF)c1ccc([N+](=O)[O-])c(O)c1	ZINC000593861936	360179929	/nfs/dbraw/zinc/17/99/29/360179929.db2.gz	JQIWYLNXURRSCD-QMMMGPOBSA-N	0	2	272.232	0.751	20	5		CCBDLN
CCN(CC(=O)N(C)C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000611535119	363735996	/nfs/dbraw/zinc/73/59/96/363735996.db2.gz	FBNSBLNFWLQHOO-UHFFFAOYSA-N	0	2	295.295	0.851	20	5		CCBDLN
C[C@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])c1ncnn1C	ZINC000597566513	361140417	/nfs/dbraw/zinc/14/04/17/361140417.db2.gz	NDVWTVFWBXEOQV-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
Cc1nc(NCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000301629380	201106109	/nfs/dbraw/zinc/10/61/09/201106109.db2.gz	CAGMETPXHHQIKR-UHFFFAOYSA-N	0	2	250.218	0.322	20	5		CCBDLN
Cn1nncc1S(=O)(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000616169808	365201366	/nfs/dbraw/zinc/20/13/66/365201366.db2.gz	IRRGOVVKLYTMAH-UHFFFAOYSA-N	0	2	283.269	0.524	20	5		CCBDLN
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCc2[nH+]ccn2C)n1	ZINC000515852104	249146059	/nfs/dbraw/zinc/14/60/59/249146059.db2.gz	ZBWMYIJUTMGRSM-UHFFFAOYSA-N	0	2	291.267	0.764	20	5		CCBDLN
COC(=O)C1(C)CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000425165226	533183006	/nfs/dbraw/zinc/18/30/06/533183006.db2.gz	SGAPXNXGDCOQJX-UHFFFAOYSA-N	0	2	294.263	0.936	20	5		CCBDLN
CN(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000023441935	388804998	/nfs/dbraw/zinc/80/49/98/388804998.db2.gz	NRZFKFHVPPVOBO-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
O=C(NCCc1[nH]cc[nH+]1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000186276038	388831345	/nfs/dbraw/zinc/83/13/45/388831345.db2.gz	MAFBHHJZUIVICU-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
CO[C@H]1COC[C@@H]1NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000291795527	388936608	/nfs/dbraw/zinc/93/66/08/388936608.db2.gz	ANCQLCOHRLBFKQ-WPRPVWTQSA-N	0	2	282.252	0.444	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1COC[C@@H]1O	ZINC000342367492	389216629	/nfs/dbraw/zinc/21/66/29/389216629.db2.gz	DLPAZRKRDXCKQE-KOLCDFICSA-N	0	2	282.252	0.132	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@H]1COC[C@H]1O	ZINC000342400795	389217298	/nfs/dbraw/zinc/21/72/98/389217298.db2.gz	KUPRAPAUCLSPKD-WCBMZHEXSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(NCCCc1n[nH]c(=O)[nH]1)c1ccccc1[N+](=O)[O-]	ZINC000174581659	389524523	/nfs/dbraw/zinc/52/45/23/389524523.db2.gz	VBQKTVQGUIPVTO-UHFFFAOYSA-N	0	2	291.267	0.369	20	5		CCBDLN
CCN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1CCNC1=O	ZINC000282045827	389649922	/nfs/dbraw/zinc/64/99/22/389649922.db2.gz	BWTUWWNDFYSSOA-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1C[C@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436891582	389986442	/nfs/dbraw/zinc/98/64/42/389986442.db2.gz	HAPGWCQWNPNSOM-CBAPKCEASA-N	0	2	266.253	0.896	20	5		CCBDLN
CO[C@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1	ZINC000436938797	389987679	/nfs/dbraw/zinc/98/76/79/389987679.db2.gz	MXHPWSYCDQXCHH-ZDUSSCGKSA-N	0	2	296.279	0.836	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)c[nH]1	ZINC000436975925	389989127	/nfs/dbraw/zinc/98/91/27/389989127.db2.gz	ODHAKIDIOSWJAR-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
O=C(NCc1cc[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC000545899855	390335157	/nfs/dbraw/zinc/33/51/57/390335157.db2.gz	BKAAUMFDORFXQN-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1CN1CC[C@H]2OCC[N@@H+](C)[C@@H]2C1	ZINC000342127363	130285982	/nfs/dbraw/zinc/28/59/82/130285982.db2.gz	KMEWEIURASFOEX-ZYHUDNBSSA-N	0	2	295.343	0.233	20	5		CCBDLN
O=C(NC[C@H]1CC[C@H](CO)O1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000356506599	144008788	/nfs/dbraw/zinc/00/87/88/144008788.db2.gz	LHUDBXCDLCUUKK-NXEZZACHSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)F)c1ccc([N+](=O)[O-])cc1O	ZINC000436889739	397534358	/nfs/dbraw/zinc/53/43/58/397534358.db2.gz	XMIFSYFKJSMZTD-MRVPVSSYSA-N	0	2	276.195	0.656	20	5		CCBDLN
COCC[C@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000436982849	292722667	/nfs/dbraw/zinc/72/26/67/292722667.db2.gz	VGADVIKVDFCPAX-ZDUSSCGKSA-N	0	2	298.295	0.818	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H]1O	ZINC000436958498	300188653	/nfs/dbraw/zinc/18/86/53/300188653.db2.gz	HRQBKAQSLHVMFP-WRWORJQWSA-N	0	2	266.253	0.753	20	5		CCBDLN
C[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000384821445	336131910	/nfs/dbraw/zinc/13/19/10/336131910.db2.gz	QBRFLESSWVRDRQ-IONNQARKSA-N	0	2	266.253	0.896	20	5		CCBDLN
CCC[C@H](O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412534928	528291237	/nfs/dbraw/zinc/29/12/37/528291237.db2.gz	PPNPSXODCWNIHZ-MNOVXSKESA-N	0	2	298.295	0.552	20	5		CCBDLN
CCOC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436973362	529005113	/nfs/dbraw/zinc/00/51/13/529005113.db2.gz	RZOBSYCJCRKHSU-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1nonc1CNS(=O)(=O)c1cccnc1[N+](=O)[O-]	ZINC000742326509	581779459	/nfs/dbraw/zinc/77/94/59/581779459.db2.gz	UBPRHYYKVCZLHN-UHFFFAOYSA-N	0	2	299.268	0.160	20	5		CCBDLN
COCCONC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000748770249	581985065	/nfs/dbraw/zinc/98/50/65/581985065.db2.gz	LNBLMOCGAQUBSJ-UHFFFAOYSA-N	0	2	269.257	0.701	20	5		CCBDLN
CN(C(=O)[O-])C1CC[NH+](Cn2cc([N+](=O)[O-])cn2)CC1	ZINC000737938577	582009129	/nfs/dbraw/zinc/00/91/29/582009129.db2.gz	GYNRLAVTTXJQGV-UHFFFAOYSA-N	0	2	283.288	0.823	20	5		CCBDLN
O=C(CSc1ccc([N+](=O)[O-])cc1)NOCCO	ZINC000776583323	582081074	/nfs/dbraw/zinc/08/10/74/582081074.db2.gz	GCQYWGYPRCKEOH-UHFFFAOYSA-N	0	2	272.282	0.727	20	5		CCBDLN
CCc1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc(C)n1	ZINC000841130727	615657577	/nfs/dbraw/zinc/65/75/77/615657577.db2.gz	USBOEUDBECBKMG-RKDXNWHRSA-N	0	2	250.258	0.951	20	5		CCBDLN
CN(C)c1ncncc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840417015	616037676	/nfs/dbraw/zinc/03/76/76/616037676.db2.gz	FYEGCAYYIKWKAD-HTRCEHHLSA-N	0	2	251.246	0.146	20	5		CCBDLN
O=CN1CCC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000831244169	642336211	/nfs/dbraw/zinc/33/62/11/642336211.db2.gz	ZLFQEHZGWUKRBE-SNVBAGLBSA-N	0	2	279.252	0.860	20	5		CCBDLN
O=[N+]([O-])c1c(O)cccc1OC1CS(=O)(=O)C1	ZINC001225619641	805144316	/nfs/dbraw/zinc/14/43/16/805144316.db2.gz	GFTSIIBXPFXGOV-UHFFFAOYSA-N	0	2	259.239	0.476	20	5		CCBDLN
Cc1ccc(S(=O)(=O)Nc2nnn(C)n2)cc1[N+](=O)[O-]	ZINC001194409611	846287573	/nfs/dbraw/zinc/28/75/73/846287573.db2.gz	QSKKQHDAUXAZLZ-UHFFFAOYSA-N	0	2	298.284	0.228	20	5		CCBDLN
Cc1nsc(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC001319892514	910335797	/nfs/dbraw/zinc/33/57/97/910335797.db2.gz	KMVMJNUDDCWLPG-UHFFFAOYSA-N	0	2	268.258	0.741	20	5		CCBDLN
O=C(N[C@@H]1COCCC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000600392027	361941796	/nfs/dbraw/zinc/94/17/96/361941796.db2.gz	POEGWAFTURIRSG-SECBINFHSA-N	0	2	280.236	0.388	20	5		CCBDLN
CC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000127217897	187290645	/nfs/dbraw/zinc/29/06/45/187290645.db2.gz	CUHSGLNZGZKPCL-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000077496330	349112187	/nfs/dbraw/zinc/11/21/87/349112187.db2.gz	UMMNBQVJCABQFU-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
CC(=O)N[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000120875539	350010789	/nfs/dbraw/zinc/01/07/89/350010789.db2.gz	FCCYTMGIKYSPBC-ZCFIWIBFSA-N	0	2	267.241	0.764	20	5		CCBDLN
O=C(CCc1nnc[nH]1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000183896567	351396096	/nfs/dbraw/zinc/39/60/96/351396096.db2.gz	FBGWBRPPAFVUET-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
O=C(CCc1nc[nH]n1)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000183896567	351396098	/nfs/dbraw/zinc/39/60/98/351396098.db2.gz	FBGWBRPPAFVUET-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
CN(C)C(=O)CC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000186024869	351472960	/nfs/dbraw/zinc/47/29/60/351472960.db2.gz	PQXLYQCHBMWEBU-UHFFFAOYSA-N	0	2	267.241	0.717	20	5		CCBDLN
CNC(=O)CC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000188167316	351577634	/nfs/dbraw/zinc/57/76/34/351577634.db2.gz	JMIJITDEAXWDDK-UHFFFAOYSA-N	0	2	253.214	0.375	20	5		CCBDLN
CO[C@@]1(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])CCOC1	ZINC000217316466	351947171	/nfs/dbraw/zinc/94/71/71/351947171.db2.gz	LQCVVHZCXHERLK-CYBMUJFWSA-N	0	2	296.279	0.836	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000217316828	351946939	/nfs/dbraw/zinc/94/69/39/351946939.db2.gz	GNPUCGJFRIWGQL-WPRPVWTQSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CCC(=O)N1	ZINC000221012703	351975613	/nfs/dbraw/zinc/97/56/13/351975613.db2.gz	VVTQHLAJWOSXFY-SSDOTTSWSA-N	0	2	265.225	0.518	20	5		CCBDLN
O=C(N[C@@]1(CCO)CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000278237857	353289195	/nfs/dbraw/zinc/28/91/95/353289195.db2.gz	ZAMURBAWENRHDG-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCNC(=O)CC1	ZINC000280673118	353375057	/nfs/dbraw/zinc/37/50/57/353375057.db2.gz	BRCLXTPGBYESJB-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC(O)CC1	ZINC000280752063	353380299	/nfs/dbraw/zinc/38/02/99/353380299.db2.gz	LDGNHNFDDLTLHN-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Cc1nnc(CCNC(=O)c2cccc(O)c2[N+](=O)[O-])[nH]1	ZINC000283244528	353493623	/nfs/dbraw/zinc/49/36/23/353493623.db2.gz	ZVGNTXGLAHTHIO-UHFFFAOYSA-N	0	2	291.267	0.699	20	5		CCBDLN
Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])[nH]n2)c(=O)n1C	ZINC000287074760	353626361	/nfs/dbraw/zinc/62/63/61/353626361.db2.gz	NADZGJKDHDAUDK-UHFFFAOYSA-N	0	2	291.267	0.255	20	5		CCBDLN
CC(C)(CO)ONC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000296732648	353957028	/nfs/dbraw/zinc/95/70/28/353957028.db2.gz	AFNXIJGPOZJJOB-UHFFFAOYSA-N	0	2	283.284	0.825	20	5		CCBDLN
O=C(N[C@H]1C[C@@H](O)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000298283927	353962604	/nfs/dbraw/zinc/96/26/04/353962604.db2.gz	IBGCMMJWAZUTHY-OCAPTIKFSA-N	0	2	252.226	0.554	20	5		CCBDLN
O=C(NC[C@H](O)C(F)(F)F)c1cc(O)ccc1[N+](=O)[O-]	ZINC000353567543	356250898	/nfs/dbraw/zinc/25/08/98/356250898.db2.gz	JSZMNSVAVFBBND-QMMMGPOBSA-N	0	2	294.185	0.953	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)Nc1ccc([N+](=O)[O-])cc1	ZINC000353761367	356289203	/nfs/dbraw/zinc/28/92/03/356289203.db2.gz	SYPLAMCQBDEUBL-UHFFFAOYSA-N	0	2	278.228	0.740	20	5		CCBDLN
NC(=O)c1ccc(CSc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000361996026	138041408	/nfs/dbraw/zinc/04/14/08/138041408.db2.gz	LWXLKSIFFGDDDK-UHFFFAOYSA-N	0	2	295.280	0.810	20	5		CCBDLN
CN(C(=O)c1cc(O)ccc1[N+](=O)[O-])[C@@H]1CCNC1=O	ZINC000354509652	356428600	/nfs/dbraw/zinc/42/86/00/356428600.db2.gz	YJLPMEYICHJQKZ-SNVBAGLBSA-N	0	2	279.252	0.261	20	5		CCBDLN
Cc1ccc(S(=O)(=O)Nc2ccncc2[N+](=O)[O-])cn1	ZINC000359412851	356818681	/nfs/dbraw/zinc/81/86/81/356818681.db2.gz	OIGFJIROPJBKSQ-UHFFFAOYSA-N	0	2	294.292	0.916	20	5		CCBDLN
O=C(N[C@H]1C=C[C@H](CO)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000359470465	356827558	/nfs/dbraw/zinc/82/75/58/356827558.db2.gz	FESYGAUEFGSPMS-WPRPVWTQSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])c[nH]c1=O)N1CCc2[nH]nnc2C1	ZINC000359566071	356845798	/nfs/dbraw/zinc/84/57/98/356845798.db2.gz	QIDMFHHLQKWEBF-UHFFFAOYSA-N	0	2	290.239	0.012	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)c2ccc([N+](=O)[O-])cc2F)[nH][nH]1	ZINC000610872341	363623115	/nfs/dbraw/zinc/62/31/15/363623115.db2.gz	KEGKCZGDECBBSY-UHFFFAOYSA-N	0	2	293.214	0.230	20	5		CCBDLN
CC(C)(CO)ONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000297341303	200155071	/nfs/dbraw/zinc/15/50/71/200155071.db2.gz	XMEBXJMJWFJFRC-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
CO[C@@H]1COC[C@H]1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000592866858	359965083	/nfs/dbraw/zinc/96/50/83/359965083.db2.gz	NSLYAZZIPSRNJV-MWLCHTKSSA-N	0	2	282.252	0.444	20	5		CCBDLN
CO[C@@](C)(CO)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000594398222	360292096	/nfs/dbraw/zinc/29/20/96/360292096.db2.gz	OVSUMTPFARLRGM-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1nnc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)o1	ZINC000611534653	363735394	/nfs/dbraw/zinc/73/53/94/363735394.db2.gz	VTDPGKSVZSJFHU-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCOCCN1	ZINC000597707185	361203564	/nfs/dbraw/zinc/20/35/64/361203564.db2.gz	KNCBOQKEQBOXJT-UHFFFAOYSA-N	0	2	267.241	0.277	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC12COC2	ZINC000597728860	361214115	/nfs/dbraw/zinc/21/41/15/361214115.db2.gz	ZFUVFCSBYFTGCW-UHFFFAOYSA-N	0	2	264.237	0.915	20	5		CCBDLN
C[C@@H](O)C1(NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1	ZINC000598383598	361400291	/nfs/dbraw/zinc/40/02/91/361400291.db2.gz	HHILLYQCYBNYHH-SSDOTTSWSA-N	0	2	266.253	0.944	20	5		CCBDLN
CCN1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000330623531	203051254	/nfs/dbraw/zinc/05/12/54/203051254.db2.gz	PVINQNJQBVJMHN-UHFFFAOYSA-N	0	2	279.252	0.562	20	5		CCBDLN
COc1cc([N+](=O)[O-])ccc1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000427616964	533135282	/nfs/dbraw/zinc/13/52/82/533135282.db2.gz	BLZZMVONFHNJNF-UHFFFAOYSA-N	0	2	293.239	0.357	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000195151424	389116765	/nfs/dbraw/zinc/11/67/65/389116765.db2.gz	SSHYTQDVMKEYGB-WRWORJQWSA-N	0	2	293.279	0.555	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@H]1COC[C@@H]1O	ZINC000342400796	389217757	/nfs/dbraw/zinc/21/77/57/389217757.db2.gz	KUPRAPAUCLSPKD-WPRPVWTQSA-N	0	2	282.252	0.132	20	5		CCBDLN
C[C@@]1(O)CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000280874456	389604945	/nfs/dbraw/zinc/60/49/45/389604945.db2.gz	BXYCMOMKYZOPES-GFCCVEGCSA-N	0	2	266.253	0.897	20	5		CCBDLN
CC(C)c1n[nH]c(C(=O)NCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000434012262	389923110	/nfs/dbraw/zinc/92/31/10/389923110.db2.gz	ODHQSTBFUJVCBS-UHFFFAOYSA-N	0	2	295.259	0.195	20	5		CCBDLN
COC[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC	ZINC000436960033	389987780	/nfs/dbraw/zinc/98/77/80/389987780.db2.gz	OYIMFJNSJNJDNS-VIFPVBQESA-N	0	2	298.251	0.218	20	5		CCBDLN
Cn1cnc(CCNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436997962	389989953	/nfs/dbraw/zinc/98/99/53/389989953.db2.gz	GRTGWAHIIQHMNF-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
O=C(N=c1nc2n([nH]1)CCCC2)c1cc([N+](=O)[O-])c[nH]1	ZINC000457156000	390032674	/nfs/dbraw/zinc/03/26/74/390032674.db2.gz	QFDLYSCTXRLDFW-UHFFFAOYSA-N	0	2	276.256	0.525	20	5		CCBDLN
C[C@H]1C(=O)N(C)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000592903311	390365127	/nfs/dbraw/zinc/36/51/27/390365127.db2.gz	URKFKCOCWMLIJO-ZETCQYMHSA-N	0	2	279.252	0.561	20	5		CCBDLN
CCN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000191817012	130309843	/nfs/dbraw/zinc/30/98/43/130309843.db2.gz	JEJUQDIEWALZHF-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
NC(=O)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000342170628	130361306	/nfs/dbraw/zinc/36/13/06/130361306.db2.gz	WERYOKQTIQDFSA-UHFFFAOYSA-N	0	2	268.229	0.297	20	5		CCBDLN
O=C(NC1(CCO)CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000436865346	397533841	/nfs/dbraw/zinc/53/38/41/397533841.db2.gz	SLFRWZKIUPDENW-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(CCO)C1	ZINC000436889911	397534372	/nfs/dbraw/zinc/53/43/72/397534372.db2.gz	AIPXXAATHLWLLE-UHFFFAOYSA-N	0	2	266.253	0.755	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CCC1=O	ZINC000184802820	290277200	/nfs/dbraw/zinc/27/72/00/290277200.db2.gz	XKPODKQPALWWLV-QMMMGPOBSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C([O-])c1ccnc(N2CCn3c[nH+]cc3C2)c1[N+](=O)[O-]	ZINC000578511527	335643236	/nfs/dbraw/zinc/64/32/36/335643236.db2.gz	VFJGRQJQKVLXBU-UHFFFAOYSA-N	0	2	289.251	0.905	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H]2C[C@@]2(CO)C1	ZINC000783791259	581362559	/nfs/dbraw/zinc/36/25/59/581362559.db2.gz	XAYRJYACWUJYEG-OQPBUACISA-N	0	2	278.264	0.755	20	5		CCBDLN
C[C@@H]1C[N@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@H]1NC(=O)[O-]	ZINC000739192781	581520828	/nfs/dbraw/zinc/52/08/28/581520828.db2.gz	SMYMLPCQHCSVSZ-PSASIEDQSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@@H]1C[N@@H+](Cn2cc([N+](=O)[O-])cn2)CC[C@H]1NC(=O)[O-]	ZINC000739192781	581520830	/nfs/dbraw/zinc/52/08/30/581520830.db2.gz	SMYMLPCQHCSVSZ-PSASIEDQSA-N	0	2	283.288	0.727	20	5		CCBDLN
Cc1nc([N+](=O)[O-])cn1CCC(=O)OCc1n[nH]c(=O)[nH]1	ZINC000774935233	582003897	/nfs/dbraw/zinc/00/38/97/582003897.db2.gz	AQANZCHWWDTTAU-UHFFFAOYSA-N	0	2	296.243	0.057	20	5		CCBDLN
CCc1[nH]n(C)c2nnc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])c1-2	ZINC000839684616	615794639	/nfs/dbraw/zinc/79/46/39/615794639.db2.gz	YNXBQBLVARRSNZ-IYSWYEEDSA-N	0	2	278.272	0.463	20	5		CCBDLN
Cn1ncc(C(=O)Nc2cc([N+](=O)[O-])ccc2O)n1	ZINC000311901598	623810453	/nfs/dbraw/zinc/81/04/53/623810453.db2.gz	YGBPVNKBKMKEKQ-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(NC[C@H]1COCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000861975477	644957497	/nfs/dbraw/zinc/95/74/97/644957497.db2.gz	LWLFXWCCEYYFOF-QMMMGPOBSA-N	0	2	268.225	0.403	20	5		CCBDLN
COC(=O)[C@H](CCO)Oc1cccc(O)c1[N+](=O)[O-]	ZINC001218216381	803938119	/nfs/dbraw/zinc/93/81/19/803938119.db2.gz	FRTZIQJPBHWTLJ-VIFPVBQESA-N	0	2	271.225	0.603	20	5		CCBDLN
COC(=O)C[C@H](Oc1cccc(O)c1[N+](=O)[O-])C(=O)OC	ZINC001225622338	805145040	/nfs/dbraw/zinc/14/50/40/805145040.db2.gz	HDBGHOOJSHXQBE-VIFPVBQESA-N	0	2	299.235	0.784	20	5		CCBDLN
C[C@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(F)F	ZINC001309798220	908478537	/nfs/dbraw/zinc/47/85/37/908478537.db2.gz	AZTHYXGPLMMBAQ-BYPYZUCNSA-N	0	2	284.244	0.260	20	5		CCBDLN
O=C([O-])CNC(=O)c1ccc([N+](=O)[O-])c(-n2cc[nH+]c2)c1	ZINC001574892618	957957120	/nfs/dbraw/zinc/95/71/20/957957120.db2.gz	BHDPCPZJPGLYNA-UHFFFAOYSA-N	0	2	290.235	0.595	20	5		CCBDLN
CCn1nncc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000600158663	361879189	/nfs/dbraw/zinc/87/91/89/361879189.db2.gz	KSMFPDHYLXGGTG-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
Cc1cnc(NS(=O)(=O)c2nn(C)cc2[N+](=O)[O-])o1	ZINC000600665820	362028218	/nfs/dbraw/zinc/02/82/18/362028218.db2.gz	SICCQFNAJLWELI-UHFFFAOYSA-N	0	2	287.257	0.426	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(S(=O)(=O)NCC(F)(F)F)n1	ZINC000600666863	362028244	/nfs/dbraw/zinc/02/82/44/362028244.db2.gz	IGEFQSSINFXTIZ-UHFFFAOYSA-N	0	2	288.207	0.169	20	5		CCBDLN
CC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)OC	ZINC000273171224	192063979	/nfs/dbraw/zinc/06/39/79/192063979.db2.gz	DWYSWRBAEYQFIN-VIFPVBQESA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(NC[C@@H](O)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000344216952	137184595	/nfs/dbraw/zinc/18/45/95/137184595.db2.gz	JJFSMHCWVYWYFT-LLVKDONJSA-N	0	2	266.253	0.801	20	5		CCBDLN
Cc1nc(=NC(=O)c2ccc([N+](=O)[O-])o2)[nH]n1C	ZINC000344535047	137200267	/nfs/dbraw/zinc/20/02/67/137200267.db2.gz	SJGLGOKLTJWGTH-UHFFFAOYSA-N	0	2	251.202	0.299	20	5		CCBDLN
C[C@@H](Cn1cncn1)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000068087245	348797595	/nfs/dbraw/zinc/79/75/95/348797595.db2.gz	JQGODODEZNICJL-QMMMGPOBSA-N	0	2	291.267	0.710	20	5		CCBDLN
O=C(NC[C@]1(O)CCSC1)c1cc([N+](=O)[O-])ccc1O	ZINC000271284323	191050630	/nfs/dbraw/zinc/05/06/30/191050630.db2.gz	ORINEQPLRGBJDM-GFCCVEGCSA-N	0	2	298.320	0.898	20	5		CCBDLN
O=C(c1nc(=O)[nH][nH]1)N1CCc2ccc([N+](=O)[O-])cc2C1	ZINC000153437927	350557744	/nfs/dbraw/zinc/55/77/44/350557744.db2.gz	GGEPWRXIPCRCBC-UHFFFAOYSA-N	0	2	289.251	0.205	20	5		CCBDLN
CNC(=O)CCN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000171481521	350911235	/nfs/dbraw/zinc/91/12/35/350911235.db2.gz	BZMNJFWJARHIMH-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CC(=O)N1CC(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000175782433	351143859	/nfs/dbraw/zinc/14/38/59/351143859.db2.gz	WKTVEPYYNBYSNL-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(NC1CCS(=O)CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000230654599	352117011	/nfs/dbraw/zinc/11/70/11/352117011.db2.gz	IJPIGXRRLURGDW-UHFFFAOYSA-N	0	2	298.320	0.941	20	5		CCBDLN
COC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000234533920	352159831	/nfs/dbraw/zinc/15/98/31/352159831.db2.gz	OFUDBEGATWNXRS-LURJTMIESA-N	0	2	268.225	0.592	20	5		CCBDLN
C[C@@H]1OCC[C@]1(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000279425935	353305305	/nfs/dbraw/zinc/30/53/05/353305305.db2.gz	IRJODUNMZXOUAZ-SDBXPKJASA-N	0	2	296.279	0.570	20	5		CCBDLN
COC[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000280066227	353335596	/nfs/dbraw/zinc/33/55/96/353335596.db2.gz	RBLCCQWVKFBFPP-ZETCQYMHSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=C(NCCNC(=O)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000157686520	188332370	/nfs/dbraw/zinc/33/23/70/188332370.db2.gz	MMUQOPNKTOICLL-UHFFFAOYSA-N	0	2	293.279	0.556	20	5		CCBDLN
CC(C)[C@](C)(NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(N)=O	ZINC000287819906	353669274	/nfs/dbraw/zinc/66/92/74/353669274.db2.gz	KEJBSHMFPNGZFX-ZDUSSCGKSA-N	0	2	295.295	0.930	20	5		CCBDLN
COC(=O)[C@H](CNC(=O)c1cccc(O)c1[N+](=O)[O-])OC	ZINC000293988601	353857582	/nfs/dbraw/zinc/85/75/82/353857582.db2.gz	LILHCQOIWRGRTL-VIFPVBQESA-N	0	2	298.251	0.218	20	5		CCBDLN
CC(C)NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000175296758	188944448	/nfs/dbraw/zinc/94/44/48/188944448.db2.gz	CXUVIUREYJSZMQ-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
Nc1noc(CCNc2nc3sccn3c2[N+](=O)[O-])n1	ZINC000360237866	356974660	/nfs/dbraw/zinc/97/46/60/356974660.db2.gz	KXQRNWWSPRMHLJ-UHFFFAOYSA-N	0	2	295.284	0.754	20	5		CCBDLN
COC[C@](C)(O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000452354020	236235278	/nfs/dbraw/zinc/23/52/78/236235278.db2.gz	FOEPSQCZOURWNM-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
CNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000294643059	199118945	/nfs/dbraw/zinc/11/89/45/199118945.db2.gz	MIJPDGDGDQOFRZ-LURJTMIESA-N	0	2	267.241	0.165	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@@H](O)C2(CC2)C1	ZINC000518692114	358343931	/nfs/dbraw/zinc/34/39/31/358343931.db2.gz	VSQHZJSDTSKVNY-SNVBAGLBSA-N	0	2	278.264	0.897	20	5		CCBDLN
NC(=O)c1cc(=NC(=O)c2csc([N+](=O)[O-])c2)[nH][nH]1	ZINC000610890729	363627718	/nfs/dbraw/zinc/62/77/18/363627718.db2.gz	HYRVGRPRMMSUNU-UHFFFAOYSA-N	0	2	281.253	0.153	20	5		CCBDLN
NC(=O)C[C@@H]1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000589942101	359411912	/nfs/dbraw/zinc/41/19/12/359411912.db2.gz	HZOMXCILHOVXJP-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1	ZINC000296903735	200029987	/nfs/dbraw/zinc/02/99/87/200029987.db2.gz	HHGIWZDBUABFOX-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CCONC(=O)CNC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000298130121	200340618	/nfs/dbraw/zinc/34/06/18/200340618.db2.gz	XWFXGVUIDBUECG-UHFFFAOYSA-N	0	2	297.267	0.401	20	5		CCBDLN
CCn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)nn1	ZINC000598141062	361342997	/nfs/dbraw/zinc/34/29/97/361342997.db2.gz	BTQSASJTXWSVTI-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
COc1cc(NCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000301755897	201177560	/nfs/dbraw/zinc/17/75/60/201177560.db2.gz	DGCOTVBOXJGSLJ-UHFFFAOYSA-N	0	2	265.229	0.627	20	5		CCBDLN
O=C(NCCCn1ccnn1)c1cc([N+](=O)[O-])ccc1O	ZINC000185005362	388781647	/nfs/dbraw/zinc/78/16/47/388781647.db2.gz	JSPHAJDRIZGQIZ-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
C=CC(=O)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000092546679	389028979	/nfs/dbraw/zinc/02/89/79/389028979.db2.gz	LBMRQIPXGAHVHQ-UHFFFAOYSA-N	0	2	279.252	0.931	20	5		CCBDLN
CN(C)c1n[nH]c(NC(=O)c2cccc(O)c2[N+](=O)[O-])n1	ZINC000340840674	389163794	/nfs/dbraw/zinc/16/37/94/389163794.db2.gz	JTXMVOHJNZSEJB-UHFFFAOYSA-N	0	2	292.255	0.737	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1O)N1CCCC1	ZINC000157473542	389331211	/nfs/dbraw/zinc/33/12/11/389331211.db2.gz	XIRONBTUGOLJMD-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
NC(=O)CC1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000421921820	389383176	/nfs/dbraw/zinc/38/31/76/389383176.db2.gz	OZTFEMHTWHGUJA-UHFFFAOYSA-N	0	2	293.279	0.686	20	5		CCBDLN
COCC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000281835296	389625991	/nfs/dbraw/zinc/62/59/91/389625991.db2.gz	YEUHWPUVGYWBLO-MRVPVSSYSA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1CCN2CCOc3cccc1c32	ZINC000374510295	389584596	/nfs/dbraw/zinc/58/45/96/389584596.db2.gz	UQYPNYFUCAKIHJ-MWLCHTKSSA-N	0	2	289.291	0.897	20	5		CCBDLN
CCC[C@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000414024424	389595343	/nfs/dbraw/zinc/59/53/43/389595343.db2.gz	UCVPRDFHYBRVKQ-JQWIXIFHSA-N	0	2	298.295	0.552	20	5		CCBDLN
Cn1cc(NC(=O)c2cccc(O)c2[N+](=O)[O-])nn1	ZINC000428544292	389705943	/nfs/dbraw/zinc/70/59/43/389705943.db2.gz	HHFYIRXAHOVKAL-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
NC(=O)Cn1ccc(Nc2ncc(Cl)cc2[N+](=O)[O-])n1	ZINC000434955552	389950546	/nfs/dbraw/zinc/95/05/46/389950546.db2.gz	QIENVERKIYFULD-UHFFFAOYSA-N	0	2	296.674	0.491	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H]1COC[C@H]1O	ZINC000436629448	389981169	/nfs/dbraw/zinc/98/11/69/389981169.db2.gz	JNXQTBQGKBLUPG-MWLCHTKSSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1COC(=O)N1	ZINC000496259880	390330011	/nfs/dbraw/zinc/33/00/11/390330011.db2.gz	BNRBEKKCNVWRCM-SSDOTTSWSA-N	0	2	267.197	0.347	20	5		CCBDLN
O=C(NC[C@H]1CC[C@H](CO)O1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000356516256	144010052	/nfs/dbraw/zinc/01/00/52/144010052.db2.gz	NTHSCOPSHDFLKO-NXEZZACHSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000187692167	297925105	/nfs/dbraw/zinc/92/51/05/297925105.db2.gz	URRBWDPQQQZMSA-GFCCVEGCSA-N	0	2	266.253	0.897	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@H](CO)O1	ZINC000331317570	300197978	/nfs/dbraw/zinc/19/79/78/300197978.db2.gz	JRXJUYWUBVYTSB-DTWKUNHWSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@]1(C(N)=O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000280033213	300789664	/nfs/dbraw/zinc/78/96/64/300789664.db2.gz	MVJFYTUHEYXVIP-ZDUSSCGKSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C([O-])c1ccc([N+](=O)[O-])c(NCC[NH+]2CCOCC2)n1	ZINC000166652506	334915571	/nfs/dbraw/zinc/91/55/71/334915571.db2.gz	QQUBSDFOILQNGK-UHFFFAOYSA-N	0	2	296.283	0.432	20	5		CCBDLN
CCC[C@@H](O)[C@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000412529683	529073269	/nfs/dbraw/zinc/07/32/69/529073269.db2.gz	WGLOMORPNKNQPC-GXSJLCMTSA-N	0	2	298.295	0.552	20	5		CCBDLN
O=c1c(-c2nn[nH]n2)cccn1Cc1cccc([N+](=O)[O-])c1	ZINC000738370175	581277074	/nfs/dbraw/zinc/27/70/74/581277074.db2.gz	AAMIEOWJBGKTDH-UHFFFAOYSA-N	0	2	298.262	0.985	20	5		CCBDLN
C[C@@H]1CN(C)C(=O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000783759547	581359643	/nfs/dbraw/zinc/35/96/43/581359643.db2.gz	KZFCVCAYUMBIMG-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1C[C@H]2C[C@@]2(CO)C1	ZINC000783814772	581364600	/nfs/dbraw/zinc/36/46/00/581364600.db2.gz	VOMQIMDPWBZAKO-RNCFNFMXSA-N	0	2	278.264	0.755	20	5		CCBDLN
CNc1c(C(=O)OCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000765520462	581524287	/nfs/dbraw/zinc/52/42/87/581524287.db2.gz	BRUOIXLDOLBSDV-UHFFFAOYSA-N	0	2	293.239	0.817	20	5		CCBDLN
Cn1c[nH+]cc1Cn1cc(C(=O)[O-])cc([N+](=O)[O-])c1=O	ZINC000833057900	601478052	/nfs/dbraw/zinc/47/80/52/601478052.db2.gz	AAXAASDGSRGFPW-UHFFFAOYSA-N	0	2	278.224	0.237	20	5		CCBDLN
CC(C)[C@@H](CO)ONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000836898774	614104998	/nfs/dbraw/zinc/10/49/98/614104998.db2.gz	LQQFXDNSSCCLHI-LLVKDONJSA-N	0	2	284.268	0.979	20	5		CCBDLN
CC[S@@](=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316576	616004865	/nfs/dbraw/zinc/00/48/65/616004865.db2.gz	VALKECDZJASMKS-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
CN1C(=O)CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2ccccc21	ZINC000840378525	616134351	/nfs/dbraw/zinc/13/43/51/616134351.db2.gz	TXOUXPYZMWPRNS-LDYMZIIASA-N	0	2	275.264	0.661	20	5		CCBDLN
COC(=O)c1cccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000844886957	616930920	/nfs/dbraw/zinc/93/09/20/616930920.db2.gz	XZOPZNNHGOUTGM-HTRCEHHLSA-N	0	2	265.225	0.472	20	5		CCBDLN
O=C(Nc1ccnn1CC1CC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839706200	640355199	/nfs/dbraw/zinc/35/51/99/640355199.db2.gz	OCBPGIYXOMOECK-RKDXNWHRSA-N	0	2	250.258	0.897	20	5		CCBDLN
O=C(Nc1cccc(-c2nn[nH]n2)c1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000840249631	640997935	/nfs/dbraw/zinc/99/79/35/640997935.db2.gz	RVUZPSPULBAXNV-RKDXNWHRSA-N	0	2	274.240	0.470	20	5		CCBDLN
C[C@H]1C[C@@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C(=O)O1	ZINC000816621767	641179390	/nfs/dbraw/zinc/17/93/90/641179390.db2.gz	ORRAPRQDLKMVAX-IMTBSYHQSA-N	0	2	280.236	0.734	20	5		CCBDLN
O=C(Nc1ccnn1C[C@H]1CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001125535002	791263125	/nfs/dbraw/zinc/26/31/25/791263125.db2.gz	BKNLEYJUKXECDA-OPRDCNLKSA-N	0	2	280.284	0.523	20	5		CCBDLN
CC(C)(C)[NH+]1CC(Oc2nc(=O)[n-]cc2[N+](=O)[O-])C1	ZINC001226331769	805220238	/nfs/dbraw/zinc/22/02/38/805220238.db2.gz	OZVWMAJKBDIOLI-UHFFFAOYSA-N	0	2	268.273	0.952	20	5		CCBDLN
Nc1c2c(=O)nccc-2[nH]n1[C@H]1CC[C@H](C[N+](=O)[O-])C1	ZINC001169001065	836094919	/nfs/dbraw/zinc/09/49/19/836094919.db2.gz	CREAJRZFAGNRQI-YUMQZZPRSA-N	0	2	277.284	0.876	20	5		CCBDLN
Cn1cnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)c1	ZINC001305124464	908193520	/nfs/dbraw/zinc/19/35/20/908193520.db2.gz	BDQSMOAUVNYAQM-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
Cc1nc(Cc2noc([C@@H]3C[C@H]3[N+](=O)[O-])n2)no1	ZINC001332493113	918215539	/nfs/dbraw/zinc/21/55/39/918215539.db2.gz	OAYGDXXKQZYBKG-PHDIDXHHSA-N	0	2	251.202	0.484	20	5		CCBDLN
O=[N+]([O-])c1ccc([O-])cc1C[N@@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001473750377	926838450	/nfs/dbraw/zinc/83/84/50/926838450.db2.gz	NNEAHJJYNXLIEE-QMMMGPOBSA-N	0	2	290.283	0.803	20	5		CCBDLN
O=[N+]([O-])c1ccc([O-])cc1C[N@H+]1CC[C@H](c2nn[nH]n2)C1	ZINC001473750377	926838458	/nfs/dbraw/zinc/83/84/58/926838458.db2.gz	NNEAHJJYNXLIEE-QMMMGPOBSA-N	0	2	290.283	0.803	20	5		CCBDLN
O=C([O-])[C@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000132032093	958760644	/nfs/dbraw/zinc/76/06/44/958760644.db2.gz	NFVWPBNSCVRZGN-MWLCHTKSSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000132032093	958760660	/nfs/dbraw/zinc/76/06/60/958760660.db2.gz	NFVWPBNSCVRZGN-MWLCHTKSSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C(N[C@@H]1COCCC1=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600389258	361939430	/nfs/dbraw/zinc/93/94/30/361939430.db2.gz	JECNXSOHOOCVQY-MRVPVSSYSA-N	0	2	280.236	0.388	20	5		CCBDLN
C[N@@H+]1CCOC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000600418665	361955461	/nfs/dbraw/zinc/95/54/61/361955461.db2.gz	DUJOLUQOVPJEHN-JTQLQIEISA-N	0	2	295.295	0.361	20	5		CCBDLN
C[N@H+]1CCOC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000600418665	361955467	/nfs/dbraw/zinc/95/54/67/361955467.db2.gz	DUJOLUQOVPJEHN-JTQLQIEISA-N	0	2	295.295	0.361	20	5		CCBDLN
C[C@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)S(C)(=O)=O	ZINC000361652662	232180708	/nfs/dbraw/zinc/18/07/08/232180708.db2.gz	GNUXEOMZKFKOGJ-ZCFIWIBFSA-N	0	2	288.281	0.672	20	5		CCBDLN
CNC(=O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000063778883	348693122	/nfs/dbraw/zinc/69/31/22/348693122.db2.gz	QMLRBRNXQZYEBF-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
O=C(CCn1cncn1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000089531431	349392949	/nfs/dbraw/zinc/39/29/49/349392949.db2.gz	XIGUTNDZXRLMJB-UHFFFAOYSA-N	0	2	277.240	0.921	20	5		CCBDLN
COC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271256755	191033029	/nfs/dbraw/zinc/03/30/29/191033029.db2.gz	IRAVWJOKISHGQV-LURJTMIESA-N	0	2	268.225	0.592	20	5		CCBDLN
Cn1nccc1S(=O)(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000219465219	351967618	/nfs/dbraw/zinc/96/76/18/351967618.db2.gz	WOYOOFJFYSWNEP-UHFFFAOYSA-N	0	2	298.280	0.835	20	5		CCBDLN
Cn1cc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2O)cn1	ZINC000219465003	351967704	/nfs/dbraw/zinc/96/77/04/351967704.db2.gz	IKHWKTZRMONLKJ-UHFFFAOYSA-N	0	2	298.280	0.835	20	5		CCBDLN
Cn1cnc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])n1	ZINC000227882778	352061840	/nfs/dbraw/zinc/06/18/40/352061840.db2.gz	IXPRWIJLVMIDLR-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CNC(=O)[C@@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234394830	352158975	/nfs/dbraw/zinc/15/89/75/352158975.db2.gz	RDPFIOLPWGWLSE-ZCFIWIBFSA-N	0	2	267.241	0.165	20	5		CCBDLN
COC(=O)[C@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234533157	352159745	/nfs/dbraw/zinc/15/97/45/352159745.db2.gz	SBLQPRMMHGUUJI-LURJTMIESA-N	0	2	268.225	0.592	20	5		CCBDLN
CCN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000274749511	353159001	/nfs/dbraw/zinc/15/90/01/353159001.db2.gz	HDVISRNUNOMFKQ-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
COC(=O)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000275230437	353196945	/nfs/dbraw/zinc/19/69/45/353196945.db2.gz	DYMFZEGRXOLSCS-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(=O)N(C2CC2)C1	ZINC000279968025	353328825	/nfs/dbraw/zinc/32/88/25/353328825.db2.gz	YMRHTHDCXIEFLM-UHFFFAOYSA-N	0	2	291.263	0.705	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)NCCF	ZINC000282741805	353448803	/nfs/dbraw/zinc/44/88/03/353448803.db2.gz	IWQXEONDQIZZDQ-ZETCQYMHSA-N	0	2	299.258	0.504	20	5		CCBDLN
CCNC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000294091688	353867942	/nfs/dbraw/zinc/86/79/42/353867942.db2.gz	QORHTZJZQFGVRP-UHFFFAOYSA-N	0	2	296.283	0.349	20	5		CCBDLN
O=C(NC1(c2nn[nH]n2)CC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000348299637	355909361	/nfs/dbraw/zinc/90/93/61/355909361.db2.gz	YIDITZCHTKLUDM-UHFFFAOYSA-N	0	2	290.239	0.233	20	5		CCBDLN
CNC(=O)[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(C)C	ZINC000354242075	356372745	/nfs/dbraw/zinc/37/27/45/356372745.db2.gz	MAAMNEWYTUFCAD-NSHDSACASA-N	0	2	295.295	0.801	20	5		CCBDLN
O=C(CNc1ccccc1[N+](=O)[O-])NCc1n[nH]c(=O)[nH]1	ZINC000362412674	138058637	/nfs/dbraw/zinc/05/86/37/138058637.db2.gz	UHUBZAGKYPMJAC-UHFFFAOYSA-N	0	2	292.255	0.147	20	5		CCBDLN
O=C(N[C@H]1C=C[C@@H](CO)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000359470463	356827656	/nfs/dbraw/zinc/82/76/56/356827656.db2.gz	FESYGAUEFGSPMS-SCZZXKLOSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(NC1COCCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000590429880	359460579	/nfs/dbraw/zinc/46/05/79/359460579.db2.gz	VJHODLZVLDDWBG-UHFFFAOYSA-N	0	2	282.252	0.446	20	5		CCBDLN
O=C(NCC[C@@]1(O)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000593812011	360163378	/nfs/dbraw/zinc/16/33/78/360163378.db2.gz	GOIATQPTKZNMGY-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=C(NCC[C@@]1(O)CCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000593813363	360164508	/nfs/dbraw/zinc/16/45/08/360164508.db2.gz	NKAUWRZGEJTHMT-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
O=c1[nH]nc(CCCNc2c(Cl)cncc2[N+](=O)[O-])[nH]1	ZINC000596146351	360810831	/nfs/dbraw/zinc/81/08/31/360810831.db2.gz	ZOELIWGCPBDRIU-UHFFFAOYSA-N	0	2	298.690	0.934	20	5		CCBDLN
CN(C[C@@H]1COCCO1)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000598177431	361349005	/nfs/dbraw/zinc/34/90/05/361349005.db2.gz	RMBNNRRICKAJPQ-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@]2(O)C[C@H]2C1	ZINC000598223637	361356587	/nfs/dbraw/zinc/35/65/87/361356587.db2.gz	DEAGPJUALLIFJL-TVQRCGJNSA-N	0	2	278.264	0.897	20	5		CCBDLN
Cn1cc([N+](=O)[O-])c(S(=O)(=O)NC(C)(C)C(F)F)n1	ZINC000599295812	361639397	/nfs/dbraw/zinc/63/93/97/361639397.db2.gz	QDZCKNYJVXDXDF-UHFFFAOYSA-N	0	2	298.271	0.650	20	5		CCBDLN
C[C@H](O)CN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@@H](C)CO	ZINC000275947553	193170613	/nfs/dbraw/zinc/17/06/13/193170613.db2.gz	DHXFCPBOSGVEPP-IUCAKERBSA-N	0	2	298.295	0.504	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@@H](F)C[C@H]1CO	ZINC000330601491	203024064	/nfs/dbraw/zinc/02/40/64/203024064.db2.gz	ZEXRDSOWDJTABV-YUMQZZPRSA-N	0	2	284.243	0.845	20	5		CCBDLN
COC(=O)[C@H](CF)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000288246067	197035074	/nfs/dbraw/zinc/03/50/74/197035074.db2.gz	KWFQIMRLGKLYED-ZETCQYMHSA-N	0	2	286.215	0.541	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(n2cncn2)C1	ZINC000364392921	389261547	/nfs/dbraw/zinc/26/15/47/389261547.db2.gz	HLWCPHDVCFJQIB-UHFFFAOYSA-N	0	2	289.251	0.589	20	5		CCBDLN
C[C@H](CO)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000159617298	389370735	/nfs/dbraw/zinc/37/07/35/389370735.db2.gz	JMLWYPPDHODGJA-ZETCQYMHSA-N	0	2	254.242	0.659	20	5		CCBDLN
CN(C)C(=O)CCCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000350069933	389484031	/nfs/dbraw/zinc/48/40/31/389484031.db2.gz	BEHDJCZIVGCKSC-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1C[NH2+]CCO1	ZINC000415091879	389657516	/nfs/dbraw/zinc/65/75/16/389657516.db2.gz	DGOOXDGBHBVVPL-NSHDSACASA-N	0	2	251.286	0.673	20	5		CCBDLN
COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C1CC1	ZINC000436977986	389988960	/nfs/dbraw/zinc/98/89/60/389988960.db2.gz	GDCFZWCMTJIKBO-NSHDSACASA-N	0	2	294.263	0.982	20	5		CCBDLN
CC(=O)N1CC(C(=O)Nc2cc([N+](=O)[O-])ccc2O)C1	ZINC000191939566	130333758	/nfs/dbraw/zinc/33/37/58/130333758.db2.gz	GHPGTIVBIZDFAW-UHFFFAOYSA-N	0	2	279.252	0.717	20	5		CCBDLN
C[C@H]1C(=O)N(C)CCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186840250	299687022	/nfs/dbraw/zinc/68/70/22/299687022.db2.gz	PACVXRKNPXCHIU-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000331317569	296925327	/nfs/dbraw/zinc/92/53/27/296925327.db2.gz	JRXJUYWUBVYTSB-BDAKNGLRSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCc2n[nH]nc2C1	ZINC000353513208	304502167	/nfs/dbraw/zinc/50/21/67/304502167.db2.gz	WJDHZCRWKSSZIU-UHFFFAOYSA-N	0	2	289.251	0.617	20	5		CCBDLN
CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CCC1=O	ZINC000184802801	290308653	/nfs/dbraw/zinc/30/86/53/290308653.db2.gz	XKPODKQPALWWLV-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000195178886	299997398	/nfs/dbraw/zinc/99/73/98/299997398.db2.gz	QXKLANGMQHNQRH-CPCISQLKSA-N	0	2	293.279	0.555	20	5		CCBDLN
C[C@@]1(O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000217316890	581170211	/nfs/dbraw/zinc/17/02/11/581170211.db2.gz	NXXGYRKQMGKLKB-GFCCVEGCSA-N	0	2	266.253	0.897	20	5		CCBDLN
CCONC(=O)CNC(=O)NCc1ccc([N+](=O)[O-])cc1	ZINC000748212764	581966392	/nfs/dbraw/zinc/96/63/92/581966392.db2.gz	SCJUKTNWZGLCBA-UHFFFAOYSA-N	0	2	296.283	0.462	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc(F)cc1[N+](=O)[O-]	ZINC000774969098	582006683	/nfs/dbraw/zinc/00/66/83/582006683.db2.gz	NCGAJDBWIRAYEL-UHFFFAOYSA-N	0	2	282.187	0.915	20	5		CCBDLN
C[C@H]1C[C@@H]1C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750764037	582058498	/nfs/dbraw/zinc/05/84/98/582058498.db2.gz	REYOHZWFCPMBSN-XPUUQOCRSA-N	0	2	285.281	0.451	20	5		CCBDLN
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C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC(=O)[O-]	ZINC000130153180	605805613	/nfs/dbraw/zinc/80/56/13/605805613.db2.gz	NYQFBJNRUNCXDF-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)CC(=O)[O-]	ZINC000130153180	605805615	/nfs/dbraw/zinc/80/56/15/605805615.db2.gz	NYQFBJNRUNCXDF-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
COc1cccnc1N(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841160390	617323274	/nfs/dbraw/zinc/32/32/74/617323274.db2.gz	SSQPRQYKQXKLJG-HTQZYQBOSA-N	0	2	251.242	0.718	20	5		CCBDLN
CC1(C)COC(=O)[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000808106770	614716393	/nfs/dbraw/zinc/71/63/93/614716393.db2.gz	HENNGDFEJBZRTI-SNVBAGLBSA-N	0	2	294.263	0.982	20	5		CCBDLN
COCCc1ccnc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000839761237	616699148	/nfs/dbraw/zinc/69/91/48/616699148.db2.gz	FYPVQHDMQIQLIN-NXEZZACHSA-N	0	2	265.269	0.874	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1c2ccccc2C[C@H]1CO	ZINC000912310477	636550942	/nfs/dbraw/zinc/55/09/42/636550942.db2.gz	XIYVOOPDEGBFTN-HOSYDEDBSA-N	0	2	262.265	0.602	20	5		CCBDLN
COc1nc(O[C@@H](C[N+](=O)[O-])c2cccnc2)cc(=O)[nH]1	ZINC001227000637	805307554	/nfs/dbraw/zinc/30/75/54/805307554.db2.gz	OTZOQDAAFWFNNY-VIFPVBQESA-N	0	2	292.251	0.983	20	5		CCBDLN
COC(=O)[C@@H](C)Oc1nc(SC)[nH]c(=O)c1[N+](=O)[O-]	ZINC001227624563	805373933	/nfs/dbraw/zinc/37/39/33/805373933.db2.gz	ATWPWWFSFQJQKS-SCSAIBSYSA-N	0	2	289.269	0.753	20	5		CCBDLN
O=C(N[C@H]1CCCNC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000064098581	303957992	/nfs/dbraw/zinc/95/79/92/303957992.db2.gz	UEAVZUXCKZJZIO-QMMMGPOBSA-N	0	2	279.252	0.309	20	5		CCBDLN
NC(=O)[C@H]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000600317450	361928332	/nfs/dbraw/zinc/92/83/32/361928332.db2.gz	SOVOBPQGWZZVKY-ZKCHVHJHSA-N	0	2	279.252	0.294	20	5		CCBDLN
C[C@H]1C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000408410289	300526739	/nfs/dbraw/zinc/52/67/39/300526739.db2.gz	NGFZOKSIONUVSO-CBAPKCEASA-N	0	2	266.253	0.896	20	5		CCBDLN
COC(=O)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273170139	192064864	/nfs/dbraw/zinc/06/48/64/192064864.db2.gz	BULREEJIOVRUIT-ZETCQYMHSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[S@@](=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181999988	231830734	/nfs/dbraw/zinc/83/07/34/231830734.db2.gz	GNAPXIXMYHNIOF-LJQANCHMSA-N	0	2	286.309	0.799	20	5		CCBDLN
C[C@@H](O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000127579712	187317081	/nfs/dbraw/zinc/31/70/81/187317081.db2.gz	FYNXJHNRIIQRDH-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
O=C(N[C@H]1C=C[C@@H](CO)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000343833235	137160641	/nfs/dbraw/zinc/16/06/41/137160641.db2.gz	FEMFOXRIMRFJLC-BDAKNGLRSA-N	0	2	278.264	0.967	20	5		CCBDLN
O=C(NC[C@H](O)C1CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000344216953	137184350	/nfs/dbraw/zinc/18/43/50/137184350.db2.gz	JJFSMHCWVYWYFT-NSHDSACASA-N	0	2	266.253	0.801	20	5		CCBDLN
C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1O)S(C)(=O)=O	ZINC000230302989	352110787	/nfs/dbraw/zinc/11/07/87/352110787.db2.gz	IIJZNVDZRAQADY-LURJTMIESA-N	0	2	288.281	0.672	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCCC(=O)N1	ZINC000271490222	191169378	/nfs/dbraw/zinc/16/93/78/191169378.db2.gz	KFNJHHHTYLPPTC-QMMMGPOBSA-N	0	2	279.252	0.908	20	5		CCBDLN
Cc1nnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1C	ZINC000274831086	353165448	/nfs/dbraw/zinc/16/54/48/353165448.db2.gz	ZGTCCAGIAYLENV-UHFFFAOYSA-N	0	2	291.267	0.667	20	5		CCBDLN
CCN(C(=O)c1ccc([N+](=O)[O-])cc1O)[C@H]1CCNC1=O	ZINC000282236538	353406067	/nfs/dbraw/zinc/40/60/67/353406067.db2.gz	RLPOGDVXEIRMQD-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
CCN(CCOCCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000282486109	353428689	/nfs/dbraw/zinc/42/86/89/353428689.db2.gz	MEXLHKWFLKAHNB-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
COC[C@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)OC	ZINC000354727573	356483953	/nfs/dbraw/zinc/48/39/53/356483953.db2.gz	KDWRQBGMFKRFLS-VIFPVBQESA-N	0	2	298.251	0.218	20	5		CCBDLN
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C[C@@H](NC(=O)c1cc(O)ccc1[N+](=O)[O-])C(=O)NCCF	ZINC000355801490	356651274	/nfs/dbraw/zinc/65/12/74/356651274.db2.gz	HOMPLUWIXFBHIV-SSDOTTSWSA-N	0	2	299.258	0.504	20	5		CCBDLN
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C[C@@H]1CO[C@@H](C)CN1CCNc1c([N+](=O)[O-])ncn1C	ZINC000596428124	360891914	/nfs/dbraw/zinc/89/19/14/360891914.db2.gz	HHHZMUIUBFUBNX-ZJUUUORDSA-N	0	2	283.332	0.849	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC[C@@H](O)C1	ZINC000179420108	189193254	/nfs/dbraw/zinc/19/32/54/189193254.db2.gz	BWYQAJBNFYNRRD-SECBINFHSA-N	0	2	266.253	0.897	20	5		CCBDLN
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CCC1(O)CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000597633576	361169453	/nfs/dbraw/zinc/16/94/53/361169453.db2.gz	XWWMUQCPMCJRLB-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
NC(=O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CCC1	ZINC000614003833	364457507	/nfs/dbraw/zinc/45/75/07/364457507.db2.gz	WMSFMMKMFCSKJB-UHFFFAOYSA-N	0	2	279.252	0.438	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC(=O)N(C2CC2)C1	ZINC000279303708	194376023	/nfs/dbraw/zinc/37/60/23/194376023.db2.gz	CLTVYQHOKNAYKH-UHFFFAOYSA-N	0	2	291.263	0.705	20	5		CCBDLN
CC(C)(CC(N)=O)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281312977	195192382	/nfs/dbraw/zinc/19/23/82/195192382.db2.gz	SFVWVHJENBAXGJ-UHFFFAOYSA-N	0	2	281.268	0.684	20	5		CCBDLN
CC[C@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])C(=O)OC	ZINC000281397357	195225663	/nfs/dbraw/zinc/22/56/63/195225663.db2.gz	YHXYGUYTFOUDNQ-QMMMGPOBSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@@H](CO)N(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000185587287	388809217	/nfs/dbraw/zinc/80/92/17/388809217.db2.gz	LMEQJCUKMVZZFE-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
CC(C)(C)NC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184603665	388775578	/nfs/dbraw/zinc/77/55/78/388775578.db2.gz	ZCLUSSZSLJNQDZ-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000186831530	388855931	/nfs/dbraw/zinc/85/59/31/388855931.db2.gz	AIJJBTLLKUMXIV-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
CNC(=O)C[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000323267437	389125027	/nfs/dbraw/zinc/12/50/27/389125027.db2.gz	ZGHRDBXRUYRFFJ-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
O=C(N[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000132881662	389229292	/nfs/dbraw/zinc/22/92/92/389229292.db2.gz	NLGWOVPKWGZCDV-PSASIEDQSA-N	0	2	266.253	0.944	20	5		CCBDLN
C[C@@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2ccccc2C(=O)N1	ZINC000371687333	389436496	/nfs/dbraw/zinc/43/64/96/389436496.db2.gz	YJUKMZUXNLLFKB-HLUHBDAQSA-N	0	2	289.291	0.817	20	5		CCBDLN
C[C@@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000177431819	389584021	/nfs/dbraw/zinc/58/40/21/389584021.db2.gz	GWZMUEBNNSRFHA-GFCCVEGCSA-N	0	2	266.253	0.897	20	5		CCBDLN
CCn1cc(S(=O)(=O)Nc2ncccn2)c([N+](=O)[O-])n1	ZINC000351667770	389652830	/nfs/dbraw/zinc/65/28/30/389652830.db2.gz	LECOHJCLUPMDCL-UHFFFAOYSA-N	0	2	298.284	0.402	20	5		CCBDLN
Cc1nc(CNC(=O)c2cc([N+](=O)[O-])ccc2O)no1	ZINC000179501416	389658391	/nfs/dbraw/zinc/65/83/91/389658391.db2.gz	OOUNMACKHVCVIV-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
O=C(NCc1cc[nH]n1)c1cc([N+](=O)[O-])ccc1O	ZINC000181882617	389695552	/nfs/dbraw/zinc/69/55/52/389695552.db2.gz	HHHGHQGOVPVZPO-UHFFFAOYSA-N	0	2	262.225	0.954	20	5		CCBDLN
C[C@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000437004813	389990141	/nfs/dbraw/zinc/99/01/41/389990141.db2.gz	XGEKLUSBMDDZBN-ZCFIWIBFSA-N	0	2	267.241	0.294	20	5		CCBDLN
NC(=O)C1(C(=O)Nc2cc([N+](=O)[O-])ccc2O)CCC1	ZINC000538871152	390200446	/nfs/dbraw/zinc/20/04/46/390200446.db2.gz	QDQVNKUJHLCWPD-UHFFFAOYSA-N	0	2	279.252	0.895	20	5		CCBDLN
CCN(CC(N)=O)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000191810261	130307895	/nfs/dbraw/zinc/30/78/95/130307895.db2.gz	PCKCXYCJIRWJOZ-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
COC[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)OC	ZINC000436887034	397534915	/nfs/dbraw/zinc/53/49/15/397534915.db2.gz	IOHMRAYAVRIERC-VIFPVBQESA-N	0	2	298.251	0.218	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@H](CO)[C@H](O)C1	ZINC000581921519	336166930	/nfs/dbraw/zinc/16/69/30/336166930.db2.gz	DBEOYHNUJJHTBG-BXKDBHETSA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@@H](CO)[C@@H](O)C1	ZINC000581921520	336167042	/nfs/dbraw/zinc/16/70/42/336167042.db2.gz	DBEOYHNUJJHTBG-CABZTGNLSA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(NC[C@H]1CCCC(=O)N1)c1ccc([N+](=O)[O-])cc1O	ZINC000447748358	534634140	/nfs/dbraw/zinc/63/41/40/534634140.db2.gz	XKIUDQYBBILOEF-MRVPVSSYSA-N	0	2	293.279	0.699	20	5		CCBDLN
CCC[C@@H](O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000412534927	529054988	/nfs/dbraw/zinc/05/49/88/529054988.db2.gz	PPNPSXODCWNIHZ-GHMZBOCLSA-N	0	2	298.295	0.552	20	5		CCBDLN
C[C@H]1C[N@H+](Cn2nccc2[N+](=O)[O-])CC[C@H]1NC(=O)[O-]	ZINC000739191793	581520674	/nfs/dbraw/zinc/52/06/74/581520674.db2.gz	QMEYGARIEHIDDE-DTWKUNHWSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@H]1C[N@@H+](Cn2nccc2[N+](=O)[O-])CC[C@H]1NC(=O)[O-]	ZINC000739191793	581520676	/nfs/dbraw/zinc/52/06/76/581520676.db2.gz	QMEYGARIEHIDDE-DTWKUNHWSA-N	0	2	283.288	0.727	20	5		CCBDLN
CC(C)OC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000753819713	581559604	/nfs/dbraw/zinc/55/96/04/581559604.db2.gz	KBXDTDQEBDUYLB-UHFFFAOYSA-N	0	2	282.252	0.982	20	5		CCBDLN
O=C(N[C@H](CO)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000773589892	581935245	/nfs/dbraw/zinc/93/52/45/581935245.db2.gz	RMNDEMMUJPBCKT-SNVBAGLBSA-N	0	2	266.253	0.801	20	5		CCBDLN
Cc1nn(C[N@@H+]2CC[C@H](CNC(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920825	605750802	/nfs/dbraw/zinc/75/08/02/605750802.db2.gz	NQBYQKVMRMTCPU-SECBINFHSA-N	0	2	283.288	0.647	20	5		CCBDLN
Cc1nn(C[N@H+]2CC[C@H](CNC(=O)[O-])C2)cc1[N+](=O)[O-]	ZINC000833920825	605750806	/nfs/dbraw/zinc/75/08/06/605750806.db2.gz	NQBYQKVMRMTCPU-SECBINFHSA-N	0	2	283.288	0.647	20	5		CCBDLN
C[C@H]1Cn2nccc2N(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C1	ZINC000893880567	631479954	/nfs/dbraw/zinc/47/99/54/631479954.db2.gz	JWIWAPUJELBBRH-IWSPIJDZSA-N	0	2	250.258	0.531	20	5		CCBDLN
Cc1cccc(N(CCC(N)=O)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c1	ZINC000840303869	641048085	/nfs/dbraw/zinc/04/80/85/641048085.db2.gz	FRUNMQUVTWLNAF-VXGBXAGGSA-N	0	2	291.307	0.869	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H](CO)Cc2ccccc21	ZINC000840461413	641581400	/nfs/dbraw/zinc/58/14/00/641581400.db2.gz	DCTORYNSRSVRNI-IRUJWGPZSA-N	0	2	276.292	0.849	20	5		CCBDLN
O=C(Nc1ccnn1C1CCOCC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000889905535	648258818	/nfs/dbraw/zinc/25/88/18/648258818.db2.gz	NOSSGJZCONRONX-NXEZZACHSA-N	0	2	280.284	0.838	20	5		CCBDLN
Cn1c(=O)[nH]cc1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC001138013762	799697950	/nfs/dbraw/zinc/69/79/50/799697950.db2.gz	VIKDJLKFOKELEA-UHFFFAOYSA-N	0	2	278.224	0.992	20	5		CCBDLN
COCCc1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n(C)n1	ZINC001266106785	809936671	/nfs/dbraw/zinc/93/66/71/809936671.db2.gz	FMGOBJNTXIEIAT-RKDXNWHRSA-N	0	2	268.273	0.213	20	5		CCBDLN
Cc1ccc2n[nH]nc2c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001180764581	843295446	/nfs/dbraw/zinc/29/54/46/843295446.db2.gz	GSXWHLCMMXHBIN-HTRCEHHLSA-N	0	2	261.241	0.870	20	5		CCBDLN
Cc1ccc2[nH]nnc2c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001180764581	843295453	/nfs/dbraw/zinc/29/54/53/843295453.db2.gz	GSXWHLCMMXHBIN-HTRCEHHLSA-N	0	2	261.241	0.870	20	5		CCBDLN
NC(=O)CONC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1	ZINC001295744758	906795649	/nfs/dbraw/zinc/79/56/49/906795649.db2.gz	FPXGHKNXIQVUNI-UHFFFAOYSA-N	0	2	293.279	0.550	20	5		CCBDLN
C[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1nnnn1C	ZINC001336717946	920950169	/nfs/dbraw/zinc/95/01/69/920950169.db2.gz	YFPJUUTVMPQDPW-ZCFIWIBFSA-N	0	2	292.255	0.315	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC001445414463	930128261	/nfs/dbraw/zinc/12/82/61/930128261.db2.gz	NNEMHNAZXSVQST-UHFFFAOYSA-N	0	2	291.267	0.965	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@H](O)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000228608967	960029848	/nfs/dbraw/zinc/02/98/48/960029848.db2.gz	SCOISFSSGQJITG-QWRGUYRKSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@H](O)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000228608967	960029854	/nfs/dbraw/zinc/02/98/54/960029854.db2.gz	SCOISFSSGQJITG-QWRGUYRKSA-N	0	2	266.253	0.615	20	5		CCBDLN
CS(=O)(=O)CCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000273174209	192065183	/nfs/dbraw/zinc/06/51/83/192065183.db2.gz	FQTUACHUOJOAIJ-UHFFFAOYSA-N	0	2	288.281	0.674	20	5		CCBDLN
COC(=O)c1ccc([N+](=O)[O-])c(Sc2n[nH]c(=O)[nH]2)n1	ZINC000343085184	137114100	/nfs/dbraw/zinc/11/41/00/137114100.db2.gz	BDHBPHDHLUKUPY-UHFFFAOYSA-N	0	2	297.252	0.751	20	5		CCBDLN
C[C@H](C(=O)[O-])[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000054069592	348540484	/nfs/dbraw/zinc/54/04/84/348540484.db2.gz	FUBGRQVWPVSLED-MRVPVSSYSA-N	0	2	281.268	0.938	20	5		CCBDLN
C[C@H](C(=O)[O-])[N@@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000054069592	348540492	/nfs/dbraw/zinc/54/04/92/348540492.db2.gz	FUBGRQVWPVSLED-MRVPVSSYSA-N	0	2	281.268	0.938	20	5		CCBDLN
CNC(=O)[C@@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000132496850	350309593	/nfs/dbraw/zinc/30/95/93/350309593.db2.gz	VMEQQGKUDWCRNR-ZCFIWIBFSA-N	0	2	267.241	0.165	20	5		CCBDLN
CCN(CCO)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181873691	351340748	/nfs/dbraw/zinc/34/07/48/351340748.db2.gz	CPXIWUNRPFHIHS-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
O=C(Nc1nn[nH]n1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000356340184	304019802	/nfs/dbraw/zinc/01/98/02/304019802.db2.gz	MUCBDGKFEWECMU-UHFFFAOYSA-N	0	2	250.174	0.066	20	5		CCBDLN
CNC(=O)C1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000187544920	351546348	/nfs/dbraw/zinc/54/63/48/351546348.db2.gz	VSBPOCKNHHZEKA-UHFFFAOYSA-N	0	2	279.252	0.118	20	5		CCBDLN
C[C@H]1C(=O)N(C)CCN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000186842136	351518136	/nfs/dbraw/zinc/51/81/36/351518136.db2.gz	ZIXUXRYBHHPNFY-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(NCCCCO)c1ccc([N+](=O)[O-])c(O)c1	ZINC000194980091	351892723	/nfs/dbraw/zinc/89/27/23/351892723.db2.gz	HZBIGTUEGNJFLT-UHFFFAOYSA-N	0	2	254.242	0.803	20	5		CCBDLN
C[C@@H](CC(N)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000231676938	352132286	/nfs/dbraw/zinc/13/22/86/352132286.db2.gz	XOZJGNYAMLRNAJ-LURJTMIESA-N	0	2	267.241	0.294	20	5		CCBDLN
CCNC(=O)[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272355374	353055496	/nfs/dbraw/zinc/05/54/96/353055496.db2.gz	LQBSFQNTLNFVCK-SSDOTTSWSA-N	0	2	281.268	0.555	20	5		CCBDLN
O=C(NCCCOCCO)c1cc([N+](=O)[O-])ccc1O	ZINC000272962279	353109203	/nfs/dbraw/zinc/10/92/03/353109203.db2.gz	JUXGQCCJRJDYGB-UHFFFAOYSA-N	0	2	284.268	0.429	20	5		CCBDLN
CC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157444012	188317488	/nfs/dbraw/zinc/31/74/88/188317488.db2.gz	BHJFYWPGMMDGPG-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
CNC(=O)[C@@H]1CCCN1C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280766867	353381935	/nfs/dbraw/zinc/38/19/35/353381935.db2.gz	BLHXNQHJGBPPLN-VIFPVBQESA-N	0	2	293.279	0.651	20	5		CCBDLN
CCN(C)C(=O)[C@@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000283445038	353508952	/nfs/dbraw/zinc/50/89/52/353508952.db2.gz	NNBXNZJMVYMVEG-MRVPVSSYSA-N	0	2	295.295	0.897	20	5		CCBDLN
COC1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000310827315	354192460	/nfs/dbraw/zinc/19/24/60/354192460.db2.gz	YDNHEQBADHYINO-UHFFFAOYSA-N	0	2	252.226	0.771	20	5		CCBDLN
COc1ccc(CC(=O)N=c2cccn[nH]2)cc1[N+](=O)[O-]	ZINC000609860866	363521574	/nfs/dbraw/zinc/52/15/74/363521574.db2.gz	AZCHPEBMQYGHBD-UHFFFAOYSA-N	0	2	288.263	0.997	20	5		CCBDLN
COC(=O)[C@@H](CF)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000360479898	357022393	/nfs/dbraw/zinc/02/23/93/357022393.db2.gz	RYQKEIFDRKTZRR-MRVPVSSYSA-N	0	2	286.215	0.541	20	5		CCBDLN
CCn1cc(CNC(=O)c2cc(O)ccc2[N+](=O)[O-])nn1	ZINC000404477341	357822346	/nfs/dbraw/zinc/82/23/46/357822346.db2.gz	YHSBCQYIZQDUJJ-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
O=C(N[C@@H](CO)CCF)c1cccc(O)c1[N+](=O)[O-]	ZINC000593862172	360179412	/nfs/dbraw/zinc/17/94/12/360179412.db2.gz	UOUVHUQCCCQHAV-SSDOTTSWSA-N	0	2	272.232	0.751	20	5		CCBDLN
C[C@H](CC(=O)Nc1cc([N+](=O)[O-])ccc1O)NC(N)=O	ZINC000594337505	360275772	/nfs/dbraw/zinc/27/57/72/360275772.db2.gz	WIDJOLQUHKXXFR-ZCFIWIBFSA-N	0	2	282.256	0.686	20	5		CCBDLN
CCn1cc(CNC(=O)c2cccc(O)c2[N+](=O)[O-])nn1	ZINC000598141186	361343680	/nfs/dbraw/zinc/34/36/80/361343680.db2.gz	VGUWYJCBKIZXIB-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
CN1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CCC1=O	ZINC000598293628	361382043	/nfs/dbraw/zinc/38/20/43/361382043.db2.gz	HKMHEHVFUBKBSO-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CN1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])CCC1=O	ZINC000598298079	361384424	/nfs/dbraw/zinc/38/44/24/361384424.db2.gz	ZGJXOCGUUQRNAO-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
COc1cc(NCc2n[nH]c(=O)[nH]2)c(F)cc1[N+](=O)[O-]	ZINC000301938041	201267756	/nfs/dbraw/zinc/26/77/56/201267756.db2.gz	UJKMFULSIIUXBR-UHFFFAOYSA-N	0	2	283.219	0.766	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC[C@@H]1CO	ZINC000281256910	195170517	/nfs/dbraw/zinc/17/05/17/195170517.db2.gz	OQZKOUQQCLZPFI-MRVPVSSYSA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(N[C@H](CO)[C@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355457131	389080697	/nfs/dbraw/zinc/08/06/97/389080697.db2.gz	NVFFUYQGIRGTKI-ZYHUDNBSSA-N	0	2	296.279	0.570	20	5		CCBDLN
CC(C)N(CC(N)=O)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000232637740	389162990	/nfs/dbraw/zinc/16/29/90/389162990.db2.gz	BGNRELXWQOKREO-UHFFFAOYSA-N	0	2	281.268	0.636	20	5		CCBDLN
CN(C)C(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272386308	389467495	/nfs/dbraw/zinc/46/74/95/389467495.db2.gz	TXUYALDOWOEKPZ-UHFFFAOYSA-N	0	2	281.268	0.461	20	5		CCBDLN
CN1CCc2nc(NC(=O)[C@@H]3C[C@H]3[N+](=O)[O-])sc2C1	ZINC000371436298	389432013	/nfs/dbraw/zinc/43/20/13/389432013.db2.gz	YBYBGJFFIVLPAS-HTRCEHHLSA-N	0	2	282.325	0.735	20	5		CCBDLN
CS(=O)(=O)Cc1noc(-c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000350637537	389526288	/nfs/dbraw/zinc/52/62/88/389526288.db2.gz	OZAIMGHMFFDQAG-UHFFFAOYSA-N	0	2	299.264	0.895	20	5		CCBDLN
Cc1cc(NCCc2nc(N)no2)ncc1[N+](=O)[O-]	ZINC000444069134	389889610	/nfs/dbraw/zinc/88/96/10/389889610.db2.gz	GPXOCEPGCVSWPN-UHFFFAOYSA-N	0	2	264.245	0.170	20	5		CCBDLN
Cc1cc([N+](=O)[O-])cnc1NCCc1nc(N)no1	ZINC000433439777	389913512	/nfs/dbraw/zinc/91/35/12/389913512.db2.gz	NBSGYFAXZNIZJZ-UHFFFAOYSA-N	0	2	264.245	0.170	20	5		CCBDLN
CCNC(=O)C(C)(C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000457307902	390038374	/nfs/dbraw/zinc/03/83/74/390038374.db2.gz	WOBDZVMHEDXKLC-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
CO[C@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1	ZINC000436619536	389980406	/nfs/dbraw/zinc/98/04/06/389980406.db2.gz	POLIZRKAKJDGCK-ZDUSSCGKSA-N	0	2	296.279	0.836	20	5		CCBDLN
CO[C@@]1(CNC(=O)c2cc([N+](=O)[O-])ccc2O)CCOC1	ZINC000436619535	389980564	/nfs/dbraw/zinc/98/05/64/389980564.db2.gz	POLIZRKAKJDGCK-CYBMUJFWSA-N	0	2	296.279	0.836	20	5		CCBDLN
C[C@@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436891584	389986648	/nfs/dbraw/zinc/98/66/48/389986648.db2.gz	HAPGWCQWNPNSOM-VXNVDRBHSA-N	0	2	266.253	0.896	20	5		CCBDLN
O=C(NCCOCCO)c1cc([N+](=O)[O-])ccc1O	ZINC000436955712	389987562	/nfs/dbraw/zinc/98/75/62/389987562.db2.gz	LUSROCCLBMUEPQ-UHFFFAOYSA-N	0	2	270.241	0.039	20	5		CCBDLN
COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C1CC1	ZINC000436977968	389989108	/nfs/dbraw/zinc/98/91/08/389989108.db2.gz	GDCFZWCMTJIKBO-LLVKDONJSA-N	0	2	294.263	0.982	20	5		CCBDLN
O=C([O-])c1cnc(N2CCn3c[nH+]cc3C2)c([N+](=O)[O-])c1	ZINC000565717967	390538465	/nfs/dbraw/zinc/53/84/65/390538465.db2.gz	BILUVXWXBFUGAM-UHFFFAOYSA-N	0	2	289.251	0.905	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC(=O)N1C	ZINC000330630829	296914681	/nfs/dbraw/zinc/91/46/81/296914681.db2.gz	DPBNOYDMCKXJHK-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
NC(=O)c1cc(NC(=O)c2ccc(O)c([N+](=O)[O-])c2)n[nH]1	ZINC000612555366	420495450	/nfs/dbraw/zinc/49/54/50/420495450.db2.gz	YTWSFKDYGAJUPF-UHFFFAOYSA-N	0	2	291.223	0.375	20	5		CCBDLN
NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000026536759	262365222	/nfs/dbraw/zinc/36/52/22/262365222.db2.gz	PDBMZENTRSXGJT-UHFFFAOYSA-N	0	2	293.279	0.638	20	5		CCBDLN
C[C@@]1(O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000416281561	297925856	/nfs/dbraw/zinc/92/58/56/297925856.db2.gz	HYIBPZXAFVILNC-LYWQIFSTSA-N	0	2	266.253	0.944	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC(=O)N1	ZINC000297049330	300197973	/nfs/dbraw/zinc/19/79/73/300197973.db2.gz	OUNLEWCPOSDMKM-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
NC(=O)[C@H]1CCCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181875039	303326322	/nfs/dbraw/zinc/32/63/22/303326322.db2.gz	JDCCLRJQAIRQPO-SNVBAGLBSA-N	0	2	293.279	0.780	20	5		CCBDLN
COC(=O)NCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000308179853	534118944	/nfs/dbraw/zinc/11/89/44/534118944.db2.gz	NWLDPZOBPXNRIS-UHFFFAOYSA-N	0	2	283.240	0.386	20	5		CCBDLN
CN(CCC(N)=O)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000343478121	536319233	/nfs/dbraw/zinc/31/92/33/536319233.db2.gz	IIAYBFBHXLWBDQ-UHFFFAOYSA-N	0	2	267.241	0.248	20	5		CCBDLN
C[C@H]1C[C@H]1C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750764030	582058512	/nfs/dbraw/zinc/05/85/12/582058512.db2.gz	REYOHZWFCPMBSN-POYBYMJQSA-N	0	2	285.281	0.451	20	5		CCBDLN
CCOC(=O)c1c[nH]c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000841222512	615188092	/nfs/dbraw/zinc/18/80/92/615188092.db2.gz	YKZFFYFAVWWPSB-IYSWYEEDSA-N	0	2	268.229	0.190	20	5		CCBDLN
CCOC(=O)c1c[nH]c(NC(=O)[C@@H]2CC2[N+](=O)[O-])n1	ZINC000841222512	615188093	/nfs/dbraw/zinc/18/80/93/615188093.db2.gz	YKZFFYFAVWWPSB-IYSWYEEDSA-N	0	2	268.229	0.190	20	5		CCBDLN
CON1CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000854855876	617090461	/nfs/dbraw/zinc/09/04/61/617090461.db2.gz	JETJRGUDIQTQSV-UHFFFAOYSA-N	0	2	281.268	0.620	20	5		CCBDLN
O=C(NOC[C@@H]1CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000803171512	640719925	/nfs/dbraw/zinc/71/99/25/640719925.db2.gz	YKIZWKZOEGYZSI-MRVPVSSYSA-N	0	2	282.252	0.998	20	5		CCBDLN
CSc1nc(OC2COC2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625303	805374802	/nfs/dbraw/zinc/37/48/02/805374802.db2.gz	VOOMMTZQYRJDIC-UHFFFAOYSA-N	0	2	259.243	0.590	20	5		CCBDLN
CNC(=O)c1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc1	ZINC001269082666	813208949	/nfs/dbraw/zinc/20/89/49/813208949.db2.gz	PGCLQBXQOXQPRG-HTQZYQBOSA-N	0	2	264.241	0.045	20	5		CCBDLN
COC(=O)[C@H](C)N(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600317886	361929608	/nfs/dbraw/zinc/92/96/08/361929608.db2.gz	PLBYWKOUWCXTJF-ZETCQYMHSA-N	0	2	282.252	0.934	20	5		CCBDLN
CC[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)OC	ZINC000273171223	192064662	/nfs/dbraw/zinc/06/46/62/192064662.db2.gz	DWYSWRBAEYQFIN-SECBINFHSA-N	0	2	282.252	0.982	20	5		CCBDLN
C[C@@H](O)CN1N=C(c2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000601943227	362431680	/nfs/dbraw/zinc/43/16/80/362431680.db2.gz	BVYXFERYZLQZGX-MRVPVSSYSA-N	0	2	263.253	0.912	20	5		CCBDLN
C[C@@H](O)Cn1[nH]c(-c2ccc([N+](=O)[O-])cc2)cc1=O	ZINC000601943227	362431688	/nfs/dbraw/zinc/43/16/88/362431688.db2.gz	BVYXFERYZLQZGX-MRVPVSSYSA-N	0	2	263.253	0.912	20	5		CCBDLN
C[C@H](C(=O)Nc1ccc(O)c([N+](=O)[O-])c1)N1CCOCC1	ZINC000361654681	232180064	/nfs/dbraw/zinc/18/00/64/232180064.db2.gz	LYBFFGCMNHGMQO-SECBINFHSA-N	0	2	295.295	0.960	20	5		CCBDLN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NOCC(N)=O	ZINC000271335286	191080168	/nfs/dbraw/zinc/08/01/68/191080168.db2.gz	BPVFQISOIZLFFE-SSDOTTSWSA-N	0	2	299.308	0.609	20	5		CCBDLN
CC(C)(C)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000181987504	351343339	/nfs/dbraw/zinc/34/33/39/351343339.db2.gz	JVSBRRXFASEAGF-JTQLQIEISA-N	0	2	295.295	0.930	20	5		CCBDLN
CNC(=O)[C@H](C)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234339023	352156761	/nfs/dbraw/zinc/15/67/61/352156761.db2.gz	RDPFIOLPWGWLSE-LURJTMIESA-N	0	2	267.241	0.165	20	5		CCBDLN
COC(=O)[C@H](C)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272473619	353067439	/nfs/dbraw/zinc/06/74/39/353067439.db2.gz	ZOKYMJTUDDYDKD-SSDOTTSWSA-N	0	2	282.252	0.839	20	5		CCBDLN
Cn1cnnc1CCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000274884916	353170285	/nfs/dbraw/zinc/17/02/85/353170285.db2.gz	PUCZBGYHJKLWQY-UHFFFAOYSA-N	0	2	291.267	0.401	20	5		CCBDLN
O=C(NC1(CO)CCOCC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274762705	353160361	/nfs/dbraw/zinc/16/03/61/353160361.db2.gz	HAJFNBVXWBXEEN-UHFFFAOYSA-N	0	2	296.279	0.572	20	5		CCBDLN
CCOC(=O)NCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000275076724	353183142	/nfs/dbraw/zinc/18/31/42/353183142.db2.gz	CVFUTCVVPVEMQS-UHFFFAOYSA-N	0	2	283.240	0.985	20	5		CCBDLN
Cc1cccc([N+](=O)[O-])c1C(=O)NN1CC(=O)N(C)C1=O	ZINC000278448183	353301133	/nfs/dbraw/zinc/30/11/33/353301133.db2.gz	FYFKKZFDWWMHMR-UHFFFAOYSA-N	0	2	292.251	0.442	20	5		CCBDLN
CC(C)[C@@](C)(NC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000287962306	353678766	/nfs/dbraw/zinc/67/87/66/353678766.db2.gz	QZSUFFHMJQPBOZ-CYBMUJFWSA-N	0	2	295.295	0.930	20	5		CCBDLN
O=C(NCCCOCCO)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354650357	356464754	/nfs/dbraw/zinc/46/47/54/356464754.db2.gz	QRSQAYRULXCLSA-UHFFFAOYSA-N	0	2	284.268	0.429	20	5		CCBDLN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2O)nn1C	ZINC000436689655	358236897	/nfs/dbraw/zinc/23/68/97/358236897.db2.gz	WTWYHWOYISQWTQ-UHFFFAOYSA-N	0	2	277.240	0.990	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])c(C(=O)N=c2cc(C(N)=O)[nH][nH]2)c1	ZINC000611141584	363664419	/nfs/dbraw/zinc/66/44/19/363664419.db2.gz	MYYWHYZIMUBEBO-UHFFFAOYSA-N	0	2	289.251	0.399	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1C[C@@H]2C[C@H]1C[S@]2=O	ZINC000593876784	360189303	/nfs/dbraw/zinc/18/93/03/360189303.db2.gz	DSSVJPFMMWFPAP-DDIDRBJESA-N	0	2	296.304	0.646	20	5		CCBDLN
O=C(C[C@@H]1CC(=O)N1)Nc1cc([N+](=O)[O-])ccc1O	ZINC000597441340	361095759	/nfs/dbraw/zinc/09/57/59/361095759.db2.gz	GROGSZMAHMEKSV-LURJTMIESA-N	0	2	265.225	0.518	20	5		CCBDLN
CCNC(=O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000598063568	361330337	/nfs/dbraw/zinc/33/03/37/361330337.db2.gz	BAHGOCTWXGJTMG-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
CC(=O)c1ccc(NCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000301584742	201080953	/nfs/dbraw/zinc/08/09/53/201080953.db2.gz	UVBZHVHZRDUHSU-UHFFFAOYSA-N	0	2	277.240	0.821	20	5		CCBDLN
O=C(NC[C@@H]1CCC(=O)N1)c1cc([N+](=O)[O-])ccc1O	ZINC000598299896	361384028	/nfs/dbraw/zinc/38/40/28/361384028.db2.gz	VOLYVXPFKDWICO-ZETCQYMHSA-N	0	2	279.252	0.309	20	5		CCBDLN
O=C(N[C@H]1C[C@H](O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC000598528363	361438884	/nfs/dbraw/zinc/43/88/84/361438884.db2.gz	QSIOXDKINOMPMK-FKQCQYRASA-N	0	2	252.226	0.554	20	5		CCBDLN
COc1cc(NCc2n[nH]c(=O)[nH]2)c([N+](=O)[O-])cc1F	ZINC000301779909	201191499	/nfs/dbraw/zinc/19/14/99/201191499.db2.gz	MWGGCIKKPSYTPK-UHFFFAOYSA-N	0	2	283.219	0.766	20	5		CCBDLN
Cn1nncc1S(=O)(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000616175447	365202726	/nfs/dbraw/zinc/20/27/26/365202726.db2.gz	AKUDTWRCGJQGSD-UHFFFAOYSA-N	0	2	283.269	0.524	20	5		CCBDLN
O=C(NOC[C@@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000276299718	193276148	/nfs/dbraw/zinc/27/61/48/193276148.db2.gz	AECYCCGXMDYKCT-MRVPVSSYSA-N	0	2	282.252	0.998	20	5		CCBDLN
C[C@@H]1C(=O)NCCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000104890353	296261868	/nfs/dbraw/zinc/26/18/68/296261868.db2.gz	MEIIRCJLPBVTKA-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN(C)C(=O)CCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000194673721	284932391	/nfs/dbraw/zinc/93/23/91/284932391.db2.gz	OTHZMVWLTJXRFQ-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CCOC1=O	ZINC000292459205	388950596	/nfs/dbraw/zinc/95/05/96/388950596.db2.gz	LQKOQAFMHPEWTO-GFCCVEGCSA-N	0	2	280.236	0.736	20	5		CCBDLN
O=C(N[C@@H](CO)[C@@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355457129	389080763	/nfs/dbraw/zinc/08/07/63/389080763.db2.gz	NVFFUYQGIRGTKI-JQWIXIFHSA-N	0	2	296.279	0.570	20	5		CCBDLN
CC(C)(NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000132750042	389227251	/nfs/dbraw/zinc/22/72/51/389227251.db2.gz	DOIHJLAHZKSSJB-UHFFFAOYSA-N	0	2	267.241	0.294	20	5		CCBDLN
C[C@H]1OCC[C@@]1(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000279503276	389583463	/nfs/dbraw/zinc/58/34/63/389583463.db2.gz	NZWLBSXTYCLRHA-AMIZOPFISA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@@]1(O)C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000416276644	389723376	/nfs/dbraw/zinc/72/33/76/389723376.db2.gz	NGUGKDWQJKODMM-OGXFKERWSA-N	0	2	266.253	0.944	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@](F)(CO)C1	ZINC000436719035	389983494	/nfs/dbraw/zinc/98/34/94/389983494.db2.gz	YOPNVQMXPXNHDD-LBPRGKRZSA-N	0	2	284.243	0.847	20	5		CCBDLN
CN(CCCO)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000281702991	195344959	/nfs/dbraw/zinc/34/49/59/195344959.db2.gz	FONNPGBRVWUNNW-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000592903309	390365142	/nfs/dbraw/zinc/36/51/42/390365142.db2.gz	URKFKCOCWMLIJO-SSDOTTSWSA-N	0	2	279.252	0.561	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1COC(=O)N1	ZINC000496259881	390329773	/nfs/dbraw/zinc/32/97/73/390329773.db2.gz	BNRBEKKCNVWRCM-ZETCQYMHSA-N	0	2	267.197	0.347	20	5		CCBDLN
COc1c(C(=O)N=c2ccc(=O)[nH][nH]2)cccc1[N+](=O)[O-]	ZINC000361880045	533387941	/nfs/dbraw/zinc/38/79/41/533387941.db2.gz	KFQKJETUFXOWPU-UHFFFAOYSA-N	0	2	290.235	0.773	20	5		CCBDLN
CNC(=O)CCCN(C)C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000159383991	290379779	/nfs/dbraw/zinc/37/97/79/290379779.db2.gz	UBELQQFEYULDPL-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
C[C@]1(O)CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000187692146	300849820	/nfs/dbraw/zinc/84/98/20/300849820.db2.gz	URRBWDPQQQZMSA-LBPRGKRZSA-N	0	2	266.253	0.897	20	5		CCBDLN
Cc1c(S(=O)(=O)Nc2ccncc2[N+](=O)[O-])cnn1C	ZINC000427757084	533929557	/nfs/dbraw/zinc/92/95/57/533929557.db2.gz	YAFOSTGBFLNCLK-UHFFFAOYSA-N	0	2	297.296	0.254	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N(CCO)C1CC1	ZINC000184642272	526715791	/nfs/dbraw/zinc/71/57/91/526715791.db2.gz	PHAOUMUFYOJDFV-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Nc1cccc([N+](=O)[O-])c1C(=O)OCc1n[nH]c(=O)[nH]1	ZINC000778144378	581143584	/nfs/dbraw/zinc/14/35/84/581143584.db2.gz	URHFUZFLKOETOY-UHFFFAOYSA-N	0	2	279.212	0.358	20	5		CCBDLN
O=C(NCc1nn[nH]n1)C(F)(F)c1ccc([N+](=O)[O-])cc1	ZINC000778268247	581148271	/nfs/dbraw/zinc/14/82/71/581148271.db2.gz	DGGKFVOVBSYIGY-UHFFFAOYSA-N	0	2	298.209	0.516	20	5		CCBDLN
O=C([O-])[C@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000739582482	581600655	/nfs/dbraw/zinc/60/06/55/581600655.db2.gz	FEDWBWNYHDRIEN-QMMMGPOBSA-N	0	2	254.246	0.545	20	5		CCBDLN
O=C([O-])[C@H]1CCC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1	ZINC000739582482	581600657	/nfs/dbraw/zinc/60/06/57/581600657.db2.gz	FEDWBWNYHDRIEN-QMMMGPOBSA-N	0	2	254.246	0.545	20	5		CCBDLN
CSc1nsc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839487281	617287102	/nfs/dbraw/zinc/28/71/02/617287102.db2.gz	KISMFNRBMOWBDI-QWWZWVQMSA-N	0	2	260.300	0.864	20	5		CCBDLN
CN(C[C@@H]1CCC[N@@H+]1Cn1nccc1[N+](=O)[O-])C(=O)[O-]	ZINC000828229725	616137719	/nfs/dbraw/zinc/13/77/19/616137719.db2.gz	HPPAEBQMTLZHJO-VIFPVBQESA-N	0	2	283.288	0.823	20	5		CCBDLN
CN(C[C@@H]1CCC[N@H+]1Cn1nccc1[N+](=O)[O-])C(=O)[O-]	ZINC000828229725	616137720	/nfs/dbraw/zinc/13/77/20/616137720.db2.gz	HPPAEBQMTLZHJO-VIFPVBQESA-N	0	2	283.288	0.823	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H](CO)Cc2cccc(F)c21	ZINC000911686143	636340714	/nfs/dbraw/zinc/34/07/14/636340714.db2.gz	HIICOVCAZNVTLQ-HLUHBDAQSA-N	0	2	294.282	0.989	20	5		CCBDLN
O=C(Nc1cnn(-c2ccccc2)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839718501	640357778	/nfs/dbraw/zinc/35/77/78/640357778.db2.gz	TWQRWJODJOXBPH-NXEZZACHSA-N	0	2	273.252	0.871	20	5		CCBDLN
Cn1c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])nc2cccnc21	ZINC000839728545	640358056	/nfs/dbraw/zinc/35/80/56/640358056.db2.gz	PHJCAFLGJQZPLX-HTRCEHHLSA-N	0	2	261.241	0.572	20	5		CCBDLN
Cn1nc(C2CC2)cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001129209872	819653004	/nfs/dbraw/zinc/65/30/04/819653004.db2.gz	BNEFTIPNGHPPIF-VXNVDRBHSA-N	0	2	250.258	0.901	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)c1nn(C)cc1O	ZINC001304542759	908171307	/nfs/dbraw/zinc/17/13/07/908171307.db2.gz	BAIABRFFFGKJAS-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(NCC1COC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000600572070	362010494	/nfs/dbraw/zinc/01/04/94/362010494.db2.gz	UAUZOFKCWBXNSJ-UHFFFAOYSA-N	0	2	252.226	0.677	20	5		CCBDLN
COC(=O)[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000273267995	192094484	/nfs/dbraw/zinc/09/44/84/192094484.db2.gz	UUCDBCLUFQRRPQ-LURJTMIESA-N	0	2	268.225	0.592	20	5		CCBDLN
Nc1ncncc1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000343805739	137158524	/nfs/dbraw/zinc/15/85/24/137158524.db2.gz	JJFHBHNQORIZTA-UHFFFAOYSA-N	0	2	289.251	0.433	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@H](CO)C1	ZINC000128833530	187393253	/nfs/dbraw/zinc/39/32/53/187393253.db2.gz	KSNMOHVQUMSTFH-QMMMGPOBSA-N	0	2	266.253	0.755	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@H](CO)C1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000346814581	137306056	/nfs/dbraw/zinc/30/60/56/137306056.db2.gz	BTYFMRWHCJFQCO-DTWKUNHWSA-N	0	2	278.264	0.967	20	5		CCBDLN
CNC(=O)[C@@H](C)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000346814399	137306087	/nfs/dbraw/zinc/30/60/87/137306087.db2.gz	WLVOVPUANFEVHL-ZCFIWIBFSA-N	0	2	267.241	0.165	20	5		CCBDLN
O=C(NC[C@@H]1CC[C@@H](CO)O1)c1cccc(O)c1[N+](=O)[O-]	ZINC000349577964	137396387	/nfs/dbraw/zinc/39/63/87/137396387.db2.gz	UGDNNGLLZZNSMI-IUCAKERBSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(NCCCn1cncn1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000068079502	348796615	/nfs/dbraw/zinc/79/66/15/348796615.db2.gz	DXVWSCFJWNJXEI-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
NC(=O)CCCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000075942058	349057571	/nfs/dbraw/zinc/05/75/71/349057571.db2.gz	NODXUNOGVCMWKI-UHFFFAOYSA-N	0	2	267.241	0.296	20	5		CCBDLN
CN(C)C(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000180766496	351291821	/nfs/dbraw/zinc/29/18/21/351291821.db2.gz	QSKZBPWVDUWBBE-UHFFFAOYSA-N	0	2	267.241	0.717	20	5		CCBDLN
C[C@@H](C[S@](C)=O)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316549	351947028	/nfs/dbraw/zinc/94/70/28/351947028.db2.gz	QECCTFNWFZTTPP-IIYDVTGLSA-N	0	2	286.309	0.797	20	5		CCBDLN
Cn1cnnc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000221396929	351977648	/nfs/dbraw/zinc/97/76/48/351977648.db2.gz	FGKGHEIALUIXHI-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
CC[C@@H](C)CONC(=O)Cn1cc([N+](=O)[O-])ccc1=O	ZINC000292203564	198200361	/nfs/dbraw/zinc/20/03/61/198200361.db2.gz	XUVFYCWHSLRTIH-SECBINFHSA-N	0	2	283.284	0.850	20	5		CCBDLN
COC[C@@](C)(CCO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272422972	353062533	/nfs/dbraw/zinc/06/25/33/353062533.db2.gz	QNWSROCIWKHVKW-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
COCC[C@@](C)(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272343570	353054934	/nfs/dbraw/zinc/05/49/34/353054934.db2.gz	AWWAHWVIWPRRSB-CYBMUJFWSA-N	0	2	298.295	0.818	20	5		CCBDLN
O=C(N[C@]1(CCO)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000278017406	353278112	/nfs/dbraw/zinc/27/81/12/353278112.db2.gz	FZRWZYZXENINQL-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
C[S@](=O)C1(CNC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000282130009	353396185	/nfs/dbraw/zinc/39/61/85/353396185.db2.gz	IKWFUXWLFOHOPM-FQEVSTJZSA-N	0	2	298.320	0.941	20	5		CCBDLN
O=C(c1cccc([O-])c1[N+](=O)[O-])N1CC[NH+](CCO)CC1	ZINC000280751745	353380769	/nfs/dbraw/zinc/38/07/69/353380769.db2.gz	AAVDZTSVVMDSPC-UHFFFAOYSA-N	0	2	295.295	0.051	20	5		CCBDLN
COC(=O)[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1O)OC	ZINC000294072153	353865956	/nfs/dbraw/zinc/86/59/56/353865956.db2.gz	QJZWFKNFVSRZOF-SNVBAGLBSA-N	0	2	298.251	0.218	20	5		CCBDLN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)CC(=O)N1	ZINC000296412611	353946780	/nfs/dbraw/zinc/94/67/80/353946780.db2.gz	XMCSOIZSLCQUHY-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C[C@@H](CO)O1	ZINC000331317571	354532611	/nfs/dbraw/zinc/53/26/11/354532611.db2.gz	JRXJUYWUBVYTSB-IUCAKERBSA-N	0	2	296.279	0.522	20	5		CCBDLN
CCn1cc([N+](=O)[O-])c(C(=O)N=c2cc(C)c(C)n[nH]2)n1	ZINC000427603819	235371446	/nfs/dbraw/zinc/37/14/46/235371446.db2.gz	MIQDDAGNFQPBBY-UHFFFAOYSA-N	0	2	290.283	0.892	20	5		CCBDLN
C[C@@H](O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355019794	356552068	/nfs/dbraw/zinc/55/20/68/356552068.db2.gz	QPLQLIWAUDHNRG-SSDOTTSWSA-N	0	2	254.242	0.801	20	5		CCBDLN
NC(=O)[C@H]1CC[C@@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000594337263	360276016	/nfs/dbraw/zinc/27/60/16/360276016.db2.gz	KIGCTHJQLAXGIJ-YUMQZZPRSA-N	0	2	279.252	0.750	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@H]1C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000594337259	360276147	/nfs/dbraw/zinc/27/61/47/360276147.db2.gz	KIGCTHJQLAXGIJ-HTQZYQBOSA-N	0	2	279.252	0.750	20	5		CCBDLN
CC(C)NC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179395521	189191162	/nfs/dbraw/zinc/19/11/62/189191162.db2.gz	KCQRPCBNIMBZDS-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
C[C@H](O)C1(NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000598386040	361401878	/nfs/dbraw/zinc/40/18/78/361401878.db2.gz	ZVNZTZSVGQZMMO-ZETCQYMHSA-N	0	2	266.253	0.944	20	5		CCBDLN
O=C(NCc1cn[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC000613981183	364454094	/nfs/dbraw/zinc/45/40/94/364454094.db2.gz	UAWBAMJUUPTMMF-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
O=C(NCc1c[nH]nn1)c1ccc([N+](=O)[O-])cc1O	ZINC000613981183	364454099	/nfs/dbraw/zinc/45/40/99/364454099.db2.gz	UAWBAMJUUPTMMF-UHFFFAOYSA-N	0	2	263.213	0.349	20	5		CCBDLN
C[C@H](O)CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H](C)CO	ZINC000276080442	193206978	/nfs/dbraw/zinc/20/69/78/193206978.db2.gz	WVLOUTWGKCHMNV-IUCAKERBSA-N	0	2	298.295	0.504	20	5		CCBDLN
O=C(NCC1(O)CCC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000332464613	204724482	/nfs/dbraw/zinc/72/44/82/204724482.db2.gz	KEPAPBCSBKHTCE-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
COC(=O)C1(C)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000425158178	533183551	/nfs/dbraw/zinc/18/35/51/533183551.db2.gz	DDZULNCKMAPFIP-UHFFFAOYSA-N	0	2	294.263	0.936	20	5		CCBDLN
COC(=O)[C@@H](C)N(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000281458388	195247636	/nfs/dbraw/zinc/24/76/36/195247636.db2.gz	BWQZPZKRLVUOIE-SSDOTTSWSA-N	0	2	282.252	0.934	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])c(O)c1)C(=O)NCCF	ZINC000282646377	388755747	/nfs/dbraw/zinc/75/57/47/388755747.db2.gz	XLCNVARCCFUSRA-ZETCQYMHSA-N	0	2	299.258	0.504	20	5		CCBDLN
COCC[C@@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000281835300	389626006	/nfs/dbraw/zinc/62/60/06/389626006.db2.gz	YEUHWPUVGYWBLO-QMMMGPOBSA-N	0	2	284.268	0.428	20	5		CCBDLN
CCC[C@@H](O)[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000414024423	389595126	/nfs/dbraw/zinc/59/51/26/389595126.db2.gz	UCVPRDFHYBRVKQ-CMPLNLGQSA-N	0	2	298.295	0.552	20	5		CCBDLN
O=C(NCC(F)F)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000444328050	389901850	/nfs/dbraw/zinc/90/18/50/389901850.db2.gz	HDHQFDGKCOBXSH-UHFFFAOYSA-N	0	2	289.194	0.620	20	5		CCBDLN
Cn1cc([N+](=O)[O-])cc1C(=O)N=c1nc2n([nH]1)CCCC2	ZINC000572577825	390790097	/nfs/dbraw/zinc/79/00/97/390790097.db2.gz	IKBYSGHPWNBDNA-UHFFFAOYSA-N	0	2	290.283	0.535	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC[C@H](O)C1	ZINC000236554147	304501291	/nfs/dbraw/zinc/50/12/91/304501291.db2.gz	QNWUKXFOECXCFH-VIFPVBQESA-N	0	2	266.253	0.897	20	5		CCBDLN
C[C@@H](CO)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000184877758	524773583	/nfs/dbraw/zinc/77/35/83/524773583.db2.gz	PHDLBHGVVJDMTH-SSDOTTSWSA-N	0	2	254.242	0.659	20	5		CCBDLN
O=C(Nc1cncnc1-n1cccn1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000366546981	527483363	/nfs/dbraw/zinc/48/33/63/527483363.db2.gz	YJNIQEGYRSFMOP-VXNVDRBHSA-N	0	2	274.240	0.266	20	5		CCBDLN
O=C(NCC1OCCCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000788164302	581484723	/nfs/dbraw/zinc/48/47/23/581484723.db2.gz	XVPXPYQSYCGWBZ-UHFFFAOYSA-N	0	2	282.252	0.793	20	5		CCBDLN
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C)CC(=O)[O-]	ZINC000739871825	581630850	/nfs/dbraw/zinc/63/08/50/581630850.db2.gz	NMRVTZIJBZVFTJ-UHFFFAOYSA-N	0	2	297.267	0.558	20	5		CCBDLN
COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)CC(=O)[O-]	ZINC000739871825	581630852	/nfs/dbraw/zinc/63/08/52/581630852.db2.gz	NMRVTZIJBZVFTJ-UHFFFAOYSA-N	0	2	297.267	0.558	20	5		CCBDLN
COc1cc(=O)[nH]c(O[C@H](C[N+](=O)[O-])C2CC2)n1	ZINC001228919440	805490182	/nfs/dbraw/zinc/49/01/82/805490182.db2.gz	XSINIWUGKVMLQQ-SSDOTTSWSA-N	0	2	255.230	0.625	20	5		CCBDLN
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@@H]1CO	ZINC001171138012	839935132	/nfs/dbraw/zinc/93/51/32/839935132.db2.gz	FTUUDCCKXVHUFS-SNVBAGLBSA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@@H]1CO	ZINC001171138012	839935138	/nfs/dbraw/zinc/93/51/38/839935138.db2.gz	FTUUDCCKXVHUFS-SNVBAGLBSA-N	0	2	295.295	0.049	20	5		CCBDLN
O=C(NCCc1cc[nH]n1)c1ccc([N+](=O)[O-])cc1O	ZINC001176541802	842384067	/nfs/dbraw/zinc/38/40/67/842384067.db2.gz	AUFSREVGACSRSZ-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
C[C@]1(CO)C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001301121003	907955016	/nfs/dbraw/zinc/95/50/16/907955016.db2.gz	AFNRQSBJFMMARH-TVQRCGJNSA-N	0	2	296.279	0.258	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])c(O)c1)N1CCCO1	ZINC000600055763	361856551	/nfs/dbraw/zinc/85/65/51/361856551.db2.gz	OSQBVVDZKWKDKU-UHFFFAOYSA-N	0	2	295.251	0.194	20	5		CCBDLN
C[N@@H+]1CCOC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000600418666	361955691	/nfs/dbraw/zinc/95/56/91/361955691.db2.gz	DUJOLUQOVPJEHN-SNVBAGLBSA-N	0	2	295.295	0.361	20	5		CCBDLN
C[N@H+]1CCOC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])c([O-])c1	ZINC000600418666	361955696	/nfs/dbraw/zinc/95/56/96/361955696.db2.gz	DUJOLUQOVPJEHN-SNVBAGLBSA-N	0	2	295.295	0.361	20	5		CCBDLN
CN(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000120167766	349972498	/nfs/dbraw/zinc/97/24/98/349972498.db2.gz	BJUOCGICXZJNBC-UHFFFAOYSA-N	0	2	267.241	0.118	20	5		CCBDLN
NC(=O)[C@@H]1CCCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000273304387	192106230	/nfs/dbraw/zinc/10/62/30/192106230.db2.gz	VLHAUXMUPYNSLV-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
COC(=O)[C@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)[C@@H]1C	ZINC000346683148	137299187	/nfs/dbraw/zinc/29/91/87/137299187.db2.gz	FWCOGBCDBUPJST-BDAKNGLRSA-N	0	2	282.300	0.712	20	5		CCBDLN
O=C(NN1CCCCC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000171119167	350886821	/nfs/dbraw/zinc/88/68/21/350886821.db2.gz	GLVOBRYDAFKEAU-UHFFFAOYSA-N	0	2	279.252	0.958	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCC(=O)N1	ZINC000221012640	351975839	/nfs/dbraw/zinc/97/58/39/351975839.db2.gz	VVTQHLAJWOSXFY-ZETCQYMHSA-N	0	2	265.225	0.518	20	5		CCBDLN
COC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000280121372	353339561	/nfs/dbraw/zinc/33/95/61/353339561.db2.gz	VUADLQIUJWFDCF-MRVPVSSYSA-N	0	2	270.241	0.038	20	5		CCBDLN
COC(=O)CCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280837427	353386760	/nfs/dbraw/zinc/38/67/60/353386760.db2.gz	UNLMTJZGGHOKTM-UHFFFAOYSA-N	0	2	268.225	0.593	20	5		CCBDLN
C[C@@H](CC(N)=O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000283524198	353514053	/nfs/dbraw/zinc/51/40/53/353514053.db2.gz	SPUXQVNKCXACHO-LURJTMIESA-N	0	2	267.241	0.750	20	5		CCBDLN
C[C@H](CC(N)=O)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000283524200	353514227	/nfs/dbraw/zinc/51/42/27/353514227.db2.gz	SPUXQVNKCXACHO-ZCFIWIBFSA-N	0	2	267.241	0.750	20	5		CCBDLN
CCc1nn(C)c(NCCc2nc(N)no2)c1[N+](=O)[O-]	ZINC000354344684	356395432	/nfs/dbraw/zinc/39/54/32/356395432.db2.gz	WGAKTTSJXMPTNR-UHFFFAOYSA-N	0	2	281.276	0.341	20	5		CCBDLN
Cc1nn(C)cc1S(=O)(=O)Nc1ccncc1[N+](=O)[O-]	ZINC000359419864	356819365	/nfs/dbraw/zinc/81/93/65/356819365.db2.gz	WERWWDIQDJEMFP-UHFFFAOYSA-N	0	2	297.296	0.254	20	5		CCBDLN
O=C(NCCN1CCCC1=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000405828006	357828157	/nfs/dbraw/zinc/82/81/57/357828157.db2.gz	KHHMDDPMTZQSNT-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
COC[C@@H](OC)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000597492227	361113744	/nfs/dbraw/zinc/11/37/44/361113744.db2.gz	XLHYJEQXDUWZDV-SNVBAGLBSA-N	0	2	270.241	0.900	20	5		CCBDLN
CN(C[C@@H]1COCCO1)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000598177881	361348892	/nfs/dbraw/zinc/34/88/92/361348892.db2.gz	VBAICTXEWCSNNY-SNVBAGLBSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(N[C@H]1C[C@H](O)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000598528717	361438792	/nfs/dbraw/zinc/43/87/92/361438792.db2.gz	YZNKNTMGYRKODE-LJGSYFOKSA-N	0	2	252.226	0.554	20	5		CCBDLN
C[C@@H](CO)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280941324	195039089	/nfs/dbraw/zinc/03/90/89/195039089.db2.gz	HUSVZYVJKLNLIK-SSDOTTSWSA-N	0	2	254.242	0.659	20	5		CCBDLN
NC(=O)[C@H]1CCCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000281093438	195101776	/nfs/dbraw/zinc/10/17/76/195101776.db2.gz	FCVZBYLCICHMJO-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
CN(Cc1nncn1C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000288387878	197065053	/nfs/dbraw/zinc/06/50/53/197065053.db2.gz	RTHKFMCJTYVGBU-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
Cn1ncnc1NC(=O)c1ccc(O)c([N+](=O)[O-])c1	ZINC000156690750	389326776	/nfs/dbraw/zinc/32/67/76/389326776.db2.gz	RDYKDOMTNKHLMT-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
CCN1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])CC1=O	ZINC000391569390	389772924	/nfs/dbraw/zinc/77/29/24/389772924.db2.gz	KVZLKGLBYUDNAH-MRVPVSSYSA-N	0	2	293.279	0.651	20	5		CCBDLN
COc1n[nH]c(NC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436892754	389986714	/nfs/dbraw/zinc/98/67/14/389986714.db2.gz	MVVZFHHJICFEPR-UHFFFAOYSA-N	0	2	279.212	0.679	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCn2cnnc2C1	ZINC000436965672	389988584	/nfs/dbraw/zinc/98/85/84/389988584.db2.gz	LJMAYSRLOHACLO-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
CC1(C(N)=O)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000572724744	390799702	/nfs/dbraw/zinc/79/97/02/390799702.db2.gz	WDTZXMOSTAINHF-UHFFFAOYSA-N	0	2	279.252	0.248	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)C1(O)CCOCC1	ZINC000357661062	144110104	/nfs/dbraw/zinc/11/01/04/144110104.db2.gz	QZDBVFYOWDOCKG-UHFFFAOYSA-N	0	2	282.252	0.780	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000195178876	296575373	/nfs/dbraw/zinc/57/53/73/296575373.db2.gz	QXKLANGMQHNQRH-HQJQHLMTSA-N	0	2	293.279	0.555	20	5		CCBDLN
CCO[C@@H]1COC[C@H]1NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000456799828	286232011	/nfs/dbraw/zinc/23/20/11/286232011.db2.gz	BNZRQZWYRITHSG-MWLCHTKSSA-N	0	2	296.279	0.834	20	5		CCBDLN
C[C@@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C(=O)O1	ZINC000288740289	297282338	/nfs/dbraw/zinc/28/23/38/297282338.db2.gz	XFZVVWRCCXICKZ-HTRCEHHLSA-N	0	2	280.236	0.734	20	5		CCBDLN
O=C1N[C@H](c2ccc([N+](=O)[O-])c(O)c2)N2CCSC[C@@H]12	ZINC000270833271	304686187	/nfs/dbraw/zinc/68/61/87/304686187.db2.gz	UCTDMLJMMGXKJS-ONGXEEELSA-N	0	2	295.320	0.846	20	5		CCBDLN
Cn1c(=[NH2+])[n-]nc1SCCn1cc([N+](=O)[O-])cn1	ZINC000576428966	335202456	/nfs/dbraw/zinc/20/24/56/335202456.db2.gz	JQHVRXATFNMSLX-UHFFFAOYSA-N	0	2	269.290	0.125	20	5		CCBDLN
CN(CCOCCO)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000380403106	335981933	/nfs/dbraw/zinc/98/19/33/335981933.db2.gz	DXPVGPFFKQINDI-UHFFFAOYSA-N	0	2	284.268	0.381	20	5		CCBDLN
C[S@](=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779664026	581198375	/nfs/dbraw/zinc/19/83/75/581198375.db2.gz	UIUTWGBWLZQXQP-SFHVURJKSA-N	0	2	272.282	0.409	20	5		CCBDLN
COc1c(C(=O)OCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000796309961	581436657	/nfs/dbraw/zinc/43/66/57/581436657.db2.gz	OAPOBZMEOOKHBJ-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
O=C([O-])[C@H]1CC12CC[NH+](Cn1nccc1[N+](=O)[O-])CC2	ZINC000739537470	581567935	/nfs/dbraw/zinc/56/79/35/581567935.db2.gz	VAIVGYCUMUHWMM-SECBINFHSA-N	0	2	280.284	0.936	20	5		CCBDLN
CN(C[C@H]1CC[N@H+](Cn2cc([N+](=O)[O-])cn2)C1)C(=O)[O-]	ZINC000739665830	581588976	/nfs/dbraw/zinc/58/89/76/581588976.db2.gz	VTKRUFQZQWCFII-SECBINFHSA-N	0	2	283.288	0.681	20	5		CCBDLN
CN(C[C@H]1CC[N@@H+](Cn2cc([N+](=O)[O-])cn2)C1)C(=O)[O-]	ZINC000739665830	581588979	/nfs/dbraw/zinc/58/89/79/581588979.db2.gz	VTKRUFQZQWCFII-SECBINFHSA-N	0	2	283.288	0.681	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000228609820	600138278	/nfs/dbraw/zinc/13/82/78/600138278.db2.gz	NFVWPBNSCVRZGN-KOLCDFICSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@@H]1C[C@@H](O)C[N@@H+]1Cc1ccccc1[N+](=O)[O-]	ZINC000228609820	600138279	/nfs/dbraw/zinc/13/82/79/600138279.db2.gz	NFVWPBNSCVRZGN-KOLCDFICSA-N	0	2	266.253	0.615	20	5		CCBDLN
CC(C)(C)OC(=O)c1n[nH]cc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000862069901	614007165	/nfs/dbraw/zinc/00/71/65/614007165.db2.gz	XQQKOROKVRGHTC-HTRCEHHLSA-N	0	2	296.283	0.969	20	5		CCBDLN
COC(=O)[C@H]1CN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c2ccccc21	ZINC000839680056	616683922	/nfs/dbraw/zinc/68/39/22/616683922.db2.gz	NOBWTKIETARUME-JFGNBEQYSA-N	0	2	290.275	0.955	20	5		CCBDLN
O=C(Nc1ncc(CCO)s1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000854483018	644212234	/nfs/dbraw/zinc/21/22/34/644212234.db2.gz	AAXPAMRRDMFRQM-RNFRBKRXSA-N	0	2	257.271	0.282	20	5		CCBDLN
O=C(NCCNc1cnc([N+](=O)[O-])cn1)C(F)(F)F	ZINC001164246015	802696686	/nfs/dbraw/zinc/69/66/86/802696686.db2.gz	JJOHZMLFMNMYCZ-UHFFFAOYSA-N	0	2	279.178	0.475	20	5		CCBDLN
CSc1nc(OC2CN(C)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625212	805374332	/nfs/dbraw/zinc/37/43/32/805374332.db2.gz	SNBAGTDTMVBKGB-UHFFFAOYSA-N	0	2	272.286	0.505	20	5		CCBDLN
CC(C)(C)OC(=O)c1c[nH]nc1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001299927362	899037005	/nfs/dbraw/zinc/03/70/05/899037005.db2.gz	KWRJWINQUNUDTK-HTRCEHHLSA-N	0	2	296.283	0.969	20	5		CCBDLN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1nnn(C)n1	ZINC001309826100	908476532	/nfs/dbraw/zinc/47/65/32/908476532.db2.gz	IBQVPVZWDUHTTM-UHFFFAOYSA-N	0	2	298.284	0.228	20	5		CCBDLN
CC(=O)NC(C)(C)c1noc([C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC001333200860	918725205	/nfs/dbraw/zinc/72/52/05/918725205.db2.gz	HTRNHRZUAAIJQP-RNFRBKRXSA-N	0	2	254.246	0.573	20	5		CCBDLN
CCn1nncc1CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000600159686	361880839	/nfs/dbraw/zinc/88/08/39/361880839.db2.gz	ZXMQDHARHNESFA-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
CC1(c2nc(=NC(=O)c3cc([N+](=O)[O-])n[nH]3)s[nH]2)CC1	ZINC000600227004	361896633	/nfs/dbraw/zinc/89/66/33/361896633.db2.gz	HRFDPJDSVZCLAU-UHFFFAOYSA-N	0	2	294.296	0.895	20	5		CCBDLN
Cn1cc(C(=O)C(=O)Nc2cc([N+](=O)[O-])ccc2O)cn1	ZINC000180766225	136891784	/nfs/dbraw/zinc/89/17/84/136891784.db2.gz	XBELJRLUQSFLES-UHFFFAOYSA-N	0	2	290.235	0.855	20	5		CCBDLN
COC(=O)[C@@H]1CCN(Cc2c([N+](=O)[O-])ncn2C)[C@@H]1C	ZINC000346683154	137298760	/nfs/dbraw/zinc/29/87/60/137298760.db2.gz	FWCOGBCDBUPJST-RKDXNWHRSA-N	0	2	282.300	0.712	20	5		CCBDLN
CC(=O)N[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000120875401	350010885	/nfs/dbraw/zinc/01/08/85/350010885.db2.gz	FCCYTMGIKYSPBC-LURJTMIESA-N	0	2	267.241	0.764	20	5		CCBDLN
COC(=O)C[C@@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000271281794	191048145	/nfs/dbraw/zinc/04/81/45/191048145.db2.gz	OFMJQXNZMXFDOG-SSDOTTSWSA-N	0	2	282.252	0.982	20	5		CCBDLN
CC(=O)N1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000134336388	350361719	/nfs/dbraw/zinc/36/17/19/350361719.db2.gz	PJTLDVGADRVANA-JTQLQIEISA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCn2cnnc2C1	ZINC000105876500	186082447	/nfs/dbraw/zinc/08/24/47/186082447.db2.gz	NXBKYYVBPWNNAK-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
CNC(=O)[C@H]1CCCN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179490054	351268036	/nfs/dbraw/zinc/26/80/36/351268036.db2.gz	SEKBDUNZZSZAKL-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CC(C)(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000181987488	351342769	/nfs/dbraw/zinc/34/27/69/351342769.db2.gz	JVSBRRXFASEAGF-SNVBAGLBSA-N	0	2	295.295	0.930	20	5		CCBDLN
CC(C)[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(N)=O	ZINC000181991200	351344068	/nfs/dbraw/zinc/34/40/68/351344068.db2.gz	FDZCQFFSTAPRKS-JTQLQIEISA-N	0	2	281.268	0.540	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H]1CCN(C)C1=O	ZINC000265840114	352667588	/nfs/dbraw/zinc/66/75/88/352667588.db2.gz	WYSSGZSGXXRCKW-JTQLQIEISA-N	0	2	293.279	0.603	20	5		CCBDLN
COC[C@H](CO)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000280003136	353330739	/nfs/dbraw/zinc/33/07/39/353330739.db2.gz	MNCBNZCFXJGUPL-ZETCQYMHSA-N	0	2	270.241	0.038	20	5		CCBDLN
CC(=O)NCCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157515643	188322406	/nfs/dbraw/zinc/32/24/06/188322406.db2.gz	XKRYLHNEPOSJNX-UHFFFAOYSA-N	0	2	281.268	0.556	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)NCCF	ZINC000282741799	353448901	/nfs/dbraw/zinc/44/89/01/353448901.db2.gz	IWQXEONDQIZZDQ-SSDOTTSWSA-N	0	2	299.258	0.504	20	5		CCBDLN
CN(CCCO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000296286699	353940127	/nfs/dbraw/zinc/94/01/27/353940127.db2.gz	RIHABSWZMZNESL-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CC[C@](F)(CO)C1	ZINC000338739930	355409346	/nfs/dbraw/zinc/40/93/46/355409346.db2.gz	AMOKHLDCJXVKKU-GFCCVEGCSA-N	0	2	284.243	0.847	20	5		CCBDLN
COC[C@H](O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354059699	356337897	/nfs/dbraw/zinc/33/78/97/356337897.db2.gz	VTMJWFHFDLZVHZ-MRVPVSSYSA-N	0	2	270.241	0.038	20	5		CCBDLN
C[C@H](O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355019796	356551960	/nfs/dbraw/zinc/55/19/60/356551960.db2.gz	QPLQLIWAUDHNRG-ZETCQYMHSA-N	0	2	254.242	0.801	20	5		CCBDLN
Cc1cc(CNS(=O)(=O)c2cccnc2[N+](=O)[O-])no1	ZINC000610261792	363546042	/nfs/dbraw/zinc/54/60/42/363546042.db2.gz	QKHLWILLOQJEMU-UHFFFAOYSA-N	0	2	298.280	0.765	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@](F)(CO)C1	ZINC000355860411	356661550	/nfs/dbraw/zinc/66/15/50/356661550.db2.gz	RCHJGBILDVMSPF-LBPRGKRZSA-N	0	2	284.243	0.847	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@@H]1CCNC(=O)C1	ZINC000356302459	356743867	/nfs/dbraw/zinc/74/38/67/356743867.db2.gz	ZZDVRZBCEIJFTR-SSDOTTSWSA-N	0	2	279.252	0.765	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@H]2[C@H](CO)[C@H]2C1	ZINC000590423478	359458262	/nfs/dbraw/zinc/45/82/62/359458262.db2.gz	WGMBXLMBOFRUOD-URLYPYJESA-N	0	2	278.264	0.611	20	5		CCBDLN
O=C(N[C@@H]1CCNC(=O)CC1)c1cc([N+](=O)[O-])ccc1O	ZINC000591231109	359571408	/nfs/dbraw/zinc/57/14/08/359571408.db2.gz	LPUUQKONESLITP-QMMMGPOBSA-N	0	2	293.279	0.699	20	5		CCBDLN
O=C(N[C@@H]1CCOC1)c1cccc(O)c1[N+](=O)[O-]	ZINC000591808859	359660725	/nfs/dbraw/zinc/66/07/25/359660725.db2.gz	ROVXIBUTAXUTDN-SSDOTTSWSA-N	0	2	252.226	0.819	20	5		CCBDLN
COCCN(CCO)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000297633311	200246968	/nfs/dbraw/zinc/24/69/68/200246968.db2.gz	XEILKJJNHBKTJC-UHFFFAOYSA-N	0	2	284.268	0.381	20	5		CCBDLN
CN(C[C@@H]1COCCO1)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000598174891	361347735	/nfs/dbraw/zinc/34/77/35/361347735.db2.gz	IHXVHLPREPACRL-SECBINFHSA-N	0	2	296.279	0.788	20	5		CCBDLN
CC[C@H](NS(=O)(=O)c1nn(C)cc1[N+](=O)[O-])C(F)F	ZINC000599315134	361648463	/nfs/dbraw/zinc/64/84/63/361648463.db2.gz	DQEJFPNYGDPOCF-YFKPBYRVSA-N	0	2	298.271	0.650	20	5		CCBDLN
Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)nn1	ZINC000614029918	364465523	/nfs/dbraw/zinc/46/55/23/364465523.db2.gz	PDNNKVXESVGZLQ-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
C[C@@H]1C(=O)N(C)CCN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186840233	296256098	/nfs/dbraw/zinc/25/60/98/296256098.db2.gz	PACVXRKNPXCHIU-MRVPVSSYSA-N	0	2	293.279	0.603	20	5		CCBDLN
CC(C)(O)CONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000278591039	194060201	/nfs/dbraw/zinc/06/02/01/194060201.db2.gz	KKZYXBPUDRAJHT-UHFFFAOYSA-N	0	2	270.241	0.733	20	5		CCBDLN
C[C@H](CO)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280941326	195038229	/nfs/dbraw/zinc/03/82/29/195038229.db2.gz	HUSVZYVJKLNLIK-ZETCQYMHSA-N	0	2	254.242	0.659	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC[C@@H](CO)C1	ZINC000283049895	388761624	/nfs/dbraw/zinc/76/16/24/388761624.db2.gz	AGKXJEDCZIPKAQ-MRVPVSSYSA-N	0	2	266.253	0.755	20	5		CCBDLN
CN(C(=O)c1cccc(O)c1[N+](=O)[O-])[C@H]1CCN(C)C1=O	ZINC000286223559	388838979	/nfs/dbraw/zinc/83/89/79/388838979.db2.gz	HASWOUUTCYCCJA-VIFPVBQESA-N	0	2	293.279	0.603	20	5		CCBDLN
CN1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1=O	ZINC000190091349	388982576	/nfs/dbraw/zinc/98/25/76/388982576.db2.gz	SEGAILGFYGGTTQ-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
O=C(NC[C@@H]1CCCC(=O)N1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355512552	389087723	/nfs/dbraw/zinc/08/77/23/389087723.db2.gz	XZGFQXQGISUDLW-QMMMGPOBSA-N	0	2	293.279	0.699	20	5		CCBDLN
CCC[C@@H](O)[C@@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000414013934	389592170	/nfs/dbraw/zinc/59/21/70/389592170.db2.gz	HBNGNWOJURMOBI-NXEZZACHSA-N	0	2	298.295	0.552	20	5		CCBDLN
O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1nnc[nH]1	ZINC000182708460	389715170	/nfs/dbraw/zinc/71/51/70/389715170.db2.gz	WCQBWNCTUQHUFM-UHFFFAOYSA-N	0	2	297.296	0.697	20	5		CCBDLN
O=[N+]([O-])c1ccccc1CCS(=O)(=O)Nc1nc[nH]n1	ZINC000182708460	389715173	/nfs/dbraw/zinc/71/51/73/389715173.db2.gz	WCQBWNCTUQHUFM-UHFFFAOYSA-N	0	2	297.296	0.697	20	5		CCBDLN
CCC1(O)CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000352346604	389794088	/nfs/dbraw/zinc/79/40/88/389794088.db2.gz	SGHNSKSUVZFZEY-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
Nc1noc(CCNc2ccc([N+](=O)[O-])nc2)n1	ZINC000433431217	389913257	/nfs/dbraw/zinc/91/32/57/389913257.db2.gz	RWTUDUMHPXWTAA-UHFFFAOYSA-N	0	2	250.218	0.440	20	5		CCBDLN
CCOC(=O)CN(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000436963226	389988746	/nfs/dbraw/zinc/98/87/46/389988746.db2.gz	GFLGGJYGZIDJIH-UHFFFAOYSA-N	0	2	282.252	0.936	20	5		CCBDLN
C[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1nnc[nH]1	ZINC000356623162	144020110	/nfs/dbraw/zinc/02/01/10/144020110.db2.gz	TUBRUBDIOPCCPH-LURJTMIESA-N	0	2	277.240	0.910	20	5		CCBDLN
O=C1N[C@H](c2ccc(O)c([N+](=O)[O-])c2)N2CCSC[C@@H]12	ZINC000270777787	304686182	/nfs/dbraw/zinc/68/61/82/304686182.db2.gz	IPHNTNZBBNNEGL-ONGXEEELSA-N	0	2	295.320	0.846	20	5		CCBDLN
Cn1cnc(NC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436702540	303016373	/nfs/dbraw/zinc/01/63/73/303016373.db2.gz	IOCZQEAJRWEPQF-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCn2nncc2C1	ZINC000574099869	327290028	/nfs/dbraw/zinc/29/00/28/327290028.db2.gz	IMFBBQKIBIUDAN-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
O=C(N[C@@H]1CC[C@H]1O)c1cc([N+](=O)[O-])ccc1O	ZINC000425053098	534771384	/nfs/dbraw/zinc/77/13/84/534771384.db2.gz	VQTADSIVLVHAKT-PSASIEDQSA-N	0	2	252.226	0.554	20	5		CCBDLN
CC(C)(O)CONC(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000791263849	581211987	/nfs/dbraw/zinc/21/19/87/581211987.db2.gz	NNWQOUYKZQRKES-UHFFFAOYSA-N	0	2	283.284	0.825	20	5		CCBDLN
CON(C)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000787904061	581480880	/nfs/dbraw/zinc/48/08/80/581480880.db2.gz	DSJKHHXYMGOUPW-UHFFFAOYSA-N	0	2	269.257	0.523	20	5		CCBDLN
CCN(CC(=O)NC)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000772981067	581904196	/nfs/dbraw/zinc/90/41/96/581904196.db2.gz	AGNMDXMIRZGNOA-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CCN(CC)C(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316385	614976448	/nfs/dbraw/zinc/97/64/48/614976448.db2.gz	RZGVXOGQUBQEEF-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
COC(=O)CCc1csc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000839708429	616580311	/nfs/dbraw/zinc/58/03/11/616580311.db2.gz	XIRQIFCXJRHXAH-HTQZYQBOSA-N	0	2	299.308	0.852	20	5		CCBDLN
Cn1ncc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000805207037	640371745	/nfs/dbraw/zinc/37/17/45/640371745.db2.gz	VRIXVYRWFDELPT-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
Cn1cc(Br)c(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000843616453	643099646	/nfs/dbraw/zinc/09/96/46/643099646.db2.gz	WDBFXVFXZPLYOH-INEUFUBQSA-N	0	2	289.089	0.786	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1C[C@@H]2COC(=O)[C@@H]2C1	ZINC000863757174	645123956	/nfs/dbraw/zinc/12/39/56/645123956.db2.gz	TUVFSLGISXGSOB-GMSGAONNSA-N	0	2	292.247	0.545	20	5		CCBDLN
CONC(=O)CNc1c(F)cc([N+](=O)[O-])cc1F	ZINC001164271482	802700396	/nfs/dbraw/zinc/70/03/96/802700396.db2.gz	ZEXVTTGFXDUTAI-UHFFFAOYSA-N	0	2	261.184	0.963	20	5		CCBDLN
O=c1nc2nc[nH]c2c(O[C@@H](C[N+](=O)[O-])C2CC2)[nH]1	ZINC001227070316	805317847	/nfs/dbraw/zinc/31/78/47/805317847.db2.gz	NLSVLCPCSOVTDD-LURJTMIESA-N	0	2	265.229	0.493	20	5		CCBDLN
COC(=O)c1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])on1	ZINC001129231297	819705940	/nfs/dbraw/zinc/70/59/40/819705940.db2.gz	CWYYGOJAUCUFTP-INEUFUBQSA-N	0	2	255.186	0.065	20	5		CCBDLN
O=C(Nc1cnnn1-c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001130043337	837672442	/nfs/dbraw/zinc/67/24/42/837672442.db2.gz	ZGBJALKZHGYAEM-NXEZZACHSA-N	0	2	273.252	0.871	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1C[C@@H]2C(=O)OC[C@@H]2C1	ZINC001170059018	836813234	/nfs/dbraw/zinc/81/32/34/836813234.db2.gz	WZXOECOYARBSSV-XVKPBYJWSA-N	0	2	292.247	0.545	20	5		CCBDLN
O=C(NCCO[C@@H]1CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC001178651356	842890842	/nfs/dbraw/zinc/89/08/42/842890842.db2.gz	SLKBHQSEJGHDFZ-SNVBAGLBSA-N	0	2	296.279	0.836	20	5		CCBDLN
NC(=O)CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ccccc1	ZINC001117942983	856116841	/nfs/dbraw/zinc/11/68/41/856116841.db2.gz	KWWDIFWLRUWGHX-GHMZBOCLSA-N	0	2	277.280	0.560	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@]1(O)CCOC1	ZINC001295970284	906829204	/nfs/dbraw/zinc/82/92/04/906829204.db2.gz	BJSMXNXYAICRQQ-NSHDSACASA-N	0	2	268.225	0.390	20	5		CCBDLN
O=C(NC[C@H]1C[C@@H](O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000600511393	361999914	/nfs/dbraw/zinc/99/99/14/361999914.db2.gz	QUOVPXXLUXZXAN-OTSSQURYSA-N	0	2	266.253	0.801	20	5		CCBDLN
CN1N=C(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)CCC1=O	ZINC000273408170	192141528	/nfs/dbraw/zinc/14/15/28/192141528.db2.gz	VSQNEHYHKRAHLQ-UHFFFAOYSA-N	0	2	292.251	0.847	20	5		CCBDLN
O=C(N[C@@H]1CCC[C@H]1O)c1cc([N+](=O)[O-])ccc1O	ZINC000161457973	350721660	/nfs/dbraw/zinc/72/16/60/350721660.db2.gz	KDWPIGJFLGXONS-MWLCHTKSSA-N	0	2	266.253	0.944	20	5		CCBDLN
C[C@@H](C[S@@](C)=O)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000181684695	351332246	/nfs/dbraw/zinc/33/22/46/351332246.db2.gz	PAJFFILMJMQKIE-ZDVLTJLQSA-N	0	2	286.309	0.797	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@H](CO)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000182122528	351347439	/nfs/dbraw/zinc/34/74/39/351347439.db2.gz	JNRMEQYTKJFMLM-DTWKUNHWSA-N	0	2	278.264	0.967	20	5		CCBDLN
CNC(=O)CCN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316961	351946713	/nfs/dbraw/zinc/94/67/13/351946713.db2.gz	ADOCPHOVRKJVFE-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
Cc1nnc(CCNC(=O)c2ccc([N+](=O)[O-])c(O)c2)[nH]1	ZINC000267247847	352754277	/nfs/dbraw/zinc/75/42/77/352754277.db2.gz	YSCLOKRWBRQSHC-UHFFFAOYSA-N	0	2	291.267	0.699	20	5		CCBDLN
NC(=O)[C@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000272367454	353057427	/nfs/dbraw/zinc/05/74/27/353057427.db2.gz	GJZAEKWFKFQVAD-ZETCQYMHSA-N	0	2	279.252	0.248	20	5		CCBDLN
COC[C@@H](CNC(=O)c1cc([N+](=O)[O-])ccc1O)OC	ZINC000272924985	353106527	/nfs/dbraw/zinc/10/65/27/353106527.db2.gz	KONGDSJUXJVJPS-SECBINFHSA-N	0	2	284.268	0.692	20	5		CCBDLN
CN1C[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)CC1=O	ZINC000274860864	353168378	/nfs/dbraw/zinc/16/83/78/353168378.db2.gz	JVEAZCUREPUMDF-SSDOTTSWSA-N	0	2	279.252	0.261	20	5		CCBDLN
C[C@H](Cn1cncn1)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000157683776	188332895	/nfs/dbraw/zinc/33/28/95/188332895.db2.gz	PZPICGNGTIWKOF-MRVPVSSYSA-N	0	2	291.267	0.710	20	5		CCBDLN
COC(=O)CCCONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000290592618	353737077	/nfs/dbraw/zinc/73/70/77/353737077.db2.gz	KDDISWHDPQCTAH-UHFFFAOYSA-N	0	2	298.251	0.915	20	5		CCBDLN
CO[C@H]1C[C@@H](CO)N(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000330578674	354422443	/nfs/dbraw/zinc/42/24/43/354422443.db2.gz	JLYLFKRFLRVIII-IUCAKERBSA-N	0	2	296.279	0.522	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)F)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354060022	356338662	/nfs/dbraw/zinc/33/86/62/356338662.db2.gz	ZNIQZJBEGWKJKL-MRVPVSSYSA-N	0	2	276.195	0.656	20	5		CCBDLN
COC[C@@H](O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354377376	356401855	/nfs/dbraw/zinc/40/18/55/356401855.db2.gz	BSKMNJFCAFNGAU-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
Cc1cc(=NC(=O)Cn2cc([N+](=O)[O-])cn2)[nH]nc1C	ZINC000359495454	356832192	/nfs/dbraw/zinc/83/21/92/356832192.db2.gz	RMANWAIZZTZHMA-UHFFFAOYSA-N	0	2	276.256	0.259	20	5		CCBDLN
NC(=O)C[C@H]1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000589942099	359411872	/nfs/dbraw/zinc/41/18/72/359411872.db2.gz	HZOMXCILHOVXJP-MRVPVSSYSA-N	0	2	293.279	0.638	20	5		CCBDLN
NC(=O)[C@H]1C[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000593812420	360163570	/nfs/dbraw/zinc/16/35/70/360163570.db2.gz	CZSVLPIHEMOTRE-KNVOCYPGSA-N	0	2	279.252	0.294	20	5		CCBDLN
O=C(NCC[C@]1(O)CCOC1)c1ccc([N+](=O)[O-])cc1O	ZINC000593813436	360164783	/nfs/dbraw/zinc/16/47/83/360164783.db2.gz	PMSBPWCBBLZZMG-ZDUSSCGKSA-N	0	2	296.279	0.572	20	5		CCBDLN
CN1C[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)NC1=O	ZINC000597442470	361095436	/nfs/dbraw/zinc/09/54/36/361095436.db2.gz	LHZXTEKAASYMIN-MRVPVSSYSA-N	0	2	280.240	0.263	20	5		CCBDLN
O=C(NCCCc1nnc[nH]1)c1cccc(O)c1[N+](=O)[O-]	ZINC000597610043	361161551	/nfs/dbraw/zinc/16/15/51/361161551.db2.gz	NPZJVGGPNFFXQP-UHFFFAOYSA-N	0	2	291.267	0.781	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC12COC2	ZINC000597728381	361214136	/nfs/dbraw/zinc/21/41/36/361214136.db2.gz	UOXQKWJLKDCUMD-UHFFFAOYSA-N	0	2	264.237	0.915	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@@]2(O)C[C@H]2C1	ZINC000598226517	361358824	/nfs/dbraw/zinc/35/88/24/361358824.db2.gz	MTONWSPEDUORMV-ISVAXAHUSA-N	0	2	278.264	0.897	20	5		CCBDLN
O=C(N[C@H]1C[C@H](O)C1)c1cc([N+](=O)[O-])ccc1O	ZINC000598528344	361438703	/nfs/dbraw/zinc/43/87/03/361438703.db2.gz	PJKCRKQEHNYGCQ-FKQCQYRASA-N	0	2	252.226	0.554	20	5		CCBDLN
NC(=O)OCCNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000495554308	239074162	/nfs/dbraw/zinc/07/41/62/239074162.db2.gz	KXZDQCMDYRYZRF-UHFFFAOYSA-N	0	2	269.213	0.540	20	5		CCBDLN
O=C(NC[C@H]1CCCC(=O)N1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355512548	389087571	/nfs/dbraw/zinc/08/75/71/389087571.db2.gz	XZGFQXQGISUDLW-MRVPVSSYSA-N	0	2	293.279	0.699	20	5		CCBDLN
Cn1nccc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000194745472	389103339	/nfs/dbraw/zinc/10/33/39/389103339.db2.gz	JFPHRSLDRIBUOA-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
NC(=O)c1c[nH]c(C(=O)Nc2cc([N+](=O)[O-])ccc2O)c1	ZINC000135342532	389256485	/nfs/dbraw/zinc/25/64/85/389256485.db2.gz	OLOJSYBKYJWVKR-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
CC(=O)N[C@H](C)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000155960028	389322227	/nfs/dbraw/zinc/32/22/27/389322227.db2.gz	ZYVYGZFAHHXHJP-ZCFIWIBFSA-N	0	2	267.241	0.764	20	5		CCBDLN
CCC[C@H](O)[C@@H](CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000414013938	389591972	/nfs/dbraw/zinc/59/19/72/389591972.db2.gz	HBNGNWOJURMOBI-ZJUUUORDSA-N	0	2	298.295	0.552	20	5		CCBDLN
CCNC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179395459	389655884	/nfs/dbraw/zinc/65/58/84/389655884.db2.gz	PNXBHGZXCLADTG-UHFFFAOYSA-N	0	2	267.241	0.166	20	5		CCBDLN
Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1C[NH2+]CCO1	ZINC000415091454	389657347	/nfs/dbraw/zinc/65/73/47/389657347.db2.gz	CPXNQZPRTBSSKU-ZDUSSCGKSA-N	0	2	265.313	0.981	20	5		CCBDLN
CNC(=O)[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(C)C	ZINC000182138606	389701109	/nfs/dbraw/zinc/70/11/09/389701109.db2.gz	YARRBSMIAUAIBV-NSHDSACASA-N	0	2	295.295	0.801	20	5		CCBDLN
CC(C)[C@@](C)(NC(=O)c1ccc([N+](=O)[O-])cc1O)C(N)=O	ZINC000436608268	389980557	/nfs/dbraw/zinc/98/05/57/389980557.db2.gz	PULJSVIJAGNRLC-CYBMUJFWSA-N	0	2	295.295	0.930	20	5		CCBDLN
Cn1c[nH+]cc1CNC(=O)c1cc([N+](=O)[O-])ccc1[O-]	ZINC000436785443	389984946	/nfs/dbraw/zinc/98/49/46/389984946.db2.gz	FFHLMEMXZUYTIA-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])cc1O	ZINC000436990535	389989964	/nfs/dbraw/zinc/98/99/64/389989964.db2.gz	QOAVSDUBTSEQEA-UHFFFAOYSA-N	0	2	279.212	0.054	20	5		CCBDLN
CCO[C@@H]1COC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000456803891	390018979	/nfs/dbraw/zinc/01/89/79/390018979.db2.gz	IAHJXRMINDLIHK-ZYHUDNBSSA-N	0	2	296.279	0.834	20	5		CCBDLN
CC1(C(N)=O)CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000566563039	390629668	/nfs/dbraw/zinc/62/96/68/390629668.db2.gz	IUGIVYNKMHPWKL-UHFFFAOYSA-N	0	2	279.252	0.248	20	5		CCBDLN
O=C(NCCc1cn[nH]c1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000357000722	144049291	/nfs/dbraw/zinc/04/92/91/144049291.db2.gz	LLOZXQLMAJMMCH-UHFFFAOYSA-N	0	2	276.252	0.996	20	5		CCBDLN
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C[C@@]1(NC(=O)c2cccc(O)c2[N+](=O)[O-])CCOC1=O	ZINC000794099845	581343299	/nfs/dbraw/zinc/34/32/99/581343299.db2.gz	PKNHJKUOJRSMMS-GFCCVEGCSA-N	0	2	280.236	0.736	20	5		CCBDLN
C[C@H]1CN(C)C(=O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000783759548	581359567	/nfs/dbraw/zinc/35/95/67/581359567.db2.gz	KZFCVCAYUMBIMG-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C([O-])N[C@@H]1CC[N@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740598571	581375951	/nfs/dbraw/zinc/37/59/51/581375951.db2.gz	NKKFGEFUKVQZGH-SSDOTTSWSA-N	0	2	255.234	0.091	20	5		CCBDLN
O=C([O-])N[C@@H]1CC[N@@H+](Cn2nccc2[N+](=O)[O-])C1	ZINC000740598571	581375953	/nfs/dbraw/zinc/37/59/53/581375953.db2.gz	NKKFGEFUKVQZGH-SSDOTTSWSA-N	0	2	255.234	0.091	20	5		CCBDLN
C[C@@H]1C[N@H+](Cn2nccc2[N+](=O)[O-])CC[C@@H]1NC(=O)[O-]	ZINC000739191788	581520657	/nfs/dbraw/zinc/52/06/57/581520657.db2.gz	QMEYGARIEHIDDE-BDAKNGLRSA-N	0	2	283.288	0.727	20	5		CCBDLN
C[C@@H]1C[N@@H+](Cn2nccc2[N+](=O)[O-])CC[C@@H]1NC(=O)[O-]	ZINC000739191788	581520659	/nfs/dbraw/zinc/52/06/59/581520659.db2.gz	QMEYGARIEHIDDE-BDAKNGLRSA-N	0	2	283.288	0.727	20	5		CCBDLN
Cc1nonc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000743417529	581811688	/nfs/dbraw/zinc/81/16/88/581811688.db2.gz	IRWOAHYWSAOSJD-UHFFFAOYSA-N	0	2	278.224	0.922	20	5		CCBDLN
CCOCCONC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000775235266	582015428	/nfs/dbraw/zinc/01/54/28/582015428.db2.gz	LIXAJCOWEMCVHB-UHFFFAOYSA-N	0	2	270.241	0.998	20	5		CCBDLN
CC(C)[C@H](CO)ONC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000836898776	614214776	/nfs/dbraw/zinc/21/47/76/614214776.db2.gz	LQQFXDNSSCCLHI-NSHDSACASA-N	0	2	284.268	0.979	20	5		CCBDLN
O=C(NOC[C@H]1CCOC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000803171513	640719508	/nfs/dbraw/zinc/71/95/08/640719508.db2.gz	YKIZWKZOEGYZSI-QMMMGPOBSA-N	0	2	282.252	0.998	20	5		CCBDLN
O=C(NC[C@@H]1COCO1)c1ccc([N+](=O)[O-])cc1O	ZINC000861975476	644957810	/nfs/dbraw/zinc/95/78/10/644957810.db2.gz	LWLFXWCCEYYFOF-MRVPVSSYSA-N	0	2	268.225	0.403	20	5		CCBDLN
O=C(Nc1ccnn1[C@H]1CCOC1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000888596637	646222230	/nfs/dbraw/zinc/22/22/30/646222230.db2.gz	JXRPJPTZPUOCOJ-DJLDLDEBSA-N	0	2	266.257	0.448	20	5		CCBDLN
CSc1nc(OC[C@H]2CCO2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227625052	805374983	/nfs/dbraw/zinc/37/49/83/805374983.db2.gz	NOHDFGVIAGNDGM-RXMQYKEDSA-N	0	2	273.270	0.980	20	5		CCBDLN
O=C(NC[C@H]1C[C@H](O)C1)c1ccc([N+](=O)[O-])cc1O	ZINC001176913978	842467147	/nfs/dbraw/zinc/46/71/47/842467147.db2.gz	CQJQGLAHLVZUKO-XWEPSHTISA-N	0	2	266.253	0.801	20	5		CCBDLN
C[C@@]1(CO)C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC001301121004	907956241	/nfs/dbraw/zinc/95/62/41/907956241.db2.gz	AFNRQSBJFMMARH-ZANVPECISA-N	0	2	296.279	0.258	20	5		CCBDLN
O=C([O-])[C@H]1C[C@H](O)C[N@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000132015964	958761694	/nfs/dbraw/zinc/76/16/94/958761694.db2.gz	SCOISFSSGQJITG-WDEREUQCSA-N	0	2	266.253	0.615	20	5		CCBDLN
O=C([O-])[C@H]1C[C@H](O)C[N@@H+]1Cc1cccc([N+](=O)[O-])c1	ZINC000132015964	958761709	/nfs/dbraw/zinc/76/17/09/958761709.db2.gz	SCOISFSSGQJITG-WDEREUQCSA-N	0	2	266.253	0.615	20	5		CCBDLN
C[NH+]1CCN(C(=O)c2cc(C(=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC001116371642	982930119	/nfs/dbraw/zinc/93/01/19/982930119.db2.gz	WJAGIMFJBKPNKP-UHFFFAOYSA-N	0	2	293.279	0.681	20	5		CCBDLN
O=C(CNC(=O)c1cccc(O)c1[N+](=O)[O-])N1CCCO1	ZINC000600060252	361858753	/nfs/dbraw/zinc/85/87/53/361858753.db2.gz	SQCWBHBGNMNZGW-UHFFFAOYSA-N	0	2	295.251	0.194	20	5		CCBDLN
O=C(NC[C@H](O)[C@@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600243546	361902592	/nfs/dbraw/zinc/90/25/92/361902592.db2.gz	ULYQLILEXUMOOY-RYUDHWBXSA-N	0	2	296.279	0.570	20	5		CCBDLN
O=C(N[C@@H]1C=C[C@@H](CO)C1)c1cccc(O)c1[N+](=O)[O-]	ZINC000343833267	137160366	/nfs/dbraw/zinc/16/03/66/137160366.db2.gz	FEMFOXRIMRFJLC-RKDXNWHRSA-N	0	2	278.264	0.967	20	5		CCBDLN
C[C@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1nncn1C	ZINC000271305475	191062830	/nfs/dbraw/zinc/06/28/30/191062830.db2.gz	UEQFCYVYKMETRX-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
CC(=O)N1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000134336413	350361626	/nfs/dbraw/zinc/36/16/26/350361626.db2.gz	PJTLDVGADRVANA-SNVBAGLBSA-N	0	2	293.279	0.651	20	5		CCBDLN
CCN(C)C(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000187279746	351537542	/nfs/dbraw/zinc/53/75/42/351537542.db2.gz	USWQRTFASCYIPN-UHFFFAOYSA-N	0	2	281.268	0.509	20	5		CCBDLN
CN(Cc1nncn1C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000291600988	198047506	/nfs/dbraw/zinc/04/75/06/198047506.db2.gz	ABWOWBNRPCZFED-UHFFFAOYSA-N	0	2	291.267	0.701	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@H](CO)C1	ZINC000217316323	351947119	/nfs/dbraw/zinc/94/71/19/351947119.db2.gz	IFYIXWQRRSXKIS-QMMMGPOBSA-N	0	2	266.253	0.755	20	5		CCBDLN
CC(C)(C)NC(=O)CNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316098	351945793	/nfs/dbraw/zinc/94/57/93/351945793.db2.gz	BUDTUEFZNBDKSB-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C[C@H](CO)O1	ZINC000217316829	351946833	/nfs/dbraw/zinc/94/68/33/351946833.db2.gz	GNPUCGJFRIWGQL-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
CS(=O)(=O)CC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000221014256	351975832	/nfs/dbraw/zinc/97/58/32/351975832.db2.gz	NXDVLYZNKHNTNS-UHFFFAOYSA-N	0	2	274.254	0.284	20	5		CCBDLN
CN(C)C(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000234216097	352155216	/nfs/dbraw/zinc/15/52/16/352155216.db2.gz	ZPCBWVUKRWKURP-UHFFFAOYSA-N	0	2	281.268	0.461	20	5		CCBDLN
CCCNC(=O)CCNC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000233051530	352149363	/nfs/dbraw/zinc/14/93/63/352149363.db2.gz	WGTFHSFGBWPEJI-UHFFFAOYSA-N	0	2	295.295	0.947	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267145460	352746905	/nfs/dbraw/zinc/74/69/05/352746905.db2.gz	VGWLMSVSVNTOIQ-MRVPVSSYSA-N	0	2	294.185	0.953	20	5		CCBDLN
COC[C@H](O)CCNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000270849904	352995752	/nfs/dbraw/zinc/99/57/52/352995752.db2.gz	PQNUEFLPRGDUPI-SECBINFHSA-N	0	2	284.268	0.428	20	5		CCBDLN
CCNC(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272355376	353055601	/nfs/dbraw/zinc/05/56/01/353055601.db2.gz	LQBSFQNTLNFVCK-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
CO[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C[C@@H]1OC	ZINC000277912385	353272389	/nfs/dbraw/zinc/27/23/89/353272389.db2.gz	QVOJCEUCHZGTEG-TXEJJXNPSA-N	0	2	296.279	0.786	20	5		CCBDLN
CC(C)(O)CNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280727123	353378526	/nfs/dbraw/zinc/37/85/26/353378526.db2.gz	IAURJFFWUFLHTN-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
CNC(=O)[C@H](C)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280759478	353381110	/nfs/dbraw/zinc/38/11/10/353381110.db2.gz	AUDAAKFJPRRMAA-MRVPVSSYSA-N	0	2	295.295	0.755	20	5		CCBDLN
CN(CCOCCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000282257172	353407644	/nfs/dbraw/zinc/40/76/44/353407644.db2.gz	WEHRDFKVKKORRS-UHFFFAOYSA-N	0	2	284.268	0.381	20	5		CCBDLN
CCNC(=O)NCCNC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000293999347	353858875	/nfs/dbraw/zinc/85/88/75/353858875.db2.gz	LAGZWCAUYRKDBA-UHFFFAOYSA-N	0	2	296.283	0.349	20	5		CCBDLN
CC(C)ONC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000295771985	353917621	/nfs/dbraw/zinc/91/76/21/353917621.db2.gz	XBXCJGDDINFDPS-UHFFFAOYSA-N	0	2	281.268	0.781	20	5		CCBDLN
O=C(NCC1(CO)CC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000618937134	366127273	/nfs/dbraw/zinc/12/72/73/366127273.db2.gz	HDXVLYBVXUVZPZ-UHFFFAOYSA-N	0	2	266.253	0.803	20	5		CCBDLN
O=C(N[C@H]1CC[S@](=O)C1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000334079185	354852237	/nfs/dbraw/zinc/85/22/37/354852237.db2.gz	QIAFDZSCYMNINP-RLBGWGEZSA-N	0	2	284.293	0.551	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(O)(C(F)F)C1	ZINC000425028423	235253278	/nfs/dbraw/zinc/25/32/78/235253278.db2.gz	YJFPXAGVMIQRFL-UHFFFAOYSA-N	0	2	288.206	0.752	20	5		CCBDLN
O=C(NCc1n[nH]c(=O)[nH]1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000428017533	235389865	/nfs/dbraw/zinc/38/98/65/235389865.db2.gz	NJJRGEGMJOJCNO-UHFFFAOYSA-N	0	2	279.212	0.054	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1C[C@@H]2COC[C@H](C1)O2	ZINC000619781589	366351412	/nfs/dbraw/zinc/35/14/12/366351412.db2.gz	BYAXPTFKUVRYSZ-AOOOYVTPSA-N	0	2	294.263	0.540	20	5		CCBDLN
O=[N+]([O-])c1cnccc1NS(=O)(=O)c1cncc(F)c1	ZINC000359418417	356819214	/nfs/dbraw/zinc/81/92/14/356819214.db2.gz	VBTXAJWTVHMAAQ-UHFFFAOYSA-N	0	2	298.255	0.747	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1[C@@H]2CO[C@H]3[C@@H]2OC[C@H]31	ZINC000586801456	359293012	/nfs/dbraw/zinc/29/30/12/359293012.db2.gz	STXIOWYPKQWFSU-DDHJBXDOSA-N	0	2	292.247	0.291	20	5		CCBDLN
NC(=O)C[C@@H]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000589942121	359411713	/nfs/dbraw/zinc/41/17/13/359411713.db2.gz	JNXWUFLZHYPBEA-QMMMGPOBSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@]2(O)C[C@H]2C1	ZINC000598226463	361358966	/nfs/dbraw/zinc/35/89/66/361358966.db2.gz	LELZQCGTIBNVBS-ISVAXAHUSA-N	0	2	278.264	0.897	20	5		CCBDLN
C[C@@H](O)CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@H](C)CO	ZINC000276080443	193206974	/nfs/dbraw/zinc/20/69/74/193206974.db2.gz	WVLOUTWGKCHMNV-RKDXNWHRSA-N	0	2	298.295	0.504	20	5		CCBDLN
O=C(CN1CCOCC1=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000279148027	194305237	/nfs/dbraw/zinc/30/52/37/194305237.db2.gz	CUHLNGXOALSMPO-UHFFFAOYSA-N	0	2	295.251	0.098	20	5		CCBDLN
CN(C)C(=O)CN(C)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280738807	194952686	/nfs/dbraw/zinc/95/26/86/194952686.db2.gz	JMCKEQVFEUJQCZ-UHFFFAOYSA-N	0	2	281.268	0.461	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCn2nncc2C1	ZINC000521460822	285280132	/nfs/dbraw/zinc/28/01/32/285280132.db2.gz	NHVBCCHFFYLZFI-UHFFFAOYSA-N	0	2	289.251	0.548	20	5		CCBDLN
O=C(NCCCn1ccnn1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000185002156	388782027	/nfs/dbraw/zinc/78/20/27/388782027.db2.gz	YXGJDXHLOGFOFC-UHFFFAOYSA-N	0	2	291.267	0.712	20	5		CCBDLN
Cn1cnc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000185908434	388818459	/nfs/dbraw/zinc/81/84/59/388818459.db2.gz	AOZDXDXFMWBCAU-UHFFFAOYSA-N	0	2	277.240	0.359	20	5		CCBDLN
C[C@@H]1C[C@H](O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000408410288	389347476	/nfs/dbraw/zinc/34/74/76/389347476.db2.gz	NGFZOKSIONUVSO-APPZFPTMSA-N	0	2	266.253	0.896	20	5		CCBDLN
NC(=O)[C@H]1CC[C@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)O1	ZINC000276658222	389524086	/nfs/dbraw/zinc/52/40/86/389524086.db2.gz	XPPIRFLZOXKXGJ-NXEZZACHSA-N	0	2	295.251	0.272	20	5		CCBDLN
NC(=O)[C@@H]1CC[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2O)O1	ZINC000276658226	389524338	/nfs/dbraw/zinc/52/43/38/389524338.db2.gz	XPPIRFLZOXKXGJ-UWVGGRQHSA-N	0	2	295.251	0.272	20	5		CCBDLN
O=C(NCCn1cccn1)c1cc([N+](=O)[O-])ccc1O	ZINC000181924318	389695648	/nfs/dbraw/zinc/69/56/48/389695648.db2.gz	ZCNTYYGNQJZKJY-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
CN(C(=O)c1cc([N+](=O)[O-])ccc1O)[C@@H]1COC[C@H]1O	ZINC000436638143	389981061	/nfs/dbraw/zinc/98/10/61/389981061.db2.gz	ZZXWFXDRGLPJQC-MWLCHTKSSA-N	0	2	282.252	0.132	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(CO)C1	ZINC000436919213	389987301	/nfs/dbraw/zinc/98/73/01/389987301.db2.gz	MRTIFLABJIXICC-UHFFFAOYSA-N	0	2	252.226	0.365	20	5		CCBDLN
O=C(NC1(c2nn[nH]n2)CC1)c1cc(O)cc([N+](=O)[O-])c1	ZINC000357082596	144058376	/nfs/dbraw/zinc/05/83/76/144058376.db2.gz	XKQKAXHANNQORG-UHFFFAOYSA-N	0	2	290.239	0.233	20	5		CCBDLN
O=C(NC[C@H](O)C(F)F)c1ccc([N+](=O)[O-])cc1O	ZINC000436889741	397535039	/nfs/dbraw/zinc/53/50/39/397535039.db2.gz	XMIFSYFKJSMZTD-QMMMGPOBSA-N	0	2	276.195	0.656	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC[C@H](CO)[C@@H](O)C1	ZINC000546697919	285917512	/nfs/dbraw/zinc/91/75/12/285917512.db2.gz	PFYQVMXTUOKIFR-PELKAZGASA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCNC(=O)CC1	ZINC000236560374	304501890	/nfs/dbraw/zinc/50/18/90/304501890.db2.gz	NRMYDPOOJOWMTL-UHFFFAOYSA-N	0	2	279.252	0.263	20	5		CCBDLN
C[C@@]1(O)C[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)C1	ZINC000416278650	297925920	/nfs/dbraw/zinc/92/59/20/297925920.db2.gz	WZWMGONMDLQZNB-OGXFKERWSA-N	0	2	266.253	0.944	20	5		CCBDLN
C[C@H]1OCC[C@]1(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000279503287	300635765	/nfs/dbraw/zinc/63/57/65/300635765.db2.gz	NZWLBSXTYCLRHA-OQPBUACISA-N	0	2	296.279	0.570	20	5		CCBDLN
Cc1cc(C(=O)[O-])c([N+](=O)[O-])c(NCCn2cc[nH+]c2)n1	ZINC000581886882	336160355	/nfs/dbraw/zinc/16/03/55/336160355.db2.gz	VPBPUDGBCUZMPI-UHFFFAOYSA-N	0	2	291.267	0.727	20	5		CCBDLN
O=C(Cn1cc([N+](=O)[O-])cn1)N=c1ccc(C2CC2)n[nH]1	ZINC000341189798	527370809	/nfs/dbraw/zinc/37/08/09/527370809.db2.gz	JFVNLNZQDLUOHZ-UHFFFAOYSA-N	0	2	288.267	0.519	20	5		CCBDLN
COc1cccc(C(=O)OCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000769601907	581697516	/nfs/dbraw/zinc/69/75/16/581697516.db2.gz	IYDVFQYNORZVPK-UHFFFAOYSA-N	0	2	294.223	0.784	20	5		CCBDLN
C/C=C(\C)C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000761008020	581882792	/nfs/dbraw/zinc/88/27/92/581882792.db2.gz	KEMSPYLBEMLILF-XVNBXDOJSA-N	0	2	285.281	0.761	20	5		CCBDLN
O=C(Cc1ccccc1[N+](=O)[O-])OCc1n[nH]c(=O)[nH]1	ZINC000774882463	582000596	/nfs/dbraw/zinc/00/05/96/582000596.db2.gz	HXCVJAPWDRSNAA-UHFFFAOYSA-N	0	2	278.224	0.704	20	5		CCBDLN
Nc1c(C(=O)OCc2n[nH]c(=O)[nH]2)cccc1[N+](=O)[O-]	ZINC000774969700	582006376	/nfs/dbraw/zinc/00/63/76/582006376.db2.gz	VEJSBBSTRCXRHE-UHFFFAOYSA-N	0	2	279.212	0.358	20	5		CCBDLN
Cn1ncc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)n1	ZINC000803099140	640715901	/nfs/dbraw/zinc/71/59/01/640715901.db2.gz	YFRFILFZIMFMDL-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
Cc1nc2cc[nH]n2c(=O)c1CC(=O)OCCC[N+](=O)[O-]	ZINC000860916277	644839446	/nfs/dbraw/zinc/83/94/46/644839446.db2.gz	PREDMARCIIPBRP-UHFFFAOYSA-N	0	2	294.267	0.084	20	5		CCBDLN
Cn1nc2c(c1NC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCCC2	ZINC000870878343	646034011	/nfs/dbraw/zinc/03/40/11/646034011.db2.gz	IUFPLNUBOIQAKV-PSASIEDQSA-N	0	2	264.285	0.903	20	5		CCBDLN
NC(=O)CONC(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000124196939	646308100	/nfs/dbraw/zinc/30/81/00/646308100.db2.gz	PWVAFWHWSNRQOJ-UHFFFAOYSA-N	0	2	285.281	0.220	20	5		CCBDLN
C[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@H]1CO	ZINC001171137978	839935037	/nfs/dbraw/zinc/93/50/37/839935037.db2.gz	FTUUDCCKXVHUFS-JTQLQIEISA-N	0	2	295.295	0.049	20	5		CCBDLN
C[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2[O-])C[C@H]1CO	ZINC001171137978	839935043	/nfs/dbraw/zinc/93/50/43/839935043.db2.gz	FTUUDCCKXVHUFS-JTQLQIEISA-N	0	2	295.295	0.049	20	5		CCBDLN
O=C(Nc1cc([N+](=O)[O-])ccc1O)[C@H]1CCCNC1=O	ZINC001295971186	906829297	/nfs/dbraw/zinc/82/92/97/906829297.db2.gz	UZFJMRXTUBBMPX-QMMMGPOBSA-N	0	2	279.252	0.765	20	5		CCBDLN
O=C(NCC1COC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000600570536	362010045	/nfs/dbraw/zinc/01/00/45/362010045.db2.gz	PDVRAOWQFHPSCI-UHFFFAOYSA-N	0	2	252.226	0.677	20	5		CCBDLN
CNC(=O)C[C@H](C)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000456524627	529872433	/nfs/dbraw/zinc/87/24/33/529872433.db2.gz	YLWPWTLXGGZCOK-ZETCQYMHSA-N	0	2	281.268	0.555	20	5		CCBDLN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1O)OCC1CC1	ZINC000273201745	192073489	/nfs/dbraw/zinc/07/34/89/192073489.db2.gz	JZLZTRSBGJGHHX-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
O=C(Cc1ccccc1[N+](=O)[O-])NCc1n[nH]c(=O)[nH]1	ZINC000358368323	232089899	/nfs/dbraw/zinc/08/98/99/232089899.db2.gz	LDPICWINDMBIFH-UHFFFAOYSA-N	0	2	277.240	0.277	20	5		CCBDLN
O=C(COc1ccc([N+](=O)[O-])cc1)N=c1cccn[nH]1	ZINC000346033380	137265080	/nfs/dbraw/zinc/26/50/80/137265080.db2.gz	FKVJHWQPSQMUHN-UHFFFAOYSA-N	0	2	274.236	0.824	20	5		CCBDLN
C[S@@](=O)CCCNc1ncc([N+](=O)[O-])cc1C(N)=O	ZINC000346639965	137296667	/nfs/dbraw/zinc/29/66/67/137296667.db2.gz	UNFMFMRNGTVEJG-LJQANCHMSA-N	0	2	286.313	0.269	20	5		CCBDLN
O=C(NC[C@@H](O)[C@H]1CCOC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000347086648	137319413	/nfs/dbraw/zinc/31/94/13/137319413.db2.gz	DNKBDQHGDMHBIJ-JOYOIKCWSA-N	0	2	296.279	0.428	20	5		CCBDLN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NOCC(N)=O	ZINC000271335290	191081266	/nfs/dbraw/zinc/08/12/66/191081266.db2.gz	BPVFQISOIZLFFE-ZETCQYMHSA-N	0	2	299.308	0.609	20	5		CCBDLN
C[C@@H](C[S@](C)=O)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000181676191	351332282	/nfs/dbraw/zinc/33/22/82/351332282.db2.gz	PHXIOHPYVPDKAB-IIYDVTGLSA-N	0	2	286.309	0.797	20	5		CCBDLN
Cn1ncnc1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217316064	351946309	/nfs/dbraw/zinc/94/63/09/351946309.db2.gz	UAZPWRPXQOTDSL-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(CNC(=O)c1cc(O)ccc1[N+](=O)[O-])N1CCCC1	ZINC000217316386	351946829	/nfs/dbraw/zinc/94/68/29/351946829.db2.gz	VUIGMHUXBSKLHC-UHFFFAOYSA-N	0	2	293.279	0.653	20	5		CCBDLN
CC(C)NC(=O)CN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000232640789	352146599	/nfs/dbraw/zinc/14/65/99/352146599.db2.gz	HSUSELXRQJGSID-UHFFFAOYSA-N	0	2	295.295	0.897	20	5		CCBDLN
CN1C[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000272414089	353061704	/nfs/dbraw/zinc/06/17/04/353061704.db2.gz	PDKIAQNMWIRGBW-ZETCQYMHSA-N	0	2	279.252	0.261	20	5		CCBDLN
CN(C)C(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272415415	353061923	/nfs/dbraw/zinc/06/19/23/353061923.db2.gz	PFMSWSKNDASXNY-UHFFFAOYSA-N	0	2	296.283	0.301	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)C(=O)NCCF	ZINC000282530085	353432326	/nfs/dbraw/zinc/43/23/26/353432326.db2.gz	BXTWOBMWBAIUQM-ZETCQYMHSA-N	0	2	299.258	0.504	20	5		CCBDLN
C[C@H]1OCCN2[C@@H](c3ccc(O)c([N+](=O)[O-])c3)NC(=O)[C@H]12	ZINC000284929454	353557423	/nfs/dbraw/zinc/55/74/23/353557423.db2.gz	CHTMNYKZXPJKNM-MKCWBWRRSA-N	0	2	293.279	0.518	20	5		CCBDLN
O=C(NC[C@H]1CC[C@@H](CO)O1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000293660481	353828003	/nfs/dbraw/zinc/82/80/03/353828003.db2.gz	LHUDBXCDLCUUKK-ZJUUUORDSA-N	0	2	296.279	0.570	20	5		CCBDLN
COCC1(O)CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000295504421	353898841	/nfs/dbraw/zinc/89/88/41/353898841.db2.gz	GPBLQRKWOYSANL-UHFFFAOYSA-N	0	2	282.252	0.134	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CCC(O)(CO)CC1	ZINC000313684062	354219599	/nfs/dbraw/zinc/21/95/99/354219599.db2.gz	QZMDFXRCCXHTAQ-UHFFFAOYSA-N	0	2	296.279	0.260	20	5		CCBDLN
O=C(NCC1(O)CCC1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000332482788	354684584	/nfs/dbraw/zinc/68/45/84/354684584.db2.gz	PQPWBDGUIPQTIK-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@H](CO)[C@H](O)C1	ZINC000560668532	291111060	/nfs/dbraw/zinc/11/10/60/291111060.db2.gz	SDURYYBGCJKSQC-QPUJVOFHSA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(NC[C@@H]1CCCNC1=O)c1cc([N+](=O)[O-])ccc1O	ZINC000591173656	359565129	/nfs/dbraw/zinc/56/51/29/359565129.db2.gz	PBCGLVMIMHGBJW-QMMMGPOBSA-N	0	2	293.279	0.556	20	5		CCBDLN
CC(C)Oc1nc(NCc2n[nH]c(=O)[nH]2)ccc1[N+](=O)[O-]	ZINC000594559242	360331161	/nfs/dbraw/zinc/33/11/61/360331161.db2.gz	OMKYGXKUYPVBGR-UHFFFAOYSA-N	0	2	294.271	0.635	20	5		CCBDLN
COCCS(=O)(=O)Nc1ccc([N+](=O)[O-])c(C)n1	ZINC000180758416	189273511	/nfs/dbraw/zinc/27/35/11/189273511.db2.gz	OGYPZEJPEUVULL-UHFFFAOYSA-N	0	2	275.286	0.686	20	5		CCBDLN
O=C(NC1(CO)CCC1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000598739405	361503483	/nfs/dbraw/zinc/50/34/83/361503483.db2.gz	DWLQXHISJGVNNA-UHFFFAOYSA-N	0	2	266.253	0.945	20	5		CCBDLN
NC(=O)c1cc(C(=O)Nc2ccc(O)c([N+](=O)[O-])c2)c[nH]1	ZINC000614271685	364557300	/nfs/dbraw/zinc/55/73/00/364557300.db2.gz	RFYKIJJWWAGMLJ-UHFFFAOYSA-N	0	2	290.235	0.980	20	5		CCBDLN
C[C@@H]1OCC[C@@]1(O)CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000279425930	194427581	/nfs/dbraw/zinc/42/75/81/194427581.db2.gz	IRJODUNMZXOUAZ-ISVAXAHUSA-N	0	2	296.279	0.570	20	5		CCBDLN
COC(=O)[C@@H](CF)NC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000288173885	197019571	/nfs/dbraw/zinc/01/95/71/197019571.db2.gz	GRUKFGYFMYPFFS-MRVPVSSYSA-N	0	2	286.215	0.541	20	5		CCBDLN
CN1C(=O)CC[C@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000185891915	388816880	/nfs/dbraw/zinc/81/68/80/388816880.db2.gz	MBGFRFCDCCNXMM-VIFPVBQESA-N	0	2	279.252	0.860	20	5		CCBDLN
CN1C(=O)CC[C@@H]1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000185891932	388817039	/nfs/dbraw/zinc/81/70/39/388817039.db2.gz	MBGFRFCDCCNXMM-SECBINFHSA-N	0	2	279.252	0.860	20	5		CCBDLN
O=C(N[C@H](CO)[C@@H]1CCCO1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355457130	389080814	/nfs/dbraw/zinc/08/08/14/389080814.db2.gz	NVFFUYQGIRGTKI-PWSUYJOCSA-N	0	2	296.279	0.570	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355832674	389116956	/nfs/dbraw/zinc/11/69/56/389116956.db2.gz	JJXBVOXDJDWPDI-CPCISQLKSA-N	0	2	293.279	0.555	20	5		CCBDLN
O=C(NCCn1cc[nH+]c1)c1ccc([O-])c([N+](=O)[O-])c1	ZINC000160021115	389377883	/nfs/dbraw/zinc/37/78/83/389377883.db2.gz	YYAHXTZPTOQUJC-UHFFFAOYSA-N	0	2	276.252	0.927	20	5		CCBDLN
NC(=O)[C@@H]1CCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000422015165	389390790	/nfs/dbraw/zinc/39/07/90/389390790.db2.gz	MXZIMIQQUQQBJO-SCZZXKLOSA-N	0	2	293.279	0.684	20	5		CCBDLN
C[S@@](=O)C1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CC1	ZINC000282004947	389644718	/nfs/dbraw/zinc/64/47/18/389644718.db2.gz	SEPIYJDOYKZJRU-HXUWFJFHSA-N	0	2	298.320	0.941	20	5		CCBDLN
CN(CCCO)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000282012764	389645468	/nfs/dbraw/zinc/64/54/68/389645468.db2.gz	SWECAUAPDMDRJV-UHFFFAOYSA-N	0	2	254.242	0.755	20	5		CCBDLN
O=c1[nH]nc(CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)[nH]1	ZINC000392459637	389774490	/nfs/dbraw/zinc/77/44/90/389774490.db2.gz	LGWINSOJXYFQPH-UHFFFAOYSA-N	0	2	275.228	0.329	20	5		CCBDLN
CO[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@@H]1OC	ZINC000436746285	389984177	/nfs/dbraw/zinc/98/41/77/389984177.db2.gz	XRNOTYQAOSTVDQ-RYUDHWBXSA-N	0	2	296.279	0.786	20	5		CCBDLN
C[C@@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)C[C@H](CO)O1	ZINC000436818566	389985435	/nfs/dbraw/zinc/98/54/35/389985435.db2.gz	FVTLBIADBYXREO-PSASIEDQSA-N	0	2	296.279	0.522	20	5		CCBDLN
C[C@@]1(CNC(=O)c2ccc([N+](=O)[O-])cc2O)CCC(=O)N1	ZINC000457177782	390033660	/nfs/dbraw/zinc/03/36/60/390033660.db2.gz	GWNADSXXZORDQQ-ZDUSSCGKSA-N	0	2	293.279	0.699	20	5		CCBDLN
COC(=O)NCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000494112950	390150598	/nfs/dbraw/zinc/15/05/98/390150598.db2.gz	JQTNXFWZXLPOKY-UHFFFAOYSA-N	0	2	269.213	0.595	20	5		CCBDLN
O=C(NCC1CC1)C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000191939577	130332742	/nfs/dbraw/zinc/33/27/42/130332742.db2.gz	BTRBJWKUYPGDBB-UHFFFAOYSA-N	0	2	279.252	0.765	20	5		CCBDLN
COC[C@@](C)(O)CNC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000548514698	286044767	/nfs/dbraw/zinc/04/47/67/286044767.db2.gz	IRBXHYBHCIZJSJ-LBPRGKRZSA-N	0	2	284.268	0.428	20	5		CCBDLN
CNC(=O)CCCN(C)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000354250754	290379647	/nfs/dbraw/zinc/37/96/47/290379647.db2.gz	GQCIGFHVWIEJCF-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CNC(=O)CCCN(C)C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000182147319	290379676	/nfs/dbraw/zinc/37/96/76/290379676.db2.gz	GOTQIMVBXCRVJZ-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
COC(=O)NCCC(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000495564444	534078789	/nfs/dbraw/zinc/07/87/89/534078789.db2.gz	JSDQAOBNPYFWTI-UHFFFAOYSA-N	0	2	283.240	0.985	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])cc1C(=O)NCc1n[nH]c(=O)[nH]1	ZINC000358360841	534332921	/nfs/dbraw/zinc/33/29/21/534332921.db2.gz	UJWIITSMHSMLTC-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
CCC[C@@H](O)[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000412529687	529054646	/nfs/dbraw/zinc/05/46/46/529054646.db2.gz	WGLOMORPNKNQPC-MWLCHTKSSA-N	0	2	298.295	0.552	20	5		CCBDLN
C[C@H]1CN(C)C(=O)CN1C(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000783757436	581359159	/nfs/dbraw/zinc/35/91/59/581359159.db2.gz	NALBZBAFRIFQSI-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
O=C(OCc1n[nH]c(=O)[nH]1)c1ccc([N+](=O)[O-])o1	ZINC000774886711	582000374	/nfs/dbraw/zinc/00/03/74/582000374.db2.gz	QIRMWGURVINEIJ-UHFFFAOYSA-N	0	2	254.158	0.369	20	5		CCBDLN
C[C@@H]1C[C@@H]1C(=O)NS(=O)(=O)c1ccc([N+](=O)[O-])nc1	ZINC000750764034	582058625	/nfs/dbraw/zinc/05/86/25/582058625.db2.gz	REYOHZWFCPMBSN-SVRRBLITSA-N	0	2	285.281	0.451	20	5		CCBDLN
C[C@H]1C[N@H+](CCn2ccc([N+](=O)[O-])n2)CCN1C(=O)[O-]	ZINC000826056396	603709680	/nfs/dbraw/zinc/70/96/80/603709680.db2.gz	CGDLFNXNJHHJTG-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
C[C@H]1C[N@@H+](CCn2ccc([N+](=O)[O-])n2)CCN1C(=O)[O-]	ZINC000826056396	603709682	/nfs/dbraw/zinc/70/96/82/603709682.db2.gz	CGDLFNXNJHHJTG-VIFPVBQESA-N	0	2	283.288	0.475	20	5		CCBDLN
CC(C)[C@@H](CO)ONC(=O)c1ccc([N+](=O)[O-])cc1O	ZINC000836893582	614105306	/nfs/dbraw/zinc/10/53/06/614105306.db2.gz	XZENKFSAIIZHEC-LLVKDONJSA-N	0	2	284.268	0.979	20	5		CCBDLN
O=C([C@@H]1C[C@H]1[N+](=O)[O-])N1C[C@H](O)Cc2ccccc21	ZINC000839748272	640361159	/nfs/dbraw/zinc/36/11/59/640361159.db2.gz	YSTVRTAIHZCWLJ-CKYFFXLPSA-N	0	2	262.265	0.602	20	5		CCBDLN
COC(=O)[C@@H](C)Oc1cc(O)cc(O)c1[N+](=O)[O-]	ZINC001228971243	805493591	/nfs/dbraw/zinc/49/35/91/805493591.db2.gz	MOXBHMBXJIWHRX-RXMQYKEDSA-N	0	2	257.198	0.946	20	5		CCBDLN
CCC[N@H+](CC(N)=O)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001595863810	982809822	/nfs/dbraw/zinc/80/98/22/982809822.db2.gz	FPPROPFQHYPBHU-UHFFFAOYSA-N	0	2	295.295	0.990	20	5		CCBDLN
CCC[N@@H+](CC(N)=O)Cc1cc(C(=O)[O-])ccc1[N+](=O)[O-]	ZINC001595863810	982809832	/nfs/dbraw/zinc/80/98/32/982809832.db2.gz	FPPROPFQHYPBHU-UHFFFAOYSA-N	0	2	295.295	0.990	20	5		CCBDLN
CO[C@H](C)c1nsc(NCCn2cc([N+](=O)[O-])cn2)n1	ZINC000337882000	214298066	/nfs/dbraw/zinc/29/80/66/214298066.db2.gz	VHRQYNVBPQHROC-SSDOTTSWSA-N	0	2	298.328	0.884	20	5		CCBDLN
NC(=O)[C@H]1C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000600315377	361927505	/nfs/dbraw/zinc/92/75/05/361927505.db2.gz	MOPBVPJNJVVBCU-LJGSYFOKSA-N	0	2	279.252	0.294	20	5		CCBDLN
CNC(=O)Cc1noc(-c2ccc([N+](=O)[O-])c(O)c2)n1	ZINC000189937282	529874842	/nfs/dbraw/zinc/87/48/42/529874842.db2.gz	CMVVWZJNQQMZFF-UHFFFAOYSA-N	0	2	278.224	0.639	20	5		CCBDLN
Cc1ccc(C(=O)NCc2n[nH]c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000358365043	232088835	/nfs/dbraw/zinc/08/88/35/232088835.db2.gz	GEMBHIXNSHDNBW-UHFFFAOYSA-N	0	2	277.240	0.657	20	5		CCBDLN
O=C(NC[C@H](O)C(F)(F)F)c1ccc([N+](=O)[O-])cc1O	ZINC000273237536	192083921	/nfs/dbraw/zinc/08/39/21/192083921.db2.gz	PRAXMUOCLSLHPJ-QMMMGPOBSA-N	0	2	294.185	0.953	20	5		CCBDLN
Cn1nccc1CNC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000029707482	348114694	/nfs/dbraw/zinc/11/46/94/348114694.db2.gz	NRYYSDNWHUYFDW-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
O=C(N[C@H](CO)[C@H]1CCCO1)c1ccc([N+](=O)[O-])c(O)c1	ZINC000344930973	137222563	/nfs/dbraw/zinc/22/25/63/137222563.db2.gz	YTWPEWABUPUFPX-BXKDBHETSA-N	0	2	296.279	0.570	20	5		CCBDLN
CC(C)(C(N)=O)C(=O)Nc1ccc(O)c([N+](=O)[O-])c1	ZINC000618241488	365956348	/nfs/dbraw/zinc/95/63/48/365956348.db2.gz	UYWKMLCFDNVSOV-UHFFFAOYSA-N	0	2	267.241	0.750	20	5		CCBDLN
Cc1sc(C(=O)NN2CC(=O)N(C)C2=O)cc1[N+](=O)[O-]	ZINC000271291050	191053290	/nfs/dbraw/zinc/05/32/90/191053290.db2.gz	QHEFQCWBAJROQN-UHFFFAOYSA-N	0	2	298.280	0.504	20	5		CCBDLN
C[C@@H](CO)N(C)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182155662	351348616	/nfs/dbraw/zinc/34/86/16/351348616.db2.gz	OXGVGEOMFCJEOV-ZETCQYMHSA-N	0	2	254.242	0.753	20	5		CCBDLN
NC(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000225897193	352017209	/nfs/dbraw/zinc/01/72/09/352017209.db2.gz	LKIRAGYQQJAVMO-MRVPVSSYSA-N	0	2	279.252	0.248	20	5		CCBDLN
O=C1N[C@@H](c2ccc([N+](=O)[O-])c(O)c2)N2CCSC[C@@H]12	ZINC000270833260	352993372	/nfs/dbraw/zinc/99/33/72/352993372.db2.gz	UCTDMLJMMGXKJS-GXSJLCMTSA-N	0	2	295.320	0.846	20	5		CCBDLN
CCn1cnnc1CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000272369773	353057519	/nfs/dbraw/zinc/05/75/19/353057519.db2.gz	PDPOAGUTJYJPMP-UHFFFAOYSA-N	0	2	291.267	0.842	20	5		CCBDLN
NC(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274717379	353156136	/nfs/dbraw/zinc/15/61/36/353156136.db2.gz	BKNMUBNCTDGDTR-SSDOTTSWSA-N	0	2	279.252	0.248	20	5		CCBDLN
C[C@@H]1OCC[C@]1(O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000279641177	353307085	/nfs/dbraw/zinc/30/70/85/353307085.db2.gz	YZTRLPYPIZBTNW-SDBXPKJASA-N	0	2	296.279	0.570	20	5		CCBDLN
CCC[C@H](NC(=O)c1cccc(O)c1[N+](=O)[O-])C(N)=O	ZINC000286206494	353569083	/nfs/dbraw/zinc/56/90/83/353569083.db2.gz	CCPKJHGJKDXXQO-QMMMGPOBSA-N	0	2	281.268	0.684	20	5		CCBDLN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)NOCC1CC1	ZINC000293774166	353838546	/nfs/dbraw/zinc/83/85/46/353838546.db2.gz	NBKSNBZYTNGVBZ-UHFFFAOYSA-N	0	2	293.279	0.782	20	5		CCBDLN
CCNC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000294192763	353877684	/nfs/dbraw/zinc/87/76/84/353877684.db2.gz	WYPKPZKIPMZTPP-UHFFFAOYSA-N	0	2	296.283	0.349	20	5		CCBDLN
COCC1(O)CN(C(=O)c2cccc(O)c2[N+](=O)[O-])C1	ZINC000297035125	200067113	/nfs/dbraw/zinc/06/71/13/200067113.db2.gz	VKAYQECXJPOCJI-UHFFFAOYSA-N	0	2	282.252	0.134	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CCC(O)(CO)CC1	ZINC000598181222	361350166	/nfs/dbraw/zinc/35/01/66/361350166.db2.gz	LDATYLPTHPYBNW-UHFFFAOYSA-N	0	2	296.279	0.260	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC(O)(CO)CC1	ZINC000598179388	361348965	/nfs/dbraw/zinc/34/89/65/361348965.db2.gz	XBPZTFMUPREOEV-UHFFFAOYSA-N	0	2	296.279	0.260	20	5		CCBDLN
C[C@@H](O)C1(NC(=O)c2ccc([N+](=O)[O-])c(O)c2)CC1	ZINC000598383967	361401561	/nfs/dbraw/zinc/40/15/61/361401561.db2.gz	AJOSBHHHLPSSIR-SSDOTTSWSA-N	0	2	266.253	0.944	20	5		CCBDLN
COC[C@@](C)(CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000613534363	364286451	/nfs/dbraw/zinc/28/64/51/364286451.db2.gz	MEXVTCGEMGVRKD-GFCCVEGCSA-N	0	2	284.268	0.428	20	5		CCBDLN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)c1ncn(C)n1	ZINC000275478697	193053852	/nfs/dbraw/zinc/05/38/52/193053852.db2.gz	FTQSPNSMYMZCAT-SSDOTTSWSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(N[C@]1(CCO)CCOC1)c1cc([N+](=O)[O-])ccc1O	ZINC000278058054	193825990	/nfs/dbraw/zinc/82/59/90/193825990.db2.gz	JXTUIMFUQXJUGG-CYBMUJFWSA-N	0	2	296.279	0.572	20	5		CCBDLN
CCCN(CC(=O)NC)C(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000280928636	195032749	/nfs/dbraw/zinc/03/27/49/195032749.db2.gz	KDYWTKYUQDLXLY-UHFFFAOYSA-N	0	2	295.295	0.899	20	5		CCBDLN
CC(C)(CO)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000281189030	195141927	/nfs/dbraw/zinc/14/19/27/195141927.db2.gz	KDMFHQSCRWCXGZ-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
COC[C@H](CO)NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355515789	389087605	/nfs/dbraw/zinc/08/76/05/389087605.db2.gz	WMZJWZNZORUBHT-ZETCQYMHSA-N	0	2	270.241	0.038	20	5		CCBDLN
O=c1[nH]nc(SCCn2cc([N+](=O)[O-])cn2)[nH]1	ZINC000194625815	389099426	/nfs/dbraw/zinc/09/94/26/389099426.db2.gz	AHPJLLOYDVNTEO-UHFFFAOYSA-N	0	2	256.247	0.407	20	5		CCBDLN
C[S@](=O)CCCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000182000006	389697401	/nfs/dbraw/zinc/69/74/01/389697401.db2.gz	GNAPXIXMYHNIOF-IBGZPJMESA-N	0	2	286.309	0.799	20	5		CCBDLN
CN1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC1=O	ZINC000436957867	389987572	/nfs/dbraw/zinc/98/75/72/389987572.db2.gz	BKHXOFASMIRIOO-UHFFFAOYSA-N	0	2	265.225	0.172	20	5		CCBDLN
O=C(NC[C@@H](O)C(F)F)c1cc([N+](=O)[O-])ccc1O	ZINC000436970922	389988947	/nfs/dbraw/zinc/98/89/47/389988947.db2.gz	GNRLHPMUZFJOME-MRVPVSSYSA-N	0	2	276.195	0.656	20	5		CCBDLN
COC(=O)[C@H](CF)NC(=O)c1cccc(O)c1[N+](=O)[O-]	ZINC000489646159	390101590	/nfs/dbraw/zinc/10/15/90/390101590.db2.gz	APEAFSCOMLFUOV-ZETCQYMHSA-N	0	2	286.215	0.541	20	5		CCBDLN
COCC[C@@H](CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000281640597	195318384	/nfs/dbraw/zinc/31/83/84/195318384.db2.gz	NDDZGEMKFMVYLH-VIFPVBQESA-N	0	2	284.268	0.428	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])cc1O)N1CC[C@H](CO)[C@@H](O)C1	ZINC000567159645	390675369	/nfs/dbraw/zinc/67/53/69/390675369.db2.gz	SHFVBXVFDMADMN-PELKAZGASA-N	0	2	296.279	0.116	20	5		CCBDLN
CC(=O)NC1CN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000191508485	130246289	/nfs/dbraw/zinc/24/62/89/130246289.db2.gz	NJTZJWAZMZTCKY-UHFFFAOYSA-N	0	2	279.252	0.261	20	5		CCBDLN
CCN(C)C(=O)[C@H](C)NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000191557613	130254170	/nfs/dbraw/zinc/25/41/70/130254170.db2.gz	MDKNQCJHVJEJFD-QMMMGPOBSA-N	0	2	295.295	0.897	20	5		CCBDLN
CCONC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000253489298	131143733	/nfs/dbraw/zinc/14/37/33/131143733.db2.gz	DTRGMERWXLMVGI-UHFFFAOYSA-N	0	2	267.241	0.392	20	5		CCBDLN
CN1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])c(O)c2)C1=O	ZINC000172417682	290212706	/nfs/dbraw/zinc/21/27/06/290212706.db2.gz	ATHAVVPELOETCM-QMMMGPOBSA-N	0	2	279.252	0.261	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N1CC[C@@H](O)C1	ZINC000280944812	304550677	/nfs/dbraw/zinc/55/06/77/304550677.db2.gz	IFMJRGWMCSTKJB-SSDOTTSWSA-N	0	2	252.226	0.507	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC[S@]1=O	ZINC000353227048	300188335	/nfs/dbraw/zinc/18/83/35/300188335.db2.gz	FGDZODYDGWJWAC-FHZGZLOMSA-N	0	2	298.320	0.893	20	5		CCBDLN
C[C@H]1CN(C(=O)c2cc([N+](=O)[O-])ccc2O)CC(=O)N1C	ZINC000282466815	300188924	/nfs/dbraw/zinc/18/89/24/300188924.db2.gz	ULFVUMPVNPFYMX-QMMMGPOBSA-N	0	2	293.279	0.603	20	5		CCBDLN
NC(=O)C1CCN(C(=O)c2cccc(O)c2[N+](=O)[O-])CC1	ZINC000354282555	303239853	/nfs/dbraw/zinc/23/98/53/303239853.db2.gz	OYEOSMBVYRSHEK-UHFFFAOYSA-N	0	2	293.279	0.638	20	5		CCBDLN
O=C(N[C@H]1CCCCNC1=O)c1ccc([N+](=O)[O-])cc1O	ZINC000128876314	303951596	/nfs/dbraw/zinc/95/15/96/303951596.db2.gz	KWNYLWIMGQRXAA-JTQLQIEISA-N	0	2	293.279	0.699	20	5		CCBDLN
Cc1n[nH]nc1C(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC000789995349	581169820	/nfs/dbraw/zinc/16/98/20/581169820.db2.gz	NJUADKYBBITAPF-UHFFFAOYSA-N	0	2	263.213	0.979	20	5		CCBDLN
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CC(=O)[O-]	ZINC000130173280	605803172	/nfs/dbraw/zinc/80/31/72/605803172.db2.gz	WOSYKGXCFIASER-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)CC(=O)[O-]	ZINC000130173280	605803175	/nfs/dbraw/zinc/80/31/75/605803175.db2.gz	WOSYKGXCFIASER-QMMMGPOBSA-N	0	2	281.268	0.938	20	5		CCBDLN
COc1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])c(OC)n1	ZINC000839596332	617270575	/nfs/dbraw/zinc/27/05/75/617270575.db2.gz	VUFGVLXTONQCHJ-HTRCEHHLSA-N	0	2	267.241	0.703	20	5		CCBDLN
CSc1cc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])ncn1	ZINC000892988447	617279974	/nfs/dbraw/zinc/27/99/74/617279974.db2.gz	UHIVCHLEDFXLHA-PHDIDXHHSA-N	0	2	254.271	0.802	20	5		CCBDLN
COC(=O)C(C)(C)n1ccc(NC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1	ZINC000855899838	616344927	/nfs/dbraw/zinc/34/49/27/616344927.db2.gz	VSBFBQUNDLZLLH-HTQZYQBOSA-N	0	2	296.283	0.395	20	5		CCBDLN
O=CN1CCCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])CC1	ZINC000816267539	641148554	/nfs/dbraw/zinc/14/85/54/641148554.db2.gz	PYQVVCJJDBAMRK-UHFFFAOYSA-N	0	2	293.279	0.605	20	5		CCBDLN
CSc1nc(OC[C@H]2C[C@@H](O)C2)c([N+](=O)[O-])c(=O)[nH]1	ZINC001218432475	803957489	/nfs/dbraw/zinc/95/74/89/803957489.db2.gz	VBWKRRKZTVTQCP-OLQVQODUSA-N	0	2	287.297	0.962	20	5		CCBDLN
CSc1nc(O[C@@H](C)CON)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227628875	805374314	/nfs/dbraw/zinc/37/43/14/805374314.db2.gz	RQVDIHNLROZQLF-BYPYZUCNSA-N	0	2	276.274	0.470	20	5		CCBDLN
O=c1cc(O)nc(O[C@H](C[N+](=O)[O-])c2cccnc2)[nH]1	ZINC001228388051	805441884	/nfs/dbraw/zinc/44/18/84/805441884.db2.gz	FZICZDYZQUZJHI-MRVPVSSYSA-N	0	2	278.224	0.680	20	5		CCBDLN
CC(=O)N[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC001299651518	904073463	/nfs/dbraw/zinc/07/34/63/904073463.db2.gz	WJHXOPXCIFUCDN-SECBINFHSA-N	0	2	293.279	0.651	20	5		CCBDLN
Cn1ncc([N+](=O)[O-])c1N1CCC[C@@H](c2n[nH]c(=O)[nH]2)C1	ZINC001307118075	908282462	/nfs/dbraw/zinc/28/24/62/908282462.db2.gz	IPBNERKHAZIOCU-SSDOTTSWSA-N	0	2	293.287	0.536	20	5		CCBDLN
COCc1nsc(NC(=O)c2nn(C)cc2[N+](=O)[O-])n1	ZINC001320905094	910927468	/nfs/dbraw/zinc/92/74/68/910927468.db2.gz	MMKMRSWCJAPQEO-UHFFFAOYSA-N	0	2	298.284	0.579	20	5		CCBDLN
O=C(OCc1ccc2nn[nH]c2c1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC001343397441	923300363	/nfs/dbraw/zinc/30/03/63/923300363.db2.gz	OJXFMGGANDBNSF-GMSGAONNSA-N	0	2	262.225	0.666	20	5		CCBDLN
O=[N+]([O-])[C@@H]1C[C@H]1c1nc(COC[C@H]2CCOC2)no1	ZINC001345944089	924020260	/nfs/dbraw/zinc/02/02/60/924020260.db2.gz	KFLZUODMSPMHBR-DJLDLDEBSA-N	0	2	269.257	0.755	20	5		CCBDLN
O=C(CNC(=O)c1cc([N+](=O)[O-])ccc1O)N1CCCO1	ZINC000600060738	361859185	/nfs/dbraw/zinc/85/91/85/361859185.db2.gz	UDRCLJOVMQJHPL-UHFFFAOYSA-N	0	2	295.251	0.194	20	5		CCBDLN
CCc1n[nH]c(NC(=O)c2nn(CC)cc2[N+](=O)[O-])n1	ZINC000191852120	529699057	/nfs/dbraw/zinc/69/90/57/529699057.db2.gz	IFCFSUCBRVQWMV-UHFFFAOYSA-N	0	2	279.260	0.744	20	5		CCBDLN
CCN(CCOCCO)C(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000314036544	137078686	/nfs/dbraw/zinc/07/86/86/137078686.db2.gz	OYJFARQEAKKYLM-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
CCn1cc(S(=O)(=O)Nc2ccncc2[N+](=O)[O-])cn1	ZINC000347299406	137329979	/nfs/dbraw/zinc/32/99/79/137329979.db2.gz	CDINBDMUTIQNKF-UHFFFAOYSA-N	0	2	297.296	0.429	20	5		CCBDLN
Cn1cnc([N+](=O)[O-])c1NCCCc1n[nH]c(=O)[nH]1	ZINC000348706017	137376381	/nfs/dbraw/zinc/37/63/81/137376381.db2.gz	MJPDMLFQTDSPLY-UHFFFAOYSA-N	0	2	267.249	0.197	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CCC[C@H]1CO	ZINC000133292404	350332017	/nfs/dbraw/zinc/33/20/17/350332017.db2.gz	ZXQOQQNIEVSPLT-VIFPVBQESA-N	0	2	266.253	0.897	20	5		CCBDLN
O=C(NCC(F)(F)CO)c1cc([N+](=O)[O-])ccc1O	ZINC000186102610	351475795	/nfs/dbraw/zinc/47/57/95/351475795.db2.gz	UHYQTBLRDGRKAI-UHFFFAOYSA-N	0	2	276.195	0.658	20	5		CCBDLN
O=C(c1cccc(O)c1[N+](=O)[O-])N(CCO)C1CC1	ZINC000295161170	199378736	/nfs/dbraw/zinc/37/87/36/199378736.db2.gz	DEZBSWNZFHNBFM-UHFFFAOYSA-N	0	2	266.253	0.897	20	5		CCBDLN
C[C@@]1(C(N)=O)CCN(C(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000235425048	352183841	/nfs/dbraw/zinc/18/38/41/352183841.db2.gz	IZOSQDPCLUYWTM-CYBMUJFWSA-N	0	2	293.279	0.638	20	5		CCBDLN
CC[C@@H](NC(=O)c1cc([N+](=O)[O-])ccc1O)C(=O)OC	ZINC000272435264	353064409	/nfs/dbraw/zinc/06/44/09/353064409.db2.gz	SZZGMCRTMSWZLP-SECBINFHSA-N	0	2	282.252	0.982	20	5		CCBDLN
COC[C@H](CNC(=O)c1cc([N+](=O)[O-])ccc1O)OC	ZINC000272924988	353106519	/nfs/dbraw/zinc/10/65/19/353106519.db2.gz	KONGDSJUXJVJPS-VIFPVBQESA-N	0	2	284.268	0.692	20	5		CCBDLN
O=C(NC[C@@H](O)C1CC1)c1ccc([N+](=O)[O-])cc1O	ZINC000274746517	353158677	/nfs/dbraw/zinc/15/86/77/353158677.db2.gz	GPINGUBOPCUFCP-LLVKDONJSA-N	0	2	266.253	0.801	20	5		CCBDLN
COC(=O)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2O)C1	ZINC000274668246	353151039	/nfs/dbraw/zinc/15/10/39/353151039.db2.gz	GTALZHWDIILADP-MRVPVSSYSA-N	0	2	294.263	0.936	20	5		CCBDLN
C[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1O)c1ncnn1C	ZINC000276963792	353214155	/nfs/dbraw/zinc/21/41/55/353214155.db2.gz	ZPBOKXGLMKDUOK-ZETCQYMHSA-N	0	2	291.267	0.920	20	5		CCBDLN
O=C(CNC(=O)c1cccc(O)c1[N+](=O)[O-])OCC1CC1	ZINC000280764631	353381248	/nfs/dbraw/zinc/38/12/48/353381248.db2.gz	LUXGUVMNIWZWEY-UHFFFAOYSA-N	0	2	294.263	0.983	20	5		CCBDLN
CN(C(=O)c1ccc([N+](=O)[O-])c(O)c1)[C@@H]1COC[C@H]1O	ZINC000287136546	353628310	/nfs/dbraw/zinc/62/83/10/353628310.db2.gz	DLPAZRKRDXCKQE-MWLCHTKSSA-N	0	2	282.252	0.132	20	5		CCBDLN
CC[C@H](O)CNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000293637773	353825772	/nfs/dbraw/zinc/82/57/72/353825772.db2.gz	HDUXSFKMZUIQRU-QMMMGPOBSA-N	0	2	254.242	0.801	20	5		CCBDLN
Cn1cc(NC(=O)c2cc(O)ccc2[N+](=O)[O-])nn1	ZINC000361159486	138023537	/nfs/dbraw/zinc/02/35/37/138023537.db2.gz	MGEDGGFYAPVJQR-UHFFFAOYSA-N	0	2	263.213	0.681	20	5		CCBDLN
O=C(c1cc(O)ccc1[N+](=O)[O-])N1CC[C@@H](CO)[C@@H](O)C1	ZINC000560668533	291111286	/nfs/dbraw/zinc/11/12/86/291111286.db2.gz	SDURYYBGCJKSQC-UFBFGSQYSA-N	0	2	296.279	0.116	20	5		CCBDLN
O=C(c1ccc([N+](=O)[O-])c(O)c1)N1CCO[C@H]2C[C@H]21	ZINC000590435236	359461351	/nfs/dbraw/zinc/46/13/51/359461351.db2.gz	PZDGJTPRDPADAK-KOLCDFICSA-N	0	2	264.237	0.914	20	5		CCBDLN
COC[C@@H]1C[C@@H](O)CN1C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000593810233	360162307	/nfs/dbraw/zinc/16/23/07/360162307.db2.gz	FYSHLQFGEKZXKM-VHSXEESVSA-N	0	2	296.279	0.522	20	5		CCBDLN
COC[C@H]1C[C@@H](O)CN1C(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000593816894	360168116	/nfs/dbraw/zinc/16/81/16/360168116.db2.gz	RDMHXVOGHLTUFN-NXEZZACHSA-N	0	2	296.279	0.522	20	5		CCBDLN
[NH3+][C@@H]1C[C@@H]2C[N@@H+](Cc3cccc([N+](=O)[O-])c3)CCN2C1=O	ZINC000565234232	291364615	/nfs/dbraw/zinc/36/46/15/291364615.db2.gz	SHLZIZMBKRWJTO-CHWSQXEVSA-N	0	2	290.323	0.339	20	5		CCBDLN
COCCCN(CCO)C(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000275971264	193177138	/nfs/dbraw/zinc/17/71/38/193177138.db2.gz	LRRKXFVCONSIJJ-UHFFFAOYSA-N	0	2	298.295	0.771	20	5		CCBDLN
COC[C@H]1CN(C(=O)c2cccc(O)c2[N+](=O)[O-])CCO1	ZINC000280693383	194932431	/nfs/dbraw/zinc/93/24/31/194932431.db2.gz	DPPAKCIUMHDERV-SECBINFHSA-N	0	2	296.279	0.788	20	5		CCBDLN
O=C(NCC(F)(F)CO)c1ccc([N+](=O)[O-])c(O)c1	ZINC000186072405	388822432	/nfs/dbraw/zinc/82/24/32/388822432.db2.gz	XVONYVJTJSRALG-UHFFFAOYSA-N	0	2	276.195	0.658	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@@H]1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355832684	389116977	/nfs/dbraw/zinc/11/69/77/389116977.db2.gz	JJXBVOXDJDWPDI-WRWORJQWSA-N	0	2	293.279	0.555	20	5		CCBDLN
C[C@H]1CCNC(=O)[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000195151444	389117120	/nfs/dbraw/zinc/11/71/20/389117120.db2.gz	SSHYTQDVMKEYGB-CPCISQLKSA-N	0	2	293.279	0.555	20	5		CCBDLN
CC(C)NC(=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000179432876	389656299	/nfs/dbraw/zinc/65/62/99/389656299.db2.gz	HBESLIITGSUWFF-UHFFFAOYSA-N	0	2	295.295	0.945	20	5		CCBDLN
O=C(c1cc([N+](=O)[O-])ccc1O)N1CC(O)(C2CC2)C1	ZINC000375413328	389674305	/nfs/dbraw/zinc/67/43/05/389674305.db2.gz	GIZMWQXIWVNWCH-UHFFFAOYSA-N	0	2	278.264	0.897	20	5		CCBDLN
C[C@@]1(O)C[C@H](NC(=O)c2cc(O)ccc2[N+](=O)[O-])C1	ZINC000416281404	389724138	/nfs/dbraw/zinc/72/41/38/389724138.db2.gz	AAZAVLMDDWEDHZ-OGXFKERWSA-N	0	2	266.253	0.944	20	5		CCBDLN
Nc1noc(CCNC(=O)c2ccc([N+](=O)[O-])cc2O)n1	ZINC000436982346	389988879	/nfs/dbraw/zinc/98/88/79/389988879.db2.gz	UBNORAKXCMJQHQ-UHFFFAOYSA-N	0	2	293.239	0.068	20	5		CCBDLN
CC(C)(CO)NC(=O)c1ccc([N+](=O)[O-])c(O)c1	ZINC000267443285	131871657	/nfs/dbraw/zinc/87/16/57/131871657.db2.gz	DECDYRWMJZQDKZ-UHFFFAOYSA-N	0	2	254.242	0.801	20	5		CCBDLN
Cn1cc(CNC(=O)c2ccc([N+](=O)[O-])cc2O)cn1	ZINC000184691415	397422831	/nfs/dbraw/zinc/42/28/31/397422831.db2.gz	STWFUBPHEUMIKB-UHFFFAOYSA-N	0	2	276.252	0.964	20	5		CCBDLN
C[C@@H]1CCNC(=O)[C@H]1NC(=O)c1cc(O)ccc1[N+](=O)[O-]	ZINC000355832677	296574975	/nfs/dbraw/zinc/57/49/75/296574975.db2.gz	JJXBVOXDJDWPDI-HQJQHLMTSA-N	0	2	293.279	0.555	20	5		CCBDLN
C[N@H+](CC(=O)[O-])CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000035305195	172119895	/nfs/dbraw/zinc/11/98/95/172119895.db2.gz	ZIFHRBTXWQURBT-UHFFFAOYSA-N	0	2	267.241	0.550	20	5		CCBDLN
C[N@@H+](CC(=O)[O-])CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000035305195	172119898	/nfs/dbraw/zinc/11/98/98/172119898.db2.gz	ZIFHRBTXWQURBT-UHFFFAOYSA-N	0	2	267.241	0.550	20	5		CCBDLN
CC1(C(N)=O)CN(C(=O)c2ccc([N+](=O)[O-])c(O)c2)C1	ZINC000578991793	335696803	/nfs/dbraw/zinc/69/68/03/335696803.db2.gz	OSHQHTWFNLUPQY-UHFFFAOYSA-N	0	2	279.252	0.248	20	5		CCBDLN
C[S@@](=O)CCNC(=O)c1cc([N+](=O)[O-])ccc1O	ZINC000779664025	581198175	/nfs/dbraw/zinc/19/81/75/581198175.db2.gz	UIUTWGBWLZQXQP-GOSISDBHSA-N	0	2	272.282	0.409	20	5		CCBDLN
CC(C)c1[nH]nc(C(=O)OCc2n[nH]c(=O)[nH]2)c1[N+](=O)[O-]	ZINC000796258908	581435286	/nfs/dbraw/zinc/43/52/86/581435286.db2.gz	WMSNPIVSOPRZSG-UHFFFAOYSA-N	0	2	296.243	0.622	20	5		CCBDLN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cnnn1C	ZINC000788206013	581485376	/nfs/dbraw/zinc/48/53/76/581485376.db2.gz	SPRJLLBSGBZPFF-UHFFFAOYSA-N	0	2	297.296	0.833	20	5		CCBDLN
O=C(NCCCc1nnc[nH]1)c1cc(O)ccc1[N+](=O)[O-]	ZINC000217315777	581559090	/nfs/dbraw/zinc/55/90/90/581559090.db2.gz	KXKNGMPHCODOPZ-UHFFFAOYSA-N	0	2	291.267	0.781	20	5		CCBDLN
O=C([O-])N1CC[C@H]2CC[C@@H](C1)[N@@H+]2Cn1nccc1[N+](=O)[O-]	ZINC000834096841	605945782	/nfs/dbraw/zinc/94/57/82/605945782.db2.gz	DMIYXMMUZWJFCG-ZJUUUORDSA-N	0	2	295.299	0.966	20	5		CCBDLN
O=C([O-])N1CC[C@H]2CC[C@@H](C1)[N@H+]2Cn1nccc1[N+](=O)[O-]	ZINC000834096841	605945784	/nfs/dbraw/zinc/94/57/84/605945784.db2.gz	DMIYXMMUZWJFCG-ZJUUUORDSA-N	0	2	295.299	0.966	20	5		CCBDLN
CCN(C(=O)[C@@H]1C[C@H]1[N+](=O)[O-])c1ncc(C(=O)OC)s1	ZINC000841398655	614652116	/nfs/dbraw/zinc/65/21/16/614652116.db2.gz	WKHPODVJKNDNHS-RNFRBKRXSA-N	0	2	299.308	0.948	20	5		CCBDLN
CNC(=O)[C@H]1Cc2ccccc2N1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000841240212	616889618	/nfs/dbraw/zinc/88/96/18/616889618.db2.gz	FMRGOQCFSMFAPM-YUSALJHKSA-N	0	2	289.291	0.356	20	5		CCBDLN
O=C(NCc1n[nH]c(-c2ccccc2)n1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839619214	640347134	/nfs/dbraw/zinc/34/71/34/640347134.db2.gz	ZZGHMGTVMSTHTK-NXEZZACHSA-N	0	2	287.279	0.753	20	5		CCBDLN
O=C(NCc1nc(-c2ccccc2)n[nH]1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000839619214	640347138	/nfs/dbraw/zinc/34/71/38/640347138.db2.gz	ZZGHMGTVMSTHTK-NXEZZACHSA-N	0	2	287.279	0.753	20	5		CCBDLN
O=C(NC/C=C/CO)c1ccc([N+](=O)[O-])cc1O	ZINC001165974087	802879084	/nfs/dbraw/zinc/87/90/84/802879084.db2.gz	RILIFDSAGFDEGZ-OWOJBTEDSA-N	0	2	252.226	0.579	20	5		CCBDLN
CSc1nc(O[C@H]2CCOC2=O)c([N+](=O)[O-])c(=O)[nH]1	ZINC001227624853	805373267	/nfs/dbraw/zinc/37/32/67/805373267.db2.gz	HGYIWOVPGXKCFA-BYPYZUCNSA-N	0	2	287.253	0.507	20	5		CCBDLN
O=[N+]([O-])c1c(O)cc(O)cc1OC1COCOC1	ZINC001228972589	805494122	/nfs/dbraw/zinc/49/41/22/805494122.db2.gz	ZRKHXUAGMRNLJF-UHFFFAOYSA-N	0	2	257.198	0.758	20	5		CCBDLN
COCC(=O)NCCC(=O)Nc1cc([N+](=O)[O-])ccc1O	ZINC001319738336	910277310	/nfs/dbraw/zinc/27/73/10/910277310.db2.gz	VRLXOQXMICGGBW-UHFFFAOYSA-N	0	2	297.267	0.392	20	5		CCBDLN