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(/C=C\c1ccccc1[N+](=O)[O-])OCC(=O)Nc1ccc(Cl)cn1	ZINC000097655820	728483592	/nfs/dbraw/zinc/48/35/92/728483592.db2.gz	QOTQDSKVVFEEAF-YVMONPNESA-N	0	0	361.741	2.838	50	5		FFBARN
O=C(Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)o1)c1ccccc1	ZINC000001087428	203981958	/nfs/dbraw/zinc/98/19/58/203981958.db2.gz	DPZDLAHFTWFPCH-UHFFFAOYSA-N	0	0	373.346	2.668	50	5		FFBARN
CCCN1c2ccccc2[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000001133912	203985441	/nfs/dbraw/zinc/98/54/41/203985441.db2.gz	ZVSMYRMNAXHGFA-LJQANCHMSA-N	0	0	354.362	2.812	50	5		FFBARN
COC(=O)c1ccc(NC(=S)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000001173196	203991110	/nfs/dbraw/zinc/99/11/10/203991110.db2.gz	DDQSCNDAODCPSN-UHFFFAOYSA-N	0	0	373.390	2.817	50	5		FFBARN
O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1cccc([N+](=O)[O-])c1	ZINC000001466562	204009185	/nfs/dbraw/zinc/00/91/85/204009185.db2.gz	SXMSCYZJCOLBOV-UHFFFAOYSA-N	0	0	353.334	2.610	50	5		FFBARN
O=C1CCCc2nc3nc(SCc4ccc([N+](=O)[O-])cc4)nn3cc21	ZINC000002334268	204034293	/nfs/dbraw/zinc/03/42/93/204034293.db2.gz	JATDLETZMSAUPW-UHFFFAOYSA-N	0	0	355.379	2.844	50	5		FFBARN
O=C(c1ccn(COc2ccc([N+](=O)[O-])cc2Cl)n1)N1CCCC1	ZINC000002799174	204058803	/nfs/dbraw/zinc/05/88/03/204058803.db2.gz	SMSAGUIHGRTNGW-UHFFFAOYSA-N	0	0	350.762	2.717	50	5		FFBARN
O=C1OCC2=C1[C@@H](c1ccccc1[N+](=O)[O-])c1cc3c(cc1N2)OCCO3	ZINC000004051774	204119873	/nfs/dbraw/zinc/11/98/73/204119873.db2.gz	DERNCXGDCOYZIX-KRWDZBQOSA-N	0	0	366.329	2.734	50	5		FFBARN
O=C(CSc1nncn1-c1ccccc1)Nc1cccc([N+](=O)[O-])c1	ZINC000003544146	204106098	/nfs/dbraw/zinc/10/60/98/204106098.db2.gz	ZGQUCPBXTITZJV-UHFFFAOYSA-N	0	0	355.379	2.906	50	5		FFBARN
COc1ccc(C2=N/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000004644263	204151662	/nfs/dbraw/zinc/15/16/62/204151662.db2.gz	UBRQTLGFVCUCIB-JYRVWZFOSA-N	0	0	369.289	2.856	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004731992	204159487	/nfs/dbraw/zinc/15/94/87/204159487.db2.gz	KPBOHTIMHJXDPW-NSHDSACASA-N	0	0	373.340	2.734	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC[C@H](C(=O)N2CCCCCC2)C1	ZINC000004746127	204161083	/nfs/dbraw/zinc/16/10/83/204161083.db2.gz	IZXVXUJJNOOBKR-INIZCTEOSA-N	0	0	359.426	2.850	50	5		FFBARN
COc1ccc(C(=O)Nc2nnc(-c3ccncc3)s2)cc1[N+](=O)[O-]	ZINC000004749964	204161963	/nfs/dbraw/zinc/16/19/63/204161963.db2.gz	ASYZTXBXLGRNRT-UHFFFAOYSA-N	0	0	357.351	2.769	50	5		FFBARN
CCOc1ccc(C(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)cc1	ZINC000004412054	204138795	/nfs/dbraw/zinc/13/87/95/204138795.db2.gz	FUMRYGBBIOBTGO-UHFFFAOYSA-N	0	0	353.334	2.586	50	5		FFBARN
CCNC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1OC	ZINC000004520395	204144877	/nfs/dbraw/zinc/14/48/77/204144877.db2.gz	OZQPIDXBHWFDOW-FOWTUZBSSA-N	0	0	369.377	2.510	50	5		FFBARN
COc1cc(NC(=O)c2noc(C(C)C)c2[N+](=O)[O-])cc(OC)c1OC	ZINC000004937537	204177744	/nfs/dbraw/zinc/17/77/44/204177744.db2.gz	VNUWAWASFQBOKY-UHFFFAOYSA-N	0	0	365.342	2.984	50	5		FFBARN
Cc1nc2ccccc2c(=O)n1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005199088	204197775	/nfs/dbraw/zinc/19/77/75/204197775.db2.gz	FIRIJGWVRPUYPH-UHFFFAOYSA-N	0	0	358.741	2.650	50	5		FFBARN
Nc1cc(S(=O)(=O)N2CCCC2)ccc1Oc1ccc([N+](=O)[O-])cc1	ZINC000006584261	204254530	/nfs/dbraw/zinc/25/45/30/204254530.db2.gz	LCDKJDXGPDLQFS-UHFFFAOYSA-N	0	0	363.395	2.754	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1nn(C)c(=O)c2ccccc21	ZINC000007066797	204288155	/nfs/dbraw/zinc/28/81/55/204288155.db2.gz	NESLNVMHUCYCCR-LBPRGKRZSA-N	0	0	366.377	2.675	50	5		FFBARN
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)c1C	ZINC000007323162	204295704	/nfs/dbraw/zinc/29/57/04/204295704.db2.gz	OKAJGHBWQCLYAC-UHFFFAOYSA-N	0	0	364.379	2.784	50	5		FFBARN
O=C(Cn1c(=O)cnc2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000007985730	204312350	/nfs/dbraw/zinc/31/23/50/204312350.db2.gz	CFFOSADVXKGCQI-UHFFFAOYSA-N	0	0	358.741	2.597	50	5		FFBARN
COc1cccc(N2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1	ZINC000008247520	204323369	/nfs/dbraw/zinc/32/33/69/204323369.db2.gz	ROSYEPLEFSKFDZ-LBPRGKRZSA-N	0	0	355.350	2.595	50	5		FFBARN
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1ccccc1F	ZINC000008246666	204324073	/nfs/dbraw/zinc/32/40/73/204324073.db2.gz	NHGXPJOSAZSUIE-UHFFFAOYSA-N	0	0	373.340	2.738	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)NCCOc1ccc(Cl)cc1	ZINC000007489420	204299216	/nfs/dbraw/zinc/29/92/16/204299216.db2.gz	KUGKOQJMYMTIKQ-UHFFFAOYSA-N	0	0	350.758	2.822	50	5		FFBARN
CN(Cc1cc([N+](=O)[O-])ccc1Cl)C(=O)CCNC(=O)c1ccco1	ZINC000008980775	204350058	/nfs/dbraw/zinc/35/00/58/204350058.db2.gz	LKRRLHNSPURDBP-UHFFFAOYSA-N	0	0	365.773	2.620	50	5		FFBARN
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCCOc2ccccc2)C1=O	ZINC000009453780	204368030	/nfs/dbraw/zinc/36/80/30/204368030.db2.gz	FHVCZDLPEOBECZ-LJQANCHMSA-N	0	0	369.377	2.831	50	5		FFBARN
CCOc1ccccc1CN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000009457822	204368147	/nfs/dbraw/zinc/36/81/47/204368147.db2.gz	URNKMGNTWLAPGN-LJQANCHMSA-N	0	0	369.377	2.961	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NC1c2ccccc2-c2ccccc21	ZINC000009685824	204378450	/nfs/dbraw/zinc/37/84/50/204378450.db2.gz	PTZGTRBIHQPUFH-UHFFFAOYSA-N	0	0	361.357	2.643	50	5		FFBARN
COc1cc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccn1	ZINC000012757037	204490937	/nfs/dbraw/zinc/49/09/37/204490937.db2.gz	WBQYJMILBHOWFO-UHFFFAOYSA-N	0	0	373.412	2.875	50	5		FFBARN
O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@H]1Cc2cc(Cl)ccc2O1	ZINC000015835143	204621150	/nfs/dbraw/zinc/62/11/50/204621150.db2.gz	LBCMNWSCNHVUHB-MRXNPFEDSA-N	0	0	361.785	2.780	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000017074881	204649593	/nfs/dbraw/zinc/64/95/93/204649593.db2.gz	UHUJDIGZHQZTNK-CQSZACIVSA-N	0	0	364.423	2.769	50	5		FFBARN
Cc1ccc(C(=O)COC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1C	ZINC000032724185	204933957	/nfs/dbraw/zinc/93/39/57/204933957.db2.gz	BZQQRLNJAPQSHK-UHFFFAOYSA-N	0	0	357.318	2.980	50	5		FFBARN
Cc1nn(Cn2cnc3c4ccccc4sc3c2=O)c(C)c1[N+](=O)[O-]	ZINC000036614537	205017307	/nfs/dbraw/zinc/01/73/07/205017307.db2.gz	OWPNILUZGMNAGE-UHFFFAOYSA-N	0	0	355.379	2.839	50	5		FFBARN
COc1ccc(C(=O)N(C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000055841056	205224265	/nfs/dbraw/zinc/22/42/65/205224265.db2.gz	CYTLETDBQDWEFQ-UHFFFAOYSA-N	0	0	357.366	2.866	50	5		FFBARN
O=C(c1cc2cc([N+](=O)[O-])ccc2[nH]1)N1CCC(C(=O)N2CCCC2)CC1	ZINC000056294133	205229685	/nfs/dbraw/zinc/22/96/85/205229685.db2.gz	ICQVKKBNURIPMW-UHFFFAOYSA-N	0	0	370.409	2.551	50	5		FFBARN
O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1	ZINC000056481623	205231416	/nfs/dbraw/zinc/23/14/16/205231416.db2.gz	IGXIUTLUTHIGJB-QGZVFWFLSA-N	0	0	353.378	2.688	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C[C@@H]1COc2ccccc2O1	ZINC000057451361	205240391	/nfs/dbraw/zinc/24/03/91/205240391.db2.gz	CJTPQHPCSHTCRL-CQSZACIVSA-N	0	0	371.393	2.614	50	5		FFBARN
CCN(Cc1cccc(F)c1)C(=O)[C@H](C)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000057637840	205242607	/nfs/dbraw/zinc/24/26/07/205242607.db2.gz	SWPWUUBGCGGTOG-ZDUSSCGKSA-N	0	0	373.384	2.901	50	5		FFBARN
CN1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])[C@H](c2ccccc2)C1	ZINC000055428170	205218988	/nfs/dbraw/zinc/21/89/88/205218988.db2.gz	SEAXFCHRQRVESK-IBGZPJMESA-N	0	0	368.437	2.912	50	5		FFBARN
COc1cccc(CNC(=O)c2c[nH]nc2-c2ccc([N+](=O)[O-])cc2)c1	ZINC000072329377	205512347	/nfs/dbraw/zinc/51/23/47/205512347.db2.gz	UBKLSODZMXAKCS-UHFFFAOYSA-N	0	0	352.350	2.924	50	5		FFBARN
Cc1cc(C(F)(F)F)nn1CCCNC(=O)c1ccccc1[N+](=O)[O-]	ZINC000002872615	206157498	/nfs/dbraw/zinc/15/74/98/206157498.db2.gz	MWTVJBLZWGQWFC-UHFFFAOYSA-N	0	0	356.304	2.939	50	5		FFBARN
CC(C)c1ccccc1NC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000003253249	206158815	/nfs/dbraw/zinc/15/88/15/206158815.db2.gz	HDKXXHZXYZGPEV-UHFFFAOYSA-N	0	0	367.361	2.953	50	5		FFBARN
CCOc1ccc(C(C)=O)cc1CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000003602247	206163497	/nfs/dbraw/zinc/16/34/97/206163497.db2.gz	KUOBCVUGPAIDQX-UHFFFAOYSA-N	0	0	368.345	2.992	50	5		FFBARN
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000004496297	206178815	/nfs/dbraw/zinc/17/88/15/206178815.db2.gz	WDTXNORBCWAQAT-UHFFFAOYSA-N	0	0	352.343	2.536	50	5		FFBARN
O=C(COC(=O)c1ccccn1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000005693510	206197108	/nfs/dbraw/zinc/19/71/08/206197108.db2.gz	UQLGYWUZDZEVNF-UHFFFAOYSA-N	0	0	369.255	2.804	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005672384	206198616	/nfs/dbraw/zinc/19/86/16/206198616.db2.gz	HVKOEVULOCKPLZ-LLVKDONJSA-N	0	0	371.349	2.737	50	5		FFBARN
CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)NC(=O)N1	ZINC000006046888	206201277	/nfs/dbraw/zinc/20/12/77/206201277.db2.gz	NIZCLMPPFNTJLT-MRXNPFEDSA-N	0	0	352.350	2.861	50	5		FFBARN
C[C@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000006646323	206203806	/nfs/dbraw/zinc/20/38/06/206203806.db2.gz	XELDYPPXWBJDHL-NSHDSACASA-N	0	0	359.407	2.663	50	5		FFBARN
O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1ccc(Cl)cc1	ZINC000000997408	206225320	/nfs/dbraw/zinc/22/53/20/206225320.db2.gz	DWODVLXZDJVJMR-UHFFFAOYSA-N	0	0	359.567	2.846	50	5		FFBARN
Cc1ccc(NC(=O)CCN2C(=O)c3ccccc3C2=O)cc1[N+](=O)[O-]	ZINC000002680421	206229922	/nfs/dbraw/zinc/22/99/22/206229922.db2.gz	UAPQJEKAZGJPEH-UHFFFAOYSA-N	0	0	353.334	2.528	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccccc1Cl	ZINC000103889818	206236368	/nfs/dbraw/zinc/23/63/68/206236368.db2.gz	HQLLCKYHWPVNOU-ZFWWWQNUSA-N	0	0	371.736	2.541	50	5		FFBARN
Cc1ccc(N2C(=O)[C@H]3ON=C(c4ccc([N+](=O)[O-])cc4)C3=C2O)c(C)c1	ZINC000103945263	206236742	/nfs/dbraw/zinc/23/67/42/206236742.db2.gz	PEODFDAIUIXEHI-RDJZCZTQSA-N	0	0	365.345	2.504	50	5		FFBARN
N=C1NC(=O)/C(=C/c2ccc(OC(=O)c3cccc([N+](=O)[O-])c3)cc2)S1	ZINC000005649392	206240681	/nfs/dbraw/zinc/24/06/81/206240681.db2.gz	FCJIBJVKKCVOGM-ZSOIEALJSA-N	0	0	369.358	2.953	50	5		FFBARN
COc1cccc(C(=O)/N=c2/sc3cc([N+](=O)[O-])ccc3n2C)c1OC	ZINC000012237936	206288490	/nfs/dbraw/zinc/28/84/90/206288490.db2.gz	YZGGRCGYHKFCRW-ISLYRVAYSA-N	0	0	373.390	2.906	50	5		FFBARN
NS(=O)(=O)c1ccc(N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1	ZINC000012552719	206293217	/nfs/dbraw/zinc/29/32/17/206293217.db2.gz	ZPDGYXSSTKHYEA-LBPRGKRZSA-N	0	0	353.425	2.645	50	5		FFBARN
Cc1ccc2cc(CCNC(=O)c3cccc([N+](=O)[O-])c3)c(=O)[nH]c2c1	ZINC000013523305	206303720	/nfs/dbraw/zinc/30/37/20/206303720.db2.gz	MONUMVQHAPTABM-UHFFFAOYSA-N	0	0	351.362	2.717	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1	ZINC000023057680	206398455	/nfs/dbraw/zinc/39/84/55/206398455.db2.gz	OUVUVGOOYBYVAA-DLBZAZTESA-N	0	0	374.485	2.674	50	5		FFBARN
Cc1cc(C(=O)N[C@@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])on1	ZINC000024483667	206410387	/nfs/dbraw/zinc/41/03/87/206410387.db2.gz	QEHNFLXPLPOJSO-ZDUSSCGKSA-N	0	0	361.354	2.704	50	5		FFBARN
CC(=O)c1c(C)[nH]c(C(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1C	ZINC000008780396	132260110	/nfs/dbraw/zinc/26/01/10/132260110.db2.gz	HOPISSFVUMWKNY-UHFFFAOYSA-N	0	0	370.409	2.705	50	5		FFBARN
C[C@H](CNC(=O)OC(C)(C)C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000225388743	132284286	/nfs/dbraw/zinc/28/42/86/132284286.db2.gz	ITRHXZXQXQJAKR-CQSZACIVSA-N	0	0	364.446	2.630	50	5		FFBARN
CCOc1ccccc1N1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000001198882	132381000	/nfs/dbraw/zinc/38/10/00/132381000.db2.gz	LDNNAURSBVSDIW-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	ZINC000004785252	132824638	/nfs/dbraw/zinc/82/46/38/132824638.db2.gz	RTHUCJJXWAAULS-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
Cc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)O[C@H](C)C3)n2)c1	ZINC000009411311	132846424	/nfs/dbraw/zinc/84/64/24/132846424.db2.gz	RXYPIRVTRFPUBB-VXGBXAGGSA-N	0	0	358.402	2.633	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC000047254699	136122763	/nfs/dbraw/zinc/12/27/63/136122763.db2.gz	CXEJXUSHYUGXQS-NSHDSACASA-N	0	0	361.789	2.893	50	5		FFBARN
CC(=O)c1ccc(N2CCC(NC(=O)c3ccncc3)CC2)c([N+](=O)[O-])c1	ZINC000048369123	136123600	/nfs/dbraw/zinc/12/36/00/136123600.db2.gz	IBADAXXPRQJVQO-UHFFFAOYSA-N	0	0	368.393	2.591	50	5		FFBARN
CC(=O)N(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccc(C)cc1	ZINC000000712116	506229893	/nfs/dbraw/zinc/22/98/93/506229893.db2.gz	VPTNNGJINVEUKN-UHFFFAOYSA-N	0	0	353.334	2.510	50	5		FFBARN
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@H]1CCCO1	ZINC000032780746	506295353	/nfs/dbraw/zinc/29/53/53/506295353.db2.gz	XGQPVXVIGBMEFH-LLVKDONJSA-N	0	0	361.320	2.711	50	5		FFBARN
Cc1noc(C)c1[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000033086877	506334158	/nfs/dbraw/zinc/33/41/58/506334158.db2.gz	IRJNAAZVVZCTEP-CQSZACIVSA-N	0	0	351.384	2.725	50	5		FFBARN
CC(=O)N1CCN(c2cc(Br)c([N+](=O)[O-])cc2F)C[C@@H]1C	ZINC000004593444	506384674	/nfs/dbraw/zinc/38/46/74/506384674.db2.gz	XTLJWSKNLHQHSF-QMMMGPOBSA-N	0	0	360.183	2.553	50	5		FFBARN
CSc1ncccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000005895876	506460728	/nfs/dbraw/zinc/46/07/28/506460728.db2.gz	KPOPHJTVIFWTMY-UHFFFAOYSA-N	0	0	358.423	2.674	50	5		FFBARN
O=C1NC(=S)NC(=O)C12Cc1cc([N+](=O)[O-])ccc1N1CCCCC[C@@H]12	ZINC000009009365	506677249	/nfs/dbraw/zinc/67/72/49/506677249.db2.gz	IJBKDEZOSVNXCY-CYBMUJFWSA-N	0	0	374.422	2.669	50	5		FFBARN
CSc1ccc(C(=O)N2CCN(c3ccccn3)CC2)cc1[N+](=O)[O-]	ZINC000009690562	506708945	/nfs/dbraw/zinc/70/89/45/506708945.db2.gz	UZHOIAGRCNYPIR-UHFFFAOYSA-N	0	0	358.423	2.674	50	5		FFBARN
CCN(CC)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C(N)=O)cc1	ZINC000012509658	506870105	/nfs/dbraw/zinc/87/01/05/506870105.db2.gz	XNIDPAONKZUMOJ-UHFFFAOYSA-N	0	0	356.382	2.792	50	5		FFBARN
COC(=O)c1ccc(CN(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000013016445	506925673	/nfs/dbraw/zinc/92/56/73/506925673.db2.gz	NNFBWVNOHVVIJO-UHFFFAOYSA-N	0	0	372.377	2.880	50	5		FFBARN
CS(=O)(=O)c1ccc(NC(=O)CSc2ccc([N+](=O)[O-])cc2)cc1	ZINC000014784647	506999270	/nfs/dbraw/zinc/99/92/70/506999270.db2.gz	UGZOQWLNERNMAX-UHFFFAOYSA-N	0	0	366.420	2.729	50	5		FFBARN
COc1ccc(CNC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000015330790	507033136	/nfs/dbraw/zinc/03/31/36/507033136.db2.gz	QFWGAEPABZVWRU-LBPRGKRZSA-N	0	0	360.366	2.696	50	5		FFBARN
O=[N+]([O-])c1cccc(OS(=O)(=O)c2ccc3c(c2)OCCCO3)c1	ZINC000016091807	507072890	/nfs/dbraw/zinc/07/28/90/507072890.db2.gz	FIAKKVPNDDOHMM-UHFFFAOYSA-N	0	0	351.336	2.524	50	5		FFBARN
O=[N+]([O-])c1cc(-c2nc(-c3ccncc3)no2)ccc1N1CCOCC1	ZINC000020898028	507237319	/nfs/dbraw/zinc/23/73/19/507237319.db2.gz	STIBXQBOKBTTOM-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
Cc1ccc(CN2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1	ZINC000023243605	507341020	/nfs/dbraw/zinc/34/10/20/507341020.db2.gz	ALQKEWFLDNANMJ-HNNXBMFYSA-N	0	0	353.378	2.890	50	5		FFBARN
CC(=O)N1c2ccc(C(=O)COc3ccc(C)nc3[N+](=O)[O-])cc2C[C@@H]1C	ZINC000024827318	507440814	/nfs/dbraw/zinc/44/08/14/507440814.db2.gz	MITOECOVHJEIAT-LBPRGKRZSA-N	0	0	369.377	2.857	50	5		FFBARN
COc1ccc(C2=N/C(=C\c3ccc4c(c3)OCO4)C(=O)O2)cc1[N+](=O)[O-]	ZINC000027519226	507662932	/nfs/dbraw/zinc/66/29/32/507662932.db2.gz	FFODDADRXSJLOL-SDQBBNPISA-N	0	0	368.301	2.677	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1cccc(Cn2cccn2)c1	ZINC000031722551	507821313	/nfs/dbraw/zinc/82/13/13/507821313.db2.gz	XECLZTNNZXAYEH-UHFFFAOYSA-N	0	0	372.406	2.949	50	5		FFBARN
CCCN(CCc1ccccn1)S(=O)(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000084755212	521672704	/nfs/dbraw/zinc/67/27/04/521672704.db2.gz	QFORSPOGQQLZOR-UHFFFAOYSA-N	0	0	363.439	2.774	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000000834247	537066784	/nfs/dbraw/zinc/06/67/84/537066784.db2.gz	MPGXYBFNADPTIS-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
C[C@@H]1CC(=O)N(c2ccc(NCCc3ccccn3)c([N+](=O)[O-])c2)C1=O	ZINC000102603528	570834187	/nfs/dbraw/zinc/83/41/87/570834187.db2.gz	IUGRUUIVGOQHNP-GFCCVEGCSA-N	0	0	354.366	2.544	50	5		FFBARN
C[C@@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000004763660	219605907	/nfs/dbraw/zinc/60/59/07/219605907.db2.gz	RMDSOBUAMXNVDC-CYBMUJFWSA-N	0	0	358.350	2.953	50	5		FFBARN
CCN1c2ccc([N+](=O)[O-])cc2[C@](O)(CC(=O)c2ccc(F)cc2)C1=O	ZINC000005013645	219640619	/nfs/dbraw/zinc/64/06/19/219640619.db2.gz	XCJZWQGDTOQNQW-GOSISDBHSA-N	0	0	358.325	2.561	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2ccc(OC)cc2OC)cc([N+](=O)[O-])c1	ZINC000001097969	203982176	/nfs/dbraw/zinc/98/21/76/203982176.db2.gz	ZJQCUQZKJGVMOB-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
Cc1c(C(=O)Nc2cccc(N(C)S(C)(=O)=O)c2)cccc1[N+](=O)[O-]	ZINC000001127171	203985811	/nfs/dbraw/zinc/98/58/11/203985811.db2.gz	GGQGVHZPIZEBLQ-UHFFFAOYSA-N	0	0	363.395	2.551	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=O)[C@@H](C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000001140634	203986643	/nfs/dbraw/zinc/98/66/43/203986643.db2.gz	AKFNMVRSIPUPFJ-JTQLQIEISA-N	0	0	363.395	2.899	50	5		FFBARN
O=C(NCCc1ccc(Cl)cc1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000010326768	204009080	/nfs/dbraw/zinc/00/90/80/204009080.db2.gz	QCUGAGXDYVFIJY-UHFFFAOYSA-N	0	0	365.748	2.685	50	5		FFBARN
O=c1oc2cc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc2s1	ZINC000002208357	204029367	/nfs/dbraw/zinc/02/93/67/204029367.db2.gz	AVNVIWCUBKKWPQ-UHFFFAOYSA-N	0	0	353.333	2.530	50	5		FFBARN
O=C(NCc1cccnc1)c1cccn2c(=O)c3cc(Cl)ccc3nc12	ZINC000002957340	204069739	/nfs/dbraw/zinc/06/97/39/204069739.db2.gz	QRZFGAQUVATENN-UHFFFAOYSA-N	0	0	364.792	2.826	50	5		FFBARN
Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)N2	ZINC000004115952	204121691	/nfs/dbraw/zinc/12/16/91/204121691.db2.gz	LCYXUFMXQYWZEG-MRXNPFEDSA-N	0	0	354.366	2.973	50	5		FFBARN
Cc1ccc(C(=O)N2CCN(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000003417649	204099435	/nfs/dbraw/zinc/09/94/35/204099435.db2.gz	KDYHVTXPKLMFFV-UHFFFAOYSA-N	0	0	353.378	2.501	50	5		FFBARN
COc1cc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)c([N+](=O)[O-])cc1OC	ZINC000004616595	204150676	/nfs/dbraw/zinc/15/06/76/204150676.db2.gz	AZDNAXXUOUUVTB-UHFFFAOYSA-N	0	0	373.365	2.847	50	5		FFBARN
COc1ccc(-c2noc(CNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000005426695	204207926	/nfs/dbraw/zinc/20/79/26/204207926.db2.gz	NOQHEEXQKLSZBN-UHFFFAOYSA-N	0	0	354.322	2.583	50	5		FFBARN
Cc1cc(NC(=O)CCCn2nc([N+](=O)[O-])c(Br)c2C)no1	ZINC000004881418	204172374	/nfs/dbraw/zinc/17/23/74/204172374.db2.gz	KXVDTHLSYOSGKN-UHFFFAOYSA-N	0	0	372.179	2.578	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(CCCc2ccccc2)CC1	ZINC000005022461	204185190	/nfs/dbraw/zinc/18/51/90/204185190.db2.gz	HOFJQZTUSVUOPF-UHFFFAOYSA-N	0	0	353.422	2.985	50	5		FFBARN
COc1ccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1OC	ZINC000005126772	204192843	/nfs/dbraw/zinc/19/28/43/204192843.db2.gz	GXDHRWRUALKCCD-UHFFFAOYSA-N	0	0	352.368	2.721	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)CC2(CCCCC2)C1=O	ZINC000007046796	204286770	/nfs/dbraw/zinc/28/67/70/204286770.db2.gz	DBSRDOOMJBQBSR-UHFFFAOYSA-N	0	0	359.382	2.551	50	5		FFBARN
O=C(Cc1c(F)cccc1Cl)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000007842741	204308759	/nfs/dbraw/zinc/30/87/59/204308759.db2.gz	CBEVFTVCOHLHSL-HNNXBMFYSA-N	0	0	352.749	2.780	50	5		FFBARN
CCN(C[C@H]1COc2ccccc2O1)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000007889632	204310468	/nfs/dbraw/zinc/31/04/68/204310468.db2.gz	SEMNWEJMQKCKDK-INIZCTEOSA-N	0	0	372.377	2.662	50	5		FFBARN
CSC1=C([N+](=O)[O-])[C@H](c2cccc(Br)c2)NC(=O)N1C	ZINC000008346052	204328520	/nfs/dbraw/zinc/32/85/20/204328520.db2.gz	WZZWKUXOFCNCHX-VIFPVBQESA-N	0	0	358.217	2.954	50	5		FFBARN
Cc1nnc2sc(-c3cccc(NC(=O)c4ccc([N+](=O)[O-])o4)c3)nn12	ZINC000008927251	204349306	/nfs/dbraw/zinc/34/93/06/204349306.db2.gz	SZLYKCUPYAZKDV-UHFFFAOYSA-N	0	0	370.350	2.915	50	5		FFBARN
CCCc1nnc(S[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[nH]1	ZINC000008727374	204341064	/nfs/dbraw/zinc/34/10/64/204341064.db2.gz	KXZPPTCATOFMLG-SECBINFHSA-N	0	0	365.415	2.793	50	5		FFBARN
COc1cc(C(=O)Nc2nc(C)cs2)c([N+](=O)[O-])c(OC)c1OC	ZINC000009908634	204386698	/nfs/dbraw/zinc/38/66/98/204386698.db2.gz	STNPFWNEMCKBNJ-UHFFFAOYSA-N	0	0	353.356	2.638	50	5		FFBARN
Cc1cc(NC(=O)[C@@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])no1	ZINC000010028873	204388979	/nfs/dbraw/zinc/38/89/79/204388979.db2.gz	OORRFXPHDFFONA-MRVPVSSYSA-N	0	0	353.718	2.729	50	5		FFBARN
CCn1ccnc1S[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000011889031	204421148	/nfs/dbraw/zinc/42/11/48/204421148.db2.gz	PPOBIMFSRPEDOB-JTQLQIEISA-N	0	0	350.400	2.939	50	5		FFBARN
CCN(CC(=O)NCc1cccs1)C(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000013015806	204521175	/nfs/dbraw/zinc/52/11/75/204521175.db2.gz	IWBRPGTUAWOCPT-JXMROGBWSA-N	0	0	373.434	2.834	50	5		FFBARN
Cc1[nH]nc(C(F)(F)F)c1NC(=O)CCn1cc(Cl)c([N+](=O)[O-])n1	ZINC000017075347	204649457	/nfs/dbraw/zinc/64/94/57/204649457.db2.gz	SVMCCVJGHNRPCB-UHFFFAOYSA-N	0	0	366.687	2.524	50	5		FFBARN
COc1ccc(OCCOC(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)cc1	ZINC000023291579	204799774	/nfs/dbraw/zinc/79/97/74/204799774.db2.gz	KVOIRJCRXBNMIJ-UHFFFAOYSA-N	0	0	361.306	2.568	50	5		FFBARN
CC[C@H]1CCCN(C(=O)c2cc(OC)c(OC)c(OC)c2[N+](=O)[O-])C1	ZINC000031681225	204919052	/nfs/dbraw/zinc/91/90/52/204919052.db2.gz	PLCRRNWRJCVTSB-NSHDSACASA-N	0	0	352.387	2.883	50	5		FFBARN
CCOCCCNC(=O)/C=C/c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000032906318	204945798	/nfs/dbraw/zinc/94/57/98/204945798.db2.gz	AZMPNTOBRRHADJ-AATRIKPKSA-N	0	0	374.340	2.761	50	5		FFBARN
CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc2c(c1)NC(=O)CO2	ZINC000056288329	205230406	/nfs/dbraw/zinc/23/04/06/205230406.db2.gz	HAERJMPRCMINGD-UHFFFAOYSA-N	0	0	369.377	2.977	50	5		FFBARN
O=[N+]([O-])c1ccc(CCSc2nnc(N3CCOCC3)s2)cc1	ZINC000058191522	205257511	/nfs/dbraw/zinc/25/75/11/205257511.db2.gz	YLUDBRSTZNDVAZ-UHFFFAOYSA-N	0	0	352.441	2.618	50	5		FFBARN
Cc1sc(C(=O)N[C@@H](Cn2cncn2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000058251429	205267717	/nfs/dbraw/zinc/26/77/17/205267717.db2.gz	JRLPOEZMINAASO-ZDUSSCGKSA-N	0	0	357.395	2.728	50	5		FFBARN
CCOc1cc([C@H]2OC(c3ccccc3[N+](=O)[O-])=NN2C(C)=O)ccc1O	ZINC000064819692	205306217	/nfs/dbraw/zinc/30/62/17/205306217.db2.gz	LTSAEAKSVGCHNU-GOSISDBHSA-N	0	0	371.349	2.938	50	5		FFBARN
COc1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)cc1CO	ZINC000048325602	206083301	/nfs/dbraw/zinc/08/33/01/206083301.db2.gz	FGXCEGWYCHRUPY-UHFFFAOYSA-N	0	0	366.395	2.513	50	5		FFBARN
O=C(NC[C@@H]1COC2(CCCCC2)O1)c1cc(F)c([N+](=O)[O-])cc1F	ZINC000123669938	206115666	/nfs/dbraw/zinc/11/56/66/206115666.db2.gz	ZDOSBBAKFWMOKU-SNVBAGLBSA-N	0	0	356.325	2.679	50	5		FFBARN
CNC(=O)c1ccccc1Nc1nc2nc3ccccc3c(=O)n2cc1C	ZINC000002101341	206153239	/nfs/dbraw/zinc/15/32/39/206153239.db2.gz	DTZSFALAHIFJFX-UHFFFAOYSA-N	0	0	359.389	2.654	50	5	biogenic	FFBARN
O=C(OCc1ccccc1)[C@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000002869307	206156765	/nfs/dbraw/zinc/15/67/65/206156765.db2.gz	ASVJIMXEODKJGS-QGZVFWFLSA-N	0	0	354.362	2.943	50	5		FFBARN
O=C(NCC1N=NC(=S)N1c1ccc([N+](=O)[O-])cc1)c1ccccc1F	ZINC000004059208	206166211	/nfs/dbraw/zinc/16/62/11/206166211.db2.gz	IBPDGKKSLKMZBC-UHFFFAOYSA-N	0	0	373.369	2.533	50	5		FFBARN
O=C(COC(=O)c1ccc(Br)o1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004966582	206186634	/nfs/dbraw/zinc/18/66/34/206186634.db2.gz	ABPNIJVMWQGUFX-UHFFFAOYSA-N	0	0	369.127	2.746	50	5		FFBARN
O=[N+]([O-])c1cccc(S(=O)(=O)NCCOc2cccc3cccnc32)c1	ZINC000004828669	206180681	/nfs/dbraw/zinc/18/06/81/206180681.db2.gz	YUBIBSDMDQFTEU-UHFFFAOYSA-N	0	0	373.390	2.500	50	5		FFBARN
O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1	ZINC000007842721	206211429	/nfs/dbraw/zinc/21/14/29/206211429.db2.gz	BBCCTQCCCQFSKE-AWEZNQCLSA-N	0	0	365.183	2.821	50	5		FFBARN
Cc1cccc(NC(=O)CN(C)c2nc3sccn3c2[N+](=O)[O-])c1C	ZINC000008337194	206215694	/nfs/dbraw/zinc/21/56/94/206215694.db2.gz	XDIDAEMBJNDBPS-UHFFFAOYSA-N	0	0	359.411	2.996	50	5		FFBARN
CCCc1cc(=O)[nH]c(SCC(=O)Nc2cc([N+](=O)[O-])ccc2C)n1	ZINC000011443230	206284560	/nfs/dbraw/zinc/28/45/60/206284560.db2.gz	SDNBWHADIXRMCP-UHFFFAOYSA-N	0	0	362.411	2.670	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)C(=O)N(C)C2=O	ZINC000012750451	206294901	/nfs/dbraw/zinc/29/49/01/206294901.db2.gz	OXAKCDXSTHFLAB-NSHDSACASA-N	0	0	367.361	2.654	50	5		FFBARN
Cc1ccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)cc1[N+](=O)[O-]	ZINC000012998585	206298856	/nfs/dbraw/zinc/29/88/56/206298856.db2.gz	NYSGUBCWDDWGBP-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
CCOc1ccc(C(=O)N2CCC[C@H](c3nc(C)no3)C2)cc1[N+](=O)[O-]	ZINC000054663530	206335912	/nfs/dbraw/zinc/33/59/12/206335912.db2.gz	DGJPDDPBQLPGSY-ZDUSSCGKSA-N	0	0	360.370	2.705	50	5		FFBARN
CN(C)C(=O)C[C@@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000058162211	206392287	/nfs/dbraw/zinc/39/22/87/206392287.db2.gz	CSLQPGJYODGLOK-MRXNPFEDSA-N	0	0	356.382	2.936	50	5		FFBARN
Cc1cc(C(=O)N[C@H](CC(=O)OC(C)C)c2ccccc2[N+](=O)[O-])on1	ZINC000024483662	206410266	/nfs/dbraw/zinc/41/02/66/206410266.db2.gz	QEHNFLXPLPOJSO-CYBMUJFWSA-N	0	0	361.354	2.704	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000005446047	132258052	/nfs/dbraw/zinc/25/80/52/132258052.db2.gz	CZKMMQZXACZXFV-UHFFFAOYSA-N	0	0	372.337	2.592	50	5		FFBARN
CC(=O)N1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)CC1	ZINC000000971851	132379377	/nfs/dbraw/zinc/37/93/77/132379377.db2.gz	QACSNUZIQKOCBL-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
COC(=O)c1ccc(N2CCN(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1	ZINC000004054071	132386305	/nfs/dbraw/zinc/38/63/05/132386305.db2.gz	ICBDYYDHPSPFJI-UHFFFAOYSA-N	0	0	359.357	2.847	50	5		FFBARN
C[C@@H](OCc1ccccc1)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000048261323	136123135	/nfs/dbraw/zinc/12/31/35/136123135.db2.gz	WFRZHEHKYQCVJF-MRXNPFEDSA-N	0	0	369.421	2.849	50	5		FFBARN
COc1cc([C@@H]2NC(=O)CC[C@H]2[N+](=O)[O-])ccc1OCc1ccccc1	ZINC000000815842	506233348	/nfs/dbraw/zinc/23/33/48/506233348.db2.gz	ZCSAVJRPGZHZHC-BEFAXECRSA-N	0	0	356.378	2.871	50	5		FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000845685	506235185	/nfs/dbraw/zinc/23/51/85/506235185.db2.gz	JWJKQMQXUBCOON-INIZCTEOSA-N	0	0	352.350	2.861	50	5		FFBARN
COC(=O)[C@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000001043348	506246381	/nfs/dbraw/zinc/24/63/81/506246381.db2.gz	TYXRHAOAENLYNW-KRWDZBQOSA-N	0	0	367.361	2.590	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000001212550	506256803	/nfs/dbraw/zinc/25/68/03/506256803.db2.gz	JMNAMCJDPQGZKJ-FZMZJTMJSA-N	0	0	357.288	2.848	50	5		FFBARN
COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1	ZINC000001230375	506257215	/nfs/dbraw/zinc/25/72/15/506257215.db2.gz	XZRGUHIHGOBYTH-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
O=C(COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1ccc(F)c(F)c1	ZINC000032724190	506284417	/nfs/dbraw/zinc/28/44/17/506284417.db2.gz	IEPCLOIDJJCKOX-UHFFFAOYSA-N	0	0	365.244	2.641	50	5		FFBARN
COc1ccc(S(=O)(=O)N2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1	ZINC000032895762	506307300	/nfs/dbraw/zinc/30/73/00/506307300.db2.gz	RFUDXXKSNXOMHX-AWEZNQCLSA-N	0	0	363.395	2.524	50	5		FFBARN
Cc1noc(C)c1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000033086863	506334464	/nfs/dbraw/zinc/33/44/64/506334464.db2.gz	PJHICNZVRHATSJ-CQSZACIVSA-N	0	0	351.384	2.725	50	5		FFBARN
COc1ccc(C(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1	ZINC000004575472	506383938	/nfs/dbraw/zinc/38/39/38/506383938.db2.gz	PJGNIKBBAUNHNX-UHFFFAOYSA-N	0	0	355.394	2.586	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=S)N1CCN(c2ccccn2)CC1	ZINC000004999213	506412042	/nfs/dbraw/zinc/41/20/42/506412042.db2.gz	GIFJBZSENHYFJU-UHFFFAOYSA-N	0	0	373.438	2.517	50	5		FFBARN
COC(=O)c1ccc(C)c(NC(=O)COc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000012599261	506881529	/nfs/dbraw/zinc/88/15/29/506881529.db2.gz	QPEIIDFGEQTMOG-UHFFFAOYSA-N	0	0	374.349	2.716	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])cc1C	ZINC000013286797	506936325	/nfs/dbraw/zinc/93/63/25/506936325.db2.gz	LTTZAUJAACBVAQ-BETUJISGSA-N	0	0	372.429	2.941	50	5		FFBARN
Cn1ccnc1[C@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000014401348	506991074	/nfs/dbraw/zinc/99/10/74/506991074.db2.gz	WKMMALFAOUUPON-MRXNPFEDSA-N	0	0	369.356	2.569	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)S1	ZINC000020895473	507237072	/nfs/dbraw/zinc/23/70/72/507237072.db2.gz	OLZYYYWBRODOPN-OAHLLOKOSA-N	0	0	374.378	2.856	50	5		FFBARN
CC(C)OC(=O)C[C@@H](NC(=O)C1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000022188920	507282099	/nfs/dbraw/zinc/28/20/99/507282099.db2.gz	HKNAQCKBRUDUQB-OAHLLOKOSA-N	0	0	364.398	2.520	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(Cc1ccccc1)C1CC1	ZINC000024443604	507412681	/nfs/dbraw/zinc/41/26/81/507412681.db2.gz	DUMPDXBJWDXNMZ-UHFFFAOYSA-N	0	0	362.407	2.957	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])NC[C@@H]1CCN(c2ccccc2)C1	ZINC000024817237	507440275	/nfs/dbraw/zinc/44/02/75/507440275.db2.gz	SBYFUUPRYMSLBX-HNNXBMFYSA-N	0	0	355.394	2.616	50	5		FFBARN
CCOC(=O)Cc1nnc(Sc2ccc([N+](=O)[O-])c3cccnc23)n1C	ZINC000025045398	507461706	/nfs/dbraw/zinc/46/17/06/507461706.db2.gz	WOFHALSCIZQLMT-UHFFFAOYSA-N	0	0	373.394	2.528	50	5		FFBARN
Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1-n1cnnn1	ZINC000031996858	507822961	/nfs/dbraw/zinc/82/29/61/507822961.db2.gz	AHWKWKGEQAUOMP-UHFFFAOYSA-N	0	0	358.745	2.785	50	5		FFBARN
CCCCCNS(=O)(=O)c1cc([N+](=O)[O-])ccc1Br	ZINC000078876370	507914182	/nfs/dbraw/zinc/91/41/82/507914182.db2.gz	WGCDBGTXWYVHHN-UHFFFAOYSA-N	0	0	351.222	2.826	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCCC[C@@H]1c1ncc[nH]1	ZINC000079092252	507932431	/nfs/dbraw/zinc/93/24/31/507932431.db2.gz	PRNHJEANDYWOCD-CYBMUJFWSA-N	0	0	350.400	2.542	50	5		FFBARN
CCOC(=O)[C@@]1(Cc2ccccc2[N+](=O)[O-])c2ccccc2N(C)C1=O	ZINC000075283754	508093924	/nfs/dbraw/zinc/09/39/24/508093924.db2.gz	KBMZCFGSMYJNBT-IBGZPJMESA-N	0	0	354.362	2.615	50	5		FFBARN
COc1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c([N+](=O)[O-])c1	ZINC000100951555	508240481	/nfs/dbraw/zinc/24/04/81/508240481.db2.gz	SRPBHLBPXCGCCV-UHFFFAOYSA-N	0	0	362.254	2.672	50	5		FFBARN
COc1cccc(C2=Nc3nnnn3[C@H](c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000101034431	508240710	/nfs/dbraw/zinc/24/07/10/508240710.db2.gz	ZPEKGOTWIKTCFG-INIZCTEOSA-N	0	0	350.338	2.646	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000047175175	570881419	/nfs/dbraw/zinc/88/14/19/570881419.db2.gz	ANZCFXLZUCYXAI-HJCTWCACSA-N	0	0	365.389	2.698	50	5		FFBARN
Cn1c(-c2ccc3c(c2)OCO3)cnc1NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000004678501	571135098	/nfs/dbraw/zinc/13/50/98/571135098.db2.gz	VEVYLDHLKQHBRZ-UHFFFAOYSA-N	0	0	366.333	2.976	50	5		FFBARN
Cc1nn(CN2CCN(C/C=C/c3ccccc3)CC2)c(C)c1[N+](=O)[O-]	ZINC000023701057	962000503	/nfs/dbraw/zinc/00/05/03/962000503.db2.gz	UZXXFWAROSLTPZ-RMKNXTFCSA-N	0	0	355.442	2.697	50	5		FFBARN
Cc1ccc(NC(=O)/C=C\c2ccccc2[N+](=O)[O-])cc1-n1cnnn1	ZINC000098006650	964281595	/nfs/dbraw/zinc/28/15/95/964281595.db2.gz	CLHDKIGLUVLCDU-CLFYSBASSA-N	0	0	350.338	2.531	50	5		FFBARN
COc1cccc(NC(=O)COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1	ZINC000033579578	990438165	/nfs/dbraw/zinc/43/81/65/990438165.db2.gz	VJEBGZSKLHZBTI-YFHOEESVSA-N	0	0	356.334	2.799	50	5		FFBARN
Cc1cccc2nc(COC(=O)/C=C\c3cccc([N+](=O)[O-])c3)cc(=O)n12	ZINC000096809785	1012395002	/nfs/dbraw/zinc/39/50/02/1012395002.db2.gz	MORJMESZWXIMOM-HJWRWDBZSA-N	0	0	365.345	2.668	50	5		FFBARN
Cc1cc(=O)oc2cc(OC(=O)COc3ccccc3[N+](=O)[O-])ccc12	ZINC000001916491	204022565	/nfs/dbraw/zinc/02/25/65/204022565.db2.gz	VIHLELAYKXYCPQ-UHFFFAOYSA-N	0	0	355.302	2.994	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)N3CCc4ccccc43)c(=O)oc21	ZINC000002884598	204066638	/nfs/dbraw/zinc/06/66/38/204066638.db2.gz	VCAAYNOPVDLDSF-UHFFFAOYSA-N	0	0	366.329	2.913	50	5		FFBARN
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)N1CCc2ccccc21	ZINC000003254339	204085828	/nfs/dbraw/zinc/08/58/28/204085828.db2.gz	CCGISYOMABHOQU-UHFFFAOYSA-N	0	0	360.753	2.994	50	5		FFBARN
Cc1c(C(=O)OCC(=O)c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-]	ZINC000003317331	204091456	/nfs/dbraw/zinc/09/14/56/204091456.db2.gz	NZELUMVDMIEGLN-UHFFFAOYSA-N	0	0	357.318	2.714	50	5		FFBARN
CNC(=O)NC(=O)CSc1nc2ccccc2c2nc3ccccc3n21	ZINC000003518036	204104882	/nfs/dbraw/zinc/10/48/82/204104882.db2.gz	XIOHJDHUWIJBAD-UHFFFAOYSA-N	0	0	365.418	2.583	50	5		FFBARN
O=C(Nc1cc2cc([N+](=O)[O-])ccc2oc1=O)c1cccc([N+](=O)[O-])c1	ZINC000004644716	204151744	/nfs/dbraw/zinc/15/17/44/204151744.db2.gz	SVFXFDUXOUPMOA-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccncc1	ZINC000004715620	204157931	/nfs/dbraw/zinc/15/79/31/204157931.db2.gz	FMVOGTQSGAENHH-UHFFFAOYSA-N	0	0	370.394	2.516	50	5		FFBARN
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004732002	204159191	/nfs/dbraw/zinc/15/91/91/204159191.db2.gz	YROVNUQGPJIEJV-SNVBAGLBSA-N	0	0	361.304	2.865	50	5		FFBARN
O=[N+]([O-])c1ccc(NNS(=O)(=O)c2cc(Cl)ccc2Cl)nc1	ZINC000004419298	204138839	/nfs/dbraw/zinc/13/88/39/204138839.db2.gz	XFLBUWGBNRNFRL-UHFFFAOYSA-N	0	0	363.182	2.602	50	5		FFBARN
Cc1cccc(-n2nc([N+](=O)[O-])c(NCc3ccccc3Cl)[n+]2[O-])c1	ZINC000004922676	204176853	/nfs/dbraw/zinc/17/68/53/204176853.db2.gz	QMGULWIEKCSDLF-UHFFFAOYSA-N	0	0	359.773	2.988	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCNS(=O)(=O)Cc2ccccc2)c(Cl)c1	ZINC000004989944	204183859	/nfs/dbraw/zinc/18/38/59/204183859.db2.gz	IFULSZZVFFZUKM-UHFFFAOYSA-N	0	0	369.830	2.780	50	5		FFBARN
CCOc1ccc(N2C[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000005028136	204185882	/nfs/dbraw/zinc/18/58/82/204185882.db2.gz	UKCLBBXGBLYMRR-CYBMUJFWSA-N	0	0	369.377	2.985	50	5		FFBARN
O=[N+]([O-])c1ccc(NC(=S)NNC(=S)NC2CCCCC2)cc1	ZINC000005041751	204186969	/nfs/dbraw/zinc/18/69/69/204186969.db2.gz	BLAHWRZURKUQMJ-UHFFFAOYSA-N	0	0	353.473	2.593	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000005058970	204189180	/nfs/dbraw/zinc/18/91/80/204189180.db2.gz	HEMKOUYWJQUOGZ-LLVKDONJSA-N	0	0	374.349	2.755	50	5		FFBARN
COc1cc(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc(OC)c1	ZINC000007979869	204312339	/nfs/dbraw/zinc/31/23/39/204312339.db2.gz	ZDYVDIRIYFKNJX-UHFFFAOYSA-N	0	0	352.368	2.759	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])OCc1ccc(-n2cccn2)cc1	ZINC000008524851	204333385	/nfs/dbraw/zinc/33/33/85/204333385.db2.gz	UBLVOZOMZMTVHH-UHFFFAOYSA-N	0	0	353.334	2.903	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)OC(=O)c1cccs1	ZINC000007533827	204300298	/nfs/dbraw/zinc/30/02/98/204300298.db2.gz	IBTCJZRIFZGDLN-VIFPVBQESA-N	0	0	350.352	2.849	50	5		FFBARN
Cn1ccnc1[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F	ZINC000009364369	204364774	/nfs/dbraw/zinc/36/47/74/204364774.db2.gz	FQDLXRATLNOAHO-MRXNPFEDSA-N	0	0	354.341	2.987	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)nc(CN1CCOCC1)n2-c1ccc(F)cc1	ZINC000023994894	204813646	/nfs/dbraw/zinc/81/36/46/204813646.db2.gz	SYRBWEWGXMWWJR-UHFFFAOYSA-N	0	0	356.357	2.905	50	5		FFBARN
C[C@H](OC(=O)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCO2	ZINC000035567870	204994872	/nfs/dbraw/zinc/99/48/72/204994872.db2.gz	AJJUHIJGIUUFOI-JTQLQIEISA-N	0	0	358.306	2.508	50	5		FFBARN
Nn1ccc2nc3ccn(-c4cc(Cl)cc(Cl)c4)c(=O)c3cc2c1=O	ZINC000040398697	205069010	/nfs/dbraw/zinc/06/90/10/205069010.db2.gz	RPYHANRPCDJCSR-UHFFFAOYSA-N	0	0	373.199	2.721	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@H]1CCOc2ccccc21	ZINC000043165949	205101657	/nfs/dbraw/zinc/10/16/57/205101657.db2.gz	JCIQATCQKONCBB-AWEZNQCLSA-N	0	0	356.382	2.830	50	5		FFBARN
CC(=O)Nc1cc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2C)ccc1C	ZINC000055615305	205221102	/nfs/dbraw/zinc/22/11/02/205221102.db2.gz	DXJXAEVXDCQASU-UHFFFAOYSA-N	0	0	363.395	2.971	50	5		FFBARN
Cc1nnc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2)n1C	ZINC000058306718	205270111	/nfs/dbraw/zinc/27/01/11/205270111.db2.gz	CJNZJOPFXWNLNV-INIZCTEOSA-N	0	0	351.366	2.551	50	5		FFBARN
O=C(NC[C@@H]1CC(=O)N(Cc2ccccc2)C1)Nc1cccc([N+](=O)[O-])c1	ZINC000095442631	205754699	/nfs/dbraw/zinc/75/46/99/205754699.db2.gz	GVKCFKZWCYJIHX-HNNXBMFYSA-N	0	0	368.393	2.765	50	5		FFBARN
O=C(c1ccccc1[N+](=O)[O-])N1C(=S)N=NC1c1ccccc1[N+](=O)[O-]	ZINC000001785207	206151188	/nfs/dbraw/zinc/15/11/88/206151188.db2.gz	SXVYXDFLYAYYAW-UHFFFAOYSA-N	0	0	371.334	2.739	50	5		FFBARN
O=C(OCc1ccccc1[N+](=O)[O-])c1ccc(N2C(=O)CCC2=O)cc1	ZINC000004351470	206176598	/nfs/dbraw/zinc/17/65/98/206176598.db2.gz	ZYIKIKSOAVQSQP-UHFFFAOYSA-N	0	0	354.318	2.605	50	5		FFBARN
O=C(CCS(=O)(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004496296	206177647	/nfs/dbraw/zinc/17/76/47/206177647.db2.gz	ZXTOSTUAKITJLN-UHFFFAOYSA-N	0	0	352.343	2.536	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1C	ZINC000004497025	206177938	/nfs/dbraw/zinc/17/79/38/206177938.db2.gz	KQNBSGUPOVXELS-OAHLLOKOSA-N	0	0	353.378	2.747	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@H]1CCCc2ccccc21	ZINC000007920510	206211067	/nfs/dbraw/zinc/21/10/67/206211067.db2.gz	NTWRHRUGRLJIEB-KRWDZBQOSA-N	0	0	353.378	2.518	50	5		FFBARN
Cc1cccc(NC(=O)CNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1C	ZINC000012814035	206296550	/nfs/dbraw/zinc/29/65/50/206296550.db2.gz	MLDVVCHMSWBXBU-DHZHZOJOSA-N	0	0	353.378	2.980	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1	ZINC000023057679	206398583	/nfs/dbraw/zinc/39/85/83/206398583.db2.gz	OUVUVGOOYBYVAA-IAGOWNOFSA-N	0	0	374.485	2.674	50	5		FFBARN
Nc1nccc([C@@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)n1	ZINC000253410478	206582126	/nfs/dbraw/zinc/58/21/26/206582126.db2.gz	AQOQUDLSXFPKCS-SNVBAGLBSA-N	0	0	361.789	2.640	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccccc2)c2ncccc12	ZINC000032760698	220677050	/nfs/dbraw/zinc/67/70/50/220677050.db2.gz	YAOCWXVVNXPLHP-UHFFFAOYSA-N	0	0	372.406	2.533	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccc(C(F)(F)F)nn3)CC2)cc1	ZINC000089788219	132200396	/nfs/dbraw/zinc/20/03/96/132200396.db2.gz	MQRFMANMIYOXIF-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3c(F)c(F)nc(F)c3F)CC2)cc1	ZINC000004329478	132386859	/nfs/dbraw/zinc/38/68/59/132386859.db2.gz	HFWAXJGJPKAOGL-UHFFFAOYSA-N	0	0	356.279	2.873	50	5		FFBARN
C[C@@H]1CCN2c3ccc([N+](=O)[O-])cc3CC3(C(=O)OC(C)(C)OC3=O)[C@@H]2C1	ZINC000005425024	132828322	/nfs/dbraw/zinc/82/83/22/132828322.db2.gz	ACHWJVLPCCQNFU-ABAIWWIYSA-N	0	0	374.393	2.578	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)/C=C\c3ccccc3)CC2)cc1	ZINC000033447971	132933055	/nfs/dbraw/zinc/93/30/55/132933055.db2.gz	DCAJIQOBDLQMJU-GDNBJRDFSA-N	0	0	373.434	2.718	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000000833035	506235808	/nfs/dbraw/zinc/23/58/08/506235808.db2.gz	FYQDPZXRMZZOCL-OAHLLOKOSA-N	0	0	357.322	2.656	50	5		FFBARN
CS(=O)(=O)c1ccc(SCC(=O)OC2CCCCC2)c([N+](=O)[O-])c1	ZINC000000957044	506242502	/nfs/dbraw/zinc/24/25/02/506242502.db2.gz	PVIOCDHJGLZBLG-UHFFFAOYSA-N	0	0	373.452	2.966	50	5		FFBARN
Cc1ccc(OCC(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2F)cc1	ZINC000001172624	506252556	/nfs/dbraw/zinc/25/25/56/506252556.db2.gz	QGEOFPRJKSLSJK-UHFFFAOYSA-N	0	0	363.370	2.934	50	5		FFBARN
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(C(=O)N(C)C)CC1	ZINC000032753424	506290260	/nfs/dbraw/zinc/29/02/60/506290260.db2.gz	DUTXEASAYWFFQV-LBPRGKRZSA-N	0	0	373.413	2.506	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)n1	ZINC000004078846	506357523	/nfs/dbraw/zinc/35/75/23/506357523.db2.gz	SDEQDXYLHVWREV-VMPITWQZSA-N	0	0	361.379	2.809	50	5		FFBARN
O=C(c1cc([N+](=O)[O-])ccc1N1CCc2ccccc2C1)N1CCOCC1	ZINC000004140380	506360241	/nfs/dbraw/zinc/36/02/41/506360241.db2.gz	UZSUSNRLJMMDII-UHFFFAOYSA-N	0	0	367.405	2.630	50	5		FFBARN
O=C(Nc1ccc(F)cc1F)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004865896	506400879	/nfs/dbraw/zinc/40/08/79/506400879.db2.gz	CZHQGRKQMMBGNU-UHFFFAOYSA-N	0	0	363.320	2.962	50	5		FFBARN
CSc1ncccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000011464715	506776342	/nfs/dbraw/zinc/77/63/42/506776342.db2.gz	TWUILRZONFJRLG-SNVBAGLBSA-N	0	0	361.379	2.896	50	5		FFBARN
CC(=O)c1cccc(NC(=O)COC(=O)C=Cc2ccc([N+](=O)[O-])cc2)c1	ZINC000012569755	506879424	/nfs/dbraw/zinc/87/94/24/506879424.db2.gz	GKOSVISCGICGMB-JXMROGBWSA-N	0	0	368.345	2.993	50	5		FFBARN
C[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000013115823	506928908	/nfs/dbraw/zinc/92/89/08/506928908.db2.gz	FOAHQAYQBIMCRI-DTORHVGOSA-N	0	0	368.333	2.502	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnc(C(C)C)[nH]1	ZINC000013143752	506930048	/nfs/dbraw/zinc/93/00/48/506930048.db2.gz	NPBPUOZRGIHVOB-UHFFFAOYSA-N	0	0	351.388	2.576	50	5		FFBARN
COc1cc(C(=O)Nc2ncc(C)s2)c([N+](=O)[O-])c(OC)c1OC	ZINC000014016867	506962160	/nfs/dbraw/zinc/96/21/60/506962160.db2.gz	CPBWLZBLFZWASJ-UHFFFAOYSA-N	0	0	353.356	2.638	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCO2)C1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000015117475	507021861	/nfs/dbraw/zinc/02/18/61/507021861.db2.gz	CFUXACHIWAFEDP-UHFFFAOYSA-N	0	0	370.365	2.574	50	5		FFBARN
C[C@H](OC(=O)[C@@H]1COc2ccccc2C1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000016293432	507080882	/nfs/dbraw/zinc/08/08/82/507080882.db2.gz	STDQQYVZASSCNS-JSGCOSHPSA-N	0	0	370.361	2.716	50	5		FFBARN
C[C@H](OC(=O)[C@H]1COc2ccccc2C1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000016293437	507081052	/nfs/dbraw/zinc/08/10/52/507081052.db2.gz	STDQQYVZASSCNS-GXTWGEPZSA-N	0	0	370.361	2.716	50	5		FFBARN
CN(CCOc1ccccc1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000018072945	507136074	/nfs/dbraw/zinc/13/60/74/507136074.db2.gz	DVMUBRQRMQIQER-UHFFFAOYSA-N	0	0	358.350	2.517	50	5		FFBARN
COc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000019555337	507178951	/nfs/dbraw/zinc/17/89/51/507178951.db2.gz	JPQIOJOHCXMWRX-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
Cc1c(Cl)c([N+](=O)[O-])cc([N+](=O)[O-])c1NCCCN1CCOCC1	ZINC000019857346	507204168	/nfs/dbraw/zinc/20/41/68/507204168.db2.gz	XWPCNLVACVSODG-UHFFFAOYSA-N	0	0	358.782	2.599	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@@H](c2ccccc2[N+](=O)[O-])NC3=O)c1	ZINC000020213036	507214687	/nfs/dbraw/zinc/21/46/87/507214687.db2.gz	VNVXJEJTZLNZSL-MRXNPFEDSA-N	0	0	350.334	2.826	50	5		FFBARN
O=C(c1cc(-c2ccco2)n[nH]1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000020531688	507225588	/nfs/dbraw/zinc/22/55/88/507225588.db2.gz	TXNTUQRFPIQDNV-UHFFFAOYSA-N	0	0	367.365	2.540	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CCc1nn2c(nnc2-c2cccs2)s1	ZINC000020606492	507228033	/nfs/dbraw/zinc/22/80/33/507228033.db2.gz	WUVGFBJGKMICID-UHFFFAOYSA-N	0	0	361.412	2.570	50	5		FFBARN
CC(=O)N1N=C(c2ccccc2[N+](=O)[O-])O[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000020946042	507240222	/nfs/dbraw/zinc/24/02/22/507240222.db2.gz	FJZQDWPVUZEAMP-MRXNPFEDSA-N	0	0	356.294	2.742	50	5		FFBARN
COc1cc2c(cc1OC)[C@@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])NCC2	ZINC000022204806	507282260	/nfs/dbraw/zinc/28/22/60/507282260.db2.gz	BPZRORNUZRKVSV-IBGZPJMESA-N	0	0	374.393	2.864	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)Cc1ccc(F)cc1F	ZINC000024441331	507411617	/nfs/dbraw/zinc/41/16/17/507411617.db2.gz	HWEITPSXWQFAEQ-UHFFFAOYSA-N	0	0	372.349	2.702	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C(=O)Nc1ccccc1	ZINC000024985686	507454715	/nfs/dbraw/zinc/45/47/15/507454715.db2.gz	ZWAYUXDQYJEXQQ-KRWDZBQOSA-N	0	0	353.378	2.767	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H]1c1nnc2ccccn21	ZINC000029074952	507756626	/nfs/dbraw/zinc/75/66/26/507756626.db2.gz	DIKDMTLFRUDALH-HNNXBMFYSA-N	0	0	351.366	2.544	50	5		FFBARN
CN(C)C(=O)COc1ccc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1	ZINC000029230494	507770687	/nfs/dbraw/zinc/77/06/87/507770687.db2.gz	SZBIECKSHXHRKS-KPKJPENVSA-N	0	0	369.377	2.714	50	5		FFBARN
O=C(CN1CCO[C@H](c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000029537939	507782378	/nfs/dbraw/zinc/78/23/78/507782378.db2.gz	RKIUHLJQCGPOCZ-KRWDZBQOSA-N	0	0	359.357	2.746	50	5		FFBARN
Cc1cc(Br)ccc1NCCn1cc([N+](=O)[O-])ccc1=O	ZINC000095445290	508185786	/nfs/dbraw/zinc/18/57/86/508185786.db2.gz	IMOAPCYJRDJNON-UHFFFAOYSA-N	0	0	352.188	2.940	50	5		FFBARN
Cn1cc(CCOC(=O)c2csc(-c3ccc([N+](=O)[O-])cc3)n2)cn1	ZINC000095959804	508200165	/nfs/dbraw/zinc/20/01/65/508200165.db2.gz	SBXQVHTVHHCYMZ-UHFFFAOYSA-N	0	0	358.379	2.851	50	5		FFBARN
O=C(CCc1ccccc1)NCCc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000096277207	508212981	/nfs/dbraw/zinc/21/29/81/508212981.db2.gz	JYBVNDCRGJLVCX-UHFFFAOYSA-N	0	0	366.377	2.936	50	5		FFBARN
COC(=O)CCc1nnc(NCc2ccc(Cl)c([N+](=O)[O-])c2)s1	ZINC000170607198	509678211	/nfs/dbraw/zinc/67/82/11/509678211.db2.gz	GYPNRFQSCSTADM-UHFFFAOYSA-N	0	0	356.791	2.817	50	5		FFBARN
Cn1ccnc1C(=O)c1ccc(NC2(CCO)CCCC2)c([N+](=O)[O-])c1	ZINC000253428289	509883155	/nfs/dbraw/zinc/88/31/55/509883155.db2.gz	IZKBKAQOVOHYTL-UHFFFAOYSA-N	0	0	358.398	2.666	50	5		FFBARN
Cc1ccc(C(=O)COC(=O)c2cc(=O)[nH]c3ccccc32)cc1[N+](=O)[O-]	ZINC000008842879	526048228	/nfs/dbraw/zinc/04/82/28/526048228.db2.gz	XPKVJGLLQKSSSY-UHFFFAOYSA-N	0	0	366.329	2.784	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCCN1C(=O)c1cccnc1	ZINC000084422039	571085378	/nfs/dbraw/zinc/08/53/78/571085378.db2.gz	ZPZYFPTVLNXJMC-QGZVFWFLSA-N	0	0	369.377	2.728	50	5		FFBARN
O=C1C[C@H](c2ccccc2[N+](=O)[O-])c2c(=O)[nH]c(N3CCCCC3)nc2N1	ZINC000670416095	571336697	/nfs/dbraw/zinc/33/66/97/571336697.db2.gz	KHSCQLKHNBRXRX-GFCCVEGCSA-N	0	0	369.381	2.555	50	5		FFBARN
O=C(Oc1ccccc1C(=S)N1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000000866320	203959433	/nfs/dbraw/zinc/95/94/33/203959433.db2.gz	IBISNWSJGIZYHI-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
COc1ccc(OC)c(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000000878031	203959899	/nfs/dbraw/zinc/95/98/99/203959899.db2.gz	KWWMKDWXBRSFEJ-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CCOC(=O)Cn1nc(C)c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1C	ZINC000001426755	204005584	/nfs/dbraw/zinc/00/55/84/204005584.db2.gz	OOARRHHHGGLYMT-UHFFFAOYSA-N	0	0	360.370	2.532	50	5		FFBARN
Cn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1cccnc1	ZINC000002911397	204067562	/nfs/dbraw/zinc/06/75/62/204067562.db2.gz	IAVLHPRXNKBUAO-UHFFFAOYSA-N	0	0	370.394	2.516	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C1=N/C(=C/c2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000002930651	204069349	/nfs/dbraw/zinc/06/93/49/204069349.db2.gz	KQMLNSFIZGBRRJ-RIYZIHGNSA-N	0	0	369.289	2.856	50	5		FFBARN
COC(=O)c1ccc(SCC(=O)NC2CCCCC2)c([N+](=O)[O-])c1	ZINC000003032001	204074074	/nfs/dbraw/zinc/07/40/74/204074074.db2.gz	RULRIFKPXKSRTF-UHFFFAOYSA-N	0	0	352.412	2.922	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CCc1nc2c3c(C)c(C)sc3ncn2n1	ZINC000002808455	204059396	/nfs/dbraw/zinc/05/93/96/204059396.db2.gz	HYDQMRGOUXICLA-UHFFFAOYSA-N	0	0	357.399	2.612	50	5		FFBARN
O=C(NC[C@H]1CCCO1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002843662	204062178	/nfs/dbraw/zinc/06/21/78/204062178.db2.gz	FMMQTKGJDMMCJJ-QGZVFWFLSA-N	0	0	369.377	2.756	50	5		FFBARN
COCCNC(=O)c1ccccc1NC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000002855890	204063121	/nfs/dbraw/zinc/06/31/21/204063121.db2.gz	DCGBNHAKSOYYPU-UHFFFAOYSA-N	0	0	357.366	2.532	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCOc2ccccc2Cl)cc1[N+](=O)[O-]	ZINC000004012967	204118658	/nfs/dbraw/zinc/11/86/58/204118658.db2.gz	CPANCVYKQQCIIG-UHFFFAOYSA-N	0	0	370.814	2.914	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc2c(c1)OCO2	ZINC000003385740	204096060	/nfs/dbraw/zinc/09/60/60/204096060.db2.gz	DEHPEAZJRPMAHS-SNVBAGLBSA-N	0	0	359.338	2.771	50	5		FFBARN
Cc1ccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1Cl	ZINC000003608613	204108904	/nfs/dbraw/zinc/10/89/04/204108904.db2.gz	HXAKIHFZKRLCNR-UHFFFAOYSA-N	0	0	373.752	2.791	50	5		FFBARN
CC(=O)Nc1ccc(NC=C2N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	ZINC000004590679	204149819	/nfs/dbraw/zinc/14/98/19/204149819.db2.gz	WKROUHUGBSUMLD-MHWRWJLKSA-N	0	0	366.333	2.810	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CCCc1nc(-c2ccc3c(c2)OCO3)no1	ZINC000004753329	204162228	/nfs/dbraw/zinc/16/22/28/204162228.db2.gz	USTVDOVRTKBVQQ-UHFFFAOYSA-N	0	0	357.326	2.511	50	5		FFBARN
CN1C2=C(C(=O)N(c3cccc([N+](=O)[O-])c3)C2)[C@@H](c2ccccc2)NC1=O	ZINC000004776431	204162970	/nfs/dbraw/zinc/16/29/70/204162970.db2.gz	AHXNEKPTTGPJSV-QGZVFWFLSA-N	0	0	364.361	2.592	50	5		FFBARN
COc1ccc(-n2nc([N+](=O)[O-])c(N[C@H](C)c3ccccc3)[n+]2[O-])cc1	ZINC000004826620	204166846	/nfs/dbraw/zinc/16/68/46/204166846.db2.gz	JJFAVSFXVHZLIA-GFCCVEGCSA-N	0	0	355.354	2.596	50	5		FFBARN
Cc1ccc(NC(=O)CCCN2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1	ZINC000004828580	204167279	/nfs/dbraw/zinc/16/72/79/204167279.db2.gz	ZOHKFPGYJVMAQK-UHFFFAOYSA-N	0	0	367.361	2.918	50	5		FFBARN
O=C(CSc1nncn1-c1ccccc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004835262	204167815	/nfs/dbraw/zinc/16/78/15/204167815.db2.gz	XGWPGWZRVRPNNA-UHFFFAOYSA-N	0	0	355.379	2.906	50	5		FFBARN
O=[N+]([O-])c1cc([N+](=O)[O-])c(NC[C@H]2CCCO2)cc1NC[C@H]1CCCO1	ZINC000004406391	204139063	/nfs/dbraw/zinc/13/90/63/204139063.db2.gz	JMDYGVBOORMJTR-VXGBXAGGSA-N	0	0	366.374	2.685	50	5		FFBARN
Cc1nn(CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c(C)c1[N+](=O)[O-]	ZINC000005360620	204204485	/nfs/dbraw/zinc/20/44/85/204204485.db2.gz	JIJDHKURGRGIAT-UHFFFAOYSA-N	0	0	353.722	2.608	50	5		FFBARN
O=[N+]([O-])c1nn(-c2ccccc2)[n+]([O-])c1NCCc1ccc(Cl)cc1	ZINC000004971311	204180564	/nfs/dbraw/zinc/18/05/64/204180564.db2.gz	ZLRULBVLFBHYER-UHFFFAOYSA-N	0	0	359.773	2.722	50	5		FFBARN
COc1ccc(S(=O)(=O)NCCc2ccc(Cl)cc2)cc1[N+](=O)[O-]	ZINC000005126904	204192536	/nfs/dbraw/zinc/19/25/36/204192536.db2.gz	YCJBHVHUHDRXFL-UHFFFAOYSA-N	0	0	370.814	2.778	50	5		FFBARN
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NNC(=S)NC[C@@H]1CCCO1	ZINC000007155940	204290341	/nfs/dbraw/zinc/29/03/41/204290341.db2.gz	ZJNGKOYHAZIKAJ-VIFPVBQESA-N	0	0	364.349	2.584	50	5		FFBARN
CNc1ncnc2c1C(c1ccc([N+](=O)[O-])cc1)c1c(NC)ncnc1O2	ZINC000006792617	204270728	/nfs/dbraw/zinc/27/07/28/204270728.db2.gz	GKPQFCTYAAVHGE-UHFFFAOYSA-N	0	0	365.353	2.544	50	5		FFBARN
O=C(Cc1c(F)cccc1Cl)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000007842742	204309245	/nfs/dbraw/zinc/30/92/45/204309245.db2.gz	CBEVFTVCOHLHSL-OAHLLOKOSA-N	0	0	352.749	2.780	50	5		FFBARN
O=C(OCc1nnc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CC1(Cl)Cl	ZINC000007985767	204312345	/nfs/dbraw/zinc/31/23/45/204312345.db2.gz	UUZQEJJBOIPIFG-SECBINFHSA-N	0	0	358.137	2.882	50	5		FFBARN
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cc(Cl)c2c(c1)OCCO2	ZINC000008325371	204326807	/nfs/dbraw/zinc/32/68/07/204326807.db2.gz	KFYMTPRQIZAOJA-UHFFFAOYSA-N	0	0	374.736	2.816	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)CC2=O)cc1	ZINC000008473894	204331966	/nfs/dbraw/zinc/33/19/66/204331966.db2.gz	JRTGVQWMQUNIMO-NSHDSACASA-N	0	0	373.340	2.734	50	5		FFBARN
Cc1cc(C(=O)O[C@H](C)C(=O)Nc2ccnn2C(C)C)ccc1[N+](=O)[O-]	ZINC000007529961	204300690	/nfs/dbraw/zinc/30/06/90/204300690.db2.gz	AUELXHKSYINYSZ-GFCCVEGCSA-N	0	0	360.370	2.865	50	5		FFBARN
Cc1nn(CC(=O)N2CCS[C@@H]2c2ccccc2F)c(C)c1[N+](=O)[O-]	ZINC000008848765	204347917	/nfs/dbraw/zinc/34/79/17/204347917.db2.gz	ACNYENOHEAVMSB-MRXNPFEDSA-N	0	0	364.402	2.821	50	5		FFBARN
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cccc(F)c2F)C1=O	ZINC000009048855	204353450	/nfs/dbraw/zinc/35/34/50/204353450.db2.gz	SSQFDXHYPYGAIE-QGZVFWFLSA-N	0	0	361.304	2.840	50	5		FFBARN
CSc1ccc(C(=O)NCCCOC[C@@H]2CCCO2)cc1[N+](=O)[O-]	ZINC000009155405	204355067	/nfs/dbraw/zinc/35/50/67/204355067.db2.gz	QYISAXJKOXWTFJ-ZDUSSCGKSA-N	0	0	354.428	2.632	50	5		FFBARN
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)NC12CC3CC(CC(C3)C1)C2	ZINC000009690082	204378028	/nfs/dbraw/zinc/37/80/28/204378028.db2.gz	VDCCPEBTPNQWNJ-UHFFFAOYSA-N	0	0	371.393	2.588	50	5		FFBARN
Cc1cccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)n1	ZINC000009221251	204358350	/nfs/dbraw/zinc/35/83/50/204358350.db2.gz	XLNDIAWPJZFRLM-UHFFFAOYSA-N	0	0	356.338	2.625	50	5		FFBARN
Cc1nn(CC(=O)Nc2ccccc2OC(F)(F)F)c(C)c1[N+](=O)[O-]	ZINC000009951890	204387701	/nfs/dbraw/zinc/38/77/01/204387701.db2.gz	WVWWAAKEMZWPFW-UHFFFAOYSA-N	0	0	358.276	2.945	50	5		FFBARN
Cc1cc(NC(=O)Cn2cnc3ccsc3c2=O)c([N+](=O)[O-])cc1C	ZINC000012749841	204490046	/nfs/dbraw/zinc/49/00/46/204490046.db2.gz	BJRGJELOZBHUPJ-UHFFFAOYSA-N	0	0	358.379	2.622	50	5		FFBARN
O=C(NCc1nnc2ccc(C(F)(F)F)cn21)c1cccc([N+](=O)[O-])c1	ZINC000012891724	204506109	/nfs/dbraw/zinc/50/61/09/204506109.db2.gz	WKZSMESQNOLDQU-UHFFFAOYSA-N	0	0	365.271	2.586	50	5		FFBARN
CN(C[C@@H]1COc2ccccc2O1)C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000012931904	204511742	/nfs/dbraw/zinc/51/17/42/204511742.db2.gz	FDZBDACBEDEXMY-AUECHBEKSA-N	0	0	354.362	2.906	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000014244529	204577579	/nfs/dbraw/zinc/57/75/79/204577579.db2.gz	VPWPYODOZMHJJG-HNNXBMFYSA-N	0	0	353.378	2.890	50	5		FFBARN
Cc1ccccc1OCCN(C)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000015142672	204605956	/nfs/dbraw/zinc/60/59/56/204605956.db2.gz	COMJSPDIOBMCHE-UHFFFAOYSA-N	0	0	364.423	2.822	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@H]1CCCN(C(=O)N(C)C)C1	ZINC000040092180	204878202	/nfs/dbraw/zinc/87/82/02/204878202.db2.gz	ZPVVOOIHZKMFJJ-HIFRSBDPSA-N	0	0	362.430	2.508	50	5		FFBARN
CN(C)[C@H](c1nnnn1-c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000036062155	205001601	/nfs/dbraw/zinc/00/16/01/205001601.db2.gz	OAISGSZIIBEPRP-HNNXBMFYSA-N	0	0	358.789	2.875	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	ZINC000040073851	205052449	/nfs/dbraw/zinc/05/24/49/205052449.db2.gz	OFTDOLLULFXALW-ZYHUDNBSSA-N	0	0	373.331	2.525	50	5		FFBARN
O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000048331443	205158238	/nfs/dbraw/zinc/15/82/38/205158238.db2.gz	JKLXBYNPXNNMMT-ROUUACIJSA-N	0	0	362.389	2.821	50	5		FFBARN
O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)COCc3ccccc3F)n2)cc1	ZINC000046060850	205131260	/nfs/dbraw/zinc/13/12/60/205131260.db2.gz	UPOBJOCLFMGDAQ-INIZCTEOSA-N	0	0	372.356	2.570	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cn(Cc2ccc(Cl)c3cccnc23)c1=O	ZINC000048374367	205162358	/nfs/dbraw/zinc/16/23/58/205162358.db2.gz	TZFJGVGEWRKCFH-UHFFFAOYSA-N	0	0	373.752	2.793	50	5		FFBARN
COc1ccccc1C1(CNC(=O)c2ccc([N+](=O)[O-])o2)CCOCC1	ZINC000049411594	205171854	/nfs/dbraw/zinc/17/18/54/205171854.db2.gz	CYNJEYNLQHLKOI-UHFFFAOYSA-N	0	0	360.366	2.675	50	5		FFBARN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)Nc1ccccn1	ZINC000052968084	205188251	/nfs/dbraw/zinc/18/82/51/205188251.db2.gz	UEUZKFSEBNJZRL-LBPRGKRZSA-N	0	0	374.422	2.615	50	5		FFBARN
COc1cc2c(cc1OC)C(=O)N[C@H](c1cc([N+](=O)[O-])c(F)cc1F)N2	ZINC000063775087	205294443	/nfs/dbraw/zinc/29/44/43/205294443.db2.gz	KHNHUOFUSRZQCM-OAHLLOKOSA-N	0	0	365.292	2.744	50	5		FFBARN
CCn1c(Sc2c([N+](=O)[O-])ncn2C)nnc1-c1ccccc1OC	ZINC000058458108	205275351	/nfs/dbraw/zinc/27/53/51/205275351.db2.gz	ORAZGYYDWMGMID-UHFFFAOYSA-N	0	0	360.399	2.767	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000064819734	205306367	/nfs/dbraw/zinc/30/63/67/205306367.db2.gz	YWYMIVNXFHHKGP-MRXNPFEDSA-N	0	0	356.294	2.742	50	5		FFBARN
C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1	ZINC000067879357	205399669	/nfs/dbraw/zinc/39/96/69/205399669.db2.gz	UHSCZITXVCPKMP-SUMWQHHRSA-N	0	0	362.407	2.746	50	5		FFBARN
CCn1ccc(=O)c(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)c1	ZINC000135287195	206128601	/nfs/dbraw/zinc/12/86/01/206128601.db2.gz	NUDRNGVPKSHYED-UHFFFAOYSA-N	0	0	373.412	2.975	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000000754076	206132256	/nfs/dbraw/zinc/13/22/56/206132256.db2.gz	DCMPATFEQUAXMJ-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
Cc1cc(OC(=O)c2ccccc2Br)c([N+](=O)[O-])c(=O)[nH]1	ZINC000004248363	206172359	/nfs/dbraw/zinc/17/23/59/206172359.db2.gz	CHADLJZHBICJKC-UHFFFAOYSA-N	0	0	353.128	2.573	50	5		FFBARN
NC(=O)COC(=O)c1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000003460978	206162818	/nfs/dbraw/zinc/16/28/18/206162818.db2.gz	QWYGHCKGAAJMOP-UHFFFAOYSA-N	0	0	350.714	2.683	50	5		FFBARN
Cc1cc2cc(CNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)ccc2n1C	ZINC000004061596	206166355	/nfs/dbraw/zinc/16/63/55/206166355.db2.gz	NHCHBLNLPCWAIT-UHFFFAOYSA-N	0	0	359.407	2.873	50	5		FFBARN
COCc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000005085994	206188800	/nfs/dbraw/zinc/18/88/00/206188800.db2.gz	ISMGPWBBQNWLAK-UHFFFAOYSA-N	0	0	374.349	2.545	50	5		FFBARN
CCNc1ccc(C(=O)OCC(=O)NCCc2ccccc2)cc1[N+](=O)[O-]	ZINC000005692596	206198269	/nfs/dbraw/zinc/19/82/69/206198269.db2.gz	HCCDOMMCNPGMAZ-UHFFFAOYSA-N	0	0	371.393	2.542	50	5		FFBARN
Cc1ccc(NC(=O)CCn2ncc(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000052930302	206222711	/nfs/dbraw/zinc/22/27/11/206222711.db2.gz	AGENBYOITUAJPC-UHFFFAOYSA-N	0	0	352.350	2.642	50	5		FFBARN
CCOC(=O)[C@H]1CCCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000104810595	206233411	/nfs/dbraw/zinc/23/34/11/206233411.db2.gz	XZLSFBUSSPXDLM-OCCSQVGLSA-N	0	0	374.397	2.981	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccccc2[N+](=O)[O-])cc1OC	ZINC000004663733	206237603	/nfs/dbraw/zinc/23/76/03/206237603.db2.gz	QAEPRMCWMSPOGH-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
C[C@H](CCc1ccccc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000012921291	206299070	/nfs/dbraw/zinc/29/90/70/206299070.db2.gz	SJEHYWSJWFOGOQ-CQSZACIVSA-N	0	0	365.393	2.927	50	5		FFBARN
NC(=O)c1ccc(COC(=O)c2csc3c2CCCC3)c([N+](=O)[O-])c1	ZINC000016114336	206318625	/nfs/dbraw/zinc/31/86/25/206318625.db2.gz	BRVHMTQGAYJLBJ-UHFFFAOYSA-N	0	0	360.391	2.991	50	5		FFBARN
COc1cc(CCNC(=O)[C@@H](C)OCCC(C)C)c([N+](=O)[O-])cc1OC	ZINC000057993958	206390955	/nfs/dbraw/zinc/39/09/55/206390955.db2.gz	LMCPHAZWLLOKSM-CYBMUJFWSA-N	0	0	368.430	2.722	50	5		FFBARN
C[C@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1cccc(S(N)(=O)=O)c1	ZINC000058171905	206395035	/nfs/dbraw/zinc/39/50/35/206395035.db2.gz	ZDSSBIDBUGCZCK-NSHDSACASA-N	0	0	372.406	2.964	50	5		FFBARN
COC(=O)c1ccc(NC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000031547454	206509066	/nfs/dbraw/zinc/50/90/66/206509066.db2.gz	QBQZGAOXRUFRIP-UHFFFAOYSA-N	0	0	366.333	2.819	50	5		FFBARN
C[C@@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@H](C)O1	ZINC000239782571	132289274	/nfs/dbraw/zinc/28/92/74/132289274.db2.gz	CPHLIVBUPMAJGM-BETUJISGSA-N	0	0	356.382	2.856	50	5		FFBARN
Nc1ncnc(N2CCN(c3ccc(Cl)c(Cl)c3)CC2)c1[N+](=O)[O-]	ZINC000004059597	132386294	/nfs/dbraw/zinc/38/62/94/132386294.db2.gz	KHEJDCBDUXZIDM-UHFFFAOYSA-N	0	0	369.212	2.600	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3cn4ccccc4n3)CC2)c(F)c1	ZINC000042097044	136121128	/nfs/dbraw/zinc/12/11/28/136121128.db2.gz	DOUUAKWSCIYLRQ-UHFFFAOYSA-N	0	0	355.373	2.704	50	5		FFBARN
O=[N+]([O-])c1ccc(NCc2ccc(N3CCCC[C@H]3CCO)nc2)nc1	ZINC000047253888	136122703	/nfs/dbraw/zinc/12/27/03/136122703.db2.gz	NGXBHQPOLJKHQT-HNNXBMFYSA-N	0	0	357.414	2.738	50	5		FFBARN
COc1cc(OC)cc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000048305765	136123388	/nfs/dbraw/zinc/12/33/88/136123388.db2.gz	OXNQGXJJWLHHIJ-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
CC[C@H]1C(=O)NCCN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000075103542	136150044	/nfs/dbraw/zinc/15/00/44/136150044.db2.gz	RERIEPFXTJNISM-HNNXBMFYSA-N	0	0	353.378	2.541	50	5		FFBARN
Cc1cccc(OCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1C	ZINC000012534640	136151467	/nfs/dbraw/zinc/15/14/67/136151467.db2.gz	RUEWZDMAGMOWDM-UHFFFAOYSA-N	0	0	369.421	2.939	50	5		FFBARN
Cc1ccc(C2=N/C(=C/c3ccc4c(c3)OCO4)C(=O)O2)cc1[N+](=O)[O-]	ZINC000000829660	506235220	/nfs/dbraw/zinc/23/52/20/506235220.db2.gz	AKRIRJPUWPOVEW-AWNIVKPZSA-N	0	0	352.302	2.976	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1	ZINC000000851115	506237420	/nfs/dbraw/zinc/23/74/20/506237420.db2.gz	LPRFQXHABVZVAS-UHFFFAOYSA-N	0	0	367.317	2.912	50	5		FFBARN
Cc1cc(C(=O)Nc2ncn(Cc3ccc(F)cc3)n2)ccc1[N+](=O)[O-]	ZINC000001053743	506245888	/nfs/dbraw/zinc/24/58/88/506245888.db2.gz	DSMXLKUNUJBTMG-UHFFFAOYSA-N	0	0	355.329	2.934	50	5		FFBARN
Cc1ccc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cc1[N+](=O)[O-]	ZINC000001176425	506253668	/nfs/dbraw/zinc/25/36/68/506253668.db2.gz	MTBZEEOTEBZMEL-UHFFFAOYSA-N	0	0	369.377	2.628	50	5		FFBARN
COc1ccc(C(=O)CCC(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002989045	506305757	/nfs/dbraw/zinc/30/57/57/506305757.db2.gz	SHITZLDVCVIBAF-UHFFFAOYSA-N	0	0	371.345	2.992	50	5		FFBARN
O=C(COC(=O)Cc1ccccc1[N+](=O)[O-])NCc1ccc(Cl)cc1	ZINC000003431271	506330680	/nfs/dbraw/zinc/33/06/80/506330680.db2.gz	ZFUVSDMWGDYAKP-UHFFFAOYSA-N	0	0	362.769	2.650	50	5		FFBARN
Cc1c(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cccc1[N+](=O)[O-]	ZINC000004797366	506395526	/nfs/dbraw/zinc/39/55/26/506395526.db2.gz	ZXCFFBURBZPIQT-UHFFFAOYSA-N	0	0	370.365	2.774	50	5		FFBARN
C[C@@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)c1cccc(F)c1	ZINC000037522075	506427741	/nfs/dbraw/zinc/42/77/41/506427741.db2.gz	JHKVPKWMPMPNDQ-GFCCVEGCSA-N	0	0	357.341	2.611	50	5		FFBARN
O=C(CNc1ccccc1N1CCCC1=O)Nc1cccc([N+](=O)[O-])c1	ZINC000012517167	506870177	/nfs/dbraw/zinc/87/01/77/506870177.db2.gz	ONHGSTLTYZTWEB-UHFFFAOYSA-N	0	0	354.366	2.772	50	5		FFBARN
O=C(C1CCN(c2ccc([N+](=O)[O-])cn2)CC1)N1CCc2ccccc2C1	ZINC000012986406	506922083	/nfs/dbraw/zinc/92/20/83/506922083.db2.gz	PWEYYHSQZHXHPI-UHFFFAOYSA-N	0	0	366.421	2.791	50	5		FFBARN
CN(C[C@@H]1COc2ccccc2O1)C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000013021792	506924977	/nfs/dbraw/zinc/92/49/77/506924977.db2.gz	VVJXVUIPVVCCIS-CQSZACIVSA-N	0	0	374.418	2.985	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)[C@H](N1CCOCC1)/C(=C/C1(O)CCCCC1)O2	ZINC000019782220	507201535	/nfs/dbraw/zinc/20/15/35/507201535.db2.gz	NTHQPAPZADRELK-FDWYHIAWSA-N	0	0	360.410	2.940	50	5		FFBARN
c1nnc2c3c4c(sc3n3cnnc3n12)CN(Cc1ccccc1)CC4	ZINC000020057841	507209343	/nfs/dbraw/zinc/20/93/43/507209343.db2.gz	RWQFTXICLZFGHM-UHFFFAOYSA-N	0	0	361.434	2.545	50	5		FFBARN
CC(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)O[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000020945976	507238683	/nfs/dbraw/zinc/23/86/83/507238683.db2.gz	KCWSYUXZDNFKOM-INIZCTEOSA-N	0	0	356.294	2.742	50	5		FFBARN
C[C@@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1cccc(F)c1	ZINC000024658046	507427097	/nfs/dbraw/zinc/42/70/97/507427097.db2.gz	JQCKDPDGWQGDII-GFCCVEGCSA-N	0	0	360.341	2.938	50	5		FFBARN
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2cccs2)oc1=O	ZINC000024654871	507427173	/nfs/dbraw/zinc/42/71/73/507427173.db2.gz	JLFAFLKIMUAIPZ-SNVBAGLBSA-N	0	0	358.379	2.882	50	5		FFBARN
COc1cc2c(cc1OC)CN(Cn1ncc3cc([N+](=O)[O-])ccc31)CC2	ZINC000027490904	507660339	/nfs/dbraw/zinc/66/03/39/507660339.db2.gz	AWAWVMICBJONIH-UHFFFAOYSA-N	0	0	368.393	2.978	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1cccc(Cn2ccnc2)c1	ZINC000030584817	507811024	/nfs/dbraw/zinc/81/10/24/507811024.db2.gz	NUSQCFXOPZQPAX-UHFFFAOYSA-N	0	0	366.377	2.535	50	5		FFBARN
NC(=O)[C@H]1CCCCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000079097519	507933301	/nfs/dbraw/zinc/93/33/01/507933301.db2.gz	DVTUJJVOABWDJI-JQWIXIFHSA-N	0	0	354.794	2.804	50	5		FFBARN
O=C(NC[C@H]1CC(=O)N(Cc2ccccc2)C1)Nc1cccc([N+](=O)[O-])c1	ZINC000095442632	508185260	/nfs/dbraw/zinc/18/52/60/508185260.db2.gz	GVKCFKZWCYJIHX-OAHLLOKOSA-N	0	0	368.393	2.765	50	5		FFBARN
Cc1nc(C)c(CCNC(=O)c2cc([N+](=O)[O-])c(N(C)C)cc2F)s1	ZINC000225749226	509386517	/nfs/dbraw/zinc/38/65/17/509386517.db2.gz	YXJWSYAUCGCJNB-UHFFFAOYSA-N	0	0	366.418	2.846	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N(C)Cc1cnc(C)s1	ZINC000047259174	570884377	/nfs/dbraw/zinc/88/43/77/570884377.db2.gz	IGQDFODUNWDQHQ-JTQLQIEISA-N	0	0	364.427	2.827	50	5		FFBARN
CC(C)CCNC(=O)C1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000048253862	570940596	/nfs/dbraw/zinc/94/05/96/570940596.db2.gz	JPMGSZUCOHXQCG-UHFFFAOYSA-N	0	0	373.457	2.776	50	5		FFBARN
Cc1ccc2nc(COC(=O)/C=C\c3ccccc3[N+](=O)[O-])cc(=O)n2c1	ZINC000097994011	1013241443	/nfs/dbraw/zinc/24/14/43/1013241443.db2.gz	VQUFCXNUXAVUCN-CLFYSBASSA-N	0	0	365.345	2.668	50	5		FFBARN
CN(C)C(=O)COc1ccc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)cc1	ZINC000098006463	1013262780	/nfs/dbraw/zinc/26/27/80/1013262780.db2.gz	DFNSILZZHHNVQR-WDZFZDKYSA-N	0	0	369.377	2.714	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CCC(N2CCCCC2=O)CC1	ZINC000098059421	964702693	/nfs/dbraw/zinc/70/26/93/964702693.db2.gz	ZXCCOYOOYMYAQX-FPLPWBNLSA-N	0	0	357.410	2.612	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])c1nc[nH]c1C(=O)NC1CCCCC1	ZINC000004978912	975472317	/nfs/dbraw/zinc/47/23/17/975472317.db2.gz	VKIUOIWJLKGZOI-UHFFFAOYSA-N	0	0	357.370	2.633	50	5		FFBARN
CC(=O)Oc1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	ZINC000001228336	203995373	/nfs/dbraw/zinc/99/53/73/203995373.db2.gz	YASKABTXXUBIFJ-YBEGLDIGSA-N	0	0	352.302	2.865	50	5		FFBARN
Cn1nc(-c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cc2)ccc1=O	ZINC000010325251	204008745	/nfs/dbraw/zinc/00/87/45/204008745.db2.gz	BLAPNJJHNNORTK-UHFFFAOYSA-N	0	0	350.334	2.608	50	5		FFBARN
COc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1	ZINC000002810078	204059950	/nfs/dbraw/zinc/05/99/50/204059950.db2.gz	BZHROXQBDIMTLE-UHFFFAOYSA-N	0	0	360.278	2.551	50	5		FFBARN
CN(C)C(=O)N[C@@H](Nc1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl	ZINC000003896817	204113889	/nfs/dbraw/zinc/11/38/89/204113889.db2.gz	VMRBNSWQWIQWFL-SECBINFHSA-N	0	0	355.609	2.974	50	5		FFBARN
O=c1[nH]c2ccc(S(=O)(=O)Nc3cccc([N+](=O)[O-])c3)cc2s1	ZINC000003906376	204115936	/nfs/dbraw/zinc/11/59/36/204115936.db2.gz	FWVIVYOSFMDPFP-UHFFFAOYSA-N	0	0	351.365	2.711	50	5		FFBARN
Cc1ccc(S(=O)(=O)Nc2ccc3oc(=O)sc3c2)cc1[N+](=O)[O-]	ZINC000004148309	204124164	/nfs/dbraw/zinc/12/41/64/204124164.db2.gz	BLZMVYHGYMREBH-UHFFFAOYSA-N	0	0	366.376	2.872	50	5	biogenic	FFBARN
CCCCCC(=O)N[C@@H](Cc1ccc(OC)c([N+](=O)[O-])c1)C(=O)OCC	ZINC000004146820	204125075	/nfs/dbraw/zinc/12/50/75/204125075.db2.gz	RGTRBYOIYUWIIJ-AWEZNQCLSA-N	0	0	366.414	2.774	50	5		FFBARN
O=c1sc(N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)nc2ccccc12	ZINC000004597634	204149521	/nfs/dbraw/zinc/14/95/21/204149521.db2.gz	ZIAFZAKWPUGRJZ-UHFFFAOYSA-N	0	0	368.418	2.891	50	5		FFBARN
CCOC(=O)c1c(C)c(C)sc1NC(=O)[C@@H](C)n1cc([N+](=O)[O-])cn1	ZINC000004686790	204155531	/nfs/dbraw/zinc/15/55/31/204155531.db2.gz	FIVJTLNIZKUVEY-SECBINFHSA-N	0	0	366.399	2.846	50	5		FFBARN
COc1cc(/C=C/C(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1O	ZINC000005560433	204216131	/nfs/dbraw/zinc/21/61/31/204216131.db2.gz	USBDAZRHCLHOFY-VQHVLOKHSA-N	0	0	372.333	2.504	50	5		FFBARN
COc1cc(C2=N/C(=C\c3ccc([N+](=O)[O-])o3)C(=O)O2)cc(OC)c1OC	ZINC000004889251	204173240	/nfs/dbraw/zinc/17/32/40/204173240.db2.gz	RKSQTNCTPIFOMF-FLIBITNWSA-N	0	0	374.305	2.558	50	5		FFBARN
COc1ccc(C(=O)COC(=O)c2ccc([N+](=O)[O-])s2)cc1OC	ZINC000005020724	204184980	/nfs/dbraw/zinc/18/49/80/204184980.db2.gz	QJURLFCLQIAXAW-UHFFFAOYSA-N	0	0	351.336	2.713	50	5		FFBARN
Nc1nc(Nc2ccc(Cl)cc2)nc(NC[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000005164983	204195490	/nfs/dbraw/zinc/19/54/90/204195490.db2.gz	VXQOJNOXJUSIJM-NSHDSACASA-N	0	0	364.793	2.955	50	5		FFBARN
Nc1nc(NCCc2ccccc2)nc(NCc2ccco2)c1[N+](=O)[O-]	ZINC000005164200	204196054	/nfs/dbraw/zinc/19/60/54/204196054.db2.gz	FWPHEBIANCTASS-UHFFFAOYSA-N	0	0	354.370	2.827	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)N1CCC(Cc2ccccc2)CC1	ZINC000005900036	204230204	/nfs/dbraw/zinc/23/02/04/204230204.db2.gz	PYLHJXWHLAGOOV-UHFFFAOYSA-N	0	0	372.377	2.826	50	5		FFBARN
Cc1cccc(-c2nc3s/c(=C/c4cccc([N+](=O)[O-])c4)c(=O)n3n2)c1	ZINC000006479018	204249696	/nfs/dbraw/zinc/24/96/96/204249696.db2.gz	HAGUVVPOKBRARU-XNTDXEJSSA-N	0	0	364.386	2.582	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)NCCCc1ccccc1	ZINC000007238843	204292625	/nfs/dbraw/zinc/29/26/25/204292625.db2.gz	VOEVSEUFGRBONX-VAWYXSNFSA-N	0	0	368.389	2.900	50	5		FFBARN
O=C(c1ccccc1S(=O)(=O)c1ccc([N+](=O)[O-])cc1)N1CCCC1	ZINC000006700746	204261469	/nfs/dbraw/zinc/26/14/69/204261469.db2.gz	HHRGTOVQWCPGMW-UHFFFAOYSA-N	0	0	360.391	2.664	50	5		FFBARN
Cc1ccc(NC(=O)/C(=C/c2cnn(C)c2)n2cc([N+](=O)[O-])cn2)c(C)c1	ZINC000006787800	204270659	/nfs/dbraw/zinc/27/06/59/204270659.db2.gz	VHFZPLHWEZVRGU-IDUWFGFVSA-N	0	0	366.381	2.778	50	5		FFBARN
O=C([C@@H](Oc1cc(F)ccc1[N+](=O)[O-])c1ccccc1)N1CCOCC1	ZINC000006842371	204276314	/nfs/dbraw/zinc/27/63/14/204276314.db2.gz	MZIKDFHOJVRYFI-KRWDZBQOSA-N	0	0	360.341	2.713	50	5		FFBARN
O=C(/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2)NCc1ccc(F)cc1	ZINC000008942211	204350857	/nfs/dbraw/zinc/35/08/57/204350857.db2.gz	HGRIPCCIIRBTLG-ZZXKWVIFSA-N	0	0	358.325	2.930	50	5		FFBARN
NC(=O)c1ccc(CSc2nnc3[nH]c4ccccc4n32)c([N+](=O)[O-])c1	ZINC000009115891	204354625	/nfs/dbraw/zinc/35/46/25/204354625.db2.gz	VHAXZIGFDCHCHD-UHFFFAOYSA-N	0	0	368.378	2.510	50	5		FFBARN
COc1ccc([C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2nccn2C)cc1	ZINC000008720046	204341122	/nfs/dbraw/zinc/34/11/22/204341122.db2.gz	JPHBXEHAFAEELC-QGZVFWFLSA-N	0	0	366.377	2.856	50	5		FFBARN
O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)N1CCC[C@@H]1c1cccs1	ZINC000036735381	205021459	/nfs/dbraw/zinc/02/14/59/205021459.db2.gz	QRMSKZNRBIVRRH-GFCCVEGCSA-N	0	0	373.390	2.928	50	5		FFBARN
C[C@H]1C(=O)N(CCOc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	ZINC000047354741	205145247	/nfs/dbraw/zinc/14/52/47/205145247.db2.gz	DSXBVNKYVMQZAB-ZDUSSCGKSA-N	0	0	355.350	2.831	50	5		FFBARN
O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000048331442	205157614	/nfs/dbraw/zinc/15/76/14/205157614.db2.gz	JKLXBYNPXNNMMT-MSOLQXFVSA-N	0	0	362.389	2.821	50	5		FFBARN
Cc1c(NC(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-]	ZINC000058060576	205248893	/nfs/dbraw/zinc/24/88/93/205248893.db2.gz	PPRPZOGJMJJLBW-QGZVFWFLSA-N	0	0	368.393	2.998	50	5		FFBARN
O=C(Cc1csc(-c2cccnc2)n1)NCc1ccccc1[N+](=O)[O-]	ZINC000058406861	205274489	/nfs/dbraw/zinc/27/44/89/205274489.db2.gz	YFTCKEYFBNOVGO-UHFFFAOYSA-N	0	0	354.391	2.972	50	5		FFBARN
O=C(N[C@@H]1C[C@H]1c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000067618753	205377769	/nfs/dbraw/zinc/37/77/69/205377769.db2.gz	RDYFCQLBHFAJIO-RBUKOAKNSA-N	0	0	366.421	2.983	50	5		FFBARN
O=[N+]([O-])c1ccccc1OCCSc1nnnn1Cc1ccccc1	ZINC000048356535	206084493	/nfs/dbraw/zinc/08/44/93/206084493.db2.gz	FQJLOFXVUOVYMW-UHFFFAOYSA-N	0	0	357.395	2.801	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H]1CC(=O)N(c2ccccc2)C1	ZINC000004496954	206178426	/nfs/dbraw/zinc/17/84/26/206178426.db2.gz	QYLZPDKKVYRBBP-QIENPNARSA-N	0	0	351.362	2.530	50	5		FFBARN
O=C(N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1	ZINC000004497486	206177933	/nfs/dbraw/zinc/17/79/33/206177933.db2.gz	AEIBBZCCTLGFGY-ZDUSSCGKSA-N	0	0	359.769	2.784	50	5		FFBARN
CCS(=O)(=O)c1cccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1	ZINC000005241405	206192488	/nfs/dbraw/zinc/19/24/88/206192488.db2.gz	WVALWZAITONUGN-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
Cc1cc(C(=O)OCC(=O)N2CCC(c3ccccc3)=N2)ccc1[N+](=O)[O-]	ZINC000005635926	206198842	/nfs/dbraw/zinc/19/88/42/206198842.db2.gz	KHZXWCHQROJYNB-UHFFFAOYSA-N	0	0	367.361	2.697	50	5		FFBARN
COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000006585619	206202734	/nfs/dbraw/zinc/20/27/34/206202734.db2.gz	FNSGJYWLRRUWEB-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CNc1ccccc1C(=O)NC1CC1	ZINC000010759534	206281091	/nfs/dbraw/zinc/28/10/91/206281091.db2.gz	NOVBWYOYVHHNFT-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
O=C(Cc1cnn(-c2ccccc2)c1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000014848719	206313109	/nfs/dbraw/zinc/31/31/09/206313109.db2.gz	IRPZSUACYYYKAK-UHFFFAOYSA-N	0	0	365.393	2.551	50	5		FFBARN
COc1cccc(C(=O)N2CCCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000057142277	206384374	/nfs/dbraw/zinc/38/43/74/206384374.db2.gz	WGBLPASEHOIAPR-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
COc1ccc(S(=O)(=O)NCCCCc2ccccc2)cc1[N+](=O)[O-]	ZINC000024759863	206412416	/nfs/dbraw/zinc/41/24/16/206412416.db2.gz	JSUJENVZKZLJGX-UHFFFAOYSA-N	0	0	364.423	2.905	50	5		FFBARN
COc1ccccc1Nc1nc(N2CCC[C@H](C)C2)nc(N)c1[N+](=O)[O-]	ZINC000004306400	132386649	/nfs/dbraw/zinc/38/66/49/132386649.db2.gz	BBOZDBRGTFIUCJ-NSHDSACASA-N	0	0	358.402	2.956	50	5		FFBARN
O=C(c1ccc(Cl)cc1F)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000040074528	136119164	/nfs/dbraw/zinc/11/91/64/136119164.db2.gz	ROOPXXPNODBMTB-UHFFFAOYSA-N	0	0	364.764	2.745	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])NCCC(=O)N1CCCc2ccccc21	ZINC000040122561	136119414	/nfs/dbraw/zinc/11/94/14/136119414.db2.gz	KNWHJONKRDYTFV-UHFFFAOYSA-N	0	0	367.405	2.623	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc(Cl)cn2)cc1[N+](=O)[O-]	ZINC000000881981	506239219	/nfs/dbraw/zinc/23/92/19/506239219.db2.gz	PJFVOCHAZFCMQD-UHFFFAOYSA-N	0	0	366.786	2.779	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1F	ZINC000032675831	506275997	/nfs/dbraw/zinc/27/59/97/506275997.db2.gz	UJTYUPBZXLZKGS-LLVKDONJSA-N	0	0	366.370	2.843	50	5		FFBARN
C[C@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])n1cnc2ccccc21	ZINC000032914262	506310928	/nfs/dbraw/zinc/31/09/28/506310928.db2.gz	NEWCKTGXVGNKLO-CYBMUJFWSA-N	0	0	353.382	2.734	50	5		FFBARN
Cc1ccc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1-n1cnnn1	ZINC000033081995	506332905	/nfs/dbraw/zinc/33/29/05/506332905.db2.gz	CLHDKIGLUVLCDU-VQHVLOKHSA-N	0	0	350.338	2.531	50	5		FFBARN
C[C@@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1ccc2c(c1)OCO2	ZINC000003496282	506336355	/nfs/dbraw/zinc/33/63/55/506336355.db2.gz	BBAFSOYGHSZXAV-MRVPVSSYSA-N	0	0	364.335	2.569	50	5		FFBARN
CCOC(=O)/C(Sc1ccccc1[N+](=O)[O-])=C(\C)N1CCOCC1	ZINC000033739796	506364168	/nfs/dbraw/zinc/36/41/68/506364168.db2.gz	MNYCSLVEKNMBBY-QINSGFPZSA-N	0	0	352.412	2.814	50	5		FFBARN
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ccccc1[N+](=O)[O-]	ZINC000004825374	506396672	/nfs/dbraw/zinc/39/66/72/506396672.db2.gz	QHBXJUCELLZAGI-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1OCC(=O)NCCSc1ccccc1	ZINC000008243730	506635130	/nfs/dbraw/zinc/63/51/30/506635130.db2.gz	MOHDMLNKGCJCSU-UHFFFAOYSA-N	0	0	362.407	2.891	50	5		FFBARN
COC(=O)[C@H]1CCc2nc3scc(-c4ccc([N+](=O)[O-])cc4)c3c(=O)n21	ZINC000008382578	506648313	/nfs/dbraw/zinc/64/83/13/506648313.db2.gz	AOJQFQYHAJXBSG-GFCCVEGCSA-N	0	0	371.374	2.694	50	5		FFBARN
COc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC[C@@H](C)C3)n2)cc1	ZINC000009329407	506691655	/nfs/dbraw/zinc/69/16/55/506691655.db2.gz	FKQQMFUHQWFTST-LLVKDONJSA-N	0	0	358.402	2.956	50	5		FFBARN
Cc1cc(Oc2ccc(S(=O)(=O)N3CCCC3)cn2)ccc1[N+](=O)[O-]	ZINC000012563213	506880335	/nfs/dbraw/zinc/88/03/35/506880335.db2.gz	QKSPXVZZRRSWLW-UHFFFAOYSA-N	0	0	363.395	2.875	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CCN(Cc2ccccc2)CC1	ZINC000013943424	506957295	/nfs/dbraw/zinc/95/72/95/506957295.db2.gz	OKVDJTNLUZMAGF-MDZDMXLPSA-N	0	0	351.406	2.952	50	5		FFBARN
O=C(c1ccccc1[N+](=O)[O-])N1CCC(c2nnc3ccccn32)CC1	ZINC000045631972	506993838	/nfs/dbraw/zinc/99/38/38/506993838.db2.gz	DSMBNLZQQPRFCU-UHFFFAOYSA-N	0	0	351.366	2.657	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCCN(C(=S)Nc3ccccc3)CC2)nc1	ZINC000020406014	507220602	/nfs/dbraw/zinc/22/06/02/507220602.db2.gz	DSCQAFLKKZXBCB-UHFFFAOYSA-N	0	0	357.439	2.899	50	5		FFBARN
Cc1noc(/C=C/c2ccc(S(=O)(=O)N3CCCC3)cc2)c1[N+](=O)[O-]	ZINC000021112455	507243672	/nfs/dbraw/zinc/24/36/72/507243672.db2.gz	HPZPZXIXUQKKIC-RMKNXTFCSA-N	0	0	363.395	2.846	50	5		FFBARN
O=C(NCCNc1ncccc1[N+](=O)[O-])c1ccc(C(F)(F)F)cc1	ZINC000023055266	507326560	/nfs/dbraw/zinc/32/65/60/507326560.db2.gz	SKWVKUSMMRKFMK-UHFFFAOYSA-N	0	0	354.288	2.851	50	5		FFBARN
Cn1ccnc1C(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000024596495	507422391	/nfs/dbraw/zinc/42/23/91/507422391.db2.gz	ZCDFCWSKGRPQOL-UHFFFAOYSA-N	0	0	350.334	2.812	50	5		FFBARN
C[C@@H](Cn1cccn1)NC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000024807494	507441073	/nfs/dbraw/zinc/44/10/73/507441073.db2.gz	NVCQUKFZNSJCSW-AWEZNQCLSA-N	0	0	357.414	2.600	50	5		FFBARN
O=C(Nc1cccc(Cn2ccnc2)c1)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000025180181	507472208	/nfs/dbraw/zinc/47/22/08/507472208.db2.gz	DPVSCAOETLBVQR-UHFFFAOYSA-N	0	0	362.349	2.968	50	5		FFBARN
O=C(NCCNc1ccc([N+](=O)[O-])cc1)C1(c2ccccc2)CCOCC1	ZINC000025268501	507480253	/nfs/dbraw/zinc/48/02/53/507480253.db2.gz	ZDSFFACDTILHRN-UHFFFAOYSA-N	0	0	369.421	2.871	50	5		FFBARN
O=C(Nc1ccc(F)cc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000030260288	507804539	/nfs/dbraw/zinc/80/45/39/507804539.db2.gz	RWIGDRXJLKWBQG-UHFFFAOYSA-N	0	0	372.356	2.724	50	5		FFBARN
Cc1[nH]c(CN(C)C(=O)NC[C@H]2CCCO2)nc1-c1cccc([N+](=O)[O-])c1	ZINC000095456167	508186485	/nfs/dbraw/zinc/18/64/85/508186485.db2.gz	UMJBZQYJFSYICD-OAHLLOKOSA-N	0	0	373.413	2.614	50	5		FFBARN
CN(C)C1=N[C@@H]2Nc3ccccc3N(C)[C@H]2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000239174411	524037884	/nfs/dbraw/zinc/03/78/84/524037884.db2.gz	PZFWIEROOQOKSF-SQNIBIBYSA-N	0	0	351.410	2.909	50	5		FFBARN
COc1cccc(-c2cn(CC(=O)c3cccc([N+](=O)[O-])c3)c(=N)n2C)c1	ZINC000334157576	525715295	/nfs/dbraw/zinc/71/52/95/525715295.db2.gz	NSEKGGNNJGFQGH-UHFFFAOYSA-N	0	0	366.377	2.773	50	5		FFBARN
COc1cc(/C=C\C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000035176303	1019334598	/nfs/dbraw/zinc/33/45/98/1019334598.db2.gz	PYFKLGQCRYWMOQ-OQFOIZHKSA-N	0	0	372.333	2.504	50	5		FFBARN
CCn1cc([N+](=O)[O-])c(C(=O)Nc2ccc(Cn3nc(C)cc3C)cc2)n1	ZINC000000655536	203938862	/nfs/dbraw/zinc/93/88/62/203938862.db2.gz	GODVUNFIBOEBJP-UHFFFAOYSA-N	0	0	368.397	2.925	50	5		FFBARN
CCOc1ccc(NC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000001444841	204008519	/nfs/dbraw/zinc/00/85/19/204008519.db2.gz	OBCUDWKLYZOFNW-ZDUSSCGKSA-N	0	0	369.377	2.985	50	5		FFBARN
COc1cccc(NC(=O)[C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000002871468	204065139	/nfs/dbraw/zinc/06/51/39/204065139.db2.gz	MWJNXRLNVYYGTM-LBPRGKRZSA-N	0	0	355.350	2.595	50	5		FFBARN
COc1cccc(CNC(=O)c2ccc3nc4ccccc4c(=O)n3c2)c1	ZINC000002965654	204071333	/nfs/dbraw/zinc/07/13/33/204071333.db2.gz	AZJSJLKDECSGJL-UHFFFAOYSA-N	0	0	359.385	2.786	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N2[C@H](C)CCC[C@H]2C)cc1[N+](=O)[O-]	ZINC000003244927	204084723	/nfs/dbraw/zinc/08/47/23/204084723.db2.gz	WPANGOPXLGEYEI-VXGBXAGGSA-N	0	0	350.371	2.550	50	5		FFBARN
O=C(c1ccccc1[N+](=O)[O-])N1CCC[C@H](C(=O)N2CCCCCC2)C1	ZINC000002786818	204057051	/nfs/dbraw/zinc/05/70/51/204057051.db2.gz	JSVAKABNKQIUQO-HNNXBMFYSA-N	0	0	359.426	2.850	50	5		FFBARN
CCOc1ccc(Nc2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])cc1	ZINC000003879159	204112962	/nfs/dbraw/zinc/11/29/62/204112962.db2.gz	HQSDKMDVGFIYTO-UHFFFAOYSA-N	0	0	351.384	2.645	50	5		FFBARN
Cc1cc(C)n2nc(SCc3cc([N+](=O)[O-])cc4c3OCOC4)nc2n1	ZINC000003351923	204094141	/nfs/dbraw/zinc/09/41/41/204094141.db2.gz	OUECNGWTQJCMLI-UHFFFAOYSA-N	0	0	373.394	2.808	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccc(Cl)cc2)cc1	ZINC000004608548	204150361	/nfs/dbraw/zinc/15/03/61/204150361.db2.gz	UKSKVVMXUUWZLM-UHFFFAOYSA-N	0	0	355.803	2.639	50	5		FFBARN
CC(=O)OCCN(C)c1cc(SC(C)C)c2nonc2c1[N+](=O)[O-]	ZINC000004676223	204154064	/nfs/dbraw/zinc/15/40/64/204154064.db2.gz	XNHZVAYFCZQGAW-UHFFFAOYSA-N	0	0	354.388	2.631	50	5		FFBARN
COc1ccc(CCNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1OC	ZINC000004702873	204156747	/nfs/dbraw/zinc/15/67/47/204156747.db2.gz	VUHIPSFFMMKERF-UHFFFAOYSA-N	0	0	360.366	2.593	50	5		FFBARN
CCN(CC)S(=O)(=O)c1cc2c(=O)nc3ccccn3c2cc1Cl	ZINC000004708637	204157473	/nfs/dbraw/zinc/15/74/73/204157473.db2.gz	ZMZLVAJGUBHKML-UHFFFAOYSA-N	0	0	365.842	2.532	50	5		FFBARN
Cc1ccc(CCNc2c([N+](=O)[O-])nn(-c3cccc(C)c3)[n+]2[O-])cc1	ZINC000004922444	204176681	/nfs/dbraw/zinc/17/66/81/204176681.db2.gz	MKQATLVMDSOEET-UHFFFAOYSA-N	0	0	353.382	2.685	50	5		FFBARN
Cc1ccccc1-n1nc([N+](=O)[O-])c(NCc2ccccc2Cl)[n+]1[O-]	ZINC000004971339	204181193	/nfs/dbraw/zinc/18/11/93/204181193.db2.gz	YQHBDHMVECMEJP-UHFFFAOYSA-N	0	0	359.773	2.988	50	5		FFBARN
Cc1ccc(-c2cc(N)n(S(=O)(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000005034743	204187316	/nfs/dbraw/zinc/18/73/16/204187316.db2.gz	YRLSFTFSCCZBHV-UHFFFAOYSA-N	0	0	358.379	2.586	50	5		FFBARN
Nc1nc(Nc2cccc(Cl)c2)nc(NC[C@@H]2CCCO2)c1[N+](=O)[O-]	ZINC000005195899	204197771	/nfs/dbraw/zinc/19/77/71/204197771.db2.gz	CFGJJTDJZIRDAB-NSHDSACASA-N	0	0	364.793	2.955	50	5		FFBARN
CCS(=O)(=O)c1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000005240988	204198892	/nfs/dbraw/zinc/19/88/92/204198892.db2.gz	GPUCTMSBNQENQU-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
CS(=O)(=O)c1ccc(Oc2ccc3sc(=O)oc3c2)c([N+](=O)[O-])c1	ZINC000005721279	204222276	/nfs/dbraw/zinc/22/22/76/204222276.db2.gz	DXDKJKLWLJIRFP-UHFFFAOYSA-N	0	0	367.360	2.959	50	5		FFBARN
COc1ccc(C(C)=O)cc1Cn1cnc2cc([N+](=O)[O-])ccc2c1=O	ZINC000006084457	204235986	/nfs/dbraw/zinc/23/59/86/204235986.db2.gz	UXGYKFHQARIYBX-UHFFFAOYSA-N	0	0	353.334	2.564	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)Cn1nnc(-c2ccccc2Cl)n1	ZINC000006653205	204258666	/nfs/dbraw/zinc/25/86/66/204258666.db2.gz	IYTXQMYIIOCVLH-UHFFFAOYSA-N	0	0	372.772	2.849	50	5		FFBARN
CC[N@@H+]1CCc2c(sc3c2C(=O)N[C@@H](c2cc([O-])ccc2[N+](=O)[O-])N3)C1	ZINC000006594381	204256141	/nfs/dbraw/zinc/25/61/41/204256141.db2.gz	SVVGNZYPGCJDLE-OAHLLOKOSA-N	0	0	374.422	2.594	50	5		FFBARN
COc1ccc(Oc2ccc(/C=C3\NC(=S)NC3=O)cc2[N+](=O)[O-])cc1	ZINC000008324218	204325758	/nfs/dbraw/zinc/32/57/58/204325758.db2.gz	IPSZERRUGPVSQK-JYRVWZFOSA-N	0	0	371.374	2.741	50	5		FFBARN
C[C@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000008332549	204327689	/nfs/dbraw/zinc/32/76/89/204327689.db2.gz	AOHOMEIYPCFWRV-CYBMUJFWSA-N	0	0	351.366	2.709	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N	ZINC000008398891	204329718	/nfs/dbraw/zinc/32/97/18/204329718.db2.gz	RNCQNHKVVQNGID-UHFFFAOYSA-N	0	0	361.270	2.554	50	5		FFBARN
COc1ccc(-c2nonc2NC(=O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000008916047	204348550	/nfs/dbraw/zinc/34/85/50/204348550.db2.gz	QNNCNTRASMWFKL-UHFFFAOYSA-N	0	0	370.321	2.671	50	5		FFBARN
CCN(Cc1ccccc1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000009113912	204354280	/nfs/dbraw/zinc/35/42/80/204354280.db2.gz	WDUUZJCFVXFQKJ-UHFFFAOYSA-N	0	0	351.366	2.838	50	5		FFBARN
Cc1ccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)nc1	ZINC000009339305	204364620	/nfs/dbraw/zinc/36/46/20/204364620.db2.gz	NMRZORCUOKULIG-UHFFFAOYSA-N	0	0	356.338	2.625	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)Nc2nc3ccccc3s2)cc1[N+](=O)[O-]	ZINC000009479097	204369947	/nfs/dbraw/zinc/36/99/47/204369947.db2.gz	ZYZCFHJZBYHPPG-UHFFFAOYSA-N	0	0	370.390	2.881	50	5		FFBARN
COc1cccc([C@@H](NC(=O)c2cccc([N+](=O)[O-])c2)c2nccn2C)c1	ZINC000008719932	204341413	/nfs/dbraw/zinc/34/14/13/204341413.db2.gz	UMQOUODXEOYPFC-QGZVFWFLSA-N	0	0	366.377	2.856	50	5		FFBARN
CCN(C(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1cccc2ccccc21	ZINC000010452507	204396866	/nfs/dbraw/zinc/39/68/66/204396866.db2.gz	AIZFCZWRFDHOBO-UHFFFAOYSA-N	0	0	351.362	2.963	50	5		FFBARN
Nc1ccc(C(=O)Nc2cccc(OC[C@H]3CCCO3)c2)cc1[N+](=O)[O-]	ZINC000012539945	204472748	/nfs/dbraw/zinc/47/27/48/204472748.db2.gz	HCRGBFXOFMWZBT-OAHLLOKOSA-N	0	0	357.366	2.987	50	5		FFBARN
Cc1ccc(OCC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c([N+](=O)[O-])c1	ZINC000012994864	204516493	/nfs/dbraw/zinc/51/64/93/204516493.db2.gz	AUXIFEHMJVPPIM-UHFFFAOYSA-N	0	0	357.366	2.729	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])NCc1ccc(Cn2cccn2)cc1	ZINC000016302018	204634099	/nfs/dbraw/zinc/63/40/99/204634099.db2.gz	YYNPKZODUBXEMN-UHFFFAOYSA-N	0	0	366.377	2.535	50	5		FFBARN
CC(=O)Oc1ccccc1C1=NN(C(C)=O)[C@@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000021091269	204746461	/nfs/dbraw/zinc/74/64/61/204746461.db2.gz	KZVMFSYAWLPSEC-GOSISDBHSA-N	0	0	369.333	2.759	50	5		FFBARN
O=C(Cn1cnc([N+](=O)[O-])n1)Nc1cccc(OCc2ccc(F)cc2)c1	ZINC000048224340	205152778	/nfs/dbraw/zinc/15/27/78/205152778.db2.gz	CNGSKEMJSAHCTI-UHFFFAOYSA-N	0	0	371.328	2.543	50	5		FFBARN
O=[N+]([O-])c1ccc(NCc2cccc(CN3CCOCC3)c2)c([N+](=O)[O-])c1	ZINC000052429111	205185783	/nfs/dbraw/zinc/18/57/83/205185783.db2.gz	QKXNWBPNDBKIJY-UHFFFAOYSA-N	0	0	372.381	2.947	50	5		FFBARN
COCCc1ccc(OS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])cc1	ZINC000055954127	205225474	/nfs/dbraw/zinc/22/54/74/205225474.db2.gz	RDOSINBHPVYWDB-UHFFFAOYSA-N	0	0	351.380	2.860	50	5		FFBARN
O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1C[C@H](O)c1ccc(F)c(F)c1	ZINC000057770752	205244452	/nfs/dbraw/zinc/24/44/52/205244452.db2.gz	QXYHUWDOKDUKSY-KRWDZBQOSA-N	0	0	373.315	2.830	50	5		FFBARN
CCOC(=O)[C@H]1CCCCN1Cc1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000055543130	205220495	/nfs/dbraw/zinc/22/04/95/205220495.db2.gz	GBYDFWQXQSDEBU-CYBMUJFWSA-N	0	0	352.387	2.530	50	5		FFBARN
NC(=O)c1ccc(Nc2ccc(OC[C@H]3CCCO3)cc2)c([N+](=O)[O-])c1	ZINC000058148266	205251244	/nfs/dbraw/zinc/25/12/44/205251244.db2.gz	VEDYQMXHQJELIG-OAHLLOKOSA-N	0	0	357.366	2.995	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1	ZINC000004496977	206177849	/nfs/dbraw/zinc/17/78/49/206177849.db2.gz	BSBAYAVOQRCQLD-OAHLLOKOSA-N	0	0	353.378	2.747	50	5		FFBARN
COc1ccc(NC(=O)c2ccc(N3C(=O)CCC3=O)cc2)c([N+](=O)[O-])c1	ZINC000004072559	206166959	/nfs/dbraw/zinc/16/69/59/206166959.db2.gz	KEKCAANPEBHIQG-UHFFFAOYSA-N	0	0	369.333	2.509	50	5		FFBARN
O=[N+]([O-])c1ccc(Nc2nc(N3CCCC3)nc(N3CCCC3)n2)cc1	ZINC000004575169	206180039	/nfs/dbraw/zinc/18/00/39/206180039.db2.gz	OMEYOIQYCMDZKN-UHFFFAOYSA-N	0	0	355.402	2.724	50	5		FFBARN
COc1cccc(C(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1OC	ZINC000005536491	206195559	/nfs/dbraw/zinc/19/55/59/206195559.db2.gz	QUCZBVKIBRHIMZ-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
CCOC(=O)c1ccccc1NC(=O)COc1cc([N+](=O)[O-])ccc1OC	ZINC000006290781	206200432	/nfs/dbraw/zinc/20/04/32/206200432.db2.gz	JHPQTYJONPRHFZ-UHFFFAOYSA-N	0	0	374.349	2.798	50	5		FFBARN
O=c1cc(-c2ccccc2)nc2[nH]c(NCc3cccc([N+](=O)[O-])c3)nn21	ZINC000100282701	206221625	/nfs/dbraw/zinc/22/16/25/206221625.db2.gz	UIICZMJBNOGXJN-UHFFFAOYSA-N	0	0	362.349	2.605	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000103608104	206234102	/nfs/dbraw/zinc/23/41/02/206234102.db2.gz	TXQJNUPPOMOQKK-ZFWWWQNUSA-N	0	0	371.736	2.541	50	5		FFBARN
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)c1ccc(Cl)s1	ZINC000003512312	206235026	/nfs/dbraw/zinc/23/50/26/206235026.db2.gz	IDDJWRZYTQKSLF-UHFFFAOYSA-N	0	0	350.739	2.789	50	5		FFBARN
Cc1ccc([C@@H](CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)N2CCOCC2)o1	ZINC000024573450	206411353	/nfs/dbraw/zinc/41/13/53/206411353.db2.gz	OWDLFSXLNDIWEN-QGZVFWFLSA-N	0	0	373.409	2.608	50	5		FFBARN
CCc1ccc(C(=O)Nc2ccc3c(c2)N(C(N)=O)CC3)cc1[N+](=O)[O-]	ZINC000225629792	206489987	/nfs/dbraw/zinc/48/99/87/206489987.db2.gz	JEHKQTPPHKPCNG-UHFFFAOYSA-N	0	0	354.366	2.851	50	5		FFBARN
COc1ccc2cc(C(=O)NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)[nH]c2c1	ZINC000031213255	206506893	/nfs/dbraw/zinc/50/68/93/206506893.db2.gz	NKOBEXQIRNUBAB-QGZVFWFLSA-N	0	0	355.350	2.548	50	5		FFBARN
O=C(CCOc1ccc(F)cc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000024972237	220469110	/nfs/dbraw/zinc/46/91/10/220469110.db2.gz	NIWCBCCBRXSYCF-UHFFFAOYSA-N	0	0	373.384	2.852	50	5		FFBARN
O=[N+]([O-])c1cccc(N2CCN(Cc3nnc(C4CC4)n3C3CC3)CC2)c1	ZINC000096008308	132216913	/nfs/dbraw/zinc/21/69/13/132216913.db2.gz	IRRVKOODMUJYEF-UHFFFAOYSA-N	0	0	368.441	2.721	50	5		FFBARN
COc1ccc(C(=O)c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)cc1	ZINC000003932163	132386082	/nfs/dbraw/zinc/38/60/82/132386082.db2.gz	OZISUZNBRPBLJW-UHFFFAOYSA-N	0	0	355.394	2.586	50	5		FFBARN
CS(=O)(=O)c1ccc(N2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000005638132	132829435	/nfs/dbraw/zinc/82/94/35/132829435.db2.gz	RIBYXAZYIDQOGX-SECBINFHSA-N	0	0	352.334	2.777	50	5		FFBARN
CCCC(=O)NC(=S)N1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000009892036	132847526	/nfs/dbraw/zinc/84/75/26/132847526.db2.gz	UTFBUYXOEIVHBK-UHFFFAOYSA-N	0	0	370.862	2.571	50	5		FFBARN
COc1ccc(CN2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1OC	ZINC000025372755	132913802	/nfs/dbraw/zinc/91/38/02/132913802.db2.gz	ICWWIWJNJZDKIS-UHFFFAOYSA-N	0	0	357.410	2.934	50	5		FFBARN
O=C(Cc1c[nH]c2ccccc12)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000048306191	136123348	/nfs/dbraw/zinc/12/33/48/136123348.db2.gz	RRRBAYCBFFLCPJ-UHFFFAOYSA-N	0	0	364.405	2.967	50	5		FFBARN
Cc1c(NC(=O)CN2CCN(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-]	ZINC000054530491	136125660	/nfs/dbraw/zinc/12/56/60/136125660.db2.gz	NVQNQXSDBIPZEG-UHFFFAOYSA-N	0	0	372.400	2.803	50	5		FFBARN
O=[N+]([O-])c1cc2c(cc1CN1CCN(c3ccc(F)cc3)CC1)OCO2	ZINC000055543218	136126965	/nfs/dbraw/zinc/12/69/65/136126965.db2.gz	MWRNAKIGGNBHDE-UHFFFAOYSA-N	0	0	359.357	2.785	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000000828330	506234891	/nfs/dbraw/zinc/23/48/91/506234891.db2.gz	ARGZMVPWRZEREV-CYBMUJFWSA-N	0	0	358.325	2.830	50	5		FFBARN
O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1ccccc1Cl	ZINC000000943324	506240441	/nfs/dbraw/zinc/24/04/41/506240441.db2.gz	XHTATTGDDFHZID-UHFFFAOYSA-N	0	0	373.752	2.873	50	5		FFBARN
COc1ccc(/C=C2/N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1OC	ZINC000001041608	506245475	/nfs/dbraw/zinc/24/54/75/506245475.db2.gz	ZRFWFMCSJCCNQW-NTEUORMPSA-N	0	0	354.318	2.957	50	5		FFBARN
CCn1nc(C)c([N+](=O)[O-])c1-c1nnnn1-c1ccc(C(F)(F)F)cc1	ZINC000001047669	506246473	/nfs/dbraw/zinc/24/64/73/506246473.db2.gz	JRKDDUUEJNZZRD-UHFFFAOYSA-N	0	0	367.291	2.781	50	5		FFBARN
CC(C)N1c2ccccc2[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000001077839	506247366	/nfs/dbraw/zinc/24/73/66/506247366.db2.gz	KDAMWLREFUTWDR-IBGZPJMESA-N	0	0	354.362	2.810	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=O)[C@H](C)c2ccc([N+](=O)[O-])cc2)n1	ZINC000001140635	506250709	/nfs/dbraw/zinc/25/07/09/506250709.db2.gz	AKFNMVRSIPUPFJ-SNVBAGLBSA-N	0	0	363.395	2.899	50	5		FFBARN
COc1cc2nc(COc3ccccc3[N+](=O)[O-])oc(=O)c2cc1OC	ZINC000001139717	506250722	/nfs/dbraw/zinc/25/07/22/506250722.db2.gz	BJSCEFMPZLTJAD-UHFFFAOYSA-N	0	0	358.306	2.692	50	5		FFBARN
COC(=O)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000001174443	506251398	/nfs/dbraw/zinc/25/13/98/506251398.db2.gz	BWWZADIMPWKVBB-UHFFFAOYSA-N	0	0	359.363	2.508	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCSCc1ccccc1	ZINC000002980726	506305206	/nfs/dbraw/zinc/30/52/06/506305206.db2.gz	WURNCWCZLVLDOK-UHFFFAOYSA-N	0	0	352.437	2.807	50	5		FFBARN
O=C(NCc1cccnc1)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000035870207	506389699	/nfs/dbraw/zinc/38/96/99/506389699.db2.gz	QVBRSFIHSOHDHL-IEBWSBKVSA-N	0	0	366.421	2.837	50	5		FFBARN
Cc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H](C)C2=O)c1	ZINC000037275775	506423227	/nfs/dbraw/zinc/42/32/27/506423227.db2.gz	FFIADHLFTCVJKC-CQSZACIVSA-N	0	0	353.378	2.781	50	5		FFBARN
Cc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@H](C)C1=O	ZINC000037521088	506427758	/nfs/dbraw/zinc/42/77/58/506427758.db2.gz	XJPNZAWXJJTKAX-AWEZNQCLSA-N	0	0	353.378	2.781	50	5		FFBARN
Cc1cc(C)n(C[C@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1	ZINC000040146874	506474184	/nfs/dbraw/zinc/47/41/84/506474184.db2.gz	YSLLEHFVNKTRRC-AWEZNQCLSA-N	0	0	371.441	2.827	50	5		FFBARN
Cc1nnc([C@@H](C)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)o1	ZINC000040152887	506476465	/nfs/dbraw/zinc/47/64/65/506476465.db2.gz	VIAXIKRWBUEDEC-SNVBAGLBSA-N	0	0	351.794	2.823	50	5		FFBARN
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1cccc(Cl)c1	ZINC000007944649	506606151	/nfs/dbraw/zinc/60/61/51/506606151.db2.gz	VDNTUSPIMVYZPB-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
CCOc1ncccc1C(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000010963626	506759915	/nfs/dbraw/zinc/75/99/15/506759915.db2.gz	XGEJSWRPRLYKKF-UHFFFAOYSA-N	0	0	359.338	2.802	50	5		FFBARN
CCOc1ncccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000011480307	506777961	/nfs/dbraw/zinc/77/79/61/506777961.db2.gz	IGOJQYNQWNIGDR-NSHDSACASA-N	0	0	359.338	2.573	50	5		FFBARN
C[C@H](Sc1nnnn1C1CCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000012765635	506898197	/nfs/dbraw/zinc/89/81/97/506898197.db2.gz	VRXMLUVDYJFFBT-JTQLQIEISA-N	0	0	362.415	2.816	50	5		FFBARN
O=C(CCS(=O)(=O)Cc1ccccc1)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000013844487	506957800	/nfs/dbraw/zinc/95/78/00/506957800.db2.gz	IFNSMUINBUTXBM-UHFFFAOYSA-N	0	0	366.370	2.678	50	5		FFBARN
Cn1ccnc1[C@@H](NC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000014401345	506990608	/nfs/dbraw/zinc/99/06/08/506990608.db2.gz	WKMMALFAOUUPON-INIZCTEOSA-N	0	0	369.356	2.569	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000017074882	507115329	/nfs/dbraw/zinc/11/53/29/507115329.db2.gz	UHUJDIGZHQZTNK-AWEZNQCLSA-N	0	0	364.423	2.769	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc([N+](=O)[O-])cc1	ZINC000019300888	507164537	/nfs/dbraw/zinc/16/45/37/507164537.db2.gz	HGYFEULCVACRRI-UHFFFAOYSA-N	0	0	374.393	2.956	50	5		FFBARN
COc1cccc(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000019773814	507200445	/nfs/dbraw/zinc/20/04/45/507200445.db2.gz	PFXKHBXHSOHPTO-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
CC(=O)Oc1ccccc1C1=NN(C(C)=O)[C@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000021091273	507243721	/nfs/dbraw/zinc/24/37/21/507243721.db2.gz	KZVMFSYAWLPSEC-SFHVURJKSA-N	0	0	369.333	2.759	50	5		FFBARN
Cc1cccn2c(=O)cc(COC(=O)c3ccc([N+](=O)[O-])cc3Cl)nc12	ZINC000023221100	507339066	/nfs/dbraw/zinc/33/90/66/507339066.db2.gz	LQVYPPDPHNZTBC-UHFFFAOYSA-N	0	0	373.752	2.922	50	5		FFBARN
CCOC(=O)c1ccc(Nc2cc(OC)c([N+](=O)[O-])nc2[N+](=O)[O-])cc1	ZINC000023283641	507343495	/nfs/dbraw/zinc/34/34/95/507343495.db2.gz	FTBJVVMIWAYQOX-UHFFFAOYSA-N	0	0	362.298	2.827	50	5		FFBARN
O=c1c([N+](=O)[O-])c(N2CCC[C@@H]2Cc2ccccc2)nc2ccccn21	ZINC000024201718	507397975	/nfs/dbraw/zinc/39/79/75/507397975.db2.gz	HLFZMGFSLMLPDS-OAHLLOKOSA-N	0	0	350.378	2.814	50	5		FFBARN
Cc1ccc2c(c1)C(=O)N(CCC(=O)Nc1ccc(C)c([N+](=O)[O-])c1)C2=O	ZINC000025125891	507469815	/nfs/dbraw/zinc/46/98/15/507469815.db2.gz	WFLULEVJWIMQRQ-UHFFFAOYSA-N	0	0	367.361	2.836	50	5		FFBARN
O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1nc(-c2ccc(F)cc2)no1	ZINC000025254073	507480736	/nfs/dbraw/zinc/48/07/36/507480736.db2.gz	STRBAPORYQEGEP-UHFFFAOYSA-N	0	0	368.280	2.580	50	5		FFBARN
CC12CN3CC(C)(CN(C1)C3c1cc3cc4ccccc4cc3[nH]c1=O)C2=O	ZINC000095477660	508189132	/nfs/dbraw/zinc/18/91/32/508189132.db2.gz	YCVUMEQNQNAKRW-UHFFFAOYSA-N	0	0	373.456	2.906	50	5		FFBARN
CN(C)c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C2=O	ZINC000095682036	508197665	/nfs/dbraw/zinc/19/76/65/508197665.db2.gz	DWTBMWKUNWRWSF-UHFFFAOYSA-N	0	0	358.266	2.689	50	5		FFBARN
CCOC(=O)CC[C@@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000095973230	508199899	/nfs/dbraw/zinc/19/98/99/508199899.db2.gz	BHZCRWPGRJCGJZ-LBPRGKRZSA-N	0	0	374.397	2.667	50	5		FFBARN
O=C(CCc1ccccc1)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000096278047	508213042	/nfs/dbraw/zinc/21/30/42/508213042.db2.gz	RQRLHQVHKHZXPH-UHFFFAOYSA-N	0	0	352.350	2.894	50	5		FFBARN
CCn1c(=N)c(-c2nc3ccccc3n2C)cc2c1nc1ccccn1c2=O	ZINC000101157157	508240848	/nfs/dbraw/zinc/24/08/48/508240848.db2.gz	AVWHKQFLFJDYDD-UHFFFAOYSA-N	0	0	370.416	2.702	50	5		FFBARN
COc1cc(CNC(=O)c2c[nH]nc2[N+](=O)[O-])ccc1OCCC(C)C	ZINC000170617913	509681705	/nfs/dbraw/zinc/68/17/05/509681705.db2.gz	IZCWBGRQAFVMAQ-UHFFFAOYSA-N	0	0	362.386	2.681	50	5		FFBARN
CC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1	ZINC000004902794	534892448	/nfs/dbraw/zinc/89/24/48/534892448.db2.gz	KPYVUHTZWUXPAM-UHFFFAOYSA-N	0	0	369.377	2.886	50	5		FFBARN
Cc1c(CS(=O)(=O)CC(=O)N[C@@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000048718149	570959128	/nfs/dbraw/zinc/95/91/28/570959128.db2.gz	JYPFLKWDNVGMHW-SWLSCSKDSA-N	0	0	368.455	2.513	50	5		FFBARN
O=C(/C=C\c1ccc2c(c1)OCO2)OCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000033700215	990585416	/nfs/dbraw/zinc/58/54/16/990585416.db2.gz	VYSSLRYUVJGNJG-VURMDHGXSA-N	0	0	370.317	2.519	50	5		FFBARN
CCn1cc(CN(C)C(=O)c2cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c2)c(C)n1	ZINC000002764717	204056296	/nfs/dbraw/zinc/05/62/96/204056296.db2.gz	GFWRBHVRQHHEKV-UHFFFAOYSA-N	0	0	361.358	2.608	50	5		FFBARN
Cc1c(C(=O)Nc2ccccc2C(=O)N2CCOCC2)cccc1[N+](=O)[O-]	ZINC000002853679	204062557	/nfs/dbraw/zinc/06/25/57/204062557.db2.gz	BTODHLSWDIMJLE-UHFFFAOYSA-N	0	0	369.377	2.628	50	5		FFBARN
CN(C)C(=O)N[C@H](Nc1ccc([N+](=O)[O-])cc1)C(Cl)(Cl)Cl	ZINC000003896816	204113900	/nfs/dbraw/zinc/11/39/00/204113900.db2.gz	VMRBNSWQWIQWFL-VIFPVBQESA-N	0	0	355.609	2.974	50	5		FFBARN
COc1cc(OC)cc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)c1	ZINC000004090911	204120438	/nfs/dbraw/zinc/12/04/38/204120438.db2.gz	YMSDCEDSXAWWLD-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
Cc1nn(CCCc2nc(-c3ccc4c(c3)OCO4)no2)c(C)c1[N+](=O)[O-]	ZINC000004745631	204159899	/nfs/dbraw/zinc/15/98/99/204159899.db2.gz	CVBPLDIEHWWRQK-UHFFFAOYSA-N	0	0	371.353	2.820	50	5		FFBARN
COC(=O)c1ccc(C)c(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1	ZINC000004817987	204166533	/nfs/dbraw/zinc/16/65/33/204166533.db2.gz	PHOUKODAUMRZRQ-UHFFFAOYSA-N	0	0	364.379	2.799	50	5		FFBARN
CCOC(=O)c1c(NC(=O)c2ccno2)c2cc([N+](=O)[O-])ccc2n1C	ZINC000004307620	204131103	/nfs/dbraw/zinc/13/11/03/204131103.db2.gz	JATWBDGVMHEUSX-UHFFFAOYSA-N	0	0	358.310	2.504	50	5		FFBARN
COc1ccc(C2=N/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)O2)cc1OC	ZINC000004507933	204142634	/nfs/dbraw/zinc/14/26/34/204142634.db2.gz	MCWGRBXBLOMXQR-ZROIWOOFSA-N	0	0	354.318	2.957	50	5		FFBARN
COCCCNc1nc(N)c([N+](=O)[O-])c(Nc2cccc(Cl)c2)n1	ZINC000005032260	204186092	/nfs/dbraw/zinc/18/60/92/204186092.db2.gz	ZTGDKCZAFZGWSB-UHFFFAOYSA-N	0	0	352.782	2.812	50	5		FFBARN
CCOc1ccc(NC(=O)COC(=O)/C=C/c2ccco2)c([N+](=O)[O-])c1	ZINC000005753979	204224935	/nfs/dbraw/zinc/22/49/35/204224935.db2.gz	QJCWNMFDBYSREG-SOFGYWHQSA-N	0	0	360.322	2.782	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1n[nH]c2ccccc21	ZINC000005903588	204229338	/nfs/dbraw/zinc/22/93/38/204229338.db2.gz	SBOKBTXMTZEPOW-UHFFFAOYSA-N	0	0	355.306	2.695	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(=O)NC1CC1	ZINC000007168662	204290324	/nfs/dbraw/zinc/29/03/24/204290324.db2.gz	YNFJWFCJQXNKEG-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
CNS(=O)(=O)c1ccc(N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1	ZINC000007981799	204312527	/nfs/dbraw/zinc/31/25/27/204312527.db2.gz	CSNDDISZFILDPE-CYBMUJFWSA-N	0	0	367.452	2.906	50	5		FFBARN
C[C@H]1Oc2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2NC1=O	ZINC000008014266	204315728	/nfs/dbraw/zinc/31/57/28/204315728.db2.gz	ZGDNMUOFPATBPP-OALRPVAKSA-N	0	0	353.334	2.966	50	5		FFBARN
O=C1NC(=S)NC1=Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000008324221	204326281	/nfs/dbraw/zinc/32/62/81/204326281.db2.gz	FWVYBQDYOSOHBL-GHXNOFRVSA-N	0	0	359.338	2.871	50	5		FFBARN
CN(CCOc1ccc(Cl)cc1)C(=O)COc1cccnc1[N+](=O)[O-]	ZINC000007550241	204300235	/nfs/dbraw/zinc/30/02/35/204300235.db2.gz	IMIOQDIXHNBTPJ-UHFFFAOYSA-N	0	0	365.773	2.559	50	5		FFBARN
COc1ccc(-c2nonc2NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000008916417	204349418	/nfs/dbraw/zinc/34/94/18/204349418.db2.gz	PNONYFUWTZJWJU-UHFFFAOYSA-N	0	0	370.321	2.914	50	5		FFBARN
COc1ccc(Cl)cc1C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000009690140	204378473	/nfs/dbraw/zinc/37/84/73/204378473.db2.gz	QVGHMVYFTQMEMZ-AWEZNQCLSA-N	0	0	350.758	2.720	50	5		FFBARN
COc1ccc(NC(=O)[C@H]2CC(=O)N(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1	ZINC000010494626	204397419	/nfs/dbraw/zinc/39/74/19/204397419.db2.gz	NNNGMAPTHJGQRD-NSHDSACASA-N	0	0	373.340	2.734	50	5		FFBARN
CCOC(=O)c1c(C)[nH]c(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1C	ZINC000012893770	204505864	/nfs/dbraw/zinc/50/58/64/204505864.db2.gz	JTEJDUIGUYUOQM-UHFFFAOYSA-N	0	0	361.354	2.977	50	5		FFBARN
O=C(CCc1nc2ccccc2[nH]c1=O)OCc1cccc([N+](=O)[O-])c1	ZINC000016320109	204634679	/nfs/dbraw/zinc/63/46/79/204634679.db2.gz	OEKNYOLCMFYMKX-UHFFFAOYSA-N	0	0	353.334	2.507	50	5		FFBARN
O=[N+]([O-])c1nn(Cc2nc(-c3ccsc3)no2)cc1Br	ZINC000048628683	205165098	/nfs/dbraw/zinc/16/50/98/205165098.db2.gz	SONUJYQLVDARHC-UHFFFAOYSA-N	0	0	356.161	2.714	50	5		FFBARN
CCN(Cc1ccccc1)C(=O)CNC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000053464430	205193083	/nfs/dbraw/zinc/19/30/83/205193083.db2.gz	IEHSFLSAJJWWSW-UHFFFAOYSA-N	0	0	355.394	2.682	50	5		FFBARN
NC(=O)c1ccc(Nc2ccc(OC[C@@H]3CCCO3)cc2)c([N+](=O)[O-])c1	ZINC000058148257	205250362	/nfs/dbraw/zinc/25/03/62/205250362.db2.gz	VEDYQMXHQJELIG-HNNXBMFYSA-N	0	0	357.366	2.995	50	5		FFBARN
O=C(N[C@H]1C[C@@H]1c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000067618750	205379001	/nfs/dbraw/zinc/37/90/01/205379001.db2.gz	RDYFCQLBHFAJIO-MOPGFXCFSA-N	0	0	366.421	2.983	50	5		FFBARN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@H](c1ccsc1)N(C)C	ZINC000045809530	206079501	/nfs/dbraw/zinc/07/95/01/206079501.db2.gz	IIVSGGGNFGENKZ-CQSZACIVSA-N	0	0	369.468	2.546	50	5		FFBARN
O=C(COC(=O)c1ccc(O)cc1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000003272232	206158987	/nfs/dbraw/zinc/15/89/87/206158987.db2.gz	YHFXSELUEKPMRQ-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
Cc1cc(OC(=O)c2ccc(Br)cc2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000004248365	206172811	/nfs/dbraw/zinc/17/28/11/206172811.db2.gz	UYEZBTTYQGXRFS-UHFFFAOYSA-N	0	0	353.128	2.573	50	5		FFBARN
NC(=O)c1c(NC(=O)c2ccc([N+](=O)[O-])s2)sc2c1CCCC2	ZINC000004070298	206166705	/nfs/dbraw/zinc/16/67/05/206166705.db2.gz	DYXDQEDGCDTXNW-UHFFFAOYSA-N	0	0	351.409	2.948	50	5		FFBARN
C[C@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000006506282	206202811	/nfs/dbraw/zinc/20/28/11/206202811.db2.gz	FMJLYJXTKVPOKV-JTQLQIEISA-N	0	0	354.322	2.655	50	5		FFBARN
O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000003505010	206235019	/nfs/dbraw/zinc/23/50/19/206235019.db2.gz	NPXCVIODFSNHMU-UHFFFAOYSA-N	0	0	374.736	2.701	50	5		FFBARN
Cn1c(CNC(=O)c2ccco2)nnc1SCc1ccc([N+](=O)[O-])cc1	ZINC000009582354	206248148	/nfs/dbraw/zinc/24/81/48/206248148.db2.gz	IJBWMJPYYDOTGL-UHFFFAOYSA-N	0	0	373.394	2.539	50	5		FFBARN
Cc1cc(C(=O)N[C@@H](C)c2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000015197173	206314011	/nfs/dbraw/zinc/31/40/11/206314011.db2.gz	GQAHTEMBVLNUTG-LBPRGKRZSA-N	0	0	362.407	2.798	50	5		FFBARN
O=C(CCOc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccccc2)C1	ZINC000058166378	206395172	/nfs/dbraw/zinc/39/51/72/206395172.db2.gz	HNCPGRDITIUZBF-SFHVURJKSA-N	0	0	356.378	2.964	50	5		FFBARN
O=C1c2ccc([N+](=O)[O-])c3c([N+](=O)[O-])ccc(c23)C(=O)N1c1ccccn1	ZINC000095470745	132211515	/nfs/dbraw/zinc/21/15/15/132211515.db2.gz	VRXPVHJJWUZPSA-UHFFFAOYSA-N	0	0	364.273	2.852	50	5		FFBARN
CC(=O)N1CCN(c2cc(N3CCC(C)CC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000003904566	132385930	/nfs/dbraw/zinc/38/59/30/132385930.db2.gz	ONEUSTMWWNNONL-UHFFFAOYSA-N	0	0	364.421	2.639	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000000828329	506235738	/nfs/dbraw/zinc/23/57/38/506235738.db2.gz	ARGZMVPWRZEREV-ZDUSSCGKSA-N	0	0	358.325	2.830	50	5		FFBARN
COc1cc(CN2CCN(Cc3ccco3)CC2)c([N+](=O)[O-])cc1OC	ZINC000000865145	506237297	/nfs/dbraw/zinc/23/72/97/506237297.db2.gz	ZLJVLZFHCHLOKD-UHFFFAOYSA-N	0	0	361.398	2.523	50	5		FFBARN
COC(=O)c1ccccc1NC(=S)NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000001171099	506251915	/nfs/dbraw/zinc/25/19/15/506251915.db2.gz	LZRRTXQIBGWJGP-UHFFFAOYSA-N	0	0	359.363	2.508	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000001212554	506256104	/nfs/dbraw/zinc/25/61/04/506256104.db2.gz	JMNAMCJDPQGZKJ-SMDDNHRTSA-N	0	0	357.288	2.848	50	5		FFBARN
COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1ccc(C)c([N+](=O)[O-])c1	ZINC000001214796	506256402	/nfs/dbraw/zinc/25/64/02/506256402.db2.gz	WKBPEDQFGAOFIG-UHFFFAOYSA-N	0	0	374.393	2.826	50	5		FFBARN
O=[N+]([O-])c1ccc([C@@H](O)CN2CCN(C/C=C/c3ccccc3)CC2)cc1	ZINC000001307397	506258503	/nfs/dbraw/zinc/25/85/03/506258503.db2.gz	OPZYKJXPYQSPLO-XBGMYJNYSA-N	0	0	367.449	2.959	50	5		FFBARN
Cc1ccc(NC(=O)[C@H](C)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1F	ZINC000032675829	506277102	/nfs/dbraw/zinc/27/71/02/506277102.db2.gz	UJTYUPBZXLZKGS-NSHDSACASA-N	0	0	366.370	2.843	50	5		FFBARN
COc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2C)CC1	ZINC000004740953	506392127	/nfs/dbraw/zinc/39/21/27/506392127.db2.gz	MJYJNEUQTPMTJT-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
CC(C)(C)NC(=O)COC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000004839946	506398134	/nfs/dbraw/zinc/39/81/34/506398134.db2.gz	ZTDCATMTVFXHLM-UHFFFAOYSA-N	0	0	363.414	2.657	50	5		FFBARN
O=C(NCCCn1ccnc1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000004864416	506400315	/nfs/dbraw/zinc/40/03/15/506400315.db2.gz	LMDMQMDFNDHXEV-UHFFFAOYSA-N	0	0	357.414	2.602	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCCCC2)c(S(=O)(=O)N2CCCCC2)c1	ZINC000005041405	506417006	/nfs/dbraw/zinc/41/70/06/506417006.db2.gz	AIDXHLYYJXTFBK-UHFFFAOYSA-N	0	0	353.444	2.760	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(c2nc(N3C[C@H](C)C[C@H](C)C3)nc(N)c2[N+](=O)[O-])C1	ZINC000005155903	506425173	/nfs/dbraw/zinc/42/51/73/506425173.db2.gz	COZXRWRXROFHAP-SYQHCUMBSA-N	0	0	362.478	2.932	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(C(=S)NCCc3ccccc3)CC2)cc1	ZINC000005572063	506450362	/nfs/dbraw/zinc/45/03/62/506450362.db2.gz	NUTCUYQCHXRSRF-UHFFFAOYSA-N	0	0	370.478	2.834	50	5		FFBARN
Cc1cc(C)n(-c2ccc(NC(=O)c3cc([N+](=O)[O-])cnc3C)cn2)n1	ZINC000040088988	506464632	/nfs/dbraw/zinc/46/46/32/506464632.db2.gz	PWWJNTBFNXKBRG-UHFFFAOYSA-N	0	0	352.354	2.748	50	5		FFBARN
O=[N+]([O-])c1cccc(NC(=S)N2CCN(c3ccccc3O)CC2)c1	ZINC000006402738	506481277	/nfs/dbraw/zinc/48/12/77/506481277.db2.gz	KOUHCKAAEBIMHW-UHFFFAOYSA-N	0	0	358.423	2.819	50	5		FFBARN
CN(Cc1cccc(F)c1)C(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000009368752	506695680	/nfs/dbraw/zinc/69/56/80/506695680.db2.gz	UYLVZJHOHSLXCF-UHFFFAOYSA-N	0	0	373.384	2.843	50	5		FFBARN
CN(C)c1ccc(C(=O)NCCCn2cnc3ccccc32)cc1[N+](=O)[O-]	ZINC000012489825	506870458	/nfs/dbraw/zinc/87/04/58/506870458.db2.gz	GJPHYQPKTCQRKM-UHFFFAOYSA-N	0	0	367.409	2.831	50	5		FFBARN
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(C)Cc2nccn2C(F)F)c1C	ZINC000012535616	506875005	/nfs/dbraw/zinc/87/50/05/506875005.db2.gz	UZDRLFRYYKSENF-UHFFFAOYSA-N	0	0	374.369	2.624	50	5		FFBARN
Cc1c(NC(=O)CCn2cnc3sccc3c2=O)cccc1[N+](=O)[O-]	ZINC000012738711	506894078	/nfs/dbraw/zinc/89/40/78/506894078.db2.gz	CWXRIDQXUCFGOZ-UHFFFAOYSA-N	0	0	358.379	2.703	50	5		FFBARN
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000012795749	506903563	/nfs/dbraw/zinc/90/35/63/506903563.db2.gz	KHRGZXBEYNEPQK-LJQANCHMSA-N	0	0	369.421	2.707	50	5		FFBARN
O=C(CSc1nc[nH]n1)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1	ZINC000013683982	506951200	/nfs/dbraw/zinc/95/12/00/506951200.db2.gz	ZNKDXPIQQYCTLO-UHFFFAOYSA-N	0	0	362.396	2.567	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000017743619	507127991	/nfs/dbraw/zinc/12/79/91/507127991.db2.gz	VCDWSEMBMCQXCZ-GOSISDBHSA-N	0	0	370.409	2.790	50	5		FFBARN
CCCCOC[C@H](O)CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000019286097	507163034	/nfs/dbraw/zinc/16/30/34/507163034.db2.gz	FDXAGIZWXPMQSZ-OAHLLOKOSA-N	0	0	371.865	2.548	50	5		FFBARN
COc1cccc2c1O[C@]1(N3CCOCC3)CCCC[C@H]1[C@@H]2C[N+](=O)[O-]	ZINC000020413945	507220370	/nfs/dbraw/zinc/22/03/70/507220370.db2.gz	WZXCWLCTYQZXIV-JTDSTZFVSA-N	0	0	362.426	2.667	50	5		FFBARN
CC(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)O[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000020945972	507240304	/nfs/dbraw/zinc/24/03/04/507240304.db2.gz	KCWSYUXZDNFKOM-MRXNPFEDSA-N	0	0	356.294	2.742	50	5		FFBARN
CC(=O)Oc1ccc(C2=NN(C(C)=O)[C@H](c3cccc([N+](=O)[O-])c3)O2)cc1	ZINC000021091265	507244068	/nfs/dbraw/zinc/24/40/68/507244068.db2.gz	ALSRCGSHWIRCFQ-SFHVURJKSA-N	0	0	369.333	2.759	50	5		FFBARN
CCOc1ccc(C(=O)NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1OCC	ZINC000024151652	507394038	/nfs/dbraw/zinc/39/40/38/507394038.db2.gz	DOXHBQWXTLHPAS-INIZCTEOSA-N	0	0	374.393	2.856	50	5		FFBARN
Cc1nn(CN2CCO[C@H](c3ccc(F)cc3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000072312377	507774853	/nfs/dbraw/zinc/77/48/53/507774853.db2.gz	CGRBSCZKGPCJQX-KRWDZBQOSA-N	0	0	371.372	2.818	50	5		FFBARN
O=[N+]([O-])c1c(NC[C@@H](c2ccccc2)N2CCOCC2)nc2ccccn21	ZINC000029525992	507781926	/nfs/dbraw/zinc/78/19/26/507781926.db2.gz	MWVQZDVKVIMQHC-INIZCTEOSA-N	0	0	367.409	2.728	50	5		FFBARN
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000031195631	507818231	/nfs/dbraw/zinc/81/82/31/507818231.db2.gz	PMPANTDRWDFWNV-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
CC[C@H](C)N(CC(=O)OC(C)(C)C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000089942263	507888078	/nfs/dbraw/zinc/88/80/78/507888078.db2.gz	NKFICAAIQLJONM-NSHDSACASA-N	0	0	351.403	2.759	50	5		FFBARN
COC(=O)C[C@@H](Cc1ccccc1)NC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000075092416	508081654	/nfs/dbraw/zinc/08/16/54/508081654.db2.gz	AWEPGMLFTQBJLY-OAHLLOKOSA-N	0	0	357.366	2.891	50	5		FFBARN
COc1cccc(-c2noc(CCNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000096293974	508212808	/nfs/dbraw/zinc/21/28/08/508212808.db2.gz	KGVCOTZXYYVBDL-UHFFFAOYSA-N	0	0	368.349	2.626	50	5		FFBARN
O=C(/C=C/c1ccccc1)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000096276132	508213134	/nfs/dbraw/zinc/21/31/34/508213134.db2.gz	PCXVLRYYYKLXOH-IZZDOVSWSA-N	0	0	350.334	2.974	50	5		FFBARN
CC(C)(C)OC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000261494122	534838952	/nfs/dbraw/zinc/83/89/52/534838952.db2.gz	QIYZSWCPFRTMFX-UHFFFAOYSA-N	0	0	352.347	2.560	50	5		FFBARN
Cc1noc(C)c1CN1CCN(C(=O)/C=C\c2ccccc2[N+](=O)[O-])CC1	ZINC000047254155	570883741	/nfs/dbraw/zinc/88/37/41/570883741.db2.gz	MFPDSDGXZDZHKU-FPLPWBNLSA-N	0	0	370.409	2.557	50	5		FFBARN
Cc1c(CS(=O)(=O)CC(=O)N[C@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000048718156	570959272	/nfs/dbraw/zinc/95/92/72/570959272.db2.gz	JYPFLKWDNVGMHW-DOMZBBRYSA-N	0	0	368.455	2.513	50	5		FFBARN
O=C(C=Cc1ccccc1[N+](=O)[O-])OCC(=O)c1ccc2c(c1)OCO2	ZINC000033504630	992727700	/nfs/dbraw/zinc/72/77/00/992727700.db2.gz	KFVPQYVRTCZARP-VURMDHGXSA-N	0	0	355.302	2.763	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)OCC(=O)N1CCc2ccccc2C1	ZINC000035684401	1020108859	/nfs/dbraw/zinc/10/88/59/1020108859.db2.gz	DEVFHOLIBHSKAY-HJWRWDBZSA-N	0	0	366.373	2.736	50	5		FFBARN
CCn1c(SCC(=O)NC(C)(C)C)nnc1-c1cccc([N+](=O)[O-])c1	ZINC000001124393	219374798	/nfs/dbraw/zinc/37/47/98/219374798.db2.gz	FVTJOMLVVPMXPL-UHFFFAOYSA-N	0	0	363.443	2.880	50	5		FFBARN
COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)[C@@H]1c1ccccc1[N+](=O)[O-]	ZINC000000628568	203936145	/nfs/dbraw/zinc/93/61/45/203936145.db2.gz	RSTVYACYSIEKFX-QGZVFWFLSA-N	0	0	374.393	2.954	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)NC1CCCCCC1	ZINC000001430029	204006498	/nfs/dbraw/zinc/00/64/98/204006498.db2.gz	RAWGQAVPMQVBSV-UHFFFAOYSA-N	0	0	359.224	2.701	50	5		FFBARN
CC(C)OP(=O)(OC(C)C)c1ncn(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000001633277	204014797	/nfs/dbraw/zinc/01/47/97/204014797.db2.gz	OATAHRIDEFAELC-UHFFFAOYSA-N	0	0	354.303	2.844	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1ccccc1)Nc1cccc([N+](=O)[O-])c1	ZINC000002062848	204025146	/nfs/dbraw/zinc/02/51/46/204025146.db2.gz	LZRYCFPYPDIDDD-UHFFFAOYSA-N	0	0	356.334	2.740	50	5		FFBARN
COC(=O)c1sccc1NC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000002084704	204025904	/nfs/dbraw/zinc/02/59/04/204025904.db2.gz	ROIUWRRTHUCPCS-UHFFFAOYSA-N	0	0	351.296	2.603	50	5		FFBARN
CC(=O)N(C)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1	ZINC000002131817	204027589	/nfs/dbraw/zinc/02/75/89/204027589.db2.gz	VAAPQXHMULFLHI-UHFFFAOYSA-N	0	0	358.310	2.738	50	5		FFBARN
Nc1nc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)nn1-c1ccccc1	ZINC000002249147	204029968	/nfs/dbraw/zinc/02/99/68/204029968.db2.gz	UGKCLDMCDCYWQF-UHFFFAOYSA-N	0	0	358.745	2.663	50	5		FFBARN
CC(C)NC(=O)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1C2=O	ZINC000003138262	204079977	/nfs/dbraw/zinc/07/99/77/204079977.db2.gz	YLZIHVNLRROJJE-UHFFFAOYSA-N	0	0	355.306	2.853	50	5		FFBARN
COc1cc(Cl)c(C)cc1NC(=O)COc1cccnc1[N+](=O)[O-]	ZINC000002639468	204047822	/nfs/dbraw/zinc/04/78/22/204047822.db2.gz	HWZOIEYHUFELBR-UHFFFAOYSA-N	0	0	351.746	2.978	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cnn(Cc2ccccc2)c1	ZINC000002761847	204056211	/nfs/dbraw/zinc/05/62/11/204056211.db2.gz	MCHZSEMOURFORJ-UHFFFAOYSA-N	0	0	352.350	2.857	50	5		FFBARN
CCCCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1	ZINC000002813942	204060953	/nfs/dbraw/zinc/06/09/53/204060953.db2.gz	BUULPQBWZJYAOT-QINSGFPZSA-N	0	0	357.366	2.875	50	5		FFBARN
O=C1OCC2=C1[C@H](c1ccccc1[N+](=O)[O-])c1cc3c(cc1N2)OCO3	ZINC000004052197	204119118	/nfs/dbraw/zinc/11/91/18/204119118.db2.gz	HQXKDBWLBLPDJV-MRXNPFEDSA-N	0	0	352.302	2.692	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1I)C(F)(F)F	ZINC000004099315	204121063	/nfs/dbraw/zinc/12/10/63/204121063.db2.gz	FKYQJXBMNHFFFV-UHFFFAOYSA-N	0	0	360.029	2.700	50	5		FFBARN
COC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)cc(C(=O)OC)c1	ZINC000004600591	204150988	/nfs/dbraw/zinc/15/09/88/204150988.db2.gz	HVRTWDHQPUCLGO-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
COc1ccc(CNC(=O)CSc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1	ZINC000004678364	204153911	/nfs/dbraw/zinc/15/39/11/204153911.db2.gz	MIQZNMYNARHLNU-UHFFFAOYSA-N	0	0	372.406	2.888	50	5		FFBARN
O=C(CCc1nc2ccccc2c(=O)[nH]1)OCc1ccc([N+](=O)[O-])cc1	ZINC000004251221	204128804	/nfs/dbraw/zinc/12/88/04/204128804.db2.gz	DPYLWNYNBABBAY-UHFFFAOYSA-N	0	0	353.334	2.507	50	5		FFBARN
CC(C)NC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1	ZINC000004482686	204141644	/nfs/dbraw/zinc/14/16/44/204141644.db2.gz	IACVFWKBAJGTAT-SFQUDFHCSA-N	0	0	353.378	2.890	50	5		FFBARN
Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1	ZINC000004976612	204182528	/nfs/dbraw/zinc/18/25/28/204182528.db2.gz	JISRFEBMBDSCRV-UHFFFAOYSA-N	0	0	370.394	2.516	50	5		FFBARN
CC(=O)Nc1ccc(Nc2cc(N(C)C)c3nonc3c2[N+](=O)[O-])cc1	ZINC000005024987	204184795	/nfs/dbraw/zinc/18/47/95/204184795.db2.gz	OHGOZWHDNQTWEX-UHFFFAOYSA-N	0	0	356.342	2.899	50	5		FFBARN
COC(=O)c1cc(NC(=O)Nc2ccc([N+](=O)[O-])cc2)cc(C(=O)OC)c1	ZINC000005060497	204189234	/nfs/dbraw/zinc/18/92/34/204189234.db2.gz	OZQRBBILPCXXPL-UHFFFAOYSA-N	0	0	373.321	2.812	50	5		FFBARN
Cc1ccc2nc(COC(=O)c3ccc([N+](=O)[O-])cc3Cl)cc(=O)n2c1	ZINC000005185882	204195191	/nfs/dbraw/zinc/19/51/91/204195191.db2.gz	ZXDYQPPCTPHLCZ-UHFFFAOYSA-N	0	0	373.752	2.922	50	5		FFBARN
CCN(CC)S(=O)(=O)c1ccc(Sc2nccn2C)c([N+](=O)[O-])c1	ZINC000006160155	204240017	/nfs/dbraw/zinc/24/00/17/204240017.db2.gz	UAUZMOGAUBNVEZ-UHFFFAOYSA-N	0	0	370.456	2.510	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)Nc1cccnc1Cl	ZINC000006321686	204244753	/nfs/dbraw/zinc/24/47/53/204244753.db2.gz	ZNEOLJKRYIIRGL-VOTSOKGWSA-N	0	0	361.741	2.838	50	5		FFBARN
CCN(CC(=O)NCc1ccc(F)cc1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000006602493	204256047	/nfs/dbraw/zinc/25/60/47/204256047.db2.gz	BFTBIOIFUYLBSI-UHFFFAOYSA-N	0	0	359.357	2.512	50	5		FFBARN
CN(Cc1ccc(OC(F)F)cc1)c1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000007985037	204313041	/nfs/dbraw/zinc/31/30/41/204313041.db2.gz	OESPBMKIHLQOEC-UHFFFAOYSA-N	0	0	351.309	2.932	50	5		FFBARN
O=C(CCc1nc2cc([N+](=O)[O-])ccc2[nH]1)N1CCc2ccccc2C1	ZINC000008914678	204348844	/nfs/dbraw/zinc/34/88/44/204348844.db2.gz	RCQVKPUGYYGMCK-UHFFFAOYSA-N	0	0	350.378	2.989	50	5		FFBARN
O=C1C[C@H](c2cccc([N+](=O)[O-])c2)c2c(=O)[nH]c(-c3ccccc3)nc2N1	ZINC000009165041	204356410	/nfs/dbraw/zinc/35/64/10/204356410.db2.gz	HGUFKOZVHWBHQM-CQSZACIVSA-N	0	0	362.345	2.819	50	5		FFBARN
Cn1ccnc1[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000009367241	204365788	/nfs/dbraw/zinc/36/57/88/204365788.db2.gz	NFOLPKLEDLMHRR-MRXNPFEDSA-N	0	0	369.356	2.768	50	5		FFBARN
COc1ccc(Cl)cc1C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000009690141	204378239	/nfs/dbraw/zinc/37/82/39/204378239.db2.gz	QVGHMVYFTQMEMZ-CQSZACIVSA-N	0	0	350.758	2.720	50	5		FFBARN
COc1ccc(CNC(=O)Cn2c3ccccc3c(=O)c3ccccc32)cn1	ZINC000014900217	204590353	/nfs/dbraw/zinc/59/03/53/204590353.db2.gz	MDHKLJWQCMSZHI-UHFFFAOYSA-N	0	0	373.412	2.875	50	5		FFBARN
COc1ccc(-c2noc(CCNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000035681722	204998048	/nfs/dbraw/zinc/99/80/48/204998048.db2.gz	WZIAQKWODSJCER-UHFFFAOYSA-N	0	0	368.349	2.626	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N[C@@H](CN1CCCC1=O)c1ccccc1	ZINC000048277514	205154323	/nfs/dbraw/zinc/15/43/23/205154323.db2.gz	DLUXTFMJHAZUPC-KRWDZBQOSA-N	0	0	367.405	2.617	50	5		FFBARN
CC(C)N(C(=O)Cn1cc(Br)c([N+](=O)[O-])n1)c1ccccc1	ZINC000054919572	205202752	/nfs/dbraw/zinc/20/27/52/205202752.db2.gz	ZOAZGQYPLSSGFQ-UHFFFAOYSA-N	0	0	367.203	2.995	50	5		FFBARN
COc1ccc(C(=O)NCCOc2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	ZINC000056008710	205227131	/nfs/dbraw/zinc/22/71/31/205227131.db2.gz	PWQCHRLIIJNVMT-UHFFFAOYSA-N	0	0	356.378	2.901	50	5		FFBARN
O=[N+]([O-])c1cc(Cc2cc([N+](=O)[O-])cc3c2OCOC3)c2c(c1)COCO2	ZINC000004387833	206174991	/nfs/dbraw/zinc/17/49/91/206174991.db2.gz	IYGSOQZPRYJJID-UHFFFAOYSA-N	0	0	374.305	2.827	50	5		FFBARN
CC(C)OC(=O)c1ccc([N-]S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000003947409	206165229	/nfs/dbraw/zinc/16/52/29/206165229.db2.gz	VSONEXZIURGMNX-UHFFFAOYSA-N	0	0	364.379	2.961	50	5		FFBARN
Cc1[nH]c2ccccc2c1C(=O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000004515801	206179058	/nfs/dbraw/zinc/17/90/58/206179058.db2.gz	VEKVCZKEGZKMAT-UHFFFAOYSA-N	0	0	362.345	2.977	50	5		FFBARN
O=C(CCCNC(=O)NC1CCCCC1)NCc1ccccc1[N+](=O)[O-]	ZINC000053867201	206320886	/nfs/dbraw/zinc/32/08/86/206320886.db2.gz	NLNUZHXCSCZEFG-UHFFFAOYSA-N	0	0	362.430	2.623	50	5		FFBARN
CCOc1ccc(C(=O)N2CCC[C@@H](c3nc(C)no3)C2)cc1[N+](=O)[O-]	ZINC000054663532	206335987	/nfs/dbraw/zinc/33/59/87/206335987.db2.gz	DGJPDDPBQLPGSY-CYBMUJFWSA-N	0	0	360.370	2.705	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])c(F)c1)Nc1ccccc1-n1cccn1	ZINC000058014413	206391518	/nfs/dbraw/zinc/39/15/18/206391518.db2.gz	XMLMPLMMSMUHJR-UHFFFAOYSA-N	0	0	356.313	2.937	50	5		FFBARN
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H]3CC[C@H](O)[C@@H]3C2)CC1	ZINC000097107791	132227705	/nfs/dbraw/zinc/22/77/05/132227705.db2.gz	BQEWZZCEKPLKQB-YJLNNSPDSA-N	0	0	373.453	2.674	50	5		FFBARN
COc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-]	ZINC000000821772	132252053	/nfs/dbraw/zinc/25/20/53/132252053.db2.gz	PPWSTGVNXGEKHM-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
COc1ccc(NC(=O)C2=NN(c3ccccc3)C(=O)CC2)c([N+](=O)[O-])c1	ZINC000014128894	132872963	/nfs/dbraw/zinc/87/29/63/132872963.db2.gz	ACUOGCBGVDPVMQ-UHFFFAOYSA-N	0	0	368.349	2.725	50	5		FFBARN
Cn1c(C2CC2)nn(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1=S	ZINC000054516188	136125521	/nfs/dbraw/zinc/12/55/21/136125521.db2.gz	WHMKUGGDEOQLCQ-UHFFFAOYSA-N	0	0	374.470	2.516	50	5		FFBARN
O=[N+]([O-])c1cc2c(cc1CN1CCN(c3ccccc3F)CC1)OCO2	ZINC000055543862	136126996	/nfs/dbraw/zinc/12/69/96/136126996.db2.gz	NWLSYTXOZRHQNV-UHFFFAOYSA-N	0	0	359.357	2.785	50	5		FFBARN
O=[N+]([O-])c1c(F)cccc1N1CCN(Cc2ccc3c(c2)CCO3)CC1	ZINC000060564925	136132362	/nfs/dbraw/zinc/13/23/62/136132362.db2.gz	GINWAUVOJZSGLN-UHFFFAOYSA-N	0	0	357.385	2.991	50	5		FFBARN
COc1ccc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1OC	ZINC000000865234	506237383	/nfs/dbraw/zinc/23/73/83/506237383.db2.gz	SEOAUWSQSIANOK-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
Cc1cccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000000850450	506237399	/nfs/dbraw/zinc/23/73/99/506237399.db2.gz	XBNUCSFWFSWJLX-UHFFFAOYSA-N	0	0	353.334	2.528	50	5		FFBARN
C[C@@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	ZINC000000947368	506240625	/nfs/dbraw/zinc/24/06/25/506240625.db2.gz	YHOVPIUQSVDYHH-VIFPVBQESA-N	0	0	373.752	2.871	50	5		FFBARN
COc1cc(/C=C/[N+](=O)[O-])ccc1OC(=O)[C@H]1COc2ccccc2O1	ZINC000000943470	506240792	/nfs/dbraw/zinc/24/07/92/506240792.db2.gz	WPWDBNBDESFBDS-KBOKABMXSA-N	0	0	357.318	2.688	50	5		FFBARN
COc1ccccc1[C@H]1c2c(c3ccccc3oc2=O)OC(N)=C1[N+](=O)[O-]	ZINC000000989291	506242083	/nfs/dbraw/zinc/24/20/83/506242083.db2.gz	WSGCDVOWKYOSPM-AWEZNQCLSA-N	0	0	366.329	2.730	50	5		FFBARN
O=C1NC(=S)NC1=Cc1cccc(OCc2ccc([N+](=O)[O-])cc2)c1	ZINC000000993806	506242595	/nfs/dbraw/zinc/24/25/95/506242595.db2.gz	KKMUVOQRACFRHO-OQLLNIDSSA-N	0	0	355.375	2.930	50	5		FFBARN
O=C(N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC1)c1ccco1	ZINC000001216869	506255813	/nfs/dbraw/zinc/25/58/13/506255813.db2.gz	CKCZLBLFKLPAKD-DTQAZKPQSA-N	0	0	369.377	2.971	50	5		FFBARN
O=C(NCc1cccnc1OCC(F)(F)F)c1ccccc1[N+](=O)[O-]	ZINC000033108473	506337494	/nfs/dbraw/zinc/33/74/94/506337494.db2.gz	NQDYEUWMOKXCEV-UHFFFAOYSA-N	0	0	355.272	2.861	50	5		FFBARN
COC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@H](c2ccc([N+](=O)[O-])cc2)N1	ZINC000034792220	506369511	/nfs/dbraw/zinc/36/95/11/506369511.db2.gz	PMTFLAWFQMHLPS-IRXDYDNUSA-N	0	0	351.362	2.853	50	5		FFBARN
Cc1ccc(C(=O)N2CCSc3nnc(-c4ccco4)n32)cc1[N+](=O)[O-]	ZINC000034927722	506373959	/nfs/dbraw/zinc/37/39/59/506373959.db2.gz	NQKYJXSXWJRLST-UHFFFAOYSA-N	0	0	371.378	2.639	50	5		FFBARN
Cc1ccc(C)c(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000004749379	506393231	/nfs/dbraw/zinc/39/32/31/506393231.db2.gz	CTPBKHJTCYHDFF-UHFFFAOYSA-N	0	0	369.421	2.939	50	5		FFBARN
COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)c1	ZINC000004978280	506411396	/nfs/dbraw/zinc/41/13/96/506411396.db2.gz	CUWVPDCPBIMKTB-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
C[C@H]1C(=O)N(c2ccccc2F)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000037521834	506427512	/nfs/dbraw/zinc/42/75/12/506427512.db2.gz	VWDFQILPHDOANP-LBPRGKRZSA-N	0	0	357.341	2.611	50	5		FFBARN
O=[N+]([O-])c1cccc(NC(=S)N2CCN(c3ccc(O)cc3)CC2)c1	ZINC000006402383	506481006	/nfs/dbraw/zinc/48/10/06/506481006.db2.gz	QLAXRNWNSSSZDN-UHFFFAOYSA-N	0	0	358.423	2.819	50	5		FFBARN
COC(=O)c1cc(C(=O)N2CCCc3cc(OC)ccc32)cc([N+](=O)[O-])c1	ZINC000010541990	506746527	/nfs/dbraw/zinc/74/65/27/506746527.db2.gz	COKFIRZPKWZMCL-UHFFFAOYSA-N	0	0	370.361	2.983	50	5		FFBARN
CC(C)OC(=O)Oc1c([N+](=O)[O-])cc(N2CCCC2=O)cc1[N+](=O)[O-]	ZINC000012382703	506858082	/nfs/dbraw/zinc/85/80/82/506858082.db2.gz	RNNKZTYHDCABGX-UHFFFAOYSA-N	0	0	353.287	2.554	50	5		FFBARN
CCN(CC)c1nc(O)c(CC(=O)Nc2ccc(C)cc2[N+](=O)[O-])s1	ZINC000012687113	506890387	/nfs/dbraw/zinc/89/03/87/506890387.db2.gz	FDKBBGVSPBVJBT-ZDUSSCGKSA-N	0	0	364.427	2.572	50	5		FFBARN
COC(=O)C1(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)CCCCCC1	ZINC000012904823	506913908	/nfs/dbraw/zinc/91/39/08/506913908.db2.gz	PRRPRPDKDLXKNC-UHFFFAOYSA-N	0	0	350.371	2.599	50	5		FFBARN
Cc1cc(C(=O)Nc2ccccc2C(=O)N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000013020711	506924489	/nfs/dbraw/zinc/92/44/89/506924489.db2.gz	XTUOVIDMQRVGEU-UHFFFAOYSA-N	0	0	369.377	2.628	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000014244530	506982068	/nfs/dbraw/zinc/98/20/68/506982068.db2.gz	VPWPYODOZMHJJG-OAHLLOKOSA-N	0	0	353.378	2.890	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(N2CCCCC2)nc1	ZINC000045810293	507026539	/nfs/dbraw/zinc/02/65/39/507026539.db2.gz	YZGBAMJOWXLJSK-UHFFFAOYSA-N	0	0	356.382	2.998	50	5		FFBARN
O=C(c1ccc2nsnc2c1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000015936493	507066213	/nfs/dbraw/zinc/06/62/13/507066213.db2.gz	IYNIRWDQHUXROA-UHFFFAOYSA-N	0	0	369.406	2.562	50	5		FFBARN
Cc1cccc(N2CCN(C(=O)c3ccc(N(C)C)c([N+](=O)[O-])c3)CC2)c1	ZINC000016280859	507080655	/nfs/dbraw/zinc/08/06/55/507080655.db2.gz	KWARMVKEMNGSDY-UHFFFAOYSA-N	0	0	368.437	2.932	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)N3C[C@@H](C)O[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-]	ZINC000017824641	507128208	/nfs/dbraw/zinc/12/82/08/507128208.db2.gz	QBNSSDGKSSNULY-BETUJISGSA-N	0	0	372.425	2.706	50	5		FFBARN
COc1ccc(C(=O)Nc2ccc(CN3CCOCC3)cc2)cc1[N+](=O)[O-]	ZINC000019683079	507189485	/nfs/dbraw/zinc/18/94/85/507189485.db2.gz	LXCCQIBSZWZFQJ-UHFFFAOYSA-N	0	0	371.393	2.688	50	5		FFBARN
CC(C)C(=O)Nc1cccc(CNc2ccc(C(N)=O)cc2[N+](=O)[O-])c1	ZINC000024211432	507398533	/nfs/dbraw/zinc/39/85/33/507398533.db2.gz	MMMRNQUFQKPTNE-UHFFFAOYSA-N	0	0	356.382	2.900	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1cc(Cl)c[nH]1	ZINC000025195007	507474490	/nfs/dbraw/zinc/47/44/90/507474490.db2.gz	BUODJUIPDNTZDV-MRVPVSSYSA-N	0	0	367.745	2.769	50	5		FFBARN
O=C(NC1CCN(Cc2ccc(F)c(F)c2)CC1)c1ccc([N+](=O)[O-])o1	ZINC000072012134	507734385	/nfs/dbraw/zinc/73/43/85/507734385.db2.gz	WYOYVGQTNIGPEY-UHFFFAOYSA-N	0	0	365.336	2.860	50	5		FFBARN
COc1ccccc1CNC(=O)c1c[nH]nc1-c1ccc([N+](=O)[O-])cc1	ZINC000072329376	507776363	/nfs/dbraw/zinc/77/63/63/507776363.db2.gz	UZJVWYWCJDNNCS-UHFFFAOYSA-N	0	0	352.350	2.924	50	5		FFBARN
CNC(=O)c1ccc(/C=C/C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1	ZINC000029888281	507794279	/nfs/dbraw/zinc/79/42/79/507794279.db2.gz	IGFVUJQTZMPSFZ-RUDMXATFSA-N	0	0	351.362	2.557	50	5		FFBARN
O=C(C1CC1)N1CCC[C@@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000074017535	507977112	/nfs/dbraw/zinc/97/71/12/507977112.db2.gz	OGQLWOMJXDKHIG-OAHLLOKOSA-N	0	0	357.410	2.523	50	5		FFBARN
O=C(c1ccncc1)N1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1	ZINC000095430351	508185328	/nfs/dbraw/zinc/18/53/28/508185328.db2.gz	YBNJBOSFDFGBLZ-UHFFFAOYSA-N	0	0	360.801	2.601	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(N2C[C@H]3OCCN(Cc4ccccc4)[C@@H]3C2)c1	ZINC000170664050	509707592	/nfs/dbraw/zinc/70/75/92/509707592.db2.gz	AKLMTCGIMJQNNS-WOJBJXKFSA-N	0	0	369.421	2.693	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnnn1-c1ccccc1	ZINC000001109129	526080981	/nfs/dbraw/zinc/08/09/81/526080981.db2.gz	IQQZHUCKGRNHRY-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
CC(C)(C(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1	ZINC000029530850	535024646	/nfs/dbraw/zinc/02/46/46/535024646.db2.gz	FJRMYHJDUIIBEM-UHFFFAOYSA-N	0	0	354.410	2.616	50	5		FFBARN
O=C(CC1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1)N1CCCC1	ZINC000048272103	570939802	/nfs/dbraw/zinc/93/98/02/570939802.db2.gz	GBZCNUKQYPJUOM-UHFFFAOYSA-N	0	0	371.441	2.627	50	5		FFBARN
CC(=O)Oc1ccc(/C=C2/N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	ZINC000001228335	1014465105	/nfs/dbraw/zinc/46/51/05/1014465105.db2.gz	YASKABTXXUBIFJ-MHWRWJLKSA-N	0	0	352.302	2.865	50	5		FFBARN
CCOCCCNC(=O)/C=C\c1cc(OC)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000096991160	1012531129	/nfs/dbraw/zinc/53/11/29/1012531129.db2.gz	AZMPNTOBRRHADJ-WAYWQWQTSA-N	0	0	374.340	2.761	50	5		FFBARN
CCCN1c2ccccc2[C@](O)(CC(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000001051964	219359372	/nfs/dbraw/zinc/35/93/72/219359372.db2.gz	VGFOBZZATXMFBE-LJQANCHMSA-N	0	0	354.362	2.812	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCn1cnc2ccccc2c1=O	ZINC000001071747	219364189	/nfs/dbraw/zinc/36/41/89/219364189.db2.gz	KCYVTDKPXCTYBO-UHFFFAOYSA-N	0	0	352.350	2.642	50	5		FFBARN
C[C@@H](C(=O)Nc1cccc(Cl)c1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000001150575	219381361	/nfs/dbraw/zinc/38/13/61/219381361.db2.gz	GDJHZUVANXIYDW-VIFPVBQESA-N	0	0	373.752	2.871	50	5		FFBARN
CC(C)COCCCNS(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000013010502	209575982	/nfs/dbraw/zinc/57/59/82/209575982.db2.gz	YVOZOEUDIXMLAT-UHFFFAOYSA-N	0	0	350.824	2.589	50	5		FFBARN
O=C(CNc1ccccc1C(=O)NC1CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000010755583	209555078	/nfs/dbraw/zinc/55/50/78/209555078.db2.gz	OPLPRWGKFHKGJN-UHFFFAOYSA-N	0	0	354.366	2.538	50	5		FFBARN
C[C@@H](OC(=O)Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cn1	ZINC000005958623	219706754	/nfs/dbraw/zinc/70/67/54/219706754.db2.gz	GBQZZGVPOPOBIC-SNVBAGLBSA-N	0	0	363.757	2.756	50	5		FFBARN
Cc1c(C(=O)N[C@H]2CC(=O)N(c3cccc(F)c3)C2)cccc1[N+](=O)[O-]	ZINC000004497318	209421859	/nfs/dbraw/zinc/42/18/59/209421859.db2.gz	PTCLITYSUNXEPJ-ZDUSSCGKSA-N	0	0	357.341	2.578	50	5		FFBARN
C[C@@H]1C(=O)N(CCOc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccc(F)cc1	ZINC000047349481	209328328	/nfs/dbraw/zinc/32/83/28/209328328.db2.gz	GFSCMROHRBAVHR-GFCCVEGCSA-N	0	0	373.340	2.970	50	5		FFBARN
CCCCCn1c(=N)c(C(=O)OCC)cc2c1nc1c(C)cccn1c2=O	ZINC000101087575	209220600	/nfs/dbraw/zinc/22/06/00/209220600.db2.gz	VQFZSNNOGQAEKZ-UHFFFAOYSA-N	0	0	368.437	2.804	50	5		FFBARN
COc1ccc(C2=Nc3nnnn3[C@H](c3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000101087620	209220739	/nfs/dbraw/zinc/22/07/39/209220739.db2.gz	DQJDCGNUPMGCGZ-INIZCTEOSA-N	0	0	350.338	2.646	50	5		FFBARN
Cc1ccc2c(c1)nc1c3ccc4c(=O)oc(=O)c5ccc(c(=O)n21)c3c45	ZINC000097950561	209201025	/nfs/dbraw/zinc/20/10/25/209201025.db2.gz	VWBFHWFMEALUDS-UHFFFAOYSA-N	0	0	354.321	2.805	50	5		FFBARN
Cc1cc2nnc(SCc3nc4cc([N+](=O)[O-])ccc4[nH]3)n2c(C)n1	ZINC000097165100	209174731	/nfs/dbraw/zinc/17/47/31/209174731.db2.gz	IBTOIUJETPGVJD-UHFFFAOYSA-N	0	0	355.383	2.818	50	5		FFBARN
Cc1ccc(C(=O)NCCc2nc(-c3ccc([N+](=O)[O-])cc3)no2)cc1	ZINC000096279049	209149222	/nfs/dbraw/zinc/14/92/22/209149222.db2.gz	SBWOBLDNIJIEIN-UHFFFAOYSA-N	0	0	352.350	2.926	50	5		FFBARN
O=C(N/C(=C/c1cccc([N+](=O)[O-])c1)C(=O)N1CCCC1)c1ccccc1	ZINC000001194888	206866925	/nfs/dbraw/zinc/86/69/25/206866925.db2.gz	KUSFAJOPBXPJAF-NBVRZTHBSA-N	0	0	365.389	2.988	50	5		FFBARN
COc1cc(C=O)ccc1OS(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000003219635	206959958	/nfs/dbraw/zinc/95/99/58/206959958.db2.gz	IOQRQPPHPBAQKJ-UHFFFAOYSA-N	0	0	371.754	2.837	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nnnn1-c1ccccc1	ZINC000004827355	207052951	/nfs/dbraw/zinc/05/29/51/207052951.db2.gz	IKIUNRYINPHODS-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
O=[N+]([O-])c1nn(-c2ccccc2)[n+]([O-])c1NCc1ccc(F)cc1Cl	ZINC000004971287	207067438	/nfs/dbraw/zinc/06/74/38/207067438.db2.gz	RBXPQYNWSONQRP-UHFFFAOYSA-N	0	0	363.736	2.819	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)O[C@]12CCOC(C)(C)C2	ZINC000005024680	207073038	/nfs/dbraw/zinc/07/30/38/207073038.db2.gz	WPPNCEUAUFTUKU-UGSOOPFHSA-N	0	0	362.382	2.733	50	5		FFBARN
O=C(C[C@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)s1	ZINC000005049722	207076569	/nfs/dbraw/zinc/07/65/69/207076569.db2.gz	HPOVKSAVNSBYHX-CQSZACIVSA-N	0	0	352.755	2.722	50	5		FFBARN
CCOC(=O)C(=CNc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000005128783	207083600	/nfs/dbraw/zinc/08/36/00/207083600.db2.gz	VEQFMSJFMCVNIE-VBKFSLOCSA-N	0	0	355.350	2.841	50	5		FFBARN
COc1ccc(COC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1F	ZINC000005391166	207098168	/nfs/dbraw/zinc/09/81/68/207098168.db2.gz	WIOXHOXLLRLRFH-UHFFFAOYSA-N	0	0	363.297	2.871	50	5		FFBARN
COc1cc(CC(=O)OCc2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000005559477	207106363	/nfs/dbraw/zinc/10/63/63/207106363.db2.gz	UPRKPSAHQOGGEA-UHFFFAOYSA-N	0	0	361.350	2.907	50	5		FFBARN
Cc1c(Cl)cc(S(=O)(=O)N[C@H](C)c2ccccn2)cc1[N+](=O)[O-]	ZINC000007364749	207193645	/nfs/dbraw/zinc/19/36/45/207193645.db2.gz	OABATWFTLJKKCY-SNVBAGLBSA-N	0	0	355.803	2.991	50	5		FFBARN
Cc1cc(O[C@@H](C)C(=O)N2CC(=O)Nc3ccccc32)ccc1[N+](=O)[O-]	ZINC000008257027	207225952	/nfs/dbraw/zinc/22/59/52/207225952.db2.gz	LQZGPOMKNGREIL-LBPRGKRZSA-N	0	0	355.350	2.656	50	5		FFBARN
O=C(NC1CC1)c1ccc(NCc2cn3ccccc3n2)c([N+](=O)[O-])c1	ZINC000009156651	207260291	/nfs/dbraw/zinc/26/02/91/207260291.db2.gz	UUVOMQKXAKXEKC-UHFFFAOYSA-N	0	0	351.366	2.747	50	5		FFBARN
O=C(CSc1n[nH]c(-c2ccccc2)n1)Nc1ncc([N+](=O)[O-])s1	ZINC000010231582	207297624	/nfs/dbraw/zinc/29/76/24/207297624.db2.gz	QFQSSZDCDSJDPC-UHFFFAOYSA-N	0	0	362.396	2.567	50	5		FFBARN
O=c1c2cc(Cl)ccc2ncn1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000009883950	207289697	/nfs/dbraw/zinc/28/96/97/207289697.db2.gz	SVPAKNMNHIIABL-UHFFFAOYSA-N	0	0	373.752	2.873	50	5		FFBARN
COc1ccccc1OCC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000010964102	207308455	/nfs/dbraw/zinc/30/84/55/207308455.db2.gz	LOMQYZJSGCXBSZ-UHFFFAOYSA-N	0	0	374.349	2.782	50	5		FFBARN
Cc1ccc(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c([N+](=O)[O-])c1	ZINC000011066547	207309553	/nfs/dbraw/zinc/30/95/53/207309553.db2.gz	FTZHHKRKJYJFSR-UHFFFAOYSA-N	0	0	369.377	2.813	50	5		FFBARN
Nc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc(-c2ccc(F)cc2)no1	ZINC000012557587	207393570	/nfs/dbraw/zinc/39/35/70/207393570.db2.gz	RMWYNKBHJPDBNM-UHFFFAOYSA-N	0	0	358.285	2.723	50	5		FFBARN
COc1ccc(C)cc1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000032740719	208036770	/nfs/dbraw/zinc/03/67/70/208036770.db2.gz	MCMYMLMTVSKKLF-UHFFFAOYSA-N	0	0	358.350	2.864	50	5		FFBARN
COC(=O)c1ccc(F)c(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1	ZINC000032903240	208053907	/nfs/dbraw/zinc/05/39/07/208053907.db2.gz	CQKIOTOWTFMJMJ-UHFFFAOYSA-N	0	0	361.329	2.961	50	5		FFBARN
COc1ccc(-c2cc(OCC(N)=O)c3cc([N+](=O)[O-])ccc3n2)cc1	ZINC000032951299	208059714	/nfs/dbraw/zinc/05/97/14/208059714.db2.gz	FCRLUHUZSXQZEJ-UHFFFAOYSA-N	0	0	353.334	2.683	50	5		FFBARN
O=C(NCCc1nc(-c2ccc(F)cc2)no1)c1ccc([N+](=O)[O-])cc1	ZINC000035673125	208134887	/nfs/dbraw/zinc/13/48/87/208134887.db2.gz	IHZNRVVBFGALOX-UHFFFAOYSA-N	0	0	356.313	2.756	50	5		FFBARN
NC(=O)c1cc([N+](=O)[O-])cnc1NCc1ccc(OC(F)(F)F)cc1	ZINC000040083064	208223345	/nfs/dbraw/zinc/22/33/45/208223345.db2.gz	UCSPEGVGMQFVBB-UHFFFAOYSA-N	0	0	356.260	2.599	50	5		FFBARN
O=C(NCc1ccnc(-n2cccn2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000040081253	208223913	/nfs/dbraw/zinc/22/39/13/208223913.db2.gz	AWFJQSZZCJRVOM-UHFFFAOYSA-N	0	0	357.757	2.759	50	5		FFBARN
CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1OC(F)F	ZINC000040089082	208226240	/nfs/dbraw/zinc/22/62/40/208226240.db2.gz	VNBMWHYJTJZHOU-LBPRGKRZSA-N	0	0	354.313	2.660	50	5		FFBARN
Cc1c(F)cc(C(=O)NCc2cccnc2-n2cccn2)cc1[N+](=O)[O-]	ZINC000058423333	208585139	/nfs/dbraw/zinc/58/51/39/208585139.db2.gz	BFPNTGGBVSYJIB-UHFFFAOYSA-N	0	0	355.329	2.553	50	5		FFBARN
Cc1nn(C)c(NC[C@@H](O)COc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-]	ZINC000058244797	208573837	/nfs/dbraw/zinc/57/38/37/208573837.db2.gz	UXPKNTZPGIBQKD-LLVKDONJSA-N	0	0	374.319	2.507	50	5		FFBARN
COc1cc(C(=O)N2CCCSCC2)c([N+](=O)[O-])cc1OC(F)F	ZINC000060847256	208596951	/nfs/dbraw/zinc/59/69/51/208596951.db2.gz	UDCHICSLSJTYJN-UHFFFAOYSA-N	0	0	362.354	2.784	50	5		FFBARN
O=C(CCNc1nc2ccc([N+](=O)[O-])cc2s1)NCc1ccccn1	ZINC000096011449	209096198	/nfs/dbraw/zinc/09/61/98/209096198.db2.gz	WWLOHCQEOQIADZ-UHFFFAOYSA-N	0	0	357.395	2.718	50	5		FFBARN
C[C@H](O)c1nc2ccccc2n1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000095947487	209087990	/nfs/dbraw/zinc/08/79/90/209087990.db2.gz	GEMQGBXWLZRISC-NSHDSACASA-N	0	0	355.350	2.913	50	5		FFBARN
NC(=O)[C@@H]1CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000008053558	132842710	/nfs/dbraw/zinc/84/27/10/132842710.db2.gz	WROCKIVVNDNUMB-OAHLLOKOSA-N	0	0	353.378	2.528	50	5		FFBARN
CNC(=O)c1ccc(N(Cc2ccccc2)[C@@H](C)CCO)c([N+](=O)[O-])c1	ZINC000092962678	221840490	/nfs/dbraw/zinc/84/04/90/221840490.db2.gz	SUCZHEHPPCEQAB-AWEZNQCLSA-N	0	0	357.410	2.732	50	5		FFBARN
O=C(COC(=O)c1ccc(Br)o1)c1ccc([N+](=O)[O-])cc1	ZINC000000825467	506235102	/nfs/dbraw/zinc/23/51/02/506235102.db2.gz	HGLPSNCQMBCTAF-UHFFFAOYSA-N	0	0	354.112	2.990	50	5		FFBARN
O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1ccc(Cl)cc1	ZINC000000850475	506236706	/nfs/dbraw/zinc/23/67/06/506236706.db2.gz	LYKUKHMFZWLMOF-UHFFFAOYSA-N	0	0	373.752	2.873	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CCSc1nnnn1-c1c(C)cc(C)cc1C	ZINC000001135357	506250241	/nfs/dbraw/zinc/25/02/41/506250241.db2.gz	RDHQWGJMHSNTTR-UHFFFAOYSA-N	0	0	373.442	2.793	50	5		FFBARN
O=C(Oc1ccccc1C(=S)N1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000001166555	506252458	/nfs/dbraw/zinc/25/24/58/506252458.db2.gz	KMJBFWGJLVFGMR-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
COc1cccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c1OC	ZINC000002312845	506276391	/nfs/dbraw/zinc/27/63/91/506276391.db2.gz	JAFWNCONVGZGHQ-GXDHUFHOSA-N	0	0	354.318	2.957	50	5		FFBARN
C[C@@H](Sc1nnc(N)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000002622426	506284531	/nfs/dbraw/zinc/28/45/31/506284531.db2.gz	WNLKYAKRLMTJJZ-RXMQYKEDSA-N	0	0	359.820	2.801	50	5		FFBARN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCCC(=O)Nc1ccccn1	ZINC000052968086	506288127	/nfs/dbraw/zinc/28/81/27/506288127.db2.gz	UEUZKFSEBNJZRL-GFCCVEGCSA-N	0	0	374.422	2.615	50	5		FFBARN
CCN1C(C)=C(C(=O)OC)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)OC)=C1C	ZINC000002775253	506291971	/nfs/dbraw/zinc/29/19/71/506291971.db2.gz	SXFPCJUPGQFXDT-UHFFFAOYSA-N	0	0	374.393	2.908	50	5		FFBARN
CCn1cnc2sc(C(=O)Nc3cccc([N+](=O)[O-])c3)c(C)c2c1=O	ZINC000002910844	506301958	/nfs/dbraw/zinc/30/19/58/506301958.db2.gz	LSYBCFBELQZURP-UHFFFAOYSA-N	0	0	358.379	2.947	50	5		FFBARN
CN(C)c1ccc(NC(=O)COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1	ZINC000003222813	506312892	/nfs/dbraw/zinc/31/28/92/506312892.db2.gz	QNTNSOUSWAUHGV-LFYBBSHMSA-N	0	0	369.377	2.856	50	5		FFBARN
O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])NCCc1ccccc1	ZINC000003375991	506325512	/nfs/dbraw/zinc/32/55/12/506325512.db2.gz	KIZLVLGIAUIGTM-UHFFFAOYSA-N	0	0	362.769	2.764	50	5		FFBARN
CCOc1ccc(OCCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000003598289	506346557	/nfs/dbraw/zinc/34/65/57/506346557.db2.gz	AQYIZOAAJCWIQB-UHFFFAOYSA-N	0	0	356.334	2.669	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O	ZINC000004319296	506371341	/nfs/dbraw/zinc/37/13/41/506371341.db2.gz	QQICXRATKUNSSL-PBWFPOADSA-N	0	0	374.393	2.780	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H]1CC(=O)N(c2cccc(F)c2)C1	ZINC000004497368	506379001	/nfs/dbraw/zinc/37/90/01/506379001.db2.gz	ZALQCFGNPVLOQL-AJHXJQRKSA-N	0	0	369.352	2.669	50	5		FFBARN
CC(=O)N1CCN(c2ccccc2NC(=O)c2ccccc2[N+](=O)[O-])CC1	ZINC000004749755	506393592	/nfs/dbraw/zinc/39/35/92/506393592.db2.gz	GNGWKSFAKOFEOD-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
CC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	ZINC000004895880	506402242	/nfs/dbraw/zinc/40/22/42/506402242.db2.gz	XROJHUZUFRVJFW-UHFFFAOYSA-N	0	0	369.377	2.886	50	5		FFBARN
CN1CCN(c2ccc([N+](=O)[O-])cc2NC(=O)Cc2ccccc2)CC1	ZINC000005048970	506417488	/nfs/dbraw/zinc/41/74/88/506417488.db2.gz	AXUPWEWVMWMSJE-UHFFFAOYSA-N	0	0	354.410	2.528	50	5		FFBARN
COc1ccc(NC(=O)COc2ncnc3ccccc32)c([N+](=O)[O-])c1	ZINC000005504690	506446596	/nfs/dbraw/zinc/44/65/96/506446596.db2.gz	VIOZZBQNYQTPMV-UHFFFAOYSA-N	0	0	354.322	2.564	50	5		FFBARN
O=C(N1CCCCC1)N1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1	ZINC000040153527	506475667	/nfs/dbraw/zinc/47/56/67/506475667.db2.gz	ZCXQMTURSWQPIM-UHFFFAOYSA-N	0	0	369.425	2.871	50	5		FFBARN
O=C(CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccs1	ZINC000008030565	506615798	/nfs/dbraw/zinc/61/57/98/506615798.db2.gz	VRITZDHXUAJPJM-UHFFFAOYSA-N	0	0	373.434	2.968	50	5		FFBARN
O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CCN(c2ncccn2)CC1	ZINC000008774435	506669447	/nfs/dbraw/zinc/66/94/47/506669447.db2.gz	GIBGYGFXLICBOH-UHFFFAOYSA-N	0	0	369.406	2.562	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1cccc2c1OCCO2	ZINC000055156696	506688124	/nfs/dbraw/zinc/68/81/24/506688124.db2.gz	ADTPBKZJMCSNMH-LLVKDONJSA-N	0	0	373.365	2.814	50	5		FFBARN
CN(C[C@H]1COc2ccccc2O1)C(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000012931908	506917973	/nfs/dbraw/zinc/91/79/73/506917973.db2.gz	FDZBDACBEDEXMY-NKSUMMKUSA-N	0	0	354.362	2.906	50	5		FFBARN
Cc1ccc(C(=O)NCc2ccccc2CN2CCOCC2)cc1[N+](=O)[O-]	ZINC000012935074	506918190	/nfs/dbraw/zinc/91/81/90/506918190.db2.gz	SRKCNSVYWXJQAK-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
CNC(=O)c1ccc(CN(C(=O)c2ccccc2[N+](=O)[O-])C2CC2)cc1	ZINC000012971494	506920176	/nfs/dbraw/zinc/92/01/76/506920176.db2.gz	TVTSFKXRIFIGKS-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
CN(CC(=O)NC1CC1)c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000017282313	507119152	/nfs/dbraw/zinc/11/91/52/507119152.db2.gz	LKIKXPIONOMCAB-UHFFFAOYSA-N	0	0	353.378	2.541	50	5		FFBARN
CC(=O)Nc1ccc(C)cc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000068191733	507143814	/nfs/dbraw/zinc/14/38/14/507143814.db2.gz	SYKOWLFIFAQMMF-UHFFFAOYSA-N	0	0	353.338	2.990	50	5		FFBARN
CC(C)C12CN3CC(C(C)C)(CN(C1)C3c1cccc([N+](=O)[O-])c1)C2O	ZINC000019323110	507165651	/nfs/dbraw/zinc/16/56/51/507165651.db2.gz	BKSDRBUNFHRCPU-UHFFFAOYSA-N	0	0	359.470	2.884	50	5	biogenic	FFBARN
COc1ccc(C2=NN(C(C)=O)[C@@H](c3ccc([N+](=O)[O-])cc3)O2)cc1OC	ZINC000021090600	507244350	/nfs/dbraw/zinc/24/43/50/507244350.db2.gz	BHTLYQJCVBKEEH-GOSISDBHSA-N	0	0	371.349	2.851	50	5		FFBARN
COCc1ccc(C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1	ZINC000023048072	507326233	/nfs/dbraw/zinc/32/62/33/507326233.db2.gz	AQGIIRLBVBSCSC-UHFFFAOYSA-N	0	0	362.313	2.676	50	5		FFBARN
O=c1c([N+](=O)[O-])c(N2CCC[C@H]2Cc2ccccc2)nc2ccccn21	ZINC000024201722	507397906	/nfs/dbraw/zinc/39/79/06/507397906.db2.gz	HLFZMGFSLMLPDS-HNNXBMFYSA-N	0	0	350.378	2.814	50	5		FFBARN
Cc1nn(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(=S)s1	ZINC000024207509	507398159	/nfs/dbraw/zinc/39/81/59/507398159.db2.gz	XHHKKHIKFTZMGQ-UHFFFAOYSA-N	0	0	351.457	2.670	50	5		FFBARN
Cc1ccnn1-c1ccc(C(=O)NCCNc2ccccc2[N+](=O)[O-])cc1	ZINC000024320800	507404078	/nfs/dbraw/zinc/40/40/78/507404078.db2.gz	FIHKNUOFIHCLPF-UHFFFAOYSA-N	0	0	365.393	2.931	50	5		FFBARN
O=C(OCc1cccc(F)c1F)c1cc([N+](=O)[O-])ccc1NCCO	ZINC000024507884	507417304	/nfs/dbraw/zinc/41/73/04/507417304.db2.gz	PKQUIFHIADVUSA-UHFFFAOYSA-N	0	0	352.293	2.634	50	5		FFBARN
NC(=O)N1CCCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000060363057	507531267	/nfs/dbraw/zinc/53/12/67/507531267.db2.gz	UCSRJXGUEGASGY-UHFFFAOYSA-N	0	0	366.727	2.858	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1OCC(=O)Nc1ccnn1C1CCCC1	ZINC000031673870	507821042	/nfs/dbraw/zinc/82/10/42/507821042.db2.gz	BUNQNRMCLNATCE-UHFFFAOYSA-N	0	0	360.370	2.933	50	5		FFBARN
C[C@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1	ZINC000031964418	507822588	/nfs/dbraw/zinc/82/25/88/507822588.db2.gz	VAVCJTHAPOWNMK-CYBMUJFWSA-N	0	0	359.451	2.762	50	5		FFBARN
O=[N+]([O-])c1c(Cl)nc2ccccc2c1NCCCN1CCOCC1	ZINC000096193722	508210204	/nfs/dbraw/zinc/21/02/04/508210204.db2.gz	SBEYZNYPEQFDBZ-UHFFFAOYSA-N	0	0	350.806	2.931	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCCN1C(=O)c1cccnc1	ZINC000084422045	571085311	/nfs/dbraw/zinc/08/53/11/571085311.db2.gz	ZPZYFPTVLNXJMC-KRWDZBQOSA-N	0	0	369.377	2.728	50	5		FFBARN
O=C(/C=C\c1cc2c(cc1[N+](=O)[O-])OCO2)Nc1nc2c(s1)CCC2	ZINC000096912718	728481401	/nfs/dbraw/zinc/48/14/01/728481401.db2.gz	BEJHYJPZCIOIGH-PLNGDYQASA-N	0	0	359.363	2.921	50	5		FFBARN
O=C(NCc1ccccc1)c1[nH]cnc1C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004978868	975471915	/nfs/dbraw/zinc/47/19/15/975471915.db2.gz	RFFXWTXMOOGQMZ-UHFFFAOYSA-N	0	0	365.349	2.500	50	5		FFBARN
CC(C)c1ncc(Cl)c(C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)n1	ZINC000225528792	209816524	/nfs/dbraw/zinc/81/65/24/209816524.db2.gz	IIRSTVWDPHXOEM-UHFFFAOYSA-N	0	0	374.788	2.968	50	5		FFBARN
COc1ccc(CN(C2CC2)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000194821010	209613660	/nfs/dbraw/zinc/61/36/60/209613660.db2.gz	ZLDJQSSSKXVVJR-UHFFFAOYSA-N	0	0	362.407	2.957	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005672377	209446651	/nfs/dbraw/zinc/44/66/51/209446651.db2.gz	HVKOEVULOCKPLZ-NSHDSACASA-N	0	0	371.349	2.737	50	5		FFBARN
C[C@H](Oc1ccccc1)C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000005961350	209446225	/nfs/dbraw/zinc/44/62/25/209446225.db2.gz	XEOHLWJFLCNVMI-NSHDSACASA-N	0	0	362.313	2.683	50	5		FFBARN
CCc1ccccc1NC(=O)CNC(=O)COc1cccc([N+](=O)[O-])c1C	ZINC000048367831	209332177	/nfs/dbraw/zinc/33/21/77/209332177.db2.gz	PCJJFFFAXPZEKC-UHFFFAOYSA-N	0	0	371.393	2.599	50	5		FFBARN
CN(Cc1cnn(C)c1)C(=O)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000047867019	209329041	/nfs/dbraw/zinc/32/90/41/209329041.db2.gz	QXFWGLSCRXPLCT-UHFFFAOYSA-N	0	0	372.303	2.542	50	5		FFBARN
CO[C@@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000043892699	209311442	/nfs/dbraw/zinc/31/14/42/209311442.db2.gz	HQRDHYNBPJTWIB-KRWDZBQOSA-N	0	0	358.398	2.694	50	5		FFBARN
COc1ccc(C([O-])=CC(=O)C(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1	ZINC000101354921	209224273	/nfs/dbraw/zinc/22/42/73/209224273.db2.gz	JOMDZBIQDVFSGX-UHFFFAOYSA-N	0	0	356.334	2.692	50	5		FFBARN
Cc1cc(C)n(C(=O)[C@H](C)n2nc([N+](=O)[O-])c(Br)c2C)n1	ZINC000001070882	206859545	/nfs/dbraw/zinc/85/95/45/206859545.db2.gz	SPOUKAGICWHNJR-VIFPVBQESA-N	0	0	356.180	2.577	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000002156386	206903832	/nfs/dbraw/zinc/90/38/32/206903832.db2.gz	CFXSMYUMPNMRSC-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@@H]1c1ccc2c(c1)OCO2	ZINC000003092315	206957191	/nfs/dbraw/zinc/95/71/91/206957191.db2.gz	MXZZZGCVCWXDKK-QGZVFWFLSA-N	0	0	355.306	2.563	50	5		FFBARN
O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1	ZINC000004599780	207032720	/nfs/dbraw/zinc/03/27/20/207032720.db2.gz	NPTSMLTUZJVQKA-UHFFFAOYSA-N	0	0	352.350	2.698	50	5		FFBARN
CN(Cc1ccccc1)c1cc(NCCCO)c([N+](=O)[O-])c2nonc21	ZINC000004716628	207042396	/nfs/dbraw/zinc/04/23/96/207042396.db2.gz	QLOIILPHBUSUCO-UHFFFAOYSA-N	0	0	357.370	2.562	50	5		FFBARN
CCNc1ccc(C(=O)OCC(=O)N2CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000004871637	207057405	/nfs/dbraw/zinc/05/74/05/207057405.db2.gz	DLZJONAEEBYNRR-UHFFFAOYSA-N	0	0	369.377	2.773	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)Oc2ccc(C)nc2[N+](=O)[O-])c1C	ZINC000004892283	207058845	/nfs/dbraw/zinc/05/88/45/207058845.db2.gz	PDWXFNJCERRSAF-LLVKDONJSA-N	0	0	361.354	2.680	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)Nc2cc(OC)c([N+](=O)[O-])cc2C)cc1	ZINC000005115256	207081717	/nfs/dbraw/zinc/08/17/17/207081717.db2.gz	NRACDFUXALTZIZ-UHFFFAOYSA-N	0	0	374.349	2.716	50	5		FFBARN
Nc1ccc([N+](=O)[O-])cc1C(=O)O[C@@H](C(=O)N1CCCC1)c1ccccc1	ZINC000005278554	207091280	/nfs/dbraw/zinc/09/12/80/207091280.db2.gz	ZZYWHPCUVJGAFM-QGZVFWFLSA-N	0	0	369.377	2.698	50	5		FFBARN
Cc1c(Nc2ccc3nonc3c2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C	ZINC000005276841	207091981	/nfs/dbraw/zinc/09/19/81/207091981.db2.gz	LTAHAGBSAFOMDB-UHFFFAOYSA-N	0	0	366.337	2.672	50	5		FFBARN
Cc1c(C(=O)NCC(=O)Nc2ccc(F)c(F)c2F)cccc1[N+](=O)[O-]	ZINC000005422555	207099604	/nfs/dbraw/zinc/09/96/04/207099604.db2.gz	MSERUZDLLRFXGR-UHFFFAOYSA-N	0	0	367.283	2.689	50	5		FFBARN
Cc1ccccc1-c1nnn(CC(=O)Nc2cccc([N+](=O)[O-])c2C)n1	ZINC000006552569	207145892	/nfs/dbraw/zinc/14/58/92/207145892.db2.gz	CSRFJJZHLDWDDL-UHFFFAOYSA-N	0	0	352.354	2.504	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000007067595	207185695	/nfs/dbraw/zinc/18/56/95/207185695.db2.gz	JGGYEXRWCYDOCO-GFCCVEGCSA-N	0	0	362.407	2.832	50	5		FFBARN
O=C1C[C@H](c2ccc([N+](=O)[O-])cc2)c2c(=O)[nH]c(-c3ccccc3)nc2N1	ZINC000008738976	207246606	/nfs/dbraw/zinc/24/66/06/207246606.db2.gz	HGFXAXKLPATAKY-CQSZACIVSA-N	0	0	362.345	2.819	50	5		FFBARN
CCN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000009479389	207272811	/nfs/dbraw/zinc/27/28/11/207272811.db2.gz	LFGXZGZPRIMWMW-UHFFFAOYSA-N	0	0	366.377	2.802	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000009687635	207281046	/nfs/dbraw/zinc/28/10/46/207281046.db2.gz	KZCXRUGLVVONII-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
Cc1c(C(=O)NCc2ccc(N3CCCC3=O)cc2)cccc1[N+](=O)[O-]	ZINC000016513552	207588202	/nfs/dbraw/zinc/58/82/02/207588202.db2.gz	KIUNSJKQVJEYBY-UHFFFAOYSA-N	0	0	353.378	2.960	50	5		FFBARN
O=C(c1cc([N+](=O)[O-])c[nH]1)N1CCN(Cc2ccc(Cl)s2)CC1	ZINC000023717807	207853686	/nfs/dbraw/zinc/85/36/86/207853686.db2.gz	MGCJDTQIYITPEK-UHFFFAOYSA-N	0	0	354.819	2.596	50	5		FFBARN
COc1ccc(CN2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1	ZINC000028403917	207961268	/nfs/dbraw/zinc/96/12/68/207961268.db2.gz	BRVIWZKTNKXXJB-CQSZACIVSA-N	0	0	369.377	2.591	50	5		FFBARN
Cc1cccc(C(=O)NC2CCN(C(=O)c3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000032845656	208048980	/nfs/dbraw/zinc/04/89/80/208048980.db2.gz	JZACGPQEAXKPLM-UHFFFAOYSA-N	0	0	367.405	2.938	50	5		FFBARN
O=C(NCCCOC1CCCCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000031498123	208014228	/nfs/dbraw/zinc/01/42/28/208014228.db2.gz	JAWQASWMKCNDBR-UHFFFAOYSA-N	0	0	373.413	2.645	50	5		FFBARN
Cc1ccc(-c2noc(CCNC(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000035681716	208135274	/nfs/dbraw/zinc/13/52/74/208135274.db2.gz	QFZIRSUBLFFSDZ-UHFFFAOYSA-N	0	0	352.350	2.926	50	5		FFBARN
COc1cccc(CN(C)C(=O)c2cc(F)cc([N+](=O)[O-])c2N)c1OC	ZINC000048244872	208394254	/nfs/dbraw/zinc/39/42/54/208394254.db2.gz	IRGCHWUGJQXKND-UHFFFAOYSA-N	0	0	363.345	2.606	50	5		FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1COc2ccccc2C1	ZINC000065488767	208683149	/nfs/dbraw/zinc/68/31/49/208683149.db2.gz	SFEYTLPPIQWXCO-AWEZNQCLSA-N	0	0	365.389	2.917	50	5		FFBARN
COc1cccc(SC2=NS(=O)(=O)c3cc([N+](=O)[O-])ccc32)c1	ZINC000095481775	209059973	/nfs/dbraw/zinc/05/99/73/209059973.db2.gz	WZLHFRYSGNQZDX-UHFFFAOYSA-N	0	0	350.377	2.845	50	5		FFBARN
COC(=O)/C=C\CN1C(=O)[C@H](c2ccccc2)Oc2cc([N+](=O)[O-])ccc21	ZINC000097406794	132228658	/nfs/dbraw/zinc/22/86/58/132228658.db2.gz	UIMZWCJZDWWSCW-MTIYJEKLSA-N	0	0	368.345	2.791	50	5		FFBARN
Cc1ccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000004749695	132824486	/nfs/dbraw/zinc/82/44/86/132824486.db2.gz	JHIZKIHHWKBBKV-UHFFFAOYSA-N	0	0	355.394	2.631	50	5		FFBARN
Cc1ccccc1N1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000055543598	136127036	/nfs/dbraw/zinc/12/70/36/136127036.db2.gz	WSUMKKWEAILRHU-UHFFFAOYSA-N	0	0	355.394	2.954	50	5		FFBARN
C[C@H](C(=O)N(C)c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000057718126	136129993	/nfs/dbraw/zinc/12/99/93/136129993.db2.gz	OVLFURIZUOMSOC-MRXNPFEDSA-N	0	0	368.437	2.768	50	5		FFBARN
COc1ccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1	ZINC000004125053	136151763	/nfs/dbraw/zinc/15/17/63/136151763.db2.gz	ASDSPKOBITTWIE-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
COc1cc(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(OC)cc1Cl	ZINC000000826505	506234879	/nfs/dbraw/zinc/23/48/79/506234879.db2.gz	DSUYDAHZKUHHQN-UHFFFAOYSA-N	0	0	368.777	2.717	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000000825841	506234987	/nfs/dbraw/zinc/23/49/87/506234987.db2.gz	WJAXWNATDNUXOF-QGZVFWFLSA-N	0	0	367.361	2.966	50	5		FFBARN
COC(=O)c1cc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc(C(=O)OC)c1	ZINC000000994228	506242575	/nfs/dbraw/zinc/24/25/75/506242575.db2.gz	WIVUEIFIRULVQH-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
CCOC(=O)N1CCN(c2nc(-c3cccc([N+](=O)[O-])c3)cs2)CC1	ZINC000001158729	506252124	/nfs/dbraw/zinc/25/21/24/506252124.db2.gz	ZANZXARSGHSMIJ-UHFFFAOYSA-N	0	0	362.411	2.997	50	5		FFBARN
COC(=O)c1cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc(C(=O)OC)c1	ZINC000001230676	506255953	/nfs/dbraw/zinc/25/59/53/506255953.db2.gz	DFPLQNWBBODREE-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
CC(C)NC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1	ZINC000001793489	506269126	/nfs/dbraw/zinc/26/91/26/506269126.db2.gz	IACVFWKBAJGTAT-ATVHPVEESA-N	0	0	353.378	2.890	50	5		FFBARN
O=C(Nc1cccc2oc(=O)ccc12)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000002067144	506270819	/nfs/dbraw/zinc/27/08/19/506270819.db2.gz	KPWUTGREDLGXQK-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
O=C(NC[C@@H]1OCCc2ccccc21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000002316129	506276367	/nfs/dbraw/zinc/27/63/67/506276367.db2.gz	AGLICLBPFOMWMR-INIZCTEOSA-N	0	0	357.322	2.547	50	5		FFBARN
O=C(CSc1nccn1-c1ccc([N+](=O)[O-])cc1)Nc1nccs1	ZINC000002468356	506279630	/nfs/dbraw/zinc/27/96/30/506279630.db2.gz	DYBIEZKEBMJTHL-UHFFFAOYSA-N	0	0	361.408	2.968	50	5		FFBARN
Cc1ccc(Cl)cc1NC(=O)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002788093	506293028	/nfs/dbraw/zinc/29/30/28/506293028.db2.gz	QUIZNNMXLUSXQV-UHFFFAOYSA-N	0	0	360.761	2.708	50	5		FFBARN
COC(=O)c1sccc1NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O	ZINC000002872851	506299565	/nfs/dbraw/zinc/29/95/65/506299565.db2.gz	QNPFDRLMWKEZDU-UHFFFAOYSA-N	0	0	374.330	2.802	50	5		FFBARN
COc1ccccc1NC(=O)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000032923526	506312918	/nfs/dbraw/zinc/31/29/18/506312918.db2.gz	MLBRUVOKBNUKGQ-UHFFFAOYSA-N	0	0	356.382	2.854	50	5		FFBARN
O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1F	ZINC000003229512	506313073	/nfs/dbraw/zinc/31/30/73/506313073.db2.gz	XBWYOBHOTFCWME-NSHDSACASA-N	0	0	358.247	2.615	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000065552230	506321733	/nfs/dbraw/zinc/32/17/33/506321733.db2.gz	UDALQDAVGPXFMW-QGZVFWFLSA-N	0	0	368.393	2.998	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	ZINC000003530354	506339329	/nfs/dbraw/zinc/33/93/29/506339329.db2.gz	XGLQJUDQMFSMTD-UHFFFAOYSA-N	0	0	370.361	2.888	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc(F)c(F)c1F	ZINC000003561388	506343612	/nfs/dbraw/zinc/34/36/12/506343612.db2.gz	ANKOKCWVXQYCJA-UHFFFAOYSA-N	0	0	367.283	2.771	50	5		FFBARN
O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1	ZINC000004703734	506389442	/nfs/dbraw/zinc/38/94/42/506389442.db2.gz	FRSCLLJZLJROBY-UHFFFAOYSA-N	0	0	370.409	2.750	50	5		FFBARN
C[C@H]1C[C@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000005262011	506432405	/nfs/dbraw/zinc/43/24/05/506432405.db2.gz	IFQUJLWLDGVOAR-CMPLNLGQSA-N	0	0	357.332	2.918	50	5		FFBARN
CCOc1ccc(NC(=O)COc2ncnc3ccccc32)c([N+](=O)[O-])c1	ZINC000005504591	506446419	/nfs/dbraw/zinc/44/64/19/506446419.db2.gz	QMAKPCYVCMWJSK-UHFFFAOYSA-N	0	0	368.349	2.954	50	5		FFBARN
CC(=O)Nc1cccc(-n2c(C)nnc2Sc2ccc([N+](=O)[O-])cn2)c1	ZINC000040067623	506461720	/nfs/dbraw/zinc/46/17/20/506461720.db2.gz	WJWJDZOSCYWEJJ-UHFFFAOYSA-N	0	0	370.394	2.989	50	5		FFBARN
C[C@@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c2ccccc2S1	ZINC000006119857	506467679	/nfs/dbraw/zinc/46/76/79/506467679.db2.gz	WKFMCUDMOTZUJS-GFCCVEGCSA-N	0	0	359.407	2.674	50	5		FFBARN
O=C(c1ccc(F)cc1)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000040105746	506467788	/nfs/dbraw/zinc/46/77/88/506467788.db2.gz	GVGRYZCJXKFRNW-UHFFFAOYSA-N	0	0	373.384	2.571	50	5		FFBARN
CC(=O)c1ccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000007751607	506587491	/nfs/dbraw/zinc/58/74/91/506587491.db2.gz	SQJNLRGTNXAVSE-UHFFFAOYSA-N	0	0	353.378	2.760	50	5		FFBARN
COc1ccc(Nc2cc(N3CCOCC3)c3nonc3c2[N+](=O)[O-])cc1	ZINC000008660897	506661015	/nfs/dbraw/zinc/66/10/15/506661015.db2.gz	RTIZWMNQCRILIH-UHFFFAOYSA-N	0	0	371.353	2.720	50	5		FFBARN
Cc1cc2c(c3c1c(=O)c1ccccc1c3=O)c(=O)c1ccccc1c2=O	ZINC000043214902	506717819	/nfs/dbraw/zinc/71/78/19/506717819.db2.gz	UEPBERKGNRZASV-UHFFFAOYSA-N	0	0	352.345	2.924	50	5		FFBARN
O=C(NCc1ccc(F)cc1)c1cc(N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000012516295	506870589	/nfs/dbraw/zinc/87/05/89/506870589.db2.gz	LDHRFXLCJITQFA-UHFFFAOYSA-N	0	0	359.357	2.501	50	5		FFBARN
Cc1ccc(-c2noc(Cn3cnc4ccc([N+](=O)[O-])cc4c3=O)n2)cc1	ZINC000012888071	506911054	/nfs/dbraw/zinc/91/10/54/506911054.db2.gz	FASXSQHJZGXQRE-UHFFFAOYSA-N	0	0	363.333	2.711	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(N2CCCC2=O)cc1	ZINC000014215401	506979205	/nfs/dbraw/zinc/97/92/05/506979205.db2.gz	YKBQMVRYLAHZLP-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
CCOC(=O)[C@H]1CCCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000015402203	507038236	/nfs/dbraw/zinc/03/82/36/507038236.db2.gz	XZLSFBUSSPXDLM-JSGCOSHPSA-N	0	0	374.397	2.981	50	5		FFBARN
Cc1ccn2c(c1)nc(C)c(NC(=O)c1ccc(C)c([N+](=O)[O-])c1)c2=O	ZINC000015865275	507065115	/nfs/dbraw/zinc/06/51/15/507065115.db2.gz	ICLYMMBILMGOIG-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
CC[C@@H]1c2ccsc2CCN1C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000016778378	507105026	/nfs/dbraw/zinc/10/50/26/507105026.db2.gz	XYSFQFUFBWYIJA-OAHLLOKOSA-N	0	0	373.434	2.922	50	5		FFBARN
O=C(c1cccc(Cl)c1)N1CCCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000057141578	507182842	/nfs/dbraw/zinc/18/28/42/507182842.db2.gz	FETVZUSRCPCPCS-UHFFFAOYSA-N	0	0	360.801	2.996	50	5		FFBARN
COc1cc2c(cc1OC)[C@@H](c1cc3c(cc1[N+](=O)[O-])OCO3)NCC2	ZINC000022204771	507283238	/nfs/dbraw/zinc/28/32/38/507283238.db2.gz	DDEZIWSQYMTURV-SFHVURJKSA-N	0	0	358.350	2.576	50	5		FFBARN
COc1ccc(S(=O)(=O)NCC2(c3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000023435945	507354483	/nfs/dbraw/zinc/35/44/83/507354483.db2.gz	BJDRWOBCSIWVKH-UHFFFAOYSA-N	0	0	362.407	2.614	50	5		FFBARN
COc1ccc(Cn2cc([N+](=O)[O-])ccc2=O)c(Br)c1OC	ZINC000058174628	507378343	/nfs/dbraw/zinc/37/83/43/507378343.db2.gz	DMLLQBOLCRJGRJ-UHFFFAOYSA-N	0	0	369.171	2.585	50	5		FFBARN
Cc1cc(C(=O)NCc2ccccc2CN2CCOCC2)ccc1[N+](=O)[O-]	ZINC000024208742	507397786	/nfs/dbraw/zinc/39/77/86/507397786.db2.gz	XMSMZNJABRIOBM-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
COc1ccc(NC(=O)N(C)C[C@H]2COc3ccccc3O2)c([N+](=O)[O-])c1	ZINC000024690754	507430904	/nfs/dbraw/zinc/43/09/04/507430904.db2.gz	XFMNRDNTXIWODR-ZDUSSCGKSA-N	0	0	373.365	2.907	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1F)Nc1cccc(N2CCCC2=O)c1	ZINC000059011855	507492777	/nfs/dbraw/zinc/49/27/77/507492777.db2.gz	LTYRVIWWOHCYGJ-UHFFFAOYSA-N	0	0	373.340	2.878	50	5		FFBARN
Cc1cccc(N2CCN(CC(=O)Nc3ccc(C)cc3[N+](=O)[O-])CC2)c1	ZINC000027381950	507653068	/nfs/dbraw/zinc/65/30/68/507653068.db2.gz	ZLTLOUKUAJOHLV-UHFFFAOYSA-N	0	0	368.437	2.972	50	5		FFBARN
CCc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1N	ZINC000072312576	507775452	/nfs/dbraw/zinc/77/54/52/507775452.db2.gz	GKWYWZMFBMSZKM-LLVKDONJSA-N	0	0	357.366	2.923	50	5		FFBARN
CC(C)(C)OC(=O)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000029753828	507789081	/nfs/dbraw/zinc/78/90/81/507789081.db2.gz	WPLIQDFTOUHUPN-UHFFFAOYSA-N	0	0	351.403	2.526	50	5		FFBARN
O=C(c1ccc2ccccc2n1)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000032005594	507822956	/nfs/dbraw/zinc/82/29/56/507822956.db2.gz	OBKKGZLRVIGDPU-UHFFFAOYSA-N	0	0	363.377	2.500	50	5		FFBARN
CC(C)[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N1CCc2ccccc2C1	ZINC000073815109	507958384	/nfs/dbraw/zinc/95/83/84/507958384.db2.gz	XIWPNAZWDRIJRW-KRWDZBQOSA-N	0	0	355.394	2.978	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)N1CCNC(=O)C[C@H]1c1ccccc1	ZINC000047175173	570881178	/nfs/dbraw/zinc/88/11/78/570881178.db2.gz	ANZCFXLZUCYXAI-LPADLIQXSA-N	0	0	365.389	2.698	50	5		FFBARN
COC(=O)c1cc(/C=C\C(=O)Nc2cc([N+](=O)[O-])ccc2OC)oc1C	ZINC000096926408	1012464420	/nfs/dbraw/zinc/46/44/20/1012464420.db2.gz	SSCMPTSACNQIQF-ALCCZGGFSA-N	0	0	360.322	2.943	50	5		FFBARN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccccc1C(F)(F)F	ZINC000001066452	219362412	/nfs/dbraw/zinc/36/24/12/219362412.db2.gz	GBWXJXBQNOOYED-UHFFFAOYSA-N	0	0	367.283	2.982	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CSc1nnnn1Cc1ccccc1	ZINC000001067514	219363147	/nfs/dbraw/zinc/36/31/47/219363147.db2.gz	JGJOQRDFBSMVMM-UHFFFAOYSA-N	0	0	357.395	2.931	50	5		FFBARN
CCN(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)c1ccccc1C	ZINC000058168833	209696555	/nfs/dbraw/zinc/69/65/55/209696555.db2.gz	JIUNORZXMLCWKD-UHFFFAOYSA-N	0	0	362.407	2.973	50	5		FFBARN
Cc1cc(C)c2c(n1)sc1c2nnn(-c2ccc([N+](=O)[O-])cc2)c1=O	ZINC000004124060	219545924	/nfs/dbraw/zinc/54/59/24/219545924.db2.gz	LRVGOPCJPGHUDX-UHFFFAOYSA-N	0	0	353.363	2.915	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1OC	ZINC000005261871	209437962	/nfs/dbraw/zinc/43/79/62/209437962.db2.gz	YGTQCNNUGCKISX-UHFFFAOYSA-N	0	0	359.382	2.592	50	5		FFBARN
C[C@@H](NC(=O)NCCNC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1	ZINC000050153786	209344190	/nfs/dbraw/zinc/34/41/90/209344190.db2.gz	NLSGHUUXVFTBMM-GFCCVEGCSA-N	0	0	374.372	2.524	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(Cn2cccn2)cc1	ZINC000047176583	209328567	/nfs/dbraw/zinc/32/85/67/209328567.db2.gz	JKWWIGKNXBTQNK-UHFFFAOYSA-N	0	0	352.350	2.857	50	5		FFBARN
Cc1ccc(NC(=O)CCCN2C(=O)[C@@H]3CC=CC[C@H]3C2=O)c([N+](=O)[O-])c1	ZINC000102547743	209237329	/nfs/dbraw/zinc/23/73/29/209237329.db2.gz	UZPLMHHJQJRWAR-ZIAGYGMSSA-N	0	0	371.393	2.573	50	5		FFBARN
Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)N2	ZINC000000950769	206848779	/nfs/dbraw/zinc/84/87/79/206848779.db2.gz	BGJCZCQNWVBJRB-MRXNPFEDSA-N	0	0	354.366	2.973	50	5		FFBARN
Cc1ccc(NC(=O)C(=O)NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000010327383	206885294	/nfs/dbraw/zinc/88/52/94/206885294.db2.gz	DPZXNBPBNKFBQA-UHFFFAOYSA-N	0	0	361.785	2.854	50	5		FFBARN
CCOc1ccc(NC(=O)C[C@@H]2Nc3ccccc3NC2=O)c([N+](=O)[O-])c1	ZINC000004047445	206999052	/nfs/dbraw/zinc/99/90/52/206999052.db2.gz	YZAXUUWFRMKAPT-HNNXBMFYSA-N	0	0	370.365	2.755	50	5		FFBARN
Cc1cc(C(=O)N2NC(C3CC3)=C[C@@]2(O)C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000004178891	207004413	/nfs/dbraw/zinc/00/44/13/207004413.db2.gz	CSSXDVLYMNYVJB-CQSZACIVSA-N	0	0	357.288	2.766	50	5		FFBARN
CCCc1cc(C(N)=O)c(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)s1	ZINC000004750358	207046785	/nfs/dbraw/zinc/04/67/85/207046785.db2.gz	KGZFPXQYUZWMQP-UHFFFAOYSA-N	0	0	363.395	2.969	50	5		FFBARN
O=C(CCCn1cc([N+](=O)[O-])cn1)NCc1ccc(-n2cccc2)cc1	ZINC000004710401	207041044	/nfs/dbraw/zinc/04/10/44/207041044.db2.gz	ZYUONLZPFYAOFZ-UHFFFAOYSA-N	0	0	353.382	2.679	50	5		FFBARN
Cc1ccc(Nc2nc(N)nc(COc3ccccc3[N+](=O)[O-])n2)cc1	ZINC000005298542	207092337	/nfs/dbraw/zinc/09/23/37/207092337.db2.gz	YHGNBCBVTBRPPA-UHFFFAOYSA-N	0	0	352.354	2.993	50	5		FFBARN
CCn1cc(Cn2cc(NC(=S)Nc3ccc([N+](=O)[O-])cc3)cn2)cn1	ZINC000006243894	207134178	/nfs/dbraw/zinc/13/41/78/207134178.db2.gz	NSGUPDDHDOXBDW-UHFFFAOYSA-N	0	0	371.426	2.865	50	5		FFBARN
COc1ccc(CN(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)c(OC)c1	ZINC000006288376	207135419	/nfs/dbraw/zinc/13/54/19/207135419.db2.gz	XMEUVLZCSBWAQH-UHFFFAOYSA-N	0	0	360.366	2.893	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)OCCOc1ccccc1	ZINC000006830817	207169686	/nfs/dbraw/zinc/16/96/86/207169686.db2.gz	HKDHUHPQAYIMOD-UHFFFAOYSA-N	0	0	360.366	2.889	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1nn(C)c(=O)c2ccccc21	ZINC000007066800	207186195	/nfs/dbraw/zinc/18/61/95/207186195.db2.gz	NESLNVMHUCYCCR-GFCCVEGCSA-N	0	0	366.377	2.675	50	5		FFBARN
Cc1ccc2oc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)cc(=O)c2c1	ZINC000008183665	207222142	/nfs/dbraw/zinc/22/21/42/207222142.db2.gz	CTFBHAKFWKPDID-UHFFFAOYSA-N	0	0	367.361	2.852	50	5		FFBARN
Cc1cc(O[C@H](C)C(=O)N2CC(=O)Nc3ccccc32)ccc1[N+](=O)[O-]	ZINC000008257028	207226654	/nfs/dbraw/zinc/22/66/54/207226654.db2.gz	LQZGPOMKNGREIL-GFCCVEGCSA-N	0	0	355.350	2.656	50	5		FFBARN
Cc1ccc(OCC(=O)Nc2ccc3c(c2)OC(F)(F)O3)c([N+](=O)[O-])n1	ZINC000008687991	207240461	/nfs/dbraw/zinc/24/04/61/207240461.db2.gz	GLEATAVXALNACZ-UHFFFAOYSA-N	0	0	367.264	2.637	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)N3C[C@H](C)O[C@@H](C)C3)cc2)c(C)c1[N+](=O)[O-]	ZINC000008883724	207250444	/nfs/dbraw/zinc/25/04/44/207250444.db2.gz	QBNSSDGKSSNULY-STQMWFEESA-N	0	0	372.425	2.706	50	5		FFBARN
COC(=O)c1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000009479337	207272684	/nfs/dbraw/zinc/27/26/84/207272684.db2.gz	NVPWIUQTAXXBFN-UHFFFAOYSA-N	0	0	373.317	2.605	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCCn1c(C)csc1=O	ZINC000009337378	207267175	/nfs/dbraw/zinc/26/71/75/207267175.db2.gz	MCGHZFYAXCQZCH-UHFFFAOYSA-N	0	0	351.384	2.554	50	5		FFBARN
COc1ccc(NC(=O)NCc2ccc(-n3ccnc3)nc2)c([N+](=O)[O-])c1	ZINC000012520185	207384935	/nfs/dbraw/zinc/38/49/35/207384935.db2.gz	ULANPIQCXOWWKT-UHFFFAOYSA-N	0	0	368.353	2.506	50	5		FFBARN
Cc1ccccc1[C@H](C)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000014092829	207497594	/nfs/dbraw/zinc/49/75/94/207497594.db2.gz	PFBQTEPUMKSXLP-LBPRGKRZSA-N	0	0	355.350	2.689	50	5		FFBARN
COc1cc(C(=O)NCc2cccc(NC(C)=O)c2)c([N+](=O)[O-])cc1OC	ZINC000040093536	207958029	/nfs/dbraw/zinc/95/80/29/207958029.db2.gz	AOKMYOALBXKVHZ-UHFFFAOYSA-N	0	0	373.365	2.500	50	5		FFBARN
C[C@H](Oc1ccccc1Cl)C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032795470	208042455	/nfs/dbraw/zinc/04/24/55/208042455.db2.gz	PTGSXWLKPLXZLO-XHDPSFHLSA-N	0	0	364.785	2.865	50	5		FFBARN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1Cl)Nc1ccccc1F	ZINC000035743547	208135718	/nfs/dbraw/zinc/13/57/18/208135718.db2.gz	ULSUZYMNNOGRAX-UHFFFAOYSA-N	0	0	351.721	2.756	50	5		FFBARN
O=C(NC1CC1)c1ccc(NCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000040083263	208223880	/nfs/dbraw/zinc/22/38/80/208223880.db2.gz	FKJZQEGYDIIHPS-UHFFFAOYSA-N	0	0	369.377	2.966	50	5		FFBARN
COC(=O)c1cn(CCc2ccc([N+](=O)[O-])cc2)c2c1-c1nccn1CC2	ZINC000044126837	208311342	/nfs/dbraw/zinc/31/13/42/208311342.db2.gz	YVMNOSFWPLASTO-UHFFFAOYSA-N	0	0	366.377	2.845	50	5		FFBARN
CCN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)N1C[C@@H](C)C[C@H](C)C1	ZINC000047608148	208383297	/nfs/dbraw/zinc/38/32/97/208383297.db2.gz	PQITVPCOANDADM-KBPBESRZSA-N	0	0	355.460	2.639	50	5		FFBARN
O=C(Nc1ccc(N2CCOCC2)cc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000001801129	132382460	/nfs/dbraw/zinc/38/24/60/132382460.db2.gz	SBRWRQPJFWTVLM-UHFFFAOYSA-N	0	0	372.337	2.592	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004842020	132824926	/nfs/dbraw/zinc/82/49/26/132824926.db2.gz	NKUVAWPULBTHTE-UHFFFAOYSA-N	0	0	362.773	2.732	50	5		FFBARN
Cc1cc(CN(C)C(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)no1	ZINC000025136560	132912907	/nfs/dbraw/zinc/91/29/07/132912907.db2.gz	RDYWUNVZZLDKCX-UHFFFAOYSA-N	0	0	358.398	2.766	50	5		FFBARN
Cc1cc2c(nc3s/c(=C\c4ccc([N+](=O)[O-])cc4)c(=O)n23)c(C)c1	ZINC000000676932	506228763	/nfs/dbraw/zinc/22/87/63/506228763.db2.gz	AHCYICCWJXFIIP-DHDCSXOGSA-N	0	0	351.387	2.982	50	5		FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000845684	506235027	/nfs/dbraw/zinc/23/50/27/506235027.db2.gz	JWJKQMQXUBCOON-MRXNPFEDSA-N	0	0	352.350	2.861	50	5		FFBARN
CC(C)[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	ZINC000001135049	506250665	/nfs/dbraw/zinc/25/06/65/506250665.db2.gz	PXZWHUIBYSXGBD-INIZCTEOSA-N	0	0	367.361	2.854	50	5		FFBARN
CS(=O)(=O)c1ccc(C(=O)CSc2ccc([N+](=O)[O-])cc2)cc1	ZINC000002165059	506274004	/nfs/dbraw/zinc/27/40/04/506274004.db2.gz	AWGFYVWASRXQDH-UHFFFAOYSA-N	0	0	351.405	2.973	50	5		FFBARN
COCCn1c(=O)c2c(=O)c3ccccc3n(C)c2nc1C1CCCCC1	ZINC000002342966	506277682	/nfs/dbraw/zinc/27/76/82/506277682.db2.gz	WXFSQIXHVARWSS-UHFFFAOYSA-N	0	0	367.449	2.943	50	5		FFBARN
CC(=O)Nc1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000002632394	506284948	/nfs/dbraw/zinc/28/49/48/506284948.db2.gz	MVTFOYZFYNMKDQ-UHFFFAOYSA-N	0	0	372.333	2.777	50	5		FFBARN
O=C(COC(=O)Cc1ccccc1[N+](=O)[O-])NCc1ccccc1Cl	ZINC000002630563	506285429	/nfs/dbraw/zinc/28/54/29/506285429.db2.gz	VRKWPLRQIZCAKP-UHFFFAOYSA-N	0	0	362.769	2.650	50	5		FFBARN
CCc1c(C)sc2ncn3nc(Cn4nc([N+](=O)[O-])cc4C)nc3c12	ZINC000002808956	506295261	/nfs/dbraw/zinc/29/52/61/506295261.db2.gz	ZUQFSFZHRZAWQJ-UHFFFAOYSA-N	0	0	357.399	2.671	50	5		FFBARN
CCCCn1nnc(NC(=O)c2ccc(-c3ccccc3[N+](=O)[O-])o2)n1	ZINC000002865914	506298399	/nfs/dbraw/zinc/29/83/99/506298399.db2.gz	CQSLXNMQQRCMKN-UHFFFAOYSA-N	0	0	356.342	2.894	50	5		FFBARN
CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000003131820	506310979	/nfs/dbraw/zinc/31/09/79/506310979.db2.gz	CKOMUHFBAWJEIB-UHFFFAOYSA-N	0	0	350.352	2.629	50	5		FFBARN
C[C@@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003240980	506315139	/nfs/dbraw/zinc/31/51/39/506315139.db2.gz	MXUTZLYIYUXFEC-LLVKDONJSA-N	0	0	372.333	2.550	50	5		FFBARN
Cc1nn(CC(=O)N2CCC(Cc3ccccc3)CC2)c(C)c1[N+](=O)[O-]	ZINC000003309882	506319784	/nfs/dbraw/zinc/31/97/84/506319784.db2.gz	BDJVAJNSIRYOGZ-UHFFFAOYSA-N	0	0	356.426	2.889	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H](C)N1C(=O)c2ccccc2C1=O	ZINC000004043755	506355060	/nfs/dbraw/zinc/35/50/60/506355060.db2.gz	BGHLTIAWFVXZAD-NSHDSACASA-N	0	0	353.334	2.526	50	5		FFBARN
Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1[N+](=O)[O-]	ZINC000004286092	506370081	/nfs/dbraw/zinc/37/00/81/506370081.db2.gz	YLNPMQLOVYYBAH-UHFFFAOYSA-N	0	0	370.365	2.774	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc(OC(F)F)c1	ZINC000053434035	506378486	/nfs/dbraw/zinc/37/84/86/506378486.db2.gz	OIYRHCLXUWYGRI-UHFFFAOYSA-N	0	0	365.292	2.565	50	5		FFBARN
C[C@H](NC(=O)OCc1ccccc1)C(=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000004763657	506393141	/nfs/dbraw/zinc/39/31/41/506393141.db2.gz	RMDSOBUAMXNVDC-ZDUSSCGKSA-N	0	0	358.350	2.953	50	5		FFBARN
COc1cc(NC(=O)COc2ncnc3ccccc32)c(C)cc1[N+](=O)[O-]	ZINC000005504720	506445973	/nfs/dbraw/zinc/44/59/73/506445973.db2.gz	JKOFQWJRZLSLES-UHFFFAOYSA-N	0	0	368.349	2.873	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccccc1CN1CCCC1=O	ZINC000040071648	506463265	/nfs/dbraw/zinc/46/32/65/506463265.db2.gz	RJLDWKASKQXTQA-UHFFFAOYSA-N	0	0	367.405	2.576	50	5		FFBARN
Cc1nn(CC(=O)N2CCS[C@H]2c2ccccc2F)c(C)c1[N+](=O)[O-]	ZINC000008848766	506671198	/nfs/dbraw/zinc/67/11/98/506671198.db2.gz	ACNYENOHEAVMSB-INIZCTEOSA-N	0	0	364.402	2.821	50	5		FFBARN
Cc1ccc(NC(=O)CN(C)C[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])c1	ZINC000016629019	507100575	/nfs/dbraw/zinc/10/05/75/507100575.db2.gz	DGBRYFZVVXWHCY-CQSZACIVSA-N	0	0	371.393	2.614	50	5		FFBARN
CC1=NN(c2ccccc2)C(=O)[C@@H]1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000018240402	507148597	/nfs/dbraw/zinc/14/85/97/507148597.db2.gz	IMURLUBIDTVTPB-HNNXBMFYSA-N	0	0	368.305	2.725	50	5		FFBARN
Cc1cccc(C(=O)OCC(=O)Nc2cccc3nsnc32)c1[N+](=O)[O-]	ZINC000019078264	507153675	/nfs/dbraw/zinc/15/36/75/507153675.db2.gz	UQEQLVWLDPTQBL-UHFFFAOYSA-N	0	0	372.362	2.703	50	5		FFBARN
COc1ccc(C(=O)N2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000019732834	507197525	/nfs/dbraw/zinc/19/75/25/507197525.db2.gz	XQTYQBWHSBETCU-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COc1ccc([C@H]2OC(c3ccccc3[N+](=O)[O-])=NN2C(C)=O)cc1OC	ZINC000020946054	507239946	/nfs/dbraw/zinc/23/99/46/507239946.db2.gz	LZFTZWCPNNPEBE-GOSISDBHSA-N	0	0	371.349	2.851	50	5		FFBARN
Cc1ccc(OCCN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1	ZINC000058270426	507397428	/nfs/dbraw/zinc/39/74/28/507397428.db2.gz	ZGFGKSPCWFBNBY-UHFFFAOYSA-N	0	0	372.377	2.825	50	5		FFBARN
COc1cc2c(cc1OC)C(=O)N[C@@H](c1cc([N+](=O)[O-])c(F)cc1F)N2	ZINC000069097665	507407965	/nfs/dbraw/zinc/40/79/65/507407965.db2.gz	KHNHUOFUSRZQCM-HNNXBMFYSA-N	0	0	365.292	2.744	50	5		FFBARN
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)[C@H]1CCc2ccccc21	ZINC000058412599	507414746	/nfs/dbraw/zinc/41/47/46/507414746.db2.gz	KAFWQVMBCYOQJE-ACJLOTCBSA-N	0	0	367.405	2.859	50	5		FFBARN
O=C(NCc1ccccn1)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]12	ZINC000024536505	507417330	/nfs/dbraw/zinc/41/73/30/507417330.db2.gz	CITKAHJLPPLHFL-MJGOQNOKSA-N	0	0	366.421	2.837	50	5		FFBARN
COc1cc(CC(=O)N(C)Cc2cccc([N+](=O)[O-])c2)cc(OC)c1OC	ZINC000024946581	507451320	/nfs/dbraw/zinc/45/13/20/507451320.db2.gz	PDROMUJABZDFDY-UHFFFAOYSA-N	0	0	374.393	2.822	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C(=O)Nc1ccccc1	ZINC000024985681	507454158	/nfs/dbraw/zinc/45/41/58/507454158.db2.gz	ZWAYUXDQYJEXQQ-QGZVFWFLSA-N	0	0	353.378	2.767	50	5		FFBARN
O=C(c1cc2ccccc2o1)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000025580645	507513593	/nfs/dbraw/zinc/51/35/93/507513593.db2.gz	XDZQQJQVXQIRNF-UHFFFAOYSA-N	0	0	352.350	2.698	50	5		FFBARN
CC1CCC(NC(=O)COC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC1	ZINC000062311089	507664763	/nfs/dbraw/zinc/66/47/63/507664763.db2.gz	UKLFAHVTBNZPPA-UHFFFAOYSA-N	0	0	373.409	2.788	50	5		FFBARN
O=C(NC[C@H]1CCN(c2ccccc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000027840286	507688626	/nfs/dbraw/zinc/68/86/26/507688626.db2.gz	UQTGBUCWAVRUEW-CYBMUJFWSA-N	0	0	365.393	2.727	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(Cc2ccc(F)cc2)C1	ZINC000028580751	507731665	/nfs/dbraw/zinc/73/16/65/507731665.db2.gz	JUJNVIICWBSLTC-ZDUSSCGKSA-N	0	0	357.341	2.721	50	5		FFBARN
COc1cc(OC)c(C2=CCN(c3c([N+](=O)[O-])ncn3C)CC2)c(OC)c1	ZINC000029599181	507784113	/nfs/dbraw/zinc/78/41/13/507784113.db2.gz	FBXCEYBLURXZBN-UHFFFAOYSA-N	0	0	374.397	2.648	50	5		FFBARN
COc1ccc(OC)c2c1CN(CCc1ccc([N+](=O)[O-])cc1)C[C@@H]2O	ZINC000052561535	507813882	/nfs/dbraw/zinc/81/38/82/507813882.db2.gz	AIAGFMJWJZZASO-INIZCTEOSA-N	0	0	358.394	2.704	50	5		FFBARN
CC(C)(C)OC(=O)N1CSC[C@@H]1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000080344018	508066615	/nfs/dbraw/zinc/06/66/15/508066615.db2.gz	CIVOWSCIKHTXBI-GFCCVEGCSA-N	0	0	353.400	2.843	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cc2c(nc3ccccn3c2=O)s1	ZINC000096347272	508213561	/nfs/dbraw/zinc/21/35/61/508213561.db2.gz	NHCDKRZCHKLXGC-UHFFFAOYSA-N	0	0	373.375	2.526	50	5		FFBARN
CC(=O)Nc1ccc(C(=O)OCC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000001171249	519710952	/nfs/dbraw/zinc/71/09/52/519710952.db2.gz	IFEPGESVTUPHMJ-UHFFFAOYSA-N	0	0	356.334	2.901	50	5		FFBARN
CCNc1cc(N2CCN(C(=O)c3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000004125034	535521885	/nfs/dbraw/zinc/52/18/85/535521885.db2.gz	NRWOQEPOLCRNID-UHFFFAOYSA-N	0	0	354.410	2.989	50	5		FFBARN
CCOC(=O)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000005129013	535778583	/nfs/dbraw/zinc/77/85/83/535778583.db2.gz	UHXKBMHMUHPLKC-UHFFFAOYSA-N	0	0	366.393	2.613	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000047175176	570881274	/nfs/dbraw/zinc/88/12/74/570881274.db2.gz	ANZCFXLZUCYXAI-QZEKMECESA-N	0	0	365.389	2.698	50	5		FFBARN
Cc1nn(CC(=O)Nc2nc(-c3ccccc3)ns2)c(C)c1[N+](=O)[O-]	ZINC000048368665	570953021	/nfs/dbraw/zinc/95/30/21/570953021.db2.gz	DSPLXXLVGZLZLE-UHFFFAOYSA-N	0	0	358.383	2.565	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1F	ZINC000059012091	209864694	/nfs/dbraw/zinc/86/46/94/209864694.db2.gz	LYVWCYFYFXHVHV-LLVKDONJSA-N	0	0	373.340	2.877	50	5		FFBARN
Cc1cc(C(F)F)n2nc(C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)nc2n1	ZINC000001005631	219352993	/nfs/dbraw/zinc/35/29/93/219352993.db2.gz	DCHBMCJJCYCMTG-UHFFFAOYSA-N	0	0	366.259	2.670	50	5		FFBARN
CC(C)NS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000001076631	219365669	/nfs/dbraw/zinc/36/56/69/219365669.db2.gz	ALSLOQLZXRBSHJ-UHFFFAOYSA-N	0	0	363.395	2.534	50	5		FFBARN
Cc1ccccc1-n1ncc2c1ncn(Cc1cccc([N+](=O)[O-])c1)c2=O	ZINC000004479066	209421617	/nfs/dbraw/zinc/42/16/17/209421617.db2.gz	HBYYVUNHJLPEHH-UHFFFAOYSA-N	0	0	361.361	2.847	50	5		FFBARN
O=c1[nH]c(=O)c2c([nH]1)OC(c1ccccc1)=C[C@H]2c1ccc([N+](=O)[O-])cc1	ZINC000226761557	209368238	/nfs/dbraw/zinc/36/82/38/209368238.db2.gz	WVLRBYLKNTXSLT-AWEZNQCLSA-N	0	0	363.329	2.537	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1cccc(Cl)c1	ZINC000103529699	209254008	/nfs/dbraw/zinc/25/40/08/209254008.db2.gz	GHCHCBRODQXBLY-DZGCQCFKSA-N	0	0	371.736	2.541	50	5		FFBARN
COC(=O)c1cc2c(nc3c(C)cccn3c2=O)n(C2CCCCC2)c1=N	ZINC000100627823	209215075	/nfs/dbraw/zinc/21/50/75/209215075.db2.gz	QJTGKDIVEWZIMG-UHFFFAOYSA-N	0	0	366.421	2.729	50	5		FFBARN
COc1ccc(C(=O)NCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1	ZINC000096277089	209148590	/nfs/dbraw/zinc/14/85/90/209148590.db2.gz	IDZCWKGHGLYLJB-UHFFFAOYSA-N	0	0	368.349	2.626	50	5		FFBARN
O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(OC(F)(F)F)cc1	ZINC000016488035	220185158	/nfs/dbraw/zinc/18/51/58/220185158.db2.gz	VTJQUVKJMFFHEZ-CQSZACIVSA-N	0	0	370.283	2.957	50	5		FFBARN
CC(=O)Nc1ccc(OC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1	ZINC000000807606	206833099	/nfs/dbraw/zinc/83/30/99/206833099.db2.gz	AZRHAVSWGYNMQY-UHFFFAOYSA-N	0	0	368.301	2.879	50	5		FFBARN
Cc1nc(C)c(C(=O)OCC(=O)Nc2ccc(F)cc2[N+](=O)[O-])s1	ZINC000010142209	206875556	/nfs/dbraw/zinc/87/55/56/206875556.db2.gz	CIPFUGKZCPCLEY-UHFFFAOYSA-N	0	0	353.331	2.603	50	5		FFBARN
O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NCC(F)(F)F	ZINC000002653608	206926668	/nfs/dbraw/zinc/92/66/68/206926668.db2.gz	RFUOZMMLOHZHJM-UHFFFAOYSA-N	0	0	351.331	2.975	50	5		FFBARN
COC(=O)c1cnc(Sc2n[nH]c(-c3ccccc3)n2)c([N+](=O)[O-])c1	ZINC000004394891	207017902	/nfs/dbraw/zinc/01/79/02/207017902.db2.gz	WFVVSHOGMMYCPI-UHFFFAOYSA-N	0	0	357.351	2.713	50	5		FFBARN
CCO[C@@]12ON=C(c3cccc([N+](=O)[O-])c3)N1c1ccc(C)cc1C2=O	ZINC000004709514	207040008	/nfs/dbraw/zinc/04/00/08/207040008.db2.gz	CDQFNTROYLTGGV-SFHVURJKSA-N	0	0	353.334	2.988	50	5		FFBARN
O=C(CN1C(=O)c2ccccc2C1=O)OCc1ccc([N+](=O)[O-])cc1Cl	ZINC000004832563	207053186	/nfs/dbraw/zinc/05/31/86/207053186.db2.gz	DIUKCHNZMBEDPM-UHFFFAOYSA-N	0	0	374.736	2.588	50	5		FFBARN
COc1ccc(-c2n[nH]c3c2[C@H](c2cccc([N+](=O)[O-])c2)NC3=O)cc1	ZINC000004929070	207064361	/nfs/dbraw/zinc/06/43/61/207064361.db2.gz	PISQTRPMTCIXLO-HNNXBMFYSA-N	0	0	350.334	2.826	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)/C=C/c1ccco1	ZINC000004966351	207065996	/nfs/dbraw/zinc/06/59/96/207065996.db2.gz	OPMXSIXCOQQFQO-LXSSAFMLSA-N	0	0	360.322	2.780	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCOc1ccccc1Cl	ZINC000004985907	207069139	/nfs/dbraw/zinc/06/91/39/207069139.db2.gz	PPBZMFYQCKJNPW-UHFFFAOYSA-N	0	0	370.814	2.914	50	5		FFBARN
Cc1ccc(Nc2nc(NC[C@@H]3CCCO3)nc(N)c2[N+](=O)[O-])cc1C	ZINC000005100914	207080648	/nfs/dbraw/zinc/08/06/48/207080648.db2.gz	CHQQAIWDGSVMBJ-ZDUSSCGKSA-N	0	0	358.402	2.918	50	5		FFBARN
O=C(COc1ccccc1F)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000005989320	207124912	/nfs/dbraw/zinc/12/49/12/207124912.db2.gz	HAHLRAVWBDFEDN-UHFFFAOYSA-N	0	0	373.296	2.906	50	5		FFBARN
COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007552551	207198993	/nfs/dbraw/zinc/19/89/93/207198993.db2.gz	GSDJUAQUOJHNFQ-CQSZACIVSA-N	0	0	365.773	2.924	50	5		FFBARN
O=C(/C=C/c1nc2ccccc2o1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000008146477	207220782	/nfs/dbraw/zinc/22/07/82/207220782.db2.gz	BWVRTCUZVFVTPV-MDZDMXLPSA-N	0	0	352.350	2.978	50	5		FFBARN
COCc1cccc(C(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])c1	ZINC000008881402	207250782	/nfs/dbraw/zinc/25/07/82/207250782.db2.gz	QANVGIFVEZIABW-UHFFFAOYSA-N	0	0	374.393	2.731	50	5		FFBARN
COc1cc(COc2ccccc2C(N)=O)c([N+](=O)[O-])cc1OC(F)F	ZINC000008924343	207252518	/nfs/dbraw/zinc/25/25/18/207252518.db2.gz	HDBCJAORBSQKMT-UHFFFAOYSA-N	0	0	368.292	2.883	50	5		FFBARN
COc1ccc2[nH]c(=O)c(COC(=O)c3ccc([N+](=O)[O-])cc3)cc2c1	ZINC000009191982	207261078	/nfs/dbraw/zinc/26/10/78/207261078.db2.gz	GBFHYNNHPASVEH-UHFFFAOYSA-N	0	0	354.318	2.802	50	5		FFBARN
CN(Cc1cnn(-c2ccccc2)c1)C(=O)c1ccc(N)c([N+](=O)[O-])c1	ZINC000009933295	207291319	/nfs/dbraw/zinc/29/13/19/207291319.db2.gz	PNLQTOLSIXPRRT-UHFFFAOYSA-N	0	0	351.366	2.635	50	5		FFBARN
O=C(CNc1ccc(F)c([N+](=O)[O-])c1)Nc1ccc(N2CCCC2=O)cc1	ZINC000011549554	207314739	/nfs/dbraw/zinc/31/47/39/207314739.db2.gz	GNXVVOGMXJYXAW-UHFFFAOYSA-N	0	0	372.356	2.911	50	5		FFBARN
NC(=O)c1ccc(NCc2ccc(Cn3cccn3)cc2)c([N+](=O)[O-])c1	ZINC000012537199	207388972	/nfs/dbraw/zinc/38/89/72/207388972.db2.gz	WPNPDBRGYXQDKP-UHFFFAOYSA-N	0	0	351.366	2.551	50	5		FFBARN
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCC(C(=O)N(C)C)CC1	ZINC000032753423	208039267	/nfs/dbraw/zinc/03/92/67/208039267.db2.gz	DUTXEASAYWFFQV-GFCCVEGCSA-N	0	0	373.413	2.506	50	5		FFBARN
O=C(OCc1cc(-c2ccco2)on1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000032745401	208039715	/nfs/dbraw/zinc/03/97/15/208039715.db2.gz	NKXCWGFMWTWWLZ-UHFFFAOYSA-N	0	0	358.262	2.929	50	5		FFBARN
C[C@@H](Nc1nc2ccccn2c1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000032806460	208045002	/nfs/dbraw/zinc/04/50/02/208045002.db2.gz	SEMGEDWIIVPNAR-LLVKDONJSA-N	0	0	360.395	2.819	50	5		FFBARN
CC1CCN(C(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000033004110	208064697	/nfs/dbraw/zinc/06/46/97/208064697.db2.gz	PWEZXKUDTRKLLP-UHFFFAOYSA-N	0	0	362.411	2.995	50	5		FFBARN
CCc1onc(C)c1[C@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000033087003	208070638	/nfs/dbraw/zinc/07/06/38/208070638.db2.gz	HVYRJNWHWJBWPB-CYBMUJFWSA-N	0	0	365.411	2.979	50	5		FFBARN
O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)NC[C@H]1COCCO1	ZINC000055846781	208487242	/nfs/dbraw/zinc/48/72/42/208487242.db2.gz	HVUQDSGJFLSYNO-CFNZNRNTSA-N	0	0	374.418	2.868	50	5		FFBARN
CCCO[C@@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C1	ZINC000065796127	208692653	/nfs/dbraw/zinc/69/26/53/208692653.db2.gz	WXCFWERRWNEPKU-OAHLLOKOSA-N	0	0	356.444	2.791	50	5		FFBARN
O=C(Nc1ccncc1I)c1cccc([N+](=O)[O-])c1	ZINC000095413744	209048901	/nfs/dbraw/zinc/04/89/01/209048901.db2.gz	FKRDMSNAZIKMFU-UHFFFAOYSA-N	0	0	369.118	2.847	50	5		FFBARN
C[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000095468376	209055942	/nfs/dbraw/zinc/05/59/42/209055942.db2.gz	BVGFCNDLPJIODT-UWVGGRQHSA-N	0	0	364.370	2.818	50	5		FFBARN
CCOC(=O)N1CCC(NC(=O)Nc2ccc([N+](=O)[O-])c(C)c2)CC1	ZINC000095951613	209089296	/nfs/dbraw/zinc/08/92/96/209089296.db2.gz	ORKYDSRJTINDQG-UHFFFAOYSA-N	0	0	350.375	2.646	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000001212399	506257297	/nfs/dbraw/zinc/25/72/97/506257297.db2.gz	KTEOIVMFGWSIHU-SWLSCSKDSA-N	0	0	371.315	2.777	50	5		FFBARN
COCCn1c2nc3ccccc3nc2c2c1ncn(CC(C)C)c2=O	ZINC000002253826	506276868	/nfs/dbraw/zinc/27/68/68/506276868.db2.gz	LHAZDHPKWRMBCD-UHFFFAOYSA-N	0	0	351.410	2.597	50	5		FFBARN
O=C(Nn1cnc2sc3c(c2c1=O)CCCC3)c1ccc([N+](=O)[O-])cc1	ZINC000002798623	506293516	/nfs/dbraw/zinc/29/35/16/506293516.db2.gz	MJVBBSCYWLIWIC-UHFFFAOYSA-N	0	0	370.390	2.629	50	5		FFBARN
CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1cccc([N+](=O)[O-])c1	ZINC000002796684	506293567	/nfs/dbraw/zinc/29/35/67/506293567.db2.gz	QBGKZUCPDFSNCC-UHFFFAOYSA-N	0	0	360.366	2.518	50	5		FFBARN
Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)NCc1ccc2c(c1)OCO2	ZINC000003377218	506325832	/nfs/dbraw/zinc/32/58/32/506325832.db2.gz	OJEQZILIMMNUFG-UHFFFAOYSA-N	0	0	357.366	2.669	50	5		FFBARN
COc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2)c([N+](=O)[O-])cc1OC	ZINC000003498244	506336842	/nfs/dbraw/zinc/33/68/42/506336842.db2.gz	KTXOOBZEARTEPT-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
COc1cccc(C2=N/C(=C/c3cc4c(cc3[N+](=O)[O-])OCO4)C(=O)O2)c1	ZINC000003532113	506340254	/nfs/dbraw/zinc/34/02/54/506340254.db2.gz	CIGATYVXCZUNCC-AWNIVKPZSA-N	0	0	368.301	2.677	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000004064412	506356823	/nfs/dbraw/zinc/35/68/23/506356823.db2.gz	HJLNZUCMDYEXBK-AWEZNQCLSA-N	0	0	365.411	2.519	50	5		FFBARN
O=C1OCC2=C1[C@@H](c1ccccc1[N+](=O)[O-])c1cc3c(cc1N2)OCO3	ZINC000004052198	506357565	/nfs/dbraw/zinc/35/75/65/506357565.db2.gz	HQXKDBWLBLPDJV-INIZCTEOSA-N	0	0	352.302	2.692	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCNc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000004689118	506388099	/nfs/dbraw/zinc/38/80/99/506388099.db2.gz	YQOORQKCMBVZMV-UHFFFAOYSA-N	0	0	369.830	2.947	50	5		FFBARN
Cc1ccc(F)c(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H](C)C2=O)c1	ZINC000037520274	506426405	/nfs/dbraw/zinc/42/64/05/506426405.db2.gz	IDLRRAQBYIWJBW-ZDUSSCGKSA-N	0	0	371.368	2.920	50	5		FFBARN
C[C@@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)c1ccc(F)cc1	ZINC000037522067	506427410	/nfs/dbraw/zinc/42/74/10/506427410.db2.gz	RMILMMJFRNEBFL-GFCCVEGCSA-N	0	0	357.341	2.611	50	5		FFBARN
O=C(COC(=O)CCC(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000005505780	506446526	/nfs/dbraw/zinc/44/65/26/506446526.db2.gz	VTYWFATYMHSFIX-UHFFFAOYSA-N	0	0	374.324	2.879	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000005578926	506450425	/nfs/dbraw/zinc/45/04/25/506450425.db2.gz	UAGGQZAJJINLDJ-UHFFFAOYSA-N	0	0	374.349	2.959	50	5		FFBARN
C[C@@H](Oc1ccccc1)C(=O)OCC(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000005961353	506462804	/nfs/dbraw/zinc/46/28/04/506462804.db2.gz	XEOHLWJFLCNVMI-LLVKDONJSA-N	0	0	362.313	2.683	50	5		FFBARN
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H](C)N1CCc2sccc2C1	ZINC000040074365	506463322	/nfs/dbraw/zinc/46/33/22/506463322.db2.gz	URCKYKZYHABBOJ-NSHDSACASA-N	0	0	360.439	2.536	50	5		FFBARN
O=[N+]([O-])c1cccc(NC(=S)N2CCN(c3cccc(O)c3)CC2)c1	ZINC000006402384	506481216	/nfs/dbraw/zinc/48/12/16/506481216.db2.gz	KVOGWAWHGDZIQV-UHFFFAOYSA-N	0	0	358.423	2.819	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])o2)CC1	ZINC000007752068	506587338	/nfs/dbraw/zinc/58/73/38/506587338.db2.gz	PJJDIEXJKRHFGV-SOFGYWHQSA-N	0	0	357.366	2.558	50	5		FFBARN
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(c2cnccn2)CC1	ZINC000010646002	506750094	/nfs/dbraw/zinc/75/00/94/506750094.db2.gz	KYSQGWAODBLQTN-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
CCN(CC)C(=O)COC(=O)Cn1c2ccccc2c(=O)c2ccccc21	ZINC000011276816	506770900	/nfs/dbraw/zinc/77/09/00/506770900.db2.gz	YVPXGARABZUGFP-UHFFFAOYSA-N	0	0	366.417	2.566	50	5		FFBARN
COCc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000044548990	506857028	/nfs/dbraw/zinc/85/70/28/506857028.db2.gz	DVMCAXJTIKJTOM-UHFFFAOYSA-N	0	0	371.393	2.830	50	5		FFBARN
COc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NCc3ccco3)n2)cc1	ZINC000012551584	506877874	/nfs/dbraw/zinc/87/78/74/506877874.db2.gz	AYOIYAVJZLBBFK-UHFFFAOYSA-N	0	0	356.342	2.924	50	5		FFBARN
Cc1c(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)c(=O)n(-c2ccccc2)n1C	ZINC000012624119	506885673	/nfs/dbraw/zinc/88/56/73/506885673.db2.gz	ASBKXIFBRMYLGP-CSKARUKUSA-N	0	0	368.349	2.638	50	5		FFBARN
Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000012795752	506903659	/nfs/dbraw/zinc/90/36/59/506903659.db2.gz	KHRGZXBEYNEPQK-IBGZPJMESA-N	0	0	369.421	2.707	50	5		FFBARN
C[C@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1	ZINC000012977936	506920098	/nfs/dbraw/zinc/92/00/98/506920098.db2.gz	KIWICBBSGCGUAZ-ZDUSSCGKSA-N	0	0	351.366	2.595	50	5		FFBARN
Cc1ccc(NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cc1[N+](=O)[O-]	ZINC000012997381	506923778	/nfs/dbraw/zinc/92/37/78/506923778.db2.gz	SLMHHYHDUAHTBT-UHFFFAOYSA-N	0	0	367.361	2.805	50	5		FFBARN
O=[N+]([O-])c1cc2n[nH]c(I)c2c(Br)c1	ZINC000014983671	507010159	/nfs/dbraw/zinc/01/01/59/507010159.db2.gz	HLNODHWVZMMHLW-UHFFFAOYSA-N	0	0	367.928	2.838	50	5		FFBARN
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@H]1c1ccc(OC)c([N+](=O)[O-])c1	ZINC000015016959	507011426	/nfs/dbraw/zinc/01/14/26/507011426.db2.gz	LEMRLNVKFMWNBS-HNNXBMFYSA-N	0	0	363.370	2.527	50	5		FFBARN
O=C(NCCNc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCCO2	ZINC000015139230	507021986	/nfs/dbraw/zinc/02/19/86/507021986.db2.gz	FMMPLSRFYYQQQQ-UHFFFAOYSA-N	0	0	357.366	2.598	50	5		FFBARN
C[C@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1	ZINC000067892946	507043365	/nfs/dbraw/zinc/04/33/65/507043365.db2.gz	XZLZALHDVCQLTG-SUMWQHHRSA-N	0	0	369.377	2.522	50	5		FFBARN
Cc1cc(C)cc(OCC(=O)N2CCN(c3ccccc3[N+](=O)[O-])CC2)c1	ZINC000018077794	507136431	/nfs/dbraw/zinc/13/64/31/507136431.db2.gz	QTZLBEWLGHYRRB-UHFFFAOYSA-N	0	0	369.421	2.939	50	5		FFBARN
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000018100082	507137606	/nfs/dbraw/zinc/13/76/06/507137606.db2.gz	ZSXZOOQHTYPIID-UHFFFAOYSA-N	0	0	372.768	2.757	50	5		FFBARN
Cc1ccc(NC(=O)CCCN2C(=O)[C@H]3CC=CC[C@@H]3C2=O)c([N+](=O)[O-])c1	ZINC000018227918	507146392	/nfs/dbraw/zinc/14/63/92/507146392.db2.gz	UZPLMHHJQJRWAR-KBPBESRZSA-N	0	0	371.393	2.573	50	5		FFBARN
CCCCCn1cc2c(c1-c1cccc([N+](=O)[O-])c1)c(=O)n(C)c(=O)n2C	ZINC000020443233	507221890	/nfs/dbraw/zinc/22/18/90/507221890.db2.gz	PHKVBVHZIYALEC-UHFFFAOYSA-N	0	0	370.409	2.804	50	5		FFBARN
COC(=O)c1ccccc1N(C)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000022197351	507282446	/nfs/dbraw/zinc/28/24/46/507282446.db2.gz	ADYPLLJQUBIFBQ-UHFFFAOYSA-N	0	0	364.379	2.515	50	5		FFBARN
COc1cc2c(cc1OC)[C@H](c1cc(OC)c(OC)cc1[N+](=O)[O-])NCC2	ZINC000022204804	507282718	/nfs/dbraw/zinc/28/27/18/507282718.db2.gz	BPZRORNUZRKVSV-LJQANCHMSA-N	0	0	374.393	2.864	50	5		FFBARN
O=C(CN1C(=O)CSc2ccccc21)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000022870027	507317215	/nfs/dbraw/zinc/31/72/15/507317215.db2.gz	PVWBCZVTYQABDC-UHFFFAOYSA-N	0	0	361.354	2.811	50	5		FFBARN
Cc1nn2c(SCC(=O)c3ccccc3)nc3ccccc3c2nc1=O	ZINC000058159426	507375957	/nfs/dbraw/zinc/37/59/57/507375957.db2.gz	PWRCOYMRXGDBQT-UHFFFAOYSA-N	0	0	362.414	2.921	50	5		FFBARN
COc1ccc(C(=O)NCCc2ccn(-c3ccccc3)n2)cc1[N+](=O)[O-]	ZINC000058209249	507385086	/nfs/dbraw/zinc/38/50/86/507385086.db2.gz	LSBVIEJICQRZQF-UHFFFAOYSA-N	0	0	366.377	2.762	50	5		FFBARN
CCc1cc2c(ncnc2N[C@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000024060898	507389928	/nfs/dbraw/zinc/38/99/28/507389928.db2.gz	AQQIGBDKEACOEU-CABCVRRESA-N	0	0	374.422	2.668	50	5		FFBARN
O=C(NCCOc1ccc(F)cc1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000024745901	507435700	/nfs/dbraw/zinc/43/57/00/507435700.db2.gz	VBGCZUKUBFDDPS-UHFFFAOYSA-N	0	0	370.340	2.728	50	5		FFBARN
C[C@H]1CCC[C@H](C)N1C(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000024796423	507438221	/nfs/dbraw/zinc/43/82/21/507438221.db2.gz	ZIKRIZPVJWAUGF-HOTGVXAUSA-N	0	0	360.458	2.506	50	5		FFBARN
CCCCn1nc(C(=O)N(C)[C@H](C)c2cccc([N+](=O)[O-])c2)ccc1=O	ZINC000025831297	507538247	/nfs/dbraw/zinc/53/82/47/507538247.db2.gz	HLFNWRZLTRQOSG-CYBMUJFWSA-N	0	0	358.398	2.785	50	5		FFBARN
CCC(=O)N(C)c1ccccc1C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000072306901	507774170	/nfs/dbraw/zinc/77/41/70/507774170.db2.gz	XNEJZMOHURYVKP-UHFFFAOYSA-N	0	0	370.409	2.810	50	5		FFBARN
NS(=O)(=O)c1ccc(N2CCC[C@H]2c2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000052510581	507811379	/nfs/dbraw/zinc/81/13/79/507811379.db2.gz	WQHUMCQYBVNQAV-AWEZNQCLSA-N	0	0	365.386	2.723	50	5		FFBARN
O=C(Nc1cc(Oc2ccc([N+](=O)[O-])cc2F)ccn1)N1CCOCC1	ZINC000091294577	507979225	/nfs/dbraw/zinc/97/92/25/507979225.db2.gz	PXCLOBPSDSYDFW-UHFFFAOYSA-N	0	0	362.317	2.785	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccccc3Cl)[C@@H]2C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000103539526	508317572	/nfs/dbraw/zinc/31/75/72/508317572.db2.gz	VFNIMOBWDOSCKR-DZGCQCFKSA-N	0	0	371.736	2.541	50	5		FFBARN
Cc1ccc(S(=O)(=O)Nc2cccc(C(C)(C)O)c2)cc1[N+](=O)[O-]	ZINC000170610527	509678764	/nfs/dbraw/zinc/67/87/64/509678764.db2.gz	WLNDMAMQKWRRIZ-UHFFFAOYSA-N	0	0	350.396	2.931	50	5		FFBARN
O=C1[C@@H](Oc2cccnc2[N+](=O)[O-])CCN1c1ccccc1OC(F)F	ZINC000115964065	570927164	/nfs/dbraw/zinc/92/71/64/570927164.db2.gz	MOSBZOPBYFCDTP-ZDUSSCGKSA-N	0	0	365.292	2.776	50	5		FFBARN
COc1ccc(CNC(=O)/C=C\c2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000096911695	964152830	/nfs/dbraw/zinc/15/28/30/964152830.db2.gz	REMYQMHZBPZZSC-DAXSKMNVSA-N	0	0	370.361	2.800	50	5		FFBARN
Cc1ccc(S(=O)(=O)CCC(=O)OCc2ccc([N+](=O)[O-])cc2)cc1	ZINC000001135921	219378471	/nfs/dbraw/zinc/37/84/71/219378471.db2.gz	ZKZAUNYGRBWOLG-UHFFFAOYSA-N	0	0	363.391	2.810	50	5		FFBARN
CC(=O)Nc1ccc(Nc2ccc(N3C(=O)CCC3=O)cc2[N+](=O)[O-])cc1	ZINC000004684405	219595671	/nfs/dbraw/zinc/59/56/71/219595671.db2.gz	JOAJOIOLIJZVPP-UHFFFAOYSA-N	0	0	368.349	2.950	50	5		FFBARN
C[C@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000007338976	219801242	/nfs/dbraw/zinc/80/12/42/219801242.db2.gz	PGHPDQLKGAWVOK-LBPRGKRZSA-N	0	0	360.341	2.938	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)Nc1ccc(C)cc1F	ZINC000008705086	209473351	/nfs/dbraw/zinc/47/33/51/209473351.db2.gz	CRGBSPIWQNJEKF-UHFFFAOYSA-N	0	0	361.329	2.880	50	5		FFBARN
O=C(Cn1nc(-c2cccs2)ccc1=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000005388127	209438841	/nfs/dbraw/zinc/43/88/41/209438841.db2.gz	HNLHREZAIBJXRB-UHFFFAOYSA-N	0	0	374.353	2.658	50	5		FFBARN
CC(C)(C)n1nc2c(c1NC(=O)c1cccc([N+](=O)[O-])c1)C[S@](=O)C2	ZINC000004106099	209414616	/nfs/dbraw/zinc/41/46/16/209414616.db2.gz	RMPIYPDSERDBCR-RUZDIDTESA-N	0	0	362.411	2.561	50	5		FFBARN
COc1cccc2c3nc(-c4cccc([N+](=O)[O-])c4)nc(N)c3c(=O)oc12	ZINC000226761737	209368678	/nfs/dbraw/zinc/36/86/78/209368678.db2.gz	BNZBNUMXIXPJNQ-UHFFFAOYSA-N	0	0	364.317	2.902	50	5		FFBARN
Cc1ccccc1OCCN(C)S(=O)(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000045798702	209328656	/nfs/dbraw/zinc/32/86/56/209328656.db2.gz	BGDHDIQTXGKLRM-UHFFFAOYSA-N	0	0	364.423	2.744	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCN1C(=O)[C@@H]2CC=CC[C@H]2C1=O	ZINC000102547699	209236958	/nfs/dbraw/zinc/23/69/58/209236958.db2.gz	VDQCPZZGQXMZHZ-HUUCEWRRSA-N	0	0	371.393	2.573	50	5		FFBARN
COc1ccccc1C([O-])=CC(=O)C(=O)Nc1ccc([N+](=O)[O-])cc1C	ZINC000101354831	209224360	/nfs/dbraw/zinc/22/43/60/209224360.db2.gz	ZBFVZWBYKCNNSJ-UHFFFAOYSA-N	0	0	356.334	2.692	50	5		FFBARN
COc1ccc(C(=O)Nc2ccccc2N2CCCC2=O)cc1[N+](=O)[O-]	ZINC000016105454	220178976	/nfs/dbraw/zinc/17/89/76/220178976.db2.gz	VUWMETXGUJZDBB-UHFFFAOYSA-N	0	0	355.350	2.983	50	5		FFBARN
O=C1OC(c2ccc([N+](=O)[O-])cc2)=NC1=CNc1ccc2c(c1)OCCO2	ZINC000002946304	206947495	/nfs/dbraw/zinc/94/74/95/206947495.db2.gz	QMTKERSZEZFWHR-GXDHUFHOSA-N	0	0	367.317	2.623	50	5		FFBARN
CCCn1c(C)cc(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1C	ZINC000003602259	206986508	/nfs/dbraw/zinc/98/65/08/206986508.db2.gz	IJCFHAPADXKNIU-UHFFFAOYSA-N	0	0	369.377	2.902	50	5		FFBARN
CN(C)c1c([N+](=O)[O-])cc(C(=O)OCC(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000004181266	207006537	/nfs/dbraw/zinc/00/65/37/207006537.db2.gz	WALCWFDTDZUOGM-UHFFFAOYSA-N	0	0	373.321	2.609	50	5		FFBARN
Cn1cc([N+](=O)[O-])c(C(=O)Nc2ccn(C34CC5CC(CC(C5)C3)C4)n2)n1	ZINC000004652168	207033560	/nfs/dbraw/zinc/03/35/60/207033560.db2.gz	DSDQUPWQEWGEMI-UHFFFAOYSA-N	0	0	370.413	2.702	50	5		FFBARN
Cc1c(Cl)c([N+](=O)[O-])nn1CC(=O)NC12CC3CC(CC(C3)C1)C2	ZINC000004627769	207033656	/nfs/dbraw/zinc/03/36/56/207033656.db2.gz	CCHBHCRFIQTQIN-UHFFFAOYSA-N	0	0	352.822	2.838	50	5		FFBARN
CCCCOC(=O)C1C(C)=Nc2ncnn2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000004598016	207030442	/nfs/dbraw/zinc/03/04/42/207030442.db2.gz	XXRODLHIWLMQOX-OAHLLOKOSA-N	0	0	357.370	2.819	50	5		FFBARN
C[C@H](CCc1ccccc1)Nc1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-]	ZINC000004807395	207050027	/nfs/dbraw/zinc/05/00/27/207050027.db2.gz	UEVHHEURSMYBKQ-CQSZACIVSA-N	0	0	353.382	2.847	50	5		FFBARN
O=C(COC(=O)CCC(=O)c1cccs1)Nc1ccccc1[N+](=O)[O-]	ZINC000004979510	207067867	/nfs/dbraw/zinc/06/78/67/207067867.db2.gz	AATGUDIHSLEHQR-UHFFFAOYSA-N	0	0	362.363	2.801	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@H](C)Oc2ccc(C)nc2[N+](=O)[O-])cc1	ZINC000004891460	207059030	/nfs/dbraw/zinc/05/90/30/207059030.db2.gz	KOLWWWLZFVVBFF-NSHDSACASA-N	0	0	358.354	2.663	50	5		FFBARN
Cc1ccc(N2C(=O)C[C@@]3(CC(c4cccc([N+](=O)[O-])c4)=NO3)C2=O)cc1	ZINC000005053153	207076736	/nfs/dbraw/zinc/07/67/36/207076736.db2.gz	IFOQFYBTRATCGS-IBGZPJMESA-N	0	0	365.345	2.730	50	5		FFBARN
O=C(COC(=O)c1ccco1)Nc1ccc([N+](=O)[O-])cc1Br	ZINC000005560631	207106693	/nfs/dbraw/zinc/10/66/93/207106693.db2.gz	LLRBWJPWOFPYCO-UHFFFAOYSA-N	0	0	369.127	2.746	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ccc(-c2nnco2)cc1	ZINC000006601778	207148487	/nfs/dbraw/zinc/14/84/87/207148487.db2.gz	OSSSXAHXWUXOPZ-UHFFFAOYSA-N	0	0	370.321	2.671	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000007169326	207189890	/nfs/dbraw/zinc/18/98/90/207189890.db2.gz	BEVQSYZHIPLEDZ-GFCCVEGCSA-N	0	0	355.350	2.738	50	5		FFBARN
COc1ccc(-c2noc(COc3ccc(C)nc3[N+](=O)[O-])n2)cc1OC	ZINC000007180755	207190307	/nfs/dbraw/zinc/19/03/07/207190307.db2.gz	XMUYNEYQXKJAOB-UHFFFAOYSA-N	0	0	372.337	2.944	50	5		FFBARN
C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1ccc(F)cc1F	ZINC000007206848	207190714	/nfs/dbraw/zinc/19/07/14/207190714.db2.gz	ROIBIMQEYMNOSD-QMMMGPOBSA-N	0	0	365.292	2.639	50	5		FFBARN
O=C(Cn1c(=O)cnc2ccccc21)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000007718652	207203205	/nfs/dbraw/zinc/20/32/05/207203205.db2.gz	PNPJDWOSXXMPMT-UHFFFAOYSA-N	0	0	358.741	2.597	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)NCCCn1cnc2ccccc21	ZINC000008174632	207222118	/nfs/dbraw/zinc/22/21/18/207222118.db2.gz	QDQNJVNQDGUTBV-UHFFFAOYSA-N	0	0	354.366	2.773	50	5		FFBARN
COc1ccc(NC(=O)C2CCN(C(=O)c3ccco3)CC2)c([N+](=O)[O-])c1	ZINC000008246464	207225118	/nfs/dbraw/zinc/22/51/18/207225118.db2.gz	HLIYTBXGEADWIB-UHFFFAOYSA-N	0	0	373.365	2.687	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)CC2=O)cc1	ZINC000008473885	207233928	/nfs/dbraw/zinc/23/39/28/207233928.db2.gz	GHARDRZHASZXPZ-LLVKDONJSA-N	0	0	373.340	2.734	50	5		FFBARN
COc1ccc(Nc2nc(=NN)nc(Nc3ccc([N+](=O)[O-])cc3)[nH]2)cc1	ZINC000009310371	207264317	/nfs/dbraw/zinc/26/43/17/207264317.db2.gz	RPHUTFTWAGOKED-UHFFFAOYSA-N	0	0	368.357	2.561	50	5		FFBARN
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(Cc2cccc(F)c2F)C1=O	ZINC000009048853	207255596	/nfs/dbraw/zinc/25/55/96/207255596.db2.gz	SSQFDXHYPYGAIE-KRWDZBQOSA-N	0	0	361.304	2.840	50	5		FFBARN
CCN(CC)[C@H](C(=O)NC1CCCC1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000036644157	207285967	/nfs/dbraw/zinc/28/59/67/207285967.db2.gz	LTSSQRZCUMEKCX-KRWDZBQOSA-N	0	0	363.414	2.765	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)c1	ZINC000010347082	207298917	/nfs/dbraw/zinc/29/89/17/207298917.db2.gz	QMTNAUSIWNTCGC-UHFFFAOYSA-N	0	0	369.377	2.813	50	5		FFBARN
O=C(COc1ccc2[nH]c3ccccc3c(=O)c2c1)NCC(F)(F)F	ZINC000012522164	207384618	/nfs/dbraw/zinc/38/46/18/207384618.db2.gz	XBFICMQHHUQWFZ-UHFFFAOYSA-N	0	0	350.296	2.739	50	5		FFBARN
Cc1nc(NC(=O)COc2ccccc2[N+](=O)[O-])sc1-c1nccn1C	ZINC000012574313	207395332	/nfs/dbraw/zinc/39/53/32/207395332.db2.gz	KAQGZYWXIQGQTF-UHFFFAOYSA-N	0	0	373.394	2.778	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCOc1ccccc1Cl	ZINC000030835729	208006459	/nfs/dbraw/zinc/00/64/59/208006459.db2.gz	OFLFGIJIFAUNIP-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
O=c1c2cc3c(ccn(CCC4=CCCCC4)c3=O)nc2ccn1CCO	ZINC000036358000	208156910	/nfs/dbraw/zinc/15/69/10/208156910.db2.gz	MUICOWRJPGNGBM-UHFFFAOYSA-N	0	0	365.433	2.594	50	5		FFBARN
CC(=O)NCCc1ccc(C(=O)COc2ccc(C)cc2[N+](=O)[O-])cc1F	ZINC000040116506	208229655	/nfs/dbraw/zinc/22/96/55/208229655.db2.gz	GQNACLDEDDOZKE-UHFFFAOYSA-N	0	0	374.368	2.983	50	5		FFBARN
Cc1c(F)cc(C(=O)NCc2ccc(-n3cccn3)nc2)cc1[N+](=O)[O-]	ZINC000040141753	208233126	/nfs/dbraw/zinc/23/31/26/208233126.db2.gz	UBOMIJIQLHBOFS-UHFFFAOYSA-N	0	0	355.329	2.553	50	5		FFBARN
O=C1N[C@@]2(CCCc3ccccc32)C(=O)N1Cc1ccccc1[N+](=O)[O-]	ZINC000041093885	208280059	/nfs/dbraw/zinc/28/00/59/208280059.db2.gz	BOIRDIKIVIBIMK-LJQANCHMSA-N	0	0	351.362	2.878	50	5		FFBARN
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2cccc(F)c2)C1=O	ZINC000041702209	208286872	/nfs/dbraw/zinc/28/68/72/208286872.db2.gz	AGQOARXMSCEVGG-SFHVURJKSA-N	0	0	373.340	2.580	50	5		FFBARN
C[C@@]1(c2ccc(F)cc2)NC(=O)N(CCOc2ccccc2[N+](=O)[O-])C1=O	ZINC000047354399	208378700	/nfs/dbraw/zinc/37/87/00/208378700.db2.gz	XBVLTOJKLXIWIW-SFHVURJKSA-N	0	0	373.340	2.580	50	5		FFBARN
COc1cc(C(=O)N2CCN(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000000851734	132379032	/nfs/dbraw/zinc/37/90/32/132379032.db2.gz	KWBGMKHJLMAMSJ-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
O=[N+]([O-])c1cccc(-c2csc(N3CCN(c4ncccn4)CC3)n2)c1	ZINC000001058996	132379875	/nfs/dbraw/zinc/37/98/75/132379875.db2.gz	VEFTUWLYPMSCLG-UHFFFAOYSA-N	0	0	368.422	2.835	50	5		FFBARN
Cc1ccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C	ZINC000003904048	132385933	/nfs/dbraw/zinc/38/59/33/132385933.db2.gz	ALRYDYJOMIQSLN-UHFFFAOYSA-N	0	0	369.421	2.939	50	5		FFBARN
COc1ccccc1Nc1cc(N2CCOCC2)c2nonc2c1[N+](=O)[O-]	ZINC000004949459	132825465	/nfs/dbraw/zinc/82/54/65/132825465.db2.gz	SAOLVHFXHTZATP-UHFFFAOYSA-N	0	0	371.353	2.720	50	5		FFBARN
Cc1cccc(N2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])CC2)c1C	ZINC000005864867	132830470	/nfs/dbraw/zinc/83/04/70/132830470.db2.gz	XQRTYHLKGXFQTJ-UHFFFAOYSA-N	0	0	354.410	2.637	50	5		FFBARN
CCN(CC(=O)Nc1ccc(OC)cc1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000003449507	263329450	/nfs/dbraw/zinc/32/94/50/263329450.db2.gz	PQIGQVIRSYHTJH-UHFFFAOYSA-N	0	0	357.366	2.704	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NCc1ccccn1)c1ccc([N+](=O)[O-])o1	ZINC000001042569	506245848	/nfs/dbraw/zinc/24/58/48/506245848.db2.gz	LKYUPGWOYAPWCX-UHFFFAOYSA-N	0	0	366.333	2.765	50	5		FFBARN
CCC(=O)c1ccc(OCC(=O)NCc2ccc(OC)c([N+](=O)[O-])c2)cc1	ZINC000001108324	506249871	/nfs/dbraw/zinc/24/98/71/506249871.db2.gz	HIZNRSQOEPZWME-UHFFFAOYSA-N	0	0	372.377	2.891	50	5		FFBARN
Cc1cc(CNC(=O)CCCn2cc([N+](=O)[O-])cn2)c2ccccc2n1	ZINC000001423682	506262913	/nfs/dbraw/zinc/26/29/13/506262913.db2.gz	LIYCXVSEIDQQGY-UHFFFAOYSA-N	0	0	353.382	2.745	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N[C@@H](C)c1ccccc1	ZINC000001506575	506264238	/nfs/dbraw/zinc/26/42/38/506264238.db2.gz	HMJWKQGTDWANCX-VIFPVBQESA-N	0	0	367.203	2.740	50	5		FFBARN
COc1ccc(S(=O)(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1OC	ZINC000002158377	506274113	/nfs/dbraw/zinc/27/41/13/506274113.db2.gz	NVFXMHZOYXAVSF-UHFFFAOYSA-N	0	0	353.352	2.688	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCn1ncc(=O)c2ccccc21	ZINC000052930868	506281413	/nfs/dbraw/zinc/28/14/13/506281413.db2.gz	KCHVSGZJVOBSSL-UHFFFAOYSA-N	0	0	352.350	2.642	50	5		FFBARN
Cc1nn(CC(=O)Nc2ccc(Br)cc2F)c(C)c1[N+](=O)[O-]	ZINC000002764055	506291769	/nfs/dbraw/zinc/29/17/69/506291769.db2.gz	MEDBMMQHRHQURG-UHFFFAOYSA-N	0	0	371.166	2.948	50	5		FFBARN
O=C(Nc1ccc(Cl)cc1F)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002797049	506293476	/nfs/dbraw/zinc/29/34/76/506293476.db2.gz	YWNHZKZWFUWDKP-UHFFFAOYSA-N	0	0	364.724	2.538	50	5		FFBARN
Cc1ccc(SCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000002985727	506305977	/nfs/dbraw/zinc/30/59/77/506305977.db2.gz	ZJKRXGWDDPTCDP-UHFFFAOYSA-N	0	0	352.437	2.974	50	5		FFBARN
CCOc1ncccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003228340	506312672	/nfs/dbraw/zinc/31/26/72/506312672.db2.gz	RMTDLVVUIHXREV-NSHDSACASA-N	0	0	359.338	2.573	50	5		FFBARN
O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)c(F)c(F)c1F	ZINC000003229511	506313803	/nfs/dbraw/zinc/31/38/03/506313803.db2.gz	XBWYOBHOTFCWME-LLVKDONJSA-N	0	0	358.247	2.615	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Sc1nnc2ccccn21	ZINC000003496138	506336319	/nfs/dbraw/zinc/33/63/19/506336319.db2.gz	WZLIPQCLVGWGPE-SNVBAGLBSA-N	0	0	373.394	2.765	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccnc1Cl	ZINC000003523761	506339702	/nfs/dbraw/zinc/33/97/02/506339702.db2.gz	LDHXJGZTHQXWAH-UHFFFAOYSA-N	0	0	350.714	2.867	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)Nc1cc2c(cc1Cl)NC(=O)CO2	ZINC000033193867	506345530	/nfs/dbraw/zinc/34/55/30/506345530.db2.gz	MXYRAUIFASHGLA-UHFFFAOYSA-N	0	0	361.741	2.760	50	5		FFBARN
CCN(CC)C(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccco1	ZINC000004093767	506358726	/nfs/dbraw/zinc/35/87/26/506358726.db2.gz	UYHOGSQJHNHBLA-QINSGFPZSA-N	0	0	357.366	2.827	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3cccc(F)c3)CC2)ccc1[N+](=O)[O-]	ZINC000004688247	506388059	/nfs/dbraw/zinc/38/80/59/506388059.db2.gz	WSWKJLMURBZLCA-UHFFFAOYSA-N	0	0	358.373	2.738	50	5		FFBARN
C[C@]1(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(Cl)Cl	ZINC000004740707	506392049	/nfs/dbraw/zinc/39/20/49/506392049.db2.gz	SMRWYZIJENJMEY-CQSZACIVSA-N	0	0	358.225	2.827	50	5		FFBARN
COc1ccc(OC)c(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)c1	ZINC000005550087	506448434	/nfs/dbraw/zinc/44/84/34/506448434.db2.gz	AFGVXSQAYKERLY-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000008816107	506670886	/nfs/dbraw/zinc/67/08/86/506670886.db2.gz	CDAXJNZGDXIOSF-LLVKDONJSA-N	0	0	373.340	2.734	50	5		FFBARN
O=C(NC[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc([N+](=O)[O-])o1	ZINC000008985013	506676129	/nfs/dbraw/zinc/67/61/29/506676129.db2.gz	UNUCUPKQIRPWIE-JTQLQIEISA-N	0	0	363.757	2.624	50	5		FFBARN
O=C(NCc1ccccc1Cl)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000010326845	506737948	/nfs/dbraw/zinc/73/79/48/506737948.db2.gz	FFJLWOFJYXEQGL-UHFFFAOYSA-N	0	0	351.721	2.642	50	5		FFBARN
COC(=O)COc1ccc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)c(C)c1	ZINC000055906990	506883458	/nfs/dbraw/zinc/88/34/58/506883458.db2.gz	PHDVXQPBGLOWMG-UHFFFAOYSA-N	0	0	374.349	2.716	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2ccccc2[N+](=O)[O-])c1C	ZINC000012823377	506908039	/nfs/dbraw/zinc/90/80/39/506908039.db2.gz	CWGNRTLCBCLREE-NSHDSACASA-N	0	0	374.349	2.755	50	5		FFBARN
Cc1c(NC(=O)CN2C(=O)CC3(CCCCC3)C2=O)cccc1[N+](=O)[O-]	ZINC000012910693	506913032	/nfs/dbraw/zinc/91/30/32/506913032.db2.gz	OHMXNGCGPMYTGD-UHFFFAOYSA-N	0	0	359.382	2.551	50	5		FFBARN
O=C(NC(=O)C1CCN(c2ncccc2[N+](=O)[O-])CC1)Nc1ccccc1	ZINC000020421215	507220437	/nfs/dbraw/zinc/22/04/37/507220437.db2.gz	JYVBBUSBFMDFHL-UHFFFAOYSA-N	0	0	369.381	2.555	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC([C@H](O)c2ccccc2)CC1	ZINC000023383566	507349866	/nfs/dbraw/zinc/34/98/66/507349866.db2.gz	NDRGXZWSFMQCIJ-HXUWFJFHSA-N	0	0	370.405	2.946	50	5		FFBARN
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)OC1CCCCCCC1	ZINC000058049176	507367643	/nfs/dbraw/zinc/36/76/43/507367643.db2.gz	ROMBXDMIASRLLG-UHFFFAOYSA-N	0	0	362.382	2.976	50	5		FFBARN
O=C(NCc1ccccc1CN1CCOCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000024237475	507400312	/nfs/dbraw/zinc/40/03/12/507400312.db2.gz	BNMRWXWFPDDOSM-UHFFFAOYSA-N	0	0	370.409	2.749	50	5		FFBARN
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCc1ccccn1	ZINC000024490855	507415879	/nfs/dbraw/zinc/41/58/79/507415879.db2.gz	KJUXIQCHEAFWDG-UHFFFAOYSA-N	0	0	357.413	2.909	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCN(Cc2cccnc2)CC1	ZINC000024601704	507423126	/nfs/dbraw/zinc/42/31/26/507423126.db2.gz	VVGVNDHITMHXPE-UHFFFAOYSA-N	0	0	360.801	2.601	50	5		FFBARN
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1ncc(Cl)c(Cl)c1=O	ZINC000024655127	507427397	/nfs/dbraw/zinc/42/73/97/507427397.db2.gz	BTZRAULSENGBBY-QMMMGPOBSA-N	0	0	355.181	2.867	50	5		FFBARN
CCSc1nc2c(n1C)CCN(C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000071414407	507701644	/nfs/dbraw/zinc/70/16/44/507701644.db2.gz	AXECXEOFBIOYBP-MRXNPFEDSA-N	0	0	362.455	2.532	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCO2)c1cn(Cc2ccc([N+](=O)[O-])cc2)cn1	ZINC000071775249	507716632	/nfs/dbraw/zinc/71/66/32/507716632.db2.gz	ZBOGZWPHCBMDNR-UHFFFAOYSA-N	0	0	366.333	2.821	50	5		FFBARN
CCOc1ccc(C(=O)N(CC(=O)OC)c2ccccc2)cc1[N+](=O)[O-]	ZINC000072290120	507772846	/nfs/dbraw/zinc/77/28/46/507772846.db2.gz	WYUSKNVRFXGNIO-UHFFFAOYSA-N	0	0	358.350	2.813	50	5		FFBARN
CS(=O)(=O)c1ccc(SC[C@@H](O)c2ccccc2)c([N+](=O)[O-])c1	ZINC000052427078	507808827	/nfs/dbraw/zinc/80/88/27/507808827.db2.gz	YYNSPUXYKXKGGB-CQSZACIVSA-N	0	0	353.421	2.824	50	5		FFBARN
O=c1nc2c3cc(Br)ccc3nnn2nc1-c1ccc(F)cc1	ZINC000089793796	507866968	/nfs/dbraw/zinc/86/69/68/507866968.db2.gz	INAHLQYVDZRCCM-UHFFFAOYSA-N	0	0	372.157	2.601	50	5		FFBARN
CCOC(=O)N1CCC[C@@H](C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000079056849	507928826	/nfs/dbraw/zinc/92/88/26/507928826.db2.gz	VYAWIPTUEBVYCZ-CYBMUJFWSA-N	0	0	372.381	2.950	50	5		FFBARN
CCOC(=O)N1CCC[C@H](C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)C1	ZINC000079056843	507928929	/nfs/dbraw/zinc/92/89/29/507928929.db2.gz	VYAWIPTUEBVYCZ-ZDUSSCGKSA-N	0	0	372.381	2.950	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C2=NNC(=O)CC2)cc1	ZINC000075094418	508082244	/nfs/dbraw/zinc/08/22/44/508082244.db2.gz	GGWAUFHKJWVAHA-UHFFFAOYSA-N	0	0	352.350	2.770	50	5		FFBARN
C[C@@]1(CCc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000075106854	508083167	/nfs/dbraw/zinc/08/31/67/508083167.db2.gz	BNNMYMDISSKILM-LJQANCHMSA-N	0	0	354.410	2.938	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccc(Cl)cc1	ZINC000103608102	508319146	/nfs/dbraw/zinc/31/91/46/508319146.db2.gz	TXQJNUPPOMOQKK-DZGCQCFKSA-N	0	0	371.736	2.541	50	5		FFBARN
CCCN(C[C@@H]1CCCCO1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000170622699	509683489	/nfs/dbraw/zinc/68/34/89/509683489.db2.gz	XRYHNSRIHUJKSL-HNNXBMFYSA-N	0	0	356.444	2.873	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(N2C[C@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1	ZINC000170664053	509707777	/nfs/dbraw/zinc/70/77/77/509707777.db2.gz	AKLMTCGIMJQNNS-VQTJNVASSA-N	0	0	369.421	2.693	50	5		FFBARN
Cn1c(=N)n(CC(=O)c2ccc(F)cc2)cc1-c1cccc([N+](=O)[O-])c1	ZINC000334157490	511466769	/nfs/dbraw/zinc/46/67/69/511466769.db2.gz	BNNHCHUVAXGRBK-UHFFFAOYSA-N	0	0	354.341	2.903	50	5		FFBARN
CN(C)C1=N[C@@H]2Nc3ccccc3N(C)[C@@H]2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000239174410	524037970	/nfs/dbraw/zinc/03/79/70/524037970.db2.gz	PZFWIEROOQOKSF-KURKYZTESA-N	0	0	351.410	2.909	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1c2ccccc2[C@H](C(N)=O)C[C@H]1C	ZINC000058424539	536951640	/nfs/dbraw/zinc/95/16/40/536951640.db2.gz	BDHYBMIDMIUTTA-MLGOLLRUSA-N	0	0	355.394	2.971	50	5		FFBARN
COc1ccc(N2C(=O)C[C@H](Nc3cc(C)ccc3C)C2=O)c([N+](=O)[O-])c1	ZINC000102229212	570829760	/nfs/dbraw/zinc/82/97/60/570829760.db2.gz	XEDUUWVZSSPUND-HNNXBMFYSA-N	0	0	369.377	2.964	50	5		FFBARN
Cc1noc(C)c1CN1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000047254157	570883934	/nfs/dbraw/zinc/88/39/34/570883934.db2.gz	MFPDSDGXZDZHKU-BQYQJAHWSA-N	0	0	370.409	2.557	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1-c1ccc(C(=O)NCCCN2CCOCC2)o1	ZINC000022145908	961871966	/nfs/dbraw/zinc/87/19/66/961871966.db2.gz	ZPEDNVBFBBLLQD-UHFFFAOYSA-N	0	0	373.409	2.615	50	5		FFBARN
COc1cc(/C=C\C(=O)NC[C@@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F	ZINC000096942911	1012484087	/nfs/dbraw/zinc/48/40/87/1012484087.db2.gz	TZXOEWRVZNDTDO-WYGGZMRJSA-N	0	0	372.324	2.513	50	5		FFBARN
CC(=O)c1cccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000005966174	219707053	/nfs/dbraw/zinc/70/70/53/219707053.db2.gz	GRABYAQRBLXOLY-LBPRGKRZSA-N	0	0	356.334	2.981	50	5		FFBARN
COc1ccccc1N(CN1CCCC1=O)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000004137975	209415822	/nfs/dbraw/zinc/41/58/22/209415822.db2.gz	IYAKFHLYYVLQOL-UHFFFAOYSA-N	0	0	369.377	2.830	50	5		FFBARN
O=C(OCc1ccccc1)[C@@H]1CCCN1C(=O)c1ccccc1[N+](=O)[O-]	ZINC000002869308	209399719	/nfs/dbraw/zinc/39/97/19/209399719.db2.gz	ASVJIMXEODKJGS-KRWDZBQOSA-N	0	0	354.362	2.943	50	5		FFBARN
CC[C@H]1CCCCN1C(=O)Cn1nc([N+](=O)[O-])c(Br)c1C	ZINC000000756435	209375730	/nfs/dbraw/zinc/37/57/30/209375730.db2.gz	VMSZQHJEPVIJKC-JTQLQIEISA-N	0	0	359.224	2.653	50	5		FFBARN
Cc1cccc(OCCNS(=O)(=O)c2c(C)cccc2[N+](=O)[O-])c1	ZINC000046034205	209328969	/nfs/dbraw/zinc/32/89/69/209328969.db2.gz	RRQIMBHNDPXXMY-UHFFFAOYSA-N	0	0	350.396	2.569	50	5		FFBARN
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nc(-c2ccc(F)c(F)c2)cs1	ZINC000043269382	209275757	/nfs/dbraw/zinc/27/57/57/209275757.db2.gz	SDKKWSRDHOTYFO-UHFFFAOYSA-N	0	0	365.321	2.832	50	5		FFBARN
Cc1ccccc1-c1nc2s/c(=C\c3ccccc3[N+](=O)[O-])c(=O)n2n1	ZINC000001294490	206872125	/nfs/dbraw/zinc/87/21/25/206872125.db2.gz	VJTJVIUWMNXCRK-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
COC(=O)c1cc(C)sc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000002101569	206902136	/nfs/dbraw/zinc/90/21/36/206902136.db2.gz	AKWFHEPOGWPUPH-UHFFFAOYSA-N	0	0	365.323	2.912	50	5		FFBARN
COc1ccc(-c2nc3cc(OC(C)=O)ccc3c(=O)o2)cc1[N+](=O)[O-]	ZINC000002850453	206939809	/nfs/dbraw/zinc/93/98/09/206939809.db2.gz	FWSHOOQOSCTBTH-UHFFFAOYSA-N	0	0	356.290	2.697	50	5		FFBARN
Cc1sc(NC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C	ZINC000002872826	206942385	/nfs/dbraw/zinc/94/23/85/206942385.db2.gz	RTTQPRFCXLPWPB-SECBINFHSA-N	0	0	363.395	2.778	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N2[C@@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000003244929	206963083	/nfs/dbraw/zinc/96/30/83/206963083.db2.gz	WPANGOPXLGEYEI-RYUDHWBXSA-N	0	0	350.371	2.550	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000004081936	207000418	/nfs/dbraw/zinc/00/04/18/207000418.db2.gz	NJWQKUFNDCQGNK-RUDMXATFSA-N	0	0	356.338	2.745	50	5		FFBARN
CCOC(=O)c1sc(C)c2c1N[C@H](c1ccc([N+](=O)[O-])cc1)NC2=O	ZINC000004311480	207012145	/nfs/dbraw/zinc/01/21/45/207012145.db2.gz	JEOXTFPYSBFBER-AWEZNQCLSA-N	0	0	361.379	2.996	50	5		FFBARN
COc1ccc([C@H](C[N+](=O)[O-])c2c(=O)[nH][nH]c2-c2ccccc2O)cc1	ZINC000004649735	207034341	/nfs/dbraw/zinc/03/43/41/207034341.db2.gz	BRIZBOSOUSYVRZ-AWEZNQCLSA-N	0	0	355.350	2.905	50	5		FFBARN
COC(=O)[C@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2Cl)C1=O	ZINC000004695144	207039563	/nfs/dbraw/zinc/03/95/63/207039563.db2.gz	WDMVEPJOKGCNPA-KEXZDQNZSA-N	0	0	370.770	2.846	50	5		FFBARN
CCO[C@]12ON=C(c3cccc([N+](=O)[O-])c3)N1c1ccc(C)cc1C2=O	ZINC000004709512	207039864	/nfs/dbraw/zinc/03/98/64/207039864.db2.gz	CDQFNTROYLTGGV-GOSISDBHSA-N	0	0	353.334	2.988	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2=O)cc1	ZINC000004810652	207049142	/nfs/dbraw/zinc/04/91/42/207049142.db2.gz	VHACDOGHTZMDTR-ZDUSSCGKSA-N	0	0	369.377	2.903	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)O[C@]12CCOC(C)(C)C2	ZINC000005024681	207072205	/nfs/dbraw/zinc/07/22/05/207072205.db2.gz	WPPNCEUAUFTUKU-ACJLOTCBSA-N	0	0	362.382	2.733	50	5		FFBARN
COc1ccccc1N1C[C@@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000005028133	207074180	/nfs/dbraw/zinc/07/41/80/207074180.db2.gz	ZOPLBMJPCANAIR-LBPRGKRZSA-N	0	0	355.350	2.595	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1cccn(OCc2ccccc2)c1=O	ZINC000005054751	207076660	/nfs/dbraw/zinc/07/66/60/207076660.db2.gz	DMGJRUAAJIQAEY-UHFFFAOYSA-N	0	0	365.345	2.638	50	5		FFBARN
O=C(COC(=O)c1ccc2ccccc2n1)Nc1ccc([N+](=O)[O-])cc1	ZINC000005079962	207078737	/nfs/dbraw/zinc/07/87/37/207078737.db2.gz	XWHIRDMIOCQZBC-UHFFFAOYSA-N	0	0	351.318	2.939	50	5		FFBARN
O=C(COC(=O)c1ccc(O)cc1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000005693656	207112345	/nfs/dbraw/zinc/11/23/45/207112345.db2.gz	JEWNVVACWLHXAY-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
COc1cc(/C=C/C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1O	ZINC000005781840	207116684	/nfs/dbraw/zinc/11/66/84/207116684.db2.gz	PYFKLGQCRYWMOQ-YCRREMRBSA-N	0	0	372.333	2.504	50	5		FFBARN
COc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000006055688	207128185	/nfs/dbraw/zinc/12/81/85/207128185.db2.gz	LYVQURAZXZZIKU-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
CCOc1ccc(NC(=O)CSc2nnc(C)s2)c([N+](=O)[O-])c1	ZINC000006351150	207138320	/nfs/dbraw/zinc/13/83/20/207138320.db2.gz	SZRKACWQXGWAPQ-UHFFFAOYSA-N	0	0	354.413	2.884	50	5		FFBARN
CS(=O)(=O)c1ccc(Oc2ccc(-n3ccnc3)cc2)c([N+](=O)[O-])c1	ZINC000006608693	207148509	/nfs/dbraw/zinc/14/85/09/207148509.db2.gz	JFJLYMOLGHSHCY-UHFFFAOYSA-N	0	0	359.363	2.976	50	5		FFBARN
Cc1cccc(OCCOC(=O)c2cc([N+](=O)[O-])ccc2NCCO)c1	ZINC000006465276	207142850	/nfs/dbraw/zinc/14/28/50/207142850.db2.gz	RHPFFKOJKWLFRO-UHFFFAOYSA-N	0	0	360.366	2.543	50	5		FFBARN
Cc1nn(CC(=O)Nc2ccc(Br)cc2)c(C)c1[N+](=O)[O-]	ZINC000006881825	207174876	/nfs/dbraw/zinc/17/48/76/207174876.db2.gz	JWZWZPBQFJLXLK-UHFFFAOYSA-N	0	0	353.176	2.809	50	5		FFBARN
Cc1cc(C(=O)O[C@@H](C)C(=O)Nc2ccnn2C(C)C)ccc1[N+](=O)[O-]	ZINC000007529945	207197689	/nfs/dbraw/zinc/19/76/89/207197689.db2.gz	AUELXHKSYINYSZ-LBPRGKRZSA-N	0	0	360.370	2.865	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(Br)o1	ZINC000008145659	207220652	/nfs/dbraw/zinc/22/06/52/207220652.db2.gz	ZNYZVLXKJNXMTR-UHFFFAOYSA-N	0	0	354.160	2.792	50	5		FFBARN
CCNc1nnc(Sc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])s1	ZINC000009337387	207267420	/nfs/dbraw/zinc/26/74/20/207267420.db2.gz	FWFUYYKGVOQCRI-UHFFFAOYSA-N	0	0	365.440	2.922	50	5		FFBARN
COc1cc(SC)ccc1C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000009689960	207281466	/nfs/dbraw/zinc/28/14/66/207281466.db2.gz	PECWJWVZBKLNIK-HNNXBMFYSA-N	0	0	362.407	2.789	50	5		FFBARN
Cc1cc(NC(=O)[C@@H](c2ccccc2)n2nc(C)c([N+](=O)[O-])c2C)no1	ZINC000010214882	207297913	/nfs/dbraw/zinc/29/79/13/207297913.db2.gz	UVGGINHZSMDCAF-MRXNPFEDSA-N	0	0	355.354	2.933	50	5		FFBARN
CNc1ccc(C(=O)NCc2cnn(-c3ccccc3)c2)cc1[N+](=O)[O-]	ZINC000010488189	207301687	/nfs/dbraw/zinc/30/16/87/207301687.db2.gz	OOPHZHOJLCDJRR-UHFFFAOYSA-N	0	0	351.366	2.752	50	5		FFBARN
O=C(NC[C@H]1CCCO1)c1ccccc1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000012136942	207341051	/nfs/dbraw/zinc/34/10/51/207341051.db2.gz	LHVGULBGGJTIQO-CYBMUJFWSA-N	0	0	369.377	2.756	50	5		FFBARN
Cc1ccc2c(c1)oc(=O)n2C1CCN(C(=O)c2ccc([N+](=O)[O-])o2)CC1	ZINC000022623385	207815186	/nfs/dbraw/zinc/81/51/86/207815186.db2.gz	KERVGFZAMICNJR-UHFFFAOYSA-N	0	0	371.349	2.881	50	5		FFBARN
O=C1c2cccc([N+](=O)[O-])c2C(=O)N1Cc1cc(Cl)c2c(c1)OCCO2	ZINC000032739547	208037688	/nfs/dbraw/zinc/03/76/88/208037688.db2.gz	OFKWZROPTUFBRQ-UHFFFAOYSA-N	0	0	374.736	2.816	50	5		FFBARN
CCN(Cc1ccc2c(c1)OCCO2)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000036037204	208141003	/nfs/dbraw/zinc/14/10/03/208141003.db2.gz	XYFUCVHAYXZJFZ-UHFFFAOYSA-N	0	0	356.378	2.957	50	5		FFBARN
COc1ccc([C@H](Nc2c([N+](=O)[O-])c(C)nn2C)c2nccn2C)cc1	ZINC000040116244	208230307	/nfs/dbraw/zinc/23/03/07/208230307.db2.gz	UEHQKERZBMYQNZ-AWEZNQCLSA-N	0	0	356.386	2.580	50	5		FFBARN
COc1ccccc1CN(CCO)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1	ZINC000047323302	208375969	/nfs/dbraw/zinc/37/59/69/208375969.db2.gz	OBIMFDVRNUDSAY-UHFFFAOYSA-N	0	0	359.382	2.938	50	5		FFBARN
Cc1nn(C)c(C)c1[C@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000068256602	208745906	/nfs/dbraw/zinc/74/59/06/208745906.db2.gz	FERFMAYABZFBQA-NSHDSACASA-N	0	0	355.398	2.777	50	5		FFBARN
CCn1c(CNC(=O)COc2ccc([N+](=O)[O-])cc2)nc2ccccc21	ZINC000023053573	220409311	/nfs/dbraw/zinc/40/93/11/220409311.db2.gz	MRCWYKZNVLGGHU-UHFFFAOYSA-N	0	0	354.366	2.660	50	5		FFBARN
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@@H]1CCCc2cc(OC(F)F)ccc21	ZINC000095452358	209052370	/nfs/dbraw/zinc/05/23/70/209052370.db2.gz	VYUGUCGNBOJKJI-GFCCVEGCSA-N	0	0	366.324	2.737	50	5		FFBARN
CC1(C)C(=O)Nc2ccc(S(=O)(=O)Nc3ccc([N+](=O)[O-])cc3)cc21	ZINC000095457185	209054474	/nfs/dbraw/zinc/05/44/74/209054474.db2.gz	SRTSLAIXXOLWTG-UHFFFAOYSA-N	0	0	361.379	2.625	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cc1)N1CCN(c2ccc(O)cc2)CC1	ZINC000003340203	132385114	/nfs/dbraw/zinc/38/51/14/132385114.db2.gz	OLANCEZHZFVROC-UHFFFAOYSA-N	0	0	373.434	2.741	50	5		FFBARN
C[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N1c2ccccc2NC(=O)C1(C)C	ZINC000007202944	132839494	/nfs/dbraw/zinc/83/94/94/132839494.db2.gz	OEAQSDGSPUQQIZ-LLVKDONJSA-N	0	0	370.365	2.521	50	5		FFBARN
O=[N+]([O-])c1ccc(NCc2ccc(N3CCCC[C@@H]3CCO)nc2)nc1	ZINC000047253886	136122687	/nfs/dbraw/zinc/12/26/87/136122687.db2.gz	NGXBHQPOLJKHQT-OAHLLOKOSA-N	0	0	357.414	2.738	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3nc(-c4ccccc4)no3)CC2)cc1	ZINC000055526909	136126824	/nfs/dbraw/zinc/12/68/24/136126824.db2.gz	ZVPWCDOFMSEUGJ-UHFFFAOYSA-N	0	0	365.393	2.967	50	5		FFBARN
Cc1c(C(=O)N2NC(C3CC3)=C[C@@]2(O)C(F)(F)F)cccc1[N+](=O)[O-]	ZINC000000651720	506226555	/nfs/dbraw/zinc/22/65/55/506226555.db2.gz	PMYPQFGNTMMJRH-CQSZACIVSA-N	0	0	357.288	2.766	50	5		FFBARN
Cc1nn(C)c(C)c1N1C(=O)c2cccc3c([N+](=O)[O-])ccc(c32)C1=O	ZINC000000885750	506238740	/nfs/dbraw/zinc/23/87/40/506238740.db2.gz	WSRPFSNFNBLSSY-UHFFFAOYSA-N	0	0	350.334	2.899	50	5		FFBARN
CC(=O)Oc1ccccc1/C=C1/N=C(c2ccc([N+](=O)[O-])cc2)OC1=O	ZINC000001041606	506245444	/nfs/dbraw/zinc/24/54/44/506245444.db2.gz	GZHZFMNOBLXGKX-XNTDXEJSSA-N	0	0	352.302	2.865	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc(OC)c([N+](=O)[O-])c2)cc1	ZINC000001137220	506250205	/nfs/dbraw/zinc/25/02/05/506250205.db2.gz	YNEASVJBVMRQBN-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000001171404	506251333	/nfs/dbraw/zinc/25/13/33/506251333.db2.gz	HPOLSCWTUFZCDJ-UHFFFAOYSA-N	0	0	358.379	2.680	50	5		FFBARN
COc1cc(C(=O)Nc2ccc(NC(C)=O)cc2)c([N+](=O)[O-])cc1OC	ZINC000001218273	506256611	/nfs/dbraw/zinc/25/66/11/506256611.db2.gz	PYQACRBBNQZYPI-UHFFFAOYSA-N	0	0	359.338	2.823	50	5		FFBARN
Cc1nn(CC(=O)N(C)c2ccc(OC(F)(F)F)cc2)c(C)c1[N+](=O)[O-]	ZINC000001427457	506261371	/nfs/dbraw/zinc/26/13/71/506261371.db2.gz	VYBDKKQALNAEAQ-UHFFFAOYSA-N	0	0	372.303	2.970	50	5		FFBARN
COc1cc2c(cc1OC)[C@@H](c1cc3c(cc1[N+](=O)[O-])OCO3)CC(=O)N2	ZINC000001440251	506261599	/nfs/dbraw/zinc/26/15/99/506261599.db2.gz	ATBNZGVSEHYHFM-VIFPVBQESA-N	0	0	372.333	2.815	50	5		FFBARN
Cc1ccc(S(=O)(=O)Oc2c([N+](=O)[O-])cc(C)cc2[N+](=O)[O-])cc1	ZINC000001628065	506267399	/nfs/dbraw/zinc/26/73/99/506267399.db2.gz	LGWABQLVZMOIMO-UHFFFAOYSA-N	0	0	352.324	2.888	50	5		FFBARN
CC(C)(C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000001891983	506270092	/nfs/dbraw/zinc/27/00/92/506270092.db2.gz	LRXGNLYTSNBCHN-UHFFFAOYSA-N	0	0	369.424	2.869	50	5		FFBARN
O=[N+]([O-])c1cnn(Cc2ccc(-c3nc4c5ccccc5ncn4n3)o2)c1	ZINC000002806462	506295205	/nfs/dbraw/zinc/29/52/05/506295205.db2.gz	CQFGJTCFBKCNLB-UHFFFAOYSA-N	0	0	361.321	2.691	50	5		FFBARN
COc1ccc(N[C@H]2CC(=O)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc1	ZINC000002879105	506299450	/nfs/dbraw/zinc/29/94/50/506299450.db2.gz	DEDBECRSZKGNQV-HNNXBMFYSA-N	0	0	355.350	2.656	50	5		FFBARN
Cc1ccc(S(=O)(=O)Oc2c(C)cc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000003132927	506311619	/nfs/dbraw/zinc/31/16/19/506311619.db2.gz	TZISYEQTDNULQX-UHFFFAOYSA-N	0	0	352.324	2.888	50	5		FFBARN
COc1ccc(C(=O)O[C@@H](C)C(=O)N2CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000003544702	506341855	/nfs/dbraw/zinc/34/18/55/506341855.db2.gz	OBNDKLBEIRCITQ-LBPRGKRZSA-N	0	0	370.361	2.738	50	5		FFBARN
CCOC(=O)CSc1cc([N+](=O)[O-])cc2sc(C(=O)OC)c(N)c21	ZINC000003617965	506347270	/nfs/dbraw/zinc/34/72/70/506347270.db2.gz	ADWWVBBWJCKFCH-UHFFFAOYSA-N	0	0	370.408	2.834	50	5		FFBARN
Cn1nc([N+](=O)[O-])c([N+](=O)[O-])c1C(=O)Nc1cccc(C(F)(F)F)c1	ZINC000033651634	506361762	/nfs/dbraw/zinc/36/17/62/506361762.db2.gz	MHNUMHJNXNAAGI-UHFFFAOYSA-N	0	0	359.220	2.508	50	5		FFBARN
O=C(N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000004497488	506379632	/nfs/dbraw/zinc/37/96/32/506379632.db2.gz	YLMWATJQHUZMPR-ZDUSSCGKSA-N	0	0	359.769	2.784	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000004497010	506378033	/nfs/dbraw/zinc/37/80/33/506378033.db2.gz	WXKGCSRIFSGNBH-BCTQVIJGSA-N	0	0	365.389	2.838	50	5		FFBARN
CC[C@H](C)NC(=O)COC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000004839943	506399316	/nfs/dbraw/zinc/39/93/16/506399316.db2.gz	RJVKPCMVLKDAQO-ZDUSSCGKSA-N	0	0	363.414	2.657	50	5		FFBARN
COc1ccc(NC(=O)CN(C)C(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1	ZINC000005511116	506446433	/nfs/dbraw/zinc/44/64/33/506446433.db2.gz	WJUUUQCTMHTGSX-IZZDOVSWSA-N	0	0	369.377	2.714	50	5		FFBARN
CCOc1ccccc1N1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000006250755	506473151	/nfs/dbraw/zinc/47/31/51/506473151.db2.gz	NRGIBCIOAFIQPK-UHFFFAOYSA-N	0	0	369.421	2.885	50	5		FFBARN
O=c1[nH]cnc2cc(NCCCOCc3ccccc3)c([N+](=O)[O-])cc21	ZINC000009338899	506691263	/nfs/dbraw/zinc/69/12/63/506691263.db2.gz	WYSNDIUSURZXDW-UHFFFAOYSA-N	0	0	354.366	2.850	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1COC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000011342060	506773652	/nfs/dbraw/zinc/77/36/52/506773652.db2.gz	PKNZNGDWYFLWJD-UHFFFAOYSA-N	0	0	362.294	2.877	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000012635197	506887564	/nfs/dbraw/zinc/88/75/64/506887564.db2.gz	AXHKEIXSSFWECM-UHFFFAOYSA-N	0	0	352.690	2.569	50	5		FFBARN
CC1CCC(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)CC1	ZINC000012814097	506906734	/nfs/dbraw/zinc/90/67/34/506906734.db2.gz	UEHKJFGYPJWPTM-UHFFFAOYSA-N	0	0	360.458	2.655	50	5		FFBARN
C[C@@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)cc1F	ZINC000015813480	507061282	/nfs/dbraw/zinc/06/12/82/507061282.db2.gz	SQOVGRCYCJBMPW-SNVBAGLBSA-N	0	0	373.319	2.945	50	5		FFBARN
O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc3c(c2)CCO3)ccc1Cl	ZINC000057512914	507283461	/nfs/dbraw/zinc/28/34/61/507283461.db2.gz	OTKKORBNPUMBRC-UHFFFAOYSA-N	0	0	354.771	2.984	50	5		FFBARN
CC(C)NS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1	ZINC000022279208	507286601	/nfs/dbraw/zinc/28/66/01/507286601.db2.gz	YFOVGEJENJLWEP-UHFFFAOYSA-N	0	0	363.395	2.534	50	5		FFBARN
COC(=O)c1cn(CC(=O)Nc2ccc([N+](=O)[O-])cc2)c2ccccc12	ZINC000023330867	507346713	/nfs/dbraw/zinc/34/67/13/507346713.db2.gz	BJENYTSVPGFBMW-UHFFFAOYSA-N	0	0	353.334	2.975	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(CCN(C)C)c1ccccc1	ZINC000058009338	507363322	/nfs/dbraw/zinc/36/33/22/507363322.db2.gz	LLTDYGFWKHMCDG-UHFFFAOYSA-N	0	0	363.439	2.660	50	5		FFBARN
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC[C@@H]1CCCO1	ZINC000023876417	507377477	/nfs/dbraw/zinc/37/74/77/507377477.db2.gz	PMIOFTPIBVPRBE-HNNXBMFYSA-N	0	0	350.418	2.840	50	5		FFBARN
CCN(CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCO2	ZINC000058372836	507410451	/nfs/dbraw/zinc/41/04/51/507410451.db2.gz	ODUBKSKNRNCWDP-UHFFFAOYSA-N	0	0	357.366	2.784	50	5		FFBARN
Cc1ccc([C@H](CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)N2CCOCC2)o1	ZINC000024573454	507420050	/nfs/dbraw/zinc/42/00/50/507420050.db2.gz	OWDLFSXLNDIWEN-KRWDZBQOSA-N	0	0	373.409	2.608	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OC(=O)c2ccc(N3C(=O)CCC3=O)cc2)c1	ZINC000024597370	507423288	/nfs/dbraw/zinc/42/32/88/507423288.db2.gz	WXIDCVQTLOGFRZ-UHFFFAOYSA-N	0	0	354.318	2.776	50	5		FFBARN
C[C@@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1ncc(Cl)c(Cl)c1=O	ZINC000024655122	507427851	/nfs/dbraw/zinc/42/78/51/507427851.db2.gz	BTZRAULSENGBBY-MRVPVSSYSA-N	0	0	355.181	2.867	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CCN(c2ccccc2)C1	ZINC000024816106	507441038	/nfs/dbraw/zinc/44/10/38/507441038.db2.gz	MOTUNAAJWIRQAQ-AWEZNQCLSA-N	0	0	355.394	2.860	50	5		FFBARN
COCCOc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1OC	ZINC000024936692	507451309	/nfs/dbraw/zinc/45/13/09/507451309.db2.gz	QISLYWJWKWJCRE-UHFFFAOYSA-N	0	0	360.366	2.810	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1cc(Cl)c[nH]1	ZINC000025195015	507474685	/nfs/dbraw/zinc/47/46/85/507474685.db2.gz	BUODJUIPDNTZDV-QMMMGPOBSA-N	0	0	367.745	2.769	50	5		FFBARN
CC[C@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)c1	ZINC000048310742	507499246	/nfs/dbraw/zinc/49/92/46/507499246.db2.gz	BOZVPGSQZLKCGB-LBPRGKRZSA-N	0	0	370.409	2.757	50	5		FFBARN
Cc1ccc(NC(=O)C2CCN(C(=O)c3ccco3)CC2)cc1[N+](=O)[O-]	ZINC000026765416	507606794	/nfs/dbraw/zinc/60/67/94/507606794.db2.gz	WIVLKDGMAIFOEG-UHFFFAOYSA-N	0	0	357.366	2.987	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(Cc2ccc(F)cc2)C1	ZINC000028580753	507731200	/nfs/dbraw/zinc/73/12/00/507731200.db2.gz	JUJNVIICWBSLTC-CYBMUJFWSA-N	0	0	357.341	2.721	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1c1nnc2ccccn21	ZINC000029074947	507756812	/nfs/dbraw/zinc/75/68/12/507756812.db2.gz	DIKDMTLFRUDALH-OAHLLOKOSA-N	0	0	351.366	2.544	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1ccc(Cn2ccnc2)cc1	ZINC000030220826	507803808	/nfs/dbraw/zinc/80/38/08/507803808.db2.gz	LFFCPGFKQWLOSV-UHFFFAOYSA-N	0	0	350.378	2.699	50	5		FFBARN
CCc1nc([C@H](C)NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cs1	ZINC000078616335	507889748	/nfs/dbraw/zinc/88/97/48/507889748.db2.gz	RTFNSFHTANTVFU-VIFPVBQESA-N	0	0	351.432	2.695	50	5		FFBARN
CN1CCCN(C[C@@H](O)COc2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000225443954	509373016	/nfs/dbraw/zinc/37/30/16/509373016.db2.gz	PHAGQYLSRDGKRY-MRXNPFEDSA-N	0	0	357.410	2.681	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@H]2C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000239159688	520827057	/nfs/dbraw/zinc/82/70/57/520827057.db2.gz	MPOGNXFBWLAWGZ-HQQWDMGQSA-N	0	0	359.382	2.955	50	5		FFBARN
Cc1ccc(OCC(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000019841666	525381635	/nfs/dbraw/zinc/38/16/35/525381635.db2.gz	KBYYESXNFFESGI-UHFFFAOYSA-N	0	0	369.421	2.626	50	5		FFBARN
CN(Cc1cc(F)cc2c1OCOC2)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000032915999	209853933	/nfs/dbraw/zinc/85/39/33/209853933.db2.gz	PSOLORHGAFGYSM-UHFFFAOYSA-N	0	0	360.341	2.802	50	5		FFBARN
Cc1ccc(C(=O)N2NC(C3CC3)=C[C@]2(O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000000651695	209374221	/nfs/dbraw/zinc/37/42/21/209374221.db2.gz	YPSVMXUOBUOBHI-AWEZNQCLSA-N	0	0	357.288	2.766	50	5		FFBARN
C[C@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCCO2	ZINC000003514717	206982560	/nfs/dbraw/zinc/98/25/60/206982560.db2.gz	UBIXWXRIMDOWPB-JTQLQIEISA-N	0	0	362.313	2.911	50	5		FFBARN
COC(=O)c1cc(C(=O)OCCc2ccc(OC)cc2)cc([N+](=O)[O-])c1	ZINC000003545446	206983584	/nfs/dbraw/zinc/98/35/84/206983584.db2.gz	UROMMLFNAGTPPZ-UHFFFAOYSA-N	0	0	359.334	2.790	50	5		FFBARN
O=C(OCCN1C(=O)c2ccccc2C1=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000003564614	206984799	/nfs/dbraw/zinc/98/47/99/206984799.db2.gz	BWDTZQDHBJZBHY-UHFFFAOYSA-N	0	0	374.736	2.701	50	5		FFBARN
CNC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004006631	206997820	/nfs/dbraw/zinc/99/78/20/206997820.db2.gz	PRLQWEKGEUKOAE-UTNBAMHJSA-N	0	0	371.437	2.656	50	5		FFBARN
COC(=O)c1ccc(NCCC(=O)N2CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000004668833	207036843	/nfs/dbraw/zinc/03/68/43/207036843.db2.gz	SWXSHTJWTGZFBR-UHFFFAOYSA-N	0	0	369.377	2.773	50	5		FFBARN
CCCC1=Nc2ncnn2[C@H](c2ccccc2[N+](=O)[O-])C1C(=O)OCC	ZINC000004866830	207057485	/nfs/dbraw/zinc/05/74/85/207057485.db2.gz	UBRVJLIUDXQIDP-OAHLLOKOSA-N	0	0	357.370	2.819	50	5		FFBARN
O=C(COC(=O)Cc1ccccc1[N+](=O)[O-])N[C@@H]1CCCc2ccccc21	ZINC000004918230	207062565	/nfs/dbraw/zinc/06/25/65/207062565.db2.gz	CQLWEFOOTNUQQG-QGZVFWFLSA-N	0	0	368.389	2.874	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@H](/C=C\c2cccc([N+](=O)[O-])c2)N3)C1	ZINC000004908494	207060824	/nfs/dbraw/zinc/06/08/24/207060824.db2.gz	QOCHASNCRCUSRF-YVACAVLKSA-N	0	0	370.434	2.839	50	5		FFBARN
COc1cccc(N2C[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)c1	ZINC000005028129	207073555	/nfs/dbraw/zinc/07/35/55/207073555.db2.gz	HBRDOGLWOVYKGX-LBPRGKRZSA-N	0	0	355.350	2.595	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cn1)c1ccccc1I	ZINC000004998875	207070962	/nfs/dbraw/zinc/07/09/62/207070962.db2.gz	DXBZIXAIOURTBB-UHFFFAOYSA-N	0	0	369.118	2.847	50	5		FFBARN
CCN(CC)C(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1	ZINC000005092917	207080803	/nfs/dbraw/zinc/08/08/03/207080803.db2.gz	USBFKELRAAYCKF-NTCAYCPXSA-N	0	0	357.366	2.827	50	5		FFBARN
CC(C)N(C(=O)COC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000005658245	207110227	/nfs/dbraw/zinc/11/02/27/207110227.db2.gz	RRVIKKBHXMVOJO-UHFFFAOYSA-N	0	0	357.366	2.775	50	5		FFBARN
COc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]	ZINC000009141559	207258801	/nfs/dbraw/zinc/25/88/01/207258801.db2.gz	UWFYOKNLIVQYOI-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCS(=O)(=O)Cc1ccccc1	ZINC000009698591	207282099	/nfs/dbraw/zinc/28/20/99/207282099.db2.gz	MAPZEZJFUFHSED-UHFFFAOYSA-N	0	0	362.407	2.847	50	5		FFBARN
COc1ccc(NC(=O)[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)c([N+](=O)[O-])c1	ZINC000010494621	207301604	/nfs/dbraw/zinc/30/16/04/207301604.db2.gz	NNNGMAPTHJGQRD-LLVKDONJSA-N	0	0	373.340	2.734	50	5		FFBARN
COc1ccc(C2=N/C(=C\c3cccc([N+](=O)[O-])c3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000015217122	207549753	/nfs/dbraw/zinc/54/97/53/207549753.db2.gz	WTZNIHBSFXFEFF-JYRVWZFOSA-N	0	0	369.289	2.856	50	5		FFBARN
CC(=O)Oc1ccc(C2=NN(C(C)=O)[C@H](c3ccccc3[N+](=O)[O-])O2)cc1	ZINC000021092050	207762940	/nfs/dbraw/zinc/76/29/40/207762940.db2.gz	IUHBUMASQFGTLE-SFHVURJKSA-N	0	0	369.333	2.759	50	5		FFBARN
Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](C)N1CCc2sccc2C1	ZINC000040074364	207953819	/nfs/dbraw/zinc/95/38/19/207953819.db2.gz	URCKYKZYHABBOJ-LLVKDONJSA-N	0	0	360.439	2.536	50	5		FFBARN
O=c1n(CCSc2nc3ccc([N+](=O)[O-])cc3s2)nc2ccccn21	ZINC000031840980	208019471	/nfs/dbraw/zinc/01/94/71/208019471.db2.gz	PZHUUMTYSANBPK-UHFFFAOYSA-N	0	0	373.419	2.806	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000032727299	208037848	/nfs/dbraw/zinc/03/78/48/208037848.db2.gz	YLAVMWCNCNXZEU-CYBMUJFWSA-N	0	0	357.366	2.549	50	5		FFBARN
C[C@@H](OC(=O)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCO2	ZINC000035567872	208130784	/nfs/dbraw/zinc/13/07/84/208130784.db2.gz	AJJUHIJGIUUFOI-SNVBAGLBSA-N	0	0	358.306	2.508	50	5		FFBARN
Cc1cc(OCc2ccc(S(=O)(=O)N3CCCC3)o2)ccc1[N+](=O)[O-]	ZINC000040116484	208229460	/nfs/dbraw/zinc/22/94/60/208229460.db2.gz	VJWFIUUIULSBIK-UHFFFAOYSA-N	0	0	366.395	2.860	50	5		FFBARN
O=C(N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)[C@H]1C[C@@H]1[N+](=O)[O-]	ZINC000045819529	208338789	/nfs/dbraw/zinc/33/87/89/208338789.db2.gz	NPTGIHFGCGXZJM-LESCRADOSA-N	0	0	368.368	2.698	50	5		FFBARN
CC(C)CSCCN1C(=O)N[C@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000095446966	209050311	/nfs/dbraw/zinc/05/03/11/209050311.db2.gz	WCACOVMKXZBUJG-MRXNPFEDSA-N	0	0	351.428	2.751	50	5		FFBARN
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@H](CCc1ccccc1)C(F)(F)F	ZINC000095465881	209054952	/nfs/dbraw/zinc/05/49/52/209054952.db2.gz	LJBOVGMUGGHLJC-CQSZACIVSA-N	0	0	370.331	2.861	50	5		FFBARN
O=C(CCn1cc([N+](=O)[O-])cn1)N[C@@H](CCc1ccccc1)C(F)(F)F	ZINC000095465880	209056103	/nfs/dbraw/zinc/05/61/03/209056103.db2.gz	LJBOVGMUGGHLJC-AWEZNQCLSA-N	0	0	370.331	2.861	50	5		FFBARN
C[C@@H]1C[C@@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000005262008	132827965	/nfs/dbraw/zinc/82/79/65/132827965.db2.gz	IFQUJLWLDGVOAR-PWSUYJOCSA-N	0	0	357.332	2.918	50	5		FFBARN
O=[N+]([O-])c1c(NCc2ccc(N3CCOCC3)nc2)ccc2ncccc21	ZINC000042109822	136121147	/nfs/dbraw/zinc/12/11/47/136121147.db2.gz	FWBKWEQCNCXMJO-UHFFFAOYSA-N	0	0	365.393	2.987	50	5		FFBARN
Cc1cccc(NC(=O)CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C	ZINC000057364208	136128853	/nfs/dbraw/zinc/12/88/53/136128853.db2.gz	LPKPVMFHUYPHBC-UHFFFAOYSA-N	0	0	368.437	2.972	50	5		FFBARN
CC[C@@H]1C(=O)NCCN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000075103540	136149998	/nfs/dbraw/zinc/14/99/98/136149998.db2.gz	RERIEPFXTJNISM-OAHLLOKOSA-N	0	0	353.378	2.541	50	5		FFBARN
CCOC(=O)N1CCN(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000040098687	506466495	/nfs/dbraw/zinc/46/64/95/506466495.db2.gz	SNDWQMFOOZJYQP-UHFFFAOYSA-N	0	0	356.766	2.554	50	5		FFBARN
CC1=C(C(=O)OCc2ccco2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000844463	506235561	/nfs/dbraw/zinc/23/55/61/506235561.db2.gz	YYTHXCTWIGEWMU-HNNXBMFYSA-N	0	0	357.322	2.559	50	5		FFBARN
CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000000853679	506237068	/nfs/dbraw/zinc/23/70/68/506237068.db2.gz	HJVVJXOJCQJLEC-HNNXBMFYSA-N	0	0	356.334	2.558	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)N1C(=O)c2ccccc2C1=O	ZINC000001133201	506250732	/nfs/dbraw/zinc/25/07/32/506250732.db2.gz	JWDWKQRLBZBAOB-NSHDSACASA-N	0	0	353.334	2.526	50	5		FFBARN
O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1ccccc1[N+](=O)[O-]	ZINC000001191808	506253827	/nfs/dbraw/zinc/25/38/27/506253827.db2.gz	LFJIDPQLWIKTFV-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
O=C(NCc1ccco1)c1cc(C(=O)NCc2ccco2)cc([N+](=O)[O-])c1	ZINC000001190334	506254483	/nfs/dbraw/zinc/25/44/83/506254483.db2.gz	GUTQAMASTDCINY-UHFFFAOYSA-N	0	0	369.333	2.641	50	5		FFBARN
CC1(c2ccc([N+](=O)[O-])c(CS(=O)(=O)c3ccccc3)c2)OCCO1	ZINC000001388719	506260142	/nfs/dbraw/zinc/26/01/42/506260142.db2.gz	FHKZHCVRXTZXAM-UHFFFAOYSA-N	0	0	363.391	2.788	50	5		FFBARN
Cc1nc([N+](=O)[O-])c(C(=O)OCc2cccc(Br)c2)n1C	ZINC000001424496	506261915	/nfs/dbraw/zinc/26/19/15/506261915.db2.gz	GJGUGVUMWHKTJE-UHFFFAOYSA-N	0	0	354.160	2.756	50	5		FFBARN
CCCOC(=O)Cn1cnc2scc(-c3cccc([N+](=O)[O-])c3)c2c1=O	ZINC000001778441	506269116	/nfs/dbraw/zinc/26/91/16/506269116.db2.gz	JNAGNTMRKFZQLJ-UHFFFAOYSA-N	0	0	373.390	2.986	50	5		FFBARN
CC(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000003255991	506317397	/nfs/dbraw/zinc/31/73/97/506317397.db2.gz	VRVOZLYRINJWML-GFCCVEGCSA-N	0	0	356.334	2.981	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)C1=NN(c2ccccc2)C(=O)CC1	ZINC000033018857	506326244	/nfs/dbraw/zinc/32/62/44/506326244.db2.gz	XKUIIIZHCRTATO-UHFFFAOYSA-N	0	0	368.349	2.725	50	5		FFBARN
COC(=O)c1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1	ZINC000004090482	506358424	/nfs/dbraw/zinc/35/84/24/506358424.db2.gz	FAMHCFIROGKTAU-UHFFFAOYSA-N	0	0	373.390	2.817	50	5		FFBARN
CC(C)OC[C@H]1C[C@H](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000004132663	506361286	/nfs/dbraw/zinc/36/12/86/506361286.db2.gz	YBAGMGBNHBRAAY-SWLSCSKDSA-N	0	0	350.371	2.670	50	5		FFBARN
CC(C)NC(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000004299935	506369424	/nfs/dbraw/zinc/36/94/24/506369424.db2.gz	BDWBGWKJKBONAC-UHFFFAOYSA-N	0	0	360.336	2.854	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000004820598	506396898	/nfs/dbraw/zinc/39/68/98/506396898.db2.gz	ZZLBBWJKTDGVIU-UHFFFAOYSA-N	0	0	356.382	2.958	50	5		FFBARN
O=C(CSc1nnc(-c2cccnc2)o1)Nc1ccccc1[N+](=O)[O-]	ZINC000004889825	506402874	/nfs/dbraw/zinc/40/28/74/506402874.db2.gz	DOCORBVXUBDUJW-UHFFFAOYSA-N	0	0	357.351	2.771	50	5		FFBARN
Cc1cc(C)n(C[C@@H](C)NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)n1	ZINC000040146873	506474078	/nfs/dbraw/zinc/47/40/78/506474078.db2.gz	YSLLEHFVNKTRRC-CQSZACIVSA-N	0	0	371.441	2.827	50	5		FFBARN
O=C(COc1ccc(N2CCCC2=O)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000007062740	506530234	/nfs/dbraw/zinc/53/02/34/506530234.db2.gz	WLSUWXKCWKXNGZ-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
C[C@H](Oc1cccnc1[N+](=O)[O-])C(=O)N1c2ccccc2NC(=O)C1(C)C	ZINC000007202941	506541546	/nfs/dbraw/zinc/54/15/46/506541546.db2.gz	OEAQSDGSPUQQIZ-NSHDSACASA-N	0	0	370.365	2.521	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N2CCN(C3CCCCCC3)CC2)cc1	ZINC000054991936	506656544	/nfs/dbraw/zinc/65/65/44/506656544.db2.gz	VNXZLPUNMNWAEF-UHFFFAOYSA-N	0	0	367.471	2.624	50	5		FFBARN
CSc1ncccc1C(=O)O[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000011464707	506776235	/nfs/dbraw/zinc/77/62/35/506776235.db2.gz	TWUILRZONFJRLG-JTQLQIEISA-N	0	0	361.379	2.896	50	5		FFBARN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1	ZINC000012772286	506899781	/nfs/dbraw/zinc/89/97/81/506899781.db2.gz	XFFDWWXKPBRSAP-VIFPVBQESA-N	0	0	358.379	2.884	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@H](/C=C\c2ccccc2[N+](=O)[O-])N3)C1	ZINC000013583249	506945321	/nfs/dbraw/zinc/94/53/21/506945321.db2.gz	ITPYIYQYRMPSCP-XHPSBEMXSA-N	0	0	370.434	2.839	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@@H](/C=C\c2ccccc2[N+](=O)[O-])N3)C1	ZINC000013583252	506945564	/nfs/dbraw/zinc/94/55/64/506945564.db2.gz	ITPYIYQYRMPSCP-IDTUSYRASA-N	0	0	370.434	2.839	50	5		FFBARN
Cc1cc(C(=O)N[C@H](C)c2ccc(S(C)(=O)=O)cc2)ccc1[N+](=O)[O-]	ZINC000015197170	507024982	/nfs/dbraw/zinc/02/49/82/507024982.db2.gz	GQAHTEMBVLNUTG-GFCCVEGCSA-N	0	0	362.407	2.798	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NCc3ccco3)n2)cc1C	ZINC000017208185	507118921	/nfs/dbraw/zinc/11/89/21/507118921.db2.gz	POKICEMLTVVMKV-UHFFFAOYSA-N	0	0	354.370	2.954	50	5	aggregator	FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CCOc2ccccc2C1	ZINC000068217883	507151797	/nfs/dbraw/zinc/15/17/97/507151797.db2.gz	CMWYVOKYMAVJLH-UHFFFAOYSA-N	0	0	351.362	2.971	50	5		FFBARN
Cc1c(C(=O)NCc2ccc(CN3CCOCC3)cc2)cccc1[N+](=O)[O-]	ZINC000024193295	507397242	/nfs/dbraw/zinc/39/72/42/507397242.db2.gz	SGVFHTPTEDYHRJ-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
C[C@H](OC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1cccc(F)c1	ZINC000024658054	507427169	/nfs/dbraw/zinc/42/71/69/507427169.db2.gz	JQCKDPDGWQGDII-LBPRGKRZSA-N	0	0	360.341	2.938	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(NC(=O)[C@H]2CCCO2)c1	ZINC000024933041	507451777	/nfs/dbraw/zinc/45/17/77/507451777.db2.gz	ITGZHSBJZKRJJW-MRXNPFEDSA-N	0	0	355.350	2.965	50	5		FFBARN
Cc1csc(-n2c(C)cc(C(=O)Cn3cc([N+](=O)[O-])ccc3=O)c2C)n1	ZINC000025254707	507480751	/nfs/dbraw/zinc/48/07/51/507480751.db2.gz	GVAZVNKOQMHHGH-UHFFFAOYSA-N	0	0	372.406	2.812	50	5		FFBARN
CCc1ccc(C(=O)N2CCN(C(=O)c3ccc([N+](=O)[O-])s3)CC2)cc1	ZINC000025466984	507503962	/nfs/dbraw/zinc/50/39/62/507503962.db2.gz	YTAJENKFSLZBTA-UHFFFAOYSA-N	0	0	373.434	2.817	50	5		FFBARN
CN(CC(=O)Nc1cccc(Cl)c1)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000026037437	507553766	/nfs/dbraw/zinc/55/37/66/507553766.db2.gz	RPCWWIIPAMWQHB-UHFFFAOYSA-N	0	0	361.785	2.888	50	5		FFBARN
Cc1ccc(/C=c2/sc3nc(-c4cccc([N+](=O)[O-])c4)nn3c2=O)cc1	ZINC000027024068	507626087	/nfs/dbraw/zinc/62/60/87/507626087.db2.gz	ZQWZUWNORVRFCL-OQLLNIDSSA-N	0	0	364.386	2.582	50	5		FFBARN
Cc1cccc(C)c1NC(=O)CN(C)c1nc2ccccn2c1[N+](=O)[O-]	ZINC000070790229	507638007	/nfs/dbraw/zinc/63/80/07/507638007.db2.gz	XXAAITPISWCCNR-UHFFFAOYSA-N	0	0	353.382	2.934	50	5		FFBARN
CCC[C@@H]1CCCN(c2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000071845377	507720572	/nfs/dbraw/zinc/72/05/72/507720572.db2.gz	NURBGPIJNJQBTG-CYBMUJFWSA-N	0	0	355.460	2.910	50	5		FFBARN
O=C(c1cccc2c(=O)c3ccccc3[nH]c12)N1CCCn2cncc2C1	ZINC000072171653	507769091	/nfs/dbraw/zinc/76/90/91/507769091.db2.gz	JKWPPYINPAGGJE-UHFFFAOYSA-N	0	0	358.401	2.924	50	5		FFBARN
C[C@H](Cc1cccc(Cl)c1)Nc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000052280562	507804927	/nfs/dbraw/zinc/80/49/27/507804927.db2.gz	GSDYBWIHURLKRZ-SNVBAGLBSA-N	0	0	369.830	2.939	50	5		FFBARN
O=C(N1CCc2cc([N+](=O)[O-])c(Br)cc2C1)C(F)(F)F	ZINC000079387324	507957166	/nfs/dbraw/zinc/95/71/66/507957166.db2.gz	ZDVBRUOONPLBFS-UHFFFAOYSA-N	0	0	353.094	2.804	50	5		FFBARN
COC(=O)C[C@H](Cc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000075092415	508081925	/nfs/dbraw/zinc/08/19/25/508081925.db2.gz	UNZZZVPNZBSRDV-HNNXBMFYSA-N	0	0	357.366	2.891	50	5		FFBARN
C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@H](C)[C@H]1C	ZINC000248133023	509243151	/nfs/dbraw/zinc/24/31/51/509243151.db2.gz	ZINVDDQTRNQZSD-OZTPJHRESA-N	0	0	363.414	2.663	50	5		FFBARN
CCOC(=O)c1c([N+](=O)[O-])c(C(C)(C)C)nn1CCO[C@@H]1CCCCO1	ZINC000601014550	520596061	/nfs/dbraw/zinc/59/60/61/520596061.db2.gz	VBEAKDFRCBWWCF-GFCCVEGCSA-N	0	0	369.418	2.809	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)/C=C/c2ccccc2[N+](=O)[O-])CC1	ZINC000001134991	537062814	/nfs/dbraw/zinc/06/28/14/537062814.db2.gz	IWWHFWWURWYFMW-ZHACJKMWSA-N	0	0	367.405	2.965	50	5		FFBARN
Cc1ccc(C(=O)[C@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000049703899	570965525	/nfs/dbraw/zinc/96/55/25/570965525.db2.gz	KSCDCPSBDHWTEO-QGZVFWFLSA-N	0	0	374.418	2.939	50	5		FFBARN
Cc1nn(-c2ccc(S(N)(=O)=O)cc2)c(C)c1-c1cccc([N+](=O)[O-])c1	ZINC000001156818	219382238	/nfs/dbraw/zinc/38/22/38/219382238.db2.gz	FQYZPOAJBQYAJO-UHFFFAOYSA-N	0	0	372.406	2.712	50	5		FFBARN
Cc1c(C(=O)N2CCCN(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-]	ZINC000058167284	209699094	/nfs/dbraw/zinc/69/90/94/209699094.db2.gz	KFOCEDRRSBAGPY-UHFFFAOYSA-N	0	0	363.414	2.986	50	5		FFBARN
Cc1ccc(C(=O)CSc2nnnn2-c2cccc(F)c2)cc1[N+](=O)[O-]	ZINC000005219965	209439506	/nfs/dbraw/zinc/43/95/06/209439506.db2.gz	UPPGUUPBURLQNF-UHFFFAOYSA-N	0	0	373.369	2.993	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1	ZINC000004497507	209422020	/nfs/dbraw/zinc/42/20/20/209422020.db2.gz	BCTDPSPOFHSKRX-CQSZACIVSA-N	0	0	373.796	2.712	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)N3C[C@@H](C)C[C@H](C)C3)c(=O)oc21	ZINC000001061195	209385819	/nfs/dbraw/zinc/38/58/19/209385819.db2.gz	ZGSQUCDIWPUGLR-QWRGUYRKSA-N	0	0	360.366	2.828	50	5		FFBARN
NC(=O)c1c(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)sc2c1CCC2	ZINC000000939393	209383432	/nfs/dbraw/zinc/38/34/32/209383432.db2.gz	VXNKFEGIPPWEJY-BQYQJAHWSA-N	0	0	357.391	2.896	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@@H]2C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000101113094	209379859	/nfs/dbraw/zinc/37/98/59/209379859.db2.gz	MPOGNXFBWLAWGZ-JJMVLAAESA-N	0	0	359.382	2.955	50	5		FFBARN
C[C@@H](CCc1ccccc1)NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000012921286	220042609	/nfs/dbraw/zinc/04/26/09/220042609.db2.gz	SJEHYWSJWFOGOQ-AWEZNQCLSA-N	0	0	365.393	2.927	50	5		FFBARN
O=C(Cc1ccc(F)cc1)NCCc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000096290717	209150224	/nfs/dbraw/zinc/15/02/24/209150224.db2.gz	FNGVBSPUJCJSOF-UHFFFAOYSA-N	0	0	370.340	2.685	50	5		FFBARN
COc1ccc(CNC(=O)Cn2ccc3c2cccc3[N+](=O)[O-])cc1OC	ZINC000096118667	209116394	/nfs/dbraw/zinc/11/63/94/209116394.db2.gz	SGVTWTRTPAZGBQ-UHFFFAOYSA-N	0	0	369.377	2.883	50	5		FFBARN
COc1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)c(OC)c1	ZINC000000829683	206837871	/nfs/dbraw/zinc/83/78/71/206837871.db2.gz	PTYSFCDMMAUFBY-DHDCSXOGSA-N	0	0	354.318	2.957	50	5		FFBARN
COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1	ZINC000000861522	206840028	/nfs/dbraw/zinc/84/00/28/206840028.db2.gz	FUXVZXSCPAIJCJ-UHFFFAOYSA-N	0	0	360.366	2.518	50	5		FFBARN
Cc1ccc2c(Cn3cnc4cc([N+](=O)[O-])ccc4c3=O)cc(=O)oc2c1	ZINC000003442791	206978743	/nfs/dbraw/zinc/97/87/43/206978743.db2.gz	DTTUCVNFWYBKFV-UHFFFAOYSA-N	0	0	363.329	2.768	50	5		FFBARN
Cc1cc(Cl)ccc1NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000003493656	206981169	/nfs/dbraw/zinc/98/11/69/206981169.db2.gz	VRDJJPRYQZSDPD-UHFFFAOYSA-N	0	0	373.752	2.791	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1cc2ccccc2oc1=O	ZINC000004458846	207020173	/nfs/dbraw/zinc/02/01/73/207020173.db2.gz	JOCAUGSIAXBFTO-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
COc1ccc([C@@H](C[N+](=O)[O-])c2c(=O)[nH][nH]c2-c2ccccc2O)cc1	ZINC000004641258	207033804	/nfs/dbraw/zinc/03/38/04/207033804.db2.gz	BRIZBOSOUSYVRZ-CQSZACIVSA-N	0	0	355.350	2.905	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2nc3c(s2)CCCC3)cc([N+](=O)[O-])c1	ZINC000004696159	207039493	/nfs/dbraw/zinc/03/94/93/207039493.db2.gz	GWPCSPWBLUHUIC-UHFFFAOYSA-N	0	0	361.379	2.969	50	5		FFBARN
Cc1cc2c(c(SCC(=O)Nc3ccc([N+](=O)[O-])cc3)n1)C(=O)OC2	ZINC000004593205	207030659	/nfs/dbraw/zinc/03/06/59/207030659.db2.gz	IBTCYLNIAKGWBX-UHFFFAOYSA-N	0	0	359.363	2.699	50	5		FFBARN
Cc1ccc(CNc2cc(NCCCO)c([N+](=O)[O-])c3nonc32)cc1	ZINC000004716627	207042300	/nfs/dbraw/zinc/04/23/00/207042300.db2.gz	YRIPGAZFSHFPKT-UHFFFAOYSA-N	0	0	357.370	2.846	50	5		FFBARN
Nc1ccc(C(=O)OCC(=O)Nc2ccc(Cl)cc2F)cc1[N+](=O)[O-]	ZINC000004866697	207057268	/nfs/dbraw/zinc/05/72/68/207057268.db2.gz	ZTBIFXCEKNLXMF-UHFFFAOYSA-N	0	0	367.720	2.765	50	5		FFBARN
Cc1cc2nc3s/c(=C/c4ccc([N+](=O)[O-])cc4)c(=O)n3c2cc1C	ZINC000004795067	207050083	/nfs/dbraw/zinc/05/00/83/207050083.db2.gz	OKWKRNPKOVCYJC-CXUHLZMHSA-N	0	0	351.387	2.982	50	5		FFBARN
Cc1cc(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)c([N+](=O)[O-])cc1C	ZINC000004932210	207064056	/nfs/dbraw/zinc/06/40/56/207064056.db2.gz	JFXRSPRPEKTACK-UHFFFAOYSA-N	0	0	371.180	2.714	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)C[C@@H]1c1ccccc1[N+](=O)[O-]	ZINC000004913533	207061430	/nfs/dbraw/zinc/06/14/30/207061430.db2.gz	MAPVNLSCVDWVMY-CYBMUJFWSA-N	0	0	364.423	2.769	50	5		FFBARN
Cc1c(O[C@H](C)C(=O)NCCCO)ccc2c3ccccc3c(=O)oc12	ZINC000005243669	207088504	/nfs/dbraw/zinc/08/85/04/207088504.db2.gz	HRBXOTGHGLAGHT-CYBMUJFWSA-N	0	0	355.390	2.521	50	5		FFBARN
C[C@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1cc(F)ccc1F	ZINC000007206851	207190727	/nfs/dbraw/zinc/19/07/27/207190727.db2.gz	BSVXXQVFAOGBGR-QMMMGPOBSA-N	0	0	365.292	2.639	50	5		FFBARN
Cc1cc(NC(=O)Cn2c(=O)cnc3ccccc32)c([N+](=O)[O-])cc1C	ZINC000007719415	207204064	/nfs/dbraw/zinc/20/40/64/207204064.db2.gz	OPIZOWNBZIQPFS-UHFFFAOYSA-N	0	0	352.350	2.560	50	5		FFBARN
C[C@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	ZINC000008033817	207217843	/nfs/dbraw/zinc/21/78/43/207217843.db2.gz	IYGQXDAUGHOYIM-NSHDSACASA-N	0	0	361.785	2.855	50	5		FFBARN
COc1ccc(CN2CCOc3ccc([N+](=O)[O-])cc3C2=O)c(OC)c1	ZINC000035588015	207221150	/nfs/dbraw/zinc/22/11/50/207221150.db2.gz	SNYRVWIKQHUWLW-UHFFFAOYSA-N	0	0	358.350	2.647	50	5		FFBARN
Cn1cnnc1-c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1	ZINC000008722290	207245302	/nfs/dbraw/zinc/24/53/02/207245302.db2.gz	UEXQABHOWGDRNQ-UHFFFAOYSA-N	0	0	368.309	2.551	50	5		FFBARN
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccsc2)CC1	ZINC000008750358	207246747	/nfs/dbraw/zinc/24/67/47/207246747.db2.gz	QERWAZKLACDXHA-AWEZNQCLSA-N	0	0	374.466	2.801	50	5		FFBARN
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000008936804	207252510	/nfs/dbraw/zinc/25/25/10/207252510.db2.gz	VXEUZWVDNQJTTK-KRWDZBQOSA-N	0	0	354.362	2.643	50	5		FFBARN
CN(Cc1c(F)cccc1Cl)C(=O)COc1cccnc1[N+](=O)[O-]	ZINC000009617009	207280510	/nfs/dbraw/zinc/28/05/10/207280510.db2.gz	YTTSEYNODPHNMB-UHFFFAOYSA-N	0	0	353.737	2.820	50	5		FFBARN
O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1ccccc1N1CCCC1=O	ZINC000011453537	207314414	/nfs/dbraw/zinc/31/44/14/207314414.db2.gz	UIESQWDKPYXZHA-UHFFFAOYSA-N	0	0	373.340	2.878	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000012660269	207406717	/nfs/dbraw/zinc/40/67/17/207406717.db2.gz	PQMSJLGHMCHRNX-PHIMTYICSA-N	0	0	354.790	2.910	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1ccsc1	ZINC000015179665	207547754	/nfs/dbraw/zinc/54/77/54/207547754.db2.gz	ZYNOZGVLNBXGCU-LBPRGKRZSA-N	0	0	361.423	2.996	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(C(F)(F)F)cc1	ZINC000015565075	207555676	/nfs/dbraw/zinc/55/56/76/207555676.db2.gz	ZEDCGBXYJMSPCJ-UHFFFAOYSA-N	0	0	367.283	2.982	50	5		FFBARN
COc1ccc(C2=NN(C(C)=O)[C@H](c3ccccc3[N+](=O)[O-])O2)cc1OC	ZINC000021090621	207762630	/nfs/dbraw/zinc/76/26/30/207762630.db2.gz	IRNITKCUEJOFPN-SFHVURJKSA-N	0	0	371.349	2.851	50	5		FFBARN
CC(C)OC(=O)C[C@H](NC(=O)C1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000022188923	207797872	/nfs/dbraw/zinc/79/78/72/207797872.db2.gz	HKNAQCKBRUDUQB-HNNXBMFYSA-N	0	0	364.398	2.520	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CC=C(c2ccccc2)CC1	ZINC000030996318	208007374	/nfs/dbraw/zinc/00/73/74/208007374.db2.gz	HICKOAKTLGMPFP-UHFFFAOYSA-N	0	0	365.389	2.641	50	5		FFBARN
C[C@H](Nc1nc2ccccn2c1[N+](=O)[O-])c1ccc(S(C)(=O)=O)cc1	ZINC000032806462	208044822	/nfs/dbraw/zinc/04/48/22/208044822.db2.gz	SEMGEDWIIVPNAR-NSHDSACASA-N	0	0	360.395	2.819	50	5		FFBARN
O=C(NCc1cccnc1OCC(F)(F)F)c1cccc([N+](=O)[O-])c1	ZINC000033107899	208073415	/nfs/dbraw/zinc/07/34/15/208073415.db2.gz	CRMZSJOAXJKFFK-UHFFFAOYSA-N	0	0	355.272	2.861	50	5		FFBARN
COCCCn1ccc2nc3ccn(C4CCCC4)c(=O)c3cc2c1=O	ZINC000036359231	208158590	/nfs/dbraw/zinc/15/85/90/208158590.db2.gz	SUMVCADRFVUAIP-UHFFFAOYSA-N	0	0	353.422	2.863	50	5		FFBARN
Cc1cccc(C(=O)N[C@H](C(=O)N2CCCC2)c2ccccc2)c1[N+](=O)[O-]	ZINC000040146354	208235973	/nfs/dbraw/zinc/23/59/73/208235973.db2.gz	SNSQOQYHSKABRI-KRWDZBQOSA-N	0	0	367.405	2.997	50	5		FFBARN
CN(C)n1ccc2nc3ccn(-c4cccc(Cl)c4)c(=O)c3cc2c1=O	ZINC000040398690	208250206	/nfs/dbraw/zinc/25/02/06/208250206.db2.gz	AMUBNXPIVBJQFM-UHFFFAOYSA-N	0	0	366.808	2.552	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000005446042	132258018	/nfs/dbraw/zinc/25/80/18/132258018.db2.gz	PGSSVCHSKQSQDS-UHFFFAOYSA-N	0	0	372.337	2.592	50	5		FFBARN
COC(=O)c1ccc([N+](=O)[O-])c(N2CCC(N(C)c3ccccc3)CC2)n1	ZINC000225541694	132285454	/nfs/dbraw/zinc/28/54/54/132285454.db2.gz	UFKPBFPEMXSFER-UHFFFAOYSA-N	0	0	370.409	2.882	50	5		FFBARN
CCc1ccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000003904049	132386017	/nfs/dbraw/zinc/38/60/17/132386017.db2.gz	NKDYRTFCSXWRBW-UHFFFAOYSA-N	0	0	369.421	2.885	50	5		FFBARN
C[C@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000004750298	132824566	/nfs/dbraw/zinc/82/45/66/132824566.db2.gz	XXJSKDGDYGAJDD-HNNXBMFYSA-N	0	0	355.394	2.711	50	5		FFBARN
COc1cc(C)c(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2N)cc1C	ZINC000095939651	209086737	/nfs/dbraw/zinc/08/67/37/209086737.db2.gz	OLTVXALWUGLUDH-UHFFFAOYSA-N	0	0	351.384	2.603	50	5		FFBARN
C[C@H](NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	ZINC000007304066	263350652	/nfs/dbraw/zinc/35/06/52/263350652.db2.gz	SPCQQWJKQKZAPB-LBPRGKRZSA-N	0	0	359.357	2.731	50	5		FFBARN
COc1ccc(C(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000019773495	263376796	/nfs/dbraw/zinc/37/67/96/263376796.db2.gz	HLHDRDQYMXFAPM-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
Cc1c(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(=O)n(-c2ccccc2)n1C	ZINC000000705129	506227968	/nfs/dbraw/zinc/22/79/68/506227968.db2.gz	BKGUEUDIRYDVLA-UHFFFAOYSA-N	0	0	366.377	2.953	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000820537	506235348	/nfs/dbraw/zinc/23/53/48/506235348.db2.gz	KOFRKMPTJWTECN-KRWDZBQOSA-N	0	0	367.361	2.966	50	5		FFBARN
COC(=O)C1=C(C)N(C)C(C)=C(C(=O)OC)C1c1ccc([N+](=O)[O-])cc1	ZINC000000861523	506236602	/nfs/dbraw/zinc/23/66/02/506236602.db2.gz	KTROMQYPJIPJJD-UHFFFAOYSA-N	0	0	360.366	2.518	50	5		FFBARN
COc1ccccc1C1=NO[C@@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000001035291	506244393	/nfs/dbraw/zinc/24/43/93/506244393.db2.gz	WAHWAVDUMOEKLY-CQSZACIVSA-N	0	0	356.334	2.953	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000001195002	506254215	/nfs/dbraw/zinc/25/42/15/506254215.db2.gz	PKSSXEOECMCCCI-HNNXBMFYSA-N	0	0	357.322	2.656	50	5		FFBARN
CCOC(=O)C1=C(C(F)(F)F)NC(=O)C[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000001392230	506259640	/nfs/dbraw/zinc/25/96/40/506259640.db2.gz	GVKIDXQDEXAFPF-JTQLQIEISA-N	0	0	358.272	2.578	50	5		FFBARN
COC(=O)c1ccc(C(=O)OC)c(NC(=O)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000002851101	506298042	/nfs/dbraw/zinc/29/80/42/506298042.db2.gz	CXGYNINCJRXPQM-UHFFFAOYSA-N	0	0	373.321	2.812	50	5		FFBARN
COc1ccccc1NC(=O)COC(=O)/C=C/c1ccccc1[N+](=O)[O-]	ZINC000003229679	506313394	/nfs/dbraw/zinc/31/33/94/506313394.db2.gz	DCPYRMVSWPXQQG-ZHACJKMWSA-N	0	0	356.334	2.799	50	5		FFBARN
C[C@@H](Oc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000003441572	506330645	/nfs/dbraw/zinc/33/06/45/506330645.db2.gz	DCLCTUKJTBRDJZ-SECBINFHSA-N	0	0	363.757	2.753	50	5		FFBARN
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Br)cc1F	ZINC000065712691	506348252	/nfs/dbraw/zinc/34/82/52/506348252.db2.gz	KCPOLKIQXFKQEO-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H](C)N2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1	ZINC000003903016	506352311	/nfs/dbraw/zinc/35/23/11/506352311.db2.gz	VJQCJIJCVYKEEQ-LLVKDONJSA-N	0	0	353.334	2.526	50	5		FFBARN
Cc1ccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H](C)C2=O)cc1F	ZINC000037520829	506427131	/nfs/dbraw/zinc/42/71/31/506427131.db2.gz	GGPCYFLHQXMQBX-CYBMUJFWSA-N	0	0	371.368	2.920	50	5		FFBARN
C[C@@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)CCc1ccccc1	ZINC000037520513	506427655	/nfs/dbraw/zinc/42/76/55/506427655.db2.gz	GFGSOQYZVSMQIV-OAHLLOKOSA-N	0	0	367.405	2.791	50	5		FFBARN
C[C@@H]1C[C@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000005262010	506432698	/nfs/dbraw/zinc/43/26/98/506432698.db2.gz	IFQUJLWLDGVOAR-ZYHUDNBSSA-N	0	0	357.332	2.918	50	5		FFBARN
Cc1ccc(C(=O)CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000039570110	506453730	/nfs/dbraw/zinc/45/37/30/506453730.db2.gz	NWGVNCFBYBQROE-IBGZPJMESA-N	0	0	367.361	2.553	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(Br)cc1F	ZINC000007344370	506554262	/nfs/dbraw/zinc/55/42/62/506554262.db2.gz	OEHPYGJXNUZFPS-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2ccccc2F)C1=O	ZINC000008646116	506660545	/nfs/dbraw/zinc/66/05/45/506660545.db2.gz	ZKVMERISSMCANS-GOSISDBHSA-N	0	0	373.340	2.580	50	5		FFBARN
O=C(c1ccc2c(c1)OCCO2)C1CCN(c2ccc([N+](=O)[O-])cn2)CC1	ZINC000012926843	506915614	/nfs/dbraw/zinc/91/56/14/506915614.db2.gz	ZDJFSBTVCQAULG-UHFFFAOYSA-N	0	0	369.377	2.860	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(C(=O)NC2CC2)c1	ZINC000012940119	506917933	/nfs/dbraw/zinc/91/79/33/506917933.db2.gz	TZEBLZBHHPDLCL-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
O=C(COc1cccc(N2CCCC2=O)c1)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000015633107	507052945	/nfs/dbraw/zinc/05/29/45/507052945.db2.gz	KNUUIYHFWHIXCH-UHFFFAOYSA-N	0	0	373.340	2.878	50	5		FFBARN
Cc1cccn2c(=O)c(NC(=O)c3cccc([N+](=O)[O-])c3C)c(C)nc12	ZINC000015865279	507064432	/nfs/dbraw/zinc/06/44/32/507064432.db2.gz	ROTOZCUMCRWVOL-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
COc1ccccc1C(=O)N1CCCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000057142352	507183887	/nfs/dbraw/zinc/18/38/87/507183887.db2.gz	NMDZBEIAVSHTII-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
CSCC[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21	ZINC000020739274	507233717	/nfs/dbraw/zinc/23/37/17/507233717.db2.gz	PRCMQSYSBQWUIX-AWEZNQCLSA-N	0	0	371.422	2.862	50	5		FFBARN
COc1ccc(OC)c2c1CN(C(=O)Nc1ccccc1[N+](=O)[O-])C[C@H]2O	ZINC000024238138	507399960	/nfs/dbraw/zinc/39/99/60/507399960.db2.gz	QXBQDYDRONTSOG-CQSZACIVSA-N	0	0	373.365	2.693	50	5		FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@@H]1COc2ccccc2O1	ZINC000058357584	507409423	/nfs/dbraw/zinc/40/94/23/507409423.db2.gz	WUWAPXAHYCZGNV-OAHLLOKOSA-N	0	0	367.361	2.506	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@H]1C(=O)Nc1ccccc1	ZINC000024984851	507454040	/nfs/dbraw/zinc/45/40/40/507454040.db2.gz	RWYLASQGIZNBJY-INIZCTEOSA-N	0	0	369.377	2.603	50	5		FFBARN
COc1cc(COC(=O)c2cc(C)no2)c([N+](=O)[O-])cc1OC(F)F	ZINC000025052242	507461261	/nfs/dbraw/zinc/46/12/61/507461261.db2.gz	VXOBRTDGOWIOAT-UHFFFAOYSA-N	0	0	358.253	2.858	50	5		FFBARN
COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)c(C(=O)N(C)C)cc1OC	ZINC000025213165	507475860	/nfs/dbraw/zinc/47/58/60/507475860.db2.gz	VUOIUJKHGWPPJQ-UHFFFAOYSA-N	0	0	373.365	2.566	50	5		FFBARN
O=C(NCCc1cccs1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000026523681	507593585	/nfs/dbraw/zinc/59/35/85/507593585.db2.gz	LBFXVLGKXUDJAJ-UHFFFAOYSA-N	0	0	360.439	2.731	50	5		FFBARN
COc1ccc(-c2nnc(Cn3c4cc([N+](=O)[O-])ccc4oc3=O)o2)cc1	ZINC000028006047	507700282	/nfs/dbraw/zinc/70/02/82/507700282.db2.gz	ZAPNRRZCKBGOIM-UHFFFAOYSA-N	0	0	368.305	2.610	50	5		FFBARN
COc1ccc(CN2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1	ZINC000028403911	507723157	/nfs/dbraw/zinc/72/31/57/507723157.db2.gz	BRVIWZKTNKXXJB-AWEZNQCLSA-N	0	0	369.377	2.591	50	5		FFBARN
COC(=O)C[C@@H](Cc1ccccc1)NC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000075092414	508081613	/nfs/dbraw/zinc/08/16/13/508081613.db2.gz	UNZZZVPNZBSRDV-OAHLLOKOSA-N	0	0	357.366	2.891	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccccc3Cl)C2=C(O)N1c1cccc([N+](=O)[O-])c1	ZINC000103539530	508317726	/nfs/dbraw/zinc/31/77/26/508317726.db2.gz	VFNIMOBWDOSCKR-ZFWWWQNUSA-N	0	0	371.736	2.541	50	5		FFBARN
O=C(N=c1scc(-c2ccc([N+](=O)[O-])cc2)n1CCO)c1ccccc1	ZINC000252675799	509857968	/nfs/dbraw/zinc/85/79/68/509857968.db2.gz	VDHDOWXAOHBAGM-UHFFFAOYSA-N	0	0	369.402	2.858	50	5		FFBARN
O=C(C[C@@H]1COCCN1CCOc1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000084374569	527133767	/nfs/dbraw/zinc/13/37/67/527133767.db2.gz	HHTGERKQWPLNIO-OAHLLOKOSA-N	0	0	360.366	2.540	50	5		FFBARN
C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@H](C)[C@@H]1C	ZINC000103938290	570853595	/nfs/dbraw/zinc/85/35/95/570853595.db2.gz	ZINVDDQTRNQZSD-JUFZMCDQSA-N	0	0	363.414	2.663	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCNC(=O)/C=C\c1ccccc1	ZINC000097987631	970006347	/nfs/dbraw/zinc/00/63/47/970006347.db2.gz	WDDHEWDVHJGXEY-YFHOEESVSA-N	0	0	369.377	2.762	50	5		FFBARN
CCOC(=O)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000000674554	210261235	/nfs/dbraw/zinc/26/12/35/210261235.db2.gz	DGBDBYWIGJYRIB-UHFFFAOYSA-N	0	0	373.390	2.898	50	5		FFBARN
CC(=O)N1N=C(c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)O[C@@H]1c1ccccc1F	ZINC000064819839	212044939	/nfs/dbraw/zinc/04/49/39/212044939.db2.gz	GCIYVKVHXZJLBL-MRXNPFEDSA-N	0	0	374.284	2.881	50	5		FFBARN
CCn1c(CNC(=O)c2ccc(OC)c([N+](=O)[O-])c2)nc2ccccc21	ZINC000057822839	211979464	/nfs/dbraw/zinc/97/94/64/211979464.db2.gz	DUWITNMXSNSVAT-UHFFFAOYSA-N	0	0	354.366	2.903	50	5		FFBARN
COc1cc(C=C2NC(=S)NC2=O)ccc1Oc1ccc([N+](=O)[O-])cn1	ZINC000012970972	220047758	/nfs/dbraw/zinc/04/77/58/220047758.db2.gz	KJNJOHKKTPLNHY-WDZFZDKYSA-N	0	0	372.362	2.547	50	5		FFBARN
Cc1cccc(OCCN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1	ZINC000045296751	211813842	/nfs/dbraw/zinc/81/38/42/211813842.db2.gz	BMEJUKAKFVJHBY-UHFFFAOYSA-N	0	0	354.366	2.931	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCCn1c(=O)oc2ccccc21	ZINC000015270883	220150534	/nfs/dbraw/zinc/15/05/34/220150534.db2.gz	OTFFDVBSOHBODS-UHFFFAOYSA-N	0	0	371.349	2.930	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CCCN(C(=O)c2ccoc2)C1	ZINC000023053875	211373263	/nfs/dbraw/zinc/37/32/63/211373263.db2.gz	IYCASLIKKATXCH-CYBMUJFWSA-N	0	0	357.366	2.987	50	5		FFBARN
CCOc1ccc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000021475931	211315353	/nfs/dbraw/zinc/31/53/53/211315353.db2.gz	ALVMEIYLJPFLBN-UHFFFAOYSA-N	0	0	369.421	2.952	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1cccs1)Nc1ccc([N+](=O)[O-])cc1	ZINC000013856614	211064357	/nfs/dbraw/zinc/06/43/57/211064357.db2.gz	FMPOMDPXTHQYDT-UHFFFAOYSA-N	0	0	362.363	2.801	50	5		FFBARN
CCN(CC)C(=O)COc1cc(O)c2c(c1)oc1ccc(OC)cc1c2=O	ZINC000012895831	211004360	/nfs/dbraw/zinc/00/43/60/211004360.db2.gz	AILUKKSULMKYGB-UHFFFAOYSA-N	0	0	371.389	2.908	50	5	biogenic	FFBARN
COc1ccc(OCC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCCCO3)cc1	ZINC000010964073	210878930	/nfs/dbraw/zinc/87/89/30/210878930.db2.gz	HYDJPLQRNFMCID-UHFFFAOYSA-N	0	0	374.349	2.782	50	5		FFBARN
C[C@H](Sc1nnc2ccccn21)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000005212917	210608232	/nfs/dbraw/zinc/60/82/32/210608232.db2.gz	CNEMDKINOKEPJE-VIFPVBQESA-N	0	0	361.358	2.896	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2cccc(NC(C)=O)c2)cc([N+](=O)[O-])c1	ZINC000004177357	210515426	/nfs/dbraw/zinc/51/54/26/210515426.db2.gz	QKRPCBRHOOMXJM-UHFFFAOYSA-N	0	0	357.322	2.592	50	5		FFBARN
CCOC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)cc1	ZINC000003194852	210453832	/nfs/dbraw/zinc/45/38/32/210453832.db2.gz	NRFBIGCEOUFZEM-UHFFFAOYSA-N	0	0	359.294	2.932	50	5		FFBARN
O=[N+]([O-])c1cnn(C(=S)Nc2cnn(Cc3ccccc3Cl)c2)c1	ZINC000002802291	210425216	/nfs/dbraw/zinc/42/52/16/210425216.db2.gz	XOQPIUGNHOAIKT-UHFFFAOYSA-N	0	0	362.802	2.935	50	5		FFBARN
COCCn1c(=O)c2c(=O)c3ccccc3oc2nc1-c1ccc(F)cc1	ZINC000002434236	210397943	/nfs/dbraw/zinc/39/79/43/210397943.db2.gz	RPGYVFNEGICKJJ-UHFFFAOYSA-N	0	0	366.348	2.955	50	5		FFBARN
Cc1nn(CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)c(C)c1[N+](=O)[O-]	ZINC000002101858	210380757	/nfs/dbraw/zinc/38/07/57/210380757.db2.gz	MZDUKISGTYNRBA-UHFFFAOYSA-N	0	0	353.722	2.608	50	5		FFBARN
C[C@H](C(=O)Nc1nnc(CCc2ccccc2)s1)n1cc([N+](=O)[O-])cn1	ZINC000001432067	210353536	/nfs/dbraw/zinc/35/35/36/210353536.db2.gz	LCSGRBAZPVUZKV-LLVKDONJSA-N	0	0	372.410	2.628	50	5		FFBARN
O=[N+]([O-])c1ccccc1CN1CCN(Cc2ccc3c(c2)OCO3)CC1	ZINC000001227616	210336894	/nfs/dbraw/zinc/33/68/94/210336894.db2.gz	YBNXHYNHRCFQBN-UHFFFAOYSA-N	0	0	355.394	2.641	50	5		FFBARN
COc1cccc(OC(=O)c2cc3cc([N+](=O)[O-])cc(OC)c3oc2=O)c1	ZINC000001132555	210323705	/nfs/dbraw/zinc/32/37/05/210323705.db2.gz	QUVJLLLUWXBFOX-UHFFFAOYSA-N	0	0	371.301	2.938	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1c(=O)sc2ccccc21	ZINC000001134993	210323478	/nfs/dbraw/zinc/32/34/78/210323478.db2.gz	HXEWMXXUSDLDEY-UHFFFAOYSA-N	0	0	359.363	2.619	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CC(=O)Nc1ccc(OC(F)(F)Cl)cc1	ZINC000001072728	210313758	/nfs/dbraw/zinc/31/37/58/210313758.db2.gz	GIIGHJKQSJPJEY-UHFFFAOYSA-N	0	0	360.704	2.906	50	5		FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccccc2[N+](=O)[O-])NC(=O)N1	ZINC000000956667	210295184	/nfs/dbraw/zinc/29/51/84/210295184.db2.gz	KIPYWUZZUCRLHD-MRXNPFEDSA-N	0	0	352.350	2.861	50	5		FFBARN
Cc1nn(C)c(C)c1N1C(=O)c2cccc3cc([N+](=O)[O-])cc(c32)C1=O	ZINC000000840955	210279625	/nfs/dbraw/zinc/27/96/25/210279625.db2.gz	PTSVWYROZUUAET-UHFFFAOYSA-N	0	0	350.334	2.899	50	5		FFBARN
O=C(NCc1ccccc1Cl)[C@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1	ZINC000000834682	210278732	/nfs/dbraw/zinc/27/87/32/210278732.db2.gz	LOHBODDNWAYKQV-ZDUSSCGKSA-N	0	0	373.796	2.918	50	5		FFBARN
CC(C)OC(=O)c1ccc2c(c1)C(=O)N(c1cccc([N+](=O)[O-])c1)C2=O	ZINC000000797304	210271840	/nfs/dbraw/zinc/27/18/40/210271840.db2.gz	QIMAUJFQHOXPLO-UHFFFAOYSA-N	0	0	354.318	2.961	50	5		FFBARN
CC1(C)Cc2cccc(OCCNC(=O)c3ccc(N)c([N+](=O)[O-])c3)c2O1	ZINC000024448968	220449507	/nfs/dbraw/zinc/44/95/07/220449507.db2.gz	FMKUAJCUSUPAAZ-UHFFFAOYSA-N	0	0	371.393	2.699	50	5		FFBARN
O=C(NCCNc1ccc(C(F)(F)F)cn1)c1ccccc1[N+](=O)[O-]	ZINC000032818323	220684306	/nfs/dbraw/zinc/68/43/06/220684306.db2.gz	LNVDCPPRZAKEJC-UHFFFAOYSA-N	0	0	354.288	2.851	50	5		FFBARN
COCCN(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1F	ZINC000055235758	221062726	/nfs/dbraw/zinc/06/27/26/221062726.db2.gz	FWGBWVRUJTYFBD-UHFFFAOYSA-N	0	0	374.415	2.633	50	5		FFBARN
Nc1nccc([C@H]2CCCN(c3ccc4ncccc4c3[N+](=O)[O-])C2)n1	ZINC000170616222	132264835	/nfs/dbraw/zinc/26/48/35/132264835.db2.gz	GMVVDXBMOXVDST-LBPRGKRZSA-N	0	0	350.382	2.899	50	5		FFBARN
O=C(Nc1cccc(Cl)c1N1CCOCC1)c1ccc([N+](=O)[O-])o1	ZINC000002865851	132384199	/nfs/dbraw/zinc/38/41/99/132384199.db2.gz	HRXFKGFAASAQSY-UHFFFAOYSA-N	0	0	351.746	2.930	50	5		FFBARN
COc1ccc(Nc2nc(N3CCC[C@H](C)C3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004306117	132386745	/nfs/dbraw/zinc/38/67/45/132386745.db2.gz	SKSKDYDNBCQNQF-NSHDSACASA-N	0	0	358.402	2.956	50	5		FFBARN
O=c1c([N+](=O)[O-])c(N2CCOCC2)c2ccccc2n1-c1ccccc1	ZINC000004310963	132386801	/nfs/dbraw/zinc/38/68/01/132386801.db2.gz	PNUFJHGTUAPVFD-UHFFFAOYSA-N	0	0	351.362	2.736	50	5		FFBARN
COc1cccc(Nc2cc(N3CCOCC3)c3nonc3c2[N+](=O)[O-])c1	ZINC000004707163	132824101	/nfs/dbraw/zinc/82/41/01/132824101.db2.gz	WHKNKJABNGBMGT-UHFFFAOYSA-N	0	0	371.353	2.720	50	5		FFBARN
COc1ccccc1NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004841367	132824850	/nfs/dbraw/zinc/82/48/50/132824850.db2.gz	VBJVEBXMMTZZFF-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
C[C@H](CC(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1	ZINC000057140759	136128281	/nfs/dbraw/zinc/12/82/81/136128281.db2.gz	JVCJHJJXRPZNOT-OAHLLOKOSA-N	0	0	354.410	2.832	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccccc1Cl	ZINC000103889826	222345211	/nfs/dbraw/zinc/34/52/11/222345211.db2.gz	HQLLCKYHWPVNOU-UKRRQHHQSA-N	0	0	371.736	2.541	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N2C(=O)CCC2=O)cc1	ZINC000001518557	506263611	/nfs/dbraw/zinc/26/36/11/506263611.db2.gz	FOGIOTBQWPDMCV-UHFFFAOYSA-N	0	0	369.333	2.509	50	5		FFBARN
CN1C(=O)c2ccc(NC(=O)c3cc(Cl)ccc3[N+](=O)[O-])cc2C1=O	ZINC000002485190	506281771	/nfs/dbraw/zinc/28/17/71/506281771.db2.gz	HOOLNVXNVVVMLP-UHFFFAOYSA-N	0	0	359.725	2.726	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000032727302	506283777	/nfs/dbraw/zinc/28/37/77/506283777.db2.gz	YLAVMWCNCNXZEU-ZDUSSCGKSA-N	0	0	357.366	2.549	50	5		FFBARN
CNc1ccc(C(=O)N2CCC[C@@H]2C(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000032796956	506297449	/nfs/dbraw/zinc/29/74/49/506297449.db2.gz	FVJXFIAYJKEHNZ-MRXNPFEDSA-N	0	0	368.393	2.880	50	5		FFBARN
Cc1ccc(Cl)cc1NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000003598612	506346866	/nfs/dbraw/zinc/34/68/66/506346866.db2.gz	FDGGWEPWPRSZQH-UHFFFAOYSA-N	0	0	373.752	2.791	50	5		FFBARN
COC(=O)c1ccc(N2CCN(c3ccccc3OC)CC2)c([N+](=O)[O-])c1	ZINC000004182243	506363564	/nfs/dbraw/zinc/36/35/64/506363564.db2.gz	BNCOAWXQXHYGOQ-UHFFFAOYSA-N	0	0	371.393	2.717	50	5		FFBARN
C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1	ZINC000004219362	506366405	/nfs/dbraw/zinc/36/64/05/506366405.db2.gz	SHDSKLUMWXTGDD-ZDUSSCGKSA-N	0	0	374.418	2.935	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@H]2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000004256032	506368408	/nfs/dbraw/zinc/36/84/08/506368408.db2.gz	BQRURLIZQQYDGS-QSGSBWRWSA-N	0	0	359.382	2.955	50	5		FFBARN
COc1cc(OC)cc(-c2nnc(NC(=O)c3cccc([N+](=O)[O-])c3)o2)c1	ZINC000004330104	506373406	/nfs/dbraw/zinc/37/34/06/506373406.db2.gz	KVVQBZNGLVUKQR-UHFFFAOYSA-N	0	0	370.321	2.914	50	5		FFBARN
O=C1CCCN1c1ccc(S(=O)(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000004596973	506385327	/nfs/dbraw/zinc/38/53/27/506385327.db2.gz	JQGFYFPXSTUEPI-UHFFFAOYSA-N	0	0	361.379	2.522	50	5		FFBARN
CC(=O)N1CCN(c2cc(Br)c([N+](=O)[O-])cc2F)C[C@H]1C	ZINC000004593443	506385349	/nfs/dbraw/zinc/38/53/49/506385349.db2.gz	XTLJWSKNLHQHSF-MRVPVSSYSA-N	0	0	360.183	2.553	50	5		FFBARN
CCOC(=O)c1c(C)c(C)sc1NC(=O)[C@H](C)n1cc([N+](=O)[O-])cn1	ZINC000004686792	506387917	/nfs/dbraw/zinc/38/79/17/506387917.db2.gz	FIVJTLNIZKUVEY-VIFPVBQESA-N	0	0	366.399	2.846	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004833943	506397564	/nfs/dbraw/zinc/39/75/64/506397564.db2.gz	RCSXIQXXJKLASH-UHFFFAOYSA-N	0	0	374.324	2.879	50	5		FFBARN
Cc1cccc(CCNc2c([N+](=O)[O-])nn(-c3ccccc3C)[n+]2[O-])c1	ZINC000004971351	506410857	/nfs/dbraw/zinc/41/08/57/506410857.db2.gz	ITIJYGWTASNRAB-UHFFFAOYSA-N	0	0	353.382	2.685	50	5		FFBARN
C[C@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000004979794	506411152	/nfs/dbraw/zinc/41/11/52/506411152.db2.gz	MXUTZLYIYUXFEC-NSHDSACASA-N	0	0	372.333	2.550	50	5		FFBARN
CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@](O)(c2cccc([N+](=O)[O-])c2)C1	ZINC000005232394	506430875	/nfs/dbraw/zinc/43/08/75/506430875.db2.gz	UFACBOHXFLUWTR-QGZVFWFLSA-N	0	0	370.321	2.570	50	5		FFBARN
CCCCOC(=O)c1nn2cc(-c3n[nH]cc3[N+](=O)[O-])cnc2c1Cl	ZINC000005298276	506433565	/nfs/dbraw/zinc/43/35/65/506433565.db2.gz	LURQICYPYADIHN-UHFFFAOYSA-N	0	0	364.749	2.638	50	5		FFBARN
Cn1c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2)nnc1-c1ccco1	ZINC000005864851	506459515	/nfs/dbraw/zinc/45/95/15/506459515.db2.gz	PIIBUGSNNGLBSR-UHFFFAOYSA-N	0	0	359.367	2.714	50	5		FFBARN
CN(C)n1ccc2nc3ccn(CCC4=CCCCC4)c(=O)c3cc2c1=O	ZINC000040398679	506481085	/nfs/dbraw/zinc/48/10/85/506481085.db2.gz	ZMKRNCCLFBNIKX-UHFFFAOYSA-N	0	0	364.449	2.800	50	5		FFBARN
Cc1ccccc1OCCOC(=O)c1cc([N+](=O)[O-])ccc1NCCO	ZINC000006465277	506484479	/nfs/dbraw/zinc/48/44/79/506484479.db2.gz	FEKZKMVXPSUTGH-UHFFFAOYSA-N	0	0	360.366	2.543	50	5		FFBARN
COc1ccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000006552961	506488030	/nfs/dbraw/zinc/48/80/30/506488030.db2.gz	FUNCCNPAHYUWFW-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1cc(F)ccc1F	ZINC000007206852	506543847	/nfs/dbraw/zinc/54/38/47/506543847.db2.gz	BSVXXQVFAOGBGR-MRVPVSSYSA-N	0	0	365.292	2.639	50	5		FFBARN
COc1cc2c(cc1OC)CN(C(=O)COc1cccc([N+](=O)[O-])c1)CC2	ZINC000007489211	506567729	/nfs/dbraw/zinc/56/77/29/506567729.db2.gz	WHQUNRHXRVAVKB-UHFFFAOYSA-N	0	0	372.377	2.576	50	5		FFBARN
CSc1ncccc1C(=O)O[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007657632	506579279	/nfs/dbraw/zinc/57/92/79/506579279.db2.gz	XUVLJKVZRVYPLY-SNVBAGLBSA-N	0	0	361.379	2.896	50	5		FFBARN
O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Br)c1	ZINC000007842722	506596418	/nfs/dbraw/zinc/59/64/18/506596418.db2.gz	BBCCTQCCCQFSKE-CQSZACIVSA-N	0	0	365.183	2.821	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)N[C@H]1CCOc2ccccc21	ZINC000007909606	506600192	/nfs/dbraw/zinc/60/01/92/506600192.db2.gz	YPFZNZNWSAZQFL-KRWDZBQOSA-N	0	0	371.393	2.907	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000007985492	506610011	/nfs/dbraw/zinc/61/00/11/506610011.db2.gz	KKXRQLPQMWKDJK-QGZVFWFLSA-N	0	0	368.389	2.729	50	5		FFBARN
Cc1ccnn1-c1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)cc1	ZINC000008183638	506629707	/nfs/dbraw/zinc/62/97/07/506629707.db2.gz	XZEHYGRSEHWWMB-UHFFFAOYSA-N	0	0	365.393	2.931	50	5		FFBARN
O=C(NCc1ccccc1F)c1cc(N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000008331371	506643564	/nfs/dbraw/zinc/64/35/64/506643564.db2.gz	ZFRZYWXMWQSQJX-UHFFFAOYSA-N	0	0	359.357	2.501	50	5		FFBARN
O=C(N=c1[nH]c2ccccc2[nH]1)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000008405692	506649574	/nfs/dbraw/zinc/64/95/74/506649574.db2.gz	OXMOLDOJROOMPB-UHFFFAOYSA-N	0	0	351.366	2.746	50	5		FFBARN
O=[N+]([O-])c1cnc(N2CCO[C@H](c3ccccc3F)C2)nc1NC1CC1	ZINC000066814246	506649864	/nfs/dbraw/zinc/64/98/64/506649864.db2.gz	WXEFOUIMFAGEOA-HNNXBMFYSA-N	0	0	359.361	2.676	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000009095369	506680868	/nfs/dbraw/zinc/68/08/68/506680868.db2.gz	AMDZRNDCEUFLMT-GFCCVEGCSA-N	0	0	361.398	2.723	50	5		FFBARN
O=C(NC[C@@H]1COc2ccccc2O1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000009157457	506685291	/nfs/dbraw/zinc/68/52/91/506685291.db2.gz	SGXRGNSCMFLZOV-CQSZACIVSA-N	0	0	369.377	2.739	50	5		FFBARN
Cc1sc2ncnc(N[C@@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C	ZINC000011170321	506768350	/nfs/dbraw/zinc/76/83/50/506768350.db2.gz	HAGOYDBUFBWQDO-ZFWWWQNUSA-N	0	0	374.422	2.723	50	5		FFBARN
CNc1ccc(C(=O)NCc2ccccc2Cn2cccn2)cc1[N+](=O)[O-]	ZINC000012587467	506882186	/nfs/dbraw/zinc/88/21/86/506882186.db2.gz	NIWVJOCHNKPQJI-UHFFFAOYSA-N	0	0	365.393	2.811	50	5		FFBARN
COc1ccccc1CNC(=O)c1ccc2nc3ccccc3c(=O)n2c1	ZINC000057477668	507275471	/nfs/dbraw/zinc/27/54/71/507275471.db2.gz	WXJHRDGLOMPEQV-UHFFFAOYSA-N	0	0	359.385	2.786	50	5		FFBARN
CN(Cc1nnnn1-c1ccccc1)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000057503298	507281322	/nfs/dbraw/zinc/28/13/22/507281322.db2.gz	XEWFPKCHFWQCBU-UHFFFAOYSA-N	0	0	358.789	2.856	50	5		FFBARN
O=c1c(C(F)(F)F)cccn1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000047370045	507317760	/nfs/dbraw/zinc/31/77/60/507317760.db2.gz	GZJMMRGSTLLZHS-UHFFFAOYSA-N	0	0	366.255	2.874	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC(=O)N2CCCC[C@@H]2C)CC1	ZINC000023057678	507328036	/nfs/dbraw/zinc/32/80/36/507328036.db2.gz	OUVUVGOOYBYVAA-IRXDYDNUSA-N	0	0	374.485	2.674	50	5		FFBARN
O=[N+]([O-])c1ccccc1-c1ccc(CN2CCN(c3ncccn3)CC2)o1	ZINC000023280591	507343847	/nfs/dbraw/zinc/34/38/47/507343847.db2.gz	PCWAJIXBVMUSEX-UHFFFAOYSA-N	0	0	365.393	2.967	50	5		FFBARN
CCc1cc2c(ncnc2N[C@@H](CO)[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000024060895	507389229	/nfs/dbraw/zinc/38/92/29/507389229.db2.gz	AQQIGBDKEACOEU-GJZGRUSLSA-N	0	0	374.422	2.668	50	5		FFBARN
Cc1cc(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)ccc1[N+](=O)[O-]	ZINC000024208837	507398056	/nfs/dbraw/zinc/39/80/56/507398056.db2.gz	WVTRUHTVGKNFGK-SFHVURJKSA-N	0	0	369.421	2.707	50	5		FFBARN
COc1ccc(S(=O)(=O)N2CCC[C@@H]2c2ccncc2)cc1[N+](=O)[O-]	ZINC000024434517	507410275	/nfs/dbraw/zinc/41/02/75/507410275.db2.gz	OXFKTUZQNIJSFE-CQSZACIVSA-N	0	0	363.395	2.524	50	5		FFBARN
CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@@H]2COc3ccccc3O2)c1	ZINC000025043968	507461426	/nfs/dbraw/zinc/46/14/26/507461426.db2.gz	CLHBEMGCKGLTSG-LLVKDONJSA-N	0	0	360.391	2.887	50	5		FFBARN
CCOc1ccc(NC(=O)CN(C)c2ccc([N+](=O)[O-])cn2)cc1OCC	ZINC000025370209	507495147	/nfs/dbraw/zinc/49/51/47/507495147.db2.gz	LGBSJAXQBQIYLJ-UHFFFAOYSA-N	0	0	374.397	2.862	50	5		FFBARN
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@@H](C)O1	ZINC000079064727	507929469	/nfs/dbraw/zinc/92/94/69/507929469.db2.gz	KEKDZKSTYYDXQC-HTQZYQBOSA-N	0	0	361.167	2.746	50	5		FFBARN
CC(C)(C)OC(=O)N1CSC[C@H]1C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000080344021	508066769	/nfs/dbraw/zinc/06/67/69/508066769.db2.gz	CIVOWSCIKHTXBI-LBPRGKRZSA-N	0	0	353.400	2.843	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1NCC(C)(C)CCCO	ZINC000095458793	508186563	/nfs/dbraw/zinc/18/65/63/508186563.db2.gz	UZVRKINTQHRFRY-UHFFFAOYSA-N	0	0	355.347	2.500	50	5		FFBARN
CS(=O)(=O)c1cc([N+](=O)[O-])c(OC(F)(F)F)cc1Br	ZINC000095496049	508189030	/nfs/dbraw/zinc/18/90/30/508189030.db2.gz	KCHRASZRDOIERM-UHFFFAOYSA-N	0	0	364.095	2.659	50	5		FFBARN
Nc1nccc([C@H]2CCCN(C(=O)c3ccc([N+](=O)[O-])cc3Cl)C2)n1	ZINC000253410469	509879510	/nfs/dbraw/zinc/87/95/10/509879510.db2.gz	AQOQUDLSXFPKCS-JTQLQIEISA-N	0	0	361.789	2.640	50	5		FFBARN
O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCCN(CC(F)(F)F)C3)cc2N1	ZINC000253426856	509881071	/nfs/dbraw/zinc/88/10/71/509881071.db2.gz	BGIVMSSWMCVAHP-NSHDSACASA-N	0	0	372.347	2.918	50	5		FFBARN
CCN(Cc1c(C)nn(CC)c1C)S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000020602078	521278809	/nfs/dbraw/zinc/27/88/09/521278809.db2.gz	BZAQMDJUZQPSJA-UHFFFAOYSA-N	0	0	366.443	2.639	50	5		FFBARN
O=C1C[C@@H](c2ccccc2[N+](=O)[O-])c2c(=O)[nH]c(N3CCCCC3)nc2N1	ZINC000670416096	571336734	/nfs/dbraw/zinc/33/67/34/571336734.db2.gz	KHSCQLKHNBRXRX-LBPRGKRZSA-N	0	0	369.381	2.555	50	5		FFBARN
COC(=O)[C@H](Cc1ccccc1)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000002831270	966389248	/nfs/dbraw/zinc/38/92/48/966389248.db2.gz	GQMMCGGEGLZMNF-DVQDXYAYSA-N	0	0	354.362	2.509	50	5		FFBARN
COc1ccc(OC)c(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)c1	ZINC000000725777	210266012	/nfs/dbraw/zinc/26/60/12/210266012.db2.gz	VKXGCNDTMZFEKI-GDNBJRDFSA-N	0	0	354.318	2.957	50	5		FFBARN
CC(C)(C)n1nc2c(c1NC(=O)c1ccccc1[N+](=O)[O-])C[S@](=O)C2	ZINC000004106090	219543272	/nfs/dbraw/zinc/54/32/72/219543272.db2.gz	YYEFHZGUHGEGIC-RUZDIDTESA-N	0	0	362.411	2.561	50	5		FFBARN
Cn1nnnc1-c1cccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1	ZINC000008728809	219867945	/nfs/dbraw/zinc/86/79/45/219867945.db2.gz	IJSBIDFVJDVSJI-UHFFFAOYSA-N	0	0	358.745	2.691	50	5		FFBARN
COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(C(=O)N(C)C)cc1OC	ZINC000025213081	211426273	/nfs/dbraw/zinc/42/62/73/211426273.db2.gz	VUNUTMSFRHLJBI-UHFFFAOYSA-N	0	0	373.365	2.566	50	5		FFBARN
Cc1cccc(C(=O)N2CCN(CCOc3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000023641600	211393847	/nfs/dbraw/zinc/39/38/47/211393847.db2.gz	HPNLAKXUFNBEQC-UHFFFAOYSA-N	0	0	369.421	2.740	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H](c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	ZINC000022028046	211335246	/nfs/dbraw/zinc/33/52/46/211335246.db2.gz	VJXJVGFTMDIEQI-GOSISDBHSA-N	0	0	355.394	2.915	50	5		FFBARN
COc1ccc(OCC2=NN(C(C)=O)[C@H](c3cccc([N+](=O)[O-])c3)O2)cc1	ZINC000021151676	211309785	/nfs/dbraw/zinc/30/97/85/211309785.db2.gz	GBSLLKLETFLYRD-SFHVURJKSA-N	0	0	371.349	2.873	50	5		FFBARN
CC(=O)N1N=C(c2ccc3c(c2)OCO3)O[C@H]1c1ccccc1[N+](=O)[O-]	ZINC000021092026	211304887	/nfs/dbraw/zinc/30/48/87/211304887.db2.gz	SCYQNNYUDAZPQJ-KRWDZBQOSA-N	0	0	355.306	2.563	50	5		FFBARN
COc1ccc(C2=NN(C(C)=O)[C@H](c3ccc([N+](=O)[O-])cc3)O2)cc1OC	ZINC000021090604	211304952	/nfs/dbraw/zinc/30/49/52/211304952.db2.gz	BHTLYQJCVBKEEH-SFHVURJKSA-N	0	0	371.349	2.851	50	5		FFBARN
C[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)c1ccc(F)c(F)c1	ZINC000016207994	211156640	/nfs/dbraw/zinc/15/66/40/211156640.db2.gz	OVRGVNXYFHJPKW-MRVPVSSYSA-N	0	0	350.277	2.883	50	5		FFBARN
COc1cc2c(cc1OC)CN(C(=O)Cc1ccc([N+](=O)[O-])cc1)CC2	ZINC000015977309	211151453	/nfs/dbraw/zinc/15/14/53/211151453.db2.gz	LOSARNASPVXQAZ-UHFFFAOYSA-N	0	0	356.378	2.739	50	5		FFBARN
CCCc1cc(=O)[nH]c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)n1	ZINC000016045265	211153612	/nfs/dbraw/zinc/15/36/12/211153612.db2.gz	YDKWQXNUYAFLFM-UHFFFAOYSA-N	0	0	363.395	2.789	50	5		FFBARN
O=C(CCNc1ccc([N+](=O)[O-])cn1)NCCc1c[nH]c2ccccc12	ZINC000013734492	211055878	/nfs/dbraw/zinc/05/58/78/211055878.db2.gz	HKEDQWFIJBWGCK-UHFFFAOYSA-N	0	0	353.382	2.632	50	5		FFBARN
CCNC(=O)c1cccc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c1	ZINC000013624070	211043773	/nfs/dbraw/zinc/04/37/73/211043773.db2.gz	VVIKKJRXAFJOLZ-UHFFFAOYSA-N	0	0	358.310	2.505	50	5		FFBARN
COc1ccc(NC(=O)CSc2nnc(C(C)C)[nH]2)c([N+](=O)[O-])c1	ZINC000013143754	211026388	/nfs/dbraw/zinc/02/63/88/211026388.db2.gz	LNPYFWSNRQFUAG-UHFFFAOYSA-N	0	0	351.388	2.576	50	5		FFBARN
Cc1ccccc1-c1noc(Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)n1	ZINC000013000808	211019551	/nfs/dbraw/zinc/01/95/51/211019551.db2.gz	GVKXHRCIAHOTIQ-UHFFFAOYSA-N	0	0	363.333	2.711	50	5		FFBARN
O=C(CNc1ccc(F)c([N+](=O)[O-])c1)Nc1ccccc1C(=O)NC1CC1	ZINC000012977716	211014415	/nfs/dbraw/zinc/01/44/15/211014415.db2.gz	AWSDEYSKIHQEIR-UHFFFAOYSA-N	0	0	372.356	2.677	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(NC(=O)C2CC2)cc1	ZINC000012435231	210956390	/nfs/dbraw/zinc/95/63/90/210956390.db2.gz	HISCLRHUOFYNQH-UHFFFAOYSA-N	0	0	355.350	2.961	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NCC(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000011549261	210885743	/nfs/dbraw/zinc/88/57/43/210885743.db2.gz	YUQSMSQXTZPAEW-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
CCOc1cc(C(=O)N=c2[nH]c3ccccc3[nH]2)c([N+](=O)[O-])cc1OC	ZINC000009337602	210827982	/nfs/dbraw/zinc/82/79/82/210827982.db2.gz	CNOMZQSAAYGFTI-UHFFFAOYSA-N	0	0	356.338	2.553	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2NCCc1ccc(Cl)cc1	ZINC000005344430	210614837	/nfs/dbraw/zinc/61/48/37/210614837.db2.gz	ZARIYOLTPJXABM-UHFFFAOYSA-N	0	0	365.798	2.529	50	5		FFBARN
Nc1ccc([N+](=O)[O-])cc1C(=O)O[C@H](C(=O)N1CCCC1)c1ccccc1	ZINC000005278550	210612713	/nfs/dbraw/zinc/61/27/13/210612713.db2.gz	ZZYWHPCUVJGAFM-KRWDZBQOSA-N	0	0	369.377	2.698	50	5		FFBARN
COc1ccc(NC(=O)COC(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1	ZINC000003224668	210456320	/nfs/dbraw/zinc/45/63/20/210456320.db2.gz	JRAFVRAIWJXWNE-IZZDOVSWSA-N	0	0	356.334	2.799	50	5		FFBARN
Cc1nn(CC(=O)NCc2cc3cc(Cl)ccc3[nH]2)c(C)c1[N+](=O)[O-]	ZINC000002760647	210420113	/nfs/dbraw/zinc/42/01/13/210420113.db2.gz	RXIWAMMDFJTJEX-UHFFFAOYSA-N	0	0	361.789	2.859	50	5		FFBARN
O=c1ccc(C(F)(F)F)cn1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000002620047	210408831	/nfs/dbraw/zinc/40/88/31/210408831.db2.gz	XCVQLENDAAXYKO-UHFFFAOYSA-N	0	0	356.256	2.690	50	5		FFBARN
COCCCn1c(=O)c2c(=O)c3ccc(OC)cc3oc2nc1C(C)C	ZINC000002343117	210391191	/nfs/dbraw/zinc/39/11/91/210391191.db2.gz	PPNRUAZLHVFOEJ-UHFFFAOYSA-N	0	0	358.394	2.671	50	5		FFBARN
CCOc1ccc(C(=O)NC(=S)Nc2cccc(C)n2)cc1[N+](=O)[O-]	ZINC000001173599	210329328	/nfs/dbraw/zinc/32/93/28/210329328.db2.gz	VPBHRXGXJLTINN-UHFFFAOYSA-N	0	0	360.395	2.824	50	5		FFBARN
COc1cc(C(=O)Nc2nnc(CC(C)C)s2)c([N+](=O)[O-])cc1OC	ZINC000001152751	210326290	/nfs/dbraw/zinc/32/62/90/210326290.db2.gz	QINGNMZERMDILN-UHFFFAOYSA-N	0	0	366.399	2.914	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)NCc3ccc(C)cc3)c(=O)oc21	ZINC000001070656	210313791	/nfs/dbraw/zinc/31/37/91/210313791.db2.gz	JNPKOUVPEJAIJJ-UHFFFAOYSA-N	0	0	368.345	2.948	50	5		FFBARN
CC(C)N1c2ccccc2[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000001077841	210312835	/nfs/dbraw/zinc/31/28/35/210312835.db2.gz	KDAMWLREFUTWDR-LJQANCHMSA-N	0	0	354.362	2.810	50	5		FFBARN
COc1cc(CO)ccc1Oc1nc([N+](=O)[O-])nn1Cc1ccccc1F	ZINC000001059153	210311080	/nfs/dbraw/zinc/31/10/80/210311080.db2.gz	BAGCGHDJIDFEGF-UHFFFAOYSA-N	0	0	374.328	2.667	50	5		FFBARN
Cc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000000850451	210280195	/nfs/dbraw/zinc/28/01/95/210280195.db2.gz	FZWVFTHKJVTYCI-UHFFFAOYSA-N	0	0	353.334	2.528	50	5		FFBARN
CC1=C(C(=O)OCc2ccco2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000844462	210278651	/nfs/dbraw/zinc/27/86/51/210278651.db2.gz	YYTHXCTWIGEWMU-OAHLLOKOSA-N	0	0	357.322	2.559	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1Sc1nc2nc(C)cc(C)n2n1	ZINC000032923354	220700750	/nfs/dbraw/zinc/70/07/50/220700750.db2.gz	RYVSZHFEMRNJFT-UHFFFAOYSA-N	0	0	359.367	2.587	50	5		FFBARN
CC(=O)c1ccc(N2CCN(c3nc(C)cc(C)n3)CC2)c([N+](=O)[O-])c1	ZINC000097083980	132227250	/nfs/dbraw/zinc/22/72/50/132227250.db2.gz	DKLHKWVJCYWBQD-UHFFFAOYSA-N	0	0	355.398	2.531	50	5		FFBARN
Cc1cccc(Nc2nc(N3C[C@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])c1	ZINC000005068640	132826339	/nfs/dbraw/zinc/82/63/39/132826339.db2.gz	QBAOLCNCQYYCFT-RYUDHWBXSA-N	0	0	358.402	2.633	50	5		FFBARN
CS(=O)(=O)c1ccc(N2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1	ZINC000005638130	132829210	/nfs/dbraw/zinc/82/92/10/132829210.db2.gz	RIBYXAZYIDQOGX-VIFPVBQESA-N	0	0	352.334	2.777	50	5		FFBARN
O=C(NCc1cccnc1)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]12	ZINC000024536599	132911440	/nfs/dbraw/zinc/91/14/40/132911440.db2.gz	QVBRSFIHSOHDHL-HKUYNNGSSA-N	0	0	366.421	2.837	50	5		FFBARN
COc1cc(CN2CCN(c3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000055543548	136127063	/nfs/dbraw/zinc/12/70/63/136127063.db2.gz	HHBSQWADXFHNAM-UHFFFAOYSA-N	0	0	357.410	2.934	50	5		FFBARN
CCCCCCn1c(=N)c(C(=O)OC)cc2c1nc1c(C)cccn1c2=O	ZINC000100851719	222255081	/nfs/dbraw/zinc/25/50/81/222255081.db2.gz	VMUXANMABMILGG-UHFFFAOYSA-N	0	0	368.437	2.804	50	5		FFBARN
Cc1ccc(NC(=S)NCCn2cc([N+](=O)[O-])cn2)c(OC(F)F)c1	ZINC000002728505	506290092	/nfs/dbraw/zinc/29/00/92/506290092.db2.gz	GEPKTTDAUYWHMJ-UHFFFAOYSA-N	0	0	371.369	2.688	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000032769188	506293776	/nfs/dbraw/zinc/29/37/76/506293776.db2.gz	RQTLYFPQIMGMPR-ZDUSSCGKSA-N	0	0	369.377	2.619	50	5		FFBARN
O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000032779516	506295682	/nfs/dbraw/zinc/29/56/82/506295682.db2.gz	LDDJNHPJCAFGHG-UHFFFAOYSA-N	0	0	368.349	2.888	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000032904372	506308678	/nfs/dbraw/zinc/30/86/78/506308678.db2.gz	WHXQZMZNLVOPRK-OAHLLOKOSA-N	0	0	365.393	2.586	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc2nc3n(c2c1)CCC3	ZINC000032935357	506314091	/nfs/dbraw/zinc/31/40/91/506314091.db2.gz	CPNVZTXNCHDOKK-UHFFFAOYSA-N	0	0	365.393	2.733	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccc([N+](=O)[O-])c1	ZINC000003257068	506317527	/nfs/dbraw/zinc/31/75/27/506317527.db2.gz	WMSYSGHMGFSTTD-UHFFFAOYSA-N	0	0	360.278	2.727	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccc(F)cc1	ZINC000003510032	506338313	/nfs/dbraw/zinc/33/83/13/506338313.db2.gz	UHPFMIOPFVEGKC-JTQLQIEISA-N	0	0	362.313	2.927	50	5		FFBARN
Cc1cc2ccccc2n1CC(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000053275091	506346767	/nfs/dbraw/zinc/34/67/67/506346767.db2.gz	SGYBPUFNOYTURJ-GOSISDBHSA-N	0	0	353.378	2.708	50	5		FFBARN
Cc1c(Cl)c([N+](=O)[O-])nn1CCCC(=O)NCCc1ccccc1	ZINC000003896221	506351845	/nfs/dbraw/zinc/35/18/45/506351845.db2.gz	IVRDBIUIZVHEED-UHFFFAOYSA-N	0	0	350.806	2.892	50	5		FFBARN
O=[N+]([O-])c1cccc(C2=Nn3c(nnc3-c3ccccc3O)SC2)c1	ZINC000003911155	506353410	/nfs/dbraw/zinc/35/34/10/506353410.db2.gz	NPEWMSBNILIWKP-UHFFFAOYSA-N	0	0	353.363	2.917	50	5		FFBARN
CCc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000004037856	506355757	/nfs/dbraw/zinc/35/57/57/506355757.db2.gz	YFZKGCCMEQSCNE-UHFFFAOYSA-N	0	0	367.361	2.782	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)Nc2cc([N+](=O)[O-])ccc2Cl)cc1	ZINC000004143328	506363041	/nfs/dbraw/zinc/36/30/41/506363041.db2.gz	WLFRKALHVPBUGY-UHFFFAOYSA-N	0	0	357.731	2.957	50	5		FFBARN
CCCCN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1	ZINC000004504732	506379589	/nfs/dbraw/zinc/37/95/89/506379589.db2.gz	HXZZPKLZSWGFKM-LBPRGKRZSA-N	0	0	374.846	2.678	50	5		FFBARN
Cc1nn(CC(=O)NCc2ccc(-n3cccc3)cc2)c(C)c1[N+](=O)[O-]	ZINC000004628877	506386363	/nfs/dbraw/zinc/38/63/63/506386363.db2.gz	XMWVYJNABHALIU-UHFFFAOYSA-N	0	0	353.382	2.515	50	5		FFBARN
O=C1CCCC(=O)N1c1ccc(NCCc2ccccn2)c([N+](=O)[O-])c1	ZINC000004684498	506388338	/nfs/dbraw/zinc/38/83/38/506388338.db2.gz	IFPCPFOUMDVCKK-UHFFFAOYSA-N	0	0	354.366	2.688	50	5		FFBARN
O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1ccc(Cl)cc1	ZINC000004687604	506388724	/nfs/dbraw/zinc/38/87/24/506388724.db2.gz	OSYJXEWNKBBMFG-UHFFFAOYSA-N	0	0	355.803	2.639	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@H](/C=C\c2ccc([N+](=O)[O-])cc2)N3)C1	ZINC000004854421	506398374	/nfs/dbraw/zinc/39/83/74/506398374.db2.gz	PXRUSSQOZFNDPD-QZDDGCDVSA-N	0	0	370.434	2.839	50	5		FFBARN
Cc1nc(N2C[C@H](C)O[C@@H](C)C2)nc(NCc2ccccc2)c1[N+](=O)[O-]	ZINC000036708816	506414810	/nfs/dbraw/zinc/41/48/10/506414810.db2.gz	KQLQYQVFYCWXEY-STQMWFEESA-N	0	0	357.414	2.919	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)O[C@@]12CCOC(C)(C)C2	ZINC000005024679	506415394	/nfs/dbraw/zinc/41/53/94/506415394.db2.gz	WPPNCEUAUFTUKU-FZKQIMNGSA-N	0	0	362.382	2.733	50	5		FFBARN
O=C(c1cccc(F)c1F)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000005033637	506417245	/nfs/dbraw/zinc/41/72/45/506417245.db2.gz	QKWOMBIXUCUUJF-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)OC(=O)c2cccc([N+](=O)[O-])c2)c1C	ZINC000005058971	506419309	/nfs/dbraw/zinc/41/93/09/506419309.db2.gz	HEMKOUYWJQUOGZ-NSHDSACASA-N	0	0	374.349	2.755	50	5		FFBARN
Cc1ccc(Cn2cccc(C(=O)Nc3ncc([N+](=O)[O-])s3)c2=O)cc1	ZINC000005270222	506431459	/nfs/dbraw/zinc/43/14/59/506431459.db2.gz	QXUKNSRUHAQRSY-UHFFFAOYSA-N	0	0	370.390	2.822	50	5		FFBARN
COC(=O)c1ccc(O[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	ZINC000006404811	506480881	/nfs/dbraw/zinc/48/08/81/506480881.db2.gz	MMHARGKHJJNSDN-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
CC(C)(C)c1ccc(C(=O)NCc2nnc3n2CCCC3)cc1[N+](=O)[O-]	ZINC000041139610	506493641	/nfs/dbraw/zinc/49/36/41/506493641.db2.gz	GYYMAYRKXABGPG-UHFFFAOYSA-N	0	0	357.414	2.750	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N)cc1F	ZINC000007206875	506543321	/nfs/dbraw/zinc/54/33/21/506543321.db2.gz	VWASLTIPHQXGQI-SNVBAGLBSA-N	0	0	361.329	2.809	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc2c(c1)OCCO2	ZINC000007221817	506545383	/nfs/dbraw/zinc/54/53/83/506545383.db2.gz	KYKXLVUQUPWTQM-NSHDSACASA-N	0	0	373.365	2.814	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N2c3ccccc3C[C@H]2C)cc1[N+](=O)[O-]	ZINC000007605281	506573246	/nfs/dbraw/zinc/57/32/46/506573246.db2.gz	AJUKPEAEBXXUPB-GFCCVEGCSA-N	0	0	370.361	2.738	50	5		FFBARN
COc1cccc([C@@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)c1	ZINC000008327721	506643858	/nfs/dbraw/zinc/64/38/58/506643858.db2.gz	HTZJEDRWVAPXIP-GOSISDBHSA-N	0	0	355.350	2.571	50	5		FFBARN
O=C(Cn1cc(Br)c([N+](=O)[O-])n1)NCc1ccc(Cl)cc1	ZINC000054919230	506647190	/nfs/dbraw/zinc/64/71/90/506647190.db2.gz	DKIHDDZDFMQBOU-UHFFFAOYSA-N	0	0	373.594	2.524	50	5		FFBARN
Cc1cc(C)nc(Sc2c([N+](=O)[O-])cc([N+](=O)[O-])cc2[N+](=O)[O-])n1	ZINC000008425476	506649940	/nfs/dbraw/zinc/64/99/40/506649940.db2.gz	HZZOUEWGVQZLEI-UHFFFAOYSA-N	0	0	351.300	2.969	50	5		FFBARN
Cc1cc(C(C)(C)C)cc(C)c1Cn1cc([N+](=O)[O-])cc(C(N)=O)c1=O	ZINC000042649802	506650438	/nfs/dbraw/zinc/65/04/38/506650438.db2.gz	OOPSPPWSWNKCRY-UHFFFAOYSA-N	0	0	357.410	2.818	50	5		FFBARN
CN(C(=O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)nc1n2CCOC1	ZINC000009108840	506681860	/nfs/dbraw/zinc/68/18/60/506681860.db2.gz	PTQVSTAMXVEJTP-UHFFFAOYSA-N	0	0	352.350	2.751	50	5		FFBARN
CC(=O)N1CCc2cc(N[C@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)ccc21	ZINC000012564889	506880489	/nfs/dbraw/zinc/88/04/89/506880489.db2.gz	LVXVFMVCNPPXAH-GFCCVEGCSA-N	0	0	368.393	2.943	50	5		FFBARN
Cc1cccc(C(=O)NCc2ccccc2CN2CCOCC2)c1[N+](=O)[O-]	ZINC000012753195	506895329	/nfs/dbraw/zinc/89/53/29/506895329.db2.gz	KNLFEGAAWYFJMR-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
Cc1nn(CC(=O)N[C@H](c2nc3ccccc3[nH]2)C(C)C)c(C)c1[N+](=O)[O-]	ZINC000045673320	506999697	/nfs/dbraw/zinc/99/96/97/506999697.db2.gz	XSGDUXBTXNHONQ-INIZCTEOSA-N	0	0	370.413	2.798	50	5		FFBARN
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@@H]1CCc2c1cccc2Cl	ZINC000057147354	507185213	/nfs/dbraw/zinc/18/52/13/507185213.db2.gz	AMAYJPCADBLCOU-CYBMUJFWSA-N	0	0	367.814	2.995	50	5		FFBARN
CC[C@](C)(NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC	ZINC000058197871	507383450	/nfs/dbraw/zinc/38/34/50/507383450.db2.gz	GNWABOMIDKKFFG-NRFANRHFSA-N	0	0	366.417	2.613	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000024836429	507442415	/nfs/dbraw/zinc/44/24/15/507442415.db2.gz	ZJKBYHDTNFTYQY-AWEZNQCLSA-N	0	0	371.368	2.764	50	5		FFBARN
COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@@H]1c1ccccc1[N+](=O)[O-]	ZINC000028294252	507717888	/nfs/dbraw/zinc/71/78/88/507717888.db2.gz	QWOMQZZKLYJBKI-LLVKDONJSA-N	0	0	374.378	2.757	50	5		FFBARN
Cc1cc(=O)c(C(=O)N2C[C@H](C)C[C@@H](C)C2)nn1-c1ccccc1[N+](=O)[O-]	ZINC000029514907	507780657	/nfs/dbraw/zinc/78/06/57/507780657.db2.gz	GTXPUCYVFUTJLM-CHWSQXEVSA-N	0	0	370.409	2.567	50	5		FFBARN
O=C(NC[C@@H]1Cc2ccccc2O1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000031370777	507819213	/nfs/dbraw/zinc/81/92/13/507819213.db2.gz	HCERQWIODRUQJD-INIZCTEOSA-N	0	0	364.361	2.514	50	5		FFBARN
O=C(Cn1c2ccccc2nc1NCCCO)c1cccc([N+](=O)[O-])c1	ZINC000002897748	966766173	/nfs/dbraw/zinc/76/61/73/966766173.db2.gz	CCXMXEKZGGSJMS-UHFFFAOYSA-N	0	0	354.366	2.622	50	5		FFBARN
O=C(/C=C/c1ccccc1[N+](=O)[O-])OCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000005835197	1005319368	/nfs/dbraw/zinc/31/93/68/1005319368.db2.gz	FVJNOQREHVHKMU-MDZDMXLPSA-N	0	0	371.305	2.698	50	5		FFBARN
O=C(/C=C\c1cc([N+](=O)[O-])cc2c1OCOC2)Nc1nnc(C2CC2)s1	ZINC000096911763	1012454330	/nfs/dbraw/zinc/45/43/30/1012454330.db2.gz	LGKUNGKZWHZIDW-ARJAWSKDSA-N	0	0	374.378	2.842	50	5		FFBARN
O=C(/C=C\c1cc([N+](=O)[O-])cc2c1OCOC2)NCc1ccc(F)cc1	ZINC000096911744	1012454355	/nfs/dbraw/zinc/45/43/55/1012454355.db2.gz	HGRIPCCIIRBTLG-UTCJRWHESA-N	0	0	358.325	2.930	50	5		FFBARN
CC(=O)N(C)c1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000000675591	210261123	/nfs/dbraw/zinc/26/11/23/210261123.db2.gz	NJLDHYDBHUVERY-UHFFFAOYSA-N	0	0	372.406	2.704	50	5		FFBARN
CCOC(=O)C1=C(C)N(C)C(=O)N[C@@H]1c1cc([N+](=O)[O-])ccc1OCC	ZINC000000670970	210260809	/nfs/dbraw/zinc/26/08/09/210260809.db2.gz	MWKJKUYFXFTTDK-OAHLLOKOSA-N	0	0	363.370	2.527	50	5		FFBARN
C[C@@H](Cn1cc(Br)cn1)C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000002794299	210078048	/nfs/dbraw/zinc/07/80/48/210078048.db2.gz	HULNVIFMCCNGPD-QMMMGPOBSA-N	0	0	371.166	2.968	50	5		FFBARN
O=C(NC1C2CC3CC(C2)CC1C3)c1ccc(Cn2cc([N+](=O)[O-])cn2)o1	ZINC000002761926	210076868	/nfs/dbraw/zinc/07/68/68/210076868.db2.gz	SRNCGQTZYQGMSR-UHFFFAOYSA-N	0	0	370.409	2.987	50	5		FFBARN
CC1([N+](=O)[O-])COC2(OC1)c1ccccc1N(Cc1ccccc1F)C2=O	ZINC000226762855	222887784	/nfs/dbraw/zinc/88/77/84/222887784.db2.gz	RIFTUSFGIFAMRR-UHFFFAOYSA-N	0	0	372.352	2.608	50	5		FFBARN
CC[C@@](C)(NC(=O)Cn1c2ccccc2c(=O)c2ccccc21)C(=O)OC	ZINC000058197874	211993410	/nfs/dbraw/zinc/99/34/10/211993410.db2.gz	GNWABOMIDKKFFG-OAQYLSRUSA-N	0	0	366.417	2.613	50	5		FFBARN
Cc1cc(C(=O)NCc2ccc(CN3CCOCC3)cc2)ccc1[N+](=O)[O-]	ZINC000012998583	220050613	/nfs/dbraw/zinc/05/06/13/220050613.db2.gz	GDLOHTHJHUBNTJ-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
C[C@@H]1C(=O)N(CCOc2ccccc2[N+](=O)[O-])C(=O)N1c1ccc(F)cc1	ZINC000047349473	211852161	/nfs/dbraw/zinc/85/21/61/211852161.db2.gz	CQMVVYVCZZNXIY-GFCCVEGCSA-N	0	0	373.340	2.970	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1	ZINC000016606825	220187744	/nfs/dbraw/zinc/18/77/44/220187744.db2.gz	XAHROYCCJQZFKZ-HNNXBMFYSA-N	0	0	357.322	2.559	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC[C@H](c2nnc3ccccn32)C1	ZINC000032904373	211572271	/nfs/dbraw/zinc/57/22/71/211572271.db2.gz	WHXQZMZNLVOPRK-HNNXBMFYSA-N	0	0	365.393	2.586	50	5		FFBARN
NC(=O)c1ccc(COC(=O)CCn2ccc3ccccc32)c([N+](=O)[O-])c1	ZINC000016118363	211155391	/nfs/dbraw/zinc/15/53/91/211155391.db2.gz	YCEUWXBVLDFMDM-UHFFFAOYSA-N	0	0	367.361	2.782	50	5		FFBARN
Cc1ccc(NC(=O)COC(=O)C2C[C@H]3CCC[C@@H](C2)C3=O)c([N+](=O)[O-])c1	ZINC000013095443	211022499	/nfs/dbraw/zinc/02/24/99/211022499.db2.gz	MSJFVEKHCHGHIX-PBWFPOADSA-N	0	0	374.393	2.780	50	5		FFBARN
O=C(OCc1cccc([N+](=O)[O-])c1)[C@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000013000842	211019093	/nfs/dbraw/zinc/01/90/93/211019093.db2.gz	KBBKYVIHQVFPQH-KRWDZBQOSA-N	0	0	368.389	2.729	50	5		FFBARN
O=C(OCc1cccc([N+](=O)[O-])c1)[C@@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000013000840	211019006	/nfs/dbraw/zinc/01/90/06/211019006.db2.gz	KBBKYVIHQVFPQH-QGZVFWFLSA-N	0	0	368.389	2.729	50	5		FFBARN
COc1ccc2cc(CN(C)C(=O)c3cccc([N+](=O)[O-])c3)c(=O)[nH]c2c1	ZINC000009192141	210819555	/nfs/dbraw/zinc/81/95/55/210819555.db2.gz	QCPVHXCYNCKXBG-UHFFFAOYSA-N	0	0	367.361	2.717	50	5		FFBARN
Cc1ccc(NC(=O)CSc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1F	ZINC000006785844	210700622	/nfs/dbraw/zinc/70/06/22/210700622.db2.gz	RWHKTBSJVKNDHI-UHFFFAOYSA-N	0	0	363.370	2.872	50	5		FFBARN
CCNc1nc(NCC)nc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])n1	ZINC000003251722	210459696	/nfs/dbraw/zinc/45/96/96/210459696.db2.gz	WQUCWLSKBNXGKG-UHFFFAOYSA-N	0	0	365.375	2.703	50	5		FFBARN
C[C@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000002793590	210423177	/nfs/dbraw/zinc/42/31/77/210423177.db2.gz	FDOFMVIIBPEJIH-RXMQYKEDSA-N	0	0	364.230	2.762	50	5		FFBARN
COc1ccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000019774110	220295418	/nfs/dbraw/zinc/29/54/18/220295418.db2.gz	RZYUFHUBJPPQJJ-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COCCOC(=O)c1ccc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000001771519	210369755	/nfs/dbraw/zinc/36/97/55/210369755.db2.gz	VSCYKSQRAAJKGW-UHFFFAOYSA-N	0	0	358.350	2.959	50	5		FFBARN
COc1cc2c(cc1OC)[C@H](c1cc3c(cc1[N+](=O)[O-])OCO3)CC(=O)N2	ZINC000001440250	210353433	/nfs/dbraw/zinc/35/34/33/210353433.db2.gz	ATBNZGVSEHYHFM-SECBINFHSA-N	0	0	372.333	2.815	50	5		FFBARN
O=[N+]([O-])c1ccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)s1	ZINC000001227105	210337180	/nfs/dbraw/zinc/33/71/80/210337180.db2.gz	MWVFEORPRLVLHS-UHFFFAOYSA-N	0	0	361.423	2.703	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2ccc(N(C)C(C)=O)cc2)cc([N+](=O)[O-])c1	ZINC000001182768	210330132	/nfs/dbraw/zinc/33/01/32/210330132.db2.gz	WCNAEGLXRGOLTA-UHFFFAOYSA-N	0	0	371.349	2.616	50	5		FFBARN
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCc1ccc(Cl)cc1	ZINC000001164498	210328149	/nfs/dbraw/zinc/32/81/49/210328149.db2.gz	NGLORZBSWVIBIU-UHFFFAOYSA-N	0	0	374.736	2.588	50	5		FFBARN
CCCN1c2ccccc2[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000001133911	210322674	/nfs/dbraw/zinc/32/26/74/210322674.db2.gz	ZVSMYRMNAXHGFA-IBGZPJMESA-N	0	0	354.362	2.812	50	5		FFBARN
Cc1c(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C	ZINC000001013943	210301264	/nfs/dbraw/zinc/30/12/64/210301264.db2.gz	PIJQYBUQKAIXSO-UHFFFAOYSA-N	0	0	370.340	2.784	50	5		FFBARN
O=C(Nc1nc2ccc([N+](=O)[O-])cc2s1)[C@H]1COc2ccccc2O1	ZINC000000953142	210295201	/nfs/dbraw/zinc/29/52/01/210295201.db2.gz	AICVVEYTDPSICO-CYBMUJFWSA-N	0	0	357.347	2.983	50	5		FFBARN
O=C(Nc1nnc(C2=COCCO2)o1)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000009427805	210290353	/nfs/dbraw/zinc/29/03/53/210290353.db2.gz	HULPHDATGNYCJW-UHFFFAOYSA-N	0	0	374.334	2.790	50	5		FFBARN
COc1cccc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1OC	ZINC000000865096	210282493	/nfs/dbraw/zinc/28/24/93/210282493.db2.gz	PJTLESMBXJYAEN-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
Cc1nn(CC(=O)Nc2ccc(OC(F)(F)F)cc2)c(C)c1[N+](=O)[O-]	ZINC000000826506	210277235	/nfs/dbraw/zinc/27/72/35/210277235.db2.gz	GFLBFGZCQXTANX-UHFFFAOYSA-N	0	0	358.276	2.945	50	5		FFBARN
C[C@@H](Oc1ccc(Cl)cc1)C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032999816	220709346	/nfs/dbraw/zinc/70/93/46/220709346.db2.gz	RNRXZSOEXYIMOG-BDJLRTHQSA-N	0	0	364.785	2.865	50	5		FFBARN
COc1nn(C)cc1C(=O)Nc1nc(-c2cc([N+](=O)[O-])cs2)cs1	ZINC000042379124	220938113	/nfs/dbraw/zinc/93/81/13/220938113.db2.gz	KISQAIUMNMTBLD-UHFFFAOYSA-N	0	0	365.396	2.774	50	5		FFBARN
Cc1nn(CN2CCC(NC(=O)c3ccccc3C)CC2)c(C)c1[N+](=O)[O-]	ZINC000054491664	221054288	/nfs/dbraw/zinc/05/42/88/221054288.db2.gz	IWXBAXBADYINHL-UHFFFAOYSA-N	0	0	371.441	2.568	50	5		FFBARN
CN(CCc1ccncc1)S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000062582061	221140292	/nfs/dbraw/zinc/14/02/92/221140292.db2.gz	LNGFUMJDIAAQFT-UHFFFAOYSA-N	0	0	355.803	2.506	50	5		FFBARN
CC(=O)N[C@@H]1Cc2ccccc2N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000095972517	132216489	/nfs/dbraw/zinc/21/64/89/132216489.db2.gz	JZMYRNYFXCNJNS-OAHLLOKOSA-N	0	0	373.796	2.956	50	5		FFBARN
Cc1ccccc1N1CCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC1	ZINC000002707852	132253943	/nfs/dbraw/zinc/25/39/43/132253943.db2.gz	NIQPHMMKILZMAX-UHFFFAOYSA-N	0	0	370.365	2.774	50	5		FFBARN
C[C@@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@@H](C)O1	ZINC000239782572	132289084	/nfs/dbraw/zinc/28/90/84/132289084.db2.gz	CPHLIVBUPMAJGM-CHWSQXEVSA-N	0	0	356.382	2.856	50	5		FFBARN
O=[N+]([O-])c1cc(-c2nc(-c3ccccn3)no2)ccc1N1CCOCC1	ZINC000020898064	132899156	/nfs/dbraw/zinc/89/91/56/132899156.db2.gz	DJPBAUPWQVIFEC-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
CCOc1ccccc1OC1CCN(Cc2ncc([N+](=O)[O-])n2C)CC1	ZINC000097166031	222165596	/nfs/dbraw/zinc/16/55/96/222165596.db2.gz	BIIQPSDPWMXOHC-UHFFFAOYSA-N	0	0	360.414	2.770	50	5		FFBARN
CCc1nn(C)c(CC)c1CNC(=O)Nc1ccc([N+](=O)[O-])cc1OC	ZINC000097163171	222166490	/nfs/dbraw/zinc/16/64/90/222166490.db2.gz	IXYPRXQHFFZKHH-UHFFFAOYSA-N	0	0	361.402	2.783	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)/C=C\c2cccc([N+](=O)[O-])c2)CC1	ZINC000033916253	263396825	/nfs/dbraw/zinc/39/68/25/263396825.db2.gz	NUKOAACTLSCAKB-KTKRTIGZSA-N	0	0	367.405	2.965	50	5		FFBARN
C[C@H](Sc1nnc(N)s1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000002622425	506283910	/nfs/dbraw/zinc/28/39/10/506283910.db2.gz	WNLKYAKRLMTJJZ-YFKPBYRVSA-N	0	0	359.820	2.801	50	5		FFBARN
C[C@@H]1C[C@H](OC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C(=O)O1	ZINC000032736103	506287816	/nfs/dbraw/zinc/28/78/16/506287816.db2.gz	XORVIMMOUXEBFR-WBMJQRKESA-N	0	0	362.382	2.836	50	5		FFBARN
CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1ccc(C)c([N+](=O)[O-])c1	ZINC000002796838	506292997	/nfs/dbraw/zinc/29/29/97/506292997.db2.gz	NOBNMPJHFTYBPF-UHFFFAOYSA-N	0	0	374.393	2.826	50	5		FFBARN
CCNC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(C)cc1	ZINC000002832595	506297312	/nfs/dbraw/zinc/29/73/12/506297312.db2.gz	KBKQIIVELBRSIE-ATVHPVEESA-N	0	0	353.378	2.810	50	5		FFBARN
Cc1ccc(N(C(=O)c2cccc([N+](=O)[O-])c2)[C@@H]2C=CS(=O)(=O)C2)cc1	ZINC000003173594	506310370	/nfs/dbraw/zinc/31/03/70/506310370.db2.gz	NLYIDGYGOJUKMH-QGZVFWFLSA-N	0	0	372.402	2.861	50	5		FFBARN
C[C@@H]1CN(C(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H](C)O1	ZINC000003234876	506314852	/nfs/dbraw/zinc/31/48/52/506314852.db2.gz	JDSHPJUFWJGPDF-NXEZZACHSA-N	0	0	367.452	2.932	50	5		FFBARN
Cc1c(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)cccc1-n1cnnn1	ZINC000003431913	506331146	/nfs/dbraw/zinc/33/11/46/506331146.db2.gz	VRDIKTFOOPBAAS-UHFFFAOYSA-N	0	0	358.745	2.785	50	5		FFBARN
COCCCNc1nc(N)c([N+](=O)[O-])c(Nc2ccc(Cl)cc2)n1	ZINC000004305938	506369594	/nfs/dbraw/zinc/36/95/94/506369594.db2.gz	RJUFAEQJFPFXSM-UHFFFAOYSA-N	0	0	352.782	2.812	50	5		FFBARN
CN(C)C(=O)N[C@H](Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl	ZINC000004531850	506380021	/nfs/dbraw/zinc/38/00/21/506380021.db2.gz	HVANRYOBXAAFEF-VIFPVBQESA-N	0	0	355.609	2.974	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCNS(=O)(=O)c2ccccc2)c(Cl)c1	ZINC000004549815	506381787	/nfs/dbraw/zinc/38/17/87/506381787.db2.gz	QFWQHGZRROBGHS-UHFFFAOYSA-N	0	0	355.803	2.639	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCNc2ccc([N+](=O)[O-])cc2Cl)cc1	ZINC000004565473	506383066	/nfs/dbraw/zinc/38/30/66/506383066.db2.gz	FGKSPJHBPRXUAP-UHFFFAOYSA-N	0	0	369.830	2.947	50	5		FFBARN
Cn1cc(Br)c(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)n1	ZINC000004646926	506386250	/nfs/dbraw/zinc/38/62/50/506386250.db2.gz	ZXBVZXOKSJLPKZ-UHFFFAOYSA-N	0	0	359.567	2.997	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000004739315	506391260	/nfs/dbraw/zinc/39/12/60/506391260.db2.gz	STRIFSXIYYYIQT-UHFFFAOYSA-N	0	0	362.773	2.732	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004731991	506391684	/nfs/dbraw/zinc/39/16/84/506391684.db2.gz	KPBOHTIMHJXDPW-LLVKDONJSA-N	0	0	373.340	2.734	50	5		FFBARN
COc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC(C)CC3)n2)cc1	ZINC000005025927	506415660	/nfs/dbraw/zinc/41/56/60/506415660.db2.gz	KELRAPKVCYUDSN-UHFFFAOYSA-N	0	0	358.402	2.956	50	5		FFBARN
COc1ccc(N2C(=S)N=NC2[C@H](C)n2nc(C)c([N+](=O)[O-])c2C)cc1	ZINC000005425091	506441020	/nfs/dbraw/zinc/44/10/20/506441020.db2.gz	PFWAGGOPWGRCFP-NSHDSACASA-N	0	0	374.426	2.895	50	5		FFBARN
CN(C)[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000005688228	506453675	/nfs/dbraw/zinc/45/36/75/506453675.db2.gz	RWNDXGYKQFIYPY-KRWDZBQOSA-N	0	0	363.439	2.713	50	5		FFBARN
C[C@@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1	ZINC000040074368	506463254	/nfs/dbraw/zinc/46/32/54/506463254.db2.gz	KLDSQJWSAZSEIY-ZDUSSCGKSA-N	0	0	359.451	2.762	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])N1CCNC(=O)C[C@H]1c1ccccc1	ZINC000040149955	506473337	/nfs/dbraw/zinc/47/33/37/506473337.db2.gz	ATJWHVPFADMVRU-INIZCTEOSA-N	0	0	354.366	2.690	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1n[nH]c2ccccc21	ZINC000006370652	506479500	/nfs/dbraw/zinc/47/95/00/506479500.db2.gz	FPBKOCVPJLWOPU-UHFFFAOYSA-N	0	0	354.322	2.575	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000006987290	506524390	/nfs/dbraw/zinc/52/43/90/506524390.db2.gz	WVKTWBCLUVDDFQ-UHFFFAOYSA-N	0	0	359.426	2.850	50	5		FFBARN
C[C@H](Oc1ccc(C(=O)NC2CC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000054271602	506527922	/nfs/dbraw/zinc/52/79/22/506527922.db2.gz	RRMXNVBPOAQHGA-LBPRGKRZSA-N	0	0	369.377	2.893	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc(S(C)(=O)=O)cc1	ZINC000007067590	506530405	/nfs/dbraw/zinc/53/04/05/506530405.db2.gz	JGGYEXRWCYDOCO-LBPRGKRZSA-N	0	0	362.407	2.832	50	5		FFBARN
Cc1c(CSc2nnc(-c3ccco3)n2CC(N)=O)cccc1[N+](=O)[O-]	ZINC000042155350	506604768	/nfs/dbraw/zinc/60/47/68/506604768.db2.gz	YFYXVGCWTCMPLJ-UHFFFAOYSA-N	0	0	373.394	2.532	50	5		FFBARN
COC(=O)c1ccc(Cl)c(NS(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000008092236	506621916	/nfs/dbraw/zinc/62/19/16/506621916.db2.gz	RACCLZHDELCCHL-UHFFFAOYSA-N	0	0	370.770	2.836	50	5		FFBARN
COc1ccc(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c(OC)c1	ZINC000008210540	506632473	/nfs/dbraw/zinc/63/24/73/506632473.db2.gz	ZZJGAIUJEBIABF-UHFFFAOYSA-N	0	0	360.322	2.636	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)C1CCN(C(=O)c2ccco2)CC1	ZINC000008246426	506635559	/nfs/dbraw/zinc/63/55/59/506635559.db2.gz	SGTCYTWKXFLMLR-UHFFFAOYSA-N	0	0	357.366	2.987	50	5		FFBARN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000008349415	506644489	/nfs/dbraw/zinc/64/44/89/506644489.db2.gz	FLYCQVZPRKDGDE-CQSZACIVSA-N	0	0	365.393	2.938	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(F)cc2c1OCOC2	ZINC000008529119	506657779	/nfs/dbraw/zinc/65/77/79/506657779.db2.gz	OWRQSYFUQIJKFH-UHFFFAOYSA-N	0	0	362.313	2.999	50	5		FFBARN
CN(C)C(=O)[C@@H]1CCCN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000008779862	506668403	/nfs/dbraw/zinc/66/84/03/506668403.db2.gz	RZNXIMRAJITRTF-KRWDZBQOSA-N	0	0	367.405	2.883	50	5		FFBARN
O=C1C[C@@H](c2cccc([N+](=O)[O-])c2)c2c(=O)[nH]c(-c3ccccc3)nc2N1	ZINC000009165040	506686064	/nfs/dbraw/zinc/68/60/64/506686064.db2.gz	HGUFKOZVHWBHQM-AWEZNQCLSA-N	0	0	362.345	2.819	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000009458813	506697575	/nfs/dbraw/zinc/69/75/75/506697575.db2.gz	WGTXNOIERIRVSO-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1C(=O)N[C@](C)(c2ccc(C)cc2)C1=O	ZINC000009585677	506704661	/nfs/dbraw/zinc/70/46/61/506704661.db2.gz	XZYXGSPMEYZVQA-LJQANCHMSA-N	0	0	369.377	2.879	50	5		FFBARN
O=[N+]([O-])c1cc(-c2noc(-c3ccncc3)n2)ccc1N1CCOCC1	ZINC000009669039	506706785	/nfs/dbraw/zinc/70/67/85/506706785.db2.gz	VSWWUMVQWLQTJA-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
Cc1c(NCC(=O)Nc2ccccc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000012562032	506880008	/nfs/dbraw/zinc/88/00/08/506880008.db2.gz	MFVUWRVEXBDALG-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)Nc2nc(C(C)C)cs2)cc1[N+](=O)[O-]	ZINC000012614291	506884228	/nfs/dbraw/zinc/88/42/28/506884228.db2.gz	LQLXSCLMKKNOPU-UHFFFAOYSA-N	0	0	362.411	2.852	50	5		FFBARN
O=C(OCCOc1ccccc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000015277965	507026187	/nfs/dbraw/zinc/02/61/87/507026187.db2.gz	CLSZVFQTEQRPIR-UHFFFAOYSA-N	0	0	372.377	2.667	50	5		FFBARN
CC(=O)c1ccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)c(F)c1	ZINC000016110860	507073530	/nfs/dbraw/zinc/07/35/30/507073530.db2.gz	NDRPFMSUYQAUFK-UHFFFAOYSA-N	0	0	371.368	2.899	50	5		FFBARN
Cc1nn(C)c(NC[C@H](O)COc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-]	ZINC000058160210	507375667	/nfs/dbraw/zinc/37/56/67/507375667.db2.gz	QFJLQBVTBBGUIW-NSHDSACASA-N	0	0	374.319	2.507	50	5		FFBARN
O=C(CSc1nnc2n1CCCCC2)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000024173235	507396045	/nfs/dbraw/zinc/39/60/45/507396045.db2.gz	QZOHVNNZZCXRIG-UHFFFAOYSA-N	0	0	365.390	2.783	50	5		FFBARN
O=C(Cc1ccc(OC(F)F)cc1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000024320740	507403898	/nfs/dbraw/zinc/40/38/98/507403898.db2.gz	XLCFECJWBGWUSV-UHFFFAOYSA-N	0	0	365.336	2.967	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)OCc1cc(F)cc2c1OCOC2	ZINC000024423195	507410267	/nfs/dbraw/zinc/41/02/67/507410267.db2.gz	BPMIMZGNOWWARI-UHFFFAOYSA-N	0	0	363.297	2.966	50	5		FFBARN
CSc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2COc3ccccc3O2)c1	ZINC000025043975	507460926	/nfs/dbraw/zinc/46/09/26/507460926.db2.gz	CLHBEMGCKGLTSG-NSHDSACASA-N	0	0	360.391	2.887	50	5		FFBARN
O=C(Nc1ccccc1)[C@@H]1CCCN1c1ncc([N+](=O)[O-])c(NC2CC2)n1	ZINC000025494866	507505434	/nfs/dbraw/zinc/50/54/34/507505434.db2.gz	UYQAETDAMSOBMQ-AWEZNQCLSA-N	0	0	368.397	2.567	50	5		FFBARN
CNc1ccc(C(=O)Nc2ccc(N3CCOCC3)cc2)cc1[N+](=O)[O-]	ZINC000027762201	507682399	/nfs/dbraw/zinc/68/23/99/507682399.db2.gz	HHPONCHECSYIMX-UHFFFAOYSA-N	0	0	356.382	2.725	50	5		FFBARN
O=C(NC[C@@H]1CCN(c2ccccc2)C1)c1[nH]nc2ccc([N+](=O)[O-])cc21	ZINC000027840276	507688424	/nfs/dbraw/zinc/68/84/24/507688424.db2.gz	UQTGBUCWAVRUEW-ZDUSSCGKSA-N	0	0	365.393	2.727	50	5		FFBARN
COc1ccc(C(=O)Nc2cccc(-c3nncn3C)c2)cc1[N+](=O)[O-]	ZINC000031806881	507821921	/nfs/dbraw/zinc/82/19/21/507821921.db2.gz	MGENRXZFMOKEBT-UHFFFAOYSA-N	0	0	353.338	2.651	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C(=O)N1CCc2ccc(F)cc21	ZINC000225687361	509384663	/nfs/dbraw/zinc/38/46/63/509384663.db2.gz	TUBLHXDRCPOIEZ-UHFFFAOYSA-N	0	0	357.341	2.879	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCC(C(=O)Nc2cccnc2)CC1	ZINC000084177530	571077010	/nfs/dbraw/zinc/07/70/10/571077010.db2.gz	SRRRAUSLQNLRNY-UHFFFAOYSA-N	0	0	368.393	2.789	50	5		FFBARN
O=C(/C=C\c1nc2ccccc2o1)NCCNc1ccccc1[N+](=O)[O-]	ZINC000096904799	1012443474	/nfs/dbraw/zinc/44/34/74/1012443474.db2.gz	BWVRTCUZVFVTPV-KTKRTIGZSA-N	0	0	352.350	2.978	50	5		FFBARN
COc1ccc(-c2nc(N)c3c(n2)c2ccccc2oc3=O)cc1[N+](=O)[O-]	ZINC000000753938	210074115	/nfs/dbraw/zinc/07/41/15/210074115.db2.gz	LTQVVAVDCAUKKQ-UHFFFAOYSA-N	0	0	364.317	2.902	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)n1	ZINC000045068457	210049075	/nfs/dbraw/zinc/04/90/75/210049075.db2.gz	ZMDRWCIVOGFIOH-UHFFFAOYSA-N	0	0	366.424	2.966	50	5		FFBARN
O=C(/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2)NCc1ccccc1F	ZINC000007960935	219834629	/nfs/dbraw/zinc/83/46/29/219834629.db2.gz	VLANTWIMZRHGBV-AATRIKPKSA-N	0	0	358.325	2.930	50	5		FFBARN
COc1ccc(OC)c(S(=O)(=O)Oc2cc(F)ccc2[N+](=O)[O-])c1	ZINC000016094243	220178181	/nfs/dbraw/zinc/17/81/81/220178181.db2.gz	JZGLOWVJGLFNPH-UHFFFAOYSA-N	0	0	357.315	2.519	50	5		FFBARN
COc1cccc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	ZINC000018076935	220223845	/nfs/dbraw/zinc/22/38/45/220223845.db2.gz	ZGUOXYGWXSJOLN-UHFFFAOYSA-N	0	0	371.349	2.930	50	5		FFBARN
O=C(COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2)c1cc(F)ccc1F	ZINC000024882573	211416010	/nfs/dbraw/zinc/41/60/10/211416010.db2.gz	UMGJSMHTXXSPQY-UHFFFAOYSA-N	0	0	365.244	2.641	50	5		FFBARN
CCc1c([N+](=O)[O-])c(C(N)=O)nn1CCOc1ccc(C(C)C)c(C)c1	ZINC000024841247	211415665	/nfs/dbraw/zinc/41/56/65/211415665.db2.gz	NROIUYMORJYTMF-UHFFFAOYSA-N	0	0	360.414	2.963	50	5		FFBARN
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCC[C@H]1CCCO1	ZINC000023876419	211397761	/nfs/dbraw/zinc/39/77/61/211397761.db2.gz	PMIOFTPIBVPRBE-OAHLLOKOSA-N	0	0	350.418	2.840	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)Nc3ncccc3O)cc2)c(C)c1[N+](=O)[O-]	ZINC000022264200	211345380	/nfs/dbraw/zinc/34/53/80/211345380.db2.gz	ABPNLBQVBZOYRQ-UHFFFAOYSA-N	0	0	367.365	2.809	50	5		FFBARN
CC(=O)N1N=C(c2ccc3c(c2)OCO3)O[C@@H]1c1ccccc1[N+](=O)[O-]	ZINC000021092022	211305097	/nfs/dbraw/zinc/30/50/97/211305097.db2.gz	SCYQNNYUDAZPQJ-QGZVFWFLSA-N	0	0	355.306	2.563	50	5		FFBARN
CC(=O)Oc1ccccc1[C@@H]1OC(c2ccc([N+](=O)[O-])cc2)=NN1C(C)=O	ZINC000021092336	211305027	/nfs/dbraw/zinc/30/50/27/211305027.db2.gz	PCPPYMGAISXUIX-SFHVURJKSA-N	0	0	369.333	2.759	50	5		FFBARN
CC(C)c1ccc(C2N3CC4([N+](=O)[O-])CN2CC([N+](=O)[O-])(C3)C4(C)C)cc1	ZINC000019320544	211215092	/nfs/dbraw/zinc/21/50/92/211215092.db2.gz	CEEOYVKWLOWJQL-UHFFFAOYSA-N	0	0	374.441	2.511	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1n[nH]c(-c2cccnc2)n1	ZINC000018191205	211194072	/nfs/dbraw/zinc/19/40/72/211194072.db2.gz	BDMSMRYJZYDNFY-UHFFFAOYSA-N	0	0	370.394	2.814	50	5		FFBARN
Cc1cc(OCC2N=NC(=S)N2C[C@H]2CCCO2)ccc1[N+](=O)[O-]	ZINC000017072693	211175036	/nfs/dbraw/zinc/17/50/36/211175036.db2.gz	GNJDQPIBRWZMTF-GFCCVEGCSA-N	0	0	350.400	2.541	50	5		FFBARN
O=C(Cc1nn2cnc3ccccc3c2nc1=O)c1cc2ccccc2o1	ZINC000014241053	211086737	/nfs/dbraw/zinc/08/67/37/211086737.db2.gz	ULQLGLHZDOEKRG-UHFFFAOYSA-N	0	0	356.341	2.809	50	5		FFBARN
CN(C)C(=O)[C@H]1CCCN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000008779864	210806701	/nfs/dbraw/zinc/80/67/01/210806701.db2.gz	RZNXIMRAJITRTF-QGZVFWFLSA-N	0	0	367.405	2.883	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCOc2ccccc21	ZINC000007909603	210758256	/nfs/dbraw/zinc/75/82/56/210758256.db2.gz	YPFZNZNWSAZQFL-QGZVFWFLSA-N	0	0	371.393	2.907	50	5		FFBARN
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1ccccc1[N+](=O)[O-]	ZINC000006059715	210654245	/nfs/dbraw/zinc/65/42/45/210654245.db2.gz	DRCQAOWRRICKMT-UHFFFAOYSA-N	0	0	374.349	2.756	50	5		FFBARN
CSc1ccc(C(=O)NC[C@@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	ZINC000005630938	210631927	/nfs/dbraw/zinc/63/19/27/210631927.db2.gz	YOMNNYBIAGAOGQ-GFCCVEGCSA-N	0	0	360.391	2.887	50	5		FFBARN
Cc1ccc(-n2nnnc2SCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000004810650	210565211	/nfs/dbraw/zinc/56/52/11/210565211.db2.gz	IGGGCTKOYQUNGA-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1cccc(F)c1	ZINC000001429856	210353066	/nfs/dbraw/zinc/35/30/66/210353066.db2.gz	OMVHGLDKNJRYQZ-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
COc1ccc(C(=O)COC(=O)c2ccc(NC(C)=O)cc2)cc1[N+](=O)[O-]	ZINC000001171868	210328965	/nfs/dbraw/zinc/32/89/65/210328965.db2.gz	AAZYXXFCVACTDM-UHFFFAOYSA-N	0	0	372.333	2.602	50	5		FFBARN
Cc1ccc(C)c(NC(=O)[C@@H](C)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000001151298	210326527	/nfs/dbraw/zinc/32/65/27/210326527.db2.gz	DLUDDBQXJIEHFI-GFCCVEGCSA-N	0	0	367.361	2.835	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000001212553	210335682	/nfs/dbraw/zinc/33/56/82/210335682.db2.gz	JMNAMCJDPQGZKJ-RISCZKNCSA-N	0	0	357.288	2.848	50	5		FFBARN
CN1c2ccc(Cl)cc2[C@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000001068086	210311324	/nfs/dbraw/zinc/31/13/24/210311324.db2.gz	JHFISHRHNDISFW-QGZVFWFLSA-N	0	0	360.753	2.685	50	5		FFBARN
CCCN1c2ccccc2[C@@](O)(CC(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000001051963	210309842	/nfs/dbraw/zinc/30/98/42/210309842.db2.gz	VGFOBZZATXMFBE-IBGZPJMESA-N	0	0	354.362	2.812	50	5		FFBARN
O=C(NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)C1CCCCC1	ZINC000001036998	210304436	/nfs/dbraw/zinc/30/44/36/210304436.db2.gz	ZAHDDDBHKVUPJK-UHFFFAOYSA-N	0	0	359.426	2.896	50	5		FFBARN
CNC(=O)c1ccc(N2CCC[C@H](c3nncn3C(C)C)C2)c([N+](=O)[O-])c1	ZINC000089894137	132200433	/nfs/dbraw/zinc/20/04/33/132200433.db2.gz	KOFNAVSIKIHEGZ-AWEZNQCLSA-N	0	0	372.429	2.511	50	5		FFBARN
CC(C)C(=O)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000004624266	132823751	/nfs/dbraw/zinc/82/37/51/132823751.db2.gz	AXIIWZCGLDPYAU-UHFFFAOYSA-N	0	0	364.421	2.639	50	5		FFBARN
O=[N+]([O-])c1ccccc1OCCN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000051374503	136124167	/nfs/dbraw/zinc/12/41/67/136124167.db2.gz	SPGQTVFCMPLXKU-UHFFFAOYSA-N	0	0	372.381	2.704	50	5		FFBARN
O=C(Nc1ccccc1)OCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000052521490	136124508	/nfs/dbraw/zinc/12/45/08/136124508.db2.gz	MPTLPGCHHHWANV-UHFFFAOYSA-N	0	0	370.409	2.966	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccc(N2CCCCC2)nc1	ZINC000053509762	136124832	/nfs/dbraw/zinc/12/48/32/136124832.db2.gz	LSKSWWHZDXHZGH-UHFFFAOYSA-N	0	0	370.409	2.675	50	5		FFBARN
COC(=O)c1ccc2c(c1)CCN2Cc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000097164438	222166402	/nfs/dbraw/zinc/16/64/02/222166402.db2.gz	HWNSIXYMVGZSAE-UHFFFAOYSA-N	0	0	370.361	2.715	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccc(Cl)cc1	ZINC000032400725	506248850	/nfs/dbraw/zinc/24/88/50/506248850.db2.gz	GLGSLDGYJQHSJC-UHFFFAOYSA-N	0	0	356.787	2.735	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)NCCCc2ccccc2)cc1[N+](=O)[O-]	ZINC000002664784	506287857	/nfs/dbraw/zinc/28/78/57/506287857.db2.gz	KHQJINWQORMICN-UHFFFAOYSA-N	0	0	372.377	2.509	50	5		FFBARN
O=C(CCC1CCCC1)Nc1cc(SC[C@@H](O)CO)cc([N+](=O)[O-])c1	ZINC000002765316	506290971	/nfs/dbraw/zinc/29/09/71/506290971.db2.gz	UCFFGQHQRAPVFS-HNNXBMFYSA-N	0	0	368.455	2.949	50	5		FFBARN
Cn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)nc2ccccc2c1=O	ZINC000002802934	506294402	/nfs/dbraw/zinc/29/44/02/506294402.db2.gz	SJKDHGNXWFCVNI-UHFFFAOYSA-N	0	0	370.390	2.573	50	5		FFBARN
CCCCN1C=C(C(=O)OC)C(c2cccc([N+](=O)[O-])c2)C(C(=O)OC)=C1	ZINC000002838788	506297106	/nfs/dbraw/zinc/29/71/06/506297106.db2.gz	SVVCRNKJVMHPSI-UHFFFAOYSA-N	0	0	374.393	2.908	50	5		FFBARN
O=C(/C=C/c1ccccc1[N+](=O)[O-])OCC(=O)Nc1ccc(Cl)cn1	ZINC000003424439	506329350	/nfs/dbraw/zinc/32/93/50/506329350.db2.gz	QOTQDSKVVFEEAF-VMPITWQZSA-N	0	0	361.741	2.838	50	5		FFBARN
NC(=O)c1ccc(SCC(=O)Nc2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000003435595	506331221	/nfs/dbraw/zinc/33/12/21/506331221.db2.gz	YDEBAAWSMOQLKP-UHFFFAOYSA-N	0	0	367.333	2.703	50	5		FFBARN
O=[N+]([O-])c1ccc2c(cnn2CN2CCN(c3ccc(F)cc3)CC2)c1	ZINC000033428398	506356982	/nfs/dbraw/zinc/35/69/82/506356982.db2.gz	CCAKXINZMUZYCU-UHFFFAOYSA-N	0	0	355.373	2.863	50	5		FFBARN
O=C(CCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])OCC(=O)c1ccccc1	ZINC000004247161	506366611	/nfs/dbraw/zinc/36/66/11/506366611.db2.gz	YYLHWOTWHGCOPH-UHFFFAOYSA-N	0	0	373.321	2.731	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CSc1nncn1-c1cccnc1	ZINC000004321375	506371071	/nfs/dbraw/zinc/37/10/71/506371071.db2.gz	JKHGBWWMUJKHOJ-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
CCOC(=O)c1sc(C)c2c1N[C@@H](c1ccc([N+](=O)[O-])cc1)NC2=O	ZINC000004311479	506371990	/nfs/dbraw/zinc/37/19/90/506371990.db2.gz	JEOXTFPYSBFBER-CQSZACIVSA-N	0	0	361.379	2.996	50	5		FFBARN
Cc1ccc(C2=N/C(=C\c3ccc4c(c3)OCO4)C(=O)O2)cc1[N+](=O)[O-]	ZINC000004460212	506376784	/nfs/dbraw/zinc/37/67/84/506376784.db2.gz	AKRIRJPUWPOVEW-MLPAPPSSSA-N	0	0	352.302	2.976	50	5		FFBARN
COc1ccc(CNc2cc(NCCCO)c([N+](=O)[O-])c3nonc32)cc1	ZINC000004716626	506390498	/nfs/dbraw/zinc/39/04/98/506390498.db2.gz	LFGXDIMWLNGKAW-UHFFFAOYSA-N	0	0	373.369	2.546	50	5		FFBARN
COc1cc(CN2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])cc1OC	ZINC000004977823	506411026	/nfs/dbraw/zinc/41/10/26/506411026.db2.gz	GERMEDWQKFHKOX-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
C[C@H]1CCCN(c2nc(NCCc3ccccc3)nc(N)c2[N+](=O)[O-])C1	ZINC000005159032	506425530	/nfs/dbraw/zinc/42/55/30/506425530.db2.gz	YAPPHPYDVHGGIW-ZDUSSCGKSA-N	0	0	356.430	2.858	50	5		FFBARN
COc1ccc(C(=O)Nc2cc3cccc([N+](=O)[O-])c3oc2=O)cc1OC	ZINC000005185574	506427015	/nfs/dbraw/zinc/42/70/15/506427015.db2.gz	YOVDQMCHGBFVMD-UHFFFAOYSA-N	0	0	370.317	2.971	50	5		FFBARN
COc1ccc(C(=O)N(C)Cc2nc(-c3ccccc3)no2)cc1[N+](=O)[O-]	ZINC000005421959	506441282	/nfs/dbraw/zinc/44/12/82/506441282.db2.gz	CAIDVELXUCUCEE-UHFFFAOYSA-N	0	0	368.349	2.926	50	5		FFBARN
COCCCn1ccc2nc3ccn(-c4ccccc4)c(=O)c3cc2c1=O	ZINC000038828988	506445807	/nfs/dbraw/zinc/44/58/07/506445807.db2.gz	LHRYFXBJAIEASI-UHFFFAOYSA-N	0	0	361.401	2.737	50	5		FFBARN
O=C(COC(=O)c1ccc(Br)o1)Nc1cccc([N+](=O)[O-])c1	ZINC000005560680	506447542	/nfs/dbraw/zinc/44/75/42/506447542.db2.gz	CMYKTTSPKKGVKV-UHFFFAOYSA-N	0	0	369.127	2.746	50	5		FFBARN
COc1ccc(NC(=O)[C@@H](C)N(C)Cc2cnc(C)s2)c([N+](=O)[O-])c1	ZINC000040154605	506475728	/nfs/dbraw/zinc/47/57/28/506475728.db2.gz	FTPZBIMUHYWMCP-SNVBAGLBSA-N	0	0	364.427	2.827	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)Nc1ccc2c(c1)OCCO2	ZINC000007221820	506545130	/nfs/dbraw/zinc/54/51/30/506545130.db2.gz	KYKXLVUQUPWTQM-LLVKDONJSA-N	0	0	373.365	2.814	50	5		FFBARN
O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)Nc1ccc2c(c1)OCCO2	ZINC000008060152	506618716	/nfs/dbraw/zinc/61/87/16/506618716.db2.gz	WCBDYXYAFCFUMW-DAFODLJHSA-N	0	0	370.317	2.747	50	5		FFBARN
CC(C)n1ncc2cc(NC(=O)COc3ccc([N+](=O)[O-])cc3)cnc21	ZINC000008881845	506672880	/nfs/dbraw/zinc/67/28/80/506672880.db2.gz	FURMRXHZWPZPCJ-UHFFFAOYSA-N	0	0	355.354	2.938	50	5		FFBARN
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000008936797	506674491	/nfs/dbraw/zinc/67/44/91/506674491.db2.gz	VXEUZWVDNQJTTK-QGZVFWFLSA-N	0	0	354.362	2.643	50	5		FFBARN
O=C(c1ccc(Cl)cc1[N+](=O)[O-])N1CCN(c2nccs2)CC1	ZINC000010269852	506736213	/nfs/dbraw/zinc/73/62/13/506736213.db2.gz	NOULRFWMBZSGBY-UHFFFAOYSA-N	0	0	352.803	2.667	50	5		FFBARN
COc1ccc(C(=O)OCc2cc(=O)oc3cc(O)ccc23)cc1[N+](=O)[O-]	ZINC000011342042	506772498	/nfs/dbraw/zinc/77/24/98/506772498.db2.gz	UQAMRAVMWKONQL-UHFFFAOYSA-N	0	0	371.301	2.772	50	5		FFBARN
Cn1ncc2c1ncnc2SCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000011678619	506787783	/nfs/dbraw/zinc/78/77/83/506787783.db2.gz	GNLSXBJDDPCSDM-UHFFFAOYSA-N	0	0	369.366	2.614	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)OCc1nc(N)c2ccccc2n1	ZINC000012633914	506887255	/nfs/dbraw/zinc/88/72/55/506887255.db2.gz	WPXIJBWWZYRSOA-UHFFFAOYSA-N	0	0	353.338	2.519	50	5		FFBARN
Cc1cccc(C(=O)N2CCC[C@@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-]	ZINC000047237150	507289186	/nfs/dbraw/zinc/28/91/86/507289186.db2.gz	CZCAGSJEPUJQBI-CQSZACIVSA-N	0	0	368.393	2.789	50	5		FFBARN
COC(=O)c1n[nH]c2ccc(NC(=O)c3cc([N+](=O)[O-])c(C)s3)cc21	ZINC000025083739	507464922	/nfs/dbraw/zinc/46/49/22/507464922.db2.gz	XCBJAJAPZFSIJQ-UHFFFAOYSA-N	0	0	360.351	2.880	50	5		FFBARN
COc1cc(C(=O)OCc2nc(CC(C)C)no2)c([N+](=O)[O-])cc1OC	ZINC000025247123	507479366	/nfs/dbraw/zinc/47/93/66/507479366.db2.gz	OQLDPEQKGAZEFO-UHFFFAOYSA-N	0	0	365.342	2.551	50	5		FFBARN
O=C(Nc1ccccc1)[C@H]1CCCN1c1ncc([N+](=O)[O-])c(NC2CC2)n1	ZINC000025494870	507504621	/nfs/dbraw/zinc/50/46/21/507504621.db2.gz	UYQAETDAMSOBMQ-CQSZACIVSA-N	0	0	368.397	2.567	50	5		FFBARN
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@H]1Cc2ccccc2O1	ZINC000026865367	507615102	/nfs/dbraw/zinc/61/51/02/507615102.db2.gz	QMZIAYCOHBBECT-GFCCVEGCSA-N	0	0	368.798	2.530	50	5		FFBARN
CCn1nc(C)c([N+](=O)[O-])c1C(=O)NCc1ccc(Br)s1	ZINC000095462898	508186989	/nfs/dbraw/zinc/18/69/89/508186989.db2.gz	ACQLDIRTVLLHLN-UHFFFAOYSA-N	0	0	373.232	2.874	50	5		FFBARN
CN(C)C(=O)COc1ccc(NC(=O)/C=C\c2ccccc2[N+](=O)[O-])cc1	ZINC000098006462	1013262892	/nfs/dbraw/zinc/26/28/92/1013262892.db2.gz	SZBIECKSHXHRKS-GHXNOFRVSA-N	0	0	369.377	2.714	50	5		FFBARN
CNC(=O)c1ccc(/C=C\C(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1	ZINC000098054511	1013387309	/nfs/dbraw/zinc/38/73/09/1013387309.db2.gz	IGFVUJQTZMPSFZ-WTKPLQERSA-N	0	0	351.362	2.557	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)OCC(=O)NCCCc1ccccc1	ZINC000033546034	990395826	/nfs/dbraw/zinc/39/58/26/990395826.db2.gz	VOEVSEUFGRBONX-QXMHVHEDSA-N	0	0	368.389	2.900	50	5		FFBARN
CC1CCC(NC(=O)COC(=O)CSc2ccc([N+](=O)[O-])cc2)CC1	ZINC000004219399	219556229	/nfs/dbraw/zinc/55/62/29/219556229.db2.gz	LQPBEDHBXVUKCN-UHFFFAOYSA-N	0	0	366.439	2.925	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N[C@@H]1CCCc2ccccc21	ZINC000007920511	219833928	/nfs/dbraw/zinc/83/39/28/219833928.db2.gz	NTWRHRUGRLJIEB-QGZVFWFLSA-N	0	0	353.378	2.518	50	5		FFBARN
O=C(NCCCc1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000012921294	220043521	/nfs/dbraw/zinc/04/35/21/220043521.db2.gz	QCRXTCJAFWOBDI-UHFFFAOYSA-N	0	0	351.366	2.538	50	5		FFBARN
COc1ccc(C(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)cc1[N+](=O)[O-]	ZINC000013012886	220054024	/nfs/dbraw/zinc/05/40/24/220054024.db2.gz	MSUPVCAFUBRCPO-UHFFFAOYSA-N	0	0	369.377	2.507	50	5		FFBARN
C[C@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nncn1C	ZINC000032933548	211576915	/nfs/dbraw/zinc/57/69/15/211576915.db2.gz	AWESZJPDHWPJCV-LBPRGKRZSA-N	0	0	366.381	2.958	50	5		FFBARN
O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)c1ccc(F)c([N+](=O)[O-])c1	ZINC000032764918	211560404	/nfs/dbraw/zinc/56/04/04/211560404.db2.gz	YREYYGKKLXUAQK-UHFFFAOYSA-N	0	0	371.324	2.635	50	5		FFBARN
Cc1ccc(CN2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)cc1	ZINC000023243608	211382325	/nfs/dbraw/zinc/38/23/25/211382325.db2.gz	ALQKEWFLDNANMJ-OAHLLOKOSA-N	0	0	353.378	2.890	50	5		FFBARN
COc1ccc([C@@H]2OC(c3ccccc3[N+](=O)[O-])=NN2C(C)=O)cc1OC	ZINC000020946050	211301208	/nfs/dbraw/zinc/30/12/08/211301208.db2.gz	LZFTZWCPNNPEBE-SFHVURJKSA-N	0	0	371.349	2.851	50	5		FFBARN
COc1ccc(C2=NN(C(C)=O)[C@H](c3ccccc3[N+](=O)[O-])O2)c(OC)c1	ZINC000021092057	211305811	/nfs/dbraw/zinc/30/58/11/211305811.db2.gz	XEANMPLZOUVGIP-SFHVURJKSA-N	0	0	371.349	2.851	50	5		FFBARN
COc1ccc(C2=NN(C(C)=O)[C@@H](c3ccccc3[N+](=O)[O-])O2)cc1OC	ZINC000021090618	211305671	/nfs/dbraw/zinc/30/56/71/211305671.db2.gz	IRNITKCUEJOFPN-GOSISDBHSA-N	0	0	371.349	2.851	50	5		FFBARN
Cn1ccnc1[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000017590101	211185848	/nfs/dbraw/zinc/18/58/48/211185848.db2.gz	OCEBNRBHZPEHHH-INIZCTEOSA-N	0	0	351.366	2.629	50	5		FFBARN
O=C(NCc1ccc(CN2CCOCC2)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000018174776	211194558	/nfs/dbraw/zinc/19/45/58/211194558.db2.gz	ZHHVBFFEHIVJHQ-UHFFFAOYSA-N	0	0	370.409	2.749	50	5		FFBARN
CNS(=O)(=O)c1ccc(Sc2ccc(F)cc2F)c([N+](=O)[O-])c1	ZINC000016737917	211168897	/nfs/dbraw/zinc/16/88/97/211168897.db2.gz	VIYDCQXMNFBZPJ-UHFFFAOYSA-N	0	0	360.363	2.932	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC[C@H](c2nnc3ccccn32)C1	ZINC000013723548	211054025	/nfs/dbraw/zinc/05/40/25/211054025.db2.gz	SYZQGMJVPUYTFQ-AWEZNQCLSA-N	0	0	351.366	2.657	50	5		FFBARN
CC(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1	ZINC000004868526	210572931	/nfs/dbraw/zinc/57/29/31/210572931.db2.gz	DCDJTLSHNPCSEX-NSHDSACASA-N	0	0	371.349	2.564	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)oc1ccc(S(=O)(=O)N3CCOCC3)cc12	ZINC000003624914	210489565	/nfs/dbraw/zinc/48/95/65/210489565.db2.gz	ITVNBKVOCBYPLF-UHFFFAOYSA-N	0	0	362.363	2.515	50	5		FFBARN
COc1ccc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1[N+](=O)[O-]	ZINC000002323854	210392316	/nfs/dbraw/zinc/39/23/16/210392316.db2.gz	UEXONJDKALGVEA-QPEQYQDCSA-N	0	0	369.289	2.856	50	5		FFBARN
Cn1c2ccccc2c2c(c1=O)[C@@H](c1ccc([N+](=O)[O-])cc1)CC(=O)O2	ZINC000001427904	210351539	/nfs/dbraw/zinc/35/15/39/210351539.db2.gz	JOACQBGALQTWTC-CQSZACIVSA-N	0	0	350.330	2.888	50	5		FFBARN
O=C(Cc1ccccc1)NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000001037010	210305036	/nfs/dbraw/zinc/30/50/36/210305036.db2.gz	PBNPNYJGZXQBGK-UHFFFAOYSA-N	0	0	367.405	2.558	50	5		FFBARN
Cc1nc2ccc(Cl)cn2c(=O)c1NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000009616966	210289874	/nfs/dbraw/zinc/28/98/74/210289874.db2.gz	MFYNNWYZHRSRAS-UHFFFAOYSA-N	0	0	358.741	2.817	50	5		FFBARN
O=[N+]([O-])c1cccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)c1	ZINC000000865188	210282508	/nfs/dbraw/zinc/28/25/08/210282508.db2.gz	IMEHRNXVSBPIER-UHFFFAOYSA-N	0	0	355.394	2.641	50	5		FFBARN
Cc1nc(SCCOc2ccccc2[N+](=O)[O-])sc1CC(N)=O	ZINC000053664876	221046767	/nfs/dbraw/zinc/04/67/67/221046767.db2.gz	MNKYMIPWKUWBQO-UHFFFAOYSA-N	0	0	353.425	2.559	50	5		FFBARN
O=C(Cn1cc(Br)c([N+](=O)[O-])n1)NCc1cccc(Cl)c1	ZINC000054919795	221056546	/nfs/dbraw/zinc/05/65/46/221056546.db2.gz	NITYHLDNHGEKKW-UHFFFAOYSA-N	0	0	373.594	2.524	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000065553178	221234005	/nfs/dbraw/zinc/23/40/05/221234005.db2.gz	IEDSBHSMBXQIOU-CYBMUJFWSA-N	0	0	373.365	2.907	50	5		FFBARN
COc1ccc(CNC(=O)c2c[nH]nc2-c2ccc([N+](=O)[O-])cc2)cc1	ZINC000072329378	221467916	/nfs/dbraw/zinc/46/79/16/221467916.db2.gz	ZNAAGOBLAGPQOO-UHFFFAOYSA-N	0	0	352.350	2.924	50	5		FFBARN
Cc1c(C(=O)N2CCN(c3ccccc3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000002729427	132383974	/nfs/dbraw/zinc/38/39/74/132383974.db2.gz	KFBGGOOJRQXRIP-UHFFFAOYSA-N	0	0	370.365	2.774	50	5		FFBARN
NC(=O)c1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)cc1	ZINC000014830416	132875183	/nfs/dbraw/zinc/87/51/83/132875183.db2.gz	PEBFWKXLOQDJDX-UHFFFAOYSA-N	0	0	368.393	2.936	50	5		FFBARN
O=C(NCc1ccccn1)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000035870205	132937560	/nfs/dbraw/zinc/93/75/60/132937560.db2.gz	CITKAHJLPPLHFL-IEBWSBKVSA-N	0	0	366.421	2.837	50	5		FFBARN
CCCCC(=O)NC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)OC)CC1	ZINC000048309823	136123351	/nfs/dbraw/zinc/12/33/51/136123351.db2.gz	CSCCKEDREIOLET-UHFFFAOYSA-N	0	0	363.414	2.657	50	5		FFBARN
Cc1cccc2c1N(C(=O)c1cc([N+](=O)[O-])cc(S(C)(=O)=O)c1)CCC2	ZINC000058168819	136130702	/nfs/dbraw/zinc/13/07/02/136130702.db2.gz	JNGWWMBJSLLZSW-UHFFFAOYSA-N	0	0	374.418	2.900	50	5		FFBARN
Cc1c([C@@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cnn1C	ZINC000024999754	136153152	/nfs/dbraw/zinc/15/31/52/136153152.db2.gz	NGQCDJGVQSEARP-CYBMUJFWSA-N	0	0	371.441	2.731	50	5		FFBARN
O=C(CCc1ccccc1)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000096275565	222108476	/nfs/dbraw/zinc/10/84/76/222108476.db2.gz	XKPJYCVZHCIGKR-UHFFFAOYSA-N	0	0	352.350	2.894	50	5		FFBARN
COc1cc2s/c(=N\C(=O)c3ccc([N+](=O)[O-])cc3)n(C)c2cc1OC	ZINC000101035528	222261168	/nfs/dbraw/zinc/26/11/68/222261168.db2.gz	LBKALIQCNUKZKX-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
O=c1c2c(nc3c4ccccc4c(NCCO)nn13)sc1c2CCCC1	ZINC000002679227	506288186	/nfs/dbraw/zinc/28/81/86/506288186.db2.gz	ONGPFQBAWCTHGQ-UHFFFAOYSA-N	0	0	366.446	2.740	50	5		FFBARN
COC(=O)C1=CN(C(C)(C)C)C=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1	ZINC000002881124	506299764	/nfs/dbraw/zinc/29/97/64/506299764.db2.gz	UYLKABNEVSLAIS-UHFFFAOYSA-N	0	0	374.393	2.906	50	5		FFBARN
COCCOc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2)cc1C	ZINC000032831054	506302166	/nfs/dbraw/zinc/30/21/66/506302166.db2.gz	OQOLNRBXWNXOIZ-UHFFFAOYSA-N	0	0	366.395	2.729	50	5		FFBARN
COc1ccc(C2=N/C(=C/c3ccccc3[N+](=O)[O-])C(=O)O2)cc1OC	ZINC000002945176	506303932	/nfs/dbraw/zinc/30/39/32/506303932.db2.gz	LIPJMCNQQZNHFI-UKTHLTGXSA-N	0	0	354.318	2.957	50	5		FFBARN
COCCOC(=O)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1C2=O	ZINC000003128845	506310605	/nfs/dbraw/zinc/31/06/05/506310605.db2.gz	AWYTWJUMNFGOMD-UHFFFAOYSA-N	0	0	372.289	2.518	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1nnc(-c2cccnc2)s1	ZINC000003189658	506312814	/nfs/dbraw/zinc/31/28/14/506312814.db2.gz	YXWWZGQJHLAJGY-UHFFFAOYSA-N	0	0	357.351	2.526	50	5		FFBARN
CCOC(=O)c1c(C)[nH]c(C)c1C(=O)COC(=O)c1cccc([N+](=O)[O-])c1	ZINC000003313461	506319708	/nfs/dbraw/zinc/31/97/08/506319708.db2.gz	WPFUDRZNHMQJEW-UHFFFAOYSA-N	0	0	374.349	2.756	50	5		FFBARN
CCOC(=O)c1ccccc1NC(=O)COC(=O)c1cccc([N+](=O)[O-])c1	ZINC000003300605	506320797	/nfs/dbraw/zinc/32/07/97/506320797.db2.gz	KSFGCTMUSNCUDQ-UHFFFAOYSA-N	0	0	372.333	2.567	50	5		FFBARN
CCOc1ccc(NC(=O)CCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000003482902	506335138	/nfs/dbraw/zinc/33/51/38/506335138.db2.gz	REJRWELSUDZSFR-UHFFFAOYSA-N	0	0	357.366	2.752	50	5		FFBARN
O=C(COc1ccc2ccc(=O)oc2c1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000003598912	506346791	/nfs/dbraw/zinc/34/67/91/506346791.db2.gz	CTGSGATXDNZYKU-UHFFFAOYSA-N	0	0	358.281	2.858	50	5		FFBARN
CCCCOC(=O)C1C(C)=Nc2ncnn2[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000003907120	506353744	/nfs/dbraw/zinc/35/37/44/506353744.db2.gz	UERDQUGJKKYWFK-OAHLLOKOSA-N	0	0	357.370	2.819	50	5		FFBARN
O=C1C(Cl)=C(Oc2ccc([N+](=O)[O-])cc2)C(=O)N1Cc1ccccc1	ZINC000004043313	506354529	/nfs/dbraw/zinc/35/45/29/506354529.db2.gz	JBAQOXOOZVNVQZ-UHFFFAOYSA-N	0	0	358.737	2.993	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(S(=O)(=O)/C=C/c3ccccc3)CC2)cc1	ZINC000004188640	506364669	/nfs/dbraw/zinc/36/46/69/506364669.db2.gz	DCAJIQOBDLQMJU-XNTDXEJSSA-N	0	0	373.434	2.718	50	5		FFBARN
CN1CCN(c2c3ccccc3n(-c3ccccc3)c(=O)c2[N+](=O)[O-])CC1	ZINC000004263727	506367736	/nfs/dbraw/zinc/36/77/36/506367736.db2.gz	IVPOUSHRTVIOIG-UHFFFAOYSA-N	0	0	364.405	2.651	50	5		FFBARN
O=C1NCCCC[C@H]1Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000004306703	506369432	/nfs/dbraw/zinc/36/94/32/506369432.db2.gz	HHYZNTQFJBNUSS-MRVPVSSYSA-N	0	0	362.264	2.602	50	5		FFBARN
CC(C)(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCC3)c2)CC1	ZINC000004676002	506386224	/nfs/dbraw/zinc/38/62/24/506386224.db2.gz	PASZSDQGEOLWDO-UHFFFAOYSA-N	0	0	360.458	2.890	50	5		FFBARN
Cc1ccn(-c2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2)n1	ZINC000004697951	506387443	/nfs/dbraw/zinc/38/74/43/506387443.db2.gz	OOEBNMJGVIVEST-UHFFFAOYSA-N	0	0	358.379	2.890	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000004725161	506392171	/nfs/dbraw/zinc/39/21/71/506392171.db2.gz	KVXMFALNGFOCRG-SMDDNHRTSA-N	0	0	357.288	2.848	50	5		FFBARN
CCCNS(=O)(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000004784085	506395668	/nfs/dbraw/zinc/39/56/68/506395668.db2.gz	OLYNLAYELGMKLU-UHFFFAOYSA-N	0	0	363.395	2.535	50	5		FFBARN
Cc1ccc(OCCNS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000004833807	506397344	/nfs/dbraw/zinc/39/73/44/506397344.db2.gz	JDAVQUCJHNRYRL-UHFFFAOYSA-N	0	0	350.396	2.569	50	5		FFBARN
Cc1ccc(C(=O)Nc2cc3c4c(c2)CCCN4C(=O)C3)cc1[N+](=O)[O-]	ZINC000004850544	506398524	/nfs/dbraw/zinc/39/85/24/506398524.db2.gz	YLPDSFJAVQPDSK-UHFFFAOYSA-N	0	0	351.362	2.991	50	5		FFBARN
COc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)c1	ZINC000004895963	506402302	/nfs/dbraw/zinc/40/23/02/506402302.db2.gz	WLKWQUASIVBDJL-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
Cc1noc(C)c1CN1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000036391118	506403813	/nfs/dbraw/zinc/40/38/13/506403813.db2.gz	SPJJEOXAEWHOMA-UHFFFAOYSA-N	0	0	359.386	2.549	50	5		FFBARN
Nc1nc(NC[C@@H]2CCCO2)nc(Nc2cccc(Cl)c2)c1[N+](=O)[O-]	ZINC000005094198	506420226	/nfs/dbraw/zinc/42/02/26/506420226.db2.gz	AADOHPJLNNJGGG-NSHDSACASA-N	0	0	364.793	2.955	50	5		FFBARN
COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCCC1=O	ZINC000005440202	506442931	/nfs/dbraw/zinc/44/29/31/506442931.db2.gz	HNYARAYKWGECMW-UHFFFAOYSA-N	0	0	355.350	2.983	50	5		FFBARN
Cc1ccc(C(=O)CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000039570109	506454186	/nfs/dbraw/zinc/45/41/86/506454186.db2.gz	NWGVNCFBYBQROE-LJQANCHMSA-N	0	0	367.361	2.553	50	5		FFBARN
O=C(COC(=O)c1ccc(O)cc1)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005700405	506454742	/nfs/dbraw/zinc/45/47/42/506454742.db2.gz	RKVGAZLKNCMQPC-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
C[C@@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000039588712	506455038	/nfs/dbraw/zinc/45/50/38/506455038.db2.gz	ORFABDSRIZOZMU-SNVBAGLBSA-N	0	0	354.322	2.655	50	5		FFBARN
O=C(CCOc1cccc(F)c1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000040069585	506463514	/nfs/dbraw/zinc/46/35/14/506463514.db2.gz	HGRCGIWBHBBONY-UHFFFAOYSA-N	0	0	373.384	2.852	50	5		FFBARN
O=C(CSc1nc2ccccc2c(=O)[nH]1)Nc1ccc([N+](=O)[O-])cc1	ZINC000006566738	506488820	/nfs/dbraw/zinc/48/88/20/506488820.db2.gz	AWJCKSUTABKWJM-UHFFFAOYSA-N	0	0	356.363	2.562	50	5		FFBARN
COc1ccc(O[C@@H](C(=O)N2CCOCC2)c2ccccc2)c([N+](=O)[O-])c1	ZINC000006846904	506511636	/nfs/dbraw/zinc/51/16/36/506511636.db2.gz	JOULWPZMCBMWMR-GOSISDBHSA-N	0	0	372.377	2.582	50	5		FFBARN
CSc1ccc(C(=O)NCCCOC[C@H]2CCCO2)cc1[N+](=O)[O-]	ZINC000009155406	506683073	/nfs/dbraw/zinc/68/30/73/506683073.db2.gz	QYISAXJKOXWTFJ-CYBMUJFWSA-N	0	0	354.428	2.632	50	5		FFBARN
O=C(NC[C@H]1COc2ccccc2O1)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000009157456	506684991	/nfs/dbraw/zinc/68/49/91/506684991.db2.gz	SGXRGNSCMFLZOV-AWEZNQCLSA-N	0	0	369.377	2.739	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])NCCc1cnn(-c2ccccc2)c1	ZINC000011147199	506766172	/nfs/dbraw/zinc/76/61/72/506766172.db2.gz	JGYUXKUOGRRLTF-UHFFFAOYSA-N	0	0	366.377	2.518	50	5		FFBARN
CCOC(=O)[C@@H]1CCCCN1Cc1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000055543128	506773938	/nfs/dbraw/zinc/77/39/38/506773938.db2.gz	GBYDFWQXQSDEBU-ZDUSSCGKSA-N	0	0	352.387	2.530	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)[C@@H](N1CCOCC1)/C(=C\C1(O)CCCCC1)O2	ZINC000012375206	506856127	/nfs/dbraw/zinc/85/61/27/506856127.db2.gz	NTHQPAPZADRELK-VJSYINPZSA-N	0	0	360.410	2.940	50	5		FFBARN
CN(C[C@@H]1COc2ccccc2O1)C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000012553004	506877942	/nfs/dbraw/zinc/87/79/42/506877942.db2.gz	AMYPGSFCIIQSPQ-CQSZACIVSA-N	0	0	371.393	2.695	50	5		FFBARN
O=C(CCC(=O)N1CCC(c2ccccc2)=N1)Nc1cccc([N+](=O)[O-])c1	ZINC000012774373	506900369	/nfs/dbraw/zinc/90/03/69/506900369.db2.gz	MNXLCVOQOWVICQ-UHFFFAOYSA-N	0	0	366.377	2.950	50	5		FFBARN
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000012982194	506921543	/nfs/dbraw/zinc/92/15/43/506921543.db2.gz	QYMJBYPKMMIAOA-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
CN(C)C(=O)[C@H](c1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000015443448	507041469	/nfs/dbraw/zinc/04/14/69/507041469.db2.gz	SMMWNBRJYFVAAX-IBGZPJMESA-N	0	0	368.437	2.546	50	5		FFBARN
Cc1cccc(C)c1OC[C@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000046060868	507071409	/nfs/dbraw/zinc/07/14/09/507071409.db2.gz	PRANBZVFYFNJMY-QGZVFWFLSA-N	0	0	368.393	2.910	50	5		FFBARN
CC(C)(C)NC(=O)[C@@H]1Cc2ccccc2CN1c1ncccc1[N+](=O)[O-]	ZINC000020386069	507220150	/nfs/dbraw/zinc/22/01/50/507220150.db2.gz	HCVVKYGIOCDOEX-INIZCTEOSA-N	0	0	354.410	2.836	50	5		FFBARN
CC(C)COC(=O)N1CCCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1	ZINC000057265191	507222093	/nfs/dbraw/zinc/22/20/93/507222093.db2.gz	DRRUPLIWHFTORQ-UHFFFAOYSA-N	0	0	364.402	2.927	50	5		FFBARN
CS(=O)(=O)c1cc(C(=O)N2CCCCc3ccccc32)cc([N+](=O)[O-])c1	ZINC000058167426	507378735	/nfs/dbraw/zinc/37/87/35/507378735.db2.gz	XZUALSUQILUZFO-UHFFFAOYSA-N	0	0	374.418	2.981	50	5		FFBARN
O=C(CCCNc1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)NC(=O)CO2	ZINC000024180206	507396332	/nfs/dbraw/zinc/39/63/32/507396332.db2.gz	UMUWHMWURIHUQE-UHFFFAOYSA-N	0	0	370.365	2.757	50	5		FFBARN
CN(C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)c1ccccc1	ZINC000026765241	507607695	/nfs/dbraw/zinc/60/76/95/507607695.db2.gz	NDRBRSJOBTWZPW-UHFFFAOYSA-N	0	0	355.350	2.946	50	5		FFBARN
O=C(COc1cccc(NC(=O)c2ccccc2[N+](=O)[O-])c1)N1CCCC1	ZINC000027447671	507656715	/nfs/dbraw/zinc/65/67/15/507656715.db2.gz	CQRFMQKHELUOMV-UHFFFAOYSA-N	0	0	369.377	2.848	50	5		FFBARN
Cc1ccc(NC(=O)c2ccc(=O)n(Cc3ccccc3)n2)cc1[N+](=O)[O-]	ZINC000028700169	507738827	/nfs/dbraw/zinc/73/88/27/507738827.db2.gz	DSVCFPHQSQULDB-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000031209935	507818124	/nfs/dbraw/zinc/81/81/24/507818124.db2.gz	JCOUSCJNTRCYBF-UHFFFAOYSA-N	0	0	372.377	2.819	50	5		FFBARN
COc1ccc(C)cc1[C@@]1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000089616389	507850904	/nfs/dbraw/zinc/85/09/04/507850904.db2.gz	LFZCJNJSMRCYGR-LJQANCHMSA-N	0	0	369.377	2.879	50	5		FFBARN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(N(C)C)n1	ZINC000089478867	525990229	/nfs/dbraw/zinc/99/02/29/525990229.db2.gz	FNVWTCMPGXCNOR-GFCCVEGCSA-N	0	0	360.439	2.853	50	5		FFBARN
O=[N+]([O-])c1ccccc1CCS(=O)(=O)NCCCOC1CCCCC1	ZINC000089813906	527399321	/nfs/dbraw/zinc/39/93/21/527399321.db2.gz	GAPWMFATWSVSTO-UHFFFAOYSA-N	0	0	370.471	2.796	50	5		FFBARN
Cc1cccc(C(=O)NCCCN(C)C(=O)OC(C)(C)C)c1[N+](=O)[O-]	ZINC000048012816	570934173	/nfs/dbraw/zinc/93/41/73/570934173.db2.gz	KNCDMKCGUGSKQV-UHFFFAOYSA-N	0	0	351.403	2.890	50	5		FFBARN
O=C(c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-])N1CCSCC1	ZINC000049213807	570961409	/nfs/dbraw/zinc/96/14/09/570961409.db2.gz	BQGPBOVSDSHBRR-UHFFFAOYSA-N	0	0	350.318	2.725	50	5		FFBARN
COCCN(C(=O)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1)C1CCCC1	ZINC000049656588	570964778	/nfs/dbraw/zinc/96/47/78/570964778.db2.gz	FJOCOBWAERQPBY-UHFFFAOYSA-N	0	0	358.398	2.812	50	5		FFBARN
C[C@H]1Oc2ccc(NC(=O)/C=C\c3ccccc3[N+](=O)[O-])cc2NC1=O	ZINC000096912941	1012456532	/nfs/dbraw/zinc/45/65/32/1012456532.db2.gz	ZGDNMUOFPATBPP-DHHDDZJSSA-N	0	0	353.334	2.966	50	5		FFBARN
O=C(Oc1cc(=O)oc2c3cccc4c3n(c(=O)c12)CCC4)c1ccco1	ZINC000000642483	210256144	/nfs/dbraw/zinc/25/61/44/210256144.db2.gz	APXCVYYABMPPAH-UHFFFAOYSA-N	0	0	363.325	2.866	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@@H](C)OC(=O)c2ccccc2[N+](=O)[O-])c1C	ZINC000012823375	220034830	/nfs/dbraw/zinc/03/48/30/220034830.db2.gz	CWGNRTLCBCLREE-LLVKDONJSA-N	0	0	374.349	2.755	50	5		FFBARN
Cc1nn(C)c(NC[C@H](O)COc2cccc(C(F)(F)F)c2)c1[N+](=O)[O-]	ZINC000058244796	212000008	/nfs/dbraw/zinc/00/00/08/212000008.db2.gz	UXPKNTZPGIBQKD-NSHDSACASA-N	0	0	374.319	2.507	50	5		FFBARN
CNC(=O)c1ccc(CN(C(=O)c2cccc([N+](=O)[O-])c2)C2CC2)cc1	ZINC000013009264	220052824	/nfs/dbraw/zinc/05/28/24/220052824.db2.gz	DDSNHAXCWLUPQM-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
C[C@]1(c2ccc(F)cc2)NC(=O)N(CCOc2ccccc2[N+](=O)[O-])C1=O	ZINC000047354400	211852541	/nfs/dbraw/zinc/85/25/41/211852541.db2.gz	XBVLTOJKLXIWIW-GOSISDBHSA-N	0	0	373.340	2.580	50	5		FFBARN
COc1cc(CCNC(=O)Cc2ccsc2)c([N+](=O)[O-])cc1OC	ZINC000032788444	211562487	/nfs/dbraw/zinc/56/24/87/211562487.db2.gz	MSSGWUDZJNJFRW-UHFFFAOYSA-N	0	0	350.396	2.575	50	5		FFBARN
CCCNC(=O)c1ccccc1NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21	ZINC000040080054	211484753	/nfs/dbraw/zinc/48/47/53/211484753.db2.gz	PMSKHFGZPWRPMI-UHFFFAOYSA-N	0	0	367.365	2.863	50	5		FFBARN
Cc1nc(-c2ccc3c(c2)CCN3C(=O)Cn2cnc([N+](=O)[O-])c2)cs1	ZINC000025586724	211432688	/nfs/dbraw/zinc/43/26/88/211432688.db2.gz	UMTOAWQGECEDSB-UHFFFAOYSA-N	0	0	369.406	2.813	50	5		FFBARN
Cc1ccc(S(C)(=O)=O)cc1C(=O)N(C)Cc1cccc([N+](=O)[O-])c1	ZINC000025253406	211426278	/nfs/dbraw/zinc/42/62/78/211426278.db2.gz	XPWDLMBDPOZPHL-UHFFFAOYSA-N	0	0	362.407	2.579	50	5		FFBARN
CC(=O)N1N=C(c2ccccc2[N+](=O)[O-])O[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000020946046	211301761	/nfs/dbraw/zinc/30/17/61/211301761.db2.gz	FJZQDWPVUZEAMP-INIZCTEOSA-N	0	0	356.294	2.742	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1ccccc1	ZINC000015178974	211123294	/nfs/dbraw/zinc/12/32/94/211123294.db2.gz	RMTCALJDOSLXRR-CQSZACIVSA-N	0	0	355.394	2.934	50	5		FFBARN
Cc1ccc2[nH]cc(CCNS(=O)(=O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000013957969	211066222	/nfs/dbraw/zinc/06/62/22/211066222.db2.gz	RUHMPZBKMXRPCC-UHFFFAOYSA-N	0	0	359.407	2.906	50	5		FFBARN
CC(=O)Nc1cccc([C@@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000036394720	210844915	/nfs/dbraw/zinc/84/49/15/210844915.db2.gz	SGKYTNRJWXQZOV-GFCCVEGCSA-N	0	0	357.366	2.809	50	5		FFBARN
Cc1ccc(NC(=O)Cn2nnc(-c3ccccc3C)n2)c([N+](=O)[O-])c1	ZINC000006204031	210660997	/nfs/dbraw/zinc/66/09/97/210660997.db2.gz	IMBMAYHKTUGIFW-UHFFFAOYSA-N	0	0	352.354	2.504	50	5		FFBARN
CCOC(=O)C(CCCCOc1ccc([N+](=O)[O-])cc1)C(=O)OCC	ZINC000004949197	210584640	/nfs/dbraw/zinc/58/46/40/210584640.db2.gz	AYBNPPBJLWEEST-UHFFFAOYSA-N	0	0	353.371	2.886	50	5		FFBARN
CCOC(=O)N1CCN(C(=O)c2cc3cc([N+](=O)[O-])ccc3s2)CC1	ZINC000003218168	210456127	/nfs/dbraw/zinc/45/61/27/210456127.db2.gz	BZYYNSOYBBNVCY-UHFFFAOYSA-N	0	0	363.395	2.724	50	5		FFBARN
CC(=O)c1c(C)[nH]c(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1C	ZINC000002662314	210413408	/nfs/dbraw/zinc/41/34/08/210413408.db2.gz	DFJOOIOQXCPGHT-UHFFFAOYSA-N	0	0	374.349	2.966	50	5		FFBARN
O=C(NC(=S)Nc1nc(-c2cccc([N+](=O)[O-])c2)cs1)c1ccco1	ZINC000002053680	210377832	/nfs/dbraw/zinc/37/78/32/210377832.db2.gz	PPLSVHYXTYKKLO-UHFFFAOYSA-N	0	0	374.403	2.860	50	5		FFBARN
COc1cc(NC(=O)c2ccccc2CC[N+](=O)[O-])cc(OC)c1OC	ZINC000001398077	210348986	/nfs/dbraw/zinc/34/89/86/210348986.db2.gz	DGFHMBHIUVSPAE-UHFFFAOYSA-N	0	0	360.366	2.784	50	5		FFBARN
COc1ccc(/C=C2/NC(=O)N(Cc3ccccc3F)C2=O)cc1[N+](=O)[O-]	ZINC000001132648	210323281	/nfs/dbraw/zinc/32/32/81/210323281.db2.gz	RVSCHHNDABYDDR-RIYZIHGNSA-N	0	0	371.324	2.835	50	5		FFBARN
CCCn1c(CC)nc([N+](=O)[O-])c1S(=O)(=O)c1ccc(Cl)cn1	ZINC000000987851	210299064	/nfs/dbraw/zinc/29/90/64/210299064.db2.gz	QAQLCRLGFZHETL-UHFFFAOYSA-N	0	0	358.807	2.645	50	5		FFBARN
COC(=O)c1ccccc1NC(=S)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000000940111	210292402	/nfs/dbraw/zinc/29/24/02/210292402.db2.gz	POKQCBYBVPHYAI-UHFFFAOYSA-N	0	0	359.363	2.508	50	5		FFBARN
O=[N+]([O-])c1ccc(CN2CCN(Cc3ccc4c(c3)OCO4)CC2)cc1	ZINC000000865246	210283021	/nfs/dbraw/zinc/28/30/21/210283021.db2.gz	YBVYBXITRCVUEC-UHFFFAOYSA-N	0	0	355.394	2.641	50	5		FFBARN
CCn1c(=O)c([N+](=O)[O-])c(N(CCO)Cc2ccccc2)c2ccccc21	ZINC000009328459	210271273	/nfs/dbraw/zinc/27/12/73/210271273.db2.gz	UPNHJRPUWUGIOE-UHFFFAOYSA-N	0	0	367.405	2.929	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N(C)Cc1ccccc1	ZINC000000797418	210272649	/nfs/dbraw/zinc/27/26/49/210272649.db2.gz	NKOIZMNRAAQGDI-UHFFFAOYSA-N	0	0	367.203	2.521	50	5		FFBARN
O=[N+]([O-])c1c(Cl)c([N+](=O)[O-])c(N2CCOCC2)c([N+](=O)[O-])c1Cl	ZINC000101496891	132234020	/nfs/dbraw/zinc/23/40/20/132234020.db2.gz	XZSXBQUQXKNELM-UHFFFAOYSA-N	0	0	367.101	2.555	50	5		FFBARN
COc1ccc(OCCNc2cc(N3CCOCC3)ccc2[N+](=O)[O-])cc1	ZINC000004117155	132386422	/nfs/dbraw/zinc/38/64/22/132386422.db2.gz	YYYJTRHICSBNKZ-UHFFFAOYSA-N	0	0	373.409	2.931	50	5		FFBARN
CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccccc3)c2)CC1	ZINC000004104330	132386438	/nfs/dbraw/zinc/38/64/38/132386438.db2.gz	PEVJOWTYIDYLMT-UHFFFAOYSA-N	0	0	354.410	2.875	50	5		FFBARN
Cc1nc(N2CCN(c3ccccc3)CC2)nc(N2CCCC2)c1[N+](=O)[O-]	ZINC000038488494	136118814	/nfs/dbraw/zinc/11/88/14/136118814.db2.gz	ZZPJRJRCGGAYKS-UHFFFAOYSA-N	0	0	368.441	2.620	50	5		FFBARN
Cc1cc(C)n(C[C@@H]2CC(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)n1	ZINC000100932502	222257503	/nfs/dbraw/zinc/25/75/03/222257503.db2.gz	TYVWYKYIURXAQM-NSHDSACASA-N	0	0	362.773	2.641	50	5		FFBARN
CC(C)(CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)N1CCOCC1	ZINC000032674434	506277042	/nfs/dbraw/zinc/27/70/42/506277042.db2.gz	QNMFFVFQWKZAKB-UHFFFAOYSA-N	0	0	363.439	2.650	50	5		FFBARN
O=C(NC1CCN(C(=O)C2CCCCC2)CC1)c1csc([N+](=O)[O-])c1	ZINC000052992368	506293101	/nfs/dbraw/zinc/29/31/01/506293101.db2.gz	FJDBPTJPVDPOIG-UHFFFAOYSA-N	0	0	365.455	2.957	50	5		FFBARN
O=C(Nc1ccc2ccccc2c1)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002796665	506293412	/nfs/dbraw/zinc/29/34/12/506293412.db2.gz	YPTXYJGZQXSTEU-UHFFFAOYSA-N	0	0	362.349	2.899	50	5		FFBARN
Cc1sc(C(=O)NCCN2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000032827678	506300614	/nfs/dbraw/zinc/30/06/14/506300614.db2.gz	XCXRLKXUKXVWHK-UHFFFAOYSA-N	0	0	374.466	2.517	50	5		FFBARN
CSc1ncccc1C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000003331751	506322257	/nfs/dbraw/zinc/32/22/57/506322257.db2.gz	RZQMUKHNZXEGJU-UHFFFAOYSA-N	0	0	362.363	2.935	50	5		FFBARN
O=[N+]([O-])c1ccc(-n2ncc3c2cc([N+](=O)[O-])cc3[N+](=O)[O-])c([N+](=O)[O-])c1	ZINC000033353949	506357262	/nfs/dbraw/zinc/35/72/62/506357262.db2.gz	URDVCOUTNQZQSO-UHFFFAOYSA-N	0	0	374.225	2.658	50	5		FFBARN
COc1ccccc1OCCNc1cc(N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000004455744	506375655	/nfs/dbraw/zinc/37/56/55/506375655.db2.gz	FIZFQRGELLVZCI-UHFFFAOYSA-N	0	0	373.409	2.931	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)/C=C\c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000004497009	506377773	/nfs/dbraw/zinc/37/77/73/506377773.db2.gz	WXKGCSRIFSGNBH-BDJZEXMMSA-N	0	0	365.389	2.838	50	5		FFBARN
O=[N+]([O-])c1cc(N[C@@H]2C[C@@H](O)[C@H](O)CO2)cc(Sc2ccccc2)c1	ZINC000004571273	506383720	/nfs/dbraw/zinc/38/37/20/506383720.db2.gz	AQFSCHZBYWUHCK-ZACQAIPSSA-N	0	0	362.407	2.626	50	5	biogenic,in-vitro	FFBARN
O=C(Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004732003	506390857	/nfs/dbraw/zinc/39/08/57/506390857.db2.gz	YROVNUQGPJIEJV-JTQLQIEISA-N	0	0	361.304	2.865	50	5		FFBARN
C[C@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000004824124	506397604	/nfs/dbraw/zinc/39/76/04/506397604.db2.gz	ZRLXKBZYHIGTPK-JTQLQIEISA-N	0	0	354.322	2.655	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@@H](/C=C\c2ccc([N+](=O)[O-])cc2)N3)C1	ZINC000004854423	506399374	/nfs/dbraw/zinc/39/93/74/506399374.db2.gz	PXRUSSQOZFNDPD-IJVDHGTGSA-N	0	0	370.434	2.839	50	5		FFBARN
CN(CC(=O)Nc1ccc(N2CCOCC2)cc1)c1ccccc1[N+](=O)[O-]	ZINC000004905103	506403668	/nfs/dbraw/zinc/40/36/68/506403668.db2.gz	PXSABICANOECNY-UHFFFAOYSA-N	0	0	370.409	2.506	50	5		FFBARN
O=C(Nc1ccc(F)c(F)c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004902884	506404672	/nfs/dbraw/zinc/40/46/72/506404672.db2.gz	VHAWCJOSSRCIPY-UHFFFAOYSA-N	0	0	363.320	2.962	50	5		FFBARN
O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1NCCc1ccccc1	ZINC000004922910	506406455	/nfs/dbraw/zinc/40/64/55/506406455.db2.gz	WEJBIZTVGOIMQH-UHFFFAOYSA-N	0	0	359.773	2.722	50	5		FFBARN
COc1ccc(C(=O)N2CCN(CCc3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000053666712	506423869	/nfs/dbraw/zinc/42/38/69/506423869.db2.gz	SJSOACCGNLCIJQ-UHFFFAOYSA-N	0	0	369.421	2.604	50	5		FFBARN
Cc1ccc(C(=O)Nc2cc3c4c(c2)CCC(=O)N4CC3)cc1[N+](=O)[O-]	ZINC000005153388	506426176	/nfs/dbraw/zinc/42/61/76/506426176.db2.gz	BLMMSRUAZOTNLF-UHFFFAOYSA-N	0	0	351.362	2.991	50	5		FFBARN
CC(=O)N1N=C(c2c(C)nc3ccccn32)O[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000005646365	506453441	/nfs/dbraw/zinc/45/34/41/506453441.db2.gz	BYEMPVFEQRWDEO-GOSISDBHSA-N	0	0	365.349	2.790	50	5		FFBARN
COc1ccc(NC(=O)NC(=O)COc2cccc([N+](=O)[O-])c2C)cc1	ZINC000053837547	506454341	/nfs/dbraw/zinc/45/43/41/506454341.db2.gz	FUZLIBFSXFRALB-UHFFFAOYSA-N	0	0	359.338	2.639	50	5		FFBARN
COC(=O)c1ccc(CN(C)C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)cc1	ZINC000040072270	506463245	/nfs/dbraw/zinc/46/32/45/506463245.db2.gz	LBJSOZCOBKNBRF-UHFFFAOYSA-N	0	0	368.349	2.530	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc(=O)n(-c2ccc(F)cc2)n1	ZINC000040086801	506464718	/nfs/dbraw/zinc/46/47/18/506464718.db2.gz	GXNPVLOUDSVYAF-UHFFFAOYSA-N	0	0	354.297	2.532	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@@H]1CCCN(C(=O)N(C)C)C1	ZINC000040092173	506467266	/nfs/dbraw/zinc/46/72/66/506467266.db2.gz	ZPVVOOIHZKMFJJ-DZGCQCFKSA-N	0	0	362.430	2.508	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(SC(F)F)cc1	ZINC000006120017	506467534	/nfs/dbraw/zinc/46/75/34/506467534.db2.gz	ZDMCGHYXTAXHJZ-UHFFFAOYSA-N	0	0	355.322	2.710	50	5		FFBARN
COc1ccc(C(=O)Nc2sc3c(c2C(N)=O)CCC3)cc1[N+](=O)[O-]	ZINC000006762021	506503740	/nfs/dbraw/zinc/50/37/40/506503740.db2.gz	YOKABJLXPBPGLZ-UHFFFAOYSA-N	0	0	361.379	2.505	50	5		FFBARN
Cc1c(NCC(=O)N2CCN(c3ccc(F)cc3)CC2)cccc1[N+](=O)[O-]	ZINC000008745610	506665289	/nfs/dbraw/zinc/66/52/89/506665289.db2.gz	SKVWHPKBGCFECJ-UHFFFAOYSA-N	0	0	372.400	2.803	50	5		FFBARN
CC(C)(C)c1ccc(C(=O)OCC(=O)NC(=O)c2ccco2)cc1[N+](=O)[O-]	ZINC000009513810	506700937	/nfs/dbraw/zinc/70/09/37/506700937.db2.gz	CYAHPEFWUCDKPV-UHFFFAOYSA-N	0	0	374.349	2.599	50	5		FFBARN
Cc1cc(NC(=O)CN(C)C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)no1	ZINC000010031647	506723091	/nfs/dbraw/zinc/72/30/91/506723091.db2.gz	UZHMGEBSSBTEOJ-UHFFFAOYSA-N	0	0	374.397	2.899	50	5		FFBARN
Cc1nc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)sc1C	ZINC000012522786	506869669	/nfs/dbraw/zinc/86/96/69/506869669.db2.gz	VJHVJQNFBICOQS-UHFFFAOYSA-N	0	0	362.411	2.757	50	5		FFBARN
CC(=O)Nc1ccc2c(COc3cccnc3[N+](=O)[O-])cc(=O)oc2c1	ZINC000012546990	506875823	/nfs/dbraw/zinc/87/58/23/506875823.db2.gz	JTMBRHSHMKYEQJ-UHFFFAOYSA-N	0	0	355.306	2.634	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CNc1ccccc1C(=O)NC1CC1	ZINC000012562139	506880412	/nfs/dbraw/zinc/88/04/12/506880412.db2.gz	NWEYBBUCBNCXGZ-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)nc1n(c2=O)CCC1	ZINC000012845049	506908060	/nfs/dbraw/zinc/90/80/60/506908060.db2.gz	KXGFIQOYVDUUAB-UHFFFAOYSA-N	0	0	350.334	2.503	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(CC(=O)N2CCCC[C@H]2C)CC1	ZINC000023057677	507328128	/nfs/dbraw/zinc/32/81/28/507328128.db2.gz	OUVUVGOOYBYVAA-SJORKVTESA-N	0	0	374.485	2.674	50	5		FFBARN
O=c1c([N+](=O)[O-])c(NCc2ccccc2OC(F)F)nc2ccccn21	ZINC000024201358	507397462	/nfs/dbraw/zinc/39/74/62/507397462.db2.gz	HKXATAOUVWNRDD-UHFFFAOYSA-N	0	0	362.292	2.816	50	5		FFBARN
COc1ccccc1COC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000024666401	507427406	/nfs/dbraw/zinc/42/74/06/507427406.db2.gz	NOBCHGJJNQWEIJ-UHFFFAOYSA-N	0	0	372.377	2.797	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCc1ccc2c(c1)OCCO2	ZINC000024924122	507448844	/nfs/dbraw/zinc/44/88/44/507448844.db2.gz	KJLRYQLWVXXVPQ-UHFFFAOYSA-N	0	0	358.350	2.946	50	5		FFBARN
O=C(Cc1csc(-c2ccco2)n1)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000025354255	507493764	/nfs/dbraw/zinc/49/37/64/507493764.db2.gz	OWWIGJPHWDAIGX-CQSZACIVSA-N	0	0	373.390	2.704	50	5		FFBARN
Cc1nccc(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1	ZINC000048300854	507497843	/nfs/dbraw/zinc/49/78/43/507497843.db2.gz	DIIXBRSVLMMWCN-UHFFFAOYSA-N	0	0	369.303	2.554	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)N1CCC(c2nnc3n2CCC3)CC1	ZINC000050076465	507657280	/nfs/dbraw/zinc/65/72/80/507657280.db2.gz	WYFWDTAKUWBSGM-UHFFFAOYSA-N	0	0	356.386	2.544	50	5		FFBARN
COc1ccc2cc(C(=O)NC[C@H](O)c3ccc([N+](=O)[O-])cc3)[nH]c2c1	ZINC000031213259	507818138	/nfs/dbraw/zinc/81/81/38/507818138.db2.gz	NKOBEXQIRNUBAB-KRWDZBQOSA-N	0	0	355.350	2.548	50	5		FFBARN
C[C@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCOc2cccc(F)c2)C1=O	ZINC000031662282	507820836	/nfs/dbraw/zinc/82/08/36/507820836.db2.gz	PZQUGGFDKJEGPT-GOSISDBHSA-N	0	0	373.340	2.580	50	5		FFBARN
COc1ccc(OCCN2CCN(c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000078283037	507855761	/nfs/dbraw/zinc/85/57/61/507855761.db2.gz	FGXDHFITCBVAJO-UHFFFAOYSA-N	0	0	357.410	2.804	50	5		FFBARN
COC(=O)[C@@H]1CCC[C@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000079066065	507930000	/nfs/dbraw/zinc/93/00/00/507930000.db2.gz	HAFUARRUPOPNEI-NXEZZACHSA-N	0	0	373.312	2.659	50	5		FFBARN
Cc1ccc(-c2nnc3sc(=Cc4ccc([N+](=O)[O-])cc4)c(=O)n32)cc1	ZINC000252669204	509857352	/nfs/dbraw/zinc/85/73/52/509857352.db2.gz	GVMRZKIUTZOGRS-UHFFFAOYSA-N	0	0	364.386	2.582	50	5		FFBARN
CC(C)c1ccc(C=c2sc(=CC(=O)C(C)(C)C)[nH]c2=O)cc1[N+](=O)[O-]	ZINC000245263563	509886519	/nfs/dbraw/zinc/88/65/19/509886519.db2.gz	ASSAIQCXARDORQ-UHFFFAOYSA-N	0	0	374.462	2.693	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1c2ccccc2[C@H](C(N)=O)C[C@@H]1C	ZINC000058424540	536952133	/nfs/dbraw/zinc/95/21/33/536952133.db2.gz	BDHYBMIDMIUTTA-BLLLJJGKSA-N	0	0	355.394	2.971	50	5		FFBARN
O=C([C@H]1CC(c2cccc(F)c2)=NO1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000084372088	571083943	/nfs/dbraw/zinc/08/39/43/571083943.db2.gz	YMRKNKLCPUXQMJ-QGZVFWFLSA-N	0	0	355.325	2.816	50	5		FFBARN
Cc1c(NC(=O)c2ccc([N+](=O)[O-])cc2)c(=O)n(-c2ccccc2)n1C	ZINC000000675401	210261220	/nfs/dbraw/zinc/26/12/20/210261220.db2.gz	FHXAFYPWZCVGAM-UHFFFAOYSA-N	0	0	352.350	2.645	50	5		FFBARN
COC(=O)c1ccc2c(c1)s/c(=N/C(=O)c1ccc([N+](=O)[O-])cc1)n2C	ZINC000012180898	219963121	/nfs/dbraw/zinc/96/31/21/219963121.db2.gz	KLEIOFJTZNRFAI-ISLYRVAYSA-N	0	0	371.374	2.676	50	5		FFBARN
NC(=O)c1ccc(NCC2(c3ccc(F)cc3)CCOCC2)c([N+](=O)[O-])c1	ZINC000058214682	211995471	/nfs/dbraw/zinc/99/54/71/211995471.db2.gz	DSJDLWAESHVDFU-UHFFFAOYSA-N	0	0	373.384	2.993	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])N[C@@H]1CCOc2ccccc21	ZINC000043165948	211788503	/nfs/dbraw/zinc/78/85/03/211788503.db2.gz	JCIQATCQKONCBB-CQSZACIVSA-N	0	0	356.382	2.830	50	5		FFBARN
O=C(NCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1Cc2cc(Cl)ccc2O1	ZINC000015835146	220166302	/nfs/dbraw/zinc/16/63/02/220166302.db2.gz	LBCMNWSCNHVUHB-INIZCTEOSA-N	0	0	361.785	2.780	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])o2)NC(=O)N1	ZINC000016606821	220187938	/nfs/dbraw/zinc/18/79/38/220187938.db2.gz	XAHROYCCJQZFKZ-OAHLLOKOSA-N	0	0	357.322	2.559	50	5		FFBARN
CCOc1ccc(C(=O)NC2(C(=O)OC)CCC(C)CC2)cc1[N+](=O)[O-]	ZINC000040145942	211500665	/nfs/dbraw/zinc/50/06/65/211500665.db2.gz	KGULOGMDRCVROP-UHFFFAOYSA-N	0	0	364.398	2.845	50	5		FFBARN
COc1ccc(OC)c2c1CN(C(=O)Nc1ccccc1[N+](=O)[O-])C[C@@H]2O	ZINC000024238132	211404109	/nfs/dbraw/zinc/40/41/09/211404109.db2.gz	QXBQDYDRONTSOG-AWEZNQCLSA-N	0	0	373.365	2.693	50	5		FFBARN
CC(=O)Oc1ccc(C2=NN(C(C)=O)[C@@H](c3ccccc3[N+](=O)[O-])O2)cc1	ZINC000021092045	211305514	/nfs/dbraw/zinc/30/55/14/211305514.db2.gz	IUHBUMASQFGTLE-GOSISDBHSA-N	0	0	369.333	2.759	50	5		FFBARN
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccccc2)CC1	ZINC000019760041	211254747	/nfs/dbraw/zinc/25/47/47/211254747.db2.gz	HTIQHFZBHHKVPJ-DHZHZOJOSA-N	0	0	351.406	2.952	50	5		FFBARN
O=C(COC(=O)c1n[nH]c2ccccc21)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000013878659	211062813	/nfs/dbraw/zinc/06/28/13/211062813.db2.gz	QPLWWBOTMCFUGS-UHFFFAOYSA-N	0	0	374.740	2.920	50	5		FFBARN
CCOc1cc2c(cc1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)O[C@@H](C)C2	ZINC000012553532	210969486	/nfs/dbraw/zinc/96/94/86/210969486.db2.gz	BLAGSWLRYHYDPR-NSHDSACASA-N	0	0	371.393	2.829	50	5		FFBARN
Cc1c(NC(=O)CNc2ccccc2C(=O)NC2CC2)cccc1[N+](=O)[O-]	ZINC000010756411	210875565	/nfs/dbraw/zinc/87/55/65/210875565.db2.gz	XPCPGXYUHPSXRT-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)N[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	ZINC000009388992	210832072	/nfs/dbraw/zinc/83/20/72/210832072.db2.gz	VDSGMMJOCAORRZ-QGZVFWFLSA-N	0	0	367.405	2.827	50	5		FFBARN
Cn1ccnc1[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1F	ZINC000008719866	210799798	/nfs/dbraw/zinc/79/97/98/210799798.db2.gz	VFFKOZFUYFELRW-INIZCTEOSA-N	0	0	369.356	2.768	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])c1cc2ccccc2oc1=O	ZINC000008145736	210771821	/nfs/dbraw/zinc/77/18/21/210771821.db2.gz	ADSIGTZFJDKLCP-UHFFFAOYSA-N	0	0	353.334	2.543	50	5		FFBARN
CN(CCOc1ccccc1)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000007984440	210762661	/nfs/dbraw/zinc/76/26/61/210762661.db2.gz	TZAIZRYVVANGSN-UHFFFAOYSA-N	0	0	350.396	2.514	50	5		FFBARN
O=C(Cn1cnc2ccccc21)OCc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000007735687	210751593	/nfs/dbraw/zinc/75/15/93/210751593.db2.gz	YHAPTQKZHQPELV-UHFFFAOYSA-N	0	0	369.333	2.554	50	5		FFBARN
COc1ccccc1-n1c2ccc([N+](=O)[O-])cc2nc1SCC(N)=O	ZINC000006291745	210666941	/nfs/dbraw/zinc/66/69/41/210666941.db2.gz	PFURSJAFYIIUNH-UHFFFAOYSA-N	0	0	358.379	2.520	50	5		FFBARN
O=C(CSc1ccsc1[N+](=O)[O-])NCc1ccc2c(c1)OCO2	ZINC000005035959	210594585	/nfs/dbraw/zinc/59/45/85/210594585.db2.gz	QHSHDQBBNPDQHU-UHFFFAOYSA-N	0	0	352.393	2.794	50	5		FFBARN
Cc1ccn2c(c1)nc(=O)c1cc(S(=O)(=O)c3ccccc3)ccc12	ZINC000004708650	210554956	/nfs/dbraw/zinc/55/49/56/210554956.db2.gz	SZVMZRDOPHCPLB-UHFFFAOYSA-N	0	0	350.399	2.989	50	5		FFBARN
CCOC(=O)CSc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000004294095	210522103	/nfs/dbraw/zinc/52/21/03/210522103.db2.gz	OPIWLRRQUXIJQN-UHFFFAOYSA-N	0	0	373.330	2.544	50	5		FFBARN
O=C(CCn1ccc([N+](=O)[O-])n1)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000002781940	210422449	/nfs/dbraw/zinc/42/24/49/210422449.db2.gz	YQCGZYSMNFWJCL-UHFFFAOYSA-N	0	0	350.203	2.516	50	5		FFBARN
O=C(CSCc1ccc([N+](=O)[O-])cc1)NCc1ccc2c(c1)OCO2	ZINC000002851601	210430091	/nfs/dbraw/zinc/43/00/91/210430091.db2.gz	BNGBZQBGJVPCBH-UHFFFAOYSA-N	0	0	360.391	2.873	50	5		FFBARN
Cc1sc2ncn3nc(C(C)(C)n4cc([N+](=O)[O-])cn4)nc3c2c1C	ZINC000002808389	210426952	/nfs/dbraw/zinc/42/69/52/210426952.db2.gz	RCXBVXHTKRHRJZ-UHFFFAOYSA-N	0	0	357.399	2.844	50	5		FFBARN
COC(=O)c1ccc([N+](=O)[O-])c(OS(=O)(=O)c2ccc(Cl)cc2)c1	ZINC000002570921	210407080	/nfs/dbraw/zinc/40/70/80/210407080.db2.gz	DDXQKLLUKAVMHX-UHFFFAOYSA-N	0	0	371.754	2.803	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)O[C@@]12CCOC(C)(C)C2	ZINC000001133611	210322955	/nfs/dbraw/zinc/32/29/55/210322955.db2.gz	HHSBXLGQZNIDHW-FZKQIMNGSA-N	0	0	362.382	2.733	50	5		FFBARN
CC(=O)Oc1ccc(Cl)cc1N1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000001085705	210314397	/nfs/dbraw/zinc/31/43/97/210314397.db2.gz	TXNCEAYQGGTXEH-UHFFFAOYSA-N	0	0	360.709	2.974	50	5		FFBARN
Cc1c(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C	ZINC000000831020	210277657	/nfs/dbraw/zinc/27/76/57/210277657.db2.gz	MKTVEZQGBJRGGQ-UHFFFAOYSA-N	0	0	366.377	2.953	50	5		FFBARN
COc1ccccc1C(=O)N1CCCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000058165848	221102023	/nfs/dbraw/zinc/10/20/23/221102023.db2.gz	FQYPXDICTPIWKO-UHFFFAOYSA-N	0	0	369.421	2.952	50	5		FFBARN
CCN1C[C@H](CN(C)C(=O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21	ZINC000007256940	132839698	/nfs/dbraw/zinc/83/96/98/132839698.db2.gz	WLRIWXKAFJKISR-INIZCTEOSA-N	0	0	355.394	2.954	50	5		FFBARN
COC(=O)c1cccc2c3c([nH]c21)CCN(c1ncccc1[N+](=O)[O-])C3	ZINC000025577837	132914110	/nfs/dbraw/zinc/91/41/10/132914110.db2.gz	NAJAURQTEYOGOL-UHFFFAOYSA-N	0	0	352.350	2.820	50	5		FFBARN
Cc1ccc(F)c(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@H](C)C2=O)c1	ZINC000037520273	132942268	/nfs/dbraw/zinc/94/22/68/132942268.db2.gz	IDLRRAQBYIWJBW-CYBMUJFWSA-N	0	0	371.368	2.920	50	5		FFBARN
Cc1cc(CN2CCN(c3ccc4ncccc4c3[N+](=O)[O-])CC2)on1	ZINC000042109789	136121042	/nfs/dbraw/zinc/12/10/42/136121042.db2.gz	FZNVSURCRFZOJU-UHFFFAOYSA-N	0	0	353.382	2.762	50	5		FFBARN
COc1cccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1OC	ZINC000055543843	136126920	/nfs/dbraw/zinc/12/69/20/136126920.db2.gz	IPILBYTZNFRPGJ-UHFFFAOYSA-N	0	0	357.410	2.934	50	5		FFBARN
O=[N+]([O-])c1c2nonc2c(N2CCOCC2)cc1NCc1ccccc1	ZINC000004131824	136151751	/nfs/dbraw/zinc/15/17/51/136151751.db2.gz	OLBDPJOSJXFAME-UHFFFAOYSA-N	0	0	355.354	2.580	50	5		FFBARN
NC(=O)c1ccc(CN(Cc2ccccc2)C[C@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000052866092	506268751	/nfs/dbraw/zinc/26/87/51/506268751.db2.gz	KBXGXWOCWASPKU-GOSISDBHSA-N	0	0	369.421	2.875	50	5		FFBARN
Cc1ccc(NC(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c(Cl)c1	ZINC000002623011	506285411	/nfs/dbraw/zinc/28/54/11/506285411.db2.gz	ATHWUTJRYGMUKS-UHFFFAOYSA-N	0	0	372.768	2.905	50	5		FFBARN
CN(C(=O)Cc1csc(NC(=O)C2CC2)n1)c1ccc([N+](=O)[O-])cc1	ZINC000032769186	506293646	/nfs/dbraw/zinc/29/36/46/506293646.db2.gz	OTOXVEBQLOVUBK-UHFFFAOYSA-N	0	0	360.395	2.605	50	5		FFBARN
Cc1nn(CCc2nc3c4c(C)c(C)sc4ncn3n2)c(C)c1[N+](=O)[O-]	ZINC000002808685	506294970	/nfs/dbraw/zinc/29/49/70/506294970.db2.gz	QWEVOKHHESVHKT-UHFFFAOYSA-N	0	0	371.426	2.920	50	5		FFBARN
O=C(N/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)N1CCCCC1)c1ccco1	ZINC000002950079	506303352	/nfs/dbraw/zinc/30/33/52/506303352.db2.gz	CKCZLBLFKLPAKD-SSZFMOIBSA-N	0	0	369.377	2.971	50	5		FFBARN
Cc1ccc(OCC(=O)NC(=S)Nc2ccc(F)c([N+](=O)[O-])c2)cc1	ZINC000002971546	506304659	/nfs/dbraw/zinc/30/46/59/506304659.db2.gz	QPUCXYWYUXFJQU-UHFFFAOYSA-N	0	0	363.370	2.934	50	5		FFBARN
CCOC(=O)c1sc2ncn(Cc3cccc([N+](=O)[O-])c3)c(=O)c2c1C	ZINC000003017641	506307884	/nfs/dbraw/zinc/30/78/84/506307884.db2.gz	PHJDARQVSZAQMC-UHFFFAOYSA-N	0	0	373.390	2.900	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@H]1c1ccc2c(c1)OCO2	ZINC000003092316	506309618	/nfs/dbraw/zinc/30/96/18/506309618.db2.gz	MXZZZGCVCWXDKK-KRWDZBQOSA-N	0	0	355.306	2.563	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2c(Cl)cccc2Cl)c1	ZINC000032922684	506312851	/nfs/dbraw/zinc/31/28/51/506312851.db2.gz	SXVIAUSUBCXKRP-UHFFFAOYSA-N	0	0	357.149	2.898	50	5		FFBARN
COc1cccc(/C=C/C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1	ZINC000003230342	506313040	/nfs/dbraw/zinc/31/30/40/506313040.db2.gz	VUXUBKLEUZBWQW-VMPITWQZSA-N	0	0	374.324	2.938	50	5		FFBARN
O=C(COC(=O)c1ccc(F)cc1F)Nc1cc([N+](=O)[O-])ccc1F	ZINC000003249861	506315294	/nfs/dbraw/zinc/31/52/94/506315294.db2.gz	QCIMDNXBGRYECH-UHFFFAOYSA-N	0	0	354.240	2.808	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)NCc1ccc(F)cc1	ZINC000003377316	506326232	/nfs/dbraw/zinc/32/62/32/506326232.db2.gz	ZDQJQSLROHZLTE-RMKNXTFCSA-N	0	0	358.325	2.607	50	5		FFBARN
COc1ccc(NC(=O)CN(C)C(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1	ZINC000003431025	506331365	/nfs/dbraw/zinc/33/13/65/506331365.db2.gz	BCUYGMHWHFZMMY-UHFFFAOYSA-N	0	0	357.366	2.623	50	5		FFBARN
Cc1noc(C)c1[C@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000033086869	506334268	/nfs/dbraw/zinc/33/42/68/506334268.db2.gz	VAEYXXSCLDTCQC-CYBMUJFWSA-N	0	0	351.384	2.725	50	5		FFBARN
CCOC(=O)c1sc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2c1NC(C)=O	ZINC000003617937	506348482	/nfs/dbraw/zinc/34/84/82/506348482.db2.gz	ISXZFCVWJQJESY-UHFFFAOYSA-N	0	0	353.312	2.853	50	5		FFBARN
CCN(CC)c1nc(N)c([N+](=O)[O-])c(Nc2cc(OC)ccc2OC)n1	ZINC000004306279	506369308	/nfs/dbraw/zinc/36/93/08/506369308.db2.gz	HKUMQCZHVMDHNW-UHFFFAOYSA-N	0	0	362.390	2.574	50	5		FFBARN
O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c(NC3CC3)c2)CC1	ZINC000004543701	506381506	/nfs/dbraw/zinc/38/15/06/506381506.db2.gz	SHUCPGOHJQGCLO-UHFFFAOYSA-N	0	0	356.382	2.725	50	5		FFBARN
C[C@@]1(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(Cl)Cl	ZINC000004740708	506391640	/nfs/dbraw/zinc/39/16/40/506391640.db2.gz	SMRWYZIJENJMEY-AWEZNQCLSA-N	0	0	358.225	2.827	50	5		FFBARN
O=[N+]([O-])c1c2nonc2c(NCc2ccccc2)cc1N1CCOCC1	ZINC000004888852	506402191	/nfs/dbraw/zinc/40/21/91/506402191.db2.gz	WJFZUZOBMBRZGB-UHFFFAOYSA-N	0	0	355.354	2.580	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)C[C@H]1c1ccccc1[N+](=O)[O-]	ZINC000004913540	506406559	/nfs/dbraw/zinc/40/65/59/506406559.db2.gz	MAPVNLSCVDWVMY-ZDUSSCGKSA-N	0	0	364.423	2.769	50	5		FFBARN
COCCCNC(=O)c1cc(-c2cccc([N+](=O)[O-])c2)nc2onc(C)c21	ZINC000036618468	506408652	/nfs/dbraw/zinc/40/86/52/506408652.db2.gz	YCMQSTFRQJELFT-UHFFFAOYSA-N	0	0	370.365	2.873	50	5		FFBARN
O=C(C[C@@]1(O)C(=O)Nc2ccc([N+](=O)[O-])cc21)c1ccc(Cl)s1	ZINC000005049724	506417367	/nfs/dbraw/zinc/41/73/67/506417367.db2.gz	HPOVKSAVNSBYHX-AWEZNQCLSA-N	0	0	352.755	2.722	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1)NC12CC3CC(CC(C3)C1)C2	ZINC000005110067	506422191	/nfs/dbraw/zinc/42/21/91/506422191.db2.gz	MYWQZNANDZCRED-UHFFFAOYSA-N	0	0	358.394	2.837	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)OCc1cn2ccccc2n1	ZINC000005105346	506423082	/nfs/dbraw/zinc/42/30/82/506423082.db2.gz	BRAFRWICPDIZBD-UHFFFAOYSA-N	0	0	370.365	2.658	50	5		FFBARN
CC(=O)Nc1cccc(Oc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1	ZINC000006399044	506480905	/nfs/dbraw/zinc/48/09/05/506480905.db2.gz	OLHYPUDDQOLPLX-UHFFFAOYSA-N	0	0	350.352	2.749	50	5		FFBARN
O=C(Nc1nc(-c2ccc(F)cc2F)cs1)c1n[nH]cc1[N+](=O)[O-]	ZINC000006447973	506483209	/nfs/dbraw/zinc/48/32/09/506483209.db2.gz	MJESQTYFGAWSJJ-UHFFFAOYSA-N	0	0	351.294	2.972	50	5		FFBARN
Cc1cccc(-c2nc3s/c(=C/c4ccccc4[N+](=O)[O-])c(=O)n3n2)c1	ZINC000006479029	506485099	/nfs/dbraw/zinc/48/50/99/506485099.db2.gz	CWBMNKZBYYZRAH-XNTDXEJSSA-N	0	0	364.386	2.582	50	5		FFBARN
COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1	ZINC000006524592	506486452	/nfs/dbraw/zinc/48/64/52/506486452.db2.gz	IBQNVYYTKPXJAP-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
CC1=C(C(=O)NC(C)(C)C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1C	ZINC000006801742	506508977	/nfs/dbraw/zinc/50/89/77/506508977.db2.gz	UIJWYRRHBFPONU-CQSZACIVSA-N	0	0	362.455	2.645	50	5		FFBARN
O=C1OC(c2ccc([N+](=O)[O-])cc2)=NC1=CNc1cccc([N+](=O)[O-])c1	ZINC000006882732	506513052	/nfs/dbraw/zinc/51/30/52/506513052.db2.gz	BNWJOBWXDOGTLW-NTEUORMPSA-N	0	0	354.278	2.760	50	5		FFBARN
C[C@@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnc2)cc1	ZINC000007050174	506528345	/nfs/dbraw/zinc/52/83/45/506528345.db2.gz	BHKMOWCNDZUTNE-CYBMUJFWSA-N	0	0	372.406	2.820	50	5		FFBARN
COC(=O)C1=C(C)N(C2CC2)C(=O)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007552549	506569303	/nfs/dbraw/zinc/56/93/03/506569303.db2.gz	GSDJUAQUOJHNFQ-AWEZNQCLSA-N	0	0	365.773	2.924	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N2c3ccccc3C[C@@H]2C)cc1[N+](=O)[O-]	ZINC000007605283	506573534	/nfs/dbraw/zinc/57/35/34/506573534.db2.gz	AJUKPEAEBXXUPB-LBPRGKRZSA-N	0	0	370.361	2.738	50	5		FFBARN
COc1ccc([C@@H](NC(=O)c2ccccc2[N+](=O)[O-])c2nccn2C)cc1	ZINC000012519854	506870141	/nfs/dbraw/zinc/87/01/41/506870141.db2.gz	ALOWSMCYIMKVNX-QGZVFWFLSA-N	0	0	366.377	2.856	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cnc2ccccc2c1	ZINC000012544945	506876420	/nfs/dbraw/zinc/87/64/20/506876420.db2.gz	JRCAXYPOTDVRFC-UHFFFAOYSA-N	0	0	364.361	2.902	50	5		FFBARN
CCNC(=O)c1cccc(NC(=O)CCNc2ccccc2[N+](=O)[O-])c1	ZINC000012550067	506878681	/nfs/dbraw/zinc/87/86/81/506878681.db2.gz	UYWXPYKVFTUKSX-UHFFFAOYSA-N	0	0	356.382	2.785	50	5		FFBARN
COc1cc(C(=O)OCc2cn3cccc(C)c3n2)c([N+](=O)[O-])cc1OC	ZINC000012582439	506880507	/nfs/dbraw/zinc/88/05/07/506880507.db2.gz	PZPXMSAVSDXBIX-UHFFFAOYSA-N	0	0	371.349	2.925	50	5		FFBARN
Cn1cnc([N+](=O)[O-])c1N1CCN(c2ccnc3cc(Cl)ccc32)CC1	ZINC000012627514	506886095	/nfs/dbraw/zinc/88/60/95/506886095.db2.gz	UGXOQKAZSRIHTO-UHFFFAOYSA-N	0	0	372.816	2.857	50	5		FFBARN
Cc1cccc(N2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@H]2C)c1	ZINC000012645815	506887532	/nfs/dbraw/zinc/88/75/32/506887532.db2.gz	ORWBCOAQKBMZJD-CQSZACIVSA-N	0	0	354.410	2.717	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)COC(=O)c1c(C)cccc1[N+](=O)[O-]	ZINC000012695987	506889970	/nfs/dbraw/zinc/88/99/70/506889970.db2.gz	XIVHVLQOQAHYPM-UHFFFAOYSA-N	0	0	356.334	2.901	50	5		FFBARN
O=C(NCc1cccnc1)[C@@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]12	ZINC000024536597	507418346	/nfs/dbraw/zinc/41/83/46/507418346.db2.gz	QVBRSFIHSOHDHL-MJGOQNOKSA-N	0	0	366.421	2.837	50	5		FFBARN
Cc1ccc([C@H](CN2CCOCC2)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000024684705	507429740	/nfs/dbraw/zinc/42/97/40/507429740.db2.gz	SLXSFRVZCMGNGM-IBGZPJMESA-N	0	0	369.421	2.707	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCc2ccccc21	ZINC000025051520	507461347	/nfs/dbraw/zinc/46/13/47/507461347.db2.gz	DYMDKPSKJYYJBL-KRWDZBQOSA-N	0	0	353.378	2.518	50	5		FFBARN
CCn1cnnc1-c1cccc(NC(=O)COc2ccccc2[N+](=O)[O-])c1	ZINC000025287621	507483269	/nfs/dbraw/zinc/48/32/69/507483269.db2.gz	ZDYUUOJSUHGKSE-UHFFFAOYSA-N	0	0	367.365	2.891	50	5		FFBARN
CCc1ccc(NC(=O)Cn2cnc3c(C)cccc3c2=O)cc1[N+](=O)[O-]	ZINC000027311763	507645276	/nfs/dbraw/zinc/64/52/76/507645276.db2.gz	VSPXMXRLYAQYNA-UHFFFAOYSA-N	0	0	366.377	2.814	50	5		FFBARN
COC(=O)[C@H](C)[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000072310574	507775199	/nfs/dbraw/zinc/77/51/99/507775199.db2.gz	HVJBRRRDWRNNBG-FZKQIMNGSA-N	0	0	372.377	2.640	50	5		FFBARN
COc1ccc(CN(C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000029502353	507780328	/nfs/dbraw/zinc/78/03/28/507780328.db2.gz	UIYGCNHKPVUASU-UHFFFAOYSA-N	0	0	353.382	2.951	50	5		FFBARN
O=C(N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)[C@@H]1C[C@@H]1[N+](=O)[O-]	ZINC000045819525	570912404	/nfs/dbraw/zinc/91/24/04/570912404.db2.gz	NPTGIHFGCGXZJM-KYJSFNMBSA-N	0	0	368.368	2.698	50	5		FFBARN
COc1cc(/C=C\C(=O)Oc2cccc([N+](=O)[O-])c2)cc2c1OCCO2	ZINC000096861277	964023574	/nfs/dbraw/zinc/02/35/74/964023574.db2.gz	PZDPLEJBBOGZIP-WAYWQWQTSA-N	0	0	357.318	2.993	50	5		FFBARN
COc1cc(NC(=O)COC(=O)/C=C\c2ccco2)c(C)cc1[N+](=O)[O-]	ZINC000035334758	1019638307	/nfs/dbraw/zinc/63/83/07/1019638307.db2.gz	XARJOJHOAJUDBZ-WAYWQWQTSA-N	0	0	360.322	2.700	50	5		FFBARN
Cc1ccc2nc(COC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc(=O)n2c1	ZINC000007420209	219804724	/nfs/dbraw/zinc/80/47/24/219804724.db2.gz	VQUFCXNUXAVUCN-VQHVLOKHSA-N	0	0	365.345	2.668	50	5		FFBARN
Cc1cc(C)n(Cc2cccc(CNC(=O)c3ccc([N+](=O)[O-])o3)c2)n1	ZINC000058264377	212000320	/nfs/dbraw/zinc/00/03/20/212000320.db2.gz	AEQSKMRMRBPEGC-UHFFFAOYSA-N	0	0	354.366	2.979	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)NCCOc1cccc(Cl)c1	ZINC000040113550	211490783	/nfs/dbraw/zinc/49/07/83/211490783.db2.gz	RFTWMJHWGJGETH-UHFFFAOYSA-N	0	0	350.758	2.822	50	5		FFBARN
CC[C@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO1	ZINC000023894140	211397083	/nfs/dbraw/zinc/39/70/83/211397083.db2.gz	QWGCSWMDKVRYCC-HNNXBMFYSA-N	0	0	350.418	2.792	50	5		FFBARN
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000023106245	211375538	/nfs/dbraw/zinc/37/55/38/211375538.db2.gz	PFAZKEGDIWUYGC-SFHVURJKSA-N	0	0	373.384	2.537	50	5		FFBARN
O=c1c2cnc3nc4ccccc4n3c2ccn1-c1ccc2c(c1)OCCO2	ZINC000022607824	211357201	/nfs/dbraw/zinc/35/72/01/211357201.db2.gz	QRQIJDFDXWAXCZ-UHFFFAOYSA-N	0	0	370.368	2.958	50	5		FFBARN
Cn1c(SCn2cc([N+](=O)[O-])cn2)nnc1-c1cccc(Cl)c1	ZINC000017072796	211175890	/nfs/dbraw/zinc/17/58/90/211175890.db2.gz	XJHGAIIMVPRKQR-UHFFFAOYSA-N	0	0	350.791	2.990	50	5		FFBARN
COC(=O)C1CCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000015413017	211128412	/nfs/dbraw/zinc/12/84/12/211128412.db2.gz	PIXUGZRHZKHPMJ-NSHDSACASA-N	0	0	360.370	2.591	50	5		FFBARN
O=[N+]([O-])c1cc(N[C@@H]2C[C@H](O)[C@@H](O)CO2)cc(Sc2ccccc2)c1	ZINC000015240729	211125428	/nfs/dbraw/zinc/12/54/28/211125428.db2.gz	AQFSCHZBYWUHCK-ULQDDVLXSA-N	0	0	362.407	2.626	50	5	biogenic,in-vitro	FFBARN
O=[N+]([O-])c1cc([N+](=O)[O-])c(NC[C@@H]2CCCO2)cc1NC[C@H]1CCCO1	ZINC000015227806	211125109	/nfs/dbraw/zinc/12/51/09/211125109.db2.gz	JMDYGVBOORMJTR-TXEJJXNPSA-N	0	0	366.374	2.685	50	5		FFBARN
COc1cc(CSc2nnnn2C2CC2)c([N+](=O)[O-])cc1OC(F)F	ZINC000014124218	211074442	/nfs/dbraw/zinc/07/44/42/211074442.db2.gz	WWEMASUEZXBBDL-UHFFFAOYSA-N	0	0	373.341	2.819	50	5		FFBARN
COc1ccc(C(=O)Nc2n[nH]c(-c3ccc(C)cc3)n2)cc1[N+](=O)[O-]	ZINC000013006708	211018183	/nfs/dbraw/zinc/01/81/83/211018183.db2.gz	XTXVHPJHTKUWDL-UHFFFAOYSA-N	0	0	353.338	2.949	50	5		FFBARN
O=C(COc1cc(F)ccc1[N+](=O)[O-])c1c[nH]c(C(=O)N2CCCC2)c1	ZINC000012985656	211015763	/nfs/dbraw/zinc/01/57/63/211015763.db2.gz	OJTOMNFIERVPLN-UHFFFAOYSA-N	0	0	361.329	2.560	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)COc3cc(F)ccc3[N+](=O)[O-])ccc21	ZINC000012978960	211013103	/nfs/dbraw/zinc/01/31/03/211013103.db2.gz	HEHFXHYZEQUUCZ-UHFFFAOYSA-N	0	0	373.340	2.660	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc2c(c1)OCCCO2	ZINC000012521250	210962743	/nfs/dbraw/zinc/96/27/43/210962743.db2.gz	BHBSQFNQIDRFHE-UHFFFAOYSA-N	0	0	364.379	2.865	50	5		FFBARN
COc1cc(Cn2cc([N+](=O)[O-])ccc2=O)c(OC)cc1Br	ZINC000008878650	210807057	/nfs/dbraw/zinc/80/70/57/210807057.db2.gz	UWZIPCSWVGBIAY-UHFFFAOYSA-N	0	0	369.171	2.585	50	5		FFBARN
O=C(/C=C/c1ccccc1)NCCC(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000008079553	210769143	/nfs/dbraw/zinc/76/91/43/210769143.db2.gz	XYGHJQJTMXLEQX-RMKNXTFCSA-N	0	0	357.341	2.892	50	5		FFBARN
CC(=O)Nc1ccccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000004740414	210557917	/nfs/dbraw/zinc/55/79/17/210557917.db2.gz	MZCQIEXOWBHZPY-UHFFFAOYSA-N	0	0	358.310	2.643	50	5		FFBARN
Cc1ccc(S(=O)(=O)N2CCc3c2cc([N+](=O)[O-])cc3[N+](=O)[O-])cc1	ZINC000002381273	210395782	/nfs/dbraw/zinc/39/57/82/210395782.db2.gz	ICMUKAOBIWFYGK-UHFFFAOYSA-N	0	0	363.351	2.563	50	5		FFBARN
COc1cc(C=O)ccc1OC(=O)c1cc([N+](=O)[O-])c(C)c([N+](=O)[O-])c1	ZINC000002053022	210378450	/nfs/dbraw/zinc/37/84/50/210378450.db2.gz	OYQCHTPOGQDTKV-UHFFFAOYSA-N	0	0	360.278	2.852	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2ccc(NC(C)=O)cc2)cc([N+](=O)[O-])c1	ZINC000001218126	210337325	/nfs/dbraw/zinc/33/73/25/210337325.db2.gz	ZZCAHOBJWXXHKN-UHFFFAOYSA-N	0	0	357.322	2.592	50	5		FFBARN
O=[N+]([O-])c1ccc2[nH]c(CSc3nnnn3-c3ccccc3)nc2c1	ZINC000001187011	210332370	/nfs/dbraw/zinc/33/23/70/210332370.db2.gz	YGJDCOPUXSBKOY-UHFFFAOYSA-N	0	0	353.367	2.739	50	5		FFBARN
COC(=O)c1ccccc1NC(=O)c1cc(OC)c(OC)cc1[N+](=O)[O-]	ZINC000001191791	210331797	/nfs/dbraw/zinc/33/17/97/210331797.db2.gz	PTSXPURLSYCTRR-UHFFFAOYSA-N	0	0	360.322	2.651	50	5	biogenic	FFBARN
C[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000001025704	210302868	/nfs/dbraw/zinc/30/28/68/210302868.db2.gz	YVYVINMYBSLRMG-BBATYDOGSA-N	0	0	372.333	2.815	50	5		FFBARN
COc1ccc([C@@H]2c3c(c4ccccc4oc3=O)OC(N)=C2[N+](=O)[O-])cc1	ZINC000001052027	210309540	/nfs/dbraw/zinc/30/95/40/210309540.db2.gz	QCYFEZFCQJBYAE-CQSZACIVSA-N	0	0	366.329	2.730	50	5	biogenic	FFBARN
COC(=O)[C@@H](Cc1c[nH]c2ccccc12)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000001043347	210306433	/nfs/dbraw/zinc/30/64/33/210306433.db2.gz	TYXRHAOAENLYNW-QGZVFWFLSA-N	0	0	367.361	2.590	50	5		FFBARN
Cc1cc(C)cc(NC(=O)NC[C@@H](O)COc2ccc([N+](=O)[O-])cc2)c1	ZINC000001033888	210304107	/nfs/dbraw/zinc/30/41/07/210304107.db2.gz	RWFYZLRFNRVSGO-MRXNPFEDSA-N	0	0	359.382	2.773	50	5		FFBARN
Cc1nnc(Sc2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])n1N	ZINC000022024871	220373748	/nfs/dbraw/zinc/37/37/48/220373748.db2.gz	UJGGFASKHWVSCG-UHFFFAOYSA-N	0	0	355.379	2.591	50	5		FFBARN
Cc1nn(C[C@@H](O)COc2cccc(C(F)(F)F)c2)c(C)c1[N+](=O)[O-]	ZINC000058160924	221100624	/nfs/dbraw/zinc/10/06/24/221100624.db2.gz	HRGKHVYTIWXQHJ-GFCCVEGCSA-N	0	0	359.304	2.867	50	5		FFBARN
C[C@H]1CN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])cc3)cn2)C[C@H](C)O1	ZINC000239782573	132288895	/nfs/dbraw/zinc/28/88/95/132288895.db2.gz	CPHLIVBUPMAJGM-STQMWFEESA-N	0	0	356.382	2.856	50	5		FFBARN
CCOc1ccccc1N1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000000831826	132378908	/nfs/dbraw/zinc/37/89/08/132378908.db2.gz	CEJGKPQDPDABAC-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
O=C(Cc1noc2ccccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003908518	132386124	/nfs/dbraw/zinc/38/61/24/132386124.db2.gz	VPWIPPJUHKRJII-UHFFFAOYSA-N	0	0	366.377	2.627	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)cn1	ZINC000023408954	136153045	/nfs/dbraw/zinc/15/30/45/136153045.db2.gz	XAJHOEXBFMLPAX-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
O=C(NCCc1nc(-c2cccc([N+](=O)[O-])c2)no1)c1cccc(F)c1	ZINC000096277515	222108837	/nfs/dbraw/zinc/10/88/37/222108837.db2.gz	JPCOZBFPIVKJKF-UHFFFAOYSA-N	0	0	356.313	2.756	50	5		FFBARN
O=C(/C=C\c1cc([N+](=O)[O-])cc2c1OCOC2)NCc1ccccc1F	ZINC000097998653	222219376	/nfs/dbraw/zinc/21/93/76/222219376.db2.gz	VLANTWIMZRHGBV-WAYWQWQTSA-N	0	0	358.325	2.930	50	5		FFBARN
Cc1cc2c(nc3s/c(=C\c4cccc([N+](=O)[O-])c4)c(=O)n23)c(C)c1	ZINC000000676925	263141783	/nfs/dbraw/zinc/14/17/83/263141783.db2.gz	FBWXKJIGXMPRRK-DHDCSXOGSA-N	0	0	351.387	2.982	50	5		FFBARN
Cc1cc(OCC(=O)N2CCN(c3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000009114463	263359334	/nfs/dbraw/zinc/35/93/34/263359334.db2.gz	DOROTSBKXFWPES-UHFFFAOYSA-N	0	0	355.394	2.631	50	5		FFBARN
Cc1c([N+](=O)[O-])c([N+](=O)[O-])nn1CC(=O)Nc1ccc(Cl)cc1Cl	ZINC000004646423	506387194	/nfs/dbraw/zinc/38/71/94/506387194.db2.gz	ZOXLFMSUMLTHMR-UHFFFAOYSA-N	0	0	374.140	2.953	50	5		FFBARN
CCOc1ccc(C(C)=O)cc1Cn1cnc2cc([N+](=O)[O-])ccc2c1=O	ZINC000002621204	506283596	/nfs/dbraw/zinc/28/35/96/506283596.db2.gz	APVSXMGPOPFWGR-UHFFFAOYSA-N	0	0	367.361	2.954	50	5		FFBARN
O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCC(O)CC1	ZINC000032803851	506297507	/nfs/dbraw/zinc/29/75/07/506297507.db2.gz	JBXGGLVNFBKZSB-UHFFFAOYSA-N	0	0	352.188	2.867	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)NCc1cccs1	ZINC000002884712	506299542	/nfs/dbraw/zinc/29/95/42/506299542.db2.gz	BZHVCOXKGFTLAZ-QMMMGPOBSA-N	0	0	373.232	2.801	50	5		FFBARN
O=c1[nH]c(=O)c2c([nH]1)OC(c1ccccc1)=C[C@@H]2c1cccc([N+](=O)[O-])c1	ZINC000003166493	506310799	/nfs/dbraw/zinc/31/07/99/506310799.db2.gz	ZNNDXCMITIUCOL-CQSZACIVSA-N	0	0	363.329	2.949	50	5		FFBARN
COc1ccc(OCC(=O)NCCc2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000003443423	506331129	/nfs/dbraw/zinc/33/11/29/506331129.db2.gz	YMJZSUVWGXJQLE-UHFFFAOYSA-N	0	0	364.785	2.995	50	5		FFBARN
Cc1cc(N2CCOCC2)ccc1NC(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000033186023	506344940	/nfs/dbraw/zinc/34/49/40/506344940.db2.gz	PNSKSOPIQYHZPZ-UHFFFAOYSA-N	0	0	355.394	2.921	50	5		FFBARN
O=c1c2ccccc2nc(/C=C/c2ccc([N+](=O)[O-])cc2)n1CCCO	ZINC000004093749	506358593	/nfs/dbraw/zinc/35/85/93/506358593.db2.gz	OVVLEMVSRJFGFS-DHZHZOJOSA-N	0	0	351.362	2.858	50	5		FFBARN
CCC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCc3ccco3)c2)CC1	ZINC000004123421	506361059	/nfs/dbraw/zinc/36/10/59/506361059.db2.gz	FGHWEGQGQKMRTB-UHFFFAOYSA-N	0	0	358.398	2.859	50	5		FFBARN
COc1ccccc1C1=NO[C@H](COC(=O)c2ccc([N+](=O)[O-])cc2)C1	ZINC000004334877	506372576	/nfs/dbraw/zinc/37/25/76/506372576.db2.gz	WAHWAVDUMOEKLY-AWEZNQCLSA-N	0	0	356.334	2.953	50	5		FFBARN
O=C(N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc([N+](=O)[O-])cc1	ZINC000004497487	506378467	/nfs/dbraw/zinc/37/84/67/506378467.db2.gz	YLMWATJQHUZMPR-CYBMUJFWSA-N	0	0	359.769	2.784	50	5		FFBARN
CC(=O)Oc1ccc2nc(COc3ccc([N+](=O)[O-])cc3)oc(=O)c2c1	ZINC000004499626	506379616	/nfs/dbraw/zinc/37/96/16/506379616.db2.gz	AIBKCUOMDVIIQJ-UHFFFAOYSA-N	0	0	356.290	2.601	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(Br)cn1	ZINC000004547978	506382039	/nfs/dbraw/zinc/38/20/39/506382039.db2.gz	GPGRUHSULQWKMU-UHFFFAOYSA-N	0	0	352.144	2.770	50	5		FFBARN
COC(=O)c1ccc(NC=C2N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	ZINC000004590675	506384193	/nfs/dbraw/zinc/38/41/93/506384193.db2.gz	IEHIOJNAAXASNV-XNTDXEJSSA-N	0	0	367.317	2.638	50	5		FFBARN
CCOc1ccc(C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000004740695	506391033	/nfs/dbraw/zinc/39/10/33/506391033.db2.gz	YOEJDDLHABSVCT-UHFFFAOYSA-N	0	0	374.305	2.941	50	5		FFBARN
O=C(NC(=S)Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1)c1ccco1	ZINC000004754825	506393656	/nfs/dbraw/zinc/39/36/56/506393656.db2.gz	NVBRSRGACVJXGB-UHFFFAOYSA-N	0	0	374.403	2.860	50	5		FFBARN
O=c1c2cc3c(ccn(-c4ccncc4)c3=O)nc2ccn1Cc1ccco1	ZINC000036125574	506396736	/nfs/dbraw/zinc/39/67/36/506396736.db2.gz	LKPVZYFLCVVOQO-UHFFFAOYSA-N	0	0	370.368	2.737	50	5		FFBARN
COc1ccccc1NC(=O)c1cc(-n2cc([N+](=O)[O-])cn2)cnc1C	ZINC000004821034	506397736	/nfs/dbraw/zinc/39/77/36/506397736.db2.gz	CXBDVXLMCCCUFS-UHFFFAOYSA-N	0	0	353.338	2.745	50	5		FFBARN
CCCC1=Nc2ncnn2[C@@H](c2ccccc2[N+](=O)[O-])C1C(=O)OCC	ZINC000004866826	506401123	/nfs/dbraw/zinc/40/11/23/506401123.db2.gz	UBRVJLIUDXQIDP-HNNXBMFYSA-N	0	0	357.370	2.819	50	5		FFBARN
O=C(CSc1nnc(-c2ccncc2)o1)Nc1cccc([N+](=O)[O-])c1	ZINC000004941526	506407346	/nfs/dbraw/zinc/40/73/46/506407346.db2.gz	YNNJDPRMNXKAIH-UHFFFAOYSA-N	0	0	357.351	2.771	50	5		FFBARN
COc1ccc2cc3c(N)nn(C(=O)c4ccccc4[N+](=O)[O-])c3nc2c1	ZINC000004939912	506408135	/nfs/dbraw/zinc/40/81/35/506408135.db2.gz	VHVJCLWOXHRPDC-UHFFFAOYSA-N	0	0	363.333	2.772	50	5		FFBARN
COc1ccccc1Nc1nc(NCc2ccco2)nc(N)c1[N+](=O)[O-]	ZINC000005026103	506416223	/nfs/dbraw/zinc/41/62/23/506416223.db2.gz	FQANZQDONBVFDT-UHFFFAOYSA-N	0	0	356.342	2.924	50	5		FFBARN
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCCC3)c1ccccc1[N+](=O)[O-]	ZINC000005139788	506424816	/nfs/dbraw/zinc/42/48/16/506424816.db2.gz	NWYXUMNOQGFJAV-UHFFFAOYSA-N	0	0	364.361	2.893	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)C[C@H](C)C3)n2)C1	ZINC000005155900	506425579	/nfs/dbraw/zinc/42/55/79/506425579.db2.gz	COZXRWRXROFHAP-XDQVBPFNSA-N	0	0	362.478	2.932	50	5		FFBARN
Cc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)C(=O)[C@H]1C	ZINC000037520888	506427445	/nfs/dbraw/zinc/42/74/45/506427445.db2.gz	RBZIDSJCBNFLJI-CQSZACIVSA-N	0	0	353.378	2.781	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cccn(Cc2ccccc2F)c1=O	ZINC000005270473	506432655	/nfs/dbraw/zinc/43/26/55/506432655.db2.gz	NXKXVQUCBBJUCG-UHFFFAOYSA-N	0	0	374.353	2.653	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@H]1CCCN(C(=O)N(C)C)C1	ZINC000040092178	506467064	/nfs/dbraw/zinc/46/70/64/506467064.db2.gz	ZPVVOOIHZKMFJJ-ZFWWWQNUSA-N	0	0	362.430	2.508	50	5		FFBARN
Cc1ccc(S(=O)(=O)Nc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-]	ZINC000006623217	506492351	/nfs/dbraw/zinc/49/23/51/506492351.db2.gz	YGGOVHKLKZFZRI-UHFFFAOYSA-N	0	0	364.379	2.865	50	5		FFBARN
COc1cccc(CN(C)CC(=O)Nc2ccc(OC)cc2[N+](=O)[O-])c1	ZINC000006639934	506494407	/nfs/dbraw/zinc/49/44/07/506494407.db2.gz	QUWOFKHOGQYRPZ-UHFFFAOYSA-N	0	0	359.382	2.683	50	5		FFBARN
CC(=O)Nc1ccc(C(=O)OCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])cc1	ZINC000007157873	506538279	/nfs/dbraw/zinc/53/82/79/506538279.db2.gz	XNFCPNQJUOILIY-UHFFFAOYSA-N	0	0	371.349	2.657	50	5		FFBARN
COc1ccc2nc(NC(=O)Cn3nc(C)c([N+](=O)[O-])c3C)sc2c1	ZINC000007391449	506559983	/nfs/dbraw/zinc/55/99/83/506559983.db2.gz	DALHNTPRLDUMHV-UHFFFAOYSA-N	0	0	361.383	2.665	50	5		FFBARN
CN(Cc1ccc(Cl)c(Cl)c1)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000008941976	506673993	/nfs/dbraw/zinc/67/39/93/506673993.db2.gz	MEYXBNNMLKQMRV-UHFFFAOYSA-N	0	0	356.165	2.862	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccccc1SC(F)F	ZINC000008994015	506677542	/nfs/dbraw/zinc/67/75/42/506677542.db2.gz	ODVFVYFTJVZYNQ-UHFFFAOYSA-N	0	0	355.322	2.710	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)O[C@H](C)C3)n2)cc1C	ZINC000009328242	506691516	/nfs/dbraw/zinc/69/15/16/506691516.db2.gz	QDFXUIOFXRZTGV-CHWSQXEVSA-N	0	0	372.429	2.941	50	5		FFBARN
Cn1ccnc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000009377753	506695239	/nfs/dbraw/zinc/69/52/39/506695239.db2.gz	PNDZIWVYHVNPPW-INIZCTEOSA-N	0	0	354.341	2.987	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CCC[C@@H]1c1ccccc1	ZINC000009895298	506715653	/nfs/dbraw/zinc/71/56/53/506715653.db2.gz	XHZDIIOHLQCHLU-QGZVFWFLSA-N	0	0	353.378	2.688	50	5		FFBARN
COc1ccc2c(c1)CCCN2C(=O)COc1ccc(OC)cc1[N+](=O)[O-]	ZINC000011575850	506781976	/nfs/dbraw/zinc/78/19/76/506781976.db2.gz	LDXAFDWSDTYZPW-UHFFFAOYSA-N	0	0	372.377	2.970	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000012544006	506876435	/nfs/dbraw/zinc/87/64/35/506876435.db2.gz	WONUJOSIFYDQSX-UHFFFAOYSA-N	0	0	368.393	2.805	50	5		FFBARN
CCN(CC)c1nc(O)c(CC(=O)Nc2ccc(C)cc2[N+](=O)[O-])s1	ZINC000012687106	506889209	/nfs/dbraw/zinc/88/92/09/506889209.db2.gz	FDKBBGVSPBVJBT-CYBMUJFWSA-N	0	0	364.427	2.572	50	5		FFBARN
CC(C)N(Cc1cnn(C)c1)C(=O)CCn1ncc2ccc([N+](=O)[O-])cc21	ZINC000056026505	506913281	/nfs/dbraw/zinc/91/32/81/506913281.db2.gz	XHKDZKVGTYQTJO-UHFFFAOYSA-N	0	0	370.413	2.505	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)C[C@H](C)C3)n2)C1	ZINC000013776169	506954753	/nfs/dbraw/zinc/95/47/53/506954753.db2.gz	COZXRWRXROFHAP-XJFOESAGSA-N	0	0	362.478	2.932	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(c2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)C[C@H](C)C3)n2)C1	ZINC000013776173	506954768	/nfs/dbraw/zinc/95/47/68/506954768.db2.gz	COZXRWRXROFHAP-KPWCQOOUSA-N	0	0	362.478	2.932	50	5		FFBARN
c1nnc2c3sc4nc(N5CCOCC5)c5c(c4c3ncn12)CCCC5	ZINC000019874156	507203563	/nfs/dbraw/zinc/20/35/63/507203563.db2.gz	CTQRHNRGYRAGSX-UHFFFAOYSA-N	0	0	366.450	2.603	50	5		FFBARN
COc1ccccc1-n1nnnc1SCCOc1ccccc1[N+](=O)[O-]	ZINC000048332285	507503586	/nfs/dbraw/zinc/50/35/86/507503586.db2.gz	HTYRJAQJYIZZGP-UHFFFAOYSA-N	0	0	373.394	2.750	50	5		FFBARN
O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000048957436	507582242	/nfs/dbraw/zinc/58/22/42/507582242.db2.gz	IBMDWVRNOOQAAP-KRWDZBQOSA-N	0	0	353.378	2.688	50	5		FFBARN
CCc1nn2c(nc(CNc3ccc(CC)c([N+](=O)[O-])c3)cc2=O)s1	ZINC000026788723	507609320	/nfs/dbraw/zinc/60/93/20/507609320.db2.gz	XOMCEWHFWDKDNO-UHFFFAOYSA-N	0	0	359.411	2.796	50	5		FFBARN
C[C@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C)O1	ZINC000079064717	507929354	/nfs/dbraw/zinc/92/93/54/507929354.db2.gz	KEKDZKSTYYDXQC-YUMQZZPRSA-N	0	0	361.167	2.746	50	5		FFBARN
COC(=O)[C@H]1c2ccccc2CCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000095405169	508184181	/nfs/dbraw/zinc/18/41/81/508184181.db2.gz	ZRQLEERNAMZZRX-GOSISDBHSA-N	0	0	356.378	2.746	50	5		FFBARN
Cc1c(C)c(C)c(CNC(=O)Cn2ccc(=O)c([N+](=O)[O-])c2)c(C)c1C	ZINC000133980962	508476369	/nfs/dbraw/zinc/47/63/69/508476369.db2.gz	ZINADFYTJGXWLT-UHFFFAOYSA-N	0	0	357.410	2.615	50	5		FFBARN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)C[C@@H]1NC(=O)OC(C)(C)C	ZINC000170614766	509681655	/nfs/dbraw/zinc/68/16/55/509681655.db2.gz	GYHCJHVMWUHBGW-UWVGGRQHSA-N	0	0	355.416	2.642	50	5		FFBARN
COC(=O)c1nn(CC(=O)c2cc(C)n(C3CC3)c2C)c(C)c1[N+](=O)[O-]	ZINC000242346992	509844740	/nfs/dbraw/zinc/84/47/40/509844740.db2.gz	ZKWVHZIRXGKFIY-UHFFFAOYSA-N	0	0	360.370	2.522	50	5		FFBARN
Cn1nccc1C1=C[C@H]2CC[C@@H](C1)N2c1nc2sccn2c1[N+](=O)[O-]	ZINC000252538740	509851105	/nfs/dbraw/zinc/85/11/05/509851105.db2.gz	NGHMOBDMTIPOOL-NEPJUHHUSA-N	0	0	356.411	2.862	50	5		FFBARN
CNC(=O)c1cccc(NC(=O)NCc2cc([N+](=O)[O-])ccc2OC)c1C	ZINC000544234084	516653399	/nfs/dbraw/zinc/65/33/99/516653399.db2.gz	YPVDFLVREVSOFT-UHFFFAOYSA-N	0	0	372.381	2.593	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccccc2F)CC1	ZINC000009117103	536950813	/nfs/dbraw/zinc/95/08/13/536950813.db2.gz	RHLNLPVIOKQOBN-UHFFFAOYSA-N	0	0	359.357	2.705	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1OC(=O)Cn1cccc(C(F)(F)F)c1=O	ZINC000045997675	570917950	/nfs/dbraw/zinc/91/79/50/570917950.db2.gz	GBLLITVEWLHJIF-UHFFFAOYSA-N	0	0	356.256	2.689	50	5		FFBARN
C[C@@H]1Oc2ccc(NC(=O)/C=C\c3ccccc3[N+](=O)[O-])cc2NC1=O	ZINC000096912942	1012456041	/nfs/dbraw/zinc/45/60/41/1012456041.db2.gz	ZGDNMUOFPATBPP-WDDYJBPVSA-N	0	0	353.334	2.966	50	5		FFBARN
COc1ccc(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c(OC)c1	ZINC000000652176	219309647	/nfs/dbraw/zinc/30/96/47/219309647.db2.gz	DVCVRIKNRDSFIS-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
Cc1cc(S(=O)(=O)c2ccc([N+](=O)[O-])cn2)ccc1Br	ZINC000000987856	219350251	/nfs/dbraw/zinc/35/02/51/219350251.db2.gz	UQUGYQARDRNJPP-UHFFFAOYSA-N	0	0	357.185	2.894	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(c2ccc(C)cc2)C1	ZINC000001049092	219359030	/nfs/dbraw/zinc/35/90/30/219359030.db2.gz	GDXXJINLJNCHJR-CYBMUJFWSA-N	0	0	369.377	2.903	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)Nc1nccs1	ZINC000001068833	219362392	/nfs/dbraw/zinc/36/23/92/219362392.db2.gz	VOVDBCMWGXKLHQ-LURJTMIESA-N	0	0	360.193	2.518	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)NC1(C(Cl)(Cl)Cl)OCCO1	ZINC000001099166	219369620	/nfs/dbraw/zinc/36/96/20/219369620.db2.gz	WWZDKYBSKRDUBY-UHFFFAOYSA-N	0	0	370.576	2.787	50	5		FFBARN
CCCNC(=O)c1ccc(SCC(=O)N(CC)CC)c([N+](=O)[O-])c1	ZINC000003019745	219482061	/nfs/dbraw/zinc/48/20/61/219482061.db2.gz	XALJGYWBWWVTHV-UHFFFAOYSA-N	0	0	353.444	2.695	50	5		FFBARN
Cc1ccc(NC(=O)[C@H](C)N2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])c1	ZINC000003903017	219530139	/nfs/dbraw/zinc/53/01/39/219530139.db2.gz	VJQCJIJCVYKEEQ-NSHDSACASA-N	0	0	353.334	2.526	50	5		FFBARN
CCOc1ccc(Nc2cc(NCCO)c([N+](=O)[O-])c3nonc32)cc1	ZINC000004193976	219554499	/nfs/dbraw/zinc/55/44/99/219554499.db2.gz	XTZUFWCQHIVSLI-UHFFFAOYSA-N	0	0	359.342	2.678	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCSc2ccccc2)cc1[N+](=O)[O-]	ZINC000004310079	219564125	/nfs/dbraw/zinc/56/41/25/219564125.db2.gz	UISUHBZCADRWOI-UHFFFAOYSA-N	0	0	352.437	2.974	50	5		FFBARN
CNc1ccc(C(=O)OCC(=O)Nc2ccc3c(c2)CCC3)cc1[N+](=O)[O-]	ZINC000004509061	219581064	/nfs/dbraw/zinc/58/10/64/219581064.db2.gz	DTWZOLMKBDFOOE-UHFFFAOYSA-N	0	0	369.377	2.921	50	5		FFBARN
CN(C)C(=O)N[C@@H](Nc1ccccc1[N+](=O)[O-])C(Cl)(Cl)Cl	ZINC000004531852	219584184	/nfs/dbraw/zinc/58/41/84/219584184.db2.gz	HVANRYOBXAAFEF-SECBINFHSA-N	0	0	355.609	2.974	50	5		FFBARN
O=C(Nc1ccc(C(=O)N2CCOCC2)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000005041565	219643825	/nfs/dbraw/zinc/64/38/25/219643825.db2.gz	RWIUGGVTVKLSNN-UHFFFAOYSA-N	0	0	370.365	2.711	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1ccc(=O)n(Cc2ccc(F)cc2)c1	ZINC000007573922	219809513	/nfs/dbraw/zinc/80/95/13/219809513.db2.gz	SRRIVRMXFHHBSQ-UHFFFAOYSA-N	0	0	374.353	2.653	50	5		FFBARN
Cc1nn(CC(=O)NCCSc2ccc(Cl)cc2)c(C)c1[N+](=O)[O-]	ZINC000007828327	219829768	/nfs/dbraw/zinc/82/97/68/219829768.db2.gz	ZNNYTYWZBATHHI-UHFFFAOYSA-N	0	0	368.846	2.970	50	5		FFBARN
O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000010257270	219898118	/nfs/dbraw/zinc/89/81/18/219898118.db2.gz	KAVCMDDCFVWLGH-UHFFFAOYSA-N	0	0	356.313	2.542	50	5		FFBARN
COC[C@@H](C)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000012554227	220007337	/nfs/dbraw/zinc/00/73/37/220007337.db2.gz	FPDYGAZLTIMLDD-CYBMUJFWSA-N	0	0	371.459	2.606	50	5		FFBARN
CC(=O)N1CCc2cc(N[C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)ccc21	ZINC000012562215	220008503	/nfs/dbraw/zinc/00/85/03/220008503.db2.gz	ZGSWCJXDKVARGK-LBPRGKRZSA-N	0	0	368.393	2.943	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)CNc3cccc([N+](=O)[O-])c3C)ccc21	ZINC000012589912	220011096	/nfs/dbraw/zinc/01/10/96/220011096.db2.gz	XEHZGWSLBMMTKK-UHFFFAOYSA-N	0	0	368.393	2.863	50	5		FFBARN
O=C(Cn1c(=O)oc2cc([N+](=O)[O-])ccc21)Nc1nc2ccccc2s1	ZINC000012621427	220014457	/nfs/dbraw/zinc/01/44/57/220014457.db2.gz	WFIUGHUTRRPWLU-UHFFFAOYSA-N	0	0	370.346	2.751	50	5		FFBARN
Cc1nn(CC(=O)N[C@H]2CCSc3c(F)cccc32)c(C)c1[N+](=O)[O-]	ZINC000012621693	220014785	/nfs/dbraw/zinc/01/47/85/220014785.db2.gz	JOSGTTZBTWEDFX-ZDUSSCGKSA-N	0	0	364.402	2.901	50	5		FFBARN
CNc1ccc(C(=O)NCCCn2cnc3ccccc32)cc1[N+](=O)[O-]	ZINC000012727900	220022358	/nfs/dbraw/zinc/02/23/58/220022358.db2.gz	RLRMIPVGUPWETA-UHFFFAOYSA-N	0	0	353.382	2.806	50	5		FFBARN
Cc1ccc(C(=O)N[C@@H](CN2CCOCC2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000012754103	220024495	/nfs/dbraw/zinc/02/44/95/220024495.db2.gz	HXFBLJSCNRFMHI-SFHVURJKSA-N	0	0	369.421	2.707	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CN2CCCC2=O)cc1	ZINC000012816556	220033810	/nfs/dbraw/zinc/03/38/10/220033810.db2.gz	DAINZYLWDCYKNP-UHFFFAOYSA-N	0	0	369.377	2.978	50	5		FFBARN
O=C(NCc1nnc2ccc(C(F)(F)F)cn21)c1ccc([N+](=O)[O-])cc1	ZINC000013003613	220051991	/nfs/dbraw/zinc/05/19/91/220051991.db2.gz	XMHMDHFEXUAYLL-UHFFFAOYSA-N	0	0	365.271	2.586	50	5		FFBARN
C[C@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000015095431	220148615	/nfs/dbraw/zinc/14/86/15/220148615.db2.gz	OFXGLZAOHRTQBH-CQSZACIVSA-N	0	0	365.393	2.938	50	5		FFBARN
C[C@@H](OC(=O)[C@H]1COc2ccccc2C1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000016293435	220182675	/nfs/dbraw/zinc/18/26/75/220182675.db2.gz	STDQQYVZASSCNS-TZMCWYRMSA-N	0	0	370.361	2.716	50	5		FFBARN
C[C@H](NC(=O)OCc1ccccc1)C(=O)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000029890216	220613006	/nfs/dbraw/zinc/61/30/06/220613006.db2.gz	RHIOLMHDTNUOFN-ZDUSSCGKSA-N	0	0	369.377	2.799	50	5		FFBARN
CCOC(=O)C(C(=O)OCC)c1nc(Cl)c([N+](=O)[O-])cc1Cl	ZINC000036440479	220819960	/nfs/dbraw/zinc/81/99/60/220819960.db2.gz	HCNFCDJVZJGAHR-UHFFFAOYSA-N	0	0	351.142	2.506	50	5		FFBARN
O=C(NCc1ccccn1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000047698375	220996855	/nfs/dbraw/zinc/99/68/55/220996855.db2.gz	HNQDNFRGDJNPTH-UHFFFAOYSA-N	0	0	355.272	2.861	50	5		FFBARN
O=C(NCCc1cc(F)cc2c1OCOC2)Nc1ccc([N+](=O)[O-])cc1	ZINC000047070157	220987862	/nfs/dbraw/zinc/98/78/62/220987862.db2.gz	AOMUQZLQUMEDQE-UHFFFAOYSA-N	0	0	361.329	2.965	50	5		FFBARN
Cc1c(CS(=O)(=O)Cc2noc(C(C)(C)C)n2)cccc1[N+](=O)[O-]	ZINC000048717525	221015061	/nfs/dbraw/zinc/01/50/61/221015061.db2.gz	MQXSNKQRKABXNW-UHFFFAOYSA-N	0	0	353.400	2.699	50	5		FFBARN
Cc1cccc(OCCN(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1	ZINC000058270016	221112660	/nfs/dbraw/zinc/11/26/60/221112660.db2.gz	PECLGVFXKMNVHW-UHFFFAOYSA-N	0	0	372.377	2.825	50	5		FFBARN
CC(=O)N1N=C(c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)O[C@H]1c1ccccc1F	ZINC000064819837	221152602	/nfs/dbraw/zinc/15/26/02/221152602.db2.gz	GCIYVKVHXZJLBL-INIZCTEOSA-N	0	0	374.284	2.881	50	5		FFBARN
CCOC(=O)CN(CC(C)C)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000065732946	221236198	/nfs/dbraw/zinc/23/61/98/221236198.db2.gz	YRYDSPUXTNEUDW-UHFFFAOYSA-N	0	0	361.398	2.597	50	5		FFBARN
CCCO[C@H]1CCCN(S(=O)(=O)c2cc([N+](=O)[O-])cc(C)c2C)C1	ZINC000067435625	221254976	/nfs/dbraw/zinc/25/49/76/221254976.db2.gz	WXCFWERRWNEPKU-HNNXBMFYSA-N	0	0	356.444	2.791	50	5		FFBARN
Cc1sc(C(=O)Nc2cc(Br)c[nH]c2=O)cc1[N+](=O)[O-]	ZINC000067937586	221306984	/nfs/dbraw/zinc/30/69/84/221306984.db2.gz	CPSUMKRRZGCACZ-UHFFFAOYSA-N	0	0	358.173	2.668	50	5		FFBARN
Cc1ccc(NC(=O)N2CCN(c3ncc([N+](=O)[O-])cc3C)CC2)cc1	ZINC000096006342	132216968	/nfs/dbraw/zinc/21/69/68/132216968.db2.gz	HLDPWEUCRJCOMG-UHFFFAOYSA-N	0	0	355.398	2.961	50	5		FFBARN
COc1ccccc1Nc1nc(N2CCC(C)CC2)nc(N)c1[N+](=O)[O-]	ZINC000005029786	132825985	/nfs/dbraw/zinc/82/59/85/132825985.db2.gz	PALXWPSWOJHNLN-UHFFFAOYSA-N	0	0	358.402	2.956	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1Cl)N1CC(=O)Nc2ccccc21	ZINC000006062088	132831225	/nfs/dbraw/zinc/83/12/25/132831225.db2.gz	PXDSFWWYDRSESS-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccccc1N1CCCC1=O	ZINC000009653543	263362529	/nfs/dbraw/zinc/36/25/29/263362529.db2.gz	HCCWOJCRMUKVMH-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
O=C(NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000025212284	263388280	/nfs/dbraw/zinc/38/82/80/263388280.db2.gz	XIBMFUHTHUGUOW-UHFFFAOYSA-N	0	0	371.368	2.769	50	5		FFBARN
Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2C)c(=O)n(-c2ccccc2)n1C	ZINC000000705128	506228659	/nfs/dbraw/zinc/22/86/59/506228659.db2.gz	QUAFVDMMEZZYRS-UHFFFAOYSA-N	0	0	366.377	2.953	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)OCc1nc2ccccc2o1	ZINC000032719060	506282097	/nfs/dbraw/zinc/28/20/97/506282097.db2.gz	IFGLGLUXCTYVIW-UHFFFAOYSA-N	0	0	369.333	2.599	50	5		FFBARN
CCC(=O)Nc1ccc(CNC(=O)COc2cccc([N+](=O)[O-])c2)cc1	ZINC000032816697	506298673	/nfs/dbraw/zinc/29/86/73/506298673.db2.gz	AVSMHEFYLIWXSC-UHFFFAOYSA-N	0	0	357.366	2.639	50	5		FFBARN
COC(=O)c1ccc(CN(C)Cn2ncc3ccc([N+](=O)[O-])cc32)cc1	ZINC000032824943	506299775	/nfs/dbraw/zinc/29/97/75/506299775.db2.gz	FRCLKZGMZKPUMW-UHFFFAOYSA-N	0	0	354.366	2.821	50	5		FFBARN
CCOCCc1nnc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)s1	ZINC000002878132	506300212	/nfs/dbraw/zinc/30/02/12/506300212.db2.gz	CHILFLZIVMMDKP-UHFFFAOYSA-N	0	0	356.791	2.931	50	5		FFBARN
O=C(N/C(=C\c1ccco1)C(=O)N1CCCCC1)c1ccc([N+](=O)[O-])cc1	ZINC000002905418	506302151	/nfs/dbraw/zinc/30/21/51/506302151.db2.gz	PIGGNSAHTIZGIE-LGMDPLHJSA-N	0	0	369.377	2.971	50	5		FFBARN
CCN(CC)C(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccco1	ZINC000002950091	506303241	/nfs/dbraw/zinc/30/32/41/506303241.db2.gz	USBFKELRAAYCKF-QINSGFPZSA-N	0	0	357.366	2.827	50	5		FFBARN
Cc1cc(-c2nnc(CSc3nnc(N)s3)o2)ccc1[N+](=O)[O-]	ZINC000003138532	506311478	/nfs/dbraw/zinc/31/14/78/506311478.db2.gz	XEILLSABZMRYQD-UHFFFAOYSA-N	0	0	350.385	2.679	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)COc1ncnc2ccccc21	ZINC000003245339	506314627	/nfs/dbraw/zinc/31/46/27/506314627.db2.gz	IWPTUXKYIKSPDM-UHFFFAOYSA-N	0	0	354.322	2.564	50	5		FFBARN
CSc1ncccc1C(=O)O[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003450899	506332277	/nfs/dbraw/zinc/33/22/77/506332277.db2.gz	LPLRJKPUFFNDFX-JTQLQIEISA-N	0	0	361.379	2.896	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])Nc1cc2c(cc1Cl)NC(=O)CO2	ZINC000033193827	506346472	/nfs/dbraw/zinc/34/64/72/506346472.db2.gz	IUDJQQUQQQSRDX-UHFFFAOYSA-N	0	0	361.741	2.760	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCc2[nH]c3ccccc3c2C1	ZINC000004027815	506355793	/nfs/dbraw/zinc/35/57/93/506355793.db2.gz	OQODUOPOUIJZDO-UHFFFAOYSA-N	0	0	357.391	2.823	50	5	biogenic	FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Nc1ccc2oc(=O)sc2c1	ZINC000004148308	506362442	/nfs/dbraw/zinc/36/24/42/506362442.db2.gz	ZOZOTONYJBKVLQ-UHFFFAOYSA-N	0	0	366.376	2.872	50	5		FFBARN
O=C(c1ccc(F)cc1F)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000004191946	506364838	/nfs/dbraw/zinc/36/48/38/506364838.db2.gz	CFEKVJPOSLVIMZ-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
COc1ccc(Nc2nc(NCc3ccco3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004306102	506370258	/nfs/dbraw/zinc/37/02/58/506370258.db2.gz	WYPXDZCLCFKARD-UHFFFAOYSA-N	0	0	356.342	2.924	50	5		FFBARN
C[C@@H]1CC(=O)N(c2ccc(NCCc3ccc(O)cc3)c([N+](=O)[O-])c2)C1=O	ZINC000004684404	506387489	/nfs/dbraw/zinc/38/74/89/506387489.db2.gz	ZKJQUJMWJGDMIY-GFCCVEGCSA-N	0	0	369.377	2.854	50	5		FFBARN
Cc1ccc(N2C(=O)c3cc([N+](=O)[O-])c(N4CCOCC4)cc3C2=O)cc1	ZINC000004686405	506388451	/nfs/dbraw/zinc/38/84/51/506388451.db2.gz	XLYLBKLHESPKJL-UHFFFAOYSA-N	0	0	367.361	2.540	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3ccccc3C)CC2)ccc1[N+](=O)[O-]	ZINC000004703764	506389777	/nfs/dbraw/zinc/38/97/77/506389777.db2.gz	RJYKWFMDVDEQSK-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
O=C(NCCCn1ccnc1)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1	ZINC000004863704	506400626	/nfs/dbraw/zinc/40/06/26/506400626.db2.gz	RYXNDSRZZGWNBY-UHFFFAOYSA-N	0	0	371.441	2.992	50	5		FFBARN
Cc1cccc(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)c1	ZINC000004997416	506413053	/nfs/dbraw/zinc/41/30/53/506413053.db2.gz	QGVHRBIKUNCXEQ-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
Cc1ccc(SCCNS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005027825	506415590	/nfs/dbraw/zinc/41/55/90/506415590.db2.gz	YTTZXRZFSYWZOV-UHFFFAOYSA-N	0	0	352.437	2.974	50	5		FFBARN
Cc1ccccc1OCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000005027552	506416244	/nfs/dbraw/zinc/41/62/44/506416244.db2.gz	CCFUUALRJUIQJH-UHFFFAOYSA-N	0	0	355.394	2.631	50	5		FFBARN
COc1cccc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1OC	ZINC000005051455	506419685	/nfs/dbraw/zinc/41/96/85/506419685.db2.gz	DYMMILBRMHARMV-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
CC(=O)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o/c1=N\c1cccc(F)c1	ZINC000005188691	506427205	/nfs/dbraw/zinc/42/72/05/506427205.db2.gz	ZGACXOKONRARAS-UZYVYHOESA-N	0	0	369.308	2.989	50	5		FFBARN
Cc1cccc(N2CCN(c3ccc(C(N)=O)cc3[N+](=O)[O-])C[C@@H]2C)c1	ZINC000005688427	506453289	/nfs/dbraw/zinc/45/32/89/506453289.db2.gz	ORWBCOAQKBMZJD-AWEZNQCLSA-N	0	0	354.410	2.717	50	5		FFBARN
O=C1N[C@@]2(CCCc3sccc32)C(=O)N1Cc1ccccc1[N+](=O)[O-]	ZINC000005679378	506453338	/nfs/dbraw/zinc/45/33/38/506453338.db2.gz	QNHOEXRMIFUFGK-QGZVFWFLSA-N	0	0	357.391	2.940	50	5		FFBARN
CN(C[C@@H](O)COc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000040155566	506475709	/nfs/dbraw/zinc/47/57/09/506475709.db2.gz	CEMNVEGBAZLCHF-CYBMUJFWSA-N	0	0	371.315	2.885	50	5		FFBARN
O=C(CSc1ncnc2[nH]cnc21)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000006382835	506480701	/nfs/dbraw/zinc/48/07/01/506480701.db2.gz	STDHPBVRGPPSDS-UHFFFAOYSA-N	0	0	364.774	2.645	50	5		FFBARN
COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1	ZINC000006486800	506485340	/nfs/dbraw/zinc/48/53/40/506485340.db2.gz	IMCNCKVJQGXOMZ-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCSCc2ccco2)cc1[N+](=O)[O-]	ZINC000006520655	506486390	/nfs/dbraw/zinc/48/63/90/506486390.db2.gz	SDEYYWHSPXFBPP-UHFFFAOYSA-N	0	0	356.425	2.708	50	5		FFBARN
CC[C@@H]1Oc2ccccc2C(=O)N(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000006719944	506501272	/nfs/dbraw/zinc/50/12/72/506501272.db2.gz	IPHHVSDUBMUVDA-INIZCTEOSA-N	0	0	368.345	2.618	50	5		FFBARN
CCc1noc(C)c1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000006949012	506519270	/nfs/dbraw/zinc/51/92/70/506519270.db2.gz	MCRRQCGZGINZTL-UHFFFAOYSA-N	0	0	358.310	2.861	50	5		FFBARN
Cc1cc(CNC(=O)COC(=O)c2cccc(C)c2[N+](=O)[O-])cc(C)c1O	ZINC000007986124	506609554	/nfs/dbraw/zinc/60/95/54/506609554.db2.gz	HZXAOEHISPUJIW-UHFFFAOYSA-N	0	0	372.377	2.699	50	5		FFBARN
NC=C1c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]	ZINC000008444011	506650821	/nfs/dbraw/zinc/65/08/21/506650821.db2.gz	SDNCJZPNKGJVRF-UHFFFAOYSA-N	0	0	373.237	2.648	50	5		FFBARN
CCOC(=O)c1cc(C(=O)Nc2nnc(C3CC3)s2)cc([N+](=O)[O-])c1	ZINC000009337593	506691236	/nfs/dbraw/zinc/69/12/36/506691236.db2.gz	AEOUMTMQBLTNHT-UHFFFAOYSA-N	0	0	362.367	2.753	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCSCc1ccsc1	ZINC000009389926	506696035	/nfs/dbraw/zinc/69/60/35/506696035.db2.gz	PILRATDZQLMMQF-UHFFFAOYSA-N	0	0	358.466	2.868	50	5		FFBARN
CC[C@@H](CO)Nc1ccc(-c2n[nH]c(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000010257308	506734309	/nfs/dbraw/zinc/73/43/09/506734309.db2.gz	ZVPCIVRVOIEYAS-LBPRGKRZSA-N	0	0	354.366	2.681	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)[C@H](N1CCOCC1)/C(=C\C1(O)CCCCC1)O2	ZINC000012375205	506855934	/nfs/dbraw/zinc/85/59/34/506855934.db2.gz	NTHQPAPZADRELK-KJCUYJGMSA-N	0	0	360.410	2.940	50	5		FFBARN
CN(C)C(=O)[C@@H](c1ccccc1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000015443450	507041785	/nfs/dbraw/zinc/04/17/85/507041785.db2.gz	SMMWNBRJYFVAAX-LJQANCHMSA-N	0	0	368.437	2.546	50	5		FFBARN
O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)COc3ccc(Cl)cc3)n2)cc1	ZINC000046060822	507071004	/nfs/dbraw/zinc/07/10/04/507071004.db2.gz	XCPIKHAKBZVUPW-OAHLLOKOSA-N	0	0	374.784	2.947	50	5		FFBARN
Cc1ccc(NC(=O)[C@H](c2ccccc2)N2CCOCC2)c([N+](=O)[O-])c1	ZINC000023732541	507369207	/nfs/dbraw/zinc/36/92/07/507369207.db2.gz	OLFJKLALILCVTR-SFHVURJKSA-N	0	0	355.394	2.915	50	5		FFBARN
O=[N+]([O-])c1cccnc1N1CCN(CCOc2ccccc2Cl)CC1	ZINC000024572834	507419206	/nfs/dbraw/zinc/41/92/06/507419206.db2.gz	KGLBYFUQWLZTSV-UHFFFAOYSA-N	0	0	362.817	2.844	50	5		FFBARN
O=C(NCc1cccnc1-n1cccn1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000024590139	507422246	/nfs/dbraw/zinc/42/22/46/507422246.db2.gz	WCOGDSYTBMNXPE-UHFFFAOYSA-N	0	0	357.757	2.759	50	5		FFBARN
CCCc1ccc(OCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000030835756	507813546	/nfs/dbraw/zinc/81/35/46/507813546.db2.gz	LQXSDKMBUMOYRP-UHFFFAOYSA-N	0	0	364.423	2.905	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCO2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000031204722	507818113	/nfs/dbraw/zinc/81/81/13/507818113.db2.gz	XKZKQBKAQMXUDQ-UHFFFAOYSA-N	0	0	352.306	2.762	50	5		FFBARN
COc1ccc(C(=O)Nc2ccc(OC)c(OC)c2OC)cc1[N+](=O)[O-]	ZINC000075127060	508084908	/nfs/dbraw/zinc/08/49/08/508084908.db2.gz	GMEKTGUYKJSWGJ-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
CC(C)c1nnc(CNc2ncc(Br)cc2[N+](=O)[O-])n1C	ZINC000095467635	508187951	/nfs/dbraw/zinc/18/79/51/508187951.db2.gz	TYFAUJZEMHIUNM-UHFFFAOYSA-N	0	0	355.196	2.616	50	5		FFBARN
C[C@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000095468374	508187640	/nfs/dbraw/zinc/18/76/40/508187640.db2.gz	BVGFCNDLPJIODT-VHSXEESVSA-N	0	0	364.370	2.818	50	5		FFBARN
C[C@@H](O)c1nc2ccccc2n1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000095947488	508198358	/nfs/dbraw/zinc/19/83/58/508198358.db2.gz	GEMQGBXWLZRISC-LLVKDONJSA-N	0	0	355.350	2.913	50	5		FFBARN
C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@@H](C)[C@H]1C	ZINC000248133018	509243610	/nfs/dbraw/zinc/24/36/10/509243610.db2.gz	ZINVDDQTRNQZSD-MCYUEQNJSA-N	0	0	363.414	2.663	50	5		FFBARN
Cc1nc2ccccn2c1-c1nnc2sc(-c3ccc([N+](=O)[O-])o3)nn21	ZINC000227143766	509406673	/nfs/dbraw/zinc/40/66/73/509406673.db2.gz	AKLORIOSXWXUNG-UHFFFAOYSA-N	0	0	367.350	2.977	50	5		FFBARN
COC(=O)N1CCC([C@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000170600789	509675876	/nfs/dbraw/zinc/67/58/76/509675876.db2.gz	CNGHCPGQXMQKCP-VIFPVBQESA-N	0	0	355.416	2.561	50	5		FFBARN
Cc1c(C(=O)N2CCc3c2cccc3[N+](=O)[O-])cccc1N1CCNC1=O	ZINC000170640925	509691865	/nfs/dbraw/zinc/69/18/65/509691865.db2.gz	SNFMWHMINNFWHM-UHFFFAOYSA-N	0	0	366.377	2.636	50	5		FFBARN
COc1cccc2c1N(CC(=O)N1CCc3ccc([N+](=O)[O-])cc31)CCC2	ZINC000026339593	536959643	/nfs/dbraw/zinc/95/96/43/536959643.db2.gz	WLSHKBODRXOJFV-UHFFFAOYSA-N	0	0	367.405	2.945	50	5		FFBARN
O=C(NCC12CC3CC(CC(C3)C1)C2)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000048700298	570958541	/nfs/dbraw/zinc/95/85/41/570958541.db2.gz	HRCQSPCLWUXGCM-UHFFFAOYSA-N	0	0	357.410	2.866	50	5		FFBARN
Cc1c(CS(=O)(=O)CC(=O)N[C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-]	ZINC000048718154	570959264	/nfs/dbraw/zinc/95/92/64/570959264.db2.gz	JYPFLKWDNVGMHW-IUODEOHRSA-N	0	0	368.455	2.513	50	5		FFBARN
CC(=O)Oc1ccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1	ZINC000001227944	1014465266	/nfs/dbraw/zinc/46/52/66/1014465266.db2.gz	JBYSSHUHAVLLCX-CXUHLZMHSA-N	0	0	352.302	2.865	50	5		FFBARN
COc1cc(/C=C\C(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1O	ZINC000033370451	990258247	/nfs/dbraw/zinc/25/82/47/990258247.db2.gz	USBDAZRHCLHOFY-CLFYSBASSA-N	0	0	372.333	2.504	50	5		FFBARN
Cn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1ccc(N)cc1	ZINC000000694142	219314061	/nfs/dbraw/zinc/31/40/61/219314061.db2.gz	JUDJWZJHJGVFNL-UHFFFAOYSA-N	0	0	369.406	2.948	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1cc(C)ccc1O	ZINC000000797412	219322520	/nfs/dbraw/zinc/32/25/20/219322520.db2.gz	SIBUOKQEHRMUIJ-UHFFFAOYSA-N	0	0	369.175	2.515	50	5		FFBARN
COc1ccc(OC)c(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000000865109	219333459	/nfs/dbraw/zinc/33/34/59/219333459.db2.gz	PWYNSFSNBBUWGV-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
Cc1ccc(-c2nnc3s/c(=C\c4ccc([N+](=O)[O-])cc4)c(=O)n32)cc1	ZINC000001068623	219362967	/nfs/dbraw/zinc/36/29/67/219362967.db2.gz	GVMRZKIUTZOGRS-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
Cc1cccc(N2C[C@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)c1	ZINC000001059189	219360491	/nfs/dbraw/zinc/36/04/91/219360491.db2.gz	SJVPWZTYFQKEPO-OAHLLOKOSA-N	0	0	354.362	3.000	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O	ZINC000001133199	219377220	/nfs/dbraw/zinc/37/72/20/219377220.db2.gz	JWDWKQRLBZBAOB-LLVKDONJSA-N	0	0	353.334	2.526	50	5		FFBARN
COCCCn1c(=O)c2c(=O)c3ccccc3n(C)c2nc1-c1ccco1	ZINC000002439416	219444662	/nfs/dbraw/zinc/44/46/62/219444662.db2.gz	OCFLKZPPVRPVSL-UHFFFAOYSA-N	0	0	365.389	2.545	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NC[C@H]3CCCO3)n2)cc1C	ZINC000004306166	219563761	/nfs/dbraw/zinc/56/37/61/219563761.db2.gz	JKEWGBJXQXXVLM-CYBMUJFWSA-N	0	0	358.402	2.918	50	5		FFBARN
Cc1cc2nc3s/c(=C/c4cccc([N+](=O)[O-])c4)c(=O)n3c2cc1C	ZINC000004579325	219588879	/nfs/dbraw/zinc/58/88/79/219588879.db2.gz	CJKBSINIJQMRSN-CXUHLZMHSA-N	0	0	351.387	2.982	50	5		FFBARN
CCS(=O)(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1	ZINC000005241404	219664201	/nfs/dbraw/zinc/66/42/01/219664201.db2.gz	QVHCMJLMOBGOAZ-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
O=[N+]([O-])c1cc(C(F)(F)F)ccc1NNC(=S)NC[C@H]1CCCO1	ZINC000007155942	219793968	/nfs/dbraw/zinc/79/39/68/219793968.db2.gz	ZJNGKOYHAZIKAJ-SECBINFHSA-N	0	0	364.349	2.584	50	5		FFBARN
O=C(NCCCNC(=O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1	ZINC000008404248	219862324	/nfs/dbraw/zinc/86/23/24/219862324.db2.gz	YAZYUAUGZGXFCF-UHFFFAOYSA-N	0	0	366.377	2.626	50	5		FFBARN
COc1cc(CCNC(=O)NCc2ccccc2)c([N+](=O)[O-])cc1OC	ZINC000014015421	220103039	/nfs/dbraw/zinc/10/30/39/220103039.db2.gz	IUQBEVMSUKFIEJ-UHFFFAOYSA-N	0	0	359.382	2.654	50	5		FFBARN
C[C@@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccccc1OC(F)F	ZINC000014083290	220104942	/nfs/dbraw/zinc/10/49/42/220104942.db2.gz	RDKXBTLBQNRCAF-MRVPVSSYSA-N	0	0	370.264	2.973	50	5		FFBARN
COc1ccc(Oc2ccc3nnc(C(F)(F)F)n3n2)c([N+](=O)[O-])c1	ZINC000014212541	220116810	/nfs/dbraw/zinc/11/68/10/220116810.db2.gz	ZMMRTAGEFDANMB-UHFFFAOYSA-N	0	0	355.232	2.852	50	5		FFBARN
C[C@H]1CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2S1(=O)=O	ZINC000017244169	220211301	/nfs/dbraw/zinc/21/13/01/220211301.db2.gz	IFEFDAMGVMCTAA-LBPRGKRZSA-N	0	0	360.391	2.694	50	5		FFBARN
Cc1ccc(NC(=O)CCCN2C(=O)[C@@H]3CC=CC[C@@H]3C2=O)c([N+](=O)[O-])c1	ZINC000018227916	220228951	/nfs/dbraw/zinc/22/89/51/220228951.db2.gz	UZPLMHHJQJRWAR-OKILXGFUSA-N	0	0	371.393	2.573	50	5		FFBARN
Cc1cc(=O)c(C(=O)N2C[C@@H](C)C[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-]	ZINC000029514912	220606545	/nfs/dbraw/zinc/60/65/45/220606545.db2.gz	GTXPUCYVFUTJLM-STQMWFEESA-N	0	0	370.409	2.567	50	5		FFBARN
CC(C)(C)OC(=O)N1CCCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000058086875	221098110	/nfs/dbraw/zinc/09/81/10/221098110.db2.gz	HCUVBUJPADNZEY-UHFFFAOYSA-N	0	0	363.414	2.607	50	5		FFBARN
COCCN1C(=O)[C@H](Oc2ccc(F)cc2)[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000058085183	221098852	/nfs/dbraw/zinc/09/88/52/221098852.db2.gz	PVHVWPYMSZGGGR-DLBZAZTESA-N	0	0	360.341	2.711	50	5		FFBARN
O=C(CSc1ncccc1[N+](=O)[O-])Nc1ccc2c(c1)OCCCO2	ZINC000067648757	221264733	/nfs/dbraw/zinc/26/47/33/221264733.db2.gz	KDJKHKCLXMNDQE-UHFFFAOYSA-N	0	0	361.379	2.882	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccccc3F)CC2)cc1[N+](=O)[O-]	ZINC000001149650	132380534	/nfs/dbraw/zinc/38/05/34/132380534.db2.gz	LBFXOAAYPPXFTN-UHFFFAOYSA-N	0	0	359.357	2.705	50	5		FFBARN
Cc1nc(N2C[C@@H](C)O[C@@H](C)C2)nc(NCc2ccccc2)c1[N+](=O)[O-]	ZINC000036708812	132940210	/nfs/dbraw/zinc/94/02/10/132940210.db2.gz	KQLQYQVFYCWXEY-BETUJISGSA-N	0	0	357.414	2.919	50	5		FFBARN
O=C(Cn1ccc2c1cccc2[N+](=O)[O-])Nc1cccc(-c2nc[nH]n2)c1	ZINC000096223657	222085836	/nfs/dbraw/zinc/08/58/36/222085836.db2.gz	WBNGGDCWPMZNLH-UHFFFAOYSA-N	0	0	362.349	2.973	50	5		FFBARN
CCOC(=O)c1cc2c(nc3ccccn3c2=O)n(C2CCCCC2)c1=N	ZINC000100318741	222241565	/nfs/dbraw/zinc/24/15/65/222241565.db2.gz	ZBWKDXPRKZXWGY-UHFFFAOYSA-N	0	0	366.421	2.811	50	5		FFBARN
COCCn1c2ccccc2s/c1=N\C(=O)c1ccccc1[N+](=O)[O-]	ZINC000100872474	222255499	/nfs/dbraw/zinc/25/54/99/222255499.db2.gz	LXQRUBXRRFVEAB-ZCXUNETKSA-N	0	0	357.391	2.999	50	5		FFBARN
COCCn1c2ccc([N+](=O)[O-])cc2s/c1=N\C(=O)c1ccccc1	ZINC000100872666	222255802	/nfs/dbraw/zinc/25/58/02/222255802.db2.gz	ZBIVIICDQCOMBE-ZCXUNETKSA-N	0	0	357.391	2.999	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1cccc(Cl)c1	ZINC000103529705	222337784	/nfs/dbraw/zinc/33/77/84/222337784.db2.gz	GHCHCBRODQXBLY-UKRRQHHQSA-N	0	0	371.736	2.541	50	5		FFBARN
Cc1ccc(N2C(=O)[C@@H]3ON=C(c4ccc([N+](=O)[O-])cc4)C3=C2O)c(C)c1	ZINC000103945272	222347641	/nfs/dbraw/zinc/34/76/41/222347641.db2.gz	PEODFDAIUIXEHI-NVXWUHKLSA-N	0	0	365.345	2.504	50	5		FFBARN
CS(=O)(=O)c1ccc(Oc2ccc(-c3nnco3)cc2)c([N+](=O)[O-])c1	ZINC000003449592	263329584	/nfs/dbraw/zinc/32/95/84/263329584.db2.gz	OJNZAXXWDZJOOJ-UHFFFAOYSA-N	0	0	361.335	2.841	50	5		FFBARN
Cc1ccc(S(=O)(=O)c2ccc(Cn3cnc([N+](=O)[O-])c3)cc2)cc1	ZINC000032331575	263393184	/nfs/dbraw/zinc/39/31/84/263393184.db2.gz	HIDHALQMVHURFS-UHFFFAOYSA-N	0	0	357.391	2.981	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(Br)cc1C	ZINC000001428828	506262905	/nfs/dbraw/zinc/26/29/05/506262905.db2.gz	HHBWCXIDVZVIOG-UHFFFAOYSA-N	0	0	353.176	2.809	50	5		FFBARN
CC(C)CC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000002203451	506273479	/nfs/dbraw/zinc/27/34/79/506273479.db2.gz	OVUIQBVQPYBDDH-UHFFFAOYSA-N	0	0	369.424	2.869	50	5		FFBARN
CC(=O)Nc1cccc(-n2c(C)nnc2Sc2ncccc2[N+](=O)[O-])c1	ZINC000032779344	506295171	/nfs/dbraw/zinc/29/51/71/506295171.db2.gz	GOYISLFLAWODPD-UHFFFAOYSA-N	0	0	370.394	2.989	50	5		FFBARN
O=C(NC[C@H](c1ccccc1)N1CCOCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000032779502	506295624	/nfs/dbraw/zinc/29/56/24/506295624.db2.gz	YRDKLPOUZURCQE-GOSISDBHSA-N	0	0	370.409	2.790	50	5		FFBARN
CCOC(=O)CNC(=O)c1cc([N+](=O)[O-])ccc1Oc1ccc(OC)cc1	ZINC000003045613	506309938	/nfs/dbraw/zinc/30/99/38/506309938.db2.gz	IMEPHDUIZPFHTI-UHFFFAOYSA-N	0	0	374.349	2.689	50	5		FFBARN
Cc1ccc(S(=O)(=O)c2ccc(Cn3cc([N+](=O)[O-])cn3)cc2)cc1	ZINC000032922474	506313313	/nfs/dbraw/zinc/31/33/13/506313313.db2.gz	YYOLDOHACUMDNP-UHFFFAOYSA-N	0	0	357.391	2.981	50	5		FFBARN
CCN(C(=O)COC(=O)c1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1	ZINC000003442660	506331344	/nfs/dbraw/zinc/33/13/44/506331344.db2.gz	SRUVAJDJNOYTNC-UHFFFAOYSA-N	0	0	358.350	2.813	50	5		FFBARN
O=C1OCC2=C1[C@H](c1ccccc1[N+](=O)[O-])c1cc3c(cc1N2)OCCO3	ZINC000004051772	506357459	/nfs/dbraw/zinc/35/74/59/506357459.db2.gz	DERNCXGDCOYZIX-QGZVFWFLSA-N	0	0	366.329	2.734	50	5		FFBARN
Cc1cc2c(cc1C)N[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)C(=O)N2	ZINC000004115951	506361044	/nfs/dbraw/zinc/36/10/44/506361044.db2.gz	LCYXUFMXQYWZEG-INIZCTEOSA-N	0	0	354.366	2.973	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004732005	506392142	/nfs/dbraw/zinc/39/21/42/506392142.db2.gz	DNFDTQYMAZDDGR-SNVBAGLBSA-N	0	0	361.304	2.865	50	5		FFBARN
O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)NCCOc2ccccc2)c1	ZINC000004844778	506399392	/nfs/dbraw/zinc/39/93/92/506399392.db2.gz	ODILYHRPIZZMJX-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)c2noc(C(C)C)c2[N+](=O)[O-])CC1	ZINC000004884889	506402883	/nfs/dbraw/zinc/40/28/83/506402883.db2.gz	SSLPFVUJIWEGMT-UHFFFAOYSA-N	0	0	374.397	2.677	50	5		FFBARN
O=C(COC(=O)c1ccc2ccccc2n1)Nc1ccccc1[N+](=O)[O-]	ZINC000005079988	506421173	/nfs/dbraw/zinc/42/11/73/506421173.db2.gz	ZPVBSYSGFIMDPN-UHFFFAOYSA-N	0	0	351.318	2.939	50	5		FFBARN
C[C@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)c1cccc(F)c1	ZINC000037522076	506427077	/nfs/dbraw/zinc/42/70/77/506427077.db2.gz	JHKVPKWMPMPNDQ-LBPRGKRZSA-N	0	0	357.341	2.611	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cn1)Nc1ccccc1N1CCOCC1	ZINC000037867520	506433062	/nfs/dbraw/zinc/43/30/62/506433062.db2.gz	QUHLNLVHAMNEMY-UHFFFAOYSA-N	0	0	374.422	2.557	50	5		FFBARN
NS(=O)(=O)c1ccc(NCCCSc2ccccc2)c([N+](=O)[O-])c1	ZINC000005637461	506451686	/nfs/dbraw/zinc/45/16/86/506451686.db2.gz	TVNSQIQWJIGKJJ-UHFFFAOYSA-N	0	0	367.452	2.837	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1ccc(N2CCCCC2)cc1	ZINC000005971446	506463044	/nfs/dbraw/zinc/46/30/44/506463044.db2.gz	FFPJSZIDARUNDM-UHFFFAOYSA-N	0	0	356.382	2.998	50	5		FFBARN
O=C(COC(=O)c1cccc(OC(F)F)c1)Nc1ccc([N+](=O)[O-])cc1	ZINC000006485935	506484580	/nfs/dbraw/zinc/48/45/80/506484580.db2.gz	BYLCAWLOLWXXHX-UHFFFAOYSA-N	0	0	366.276	2.992	50	5		FFBARN
Cc1cc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])cc2)c([N+](=O)[O-])cc1C	ZINC000006945466	506518696	/nfs/dbraw/zinc/51/86/96/506518696.db2.gz	FLOKJEUITWSCLI-UHFFFAOYSA-N	0	0	373.321	2.915	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)Cc1csc(N2CCCC2=O)n1	ZINC000008775851	506669057	/nfs/dbraw/zinc/66/90/57/506669057.db2.gz	ZQUOHVZLLMWZHN-UHFFFAOYSA-N	0	0	360.395	2.668	50	5		FFBARN
COC(=O)c1ccccc1NC(=O)/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000008944078	506674244	/nfs/dbraw/zinc/67/42/44/506674244.db2.gz	BWKUEYZJMFDNIB-VOTSOKGWSA-N	0	0	370.317	2.762	50	5		FFBARN
O=C(NCCOc1ccc(-c2cccs2)nn1)c1ccc([N+](=O)[O-])cc1	ZINC000009853331	506714351	/nfs/dbraw/zinc/71/43/51/506714351.db2.gz	YUNZCPKRTVSWON-UHFFFAOYSA-N	0	0	370.390	2.922	50	5		FFBARN
C[C@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000010643215	506750257	/nfs/dbraw/zinc/75/02/57/506750257.db2.gz	CBOKUTJNFQEMMN-JTQLQIEISA-N	0	0	364.379	2.900	50	5		FFBARN
Cc1sc2ncnc(N[C@@H](CO)[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C	ZINC000011170280	506768422	/nfs/dbraw/zinc/76/84/22/506768422.db2.gz	HAGOYDBUFBWQDO-DZGCQCFKSA-N	0	0	374.422	2.723	50	5		FFBARN
O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1cccc(N2CCCC2=O)c1	ZINC000011453540	506776466	/nfs/dbraw/zinc/77/64/66/506776466.db2.gz	UXPIJXCIWYOSSB-UHFFFAOYSA-N	0	0	373.340	2.878	50	5		FFBARN
Cn1ccnc1[C@@](O)(CCNc1ccc(F)cc1[N+](=O)[O-])C(F)(F)F	ZINC000045802433	507022919	/nfs/dbraw/zinc/02/29/19/507022919.db2.gz	VGAGRCPEIYBVQT-ZDUSSCGKSA-N	0	0	362.283	2.720	50	5		FFBARN
COc1ccc(OC)c(CNc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])c1	ZINC000024211844	507398669	/nfs/dbraw/zinc/39/86/69/507398669.db2.gz	LNAWECRTMYSFID-UHFFFAOYSA-N	0	0	366.395	2.628	50	5		FFBARN
O=C(Nc1ccc(NC(=O)[C@@H]2CCCO2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000030175909	507803399	/nfs/dbraw/zinc/80/33/99/507803399.db2.gz	GLFPWIOYKXYHHP-INIZCTEOSA-N	0	0	355.350	2.965	50	5		FFBARN
CN(C)c1ccc(C(=O)N2CCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000030764661	507813047	/nfs/dbraw/zinc/81/30/47/507813047.db2.gz	OATBDYWNXASIAU-SFHVURJKSA-N	0	0	355.394	2.875	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2cc(OC)c(OC)cc2C1	ZINC000031034859	507816286	/nfs/dbraw/zinc/81/62/86/507816286.db2.gz	RZTXYHQNYLIKLG-UHFFFAOYSA-N	0	0	371.393	2.852	50	5		FFBARN
NC(=O)[C@@H]1CCCCC[C@@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000079097526	507933243	/nfs/dbraw/zinc/93/32/43/507933243.db2.gz	DVTUJJVOABWDJI-PWSUYJOCSA-N	0	0	354.794	2.804	50	5		FFBARN
C[C@@H]1c2cccn2CCN1S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F	ZINC000225832616	509390212	/nfs/dbraw/zinc/39/02/12/509390212.db2.gz	GXGXPJNUBPOMHH-SECBINFHSA-N	0	0	373.793	2.954	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)Nc1ccc(Cl)cn1	ZINC000033649833	727929414	/nfs/dbraw/zinc/92/94/14/727929414.db2.gz	IQCXJWKXZLHXLY-BAQGIRSFSA-N	0	0	361.741	2.838	50	5		FFBARN
COc1ccc(NC(=O)COC(=O)/C=C\c2ccccc2[N+](=O)[O-])cc1	ZINC000033730178	985180608	/nfs/dbraw/zinc/18/06/08/985180608.db2.gz	JRAFVRAIWJXWNE-WDZFZDKYSA-N	0	0	356.334	2.799	50	5		FFBARN
CN(Cc1ccccc1)C(=O)COC(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000033661109	990539194	/nfs/dbraw/zinc/53/91/94/990539194.db2.gz	GTSIYCGJRQJONS-XFXZXTDPSA-N	0	0	354.362	2.810	50	5		FFBARN
Cc1cc(C)cc(NC(=O)NC[C@H](O)COc2ccc([N+](=O)[O-])cc2)c1	ZINC000001033887	219354613	/nfs/dbraw/zinc/35/46/13/219354613.db2.gz	RWFYZLRFNRVSGO-INIZCTEOSA-N	0	0	359.382	2.773	50	5		FFBARN
COc1ccc(C(=O)Nc2ccccc2C(=O)NC(C)C)cc1[N+](=O)[O-]	ZINC000001059998	219361700	/nfs/dbraw/zinc/36/17/00/219361700.db2.gz	LXSLUZYEXYDEFR-UHFFFAOYSA-N	0	0	357.366	2.994	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)Nc1nccs1	ZINC000001068834	219362495	/nfs/dbraw/zinc/36/24/95/219362495.db2.gz	VOVDBCMWGXKLHQ-ZCFIWIBFSA-N	0	0	360.193	2.518	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000001212398	219390177	/nfs/dbraw/zinc/39/01/77/219390177.db2.gz	KTEOIVMFGWSIHU-DOMZBBRYSA-N	0	0	371.315	2.777	50	5		FFBARN
CCOC(=O)C1=C(c2ccccc2)NC(=O)N[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000001232836	219391846	/nfs/dbraw/zinc/39/18/46/219391846.db2.gz	MOTQRVGPHVHLKA-KRWDZBQOSA-N	0	0	367.361	2.923	50	5		FFBARN
Cc1nn(Cc2ccc(C)cc2)c(C)c1NC(=O)c1nn(C)cc1[N+](=O)[O-]	ZINC000002756405	219462025	/nfs/dbraw/zinc/46/20/25/219462025.db2.gz	QECRLZILIAVYFF-UHFFFAOYSA-N	0	0	368.397	2.751	50	5		FFBARN
CNc1ccc([N+](=O)[O-])c(CS(=O)(=O)c2ccc(C)cc2)c1[N+](=O)[O-]	ZINC000005601654	219691120	/nfs/dbraw/zinc/69/11/20/219691120.db2.gz	MGTMUBNNEWMMBA-UHFFFAOYSA-N	0	0	365.367	2.827	50	5		FFBARN
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1ccccc1	ZINC000007918444	219833862	/nfs/dbraw/zinc/83/38/62/219833862.db2.gz	WZTKKGNGLHVGJE-UHFFFAOYSA-N	0	0	355.350	2.599	50	5		FFBARN
Cc1ccc2[nH]c(=O)cc(C(=O)OCC(=O)c3cccc([N+](=O)[O-])c3)c2c1	ZINC000009201561	219876019	/nfs/dbraw/zinc/87/60/19/219876019.db2.gz	AFCPOCQNKKNKQD-UHFFFAOYSA-N	0	0	366.329	2.784	50	5		FFBARN
O=C(Nc1cccc(-c2nnnn2C2CC2)c1)c1ccccc1[N+](=O)[O-]	ZINC000009709531	219885137	/nfs/dbraw/zinc/88/51/37/219885137.db2.gz	JPTDKDCDWDAXET-UHFFFAOYSA-N	0	0	350.338	2.836	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1cccc(C(=O)NC2CC2)c1	ZINC000012766843	220026796	/nfs/dbraw/zinc/02/67/96/220026796.db2.gz	OOVZKLYUIZAVDM-UHFFFAOYSA-N	0	0	355.350	2.748	50	5		FFBARN
Cc1ccc(NC(=O)CCn2nc(-c3cccs3)oc2=O)cc1[N+](=O)[O-]	ZINC000012794579	220031333	/nfs/dbraw/zinc/03/13/33/220031333.db2.gz	IIHQUXKBNNORED-UHFFFAOYSA-N	0	0	374.378	2.810	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)OCC(=O)N2	ZINC000012809670	220033047	/nfs/dbraw/zinc/03/30/47/220033047.db2.gz	CXMWBGQGKLQZEH-LLVKDONJSA-N	0	0	355.350	2.759	50	5		FFBARN
O=C(CSc1n[nH]c(-c2cccnc2)n1)Nc1ccccc1[N+](=O)[O-]	ZINC000015913496	220172675	/nfs/dbraw/zinc/17/26/75/220172675.db2.gz	UUFCAODJEGEBJL-UHFFFAOYSA-N	0	0	356.367	2.506	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C[C@@H]1COc2ccccc2O1	ZINC000016629062	220189023	/nfs/dbraw/zinc/18/90/23/220189023.db2.gz	CEAUWPWQLKZKKF-OAHLLOKOSA-N	0	0	371.393	2.614	50	5		FFBARN
COc1cc(CNCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc(OC)c1	ZINC000019721049	220292179	/nfs/dbraw/zinc/29/21/79/220292179.db2.gz	GDPMYPWHWDESKX-UHFFFAOYSA-N	0	0	362.382	2.919	50	5		FFBARN
COC(=O)c1ccc(OCC(=O)NC2CCCCCCC2)c([N+](=O)[O-])c1	ZINC000022222753	220379056	/nfs/dbraw/zinc/37/90/56/220379056.db2.gz	OQRXIVHEPVCYCP-UHFFFAOYSA-N	0	0	364.398	2.989	50	5		FFBARN
Cc1cc(C(=O)OCCCN2C(=O)c3ccccc3C2=O)ccc1[N+](=O)[O-]	ZINC000024695621	220456606	/nfs/dbraw/zinc/45/66/06/220456606.db2.gz	VUUWUZZWHHDNCP-UHFFFAOYSA-N	0	0	368.345	2.746	50	5		FFBARN
NC(=O)c1cc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccc1F	ZINC000025145384	220475385	/nfs/dbraw/zinc/47/53/85/220475385.db2.gz	DCXUZRAPWLKKGP-UHFFFAOYSA-N	0	0	372.356	2.685	50	5		FFBARN
CNC(=O)c1ccc(CN(C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1	ZINC000043346494	220946960	/nfs/dbraw/zinc/94/69/60/220946960.db2.gz	UUCLKTSYKQBAPH-UHFFFAOYSA-N	0	0	356.382	2.927	50	5		FFBARN
CN(CCCc1cc(-c2ccc(F)cc2)n(C)n1)c1c([N+](=O)[O-])ncn1C	ZINC000048311316	221006248	/nfs/dbraw/zinc/00/62/48/221006248.db2.gz	QTUMJVHWPQDPQV-UHFFFAOYSA-N	0	0	372.404	2.937	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N[C@H](CN1CCCC1=O)c1ccccc1	ZINC000048277510	221003798	/nfs/dbraw/zinc/00/37/98/221003798.db2.gz	DLUXTFMJHAZUPC-QGZVFWFLSA-N	0	0	367.405	2.617	50	5		FFBARN
CN(CCCOc1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2c(=O)[nH]1	ZINC000055897843	221075756	/nfs/dbraw/zinc/07/57/56/221075756.db2.gz	OFTOGCMJVGPFJZ-UHFFFAOYSA-N	0	0	368.393	2.732	50	5		FFBARN
Cc1c(NC(=O)c2cc([N+](=O)[O-])ccc2F)c(=O)n(-c2ccccc2)n1C	ZINC000059594618	221126396	/nfs/dbraw/zinc/12/63/96/221126396.db2.gz	NTHVHONRBZKQEU-UHFFFAOYSA-N	0	0	370.340	2.784	50	5		FFBARN
Cc1cn(CC(=O)NC2CCCCCC2)c(=O)n1-c1cccc([N+](=O)[O-])c1	ZINC000063863943	221144198	/nfs/dbraw/zinc/14/41/98/221144198.db2.gz	VSWQXMCXMIIBOX-UHFFFAOYSA-N	0	0	372.425	2.695	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000064819732	221152700	/nfs/dbraw/zinc/15/27/00/221152700.db2.gz	YWYMIVNXFHHKGP-INIZCTEOSA-N	0	0	356.294	2.742	50	5		FFBARN
C[C@@H]1CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1	ZINC000068778563	221318158	/nfs/dbraw/zinc/31/81/58/221318158.db2.gz	WICULRCEZZDFEO-CYBMUJFWSA-N	0	0	361.398	2.932	50	5		FFBARN
CS(=O)(=O)Nc1cccc2c1CCN(c1ccc([N+](=O)[O-])cc1F)C2	ZINC000058282547	136131398	/nfs/dbraw/zinc/13/13/98/136131398.db2.gz	KRJSECSEODXSKW-UHFFFAOYSA-N	0	0	365.386	2.668	50	5		FFBARN
COc1ccc(C(=O)NCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1	ZINC000096277208	222108020	/nfs/dbraw/zinc/10/80/20/222108020.db2.gz	SADSUUKGDFRVST-UHFFFAOYSA-N	0	0	354.322	2.583	50	5		FFBARN
COc1ccc(N[C@@H]2CC(=O)N(c3cc([N+](=O)[O-])ccc3C)C2=O)cc1	ZINC000101128798	222263665	/nfs/dbraw/zinc/26/36/65/222263665.db2.gz	DEDBECRSZKGNQV-OAHLLOKOSA-N	0	0	355.350	2.656	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(N(C)S(C)(=O)=O)cc1	ZINC000004681801	263335691	/nfs/dbraw/zinc/33/56/91/263335691.db2.gz	UVAHMRHLDRQLFI-UHFFFAOYSA-N	0	0	363.395	2.551	50	5		FFBARN
COC(=O)c1ccc(C)c(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1	ZINC000008210663	263353092	/nfs/dbraw/zinc/35/30/92/263353092.db2.gz	POWIHOXSSFZROB-UHFFFAOYSA-N	0	0	372.333	2.713	50	5		FFBARN
COCCn1c(=O)c2c(=O)c3ccccc3n(C)c2nc1-c1ccccc1	ZINC000002350191	506277805	/nfs/dbraw/zinc/27/78/05/506277805.db2.gz	NMUMUFCXWACENS-UHFFFAOYSA-N	0	0	361.401	2.562	50	5		FFBARN
Cc1c(Br)c(C(=O)Nc2cc([N+](=O)[O-])ccc2F)nn1C	ZINC000002763556	506291884	/nfs/dbraw/zinc/29/18/84/506291884.db2.gz	JBILLVXIRVKYQH-UHFFFAOYSA-N	0	0	357.139	2.791	50	5		FFBARN
CCOC(=O)c1sc2cc([N+](=O)[O-])cc(SCC(=O)OC)c2c1N	ZINC000002801174	506294529	/nfs/dbraw/zinc/29/45/29/506294529.db2.gz	GSLNSXRNEUHTCZ-UHFFFAOYSA-N	0	0	370.408	2.834	50	5		FFBARN
Cc1nn(C[C@H](C)c2nc3c4ccccc4ncn3n2)c(C)c1[N+](=O)[O-]	ZINC000002806577	506294697	/nfs/dbraw/zinc/29/46/97/506294697.db2.gz	VETJZZRNINZYTH-JTQLQIEISA-N	0	0	351.370	2.803	50	5		FFBARN
CCn1cc2nc(SCc3cccc([N+](=O)[O-])c3)n(CC)c(=O)c2n1	ZINC000002802942	506295230	/nfs/dbraw/zinc/29/52/30/506295230.db2.gz	MRBWRAXFFRHIOK-UHFFFAOYSA-N	0	0	359.411	2.833	50	5		FFBARN
CCc1c(C)sc2ncn3nc(CCn4ccc([N+](=O)[O-])n4)nc3c12	ZINC000002809732	506295892	/nfs/dbraw/zinc/29/58/92/506295892.db2.gz	LDJFEPXQROZPGZ-UHFFFAOYSA-N	0	0	357.399	2.557	50	5		FFBARN
CCCCOc1ccc(CSc2nnc(CC)n2N)cc1[N+](=O)[O-]	ZINC000002846841	506296818	/nfs/dbraw/zinc/29/68/18/506296818.db2.gz	USYMHESETJLTPE-UHFFFAOYSA-N	0	0	351.432	2.934	50	5		FFBARN
C[C@@H](Oc1ccccc1Cl)C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032795469	506297154	/nfs/dbraw/zinc/29/71/54/506297154.db2.gz	PTGSXWLKPLXZLO-IAQYHMDHSA-N	0	0	364.785	2.865	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cn(C)c(=O)c2ccccc12	ZINC000002927738	506301885	/nfs/dbraw/zinc/30/18/85/506301885.db2.gz	ATMKOKKWYMGKSD-UHFFFAOYSA-N	0	0	353.334	2.708	50	5		FFBARN
COc1cc(C)c(S(=O)(=O)n2cnc3cc([N+](=O)[O-])ccc32)cc1C	ZINC000002998819	506305824	/nfs/dbraw/zinc/30/58/24/506305824.db2.gz	JVLRMQWLTGZMAU-UHFFFAOYSA-N	0	0	361.379	2.807	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1cc(C)oc1C	ZINC000003290454	506318458	/nfs/dbraw/zinc/31/84/58/506318458.db2.gz	LYPPFSPOHLULTD-NSHDSACASA-N	0	0	362.338	2.997	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000003314670	506319819	/nfs/dbraw/zinc/31/98/19/506319819.db2.gz	PQMSJLGHMCHRNX-GHMZBOCLSA-N	0	0	354.790	2.910	50	5		FFBARN
O=c1c2ccccc2nc(SCc2ccc([N+](=O)[O-])cc2)n1CCCO	ZINC000003455103	506332599	/nfs/dbraw/zinc/33/25/99/506332599.db2.gz	OAOTWXULGRNPFN-UHFFFAOYSA-N	0	0	371.418	2.979	50	5		FFBARN
O=C(OCc1cccc([N+](=O)[O-])c1)c1ccc(S(=O)(=O)C(F)F)cc1	ZINC000003455474	506332818	/nfs/dbraw/zinc/33/28/18/506332818.db2.gz	GEIXXGPMCVGEKL-UHFFFAOYSA-N	0	0	371.317	2.948	50	5		FFBARN
COc1cc2c(cc1OC)[C@@H](c1ccccc1[N+](=O)[O-])C1=C(COC1=O)N2	ZINC000004052201	506357110	/nfs/dbraw/zinc/35/71/10/506357110.db2.gz	YDHPPZOOSRLYLB-QGZVFWFLSA-N	0	0	368.345	2.980	50	5		FFBARN
CC[C@@H](CO)Nc1ccc(-c2nn(C)c(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000004164326	506362986	/nfs/dbraw/zinc/36/29/86/506362986.db2.gz	ASOVKTAKHFUBAA-ZDUSSCGKSA-N	0	0	368.393	2.692	50	5		FFBARN
C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccccc1	ZINC000004219363	506366295	/nfs/dbraw/zinc/36/62/95/506366295.db2.gz	SHDSKLUMWXTGDD-CYBMUJFWSA-N	0	0	374.418	2.935	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1	ZINC000004497508	506379624	/nfs/dbraw/zinc/37/96/24/506379624.db2.gz	BCTDPSPOFHSKRX-AWEZNQCLSA-N	0	0	373.796	2.712	50	5		FFBARN
Cc1csc2nc(COC(=O)c3cccc(C)c3[N+](=O)[O-])cc(=O)n12	ZINC000004580283	506383439	/nfs/dbraw/zinc/38/34/39/506383439.db2.gz	GIMQWRKVIZZTMW-UHFFFAOYSA-N	0	0	359.363	2.638	50	5		FFBARN
O=C(NCCc1nc(-c2ccc(F)cc2)no1)c1cccc([N+](=O)[O-])c1	ZINC000035681717	506389603	/nfs/dbraw/zinc/38/96/03/506389603.db2.gz	MOUHMVAUYVFGKO-UHFFFAOYSA-N	0	0	356.313	2.756	50	5		FFBARN
CCOC(=O)c1ccccc1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000004712983	506390129	/nfs/dbraw/zinc/39/01/29/506390129.db2.gz	UILLOXZKKVYLMK-UHFFFAOYSA-N	0	0	360.278	2.899	50	5		FFBARN
O=C(NCc1ccccn1)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000035870206	506390631	/nfs/dbraw/zinc/39/06/31/506390631.db2.gz	CITKAHJLPPLHFL-PKOBYXMFSA-N	0	0	366.421	2.837	50	5		FFBARN
Cc1c(C(=O)N2CCOCC2)sc2nc(-c3cccc([N+](=O)[O-])c3)cn12	ZINC000004931058	506406488	/nfs/dbraw/zinc/40/64/88/506406488.db2.gz	OTHJSWBKMHADKY-UHFFFAOYSA-N	0	0	372.406	2.752	50	5		FFBARN
CCOc1ccc(Nc2nc(NCCCOC)nc(N)c2[N+](=O)[O-])cc1	ZINC000005030145	506416328	/nfs/dbraw/zinc/41/63/28/506416328.db2.gz	ZOAULAKZQZLRSH-UHFFFAOYSA-N	0	0	362.390	2.558	50	5		FFBARN
COc1cc(NC(=O)COC(=O)Cc2cccs2)c(C)cc1[N+](=O)[O-]	ZINC000005078650	506421428	/nfs/dbraw/zinc/42/14/28/506421428.db2.gz	AKCXTYOYWWYKHL-UHFFFAOYSA-N	0	0	364.379	2.698	50	5		FFBARN
COc1cccc(NC(=O)COC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c1	ZINC000005113298	506422271	/nfs/dbraw/zinc/42/22/71/506422271.db2.gz	VJEBGZSKLHZBTI-JXMROGBWSA-N	0	0	356.334	2.799	50	5		FFBARN
CC1=NN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@@](O)(c2cccc([N+](=O)[O-])c2)C1	ZINC000005232415	506430219	/nfs/dbraw/zinc/43/02/19/506430219.db2.gz	UFACBOHXFLUWTR-KRWDZBQOSA-N	0	0	370.321	2.570	50	5		FFBARN
COc1ccc(-c2nc3cc4c(cc3[nH]2)[n+]([O-])c2ccccc2[n+]4[O-])cc1	ZINC000005318688	506435861	/nfs/dbraw/zinc/43/58/61/506435861.db2.gz	UGJUZNJZBDJLGZ-UHFFFAOYSA-N	0	0	358.357	2.812	50	5		FFBARN
COc1ccc(C(=O)NCc2nc(-c3ccccc3)no2)cc1[N+](=O)[O-]	ZINC000005353617	506437626	/nfs/dbraw/zinc/43/76/26/506437626.db2.gz	UXUGGWGUXQXWMP-UHFFFAOYSA-N	0	0	354.322	2.583	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2	ZINC000005529523	506448212	/nfs/dbraw/zinc/44/82/12/506448212.db2.gz	RMXBUIIYBFDSLU-NEPJUHHUSA-N	0	0	372.356	2.547	50	5	biogenic	FFBARN
CON(C)C(=O)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1	ZINC000040566566	506484221	/nfs/dbraw/zinc/48/42/21/506484221.db2.gz	YLEOFNJZGIPYFE-JTQLQIEISA-N	0	0	361.320	2.850	50	5		FFBARN
O=C([C@H](Oc1cc(F)ccc1[N+](=O)[O-])c1ccccc1)N1CCOCC1	ZINC000006842373	506511361	/nfs/dbraw/zinc/51/13/61/506511361.db2.gz	MZIKDFHOJVRYFI-QGZVFWFLSA-N	0	0	360.341	2.713	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1c(F)c(F)c(F)c(F)c1F	ZINC000007544733	506570012	/nfs/dbraw/zinc/57/00/12/506570012.db2.gz	HRMQFJOCVSFHBV-UHFFFAOYSA-N	0	0	363.198	2.703	50	5		FFBARN
COc1cccc(C2=N/C(=C\c3cc4c(cc3[N+](=O)[O-])OCO4)C(=O)O2)c1	ZINC000008179835	506630248	/nfs/dbraw/zinc/63/02/48/506630248.db2.gz	CIGATYVXCZUNCC-MLPAPPSSSA-N	0	0	368.301	2.677	50	5		FFBARN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccc([N+](=O)[O-])cc1	ZINC000008349414	506645286	/nfs/dbraw/zinc/64/52/86/506645286.db2.gz	FLYCQVZPRKDGDE-AWEZNQCLSA-N	0	0	365.393	2.938	50	5		FFBARN
O=[N+]([O-])c1cnc(N2CCO[C@@H](c3ccccc3F)C2)nc1NC1CC1	ZINC000066814248	506650118	/nfs/dbraw/zinc/65/01/18/506650118.db2.gz	WXEFOUIMFAGEOA-OAHLLOKOSA-N	0	0	359.361	2.676	50	5		FFBARN
CCCc1nnc(S[C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)[nH]1	ZINC000008727373	506663535	/nfs/dbraw/zinc/66/35/35/506663535.db2.gz	KXZPPTCATOFMLG-VIFPVBQESA-N	0	0	365.415	2.793	50	5		FFBARN
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCCOc2ccccc2)C1=O	ZINC000009453777	506697172	/nfs/dbraw/zinc/69/71/72/506697172.db2.gz	FHVCZDLPEOBECZ-IBGZPJMESA-N	0	0	369.377	2.831	50	5		FFBARN
COc1cc(C(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc(OC)c1OC	ZINC000009721287	506708859	/nfs/dbraw/zinc/70/88/59/506708859.db2.gz	VUTJZMFKNLSMSK-UHFFFAOYSA-N	0	0	358.350	2.824	50	5		FFBARN
CCOc1cc(C(=O)Nc2nnc(C3CC3)s2)c([N+](=O)[O-])cc1OC	ZINC000009913920	506718100	/nfs/dbraw/zinc/71/81/00/506718100.db2.gz	YSQBCPYCCZMORO-UHFFFAOYSA-N	0	0	364.383	2.983	50	5		FFBARN
COc1ccc(C(=O)NCCc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-]	ZINC000010222127	506732808	/nfs/dbraw/zinc/73/28/08/506732808.db2.gz	LOUFWFLYMBTZMY-UHFFFAOYSA-N	0	0	366.377	2.762	50	5		FFBARN
COc1ccc(S(=O)(=O)Oc2cccc3c2CCC3=O)cc1[N+](=O)[O-]	ZINC000010678081	506750923	/nfs/dbraw/zinc/75/09/23/506750923.db2.gz	UIJNFQBLMIOTTQ-UHFFFAOYSA-N	0	0	363.347	2.500	50	5		FFBARN
CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000010900649	506757916	/nfs/dbraw/zinc/75/79/16/506757916.db2.gz	ZVHFDTVJLTZVRA-UHFFFAOYSA-N	0	0	355.394	2.704	50	5		FFBARN
CO[C@H](CNC(=O)NCCNc1ccccc1[N+](=O)[O-])c1ccccc1	ZINC000043892702	506798098	/nfs/dbraw/zinc/79/80/98/506798098.db2.gz	HQRDHYNBPJTWIB-QGZVFWFLSA-N	0	0	358.398	2.694	50	5		FFBARN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H](c1ccsc1)N(C)C	ZINC000045809525	507024902	/nfs/dbraw/zinc/02/49/02/507024902.db2.gz	IIVSGGGNFGENKZ-AWEZNQCLSA-N	0	0	369.468	2.546	50	5		FFBARN
O=C(c1ccoc1)N1CCC(Nc2nc3ccccn3c2[N+](=O)[O-])CC1	ZINC000024207109	507398558	/nfs/dbraw/zinc/39/85/58/507398558.db2.gz	SHUVUMWJHOIQTF-UHFFFAOYSA-N	0	0	355.354	2.552	50	5		FFBARN
CCc1ccc([C@@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)c2cccs2)cc1	ZINC000048224518	507483974	/nfs/dbraw/zinc/48/39/74/507483974.db2.gz	MIQYIZQSFPUZTG-MRXNPFEDSA-N	0	0	371.422	2.716	50	5		FFBARN
O=C(c1ccccc1)c1ccc(NCC2(O)CCOCC2)c([N+](=O)[O-])c1	ZINC000078440773	507871500	/nfs/dbraw/zinc/87/15/00/507871500.db2.gz	PMTSXFWYNWMFAW-UHFFFAOYSA-N	0	0	356.378	2.779	50	5		FFBARN
COC(=O)C[C@H](Cc1ccccc1)NC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000075092417	508081752	/nfs/dbraw/zinc/08/17/52/508081752.db2.gz	AWEPGMLFTQBJLY-HNNXBMFYSA-N	0	0	357.366	2.891	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1S(=O)(=O)c1cc(C)c(C)cc1Br	ZINC000170615099	509682180	/nfs/dbraw/zinc/68/21/80/509682180.db2.gz	KRUVCHGTSAQKLJ-UHFFFAOYSA-N	0	0	374.216	2.716	50	5		FFBARN
COC(=O)[C@H]1CN(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C[C@@H]1C1CC1	ZINC000253419429	509881262	/nfs/dbraw/zinc/88/12/62/509881262.db2.gz	RFWYYKQIEVYYSS-KGLIPLIRSA-N	0	0	352.774	2.519	50	5		FFBARN
CCOC(=O)c1c([N+](=O)[O-])c(C(C)(C)C)nn1CCO[C@H]1CCCCO1	ZINC000601014551	520595937	/nfs/dbraw/zinc/59/59/37/520595937.db2.gz	VBEAKDFRCBWWCF-LBPRGKRZSA-N	0	0	369.418	2.809	50	5		FFBARN
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H]3CC[C@H](O)[C@H]3C2)CC1	ZINC000108468587	570907301	/nfs/dbraw/zinc/90/73/01/570907301.db2.gz	BQEWZZCEKPLKQB-FNHZYXHNSA-N	0	0	373.453	2.674	50	5		FFBARN
CC(=O)c1cccc(NC(=O)COC(=O)C=Cc2ccc([N+](=O)[O-])cc2)c1	ZINC000006056509	1009631854	/nfs/dbraw/zinc/63/18/54/1009631854.db2.gz	GKOSVISCGICGMB-YFHOEESVSA-N	0	0	368.345	2.993	50	5		FFBARN
CCc1nnc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c43)C2=O)s1	ZINC000000675385	219312079	/nfs/dbraw/zinc/31/20/79/219312079.db2.gz	HECOZUADFCHTPH-UHFFFAOYSA-N	0	0	354.347	2.963	50	5		FFBARN
COc1cccc(-c2nnc(SCc3ccc([N+](=O)[O-])cc3)n2N)c1	ZINC000001049721	219358280	/nfs/dbraw/zinc/35/82/80/219358280.db2.gz	AVRUNJBHFCSUIO-UHFFFAOYSA-N	0	0	357.395	2.868	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ccc(F)cc1	ZINC000001064066	219361605	/nfs/dbraw/zinc/36/16/05/219361605.db2.gz	OZRQYTMKMOODKZ-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
C[C@H](C(=O)Nc1cccc(Cl)c1)N1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000001150576	219381357	/nfs/dbraw/zinc/38/13/57/219381357.db2.gz	GDJHZUVANXIYDW-SECBINFHSA-N	0	0	373.752	2.871	50	5		FFBARN
COC(=O)c1ccc(-n2nnnc2SCc2cccc([N+](=O)[O-])c2)cc1	ZINC000001155340	219382731	/nfs/dbraw/zinc/38/27/31/219382731.db2.gz	WKQFLMOAGWVXOG-UHFFFAOYSA-N	0	0	371.378	2.649	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000001212556	219390168	/nfs/dbraw/zinc/39/01/68/219390168.db2.gz	JMNAMCJDPQGZKJ-BXUZGUMPSA-N	0	0	357.288	2.848	50	5		FFBARN
Cc1ccccc1-c1nc2s/c(=C\c3ccc([N+](=O)[O-])cc3)c(=O)n2n1	ZINC000001315693	219394713	/nfs/dbraw/zinc/39/47/13/219394713.db2.gz	QDIJNJLQEBEUBB-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
Cc1cccc(-c2nc3s/c(=C\c4ccccc4[N+](=O)[O-])c(=O)n3n2)c1	ZINC000001313529	219394880	/nfs/dbraw/zinc/39/48/80/219394880.db2.gz	CWBMNKZBYYZRAH-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
O=C(NC1CC1)[C@H]1CCCN1c1ccc([N+](=O)[O-])cc1Br	ZINC000225505147	222847469	/nfs/dbraw/zinc/84/74/69/222847469.db2.gz	PUZUKOAZBVKFQL-CYBMUJFWSA-N	0	0	354.204	2.605	50	5		FFBARN
COc1ccc(OC)c([C@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000002781345	219464291	/nfs/dbraw/zinc/46/42/91/219464291.db2.gz	SMFJOJSHMQWUBA-NSHDSACASA-N	0	0	366.395	2.652	50	5		FFBARN
O=C(Nc1ccc(F)c(Cl)c1)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002796990	219465525	/nfs/dbraw/zinc/46/55/25/219465525.db2.gz	MVHSSCKWAZDLKJ-UHFFFAOYSA-N	0	0	364.724	2.538	50	5		FFBARN
O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000003276538	219496447	/nfs/dbraw/zinc/49/64/47/219496447.db2.gz	LTMRCNOHKNMXML-UHFFFAOYSA-N	0	0	374.736	2.701	50	5		FFBARN
Cc1c(C(=O)N[C@@H]2CC(=O)N(c3cccc(F)c3)C2)cccc1[N+](=O)[O-]	ZINC000004497317	219579739	/nfs/dbraw/zinc/57/97/39/219579739.db2.gz	PTCLITYSUNXEPJ-CYBMUJFWSA-N	0	0	357.341	2.578	50	5		FFBARN
Nc1nc(Nc2ccc(Cl)cc2)nc(NC[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000005164984	219657233	/nfs/dbraw/zinc/65/72/33/219657233.db2.gz	VXQOJNOXJUSIJM-LLVKDONJSA-N	0	0	364.793	2.955	50	5		FFBARN
COC(=O)c1ccc(C)c(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c1	ZINC000005994233	219708847	/nfs/dbraw/zinc/70/88/47/219708847.db2.gz	CHUJNJTXXQCCHL-UHFFFAOYSA-N	0	0	362.313	2.846	50	5		FFBARN
CC(=O)c1cccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000005966175	219707194	/nfs/dbraw/zinc/70/71/94/219707194.db2.gz	GRABYAQRBLXOLY-GFCCVEGCSA-N	0	0	356.334	2.981	50	5		FFBARN
Cc1ccc(C(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1[N+](=O)[O-]	ZINC000006946285	219784606	/nfs/dbraw/zinc/78/46/06/219784606.db2.gz	DVSCSOOMLWUTSB-UHFFFAOYSA-N	0	0	373.321	2.915	50	5		FFBARN
CCNC(=O)[C@H]1Cc2ccccc2N1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000010256134	219897909	/nfs/dbraw/zinc/89/79/09/219897909.db2.gz	XURUAVUHBHPUTH-ZVBPTUHVSA-N	0	0	365.389	2.702	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])NCCc1cnn(-c2ccccc2)c1	ZINC000011556163	219921711	/nfs/dbraw/zinc/92/17/11/219921711.db2.gz	WYGQJQBEDMHBNY-UHFFFAOYSA-N	0	0	350.378	2.682	50	5		FFBARN
O=C(CCn1cnc([N+](=O)[O-])c1)Nc1cc2c(cc1Cl)OCCCO2	ZINC000012525219	220002811	/nfs/dbraw/zinc/00/28/11/220002811.db2.gz	JXERZVCSLXKGHK-UHFFFAOYSA-N	0	0	366.761	2.635	50	5		FFBARN
CS(=O)(=O)c1ccc(Nc2ccc(N3CCCC3)nc2)c([N+](=O)[O-])c1	ZINC000012558583	220007133	/nfs/dbraw/zinc/00/71/33/220007133.db2.gz	UAKGNNKYKXFTHD-UHFFFAOYSA-N	0	0	362.411	2.737	50	5		FFBARN
CSc1nc(C)c(CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c(=O)[nH]1	ZINC000012756823	220025880	/nfs/dbraw/zinc/02/58/80/220025880.db2.gz	QWEVXUFNEJYKTM-UHFFFAOYSA-N	0	0	362.411	2.588	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)c1ccc(CN2C(=O)CCC2=O)cc1	ZINC000012806572	220032413	/nfs/dbraw/zinc/03/24/13/220032413.db2.gz	QWEFDXOGCPQDNU-UHFFFAOYSA-N	0	0	371.324	2.635	50	5		FFBARN
CC1(C)NC(=O)N(CCSc2nc3ccc([N+](=O)[O-])cc3s2)C1=O	ZINC000012972647	220047024	/nfs/dbraw/zinc/04/70/24/220047024.db2.gz	OBMYBWHASVQWBD-UHFFFAOYSA-N	0	0	366.424	2.627	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NC[C@@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000012983266	220048087	/nfs/dbraw/zinc/04/80/87/220048087.db2.gz	JAAWEVYXTXXRAP-HNNXBMFYSA-N	0	0	369.377	2.756	50	5		FFBARN
COc1cc2s/c(=N\C(=O)c3cccc([N+](=O)[O-])c3)n(C)c2cc1OC	ZINC000013283907	220063064	/nfs/dbraw/zinc/06/30/64/220063064.db2.gz	BNANFRGYFYRXGG-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
CS(=O)(=O)c1ccc(Oc2ccc3c(c2)OCCO3)c([N+](=O)[O-])c1	ZINC000014076655	220103631	/nfs/dbraw/zinc/10/36/31/220103631.db2.gz	BDSZPUVAKMFGIZ-UHFFFAOYSA-N	0	0	351.336	2.562	50	5		FFBARN
O=C(Cc1nn2cnc3ccccc3c2nc1=O)c1ccccc1Cl	ZINC000014241046	220118408	/nfs/dbraw/zinc/11/84/08/220118408.db2.gz	ZROONTMFLVBZKA-UHFFFAOYSA-N	0	0	350.765	2.717	50	5		FFBARN
COC(=O)c1cc(CNC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1OC	ZINC000018059219	220221593	/nfs/dbraw/zinc/22/15/93/220221593.db2.gz	WFLIBYYPXHQWHN-UHFFFAOYSA-N	0	0	358.350	2.628	50	5		FFBARN
Cc1cc(-c2nc(Cn3cnc4ccccc4c3=O)no2)ccc1[N+](=O)[O-]	ZINC000021113436	220351544	/nfs/dbraw/zinc/35/15/44/220351544.db2.gz	AEDUZJAOOUOYBF-UHFFFAOYSA-N	0	0	363.333	2.711	50	5		FFBARN
COc1ccc(OCC2=NN(C(C)=O)[C@@H](c3cccc([N+](=O)[O-])c3)O2)cc1	ZINC000021151671	220354081	/nfs/dbraw/zinc/35/40/81/220354081.db2.gz	GBSLLKLETFLYRD-GOSISDBHSA-N	0	0	371.349	2.873	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@@H]1COc1ccc(C)cc1	ZINC000021092367	220350436	/nfs/dbraw/zinc/35/04/36/220350436.db2.gz	BGBRONAMAWNKHG-QGZVFWFLSA-N	0	0	355.350	2.849	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000024142179	220442774	/nfs/dbraw/zinc/44/27/74/220442774.db2.gz	CTXPJDWFTQRMGD-UHFFFAOYSA-N	0	0	373.453	2.779	50	5		FFBARN
CC(C)(NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(Br)cc1	ZINC000032399694	220661088	/nfs/dbraw/zinc/66/10/88/220661088.db2.gz	HYNXGWPSDFTVCQ-UHFFFAOYSA-N	0	0	367.203	2.605	50	5		FFBARN
Cc1cccc(C(=O)NCCc2cc(F)cc3c2OCOC3)c1[N+](=O)[O-]	ZINC000041668953	220932703	/nfs/dbraw/zinc/93/27/03/220932703.db2.gz	MLZYQPKLTWGXLF-UHFFFAOYSA-N	0	0	360.341	2.881	50	5		FFBARN
COc1cccc(CN(C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000054425061	221052599	/nfs/dbraw/zinc/05/25/99/221052599.db2.gz	ZAMVSCTZYUPHNR-UHFFFAOYSA-N	0	0	353.382	2.951	50	5		FFBARN
C[C@H](Nc1ccc(CC(=O)N(C)C)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000056171543	221078473	/nfs/dbraw/zinc/07/84/73/221078473.db2.gz	OOLORNRLAXTBMW-ZDUSSCGKSA-N	0	0	370.409	2.665	50	5		FFBARN
O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1ccc([N+](=O)[O-])cc1	ZINC000056481624	221081056	/nfs/dbraw/zinc/08/10/56/221081056.db2.gz	IGXIUTLUTHIGJB-KRWDZBQOSA-N	0	0	353.378	2.688	50	5		FFBARN
O=C(N[C@@H]1C[C@@H]1c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000067618754	221263637	/nfs/dbraw/zinc/26/36/37/221263637.db2.gz	RDYFCQLBHFAJIO-RTBURBONSA-N	0	0	366.421	2.983	50	5		FFBARN
O=C(N[C@@H](CN1CCCC1=O)c1ccccc1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000068937384	221319478	/nfs/dbraw/zinc/31/94/78/221319478.db2.gz	IYRNLBCAYYSNDH-INIZCTEOSA-N	0	0	371.368	2.827	50	5		FFBARN
CNC(=O)c1ccc(N2CCC[C@@H](c3nncn3C(C)C)C2)c([N+](=O)[O-])c1	ZINC000089894136	132200429	/nfs/dbraw/zinc/20/04/29/132200429.db2.gz	KOFNAVSIKIHEGZ-CQSZACIVSA-N	0	0	372.429	2.511	50	5		FFBARN
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H]3CC[C@@H](O)[C@@H]3C2)CC1	ZINC000097107793	132227672	/nfs/dbraw/zinc/22/76/72/132227672.db2.gz	BQEWZZCEKPLKQB-POZUXBRTSA-N	0	0	373.453	2.674	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1Cl)N1CCN(c2ccccn2)CC1	ZINC000225850916	132286789	/nfs/dbraw/zinc/28/67/89/132286789.db2.gz	DSEKMKWBKZVLKM-UHFFFAOYSA-N	0	0	361.789	2.997	50	5		FFBARN
CC(=O)c1c(C)n(-c2ccc([N+](=O)[O-])cc2)c(=S)nc1N1CCOCC1	ZINC000001199184	132380970	/nfs/dbraw/zinc/38/09/70/132380970.db2.gz	JRSQFXLHMDFYAU-UHFFFAOYSA-N	0	0	374.422	2.858	50	5		FFBARN
C[C@@H]1CC[C@H](C(N)=O)CN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000042739822	136121306	/nfs/dbraw/zinc/12/13/06/136121306.db2.gz	CJKMKSPUALZAPQ-CJNGLKHVSA-N	0	0	367.405	2.916	50	5		FFBARN
COc1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC	ZINC000055543172	136127030	/nfs/dbraw/zinc/12/70/30/136127030.db2.gz	CBJDCNBQAKGPGB-UHFFFAOYSA-N	0	0	357.410	2.934	50	5		FFBARN
C[C@@H](CC(=O)N1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1	ZINC000057140758	136128298	/nfs/dbraw/zinc/12/82/98/136128298.db2.gz	JVCJHJJXRPZNOT-HNNXBMFYSA-N	0	0	354.410	2.832	50	5		FFBARN
COc1ccc(C)cc1[C@]1(C)NC(=O)N(Cc2ccc([N+](=O)[O-])cc2)C1=O	ZINC000089616394	221741480	/nfs/dbraw/zinc/74/14/80/221741480.db2.gz	LFZCJNJSMRCYGR-IBGZPJMESA-N	0	0	369.377	2.879	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccccc3Cl)C2=C(O)N1c1cccc([N+](=O)[O-])c1	ZINC000101201653	222265637	/nfs/dbraw/zinc/26/56/37/222265637.db2.gz	VFNIMOBWDOSCKR-HIFRSBDPSA-N	0	0	371.736	2.541	50	5		FFBARN
Nc1cc(=O)[nH]c(SCc2cc(=O)oc3ccc4ccccc4c23)n1	ZINC000003449534	263329593	/nfs/dbraw/zinc/32/95/93/263329593.db2.gz	ZZLFGECKILMNMT-UHFFFAOYSA-N	0	0	351.387	2.904	50	5		FFBARN
COc1ccc(OC)c(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c1	ZINC000000725779	506230302	/nfs/dbraw/zinc/23/03/02/506230302.db2.gz	KCAMUKFRTFFPAJ-GDNBJRDFSA-N	0	0	354.318	2.957	50	5		FFBARN
Cc1ccc(N2C[C@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000001220090	506256597	/nfs/dbraw/zinc/25/65/97/506256597.db2.gz	FRKXMKOEGOYXQT-OAHLLOKOSA-N	0	0	354.362	3.000	50	5		FFBARN
COC(=O)c1ccccc1NC(=O)CCCn1nc(C)c([N+](=O)[O-])c1C	ZINC000001432139	506262816	/nfs/dbraw/zinc/26/28/16/506262816.db2.gz	VVFSCFCPISULEC-UHFFFAOYSA-N	0	0	360.370	2.614	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000001464520	506264485	/nfs/dbraw/zinc/26/44/85/506264485.db2.gz	KCEGUEFIAVHRBT-OAHLLOKOSA-N	0	0	357.322	2.656	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)OCCOc1ccc([N+](=O)[O-])cc1	ZINC000002026386	506270977	/nfs/dbraw/zinc/27/09/77/506270977.db2.gz	HIPMJAWZQJMSEJ-UHFFFAOYSA-N	0	0	362.294	2.504	50	5		FFBARN
CCOC(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1	ZINC000002753452	506289397	/nfs/dbraw/zinc/28/93/97/506289397.db2.gz	HWIGIRUJTQCXDA-UHFFFAOYSA-N	0	0	359.294	2.932	50	5		FFBARN
Cc1nn(Cc2nc3c4c(C)c(C)sc4ncn3n2)c(C)c1[N+](=O)[O-]	ZINC000002807954	506294442	/nfs/dbraw/zinc/29/44/42/506294442.db2.gz	AQTWEJHCQODRCZ-UHFFFAOYSA-N	0	0	357.399	2.726	50	5		FFBARN
Cc1[nH]c2ccccc2c1C(=O)C(=O)NCCNc1ccccc1[N+](=O)[O-]	ZINC000032914263	506311191	/nfs/dbraw/zinc/31/11/91/506311191.db2.gz	MOTMWHTZOFTSNZ-UHFFFAOYSA-N	0	0	366.377	2.796	50	5		FFBARN
COC(=O)c1cc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2)cc([N+](=O)[O-])c1	ZINC000003513578	506338227	/nfs/dbraw/zinc/33/82/27/506338227.db2.gz	KOSNSGYJAWYSTE-NSHDSACASA-N	0	0	372.333	2.565	50	5		FFBARN
Cc1ccc(Cl)cc1NC(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000003602286	506345767	/nfs/dbraw/zinc/34/57/67/506345767.db2.gz	CZYFKRHTTDIPOD-UHFFFAOYSA-N	0	0	373.752	2.791	50	5		FFBARN
O=C(Cn1cnc2c3ccccc3oc2c1=O)Nc1cccc([N+](=O)[O-])c1	ZINC000004167549	506364688	/nfs/dbraw/zinc/36/46/88/506364688.db2.gz	AYPWEGJZXSDWJA-UHFFFAOYSA-N	0	0	364.317	2.690	50	5		FFBARN
C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccco1	ZINC000004219389	506366371	/nfs/dbraw/zinc/36/63/71/506366371.db2.gz	VLJVMVYVIJDSBT-NSHDSACASA-N	0	0	364.379	2.528	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCOCC2)cc1N1CCN(c2ccccc2)CC1	ZINC000004687444	506388718	/nfs/dbraw/zinc/38/87/18/506388718.db2.gz	PASCVGLRRTYFNK-UHFFFAOYSA-N	0	0	368.437	2.758	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)N1CCN(CCc2ccccc2)CC1	ZINC000004750538	506393812	/nfs/dbraw/zinc/39/38/12/506393812.db2.gz	XAASGHUVBZPOLC-UHFFFAOYSA-N	0	0	354.410	2.987	50	5		FFBARN
O=C(CSc1nnc(-c2cccnc2)o1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004903824	506404441	/nfs/dbraw/zinc/40/44/41/506404441.db2.gz	ZVFFZEBWKOOBPQ-UHFFFAOYSA-N	0	0	357.351	2.771	50	5		FFBARN
CCOC(=O)CNc1cc(NCc2ccccc2)c([N+](=O)[O-])c2nonc21	ZINC000004898447	506404451	/nfs/dbraw/zinc/40/44/51/506404451.db2.gz	LPKBSQVQUDXAJP-UHFFFAOYSA-N	0	0	371.353	2.718	50	5		FFBARN
COC(=O)c1ccc(Cn2nc([N+](=O)[O-])c(Br)c2C)cc1	ZINC000004898308	506404509	/nfs/dbraw/zinc/40/45/09/506404509.db2.gz	FSOUCXGUESSIQR-UHFFFAOYSA-N	0	0	354.160	2.697	50	5		FFBARN
O=C(c1c(F)cccc1F)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000004959758	506409050	/nfs/dbraw/zinc/40/90/50/506409050.db2.gz	DGGGZADENCYBGS-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
O=C(CSc1ncn(-c2ccccc2)n1)Nc1ccc([N+](=O)[O-])cc1	ZINC000005014264	506413654	/nfs/dbraw/zinc/41/36/54/506413654.db2.gz	WQTQORXDFXNORH-UHFFFAOYSA-N	0	0	355.379	2.906	50	5		FFBARN
COc1ccccc1N1C[C@H](C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1=O	ZINC000005028132	506416218	/nfs/dbraw/zinc/41/62/18/506416218.db2.gz	ZOPLBMJPCANAIR-GFCCVEGCSA-N	0	0	355.350	2.595	50	5		FFBARN
O=c1ccc(-c2ccc3c(c2)OCO3)nn1Cc1cccc([N+](=O)[O-])c1	ZINC000005398589	506439207	/nfs/dbraw/zinc/43/92/07/506439207.db2.gz	HZJKTOQJZFCMKO-UHFFFAOYSA-N	0	0	351.318	2.596	50	5		FFBARN
CC(=O)N(C)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005498694	506446488	/nfs/dbraw/zinc/44/64/88/506446488.db2.gz	MSBSMIAOPUQONX-UHFFFAOYSA-N	0	0	372.406	2.704	50	5		FFBARN
NC(=O)c1ccsc1NC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000005893781	506460523	/nfs/dbraw/zinc/46/05/23/506460523.db2.gz	DCCVTGPGXADQAC-UHFFFAOYSA-N	0	0	374.422	2.998	50	5		FFBARN
O=[N+]([O-])c1ccccc1OCc1ccc(S(=O)(=O)N2CCCC2)o1	ZINC000040114169	506468059	/nfs/dbraw/zinc/46/80/59/506468059.db2.gz	ISXUWJSZSIMQRI-UHFFFAOYSA-N	0	0	352.368	2.551	50	5		FFBARN
O=C(COC(=O)Cc1c[nH]c2ccccc12)Nc1cc([N+](=O)[O-])ccc1F	ZINC000006384252	506480782	/nfs/dbraw/zinc/48/07/82/506480782.db2.gz	PFBVUWSMEOCBTL-UHFFFAOYSA-N	0	0	371.324	2.940	50	5		FFBARN
CCOC(=O)c1ccc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000006848274	506511724	/nfs/dbraw/zinc/51/17/24/506511724.db2.gz	AQQAOTGMHKWVPT-UHFFFAOYSA-N	0	0	351.336	2.539	50	5		FFBARN
O=C(Nc1cnn(Cc2ccccc2F)c1)c1[nH]nc([N+](=O)[O-])c1Cl	ZINC000007077752	506532834	/nfs/dbraw/zinc/53/28/34/506532834.db2.gz	YHPLIJDSUIBLAF-UHFFFAOYSA-N	0	0	364.724	2.608	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(C(=O)c2ccco2)CC1	ZINC000008246465	506634738	/nfs/dbraw/zinc/63/47/38/506634738.db2.gz	WNNNDEDLUKGYBX-UHFFFAOYSA-N	0	0	373.365	2.687	50	5		FFBARN
COC(=O)[C@@H]1CCc2nc3scc(-c4ccc([N+](=O)[O-])cc4)c3c(=O)n21	ZINC000008382577	506648285	/nfs/dbraw/zinc/64/82/85/506648285.db2.gz	AOJQFQYHAJXBSG-LBPRGKRZSA-N	0	0	371.374	2.694	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)c1nc[nH]c1C(=O)NC1CCCCC1	ZINC000008683310	506662746	/nfs/dbraw/zinc/66/27/46/506662746.db2.gz	ZEOLQVBAXYCROP-UHFFFAOYSA-N	0	0	357.370	2.633	50	5		FFBARN
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1ccc(Cl)cc1	ZINC000008855860	506670880	/nfs/dbraw/zinc/67/08/80/506670880.db2.gz	YQLBYXPTWLISBP-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
CCCOc1ccccc1NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000008884177	506672565	/nfs/dbraw/zinc/67/25/65/506672565.db2.gz	AMIDQLHHEVQCHE-UHFFFAOYSA-N	0	0	371.349	2.930	50	5		FFBARN
COC(=O)c1ccc(O[C@@H](C)c2nc3ccccc3c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000009596668	506705880	/nfs/dbraw/zinc/70/58/80/506705880.db2.gz	HNHKLWBMTGXYRM-JTQLQIEISA-N	0	0	369.333	2.758	50	5		FFBARN
O=[N+]([O-])c1cc(-c2noc(-c3ccccn3)n2)ccc1N1CCOCC1	ZINC000009669048	506707349	/nfs/dbraw/zinc/70/73/49/506707349.db2.gz	IRLHZCVWRRERHI-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
O=C(COCc1ccccc1Cl)NCCNc1ccccc1[N+](=O)[O-]	ZINC000044354443	506839146	/nfs/dbraw/zinc/83/91/46/506839146.db2.gz	RTBUNPLJJWRJRT-UHFFFAOYSA-N	0	0	363.801	2.993	50	5		FFBARN
CC(=O)c1ccc(NCc2ccc(N3CCOCC3)nc2)c([N+](=O)[O-])c1	ZINC000012823354	506908022	/nfs/dbraw/zinc/90/80/22/506908022.db2.gz	KGCRODSOXGYLJQ-UHFFFAOYSA-N	0	0	356.382	2.641	50	5		FFBARN
Cc1ccc(S(=O)(=O)c2ccc(Cn3nccc3[N+](=O)[O-])cc2)cc1	ZINC000047169529	507275729	/nfs/dbraw/zinc/27/57/29/507275729.db2.gz	BTAIGIZOSFDMEH-UHFFFAOYSA-N	0	0	357.391	2.981	50	5		FFBARN
Cc1cc(C)cc(OCCNS(=O)(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000023143526	507333603	/nfs/dbraw/zinc/33/36/03/507333603.db2.gz	KVKYEKWKYRPBPT-UHFFFAOYSA-N	0	0	350.396	2.569	50	5		FFBARN
CCc1cc2c(ncnc2N[C@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000024060902	507390079	/nfs/dbraw/zinc/39/00/79/507390079.db2.gz	AQQIGBDKEACOEU-HUUCEWRRSA-N	0	0	374.422	2.668	50	5		FFBARN
Cc1cc(C)n(CCCNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)n1	ZINC000024177883	507397079	/nfs/dbraw/zinc/39/70/79/507397079.db2.gz	NYRYUYSSRXSTPU-UHFFFAOYSA-N	0	0	371.441	2.828	50	5		FFBARN
CNc1ccc(C(=O)NC[C@@H](c2ccccc2OC)N(C)C)cc1[N+](=O)[O-]	ZINC000027569366	507666033	/nfs/dbraw/zinc/66/60/33/507666033.db2.gz	SCFUPTXDYUCQLL-KRWDZBQOSA-N	0	0	372.425	2.678	50	5		FFBARN
COC(=O)[C@@H](C)[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000072310573	507775014	/nfs/dbraw/zinc/77/50/14/507775014.db2.gz	HVJBRRRDWRNNBG-SCLBCKFNSA-N	0	0	372.377	2.640	50	5		FFBARN
COc1ccc(CCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000031213607	507818211	/nfs/dbraw/zinc/81/82/11/507818211.db2.gz	GJNBHNQJKCVQFJ-UHFFFAOYSA-N	0	0	366.377	2.762	50	5		FFBARN
O=C(NC[C@H]1Cc2ccccc2O1)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000031370780	507819247	/nfs/dbraw/zinc/81/92/47/507819247.db2.gz	HCERQWIODRUQJD-MRXNPFEDSA-N	0	0	364.361	2.514	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)Cn1cccc(C(F)(F)F)c1=O	ZINC000031813401	507821878	/nfs/dbraw/zinc/82/18/78/507821878.db2.gz	MWUDZPHEBLQHMF-UHFFFAOYSA-N	0	0	355.272	2.722	50	5		FFBARN
CSc1nnnn1-c1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1	ZINC000031915599	507822342	/nfs/dbraw/zinc/82/23/42/507822342.db2.gz	BFLXKDHHQOPUAT-UHFFFAOYSA-N	0	0	370.394	2.853	50	5		FFBARN
Cn1cc(CCOC(=O)c2csc(-c3cccc([N+](=O)[O-])c3)n2)cn1	ZINC000095959793	508200196	/nfs/dbraw/zinc/20/01/96/508200196.db2.gz	MIZQJLWYTIMGIJ-UHFFFAOYSA-N	0	0	358.379	2.851	50	5		FFBARN
O=C(NC[C@H]1COC2(CCCCC2)O1)c1cc(F)c([N+](=O)[O-])cc1F	ZINC000123670181	508722914	/nfs/dbraw/zinc/72/29/14/508722914.db2.gz	ZDOSBBAKFWMOKU-JTQLQIEISA-N	0	0	356.325	2.679	50	5		FFBARN
C[C@@H]1CN(C[C@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000229657174	509427276	/nfs/dbraw/zinc/42/72/76/509427276.db2.gz	HPGJFSQSGOEBLG-CKEIUWERSA-N	0	0	362.430	2.700	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(N2C[C@@H]3OCCN(Cc4ccccc4)[C@H]3C2)c1	ZINC000252584436	509853538	/nfs/dbraw/zinc/85/35/38/509853538.db2.gz	AKLMTCGIMJQNNS-PMACEKPBSA-N	0	0	369.421	2.693	50	5		FFBARN
Cn1c(=N)n(CC(=O)c2cccc([N+](=O)[O-])c2)cc1-c1ccc(F)cc1	ZINC000334157573	527019913	/nfs/dbraw/zinc/01/99/13/527019913.db2.gz	NHBUCKKXJSRMRD-UHFFFAOYSA-N	0	0	354.341	2.903	50	5		FFBARN
CC(C)NC(=O)COC(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1	ZINC000004835432	535271472	/nfs/dbraw/zinc/27/14/72/535271472.db2.gz	FOYMOMQGZLSIAJ-UHFFFAOYSA-N	0	0	363.414	2.513	50	5		FFBARN
O=C(CSc1ccc(C(F)(F)F)cc1[N+](=O)[O-])N1CCOCC1	ZINC000001151320	219381465	/nfs/dbraw/zinc/38/14/65/219381465.db2.gz	BBQPVCOPUSTFPN-UHFFFAOYSA-N	0	0	350.318	2.565	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(Br)cn1	ZINC000001208113	219389668	/nfs/dbraw/zinc/38/96/68/219389668.db2.gz	XCLUGVBCJSCRNT-UHFFFAOYSA-N	0	0	352.144	2.770	50	5		FFBARN
CC(=O)Nc1ccc2c(COC(=O)c3ccc([N+](=O)[O-])o3)cc(=O)oc2c1	ZINC000003348041	219502812	/nfs/dbraw/zinc/50/28/12/219502812.db2.gz	MATOTIRIBWBBIW-UHFFFAOYSA-N	0	0	372.289	2.610	50	5		FFBARN
C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2Cl)C1	ZINC000003314672	219498797	/nfs/dbraw/zinc/49/87/97/219498797.db2.gz	PQMSJLGHMCHRNX-QWRGUYRKSA-N	0	0	354.790	2.910	50	5		FFBARN
COc1cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2)c([N+](=O)[O-])cc1OC	ZINC000003498246	219514436	/nfs/dbraw/zinc/51/44/36/219514436.db2.gz	KTXOOBZEARTEPT-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
CNC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)C12CC3CC(CC(C3)C1)C2	ZINC000004006632	219533013	/nfs/dbraw/zinc/53/30/13/219533013.db2.gz	PRLQWEKGEUKOAE-ANCGMVAHSA-N	0	0	371.437	2.656	50	5		FFBARN
O=C(Nc1cc2c(cc1[N+](=O)[O-])OCO2)c1cc2ccccc2oc1=O	ZINC000004810737	219608748	/nfs/dbraw/zinc/60/87/48/219608748.db2.gz	AHNBCWQGYNNGIR-UHFFFAOYSA-N	0	0	354.274	2.682	50	5		FFBARN
COc1ccc(CN(C2CC2)S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000008058112	219843322	/nfs/dbraw/zinc/84/33/22/219843322.db2.gz	MHNCJCADQXPIGX-UHFFFAOYSA-N	0	0	362.407	2.957	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)NCc3ccco3)cc2)c(C)c1[N+](=O)[O-]	ZINC000007910700	219834134	/nfs/dbraw/zinc/83/41/34/219834134.db2.gz	GVXOZNJXMCPIRX-UHFFFAOYSA-N	0	0	354.366	2.979	50	5		FFBARN
Cc1cc(OCC(=O)Nc2cccc(C(=O)NC3CC3)c2)ccc1[N+](=O)[O-]	ZINC000009335577	219878142	/nfs/dbraw/zinc/87/81/42/219878142.db2.gz	AEZXRHJQZRCUOT-UHFFFAOYSA-N	0	0	369.377	2.813	50	5		FFBARN
O=C(CNc1ccccc1N1CCCC1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000012517016	220001795	/nfs/dbraw/zinc/00/17/95/220001795.db2.gz	MXTINLUKUGDQCG-UHFFFAOYSA-N	0	0	354.366	2.772	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1ccc(OC(F)(F)F)cc1	ZINC000012533277	220004011	/nfs/dbraw/zinc/00/40/11/220004011.db2.gz	SADXVZXXKHMBCI-UHFFFAOYSA-N	0	0	357.244	2.906	50	5		FFBARN
O=[N+]([O-])c1cc(CN2CCN(c3ccccc3F)CC2)c2c(c1)COCO2	ZINC000012562890	220007918	/nfs/dbraw/zinc/00/79/18/220007918.db2.gz	CPZWGLXFLLNXEU-UHFFFAOYSA-N	0	0	373.384	2.923	50	5		FFBARN
C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)c1ccc(F)c(F)c1	ZINC000016207995	220180367	/nfs/dbraw/zinc/18/03/67/220180367.db2.gz	OVRGVNXYFHJPKW-QMMMGPOBSA-N	0	0	350.277	2.883	50	5		FFBARN
O=C(NCCc1ccc2c(c1)OCCO2)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000018073359	220223887	/nfs/dbraw/zinc/22/38/87/220223887.db2.gz	DRXJSFVXLCBKPY-UHFFFAOYSA-N	0	0	362.769	2.992	50	5		FFBARN
O=[N+]([O-])c1c[nH]nc1N1CCN(Cc2ccc(Cl)cc2Cl)CC1	ZINC000022276615	220380948	/nfs/dbraw/zinc/38/09/48/220380948.db2.gz	QWISKQREOXGHHP-UHFFFAOYSA-N	0	0	356.213	2.947	50	5		FFBARN
CC(C)(C)NS(=O)(=O)c1cccc(Nc2ccc([N+](=O)[O-])cn2)c1	ZINC000032899406	220692841	/nfs/dbraw/zinc/69/28/41/220692841.db2.gz	XGFWBEOBMFZTJD-UHFFFAOYSA-N	0	0	350.400	2.810	50	5		FFBARN
Cc1c(CN2C(=O)N[C@]3(CCOc4ccccc43)C2=O)cccc1[N+](=O)[O-]	ZINC000040116445	220883382	/nfs/dbraw/zinc/88/33/82/220883382.db2.gz	MEILLDTXXUMGHS-IBGZPJMESA-N	0	0	367.361	2.633	50	5		FFBARN
Cn1c(SCCOc2ccccc2[N+](=O)[O-])nnc1-c1cccnc1	ZINC000053427421	221046105	/nfs/dbraw/zinc/04/61/05/221046105.db2.gz	IPDNRGWVRAGWKA-UHFFFAOYSA-N	0	0	357.395	2.956	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CCN(C2CCCCCC2)CC1	ZINC000054992020	221056386	/nfs/dbraw/zinc/05/63/86/221056386.db2.gz	WGDVRUYLGHFKSJ-UHFFFAOYSA-N	0	0	367.471	2.624	50	5		FFBARN
Cc1cc(=O)oc2cc(NCc3ccc(C(N)=O)cc3[N+](=O)[O-])ccc12	ZINC000056163975	221077967	/nfs/dbraw/zinc/07/79/67/221077967.db2.gz	HWASUHGBKPNSEN-UHFFFAOYSA-N	0	0	353.334	2.721	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(N2CCC(C)=N2)cc1	ZINC000056220030	221079313	/nfs/dbraw/zinc/07/93/13/221079313.db2.gz	ZDKAOTHMYALWRZ-UHFFFAOYSA-N	0	0	357.370	2.543	50	5		FFBARN
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1N[C@H]1CCc2c1cccc2Cl	ZINC000057147352	221083665	/nfs/dbraw/zinc/08/36/65/221083665.db2.gz	AMAYJPCADBLCOU-ZDUSSCGKSA-N	0	0	367.814	2.995	50	5		FFBARN
CCc1cc(Nc2cnn(CCO)c2)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000057148983	221084100	/nfs/dbraw/zinc/08/41/00/221084100.db2.gz	FQZRDDQAQUPCPD-UHFFFAOYSA-N	0	0	354.370	2.547	50	5		FFBARN
COc1cc(CCNC(=O)[C@H](C)OCCC(C)C)c([N+](=O)[O-])cc1OC	ZINC000057993955	221096387	/nfs/dbraw/zinc/09/63/87/221096387.db2.gz	LMCPHAZWLLOKSM-ZDUSSCGKSA-N	0	0	368.430	2.722	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)NC1CCN(C(=O)C2CCCCC2)CC1	ZINC000058135661	221099752	/nfs/dbraw/zinc/09/97/52/221099752.db2.gz	FXZXWFOVEVYGIQ-UHFFFAOYSA-N	0	0	373.453	2.825	50	5		FFBARN
Cc1cccc(C(=O)NCc2ccccc2N2CCOCC2)c1[N+](=O)[O-]	ZINC000065533947	221232773	/nfs/dbraw/zinc/23/27/73/221232773.db2.gz	AMIBEXWLAGFXFZ-UHFFFAOYSA-N	0	0	355.394	2.670	50	5		FFBARN
CCOCCN1CCN(c2cc(OC)c([N+](=O)[O-])cc2F)C[C@@H]1CC	ZINC000089949234	132200925	/nfs/dbraw/zinc/20/09/25/132200925.db2.gz	RNSPHRXIZOVOLO-ZDUSSCGKSA-N	0	0	355.410	2.680	50	5		FFBARN
C[C@H]1CCN2c3ccc([N+](=O)[O-])cc3CC3(C(=O)OC(C)(C)OC3=O)[C@H]2C1	ZINC000245324822	132376511	/nfs/dbraw/zinc/37/65/11/132376511.db2.gz	ACHWJVLPCCQNFU-XHDPSFHLSA-N	0	0	374.393	2.578	50	5		FFBARN
O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCC[C@H](O)C1	ZINC000040071364	136119211	/nfs/dbraw/zinc/11/92/11/136119211.db2.gz	XDBKVWGNEBQJFJ-JTQLQIEISA-N	0	0	352.188	2.867	50	5		FFBARN
O=C(Cc1noc2ccccc21)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000048306326	136123294	/nfs/dbraw/zinc/12/32/94/136123294.db2.gz	XOHNNXSXOKLORR-UHFFFAOYSA-N	0	0	366.377	2.627	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3ccc4c(c3)OCCO4)CC2)cc1	ZINC000057354977	136128741	/nfs/dbraw/zinc/12/87/41/136128741.db2.gz	NPSSNMJCRITQNC-UHFFFAOYSA-N	0	0	355.394	2.688	50	5		FFBARN
O=[N+]([O-])c1cc(CN2CCN(c3ccccc3)CC2)c2c(c1)COCO2	ZINC000057438397	136129357	/nfs/dbraw/zinc/12/93/57/136129357.db2.gz	NTCMCPGOSKJUQF-UHFFFAOYSA-N	0	0	355.394	2.784	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000100001908	222231570	/nfs/dbraw/zinc/23/15/70/222231570.db2.gz	PVHUJELLJLJGLN-MRXNPFEDSA-N	0	0	360.366	2.566	50	5	world	FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000103608098	222339929	/nfs/dbraw/zinc/33/99/29/222339929.db2.gz	TXQJNUPPOMOQKK-UKRRQHHQSA-N	0	0	371.736	2.541	50	5		FFBARN
COc1cc(NC(=O)c2cc(OC)c(OC)c(OC)c2)cc([N+](=O)[O-])c1	ZINC000000676241	506228006	/nfs/dbraw/zinc/22/80/06/506228006.db2.gz	OICVUWVGICNGFJ-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
CCN(Cc1cccs1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1OC	ZINC000032415477	506251204	/nfs/dbraw/zinc/25/12/04/506251204.db2.gz	XPQCMYNQFKJEBZ-UHFFFAOYSA-N	0	0	356.425	2.876	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(Cc1ccco1)C1CC1	ZINC000032415991	506251516	/nfs/dbraw/zinc/25/15/16/506251516.db2.gz	HIZRFCGPXDCSQF-UHFFFAOYSA-N	0	0	352.368	2.550	50	5		FFBARN
COc1ccc(CCNC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000001174749	506254003	/nfs/dbraw/zinc/25/40/03/506254003.db2.gz	IXISDDICFMADHM-UXBLZVDNSA-N	0	0	356.378	2.984	50	5		FFBARN
Cc1ccc(N2C[C@@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000001220089	506256189	/nfs/dbraw/zinc/25/61/89/506256189.db2.gz	FRKXMKOEGOYXQT-HNNXBMFYSA-N	0	0	354.362	3.000	50	5		FFBARN
Cc1nn(CC(=O)NCc2cc(C)nc3ccccc23)c(C)c1[N+](=O)[O-]	ZINC000001423681	506262870	/nfs/dbraw/zinc/26/28/70/506262870.db2.gz	CNDCJFZFIJPIIM-UHFFFAOYSA-N	0	0	353.382	2.581	50	5		FFBARN
COC(=O)CCN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)c1ccccn1	ZINC000001802525	506267978	/nfs/dbraw/zinc/26/79/78/506267978.db2.gz	ZHKTUCMMYLVJAR-UHFFFAOYSA-N	0	0	363.757	2.853	50	5		FFBARN
O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)Nc1ccccc1Cl	ZINC000002622678	506284959	/nfs/dbraw/zinc/28/49/59/506284959.db2.gz	CGGURWZBYVBPJS-UHFFFAOYSA-N	0	0	358.741	2.597	50	5		FFBARN
Cc1nn(CC(=O)NCc2cccc(C(F)(F)F)c2)c(C)c1[N+](=O)[O-]	ZINC000002760217	506289268	/nfs/dbraw/zinc/28/92/68/506289268.db2.gz	DYUPVZRYCQXXEV-UHFFFAOYSA-N	0	0	356.304	2.743	50	5		FFBARN
CCc1c(C)sc2ncn3nc(CCn4nc([N+](=O)[O-])cc4C)nc3c12	ZINC000002809482	506297328	/nfs/dbraw/zinc/29/73/28/506297328.db2.gz	FYNGSADFMYMMRL-UHFFFAOYSA-N	0	0	371.426	2.866	50	5		FFBARN
COCCOCCCNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000032829152	506300317	/nfs/dbraw/zinc/30/03/17/506300317.db2.gz	YSYDJMUXTQCYHV-UHFFFAOYSA-N	0	0	367.280	2.987	50	5		FFBARN
Cc1ccc(N(C(=O)c2cccc([N+](=O)[O-])c2)[C@H]2C=CS(=O)(=O)C2)cc1	ZINC000003173597	506311828	/nfs/dbraw/zinc/31/18/28/506311828.db2.gz	NLYIDGYGOJUKMH-KRWDZBQOSA-N	0	0	372.402	2.861	50	5		FFBARN
COc1ccc(C=O)cc1CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000032919311	506313254	/nfs/dbraw/zinc/31/32/54/506313254.db2.gz	QOWWWBHGGSQJQJ-UHFFFAOYSA-N	0	0	355.394	2.738	50	5		FFBARN
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCC(=O)Nc1ccc2c(c1)OCO2	ZINC000003275700	506318837	/nfs/dbraw/zinc/31/88/37/506318837.db2.gz	QQSOIOXLTIDWMH-FPYGCLRLSA-N	0	0	370.317	2.519	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)c2[nH]c(C)c(C(C)=O)c2C)cc1[N+](=O)[O-]	ZINC000003391144	506327357	/nfs/dbraw/zinc/32/73/57/506327357.db2.gz	VQUWMVKBZOJYAH-UHFFFAOYSA-N	0	0	374.349	2.791	50	5		FFBARN
COc1ccccc1/C=C1\N=C(c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)OC1=O	ZINC000003657457	506349854	/nfs/dbraw/zinc/34/98/54/506349854.db2.gz	RGLHYWCEJKSGKZ-ZSOIEALJSA-N	0	0	369.289	2.856	50	5		FFBARN
Cc1ccccc1-n1ncc2c1ncn(Cc1ccc([N+](=O)[O-])cc1)c2=O	ZINC000004479057	506376195	/nfs/dbraw/zinc/37/61/95/506376195.db2.gz	RYDVCHLXIKWOEP-UHFFFAOYSA-N	0	0	361.361	2.847	50	5		FFBARN
O=C(NC(=S)N=c1[nH]c2ccccc2s1)c1ccccc1[N+](=O)[O-]	ZINC000004520463	506380983	/nfs/dbraw/zinc/38/09/83/506380983.db2.gz	IAZYYBCDMRWTDR-UHFFFAOYSA-N	0	0	358.404	2.753	50	5		FFBARN
O=C1CCCC(=O)N1c1ccc(NCCc2ccc(O)cc2)c([N+](=O)[O-])c1	ZINC000004684544	506388286	/nfs/dbraw/zinc/38/82/86/506388286.db2.gz	MYPPIYLJOFHHHE-UHFFFAOYSA-N	0	0	369.377	2.999	50	5		FFBARN
COc1ccc2c(c1OC)C(=O)O[C@@H]2Nc1ccc([N+](=O)[O-])cc1OC	ZINC000004794600	506395020	/nfs/dbraw/zinc/39/50/20/506395020.db2.gz	XWIVCJAERNSSLQ-INIZCTEOSA-N	0	0	360.322	2.902	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])C1	ZINC000004923127	506406720	/nfs/dbraw/zinc/40/67/20/506406720.db2.gz	ATULDVMPMCBUKH-PHIMTYICSA-N	0	0	351.794	2.550	50	5		FFBARN
CC1=C(C(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)NC(=O)N1	ZINC000006046886	506465220	/nfs/dbraw/zinc/46/52/20/506465220.db2.gz	NIZCLMPPFNTJLT-INIZCTEOSA-N	0	0	352.350	2.861	50	5		FFBARN
CN(C[C@H](O)COc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000040155565	506476125	/nfs/dbraw/zinc/47/61/25/506476125.db2.gz	CEMNVEGBAZLCHF-ZDUSSCGKSA-N	0	0	371.315	2.885	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)NCc1ccsc1-n1cccc1	ZINC000040155793	506476250	/nfs/dbraw/zinc/47/62/50/506476250.db2.gz	VEKJIMYDMUDDEL-UHFFFAOYSA-N	0	0	363.420	2.926	50	5		FFBARN
CON(C)C(=O)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1	ZINC000040566565	506484418	/nfs/dbraw/zinc/48/44/18/506484418.db2.gz	YLEOFNJZGIPYFE-SNVBAGLBSA-N	0	0	361.320	2.850	50	5		FFBARN
O=C(CCCN1C(=O)c2ccccc2C1=O)OCc1ccc([N+](=O)[O-])cc1	ZINC000006602768	506490912	/nfs/dbraw/zinc/49/09/12/506490912.db2.gz	RMYNLSJPVAVYAM-UHFFFAOYSA-N	0	0	368.345	2.714	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000007168676	506540217	/nfs/dbraw/zinc/54/02/17/506540217.db2.gz	QRDKQTJVNGWWIV-LBPRGKRZSA-N	0	0	355.350	2.738	50	5		FFBARN
Cc1cc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)c(C)n1C	ZINC000007782048	506588758	/nfs/dbraw/zinc/58/87/58/506588758.db2.gz	RFSNFFZDWSPENT-UHFFFAOYSA-N	0	0	359.382	2.656	50	5		FFBARN
C[C@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1	ZINC000008055581	506618011	/nfs/dbraw/zinc/61/80/11/506618011.db2.gz	XCCZXZNJVFGKTM-KBPBESRZSA-N	0	0	367.471	2.862	50	5		FFBARN
COc1cccc(N2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3)CC2=O)c1	ZINC000008247516	506635381	/nfs/dbraw/zinc/63/53/81/506635381.db2.gz	ROSYEPLEFSKFDZ-GFCCVEGCSA-N	0	0	355.350	2.595	50	5		FFBARN
COc1cccc([C@]2(C)NC(=O)N(Cc3ccc([N+](=O)[O-])cc3)C2=O)c1	ZINC000008327720	506643835	/nfs/dbraw/zinc/64/38/35/506643835.db2.gz	HTZJEDRWVAPXIP-SFHVURJKSA-N	0	0	355.350	2.571	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1c(C)oc(C)c1C	ZINC000008420001	506649742	/nfs/dbraw/zinc/64/97/42/506649742.db2.gz	REAKIHFKTZMHHY-UHFFFAOYSA-N	0	0	362.338	2.917	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3F)CC2=O)cc1	ZINC000008473891	506653018	/nfs/dbraw/zinc/65/30/18/506653018.db2.gz	JRTGVQWMQUNIMO-LLVKDONJSA-N	0	0	373.340	2.734	50	5		FFBARN
O=C(Cn1cnc2c3ccccc3oc2c1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000008520260	506657339	/nfs/dbraw/zinc/65/73/39/506657339.db2.gz	OYJKCDCMNYEXJW-UHFFFAOYSA-N	0	0	364.317	2.690	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)NCCc1ccc(OC(F)F)cc1	ZINC000008707242	506662717	/nfs/dbraw/zinc/66/27/17/506662717.db2.gz	SDNNSFRSSNUFDP-UHFFFAOYSA-N	0	0	366.320	2.934	50	5		FFBARN
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1CCN(Cc2ccsc2)CC1	ZINC000008750362	506665601	/nfs/dbraw/zinc/66/56/01/506665601.db2.gz	QERWAZKLACDXHA-CQSZACIVSA-N	0	0	374.466	2.801	50	5		FFBARN
CC(=O)c1oc2ccccc2c1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000008772583	506669111	/nfs/dbraw/zinc/66/91/11/506669111.db2.gz	QKTHQOCAJGYSKC-UHFFFAOYSA-N	0	0	356.338	2.996	50	5		FFBARN
CCN1C[C@H](CN(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)Oc2ccccc21	ZINC000009117715	506682870	/nfs/dbraw/zinc/68/28/70/506682870.db2.gz	ZDBRJUPIVAJRIY-AWEZNQCLSA-N	0	0	370.409	2.537	50	5		FFBARN
Cc1cc(C(=O)Nc2ccc(-c3ccc(=O)n(C)n3)cc2)ccc1[N+](=O)[O-]	ZINC000010325319	506737940	/nfs/dbraw/zinc/73/79/40/506737940.db2.gz	HPPCDRFKELGFEV-UHFFFAOYSA-N	0	0	364.361	2.916	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(Cc2ccncc2)cc1	ZINC000012446598	506866515	/nfs/dbraw/zinc/86/65/15/506866515.db2.gz	PSCGAQUMBYFDFM-UHFFFAOYSA-N	0	0	351.366	2.724	50	5		FFBARN
CNC(=O)/C(=C/C=C/c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000012561904	506879658	/nfs/dbraw/zinc/87/96/58/506879658.db2.gz	ABADOHGDUGWOCM-WIXUPIFPSA-N	0	0	351.362	2.668	50	5		FFBARN
O=[N+]([O-])c1ccc(-c2ncn(C[C@@H](O)COCc3ccccc3F)n2)cc1	ZINC000046060848	507071566	/nfs/dbraw/zinc/07/15/66/507071566.db2.gz	UPOBJOCLFMGDAQ-MRXNPFEDSA-N	0	0	372.356	2.570	50	5		FFBARN
Nc1c(C(=O)NCc2ccccc2N2CCCC2)cc(F)cc1[N+](=O)[O-]	ZINC000057250159	507217967	/nfs/dbraw/zinc/21/79/67/507217967.db2.gz	PGEOTCOGNIINOR-UHFFFAOYSA-N	0	0	358.373	2.846	50	5		FFBARN
C[NH+]1CCN(CCCn2c(=O)c3cc4ccccc4cc3[n-]c2=S)CC1	ZINC000020644356	507229241	/nfs/dbraw/zinc/22/92/41/507229241.db2.gz	MAGSNCZTIISPQJ-UHFFFAOYSA-N	0	0	368.506	2.850	50	5		FFBARN
COc1ccc(OC)c2c1CN(C(=O)Nc1cccc([N+](=O)[O-])c1)C[C@H]2O	ZINC000024238126	507399552	/nfs/dbraw/zinc/39/95/52/507399552.db2.gz	PAWQPWOLVNAACF-CQSZACIVSA-N	0	0	373.365	2.693	50	5		FFBARN
C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)[C@H]1CCc2ccccc21	ZINC000058412592	507415141	/nfs/dbraw/zinc/41/51/41/507415141.db2.gz	KAFWQVMBCYOQJE-UGSOOPFHSA-N	0	0	367.405	2.859	50	5		FFBARN
Cc1cc(=O)c(C(=O)N2C[C@H](C)C[C@H](C)C2)nn1-c1ccccc1[N+](=O)[O-]	ZINC000029514909	507780899	/nfs/dbraw/zinc/78/08/99/507780899.db2.gz	GTXPUCYVFUTJLM-BETUJISGSA-N	0	0	370.409	2.567	50	5		FFBARN
O=C(NCCc1ccccn1)c1ccc(Br)cc1[N+](=O)[O-]	ZINC000079024348	507926441	/nfs/dbraw/zinc/92/64/41/507926441.db2.gz	UCOMMYSRUKFJBZ-UHFFFAOYSA-N	0	0	350.172	2.725	50	5		FFBARN
O=C1CCc2cc([N+](=O)[O-])c(N[C@@H]3CCCN(CC(F)(F)F)C3)cc2N1	ZINC000253426855	509880485	/nfs/dbraw/zinc/88/04/85/509880485.db2.gz	BGIVMSSWMCVAHP-LLVKDONJSA-N	0	0	372.347	2.918	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(C(=O)OC(C)(C)C)C[C@H]1C	ZINC000109242226	570913452	/nfs/dbraw/zinc/91/34/52/570913452.db2.gz	UOMILWPERKGLJT-CYBMUJFWSA-N	0	0	363.414	2.985	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCO[C@]2(CCOC2)C1	ZINC000170591474	222595151	/nfs/dbraw/zinc/59/51/51/222595151.db2.gz	RAEGQMANDAUCEC-ZUZCIYMTSA-N	0	0	355.778	2.708	50	5		FFBARN
Cc1c(C(=O)N2NC(C3CC3)=C[C@]2(O)C(F)(F)F)cccc1[N+](=O)[O-]	ZINC000000651718	219309060	/nfs/dbraw/zinc/30/90/60/219309060.db2.gz	PMYPQFGNTMMJRH-AWEZNQCLSA-N	0	0	357.288	2.766	50	5		FFBARN
COc1cccc(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1OC	ZINC000000652165	219309270	/nfs/dbraw/zinc/30/92/70/219309270.db2.gz	VYAXFJDEBDZTHP-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)C[C@@H]2CCCO2)cc1	ZINC000000741531	219318612	/nfs/dbraw/zinc/31/86/12/219318612.db2.gz	QWMXGYWEVDLTOP-HNNXBMFYSA-N	0	0	366.395	2.558	50	5		FFBARN
COc1ccc(CNC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1	ZINC000000795254	219322486	/nfs/dbraw/zinc/32/24/86/219322486.db2.gz	CNCQPBABRGBRBR-UHFFFAOYSA-N	0	0	354.318	2.640	50	5		FFBARN
O=C(COC(=O)c1cc2ccccc2oc1=O)c1cccc([N+](=O)[O-])c1	ZINC000000823763	219326940	/nfs/dbraw/zinc/32/69/40/219326940.db2.gz	DHNJJMVWVXFVMJ-UHFFFAOYSA-N	0	0	353.286	2.741	50	5		FFBARN
O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NC[C@@H]1CCCO1	ZINC000000834567	219328517	/nfs/dbraw/zinc/32/85/17/219328517.db2.gz	DIQRRRASKWSQRT-JTQLQIEISA-N	0	0	353.425	2.592	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCCO2)c1cc2cc([N+](=O)[O-])ccc2oc1=O	ZINC000001056621	219360642	/nfs/dbraw/zinc/36/06/42/219360642.db2.gz	VXQGNROMUHKQCT-UHFFFAOYSA-N	0	0	368.301	2.725	50	5		FFBARN
COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c1cccc([N+](=O)[O-])c1	ZINC000002796736	219465758	/nfs/dbraw/zinc/46/57/58/219465758.db2.gz	YBODJWFXGHKIFT-UHFFFAOYSA-N	0	0	360.366	2.516	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000002994371	219481080	/nfs/dbraw/zinc/48/10/80/219481080.db2.gz	DIEKHGHAVYJGCT-UHFFFAOYSA-N	0	0	374.324	2.879	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)Nc1ccc(Cl)cn1	ZINC000003447114	219510584	/nfs/dbraw/zinc/51/05/84/219510584.db2.gz	XNFCJGALSAKTFI-QPJJXVBHSA-N	0	0	361.741	2.838	50	5		FFBARN
O=[N+]([O-])c1ccc(-c2nnc(CSc3nnc4ccccn43)o2)cc1	ZINC000003378899	219505831	/nfs/dbraw/zinc/50/58/31/219505831.db2.gz	RKBVKTPPSPOIDH-UHFFFAOYSA-N	0	0	354.351	2.980	50	5		FFBARN
COC(=O)c1cc(C(=O)N[C@@H]2CCOc3ccccc32)cc([N+](=O)[O-])c1	ZINC000007215172	219795756	/nfs/dbraw/zinc/79/57/56/219795756.db2.gz	KFTJXGCKTDVWDO-OAHLLOKOSA-N	0	0	356.334	2.635	50	5		FFBARN
COc1ccccc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nccn1C	ZINC000009319059	219877687	/nfs/dbraw/zinc/87/76/87/219877687.db2.gz	CZXDJCAODQHRPD-KRWDZBQOSA-N	0	0	366.377	2.856	50	5		FFBARN
CCOc1ncccc1C(=O)O[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000011480308	219920478	/nfs/dbraw/zinc/92/04/78/219920478.db2.gz	IGOJQYNQWNIGDR-LLVKDONJSA-N	0	0	359.338	2.573	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1C(=O)NC1CC1	ZINC000012543638	220004708	/nfs/dbraw/zinc/00/47/08/220004708.db2.gz	JUAVIEWVRNVFOK-UHFFFAOYSA-N	0	0	368.393	2.805	50	5		FFBARN
COC(=O)c1ccc(OCC(=O)Nc2cccc(C(C)=O)c2)c([N+](=O)[O-])c1	ZINC000012680375	220016299	/nfs/dbraw/zinc/01/62/99/220016299.db2.gz	KDECQTYMEMHKCZ-UHFFFAOYSA-N	0	0	372.333	2.602	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)COc3cccc([N+](=O)[O-])c3)ccc21	ZINC000012980708	220048813	/nfs/dbraw/zinc/04/88/13/220048813.db2.gz	MWDYLSFWPCYTBO-UHFFFAOYSA-N	0	0	355.350	2.521	50	5		FFBARN
COc1ccc(NC(=O)[C@H](c2ccc([N+](=O)[O-])cc2)N2CCOCC2)cc1	ZINC000019537566	220268715	/nfs/dbraw/zinc/26/87/15/220268715.db2.gz	WECIXYSOMPRLQC-SFHVURJKSA-N	0	0	371.393	2.615	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccccc1[N+](=O)[O-]	ZINC000022414485	220385744	/nfs/dbraw/zinc/38/57/44/220385744.db2.gz	VEMSFNOEZYETHS-LBPRGKRZSA-N	0	0	356.334	2.981	50	5		FFBARN
O=C(NC1CCN(C(=O)Nc2ccccc2)CC1)c1ccc([N+](=O)[O-])o1	ZINC000032904639	220694853	/nfs/dbraw/zinc/69/48/53/220694853.db2.gz	ALTYBSVODWZVEL-UHFFFAOYSA-N	0	0	358.354	2.614	50	5		FFBARN
C[C@H](NC(=O)NCCNC(=O)c1ccccc1F)c1cccc([N+](=O)[O-])c1	ZINC000050153784	221030315	/nfs/dbraw/zinc/03/03/15/221030315.db2.gz	NLSGHUUXVFTBMM-LBPRGKRZSA-N	0	0	374.372	2.524	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)Nc1ccc(F)c(F)c1F	ZINC000055554875	221071529	/nfs/dbraw/zinc/07/15/29/221071529.db2.gz	NQCKPWZJCWFOCG-UHFFFAOYSA-N	0	0	362.285	2.822	50	5		FFBARN
O=C(CCOc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccccc2)C1	ZINC000058166379	221101847	/nfs/dbraw/zinc/10/18/47/221101847.db2.gz	HNCPGRDITIUZBF-GOSISDBHSA-N	0	0	356.378	2.964	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1nc2ccccc2[nH]1	ZINC000058222760	221109205	/nfs/dbraw/zinc/10/92/05/221109205.db2.gz	UOMMPCKBCMCLBU-UHFFFAOYSA-N	0	0	353.382	2.809	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)C[C@H]1COc2ccccc2O1	ZINC000057451363	221089810	/nfs/dbraw/zinc/08/98/10/221089810.db2.gz	CJTPQHPCSHTCRL-AWEZNQCLSA-N	0	0	371.393	2.614	50	5		FFBARN
C[C@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1	ZINC000063229249	221142117	/nfs/dbraw/zinc/14/21/17/221142117.db2.gz	XZLZALHDVCQLTG-GUYCJALGSA-N	0	0	369.377	2.522	50	5		FFBARN
CC(C)NC(=O)C1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000065479839	221224671	/nfs/dbraw/zinc/22/46/71/221224671.db2.gz	AEAFXMZUVAIBJW-UHFFFAOYSA-N	0	0	353.806	2.625	50	5		FFBARN
O=C(N[C@H]1C[C@H]1c1ccccc1)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000067618749	221263909	/nfs/dbraw/zinc/26/39/09/221263909.db2.gz	RDYFCQLBHFAJIO-OALUTQOASA-N	0	0	366.421	2.983	50	5		FFBARN
CSCCCNC(=O)/N=c1\sc([N+](=O)[O-])cn1Cc1ccccc1	ZINC000071767359	221372708	/nfs/dbraw/zinc/37/27/08/221372708.db2.gz	JTBLPWFLXSMUBT-ICFOKQHNSA-N	0	0	366.468	2.870	50	5		FFBARN
Nc1nc(Sc2nnc(NC3CCCCC3)s2)ncc1[N+](=O)[O-]	ZINC000071794735	221376067	/nfs/dbraw/zinc/37/60/67/221376067.db2.gz	BLHLYQAGEQXJLD-UHFFFAOYSA-N	0	0	353.433	2.714	50	5		FFBARN
O=C(COc1ncnc2cc([N+](=O)[O-])ccc21)N1CCCc2ccccc21	ZINC000003443330	132385325	/nfs/dbraw/zinc/38/53/25/132385325.db2.gz	LSPLDTBSJLNJIS-UHFFFAOYSA-N	0	0	364.361	2.896	50	5		FFBARN
O=C(N1CCCCC1)N1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1	ZINC000024201423	132910969	/nfs/dbraw/zinc/91/09/69/132910969.db2.gz	PHUWUVHSWBQKOX-UHFFFAOYSA-N	0	0	369.425	2.871	50	5		FFBARN
O=C(OCCN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc(F)cc1	ZINC000052521492	136124376	/nfs/dbraw/zinc/12/43/76/136124376.db2.gz	SDCUMROJRGHTPN-UHFFFAOYSA-N	0	0	373.384	2.713	50	5		FFBARN
CCc1cc(N2CCC3(CC2)OCCO3)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000054389819	136125508	/nfs/dbraw/zinc/12/55/08/136125508.db2.gz	LBJVWWOBGCJIQQ-UHFFFAOYSA-N	0	0	370.409	2.958	50	5		FFBARN
Cc1c(NC(=O)CN2CCN(c3ccccc3F)CC2)cccc1[N+](=O)[O-]	ZINC000054530197	136125585	/nfs/dbraw/zinc/12/55/85/136125585.db2.gz	GZHXFVMERWQNAQ-UHFFFAOYSA-N	0	0	372.400	2.803	50	5		FFBARN
CCOC(=O)c1cc2c(nc3c(C)cccn3c2=O)n([C@@H](C)CC)c1=N	ZINC000100628088	222247862	/nfs/dbraw/zinc/24/78/62/222247862.db2.gz	ROFHMABAQPCCMX-LBPRGKRZSA-N	0	0	354.410	2.585	50	5		FFBARN
O=c1[nH]c(SCc2nc3cc([N+](=O)[O-])ccc3[nH]2)nc2ccccc21	ZINC000005642768	263342905	/nfs/dbraw/zinc/34/29/05/263342905.db2.gz	MWNLBRYOHIDQKH-UHFFFAOYSA-N	0	0	353.363	3.000	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccccc1Cl	ZINC000032401895	506248864	/nfs/dbraw/zinc/24/88/64/506248864.db2.gz	RTCZSTCVVLWJHA-UHFFFAOYSA-N	0	0	356.787	2.735	50	5		FFBARN
COc1ccc(CCNC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1OC	ZINC000002754836	506290009	/nfs/dbraw/zinc/29/00/09/506290009.db2.gz	SMGWVTCPLMXFBC-VQHVLOKHSA-N	0	0	356.378	2.984	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H](CN1CCOCC1)c1ccccc1	ZINC000032806091	506297496	/nfs/dbraw/zinc/29/74/96/506297496.db2.gz	VRUNKLDHQHJFSZ-GOSISDBHSA-N	0	0	370.409	2.790	50	5		FFBARN
Cc1ccc(OCCOCCn2cnc3ccccc3c2=O)c([N+](=O)[O-])c1	ZINC000003003359	506305781	/nfs/dbraw/zinc/30/57/81/506305781.db2.gz	UASAZQHVKXFLPD-UHFFFAOYSA-N	0	0	369.377	2.709	50	5		FFBARN
CCOC(=O)CSc1ccc(C(=O)NCc2ccco2)cc1[N+](=O)[O-]	ZINC000003020323	506307330	/nfs/dbraw/zinc/30/73/30/506307330.db2.gz	FYILVRIRQLUWDG-UHFFFAOYSA-N	0	0	364.379	2.773	50	5		FFBARN
Cc1ccc(NC(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)cc1Cl	ZINC000003260792	506317253	/nfs/dbraw/zinc/31/72/53/506317253.db2.gz	HPLMBMNIXIVQKV-UHFFFAOYSA-N	0	0	372.768	2.905	50	5		FFBARN
CC(=O)NCCNC(=O)c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1	ZINC000003334553	506322286	/nfs/dbraw/zinc/32/22/86/506322286.db2.gz	DCWQHDIRFQYHJF-UHFFFAOYSA-N	0	0	359.407	2.612	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1cccc(Cl)c1	ZINC000003333146	506322575	/nfs/dbraw/zinc/32/25/75/506322575.db2.gz	GOOSTJNAKXTUBZ-UHFFFAOYSA-N	0	0	361.785	2.685	50	5		FFBARN
Cc1cc(C)c(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1C	ZINC000003587856	506344973	/nfs/dbraw/zinc/34/49/73/506344973.db2.gz	KQFXLMNBOGHTLY-UHFFFAOYSA-N	0	0	352.346	2.999	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)N1C(=O)c2ccccc2C1=O	ZINC000004043754	506355605	/nfs/dbraw/zinc/35/56/05/506355605.db2.gz	BGHLTIAWFVXZAD-LLVKDONJSA-N	0	0	353.334	2.526	50	5		FFBARN
O=C(COC(=O)CSc1ccc([N+](=O)[O-])cc1)NCc1cccs1	ZINC000004219353	506366270	/nfs/dbraw/zinc/36/62/70/506366270.db2.gz	INESHGVLXJNCAE-UHFFFAOYSA-N	0	0	366.420	2.608	50	5		FFBARN
COC(=O)[C@H]1Cc2c3ccccc3[nH]c2[C@H](c2ccc([N+](=O)[O-])cc2)N1	ZINC000034792222	506370397	/nfs/dbraw/zinc/37/03/97/506370397.db2.gz	PMTFLAWFQMHLPS-SJORKVTESA-N	0	0	351.362	2.853	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCC2)ccc1OCc1ccccc1	ZINC000004415715	506375958	/nfs/dbraw/zinc/37/59/58/506375958.db2.gz	HVEJOOPQJDIOPD-UHFFFAOYSA-N	0	0	362.407	2.958	50	5		FFBARN
COc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)cc1	ZINC000004456028	506376710	/nfs/dbraw/zinc/37/67/10/506376710.db2.gz	HXTDJPNCFDXLHH-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
O=C(N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1[N+](=O)[O-]	ZINC000004497483	506379443	/nfs/dbraw/zinc/37/94/43/506379443.db2.gz	KVKSDHBZIIWYRI-GFCCVEGCSA-N	0	0	359.769	2.784	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000004560411	506382127	/nfs/dbraw/zinc/38/21/27/506382127.db2.gz	PWCSMWIAZRGQSA-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
COc1cccc(C2=NC(=CNc3ccc(OC)cc3[N+](=O)[O-])C(=O)O2)c1	ZINC000004590579	506384692	/nfs/dbraw/zinc/38/46/92/506384692.db2.gz	OLJNTUNDKQDKOP-GDNBJRDFSA-N	0	0	369.333	2.869	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000004688233	506388868	/nfs/dbraw/zinc/38/88/68/506388868.db2.gz	MWXHXBIOHDDKBJ-UHFFFAOYSA-N	0	0	358.373	2.738	50	5		FFBARN
COc1ccc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c(OC)c1	ZINC000004777655	506393742	/nfs/dbraw/zinc/39/37/42/506393742.db2.gz	ZIIRSDSRNJEPIV-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@@H](C)Oc2ccc(C)nc2[N+](=O)[O-])cc1	ZINC000004891462	506402759	/nfs/dbraw/zinc/40/27/59/506402759.db2.gz	KOLWWWLZFVVBFF-LLVKDONJSA-N	0	0	358.354	2.663	50	5		FFBARN
Cc1ccc(CNc2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])cc1	ZINC000004922585	506406305	/nfs/dbraw/zinc/40/63/05/506406305.db2.gz	JZZUOFLDLMKCCM-UHFFFAOYSA-N	0	0	359.773	2.988	50	5		FFBARN
Cn1c2ccccc2c(NCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1=O	ZINC000005518848	506447904	/nfs/dbraw/zinc/44/79/04/506447904.db2.gz	WYUVXPGAFGFLFE-UHFFFAOYSA-N	0	0	353.334	2.788	50	5		FFBARN
Cc1ccc(NC(=O)[C@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000040089920	506466756	/nfs/dbraw/zinc/46/67/56/506466756.db2.gz	GTGXXRZQOKUBBH-AWEZNQCLSA-N	0	0	360.414	2.770	50	5		FFBARN
C[C@@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000006506390	506486609	/nfs/dbraw/zinc/48/66/09/506486609.db2.gz	FMJLYJXTKVPOKV-SNVBAGLBSA-N	0	0	354.322	2.655	50	5		FFBARN
O=C(Cn1cnc2ccc([N+](=O)[O-])cc2c1=O)Nc1cccc(Cl)c1	ZINC000006550420	506487660	/nfs/dbraw/zinc/48/76/60/506487660.db2.gz	FACZGOWFXHQVLR-UHFFFAOYSA-N	0	0	358.741	2.597	50	5		FFBARN
COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000006552960	506487889	/nfs/dbraw/zinc/48/78/89/506487889.db2.gz	FUNCCNPAHYUWFW-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
COc1ccc(CC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000006581916	506488446	/nfs/dbraw/zinc/48/84/46/506488446.db2.gz	GNVSVPIPRRIORM-UHFFFAOYSA-N	0	0	359.334	2.756	50	5		FFBARN
COC(=O)c1ccc(NC(=O)/C=C/c2cc3c(cc2[N+](=O)[O-])OCO3)cc1	ZINC000007063297	506530364	/nfs/dbraw/zinc/53/03/64/506530364.db2.gz	XUQRKBXSIMUEGW-QPJJXVBHSA-N	0	0	370.317	2.762	50	5		FFBARN
CC(C)(C)NS(=O)(=O)c1cccc(Nc2ncccc2[N+](=O)[O-])c1	ZINC000007187268	506541762	/nfs/dbraw/zinc/54/17/62/506541762.db2.gz	OUDLORSGPQZHMP-UHFFFAOYSA-N	0	0	350.400	2.810	50	5		FFBARN
Cc1cc(C)n(-c2nc(C)cc(NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)n2)n1	ZINC000007596884	506572823	/nfs/dbraw/zinc/57/28/23/506572823.db2.gz	OVYNNACINRERGO-MRXNPFEDSA-N	0	0	368.397	2.641	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1c(C)oc(C)c1C	ZINC000008419943	506649421	/nfs/dbraw/zinc/64/94/21/506649421.db2.gz	UMTUIONLADMUGI-UHFFFAOYSA-N	0	0	362.338	2.917	50	5		FFBARN
Cc1cc(-n2c(C)cc(C(=O)Cn3nc(C)c([N+](=O)[O-])c3C)c2C)no1	ZINC000008429816	506650424	/nfs/dbraw/zinc/65/04/24/506650424.db2.gz	HNYCJHOMZFMZBN-UHFFFAOYSA-N	0	0	357.370	2.995	50	5		FFBARN
C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(C)CC1	ZINC000009352473	506692779	/nfs/dbraw/zinc/69/27/79/506692779.db2.gz	AXLBDAUGIXOSCB-CYBMUJFWSA-N	0	0	366.439	2.877	50	5		FFBARN
Cc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)O[C@@H](C)C3)n2)c1	ZINC000009411312	506695584	/nfs/dbraw/zinc/69/55/84/506695584.db2.gz	RXYPIRVTRFPUBB-RYUDHWBXSA-N	0	0	358.402	2.633	50	5		FFBARN
COCCCNC(=O)c1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000009425996	506695749	/nfs/dbraw/zinc/69/57/49/506695749.db2.gz	OUVVTQMDSOHEQS-UHFFFAOYSA-N	0	0	357.366	2.613	50	5		FFBARN
Cc1ccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c(O)c1	ZINC000009616440	506705566	/nfs/dbraw/zinc/70/55/66/506705566.db2.gz	LYKNOFRZQIKETQ-UHFFFAOYSA-N	0	0	357.366	2.698	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H](c1ccsc1)N(C)C	ZINC000046033664	507066124	/nfs/dbraw/zinc/06/61/24/507066124.db2.gz	NGXVFBIZRNBEIY-AWEZNQCLSA-N	0	0	369.468	2.546	50	5		FFBARN
O=C(c1nc2ccc([N+](=O)[O-])cc2[nH]c1=O)[C@H](O)c1ccc(Cl)cc1	ZINC000019799229	507201568	/nfs/dbraw/zinc/20/15/68/507201568.db2.gz	PLICCEFFPLGHFD-CQSZACIVSA-N	0	0	359.725	2.813	50	5		FFBARN
C[C@@H]1CCC[C@@H](C)N1C(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000024796401	507439457	/nfs/dbraw/zinc/43/94/57/507439457.db2.gz	ZIKRIZPVJWAUGF-HZPDHXFCSA-N	0	0	360.458	2.506	50	5		FFBARN
COC(=O)C1=C(C)Nc2[nH]c(=S)[nH]c(=O)c2[C@H]1c1ccccc1[N+](=O)[O-]	ZINC000028294254	507719216	/nfs/dbraw/zinc/71/92/16/507719216.db2.gz	QWOMQZZKLYJBKI-NSHDSACASA-N	0	0	374.378	2.757	50	5		FFBARN
COCCOCCN(Cc1ccccc1)c1nc2ccccn2c1[N+](=O)[O-]	ZINC000079096288	507932557	/nfs/dbraw/zinc/93/25/57/507932557.db2.gz	ZMUWZYGPQAMNPG-UHFFFAOYSA-N	0	0	370.409	2.912	50	5		FFBARN
CCOC(=O)[C@]1(Cc2ccccc2[N+](=O)[O-])c2ccccc2N(C)C1=O	ZINC000075283751	508094008	/nfs/dbraw/zinc/09/40/08/508094008.db2.gz	KBMZCFGSMYJNBT-LJQANCHMSA-N	0	0	354.362	2.615	50	5		FFBARN
COc1cc(C(=O)NCc2ncc(C(C)(C)C)o2)c([N+](=O)[O-])cc1OC	ZINC000076093697	508157838	/nfs/dbraw/zinc/15/78/38/508157838.db2.gz	ICSWYVOCWRSZJI-UHFFFAOYSA-N	0	0	363.370	2.828	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@H]2CCOc3ccccc32)cc1F	ZINC000095978664	508200209	/nfs/dbraw/zinc/20/02/09/508200209.db2.gz	KHUCZWVKZXSASB-ZDUSSCGKSA-N	0	0	352.343	2.536	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1[N+](=O)[O-]	ZINC000005060289	518189540	/nfs/dbraw/zinc/18/95/40/518189540.db2.gz	HBLRDOMSDDOWNA-UHFFFAOYSA-N	0	0	370.814	2.914	50	5		FFBARN
C[C@H]1CCCN(C(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000019829790	526265023	/nfs/dbraw/zinc/26/50/23/526265023.db2.gz	GCUKHTDZLPLLRI-NSHDSACASA-N	0	0	362.411	2.995	50	5		FFBARN
O=c1c2cc(Br)ccc2oc2nc3n(c(=O)c12)CCCS3	ZINC000000588696	219305108	/nfs/dbraw/zinc/30/51/08/219305108.db2.gz	BZTSSXCAQQGXDN-UHFFFAOYSA-N	0	0	365.208	2.761	50	5		FFBARN
COC(=O)CNC(=O)c1ccc([N+](=O)[O-])cc1SCc1ccccc1	ZINC000001068813	219363384	/nfs/dbraw/zinc/36/33/84/219363384.db2.gz	ZIJUNERBPHTSFF-UHFFFAOYSA-N	0	0	360.391	2.790	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(C(=O)c2cccc(Cl)c2)CC1	ZINC000001200165	219388892	/nfs/dbraw/zinc/38/88/92/219388892.db2.gz	AEOUTNUSLTVHQN-UHFFFAOYSA-N	0	0	373.796	2.846	50	5		FFBARN
CCSc1ncccc1C(=O)NOc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000003118388	219487779	/nfs/dbraw/zinc/48/77/79/219487779.db2.gz	NFPDDDFEXNDMKE-UHFFFAOYSA-N	0	0	364.339	2.734	50	5		FFBARN
CCOc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NC[C@@H]3CCCO3)n2)cc1	ZINC000005156254	219657236	/nfs/dbraw/zinc/65/72/36/219657236.db2.gz	JDDJTSKADSLOJO-ZDUSSCGKSA-N	0	0	374.401	2.700	50	5		FFBARN
Cn1ccnc1Sc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000008130738	219847846	/nfs/dbraw/zinc/84/78/46/219847846.db2.gz	JLPRWVXPUYJGSX-UHFFFAOYSA-N	0	0	367.330	2.773	50	5		FFBARN
COC(=O)c1ccc(Oc2c([N+](=O)[O-])ncn2C)c(Br)c1	ZINC000012544275	220005751	/nfs/dbraw/zinc/00/57/51/220005751.db2.gz	UJOMEOSRJNUSQZ-UHFFFAOYSA-N	0	0	356.132	2.670	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCN1C(=O)[C@@H]2CC=CC[C@@H]2C1=O	ZINC000018227911	220229763	/nfs/dbraw/zinc/22/97/63/220229763.db2.gz	VDQCPZZGQXMZHZ-GASCZTMLSA-N	0	0	371.393	2.573	50	5		FFBARN
COc1c(Cl)c(Cl)ccc1S(=O)(=O)n1c(C)ncc1[N+](=O)[O-]	ZINC000019943351	220305854	/nfs/dbraw/zinc/30/58/54/220305854.db2.gz	KYAAWTGNEWXURN-UHFFFAOYSA-N	0	0	366.182	2.652	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@H](c2ccccc2[N+](=O)[O-])NC3=O)c1	ZINC000020213032	220318494	/nfs/dbraw/zinc/31/84/94/220318494.db2.gz	VNVXJEJTZLNZSL-INIZCTEOSA-N	0	0	350.334	2.826	50	5		FFBARN
O=[N+]([O-])c1cc(I)ccc1I	ZINC000021990584	220372156	/nfs/dbraw/zinc/37/21/56/220372156.db2.gz	WNAMUUCHNYHBEV-UHFFFAOYSA-N	0	0	374.903	2.804	50	5		FFBARN
CC(C)(C)OC(=O)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000022416207	220385990	/nfs/dbraw/zinc/38/59/90/220385990.db2.gz	TUYKLKQDGWYLOO-UHFFFAOYSA-N	0	0	369.805	2.941	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H](c2ccccc2)N2CCOCC2)c([N+](=O)[O-])c1	ZINC000023732543	220433681	/nfs/dbraw/zinc/43/36/81/220433681.db2.gz	OLFJKLALILCVTR-GOSISDBHSA-N	0	0	355.394	2.915	50	5		FFBARN
O=C([C@@H]1CC(=O)Nc2cc(F)ccc21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000029888918	220612806	/nfs/dbraw/zinc/61/28/06/220612806.db2.gz	RSHWILZVBOOXSN-CQSZACIVSA-N	0	0	355.325	2.749	50	5		FFBARN
CNc1ccc(C(=O)N2CCC[C@H]2C(=O)Nc2ccccc2)cc1[N+](=O)[O-]	ZINC000032796957	220682633	/nfs/dbraw/zinc/68/26/33/220682633.db2.gz	FVJXFIAYJKEHNZ-INIZCTEOSA-N	0	0	368.393	2.880	50	5		FFBARN
CCOC(=O)c1c(C)oc2ncn(Cc3cccc([N+](=O)[O-])c3C)c(=O)c21	ZINC000040127743	220886010	/nfs/dbraw/zinc/88/60/10/220886010.db2.gz	SNBDWPZPHBPFOP-UHFFFAOYSA-N	0	0	371.349	2.740	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1N[C@H](C)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000048366848	221011539	/nfs/dbraw/zinc/01/15/39/221011539.db2.gz	ZZQPMVATNKUTNW-SECBINFHSA-N	0	0	356.338	2.724	50	5		FFBARN
COc1cc(C(=O)NCC2CC2)c([N+](=O)[O-])cc1OCc1cscn1	ZINC000056391625	221079947	/nfs/dbraw/zinc/07/99/47/221079947.db2.gz	NNOMFYMZMRCGAG-UHFFFAOYSA-N	0	0	363.395	2.779	50	5		FFBARN
COCCN1C(=O)[C@H](Oc2ccc(F)cc2)[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000058085179	221098502	/nfs/dbraw/zinc/09/85/02/221098502.db2.gz	PVHVWPYMSZGGGR-IAGOWNOFSA-N	0	0	360.341	2.711	50	5		FFBARN
CCC[C@H]1CCCN(c2ccc(S(=O)(=O)NC)cc2[N+](=O)[O-])CC1	ZINC000060874591	221132008	/nfs/dbraw/zinc/13/20/08/221132008.db2.gz	NURBGPIJNJQBTG-ZDUSSCGKSA-N	0	0	355.460	2.910	50	5		FFBARN
C[C@H]1CCCN(C(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)CC1	ZINC000062923577	221140383	/nfs/dbraw/zinc/14/03/83/221140383.db2.gz	WICULRCEZZDFEO-ZDUSSCGKSA-N	0	0	361.398	2.932	50	5		FFBARN
C[C@@H](CNC(=O)OC(C)(C)C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000225388784	132284380	/nfs/dbraw/zinc/28/43/80/132284380.db2.gz	ITRHXZXQXQJAKR-AWEZNQCLSA-N	0	0	364.446	2.630	50	5		FFBARN
O=C1OCC2=C1[C@H](c1cccc([N+](=O)[O-])c1)CC(=O)N2c1ccccc1	ZINC000001427636	132381944	/nfs/dbraw/zinc/38/19/44/132381944.db2.gz	QVDLNTUYXVITKV-HNNXBMFYSA-N	0	0	350.330	2.926	50	5		FFBARN
O=[N+]([O-])c1cccnc1NCc1ccc(N2CCCC[C@@H]2CCO)nc1	ZINC000047253878	136122673	/nfs/dbraw/zinc/12/26/73/136122673.db2.gz	KOWVYTZJOIKDRE-OAHLLOKOSA-N	0	0	357.414	2.738	50	5		FFBARN
Cc1cc(C)c2c(n1)sc1c2nnn(-c2ccccc2[N+](=O)[O-])c1=O	ZINC000020446324	263380019	/nfs/dbraw/zinc/38/00/19/263380019.db2.gz	AAMGXWWISQKSND-UHFFFAOYSA-N	0	0	353.363	2.915	50	5		FFBARN
CCOC(=O)C1=C(C(F)(F)F)NC(=O)C[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000001392231	506260394	/nfs/dbraw/zinc/26/03/94/506260394.db2.gz	GVKIDXQDEXAFPF-SNVBAGLBSA-N	0	0	358.272	2.578	50	5		FFBARN
COc1cccc(/C=C2\N=C(c3ccc(OC)c([N+](=O)[O-])c3)OC2=O)c1	ZINC000001507848	506263415	/nfs/dbraw/zinc/26/34/15/506263415.db2.gz	HMOQKKHCAONAIW-ZROIWOOFSA-N	0	0	354.318	2.957	50	5		FFBARN
C[C@H]1C[C@@H](OC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C(=O)O1	ZINC000032736102	506288098	/nfs/dbraw/zinc/28/80/98/506288098.db2.gz	XORVIMMOUXEBFR-BLLLJJGKSA-N	0	0	362.382	2.836	50	5		FFBARN
O=C(N[C@@H]1CCOc2ccccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000032722332	506284400	/nfs/dbraw/zinc/28/44/00/506284400.db2.gz	DQJWIRHEHMKXKU-CYBMUJFWSA-N	0	0	356.334	2.620	50	5		FFBARN
CN(C)C(=O)N[C@H](Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl	ZINC000003130611	506311642	/nfs/dbraw/zinc/31/16/42/506311642.db2.gz	KLSOBTYDYWNKQL-VIFPVBQESA-N	0	0	355.609	2.974	50	5		FFBARN
O=C(COC(=O)c1ccc(Cl)cc1[N+](=O)[O-])N1CCc2ccccc2C1	ZINC000003271335	506317138	/nfs/dbraw/zinc/31/71/38/506317138.db2.gz	HEGAAHOVXRMOGG-UHFFFAOYSA-N	0	0	374.780	2.990	50	5		FFBARN
O=C(COC(=O)c1ccccc1O)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000003272208	506317213	/nfs/dbraw/zinc/31/72/13/506317213.db2.gz	PLUPINWAQKMYQH-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
COc1ccc(C(C)=O)cc1CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000003415583	506329553	/nfs/dbraw/zinc/32/95/53/506329553.db2.gz	GONIIJYJZPBWRP-UHFFFAOYSA-N	0	0	354.318	2.602	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1OC	ZINC000003466010	506334261	/nfs/dbraw/zinc/33/42/61/506334261.db2.gz	NGGMCFLZJVIDET-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
COC(=O)c1cc(C(=O)O[C@H](C)C(=O)Nc2ccccc2)cc([N+](=O)[O-])c1	ZINC000003513580	506338408	/nfs/dbraw/zinc/33/84/08/506338408.db2.gz	KOSNSGYJAWYSTE-LLVKDONJSA-N	0	0	372.333	2.565	50	5		FFBARN
COc1cc(C(=O)OCc2cn3ccccc3n2)c([N+](=O)[O-])cc1OC	ZINC000004274891	506367928	/nfs/dbraw/zinc/36/79/28/506367928.db2.gz	DXRDYONYEGWZNK-UHFFFAOYSA-N	0	0	357.322	2.617	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1C	ZINC000004497023	506377930	/nfs/dbraw/zinc/37/79/30/506377930.db2.gz	ORGHUUTUJNJRGL-OAHLLOKOSA-N	0	0	353.378	2.747	50	5		FFBARN
CCC(=O)OCCNc1cc(SC(C)C)c2nonc2c1[N+](=O)[O-]	ZINC000004677059	506386193	/nfs/dbraw/zinc/38/61/93/506386193.db2.gz	YUSCJOPHFRVMLT-UHFFFAOYSA-N	0	0	354.388	2.997	50	5		FFBARN
CNc1cc(N2CCN(C(=O)/C=C/c3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000004703750	506389391	/nfs/dbraw/zinc/38/93/91/506389391.db2.gz	SOTYIBZBYSEFCH-JXMROGBWSA-N	0	0	366.421	2.999	50	5		FFBARN
COc1ccccc1C(=O)Nc1cc([N+](=O)[O-])ccc1N1CCN(C)CC1	ZINC000004708119	506390216	/nfs/dbraw/zinc/39/02/16/506390216.db2.gz	HNQPDWZBYWVSQL-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
CN(CCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc(Cl)nn1	ZINC000004811825	506395004	/nfs/dbraw/zinc/39/50/04/506395004.db2.gz	FBGXEATXQNFAJN-UHFFFAOYSA-N	0	0	366.765	2.885	50	5		FFBARN
COc1cccc(NC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)c1	ZINC000004895971	506401879	/nfs/dbraw/zinc/40/18/79/506401879.db2.gz	PDJJMGDWUYGJHS-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
Cc1ccc(CNc2c([N+](=O)[O-])nn(-c3cccc(Cl)c3)[n+]2[O-])cc1	ZINC000004923425	506405911	/nfs/dbraw/zinc/40/59/11/506405911.db2.gz	LXNKWNGAHITINV-UHFFFAOYSA-N	0	0	359.773	2.988	50	5		FFBARN
CNC(=O)/C(=C\c1ccc(Cl)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000005165766	506426227	/nfs/dbraw/zinc/42/62/27/506426227.db2.gz	BRAFDKUAUPBIPX-XNTDXEJSSA-N	0	0	359.769	2.765	50	5		FFBARN
Cc1c(O[C@@H](C)C(=O)NCCCO)ccc2c3ccccc3c(=O)oc12	ZINC000005243664	506429879	/nfs/dbraw/zinc/42/98/79/506429879.db2.gz	HRBXOTGHGLAGHT-ZDUSSCGKSA-N	0	0	355.390	2.521	50	5		FFBARN
COc1cc(NC(=O)COC(=O)c2ccc(C)cc2O)c(C)cc1[N+](=O)[O-]	ZINC000005226794	506431029	/nfs/dbraw/zinc/43/10/29/506431029.db2.gz	HRIMRINRBVYKHR-UHFFFAOYSA-N	0	0	374.349	2.721	50	5		FFBARN
O=[N+]([O-])c1ccccc1N1CCN(C(=S)NCc2ccccc2)CC1	ZINC000005930787	506461951	/nfs/dbraw/zinc/46/19/51/506461951.db2.gz	HVKPHCPFQHFPEL-UHFFFAOYSA-N	0	0	356.451	2.792	50	5		FFBARN
Cc1cc(-n2c(C)cc(C(=O)COc3cccnc3[N+](=O)[O-])c2C)no1	ZINC000005971638	506463529	/nfs/dbraw/zinc/46/35/29/506463529.db2.gz	NMVZRYPGCVTHSK-UHFFFAOYSA-N	0	0	356.338	2.955	50	5		FFBARN
COc1ccc([C@@H](Nc2c([N+](=O)[O-])c(C)nn2C)c2nccn2C)cc1	ZINC000040116246	506468688	/nfs/dbraw/zinc/46/86/88/506468688.db2.gz	UEHQKERZBMYQNZ-CQSZACIVSA-N	0	0	356.386	2.580	50	5		FFBARN
CC[N@@H+]1CCc2c(sc3c2C(=O)N[C@H](c2cc([O-])ccc2[N+](=O)[O-])N3)C1	ZINC000006594375	506490880	/nfs/dbraw/zinc/49/08/80/506490880.db2.gz	SVVGNZYPGCJDLE-HNNXBMFYSA-N	0	0	374.422	2.594	50	5		FFBARN
Cn1cnc([N+](=O)[O-])c1N1CCN(c2cccc(C(F)(F)F)c2)CC1	ZINC000006653718	506494079	/nfs/dbraw/zinc/49/40/79/506494079.db2.gz	JLXWTGXXNSDGIE-UHFFFAOYSA-N	0	0	355.320	2.674	50	5		FFBARN
COC(=O)c1sccc1NC(=O)COc1ccc(C)cc1[N+](=O)[O-]	ZINC000006690866	506497977	/nfs/dbraw/zinc/49/79/77/506497977.db2.gz	HTCPWIVIRZBGOI-UHFFFAOYSA-N	0	0	350.352	2.769	50	5		FFBARN
CC[C@H]1Oc2ccccc2C(=O)N(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000006719943	506500351	/nfs/dbraw/zinc/50/03/51/506500351.db2.gz	IPHHVSDUBMUVDA-MRXNPFEDSA-N	0	0	368.345	2.618	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=S)NCc1ccc2c(c1)OCO2	ZINC000006951731	506520697	/nfs/dbraw/zinc/52/06/97/506520697.db2.gz	FJVXWAPKGLSNHJ-UHFFFAOYSA-N	0	0	361.379	2.819	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(NC(=O)CN2C(=O)CC3(CCCCC3)C2=O)c1C	ZINC000007046945	506529387	/nfs/dbraw/zinc/52/93/87/506529387.db2.gz	UTHMJYDZDJEBGU-UHFFFAOYSA-N	0	0	373.409	2.860	50	5		FFBARN
O=C(Nc1cc([N+](=O)[O-])ccc1F)C1CCN(C(=O)c2ccco2)CC1	ZINC000008246514	506635628	/nfs/dbraw/zinc/63/56/28/506635628.db2.gz	JXIHVDLRTSQEFC-UHFFFAOYSA-N	0	0	361.329	2.818	50	5		FFBARN
COC(=O)c1csc([N+](=O)[O-])c1-c1c(C(=O)OC)csc1[N+](=O)[O-]	ZINC000008431227	506651420	/nfs/dbraw/zinc/65/14/20/506651420.db2.gz	KQHPJUKPZCQVMJ-UHFFFAOYSA-N	0	0	372.336	2.866	50	5		FFBARN
COc1ccc(NC(C)=O)cc1NC(=O)c1cc([N+](=O)[O-])ccc1N(C)C	ZINC000008726423	506664616	/nfs/dbraw/zinc/66/46/16/506664616.db2.gz	CMXNXEGYJFNWIH-UHFFFAOYSA-N	0	0	372.381	2.880	50	5		FFBARN
COCCN(Cc1cccs1)C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000008748759	506666030	/nfs/dbraw/zinc/66/60/30/506666030.db2.gz	OXFXTGBWKICTLQ-UHFFFAOYSA-N	0	0	350.396	2.954	50	5		FFBARN
Cc1nn(CC(=O)NCCSCc2ccc(C)cc2)c(C)c1[N+](=O)[O-]	ZINC000009690317	506708334	/nfs/dbraw/zinc/70/83/34/506708334.db2.gz	OJKFOTSRGNYJDM-UHFFFAOYSA-N	0	0	362.455	2.766	50	5		FFBARN
COc1ccc(CNC(=O)/C=C/c2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000009723654	506710447	/nfs/dbraw/zinc/71/04/47/506710447.db2.gz	REMYQMHZBPZZSC-QPJJXVBHSA-N	0	0	370.361	2.800	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)N2CCC[C@H]2c2ccccc2)cc1[N+](=O)[O-]	ZINC000009958751	506719791	/nfs/dbraw/zinc/71/97/91/506719791.db2.gz	XEWYSNAORMSFGE-KRWDZBQOSA-N	0	0	367.405	2.997	50	5		FFBARN
Cc1cc(NC(=O)[C@H](C)OC(=O)c2cc(Cl)ccc2[N+](=O)[O-])no1	ZINC000010028876	506723139	/nfs/dbraw/zinc/72/31/39/506723139.db2.gz	OORRFXPHDFFONA-QMMMGPOBSA-N	0	0	353.718	2.729	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nnc3ccccn32)C1	ZINC000012390972	506857888	/nfs/dbraw/zinc/85/78/88/506857888.db2.gz	RAOXDKLGZBGTHG-AWEZNQCLSA-N	0	0	351.366	2.657	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])cc1	ZINC000012551596	506878122	/nfs/dbraw/zinc/87/81/22/506878122.db2.gz	MOHGDLGFZCYOFA-TXEJJXNPSA-N	0	0	358.402	2.633	50	5		FFBARN
COC(=O)/C=C/CN1C(=O)[C@H](c2ccccc2)Oc2cc([N+](=O)[O-])ccc21	ZINC000020030747	507209435	/nfs/dbraw/zinc/20/94/35/507209435.db2.gz	UIMZWCJZDWWSCW-MOTZXUDYSA-N	0	0	368.345	2.791	50	5		FFBARN
COC(=O)/C=C/CN1C(=O)[C@@H](c2ccccc2)Oc2cc([N+](=O)[O-])ccc21	ZINC000020030743	507210387	/nfs/dbraw/zinc/21/03/87/507210387.db2.gz	UIMZWCJZDWWSCW-KRZKXXONSA-N	0	0	368.345	2.791	50	5		FFBARN
Cc1cc(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)ccc1[N+](=O)[O-]	ZINC000024208846	507397607	/nfs/dbraw/zinc/39/76/07/507397607.db2.gz	WVTRUHTVGKNFGK-GOSISDBHSA-N	0	0	369.421	2.707	50	5		FFBARN
Cc1nn(CC(=O)OCc2coc(-c3ccccc3)n2)c(C)c1[N+](=O)[O-]	ZINC000024293407	507403009	/nfs/dbraw/zinc/40/30/09/507403009.db2.gz	FWUSVGJTQPUOMM-UHFFFAOYSA-N	0	0	356.338	2.807	50	5		FFBARN
Cc1ccc(C(=O)N2CCC(c3nnc4ccccn43)CC2)cc1[N+](=O)[O-]	ZINC000024327399	507404193	/nfs/dbraw/zinc/40/41/93/507404193.db2.gz	LGZOPSUTYYCJHJ-UHFFFAOYSA-N	0	0	365.393	2.966	50	5		FFBARN
C[C@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccc(-c2ccccc2)cc1	ZINC000048224443	507482201	/nfs/dbraw/zinc/48/22/01/507482201.db2.gz	WBYWXMXIJWXRON-ZDUSSCGKSA-N	0	0	351.366	2.731	50	5		FFBARN
COC(=O)c1ccc([C@H](C)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1	ZINC000025913132	507542873	/nfs/dbraw/zinc/54/28/73/507542873.db2.gz	UCABCPRUQVZHNN-ZDUSSCGKSA-N	0	0	359.382	2.858	50	5		FFBARN
COC(=O)CCSCCNC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000089400841	507835863	/nfs/dbraw/zinc/83/58/63/507835863.db2.gz	FOIZFLDFNINVHD-UHFFFAOYSA-N	0	0	361.807	2.666	50	5		FFBARN
COc1ccc(NC(=O)[C@@H](c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	ZINC000096602152	508215323	/nfs/dbraw/zinc/21/53/23/508215323.db2.gz	SCNHRRIFRQDCJH-GOSISDBHSA-N	0	0	371.393	2.615	50	5		FFBARN
O=C(CN1CCCc2cccc(F)c21)Nc1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000084445549	508279736	/nfs/dbraw/zinc/27/97/36/508279736.db2.gz	CRTPJTSXLFGESK-UHFFFAOYSA-N	0	0	373.340	2.854	50	5		FFBARN
CCCc1[nH]nc(-c2nc(-c3ccc(C(=O)OC)cc3)no2)c1[N+](=O)[O-]	ZINC000170609054	509679452	/nfs/dbraw/zinc/67/94/52/509679452.db2.gz	NNLBTNISDCMZGD-UHFFFAOYSA-N	0	0	357.326	2.774	50	5		FFBARN
Cc1nn(C(C)(C)C)c(=O)n1Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000193094349	222621087	/nfs/dbraw/zinc/62/10/87/222621087.db2.gz	BDBUBBMWYFODSZ-UHFFFAOYSA-N	0	0	369.219	2.827	50	5		FFBARN
COc1cc([C@H]2NC(=O)CC[C@H]2[N+](=O)[O-])ccc1OCc1ccccc1	ZINC000000815843	219325237	/nfs/dbraw/zinc/32/52/37/219325237.db2.gz	ZCSAVJRPGZHZHC-DNVCBOLYSA-N	0	0	356.378	2.871	50	5		FFBARN
O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000000828128	219327792	/nfs/dbraw/zinc/32/77/92/219327792.db2.gz	XCNDUMKZXBBHEJ-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
O=C(CSc1nc2ccc([N+](=O)[O-])cc2s1)NC[C@H]1CCCO1	ZINC000000834566	219329062	/nfs/dbraw/zinc/32/90/62/219329062.db2.gz	DIQRRRASKWSQRT-SNVBAGLBSA-N	0	0	353.425	2.592	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc(C(C)=O)cc2)cc1[N+](=O)[O-]	ZINC000000882015	219335163	/nfs/dbraw/zinc/33/51/63/219335163.db2.gz	UVJKEOHAOSMQKL-UHFFFAOYSA-N	0	0	373.390	2.933	50	5		FFBARN
COc1ccc(NC(=S)NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1	ZINC000000881996	219335779	/nfs/dbraw/zinc/33/57/79/219335779.db2.gz	RYQGSGQPSUAICJ-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
Cn1nc([N+](=O)[O-])nc1Oc1ccc(C(=O)OCc2ccccc2)cc1	ZINC000001062902	219361333	/nfs/dbraw/zinc/36/13/33/219361333.db2.gz	ABJGGBUEMYASRO-UHFFFAOYSA-N	0	0	354.322	2.873	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C(=O)c2ccccc2C1=O	ZINC000001134864	219377693	/nfs/dbraw/zinc/37/76/93/219377693.db2.gz	OZEBWQLZJRXYRN-UHFFFAOYSA-N	0	0	353.334	2.528	50	5		FFBARN
COc1cc(/C=C2/NC(=O)N(c3ccccc3)C2=O)c([N+](=O)[O-])cc1OC	ZINC000001164178	219384317	/nfs/dbraw/zinc/38/43/17/219384317.db2.gz	ORILCTKHXVNKFD-MDWZMJQESA-N	0	0	369.333	2.709	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	ZINC000001180947	219385898	/nfs/dbraw/zinc/38/58/98/219385898.db2.gz	AJTKWGXEZACBAJ-UHFFFAOYSA-N	0	0	372.406	2.988	50	5		FFBARN
Cn1c2ccccc2c2c(c1=O)[C@H](c1cccc([N+](=O)[O-])c1)CC(=O)O2	ZINC000001427619	219405420	/nfs/dbraw/zinc/40/54/20/219405420.db2.gz	HMHMPPHSHXVNIE-AWEZNQCLSA-N	0	0	350.330	2.888	50	5		FFBARN
CCOC(=O)c1ccc(OC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1	ZINC000002851448	219469929	/nfs/dbraw/zinc/46/99/29/219469929.db2.gz	JWXVGBHBMYITNG-UHFFFAOYSA-N	0	0	373.317	2.777	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000003407198	219507435	/nfs/dbraw/zinc/50/74/35/219507435.db2.gz	MWUZMCTYZYVMQS-ZDUSSCGKSA-N	0	0	357.341	2.721	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1cccc(S(C)(=O)=O)c1	ZINC000015179442	220149111	/nfs/dbraw/zinc/14/91/11/220149111.db2.gz	DCRFUJZGYBXJQO-GFCCVEGCSA-N	0	0	362.407	2.832	50	5		FFBARN
C[C@H](NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)cc1F	ZINC000015813482	220165070	/nfs/dbraw/zinc/16/50/70/220165070.db2.gz	SQOVGRCYCJBMPW-JTQLQIEISA-N	0	0	373.319	2.945	50	5		FFBARN
COCCN1C(=O)c2[nH]nc(-c3ccco3)c2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000020744609	220340528	/nfs/dbraw/zinc/34/05/28/220340528.db2.gz	BNZJGZNFLPVPKA-KRWDZBQOSA-N	0	0	368.349	2.770	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@H](c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)S1	ZINC000020895476	220344290	/nfs/dbraw/zinc/34/42/90/220344290.db2.gz	OLZYYYWBRODOPN-HNNXBMFYSA-N	0	0	374.378	2.856	50	5		FFBARN
CCOC(=O)c1cc(CC)sc1NC(=O)CCn1cnc([N+](=O)[O-])c1	ZINC000024591362	220452724	/nfs/dbraw/zinc/45/27/24/220452724.db2.gz	OHRNLZVPLVXLPW-UHFFFAOYSA-N	0	0	366.399	2.621	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1cccc(NC(=O)[C@@H]2CCCO2)c1	ZINC000024933038	220466940	/nfs/dbraw/zinc/46/69/40/220466940.db2.gz	ITGZHSBJZKRJJW-INIZCTEOSA-N	0	0	355.350	2.965	50	5		FFBARN
Cn1nc(C(C)(C)C)cc1NC(=O)COc1cc(F)ccc1[N+](=O)[O-]	ZINC000048355441	221009935	/nfs/dbraw/zinc/00/99/35/221009935.db2.gz	VFLIWDUEEMYCLA-UHFFFAOYSA-N	0	0	350.350	2.782	50	5		FFBARN
C[C@@H](Oc1ccc(C(=O)NC2CC2)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000054271603	221052089	/nfs/dbraw/zinc/05/20/89/221052089.db2.gz	RRMXNVBPOAQHGA-GFCCVEGCSA-N	0	0	369.377	2.893	50	5		FFBARN
Cc1ccccc1-c1noc(Cn2cc(Br)c([N+](=O)[O-])n2)n1	ZINC000054919740	221056198	/nfs/dbraw/zinc/05/61/98/221056198.db2.gz	YOTUPHBWQXWKDG-UHFFFAOYSA-N	0	0	364.159	2.961	50	5		FFBARN
COCCN1C(=O)[C@@H](Oc2ccc(F)cc2)[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000058085170	221098585	/nfs/dbraw/zinc/09/85/85/221098585.db2.gz	PVHVWPYMSZGGGR-SJORKVTESA-N	0	0	360.341	2.711	50	5		FFBARN
O=C1NC2(CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)N=C1c1ccccc1	ZINC000064963726	221158804	/nfs/dbraw/zinc/15/88/04/221158804.db2.gz	UCTKTHNVOYZGBM-UHFFFAOYSA-N	0	0	364.405	2.506	50	5		FFBARN
C[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)O1	ZINC000008132128	132259425	/nfs/dbraw/zinc/25/94/25/132259425.db2.gz	FOAHQAYQBIMCRI-RKDXNWHRSA-N	0	0	368.333	2.502	50	5		FFBARN
CC(=O)Nc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000003880219	132385848	/nfs/dbraw/zinc/38/58/48/132385848.db2.gz	DDAMLHABHJOJCI-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3nnc(-c4ccccc4)o3)CC2)cc1	ZINC000058138356	136130527	/nfs/dbraw/zinc/13/05/27/136130527.db2.gz	RTLMVYJNWVBYOV-UHFFFAOYSA-N	0	0	365.393	2.967	50	5		FFBARN
Cc1c([C@H](C)NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)cnn1C	ZINC000024999757	136153149	/nfs/dbraw/zinc/15/31/49/136153149.db2.gz	NGQCDJGVQSEARP-ZDUSSCGKSA-N	0	0	371.441	2.731	50	5		FFBARN
Cc1ccc(C(=O)NCCc2nc(-c3cccc([N+](=O)[O-])c3)no2)cc1	ZINC000096277379	222108256	/nfs/dbraw/zinc/10/82/56/222108256.db2.gz	GRDZBEWCAFCATE-UHFFFAOYSA-N	0	0	352.350	2.926	50	5		FFBARN
C[C@H]1CC(=O)N(c2ccc(NCCc3ccc(O)cc3)c([N+](=O)[O-])c2)C1=O	ZINC000101674837	222280771	/nfs/dbraw/zinc/28/07/71/222280771.db2.gz	ZKJQUJMWJGDMIY-LBPRGKRZSA-N	0	0	369.377	2.854	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(N2CCCC2=O)c1	ZINC000009653544	263362293	/nfs/dbraw/zinc/36/22/93/263362293.db2.gz	DXRHPRJXPZKRJX-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1ccc(=O)c2ccccc21	ZINC000058391375	263414902	/nfs/dbraw/zinc/41/49/02/263414902.db2.gz	HKFGAFOTSKCNKA-UHFFFAOYSA-N	0	0	353.334	2.557	50	5		FFBARN
COCCN(Cc1cccs1)S(=O)(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000032724459	506283614	/nfs/dbraw/zinc/28/36/14/506283614.db2.gz	AFYKUPJUDQJDCM-UHFFFAOYSA-N	0	0	370.452	2.802	50	5		FFBARN
C[C@@H](CCc1ccccc1)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000002651371	506287008	/nfs/dbraw/zinc/28/70/08/506287008.db2.gz	WFDLJIGYXSJDJQ-AWEZNQCLSA-N	0	0	356.378	2.889	50	5		FFBARN
Cc1cc(OS(=O)(=O)c2ccc([N+](=O)[O-])cc2)n(-c2ccccc2)n1	ZINC000003197903	506313061	/nfs/dbraw/zinc/31/30/61/506313061.db2.gz	OAUQGNZNIYCVSA-UHFFFAOYSA-N	0	0	359.363	2.857	50	5		FFBARN
C[C@H]1CN(C(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)C[C@H](C)O1	ZINC000003234877	506314683	/nfs/dbraw/zinc/31/46/83/506314683.db2.gz	JDSHPJUFWJGPDF-UWVGGRQHSA-N	0	0	367.452	2.932	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccccc1F	ZINC000003392984	506327927	/nfs/dbraw/zinc/32/79/27/506327927.db2.gz	NGFTXBCLWKGRNV-JTQLQIEISA-N	0	0	362.313	2.927	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000003499597	506336937	/nfs/dbraw/zinc/33/69/37/506336937.db2.gz	CFHIAQAMZOBSFA-GHMZBOCLSA-N	0	0	354.790	2.910	50	5		FFBARN
CCCCCC(=O)N[C@H](Cc1ccc(OC)c([N+](=O)[O-])c1)C(=O)OCC	ZINC000004146821	506363185	/nfs/dbraw/zinc/36/31/85/506363185.db2.gz	RGTRBYOIYUWIIJ-CQSZACIVSA-N	0	0	366.414	2.774	50	5		FFBARN
O=C1NCCCC[C@@H]1Nc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000004306705	506369620	/nfs/dbraw/zinc/36/96/20/506369620.db2.gz	HHYZNTQFJBNUSS-QMMMGPOBSA-N	0	0	362.264	2.602	50	5		FFBARN
O=[N+]([O-])c1cc([N+](=O)[O-])c(NC[C@@H]2CCCO2)cc1NC[C@@H]1CCCO1	ZINC000004406388	506374190	/nfs/dbraw/zinc/37/41/90/506374190.db2.gz	JMDYGVBOORMJTR-RYUDHWBXSA-N	0	0	366.374	2.685	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)c3cccc([N+](=O)[O-])c3C)CC2=O)cc1	ZINC000004496976	506378274	/nfs/dbraw/zinc/37/82/74/506378274.db2.gz	IJNAQBVGUSJWIQ-AWEZNQCLSA-N	0	0	353.378	2.747	50	5		FFBARN
CC(C)CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1	ZINC000004504735	506379038	/nfs/dbraw/zinc/37/90/38/506379038.db2.gz	VTXWKGZIJTYWBF-GFCCVEGCSA-N	0	0	374.846	2.534	50	5		FFBARN
CN1c2ccc(Cl)cc2[C@@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000004555358	506381646	/nfs/dbraw/zinc/38/16/46/506381646.db2.gz	SMDQRZLHQNTVLW-KRWDZBQOSA-N	0	0	360.753	2.685	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1	ZINC000004550575	506381664	/nfs/dbraw/zinc/38/16/64/506381664.db2.gz	TWAIQPLDAOTLSE-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
O=C(Cc1ccc(F)cc1)Nc1cc(SCCO)cc([N+](=O)[O-])c1	ZINC000004577658	506382923	/nfs/dbraw/zinc/38/29/23/506382923.db2.gz	JTDHCLCZUXHJIM-UHFFFAOYSA-N	0	0	350.371	3.000	50	5		FFBARN
Cc1cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)ccc1[N+](=O)[O-]	ZINC000004600474	506384326	/nfs/dbraw/zinc/38/43/26/506384326.db2.gz	KOHIDIRIXDFQOF-UHFFFAOYSA-N	0	0	370.365	2.774	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000004725159	506391434	/nfs/dbraw/zinc/39/14/34/506391434.db2.gz	KVXMFALNGFOCRG-RISCZKNCSA-N	0	0	357.288	2.848	50	5		FFBARN
Nc1ccc(C(=O)OCC(=O)N[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	ZINC000004869356	506400565	/nfs/dbraw/zinc/40/05/65/506400565.db2.gz	UBLHRGKGNJHOGP-MRXNPFEDSA-N	0	0	369.377	2.528	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cn1)Nc1ccc(N2CCOCC2)cc1	ZINC000037867303	506432598	/nfs/dbraw/zinc/43/25/98/506432598.db2.gz	IWYREMYATZTVON-UHFFFAOYSA-N	0	0	374.422	2.557	50	5		FFBARN
O=C(NCc1ccccc1Cn1cncn1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000040081411	506463261	/nfs/dbraw/zinc/46/32/61/506463261.db2.gz	NOIYNURGCDCXMG-UHFFFAOYSA-N	0	0	371.784	2.818	50	5		FFBARN
C[C@H](OC(=O)Cc1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(Cl)cn1	ZINC000005958619	506463834	/nfs/dbraw/zinc/46/38/34/506463834.db2.gz	GBQZZGVPOPOBIC-JTQLQIEISA-N	0	0	363.757	2.756	50	5		FFBARN
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1cccnc1OC1CCCC1	ZINC000040089443	506464863	/nfs/dbraw/zinc/46/48/63/506464863.db2.gz	LAFOWPDNCSFQGG-UHFFFAOYSA-N	0	0	356.382	2.945	50	5		FFBARN
CC(=O)c1c(C)[nH]c(C(=O)OCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])c1C	ZINC000006047518	506464956	/nfs/dbraw/zinc/46/49/56/506464956.db2.gz	YUHCWAZJAFSABU-UHFFFAOYSA-N	0	0	373.365	2.846	50	5		FFBARN
C[C@H]1c2cccn2CCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000006949128	506518822	/nfs/dbraw/zinc/51/88/22/506518822.db2.gz	DCUHILDHKMSKBV-JTQLQIEISA-N	0	0	355.803	2.815	50	5		FFBARN
O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Br	ZINC000007842711	506596309	/nfs/dbraw/zinc/59/63/09/506596309.db2.gz	DQTJTVRSILBAIX-AWEZNQCLSA-N	0	0	365.183	2.821	50	5		FFBARN
O=C(NCCNc1ccccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1	ZINC000008146060	506627641	/nfs/dbraw/zinc/62/76/41/506627641.db2.gz	AWYQPMZIPBMNTK-UHFFFAOYSA-N	0	0	368.393	2.564	50	5		FFBARN
CCOc1cc(C(=O)Nn2cnc3ccccc32)c([N+](=O)[O-])cc1OC	ZINC000008744597	506666180	/nfs/dbraw/zinc/66/61/80/506666180.db2.gz	LOMGZWFKIWDRKN-UHFFFAOYSA-N	0	0	356.338	2.736	50	5		FFBARN
COC(=O)c1ccc(C)c(NC(=O)CN2CCc3cc([N+](=O)[O-])ccc32)c1	ZINC000009468313	506697458	/nfs/dbraw/zinc/69/74/58/506697458.db2.gz	XZDMHENDIASTDJ-UHFFFAOYSA-N	0	0	369.377	2.691	50	5		FFBARN
CC(=O)Nc1ccc(N2C(=O)C/C(=C\c3ccc([N+](=O)[O-])s3)C2=O)cc1	ZINC000009546966	506703404	/nfs/dbraw/zinc/70/34/04/506703404.db2.gz	QCLPUEJKMONILS-DHZHZOJOSA-N	0	0	371.374	2.962	50	5		FFBARN
COc1cc(C(=O)Nc2nnc(C3CC3)s2)c([N+](=O)[O-])cc1OC	ZINC000009912083	506718238	/nfs/dbraw/zinc/71/82/38/506718238.db2.gz	YYGZNUDYLFPQLA-UHFFFAOYSA-N	0	0	350.356	2.593	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)N2CCC[C@@H]2c2ccccc2)cc1[N+](=O)[O-]	ZINC000009958749	506719679	/nfs/dbraw/zinc/71/96/79/506719679.db2.gz	XEWYSNAORMSFGE-QGZVFWFLSA-N	0	0	367.405	2.997	50	5		FFBARN
COc1ccc(-c2nc(Cn3cc([N+](=O)[O-])ccc3=O)cs2)cc1OC	ZINC000011288030	506771388	/nfs/dbraw/zinc/77/13/88/506771388.db2.gz	DYBYLEXDDMSKTP-UHFFFAOYSA-N	0	0	373.390	2.946	50	5		FFBARN
CCN1CCc2nc(NC(=O)c3n[nH]c4ccc([N+](=O)[O-])cc43)sc2C1	ZINC000045317245	506949448	/nfs/dbraw/zinc/94/94/48/506949448.db2.gz	IFVXCNDUPVUPBZ-UHFFFAOYSA-N	0	0	372.410	2.558	50	5		FFBARN
Cc1cccc(C)c1OC[C@@H](O)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000046060869	507070408	/nfs/dbraw/zinc/07/04/08/507070408.db2.gz	PRANBZVFYFNJMY-KRWDZBQOSA-N	0	0	368.393	2.910	50	5		FFBARN
O=C1c2cc([N+](=O)[O-])cc3cc([N+](=O)[O-])cc(c32)C(=O)N1c1ccccn1	ZINC000017364048	507124639	/nfs/dbraw/zinc/12/46/39/507124639.db2.gz	WZLUIXMSKTWXDV-UHFFFAOYSA-N	0	0	364.273	2.852	50	5		FFBARN
COC(=O)c1ccc(OCC(=O)N2CCCc3ccccc32)c([N+](=O)[O-])c1	ZINC000022222673	507283484	/nfs/dbraw/zinc/28/34/84/507283484.db2.gz	XNOQWJKESJBNPM-UHFFFAOYSA-N	0	0	370.361	2.740	50	5		FFBARN
Cc1ccc([C@@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCOCC2)o1	ZINC000022873019	507317948	/nfs/dbraw/zinc/31/79/48/507317948.db2.gz	NYPRANVNTDZWPD-MRXNPFEDSA-N	0	0	373.409	2.608	50	5		FFBARN
O=[N+]([O-])c1cccc(-c2nccn2C[C@@H](O)c2ccc3c(c2)OCCO3)c1	ZINC000058174322	507379061	/nfs/dbraw/zinc/37/90/61/507379061.db2.gz	MIALUKHMDJOXKP-MRXNPFEDSA-N	0	0	367.361	2.963	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1OCC(=O)c1ccc(CNC(C)=O)s1	ZINC000024849882	507444436	/nfs/dbraw/zinc/44/44/36/507444436.db2.gz	FVKSHPRTQNSOAV-UHFFFAOYSA-N	0	0	364.379	2.563	50	5		FFBARN
O=C(c1ccc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCN(C(=O)C2CC2)CC1	ZINC000025164595	507472092	/nfs/dbraw/zinc/47/20/92/507472092.db2.gz	AVEMLQCEJBGFTC-UHFFFAOYSA-N	0	0	369.377	2.549	50	5		FFBARN
COc1ccccc1Nc1nc(N)nc(COc2cccc([N+](=O)[O-])c2)n1	ZINC000025398498	507496863	/nfs/dbraw/zinc/49/68/63/507496863.db2.gz	BRZABQWMZJHRLY-UHFFFAOYSA-N	0	0	368.353	2.693	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCNc2ccc3nnc(C(F)(F)F)n3n2)cc1	ZINC000025571176	507511829	/nfs/dbraw/zinc/51/18/29/507511829.db2.gz	CFUVFUYHIQRAKB-UHFFFAOYSA-N	0	0	367.291	2.575	50	5		FFBARN
Cc1ccsc1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000025999417	507550768	/nfs/dbraw/zinc/55/07/68/507550768.db2.gz	LOHGVRSMGIHUKR-UHFFFAOYSA-N	0	0	361.423	2.731	50	5		FFBARN
CC(C)OCc1ccccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000028043668	507705156	/nfs/dbraw/zinc/70/51/56/507705156.db2.gz	ZOSPIQQAGKLFMD-UHFFFAOYSA-N	0	0	364.423	2.998	50	5		FFBARN
O=C(CN1CCC(=O)Nc2cc(F)ccc21)Nc1ccc([N+](=O)[O-])cc1	ZINC000072308951	507774568	/nfs/dbraw/zinc/77/45/68/507774568.db2.gz	VSIYESUXMBDOBV-UHFFFAOYSA-N	0	0	358.329	2.521	50	5		FFBARN
C[C@@]1(c2cccc([N+](=O)[O-])c2)NC(=O)N(CCOc2cccc(F)c2)C1=O	ZINC000031662280	507820834	/nfs/dbraw/zinc/82/08/34/507820834.db2.gz	PZQUGGFDKJEGPT-SFHVURJKSA-N	0	0	373.340	2.580	50	5		FFBARN
Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)CCN1C(=O)COc2ccccc21	ZINC000170617596	509681236	/nfs/dbraw/zinc/68/12/36/509681236.db2.gz	FJCFSZWBMMUMKY-UHFFFAOYSA-N	0	0	369.377	2.966	50	5		FFBARN
O=C(OCc1ccccc1F)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000020857083	526428852	/nfs/dbraw/zinc/42/88/52/526428852.db2.gz	JFOHFZUXUMTDGC-UHFFFAOYSA-N	0	0	360.341	2.928	50	5		FFBARN
COCCn1c(=O)c2c(=O)c3ccccc3oc2nc1-c1ccccc1F	ZINC000002208339	204029229	/nfs/dbraw/zinc/02/92/29/204029229.db2.gz	MQOUCCQUJAEDAH-UHFFFAOYSA-N	0	0	366.348	2.955	50	5		FFBARN
COc1ccc(C(C)=O)cc1COC(=O)COc1ccccc1[N+](=O)[O-]	ZINC000003312975	204090449	/nfs/dbraw/zinc/09/04/49/204090449.db2.gz	NXANZSXPRISVCZ-UHFFFAOYSA-N	0	0	359.334	2.928	50	5		FFBARN
Cc1sc2ncn3nc([C@H](C)Cn4cc([N+](=O)[O-])cn4)nc3c2c1C	ZINC000002808438	204059495	/nfs/dbraw/zinc/05/94/95/204059495.db2.gz	DBXHBSYTVCHDTC-MRVPVSSYSA-N	0	0	357.399	2.864	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000004064411	204119303	/nfs/dbraw/zinc/11/93/03/204119303.db2.gz	HJLNZUCMDYEXBK-CQSZACIVSA-N	0	0	365.411	2.519	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccccc1F	ZINC000003392986	204097258	/nfs/dbraw/zinc/09/72/58/204097258.db2.gz	NGFTXBCLWKGRNV-SNVBAGLBSA-N	0	0	362.313	2.927	50	5		FFBARN
CCOC(=O)c1sc(NC(=O)c2ccc(OC)c([N+](=O)[O-])c2)nc1C	ZINC000004731565	204159292	/nfs/dbraw/zinc/15/92/92/204159292.db2.gz	SDQNRWDTXMUHDP-UHFFFAOYSA-N	0	0	365.367	2.797	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000004263332	204129821	/nfs/dbraw/zinc/12/98/21/204129821.db2.gz	WJAXWNATDNUXOF-KRWDZBQOSA-N	0	0	367.361	2.966	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])C1	ZINC000004923136	204176865	/nfs/dbraw/zinc/17/68/65/204176865.db2.gz	ATULDVMPMCBUKH-GHMZBOCLSA-N	0	0	351.794	2.550	50	5		FFBARN
O=[N+]([O-])c1cccc(/C=C2\CCc3cnn([C@H]4CCS(=O)(=O)C4)c32)c1	ZINC000004945999	204179636	/nfs/dbraw/zinc/17/96/36/204179636.db2.gz	BONNIDXNLFPSSE-OIQJVACTSA-N	0	0	359.407	2.638	50	5		FFBARN
Cc1ccc(N2C(=O)C[C@]3(CC(c4ccc([N+](=O)[O-])cc4)=NO3)C2=O)cc1	ZINC000005055026	204188534	/nfs/dbraw/zinc/18/85/34/204188534.db2.gz	MYWHFLYOLAXXJZ-LJQANCHMSA-N	0	0	365.345	2.730	50	5		FFBARN
O=C1C[C@@]2(CC(c3ccc([N+](=O)[O-])cc3)=NO2)C(=O)N1c1ccc(F)cc1	ZINC000005066156	204189517	/nfs/dbraw/zinc/18/95/17/204189517.db2.gz	YWQPRQMRTVWFJR-SFHVURJKSA-N	0	0	369.308	2.561	50	5		FFBARN
COc1cccc(C(=O)O[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)c1	ZINC000006486801	204250159	/nfs/dbraw/zinc/25/01/59/204250159.db2.gz	IMCNCKVJQGXOMZ-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
Cc1cc(NC(=O)CN2C(=O)CC3(CCCCC3)C2=O)c([N+](=O)[O-])cc1C	ZINC000007046751	204286658	/nfs/dbraw/zinc/28/66/58/204286658.db2.gz	HGIKFNQILDUVOP-UHFFFAOYSA-N	0	0	373.409	2.860	50	5		FFBARN
C[C@H](Oc1ccccc1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000007159629	204290676	/nfs/dbraw/zinc/29/06/76/204290676.db2.gz	OVTAKIKSRJRFSS-LBPRGKRZSA-N	0	0	359.334	2.972	50	5		FFBARN
CNS(=O)(=O)c1ccc(N(C)Cc2ccc(C)cc2C)c([N+](=O)[O-])c1	ZINC000007903236	204310132	/nfs/dbraw/zinc/31/01/32/204310132.db2.gz	KDFAHGPZIOARBN-UHFFFAOYSA-N	0	0	363.439	2.756	50	5		FFBARN
C[C@@H](CNC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000008332547	204327113	/nfs/dbraw/zinc/32/71/13/204327113.db2.gz	AOHOMEIYPCFWRV-ZDUSSCGKSA-N	0	0	351.366	2.709	50	5		FFBARN
CC(=O)Nc1cccc([C@H](C)NC(=O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000036394719	204377779	/nfs/dbraw/zinc/37/77/79/204377779.db2.gz	SGKYTNRJWXQZOV-LBPRGKRZSA-N	0	0	357.366	2.809	50	5		FFBARN
COc1ccc2[nH]c(=O)c(CN(C)C(=O)c3cccc([N+](=O)[O-])c3)cc2c1	ZINC000009191981	204356751	/nfs/dbraw/zinc/35/67/51/204356751.db2.gz	URAIBSMJTSCJRZ-UHFFFAOYSA-N	0	0	367.361	2.717	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])CC2=O)cc1	ZINC000009226937	204359083	/nfs/dbraw/zinc/35/90/83/204359083.db2.gz	IVXYRPXXHODXQU-CYBMUJFWSA-N	0	0	369.377	2.903	50	5		FFBARN
CCc1nc2c(n1C(C)=O)SC(c1ccc([N+](=O)[O-])cc1)=NN2C(C)=O	ZINC000016777630	204642051	/nfs/dbraw/zinc/64/20/51/204642051.db2.gz	NMJZZPNFYVQBMY-UHFFFAOYSA-N	0	0	373.394	2.834	50	5		FFBARN
COc1ccc(-c2noc(CCNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000035673116	204996608	/nfs/dbraw/zinc/99/66/08/204996608.db2.gz	LOOVHNJFRQFHQL-UHFFFAOYSA-N	0	0	368.349	2.626	50	5		FFBARN
O=c1c(C(F)(F)F)cccn1Cc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000042650510	205097608	/nfs/dbraw/zinc/09/76/08/205097608.db2.gz	XXMCLTPSIHZIEA-UHFFFAOYSA-N	0	0	356.256	2.690	50	5		FFBARN
Cn1ccnc1[C@](O)(CCNc1ccc(F)cc1[N+](=O)[O-])C(F)(F)F	ZINC000045802434	205124413	/nfs/dbraw/zinc/12/44/13/205124413.db2.gz	VGAGRCPEIYBVQT-CYBMUJFWSA-N	0	0	362.283	2.720	50	5		FFBARN
O=[N+]([O-])c1ccc(CS(=O)(=O)NCCSc2ccccc2)cc1	ZINC000045798177	205124833	/nfs/dbraw/zinc/12/48/33/205124833.db2.gz	ZXZOSOWDYFNYHU-UHFFFAOYSA-N	0	0	352.437	2.807	50	5		FFBARN
O=C(NCCCOCc1ccco1)c1cnn(-c2ccc([N+](=O)[O-])cc2)c1	ZINC000052580128	205185012	/nfs/dbraw/zinc/18/50/12/205185012.db2.gz	QQNNXNYOJQTJOE-UHFFFAOYSA-N	0	0	370.365	2.710	50	5		FFBARN
O=C(c1ccc(-n2cncn2)c([N+](=O)[O-])c1)N1CC2C[C@@H]3CC1C[C@H](C2)C3	ZINC000058154847	205251303	/nfs/dbraw/zinc/25/13/03/205251303.db2.gz	ADHYWYGYUYFQJT-KKNUOHPOSA-N	0	0	367.409	2.826	50	5		FFBARN
C[C@@H]1CN(C[C@@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](C)O1	ZINC000058160915	205251763	/nfs/dbraw/zinc/25/17/63/205251763.db2.gz	HPGJFSQSGOEBLG-CPUCHLNUSA-N	0	0	362.430	2.700	50	5		FFBARN
O=C(NCc1ccccc1[N+](=O)[O-])c1cccc(CN2CCCC2=O)c1	ZINC000059306906	205280760	/nfs/dbraw/zinc/28/07/60/205280760.db2.gz	RCWIMWSCEGPOAE-UHFFFAOYSA-N	0	0	353.378	2.647	50	5		FFBARN
CCOC(=O)CN(C(=O)COc1cccc([N+](=O)[O-])c1C)c1ccccc1	ZINC000059012770	205279834	/nfs/dbraw/zinc/27/98/34/205279834.db2.gz	DEKMYAFPMYVJCX-UHFFFAOYSA-N	0	0	372.377	2.878	50	5		FFBARN
COc1cccc(-c2noc(CNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000096277899	205870958	/nfs/dbraw/zinc/87/09/58/205870958.db2.gz	XJKPXZAGICPBPU-UHFFFAOYSA-N	0	0	354.322	2.583	50	5		FFBARN
CCCCN(C)C(=O)C1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000048273907	206082411	/nfs/dbraw/zinc/08/24/11/206082411.db2.gz	SNICQTVGDCQXCR-UHFFFAOYSA-N	0	0	373.457	2.873	50	5		FFBARN
O=C(N[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccccc1[N+](=O)[O-]	ZINC000004497484	206177782	/nfs/dbraw/zinc/17/77/82/206177782.db2.gz	KVKSDHBZIIWYRI-LBPRGKRZSA-N	0	0	359.769	2.784	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)c3ccccc3[N+](=O)[O-])CC2=O)cc1C	ZINC000004497022	206178161	/nfs/dbraw/zinc/17/81/61/206178161.db2.gz	UFBOURGUGADEMV-AWEZNQCLSA-N	0	0	353.378	2.747	50	5		FFBARN
CCN(Cc1ccc2c(c1)OCO2)C(=O)COc1cccc([N+](=O)[O-])c1	ZINC000007489141	206209105	/nfs/dbraw/zinc/20/91/05/206209105.db2.gz	BONQYPBGRRCBDU-UHFFFAOYSA-N	0	0	358.350	2.751	50	5		FFBARN
C[C@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007705935	206211650	/nfs/dbraw/zinc/21/16/50/206211650.db2.gz	CLHQAKMIHBZIGO-NSHDSACASA-N	0	0	372.333	2.550	50	5		FFBARN
C[C@@H](NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000006646328	206203874	/nfs/dbraw/zinc/20/38/74/206203874.db2.gz	XELDYPPXWBJDHL-LLVKDONJSA-N	0	0	359.407	2.663	50	5		FFBARN
CC[C@H](Sc1ncnc2[nH]cnc21)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000013572007	206302738	/nfs/dbraw/zinc/30/27/38/206302738.db2.gz	KLRWJKSIVSBIIS-NSHDSACASA-N	0	0	358.383	2.771	50	5		FFBARN
O=[N+]([O-])c1cc(Br)c(N2CCOCC2)c(Br)c1	ZINC000098063975	132231574	/nfs/dbraw/zinc/23/15/74/132231574.db2.gz	HGNJTFMXJYHFDU-UHFFFAOYSA-N	0	0	366.009	2.956	50	5		FFBARN
Cc1nc(N2C[C@@H](C)O[C@H](C)C2)nc(NCc2ccccc2)c1[N+](=O)[O-]	ZINC000036708814	132940282	/nfs/dbraw/zinc/94/02/82/132940282.db2.gz	KQLQYQVFYCWXEY-CHWSQXEVSA-N	0	0	357.414	2.919	50	5		FFBARN
COc1cccc([C@@H]2c3c(c4ccccc4oc3=O)OC(N)=C2[N+](=O)[O-])c1	ZINC000000716294	506230200	/nfs/dbraw/zinc/23/02/00/506230200.db2.gz	SJLQZJOQJWFCNE-CQSZACIVSA-N	0	0	366.329	2.730	50	5	biogenic	FFBARN
COc1ccc(OC)c(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c1	ZINC000000674779	506228746	/nfs/dbraw/zinc/22/87/46/506228746.db2.gz	DLCGAWXCZJIQLH-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
O=C(CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)Nc1cccc(Cl)c1	ZINC000000850474	506236884	/nfs/dbraw/zinc/23/68/84/506236884.db2.gz	PIEHGHPPNMAQPX-UHFFFAOYSA-N	0	0	373.752	2.873	50	5		FFBARN
O=C(NC1CC1)c1ccc(NCCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1	ZINC000032869640	506305090	/nfs/dbraw/zinc/30/50/90/506305090.db2.gz	KCZXDZSKOCNKHG-UHFFFAOYSA-N	0	0	369.377	2.870	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccnc(N2CCCC2)c1	ZINC000032906155	506309405	/nfs/dbraw/zinc/30/94/05/506309405.db2.gz	UCXHAXJPGYAEKT-UHFFFAOYSA-N	0	0	372.450	2.999	50	5		FFBARN
C[C@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000033040260	506328149	/nfs/dbraw/zinc/32/81/49/506328149.db2.gz	GZNWYFRJXODHLJ-IXDOHACOSA-N	0	0	374.485	2.895	50	5		FFBARN
COc1ccc(NC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000004688559	506387979	/nfs/dbraw/zinc/38/79/79/506387979.db2.gz	BTOUAEVJKDGETI-UHFFFAOYSA-N	0	0	356.382	2.958	50	5		FFBARN
Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)C(=O)[C@@H]2C)cc1	ZINC000037275864	506423263	/nfs/dbraw/zinc/42/32/63/506423263.db2.gz	IKQUFFXPOUOJQI-AWEZNQCLSA-N	0	0	353.378	2.781	50	5		FFBARN
COC(=O)c1cc(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)ccc1F	ZINC000040079879	506463426	/nfs/dbraw/zinc/46/34/26/506463426.db2.gz	TZFDMNMYQDVNDI-UHFFFAOYSA-N	0	0	358.285	2.649	50	5		FFBARN
CC(=O)N1CCc2cc(N[C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)ccc21	ZINC000012562213	506879867	/nfs/dbraw/zinc/87/98/67/506879867.db2.gz	ZGSWCJXDKVARGK-GFCCVEGCSA-N	0	0	368.393	2.943	50	5		FFBARN
CCCCc1nnc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)s1	ZINC000013004017	506923226	/nfs/dbraw/zinc/92/32/26/506923226.db2.gz	PXEJFUZKBVUXCA-UHFFFAOYSA-N	0	0	373.398	2.622	50	5		FFBARN
COC(=O)c1cc(C(=O)OCc2cc(-c3ccco3)on2)cc([N+](=O)[O-])c1	ZINC000018221944	507146509	/nfs/dbraw/zinc/14/65/09/507146509.db2.gz	WPSDKUYPKZPPSS-UHFFFAOYSA-N	0	0	372.289	2.986	50	5		FFBARN
Cc1ccc(NC(=O)CN(C)Cc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1	ZINC000019541854	507176911	/nfs/dbraw/zinc/17/69/11/507176911.db2.gz	GDEGDJTZJVGETD-UHFFFAOYSA-N	0	0	357.366	2.702	50	5		FFBARN
CC(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)O[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000020945988	507239676	/nfs/dbraw/zinc/23/96/76/507239676.db2.gz	ARYSLTABGDLXAB-MRXNPFEDSA-N	0	0	356.294	2.742	50	5		FFBARN
O=C(c1ccoc1)N1CCC(Nc2nc3sccn3c2[N+](=O)[O-])CC1	ZINC000024207103	507398419	/nfs/dbraw/zinc/39/84/19/507398419.db2.gz	CDCDFEZKNLTBPN-UHFFFAOYSA-N	0	0	361.383	2.614	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000024659943	507427574	/nfs/dbraw/zinc/42/75/74/507427574.db2.gz	XHYUMJBVBBMQMU-ZDUSSCGKSA-N	0	0	358.350	2.515	50	5		FFBARN
Cc1ccc(NC(=O)CS(=O)(=O)c2ccc(Cl)cc2)cc1[N+](=O)[O-]	ZINC000024713730	507432747	/nfs/dbraw/zinc/43/27/47/507432747.db2.gz	DWZCGTNWPQGFHF-UHFFFAOYSA-N	0	0	368.798	2.969	50	5		FFBARN
C[C@H](Cn1cccn1)NC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000024807500	507440303	/nfs/dbraw/zinc/44/03/03/507440303.db2.gz	NVCQUKFZNSJCSW-CQSZACIVSA-N	0	0	357.414	2.600	50	5		FFBARN
COc1ccc(CN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C2CC2)cc1	ZINC000027366170	507650726	/nfs/dbraw/zinc/65/07/26/507650726.db2.gz	DQSDKDRQBFVMRH-UHFFFAOYSA-N	0	0	355.394	2.867	50	5		FFBARN
CNc1ccc(C(=O)NC[C@H](c2ccccc2OC)N(C)C)cc1[N+](=O)[O-]	ZINC000027569363	507666774	/nfs/dbraw/zinc/66/67/74/507666774.db2.gz	SCFUPTXDYUCQLL-QGZVFWFLSA-N	0	0	372.425	2.678	50	5		FFBARN
C[C@@H]1CN(C(=O)c2cc(F)cc([N+](=O)[O-])c2Br)C[C@H](C)O1	ZINC000079064709	507929520	/nfs/dbraw/zinc/92/95/20/507929520.db2.gz	KEKDZKSTYYDXQC-OCAPTIKFSA-N	0	0	361.167	2.746	50	5		FFBARN
CNC(=O)c1ccc(N(Cc2ccccc2)[C@H](C)CCO)c([N+](=O)[O-])c1	ZINC000092962679	508110969	/nfs/dbraw/zinc/11/09/69/508110969.db2.gz	SUCZHEHPPCEQAB-CQSZACIVSA-N	0	0	357.410	2.732	50	5		FFBARN
CS(=O)(=O)c1ccc(C(=O)N(C2CC2)C2CCCC2)cc1[N+](=O)[O-]	ZINC000075633553	508123470	/nfs/dbraw/zinc/12/34/70/508123470.db2.gz	UEGRPOQZCRAPIY-UHFFFAOYSA-N	0	0	352.412	2.546	50	5		FFBARN
CCCCCn1ccc2cc3ccn(-c4nnc(C)[nH]4)c(=O)c3cc2c1=O	ZINC000095115672	508173772	/nfs/dbraw/zinc/17/37/72/508173772.db2.gz	MVUYIUXSUSISOR-UHFFFAOYSA-N	0	0	363.421	2.922	50	5		FFBARN
COC(=O)[C@@H](C)NC(=O)c1ccc(N2CCCCCCC2)c([N+](=O)[O-])c1	ZINC000084098749	508265469	/nfs/dbraw/zinc/26/54/69/508265469.db2.gz	ZJKKCJCRSNTBOX-CYBMUJFWSA-N	0	0	363.414	2.657	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(N2C[C@@H]3[C@H](C2)OCCN3Cc2ccccc2)c1	ZINC000230277179	509435505	/nfs/dbraw/zinc/43/55/05/509435505.db2.gz	AKLMTCGIMJQNNS-UXHICEINSA-N	0	0	369.421	2.693	50	5		FFBARN
CN(C)C(=O)CN(C)C(=O)c1ccc(Sc2ccccc2)c([N+](=O)[O-])c1	ZINC000253417171	509880387	/nfs/dbraw/zinc/88/03/87/509880387.db2.gz	KESBUYRGFLQMGV-UHFFFAOYSA-N	0	0	373.434	2.906	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)C(F)F)ccc1N1CC(C(F)(F)F)C1	ZINC000253426982	509880555	/nfs/dbraw/zinc/88/05/55/509880555.db2.gz	CQMPWKOPTDFXDB-UHFFFAOYSA-N	0	0	360.260	2.590	50	5		FFBARN
COC(=O)[C@@H](NC(=O)c1ccnc(-c2ccccc2)c1[N+](=O)[O-])C(C)C	ZINC000253428207	509883084	/nfs/dbraw/zinc/88/30/84/509883084.db2.gz	PNDGKFWZPIMDPK-AWEZNQCLSA-N	0	0	357.366	2.584	50	5		FFBARN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2N1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000245224693	509884678	/nfs/dbraw/zinc/88/46/78/509884678.db2.gz	BRTBDCZMCJQSEH-MJEQTWJJSA-N	0	0	358.398	2.708	50	5		FFBARN
CC(C)Cn1ncc2cc(C(=O)NCCc3cccc([N+](=O)[O-])c3)cnc21	ZINC000089835269	519537889	/nfs/dbraw/zinc/53/78/89/519537889.db2.gz	UWIFHMURUWJJOH-UHFFFAOYSA-N	0	0	367.409	2.968	50	5		FFBARN
Cc1ccc(NC(=O)CSc2nnnn2C2CCCC2)cc1[N+](=O)[O-]	ZINC000013005069	525086520	/nfs/dbraw/zinc/08/65/20/525086520.db2.gz	WNVXYHGLBRZBPB-UHFFFAOYSA-N	0	0	362.415	2.736	50	5		FFBARN
CC(=O)c1ccc(N2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000001053759	534851056	/nfs/dbraw/zinc/85/10/56/534851056.db2.gz	FWPXMQAOGQMDFJ-UHFFFAOYSA-N	0	0	353.378	2.760	50	5		FFBARN
O=C(/C=C\c1cc2c(cc1[N+](=O)[O-])OCO2)Nc1ccc2c(c1)OCCO2	ZINC000096878924	964059010	/nfs/dbraw/zinc/05/90/10/964059010.db2.gz	WCBDYXYAFCFUMW-RJRFIUFISA-N	0	0	370.317	2.747	50	5		FFBARN
COc1cc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc2c1OCO2	ZINC000055031458	1018241494	/nfs/dbraw/zinc/24/14/94/1018241494.db2.gz	FMOLHHICKNMUMF-UHFFFAOYSA-N	0	0	371.393	2.654	50	5		FFBARN
Cc1ccc(O[C@@H](C(=O)N2CCOCC2)c2ccccc2)c([N+](=O)[O-])c1	ZINC000007181268	219794816	/nfs/dbraw/zinc/79/48/16/219794816.db2.gz	QGZIMLHSVWPOQZ-GOSISDBHSA-N	0	0	356.378	2.882	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)cc1	ZINC000001429852	204007584	/nfs/dbraw/zinc/00/75/84/204007584.db2.gz	JVVLZBOBYIPXLW-UHFFFAOYSA-N	0	0	359.386	2.785	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-c2ccccc2[N+](=O)[O-])o1	ZINC000001464521	204010025	/nfs/dbraw/zinc/01/00/25/204010025.db2.gz	KCEGUEFIAVHRBT-HNNXBMFYSA-N	0	0	357.322	2.656	50	5		FFBARN
O=C(Nc1cc(SCCO)cc([N+](=O)[O-])c1)c1ccc2c(c1)OCO2	ZINC000002503741	204043026	/nfs/dbraw/zinc/04/30/26/204043026.db2.gz	MXLKSHWFYLMHNO-UHFFFAOYSA-N	0	0	362.363	2.660	50	5		FFBARN
Cc1nc(-c2ccc([N+](=O)[O-])cc2)nn1CNC(=O)c1ccc(C)cc1	ZINC000003082477	204078534	/nfs/dbraw/zinc/07/85/34/204078534.db2.gz	CIRZVQJWASAOFU-UHFFFAOYSA-N	0	0	351.366	2.858	50	5		FFBARN
Cc1cc(=O)oc2ccc(OC(=O)COc3ccccc3[N+](=O)[O-])cc12	ZINC000002725706	204053060	/nfs/dbraw/zinc/05/30/60/204053060.db2.gz	VXNNXRYNZJDWMM-UHFFFAOYSA-N	0	0	355.302	2.994	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2cc([N+](=O)[O-])ccc2F)cc([N+](=O)[O-])c1	ZINC000002743030	204054259	/nfs/dbraw/zinc/05/42/59/204054259.db2.gz	NYCDASDKBZMRMZ-UHFFFAOYSA-N	0	0	363.257	2.681	50	5		FFBARN
Cc1c(Cl)cccc1NC(=O)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002787818	204056639	/nfs/dbraw/zinc/05/66/39/204056639.db2.gz	PXJKOEKZSCFQJZ-UHFFFAOYSA-N	0	0	360.761	2.708	50	5		FFBARN
O=C(NCc1ccc(F)cc1)c1ccccc1Cn1cc([N+](=O)[O-])cn1	ZINC000002795460	204057825	/nfs/dbraw/zinc/05/78/25/204057825.db2.gz	DYWSWZYEBIBTFX-UHFFFAOYSA-N	0	0	354.341	2.909	50	5		FFBARN
O=C([O-])[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC1=CCCCC1	ZINC000002852846	204062159	/nfs/dbraw/zinc/06/21/59/204062159.db2.gz	QXGYVMCWQXLZCL-INIZCTEOSA-N	0	0	361.398	2.857	50	5		FFBARN
Cc1cc(OC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1C(=O)CCC1=O	ZINC000002860813	204063147	/nfs/dbraw/zinc/06/31/47/204063147.db2.gz	DLICSSLDMJIJTB-UHFFFAOYSA-N	0	0	354.318	2.776	50	5		FFBARN
CCCCOC(=O)C1C(C)=Nc2ncnn2[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000003907121	204115146	/nfs/dbraw/zinc/11/51/46/204115146.db2.gz	UERDQUGJKKYWFK-HNNXBMFYSA-N	0	0	357.370	2.819	50	5		FFBARN
Nn1c(Cc2ccccc2F)nnc1SCc1ccc([N+](=O)[O-])cc1	ZINC000003520423	204104786	/nfs/dbraw/zinc/10/47/86/204104786.db2.gz	UYMFIDMIOUFBFN-UHFFFAOYSA-N	0	0	359.386	2.922	50	5		FFBARN
CN1C2=C(C(=O)N(c3ccc([N+](=O)[O-])cc3)C2)[C@H](c2ccccc2)NC1=O	ZINC000004726729	204159626	/nfs/dbraw/zinc/15/96/26/204159626.db2.gz	ZPXSNTMZLSLATH-KRWDZBQOSA-N	0	0	364.361	2.592	50	5		FFBARN
CCCC1=Nc2ncnn2[C@H](c2cccc([N+](=O)[O-])c2)C1C(=O)OCC	ZINC000004777016	204162690	/nfs/dbraw/zinc/16/26/90/204162690.db2.gz	PYNMSDZSXQLGKT-OAHLLOKOSA-N	0	0	357.370	2.819	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@@H]2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000004256033	204129324	/nfs/dbraw/zinc/12/93/24/204129324.db2.gz	BQRURLIZQQYDGS-DRZCJDIDSA-N	0	0	359.382	2.955	50	5		FFBARN
COc1cc2c(cc1OC)CN(C(=O)COc1ccc([N+](=O)[O-])cc1)CC2	ZINC000005111592	204191561	/nfs/dbraw/zinc/19/15/61/204191561.db2.gz	SOSANADIJCUBJM-UHFFFAOYSA-N	0	0	372.377	2.576	50	5		FFBARN
C[C@@H](Sc1nnc2ccccn21)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000005212918	204198242	/nfs/dbraw/zinc/19/82/42/204198242.db2.gz	CNEMDKINOKEPJE-SECBINFHSA-N	0	0	361.358	2.896	50	5		FFBARN
COc1cc(/C=C/C(=O)Oc2cccc([N+](=O)[O-])c2)cc2c1OCCO2	ZINC000007782200	204306772	/nfs/dbraw/zinc/30/67/72/204306772.db2.gz	PZDPLEJBBOGZIP-AATRIKPKSA-N	0	0	357.318	2.993	50	5		FFBARN
O=C(NC[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Br	ZINC000007842712	204308832	/nfs/dbraw/zinc/30/88/32/204308832.db2.gz	DQTJTVRSILBAIX-CQSZACIVSA-N	0	0	365.183	2.821	50	5		FFBARN
Cc1nn(-c2ccccc2)c(C)c1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000008328946	204327499	/nfs/dbraw/zinc/32/74/99/204327499.db2.gz	LLKLGZZDRRBRDV-UHFFFAOYSA-N	0	0	368.397	2.849	50	5		FFBARN
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2ccc(F)cc2)C1=O	ZINC000008645842	204337653	/nfs/dbraw/zinc/33/76/53/204337653.db2.gz	JYFHXRYGALUOTQ-GOSISDBHSA-N	0	0	373.340	2.580	50	5		FFBARN
Cc1ccc(-c2nonc2NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1	ZINC000008915701	204348818	/nfs/dbraw/zinc/34/88/18/204348818.db2.gz	JZVRKZNSFPHMQX-UHFFFAOYSA-N	0	0	354.322	2.971	50	5		FFBARN
Cc1ccc(OCCCCN2C(=O)c3ccccc3C2=O)c([N+](=O)[O-])n1	ZINC000009121226	204355373	/nfs/dbraw/zinc/35/53/73/204355373.db2.gz	MJEZBTFPMUBSFT-UHFFFAOYSA-N	0	0	355.350	2.753	50	5		FFBARN
COc1cc(/C=C/C(=O)Nc2ccn(C)n2)c([N+](=O)[O-])cc1OC(F)F	ZINC000009314205	204362223	/nfs/dbraw/zinc/36/22/23/204362223.db2.gz	XKAVQBSSDJNORE-ONEGZZNKSA-N	0	0	368.296	2.590	50	5		FFBARN
O=[N+]([O-])c1ccccc1NCCNc1ccc2nnc(C(F)(F)F)n2n1	ZINC000009321988	204363946	/nfs/dbraw/zinc/36/39/46/204363946.db2.gz	OPFPSCAINOXZHR-UHFFFAOYSA-N	0	0	367.291	2.575	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1ncc2ccccn21	ZINC000009467037	204369601	/nfs/dbraw/zinc/36/96/01/204369601.db2.gz	KBJRQTUIPFNPSD-UHFFFAOYSA-N	0	0	358.379	2.982	50	5		FFBARN
C[C@@H](c1ccc(-n2cncn2)cc1)N(C)C(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000015095432	204604688	/nfs/dbraw/zinc/60/46/88/204604688.db2.gz	OFXGLZAOHRTQBH-AWEZNQCLSA-N	0	0	365.393	2.938	50	5		FFBARN
CCc1onc(C)c1[C@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000033087001	204956755	/nfs/dbraw/zinc/95/67/55/204956755.db2.gz	INNKLMPUOGPVFN-CQSZACIVSA-N	0	0	365.411	2.979	50	5		FFBARN
Cc1nn(C)c2c1[C@@H](c1cc3c(cc1[N+](=O)[O-])OCO3)SCC(=O)N2	ZINC000061720331	205286778	/nfs/dbraw/zinc/28/67/78/205286778.db2.gz	QLRWYZBWWFANFG-CQSZACIVSA-N	0	0	362.367	2.790	50	5		FFBARN
CS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@H]2n2cccn2)c([N+](=O)[O-])c1	ZINC000072307297	205506464	/nfs/dbraw/zinc/50/64/64/205506464.db2.gz	MSARCKFXDSCXHQ-UKRRQHHQSA-N	0	0	364.427	2.791	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccccc1OC	ZINC000003466007	206161767	/nfs/dbraw/zinc/16/17/67/206161767.db2.gz	NGGMCFLZJVIDET-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
Cc1csc(NC(=O)C2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)n1	ZINC000058168210	206394744	/nfs/dbraw/zinc/39/47/44/206394744.db2.gz	FZMAFBUKJXPLPC-UHFFFAOYSA-N	0	0	374.422	2.851	50	5		FFBARN
Cc1ccc([C@H](CNC(=O)c2cccc(C)c2[N+](=O)[O-])N2CCOCC2)o1	ZINC000022873024	206395482	/nfs/dbraw/zinc/39/54/82/206395482.db2.gz	NYPRANVNTDZWPD-INIZCTEOSA-N	0	0	373.409	2.608	50	5		FFBARN
NC(=O)C1CCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])CC1	ZINC000006866831	132258660	/nfs/dbraw/zinc/25/86/60/132258660.db2.gz	WTIISBPFCHKRHK-UHFFFAOYSA-N	0	0	353.378	2.528	50	5		FFBARN
CCOc1ccc(N2C(=O)Cc3ccc(OC)cc3C2=O)c([N+](=O)[O-])c1	ZINC000006844896	132258790	/nfs/dbraw/zinc/25/87/90/132258790.db2.gz	XBJXITJWPPFLSB-UHFFFAOYSA-N	0	0	356.334	2.732	50	5		FFBARN
O=C(NCc1ccccc1F)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004901396	132825266	/nfs/dbraw/zinc/82/52/66/132825266.db2.gz	QMBBQISTXXYVMX-UHFFFAOYSA-N	0	0	359.357	2.501	50	5		FFBARN
CCOC(=O)C1=C(C)N(C)C(=O)N[C@H]1c1cc([N+](=O)[O-])ccc1OCC	ZINC000000670969	506226444	/nfs/dbraw/zinc/22/64/44/506226444.db2.gz	MWKJKUYFXFTTDK-HNNXBMFYSA-N	0	0	363.370	2.527	50	5		FFBARN
Cn1c2c3cnc4ccccc4n3c(-c3ccccc3)c2c(=O)n(C)c1=O	ZINC000000804801	506233426	/nfs/dbraw/zinc/23/34/26/506233426.db2.gz	YVZVATKCIBNZNI-UHFFFAOYSA-N	0	0	356.385	2.705	50	5		FFBARN
COc1ccc(-c2cnc(NC(=O)c3cccc([N+](=O)[O-])c3)n2C)cc1	ZINC000000819548	506235262	/nfs/dbraw/zinc/23/52/62/506235262.db2.gz	AUMIKOQFGMBSLI-UHFFFAOYSA-N	0	0	352.350	2.678	50	5		FFBARN
Cc1nc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)sc1C(=O)N(C)C	ZINC000001113463	506250652	/nfs/dbraw/zinc/25/06/52/506250652.db2.gz	ZXRJYFAXNDYYRX-BQYQJAHWSA-N	0	0	360.395	2.713	50	5		FFBARN
CCOC(=O)c1ccccc1NC(=O)c1cc(C(=O)OC)cc([N+](=O)[O-])c1	ZINC000001206529	506253853	/nfs/dbraw/zinc/25/38/53/506253853.db2.gz	KEUXLTCDNYXNEW-UHFFFAOYSA-N	0	0	372.333	2.810	50	5		FFBARN
CC1CCN(S(=O)(=O)c2ccc(N(C)C3CC3)c([N+](=O)[O-])c2)CC1	ZINC000032823980	506300281	/nfs/dbraw/zinc/30/02/81/506300281.db2.gz	PKMRZCFPVWOELT-UHFFFAOYSA-N	0	0	353.444	2.614	50	5		FFBARN
Cc1nc(CCNC(=O)c2ccn(-c3cccc([N+](=O)[O-])c3)n2)cs1	ZINC000032939051	506316088	/nfs/dbraw/zinc/31/60/88/506316088.db2.gz	GOWZPLKJNMOYSY-UHFFFAOYSA-N	0	0	357.395	2.518	50	5		FFBARN
COC(=O)c1cccc(NS(=O)(=O)c2ccc(C)c([N+](=O)[O-])c2)c1C	ZINC000005000154	506414214	/nfs/dbraw/zinc/41/42/14/506414214.db2.gz	WGMYNIRRKXOJCE-UHFFFAOYSA-N	0	0	364.379	2.799	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000012390971	506857509	/nfs/dbraw/zinc/85/75/09/506857509.db2.gz	RAOXDKLGZBGTHG-CQSZACIVSA-N	0	0	351.366	2.657	50	5		FFBARN
Nc1ccc(C(=O)Nc2cccc(OC[C@@H]3CCCO3)c2)cc1[N+](=O)[O-]	ZINC000012539942	506873826	/nfs/dbraw/zinc/87/38/26/506873826.db2.gz	HCRGBFXOFMWZBT-HNNXBMFYSA-N	0	0	357.366	2.987	50	5		FFBARN
COc1cc(C(=O)NCCOc2ccccc2F)c([N+](=O)[O-])cc1OC	ZINC000012770727	506897903	/nfs/dbraw/zinc/89/79/03/506897903.db2.gz	VNLMRWYRNCUUKI-UHFFFAOYSA-N	0	0	364.329	2.560	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)NC2CCC(C(F)(F)F)CC2)cc1	ZINC000012782963	506900462	/nfs/dbraw/zinc/90/04/62/506900462.db2.gz	DBNFVXOKUHNZNH-UHFFFAOYSA-N	0	0	352.334	2.994	50	5		FFBARN
Cc1cc([C@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)no1	ZINC000012948902	506918268	/nfs/dbraw/zinc/91/82/68/506918268.db2.gz	ODEMPCJXNBNRBT-CQSZACIVSA-N	0	0	351.384	2.725	50	5		FFBARN
O=C(c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)N1CCc2sccc2C1	ZINC000014804069	507000513	/nfs/dbraw/zinc/00/05/13/507000513.db2.gz	ONAIMTMQHVOJJC-UHFFFAOYSA-N	0	0	373.434	2.691	50	5		FFBARN
CCOC(=O)C1=C(C)N(CC)C(=O)N[C@@H]1c1ccc(OC)c([N+](=O)[O-])c1	ZINC000015016958	507012101	/nfs/dbraw/zinc/01/21/01/507012101.db2.gz	LEMRLNVKFMWNBS-OAHLLOKOSA-N	0	0	363.370	2.527	50	5		FFBARN
Cc1ccn2c(c1)nc(C)c(NC(=O)c1ccc([N+](=O)[O-])c(C)c1)c2=O	ZINC000015865277	507064971	/nfs/dbraw/zinc/06/49/71/507064971.db2.gz	ATBBYRVHUBOOEC-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccccc1[N+](=O)[O-]	ZINC000019204753	507157609	/nfs/dbraw/zinc/15/76/09/507157609.db2.gz	WFNGAIVVQLEDRI-UHFFFAOYSA-N	0	0	374.393	2.956	50	5		FFBARN
COc1cc(CN2CC[NH+](Cc3ccccc3)CC2)cc([N+](=O)[O-])c1[O-]	ZINC000019537477	507176737	/nfs/dbraw/zinc/17/67/37/507176737.db2.gz	ZSASJJCKLIHXAY-UHFFFAOYSA-N	0	0	357.410	2.627	50	5		FFBARN
CCOc1ccc(S(=O)(=O)n2c(C)ncc2[N+](=O)[O-])c2ccccc12	ZINC000019943360	507207149	/nfs/dbraw/zinc/20/71/49/507207149.db2.gz	CTORBJSVRSYXRM-UHFFFAOYSA-N	0	0	361.379	2.889	50	5		FFBARN
O=c1[nH]c2cc([N+](=O)[O-])ccc2nc1Cc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000020806679	507235565	/nfs/dbraw/zinc/23/55/65/507235565.db2.gz	DZIKUJXKMRFTNO-UHFFFAOYSA-N	0	0	360.713	2.984	50	5		FFBARN
O=C(CN1CSCC1=O)OCc1cc(=O)oc2ccc3ccccc3c12	ZINC000021374405	507252087	/nfs/dbraw/zinc/25/20/87/507252087.db2.gz	NGWANYFWTCDAQH-UHFFFAOYSA-N	0	0	369.398	2.522	50	5		FFBARN
COc1ccc(NC(=O)N(C)Cc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1	ZINC000023392756	507350599	/nfs/dbraw/zinc/35/05/99/507350599.db2.gz	OEWKVEWPVKUISW-UHFFFAOYSA-N	0	0	359.338	2.996	50	5		FFBARN
CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000058407682	507414245	/nfs/dbraw/zinc/41/42/45/507414245.db2.gz	RMGOSKGIDOVKIK-UHFFFAOYSA-N	0	0	363.414	2.858	50	5		FFBARN
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NC[C@@H]1Cc2ccccc2O1	ZINC000026865359	507615299	/nfs/dbraw/zinc/61/52/99/507615299.db2.gz	QMZIAYCOHBBECT-LBPRGKRZSA-N	0	0	368.798	2.530	50	5		FFBARN
CCSc1nc2c(n1C)CCN(C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2	ZINC000071414405	507702552	/nfs/dbraw/zinc/70/25/52/507702552.db2.gz	AXECXEOFBIOYBP-INIZCTEOSA-N	0	0	362.455	2.532	50	5		FFBARN
CCc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1N	ZINC000072312575	507775543	/nfs/dbraw/zinc/77/55/43/507775543.db2.gz	GKWYWZMFBMSZKM-NSHDSACASA-N	0	0	357.366	2.923	50	5		FFBARN
O=[N+]([O-])c1ccc(Br)c(S(=O)(=O)N2CCCCCC2)c1	ZINC000078876339	507914249	/nfs/dbraw/zinc/91/42/49/507914249.db2.gz	KULRSRABSJRKII-UHFFFAOYSA-N	0	0	363.233	2.922	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N1CCCC[C@H]1c1ncc[nH]1	ZINC000079092260	507932202	/nfs/dbraw/zinc/93/22/02/507932202.db2.gz	PRNHJEANDYWOCD-ZDUSSCGKSA-N	0	0	350.400	2.542	50	5		FFBARN
C[C@]1(CCc2ccccc2)CCN(c2ncc([N+](=O)[O-])cc2C(N)=O)C1	ZINC000075106853	508083444	/nfs/dbraw/zinc/08/34/44/508083444.db2.gz	BNNMYMDISSKILM-IBGZPJMESA-N	0	0	354.410	2.938	50	5		FFBARN
O=C(Nc1nccs1)c1cc([N+](=O)[O-])ccc1NC(=O)C(F)(F)F	ZINC000094992647	508172022	/nfs/dbraw/zinc/17/20/22/508172022.db2.gz	SXFVOAWVUJSOTJ-UHFFFAOYSA-N	0	0	360.273	2.804	50	5		FFBARN
COC(=O)[C@@H]1c2ccccc2CCN1CCOc1cccc([N+](=O)[O-])c1	ZINC000095405168	508184185	/nfs/dbraw/zinc/18/41/85/508184185.db2.gz	ZRQLEERNAMZZRX-SFHVURJKSA-N	0	0	356.378	2.746	50	5		FFBARN
CN(CCCCNC(=O)c1cc([N+](=O)[O-])c(N)cc1F)c1ccccc1	ZINC000253405950	509877172	/nfs/dbraw/zinc/87/71/72/509877172.db2.gz	UMUOZRZNZWWSHN-UHFFFAOYSA-N	0	0	360.389	2.963	50	5		FFBARN
CCn1c(=O)c2ccccc2c2c(O)nc(-c3cccc([N+](=O)[O-])c3)n21	ZINC000102224308	570829339	/nfs/dbraw/zinc/82/93/39/570829339.db2.gz	UNDAOYKJLGZTDW-UHFFFAOYSA-N	0	0	350.334	2.950	50	5		FFBARN
O=C1[C@H](Oc2cccnc2[N+](=O)[O-])CCN1c1ccccc1OC(F)F	ZINC000115964068	570927130	/nfs/dbraw/zinc/92/71/30/570927130.db2.gz	MOSBZOPBYFCDTP-CYBMUJFWSA-N	0	0	365.292	2.776	50	5		FFBARN
CCOC(=O)C1=CN(C)C=C(C(=O)OCC)C1c1ccc([N+](=O)[O-])cc1	ZINC000001123400	219374185	/nfs/dbraw/zinc/37/41/85/219374185.db2.gz	SHDNVUAIMVMEMV-UHFFFAOYSA-N	0	0	360.366	2.518	50	5		FFBARN
C[C@H](OC(=O)c1ccc([N+](=O)[O-])s1)C(=O)Nc1ccc2c(c1)OCO2	ZINC000003496280	219515033	/nfs/dbraw/zinc/51/50/33/219515033.db2.gz	BBAFSOYGHSZXAV-QMMMGPOBSA-N	0	0	364.335	2.569	50	5		FFBARN
C[C@@H](C(=O)Nc1nnc(CCc2ccccc2)s1)n1cc([N+](=O)[O-])cn1	ZINC000001432066	204006503	/nfs/dbraw/zinc/00/65/03/204006503.db2.gz	LCSGRBAZPVUZKV-NSHDSACASA-N	0	0	372.410	2.628	50	5		FFBARN
CCN(CC)C(=O)c1ccc2c(c1)C(=O)N(c1cccc([N+](=O)[O-])c1)C2=O	ZINC000001508486	204011318	/nfs/dbraw/zinc/01/13/18/204011318.db2.gz	VXAJOPVMCLJVQA-UHFFFAOYSA-N	0	0	367.361	2.877	50	5		FFBARN
CCSc1nnc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)s1	ZINC000002187081	204028360	/nfs/dbraw/zinc/02/83/60/204028360.db2.gz	CAAOMJNRPWTFSC-UHFFFAOYSA-N	0	0	355.357	2.719	50	5		FFBARN
Cc1cc(C)n(C[C@H]2CC(=O)N(c3ccc(Cl)c([N+](=O)[O-])c3)C2=O)n1	ZINC000002199726	204028747	/nfs/dbraw/zinc/02/87/47/204028747.db2.gz	TYVWYKYIURXAQM-LLVKDONJSA-N	0	0	362.773	2.641	50	5		FFBARN
COCCn1c(=O)c2c(nc1-c1cccs1)oc1ccccc1c2=O	ZINC000002359920	204035790	/nfs/dbraw/zinc/03/57/90/204035790.db2.gz	LEFBVQRTCFCNLT-UHFFFAOYSA-N	0	0	354.387	2.878	50	5		FFBARN
Cn1c(SCC(=O)c2ccc([N+](=O)[O-])cc2)nnc1-c1cccnc1	ZINC000002865774	204065297	/nfs/dbraw/zinc/06/52/97/204065297.db2.gz	UYXYSYIZFXRWQO-UHFFFAOYSA-N	0	0	355.379	2.760	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000003092318	204078813	/nfs/dbraw/zinc/07/88/13/204078813.db2.gz	YMUNHWZQVPHLKF-INIZCTEOSA-N	0	0	356.294	2.742	50	5		FFBARN
O=C(OCCN1C(=O)c2ccccc2C1=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000003283634	204087104	/nfs/dbraw/zinc/08/71/04/204087104.db2.gz	UCOBPEFPUBRVCN-UHFFFAOYSA-N	0	0	374.736	2.701	50	5		FFBARN
C[C@@H](Cn1cc(Br)cn1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000002794342	204058159	/nfs/dbraw/zinc/05/81/59/204058159.db2.gz	DVDPFIUSOUWDJF-QMMMGPOBSA-N	0	0	371.166	2.968	50	5		FFBARN
Cc1nn(C[C@@H](C)c2nc3c4ccccc4ncn3n2)c(C)c1[N+](=O)[O-]	ZINC000002806576	204060087	/nfs/dbraw/zinc/06/00/87/204060087.db2.gz	VETJZZRNINZYTH-SNVBAGLBSA-N	0	0	351.370	2.803	50	5		FFBARN
O=c1c2ccccc2nc(/C=C/c2cccc([N+](=O)[O-])c2)n1CCCO	ZINC000004093748	204121095	/nfs/dbraw/zinc/12/10/95/204121095.db2.gz	ZUPKJRCGNRNGGM-MDZDMXLPSA-N	0	0	351.362	2.858	50	5		FFBARN
CC[C@H](CO)Nc1ccc(-c2nn(C)c(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000004164339	204125319	/nfs/dbraw/zinc/12/53/19/204125319.db2.gz	ASOVKTAKHFUBAA-CYBMUJFWSA-N	0	0	368.393	2.692	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)cc1	ZINC000004618848	204150407	/nfs/dbraw/zinc/15/04/07/204150407.db2.gz	QFINTLPVEFMBBQ-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NC[C@@H]3CCCO3)n2)cc1C	ZINC000004306165	204131742	/nfs/dbraw/zinc/13/17/42/204131742.db2.gz	JKEWGBJXQXXVLM-ZDUSSCGKSA-N	0	0	358.402	2.918	50	5		FFBARN
Cc1cc(C(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)c(C)n1C1CC1	ZINC000004412246	204137921	/nfs/dbraw/zinc/13/79/21/204137921.db2.gz	LGDHEPPQGPMKAG-UHFFFAOYSA-N	0	0	366.377	2.941	50	5		FFBARN
COc1cc(NC(=O)c2ccccc2[N+](=O)[O-])ccc1N1CCCC1=O	ZINC000005440316	204207969	/nfs/dbraw/zinc/20/79/69/204207969.db2.gz	HMILDTNDRAGZSK-UHFFFAOYSA-N	0	0	355.350	2.983	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CSc1n[nH]c(-c2ccncc2)n1	ZINC000005530899	204213912	/nfs/dbraw/zinc/21/39/12/204213912.db2.gz	XRKLUXOKXNMIMQ-UHFFFAOYSA-N	0	0	370.394	2.814	50	5		FFBARN
COc1ccc(OCCC(=O)OCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1	ZINC000004979869	204181557	/nfs/dbraw/zinc/18/15/57/204181557.db2.gz	UKCRORDOGYECEQ-UHFFFAOYSA-N	0	0	374.349	2.554	50	5		FFBARN
Cc1ccc(NC(=O)COC(=O)[C@]2(C)CC2(Cl)Cl)c([N+](=O)[O-])c1	ZINC000005031852	204185946	/nfs/dbraw/zinc/18/59/46/204185946.db2.gz	PCEOBFVMNKGCIX-ZDUSSCGKSA-N	0	0	361.181	2.969	50	5		FFBARN
O=C(CSC1=NCCS1)Nc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000005945618	204232787	/nfs/dbraw/zinc/23/27/87/204232787.db2.gz	OYGLUWHFOGNVJX-UHFFFAOYSA-N	0	0	354.438	2.979	50	5		FFBARN
Cc1cc(=O)c(C(=O)NC2CCCCCC2)nn1-c1ccccc1[N+](=O)[O-]	ZINC000006509146	204250701	/nfs/dbraw/zinc/25/07/01/204250701.db2.gz	TWIVZRLCFHBHHY-UHFFFAOYSA-N	0	0	370.409	2.902	50	5		FFBARN
Cc1ccccc1-c1nnn(CC(=O)Nc2cc([N+](=O)[O-])ccc2Cl)n1	ZINC000006945533	204283931	/nfs/dbraw/zinc/28/39/31/204283931.db2.gz	XIXMHGAMJSSUMA-UHFFFAOYSA-N	0	0	372.772	2.849	50	5		FFBARN
O=C1N[C@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc([N+](=O)[O-])c1	ZINC000006974732	204284594	/nfs/dbraw/zinc/28/45/94/204284594.db2.gz	KMSDGVGSVCQZLP-QGZVFWFLSA-N	0	0	364.361	2.739	50	5		FFBARN
NS(=O)(=O)c1ccc(NCCCCOc2ccccc2)c([N+](=O)[O-])c1	ZINC000007990050	204314342	/nfs/dbraw/zinc/31/43/42/204314342.db2.gz	PJKJNQNYKXMYIA-UHFFFAOYSA-N	0	0	365.411	2.513	50	5		FFBARN
Cc1ccc(-c2nonc2NC(=O)COc2ccccc2[N+](=O)[O-])cc1	ZINC000008915696	204349572	/nfs/dbraw/zinc/34/95/72/204349572.db2.gz	WJKZCRRLATWGEM-UHFFFAOYSA-N	0	0	354.322	2.971	50	5		FFBARN
C[C@H]1CCCCN1C(=O)COc1cc(N2CCCC2=O)ccc1[N+](=O)[O-]	ZINC000008750030	204343546	/nfs/dbraw/zinc/34/35/46/204343546.db2.gz	ULPBOUMMCQNKGD-ZDUSSCGKSA-N	0	0	361.398	2.501	50	5		FFBARN
COc1cc(C(=O)NCCc2ccco2)c([N+](=O)[O-])cc1OC(F)F	ZINC000008751547	204343737	/nfs/dbraw/zinc/34/37/37/204343737.db2.gz	AYXUWFBSIGAQHV-UHFFFAOYSA-N	0	0	356.281	2.770	50	5		FFBARN
CS(=O)(=O)c1cccc(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)c1	ZINC000012804158	204498140	/nfs/dbraw/zinc/49/81/40/204498140.db2.gz	FDESVFZKJMPFLR-UHFFFAOYSA-N	0	0	354.771	2.904	50	5		FFBARN
Cc1cc([C@@H]2CCCN2S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)no1	ZINC000012948899	204512574	/nfs/dbraw/zinc/51/25/74/204512574.db2.gz	ODEMPCJXNBNRBT-AWEZNQCLSA-N	0	0	351.384	2.725	50	5		FFBARN
COCCOc1cc([N+](=O)[O-])c(C(=O)N(C)c2ccccc2)cc1OC	ZINC000022021309	204766612	/nfs/dbraw/zinc/76/66/12/204766612.db2.gz	DBDSTCVFESZQEL-UHFFFAOYSA-N	0	0	360.366	2.905	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)Cc2cccnc2)cc1	ZINC000024864367	204827359	/nfs/dbraw/zinc/82/73/59/204827359.db2.gz	FGZJWHIECNCUKY-UHFFFAOYSA-N	0	0	373.390	2.974	50	5		FFBARN
Cc1ncc([N+](=O)[O-])cc1C(=O)NCc1cccnc1OCC(F)(F)F	ZINC000040074512	205052759	/nfs/dbraw/zinc/05/27/59/205052759.db2.gz	BGQBDRWPJGOWQG-UHFFFAOYSA-N	0	0	370.287	2.564	50	5		FFBARN
COc1ccc(NC(=O)[C@H](C)N(C)Cc2cnc(C)s2)c([N+](=O)[O-])c1	ZINC000040154604	205060782	/nfs/dbraw/zinc/06/07/82/205060782.db2.gz	FTPZBIMUHYWMCP-JTQLQIEISA-N	0	0	364.427	2.827	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cnc2ccc(Cl)cc2c1O	ZINC000044900584	205113453	/nfs/dbraw/zinc/11/34/53/205113453.db2.gz	FBSSRYVMSYRDAD-UHFFFAOYSA-N	0	0	350.743	2.799	50	5		FFBARN
CCN(Cc1ccccc1)C(=O)CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000057028206	205233886	/nfs/dbraw/zinc/23/38/86/205233886.db2.gz	ZBOHDZLVDHLSLH-UHFFFAOYSA-N	0	0	355.394	2.682	50	5		FFBARN
CCS(=O)(=O)c1ccccc1C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000057764075	205243612	/nfs/dbraw/zinc/24/36/12/205243612.db2.gz	KSIBMELGGANTDL-UHFFFAOYSA-N	0	0	352.343	2.780	50	5		FFBARN
Cc1cc(C(=O)NCc2nc(Cc3ccccc3)no2)ccc1[N+](=O)[O-]	ZINC000057991390	205247671	/nfs/dbraw/zinc/24/76/71/205247671.db2.gz	QXOMVCZKODKUOT-UHFFFAOYSA-N	0	0	352.350	2.807	50	5		FFBARN
O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)N1CCNC(=O)CC1	ZINC000065902760	205361748	/nfs/dbraw/zinc/36/17/48/205361748.db2.gz	CHPSOOLJPOXEIR-SOFGYWHQSA-N	0	0	371.418	2.685	50	5		FFBARN
O=C(N[C@@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1cccc([N+](=O)[O-])c1	ZINC000004497485	206178433	/nfs/dbraw/zinc/17/84/33/206178433.db2.gz	AEIBBZCCTLGFGY-CYBMUJFWSA-N	0	0	359.769	2.784	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)c1cc2cc([N+](=O)[O-])ccc2oc1=O	ZINC000004853226	206182032	/nfs/dbraw/zinc/18/20/32/206182032.db2.gz	LSSGWWOTDGYBCL-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
Cc1ccc(OCCOC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)cc1	ZINC000005391164	206192396	/nfs/dbraw/zinc/19/23/96/206192396.db2.gz	PGIAEMYUZVCKOC-UHFFFAOYSA-N	0	0	359.334	2.910	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000005966140	206199415	/nfs/dbraw/zinc/19/94/15/206199415.db2.gz	BVUHETXGAQILNL-NSHDSACASA-N	0	0	371.349	2.737	50	5		FFBARN
Cc1ccc(C(=O)NCCNC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1F	ZINC000013012495	206300313	/nfs/dbraw/zinc/30/03/13/206300313.db2.gz	SPGXLEMTKQWCOG-UHFFFAOYSA-N	0	0	359.357	2.511	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1cccc2c1OCCO2	ZINC000055156695	206341824	/nfs/dbraw/zinc/34/18/24/206341824.db2.gz	ADTPBKZJMCSNMH-NSHDSACASA-N	0	0	373.365	2.814	50	5		FFBARN
O=C(c1ccccn1)N1CCCN(c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000057140647	206383380	/nfs/dbraw/zinc/38/33/80/206383380.db2.gz	WMWPEELGFHHKIW-UHFFFAOYSA-N	0	0	360.801	2.996	50	5		FFBARN
COCCNC(=O)c1ccccc1NC(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000025164888	206416641	/nfs/dbraw/zinc/41/66/41/206416641.db2.gz	IJZWSZJBRJEKIZ-UHFFFAOYSA-N	0	0	357.366	2.532	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC(c2nnc3ccccn32)CC1	ZINC000028735604	206480319	/nfs/dbraw/zinc/48/03/19/206480319.db2.gz	ZYTBUSYXFPYMJT-UHFFFAOYSA-N	0	0	351.366	2.657	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccccc3OC)CC2)cc1[N+](=O)[O-]	ZINC000000834226	132378933	/nfs/dbraw/zinc/37/89/33/132378933.db2.gz	WOIRQJZFVWKCGZ-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
CC(=O)N1CCN(c2ccc(NC(=O)c3cccc([N+](=O)[O-])c3)cc2)CC1	ZINC000000971850	132379418	/nfs/dbraw/zinc/37/94/18/132379418.db2.gz	PNTNSXHRNIJXMP-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
Cc1cc(OCC(=O)Nc2ccc(N3CCOCC3)cc2)ccc1[N+](=O)[O-]	ZINC000001284588	132381497	/nfs/dbraw/zinc/38/14/97/132381497.db2.gz	RMUCSKQZWGRZMN-UHFFFAOYSA-N	0	0	371.393	2.757	50	5		FFBARN
COc1ccccc1N1CCN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000003880232	132385806	/nfs/dbraw/zinc/38/58/06/132385806.db2.gz	WFKKLTZGUVSXFJ-UHFFFAOYSA-N	0	0	358.354	2.838	50	5		FFBARN
C[C@@H](Oc1ccccc1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000004663477	132387062	/nfs/dbraw/zinc/38/70/62/132387062.db2.gz	MCUKTXHBDIWXGN-OAHLLOKOSA-N	0	0	355.394	2.711	50	5		FFBARN
COc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC[C@H](C)C3)n2)c1	ZINC000009287322	132845553	/nfs/dbraw/zinc/84/55/53/132845553.db2.gz	QNQDZMIKRKEKIE-NSHDSACASA-N	0	0	358.402	2.956	50	5		FFBARN
O=C(CCNC(=O)c1cccc([N+](=O)[O-])c1)N1CCCc2ccccc21	ZINC000040122548	136119437	/nfs/dbraw/zinc/11/94/37/136119437.db2.gz	TXRHKCGHYNZIBS-UHFFFAOYSA-N	0	0	353.378	2.694	50	5		FFBARN
C[C@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1ccccc1	ZINC000057140765	136128242	/nfs/dbraw/zinc/12/82/42/136128242.db2.gz	AXPDEFGTVXIDLW-OAHLLOKOSA-N	0	0	354.410	2.832	50	5		FFBARN
O=c1c(=O)c(Nc2ccccc2[N+](=O)[O-])c1Nc1ccccc1[N+](=O)[O-]	ZINC000103682825	222341016	/nfs/dbraw/zinc/34/10/16/222341016.db2.gz	UAEOLBVNBZFLPD-UHFFFAOYSA-N	0	0	354.278	2.586	50	5		FFBARN
C[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)[C@@H]1CCc2ccccc21	ZINC000058412587	263415966	/nfs/dbraw/zinc/41/59/66/263415966.db2.gz	KAFWQVMBCYOQJE-SCLBCKFNSA-N	0	0	367.405	2.859	50	5		FFBARN
CCCC1=C[C@](O)(C(F)(F)F)N(C(=O)Cc2ccc([N+](=O)[O-])cc2)N1	ZINC000000845886	506235717	/nfs/dbraw/zinc/23/57/17/506235717.db2.gz	HWKFJSRQQSFMRN-AWEZNQCLSA-N	0	0	359.304	2.777	50	5		FFBARN
CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000000853678	506237334	/nfs/dbraw/zinc/23/73/34/506237334.db2.gz	HJVVJXOJCQJLEC-OAHLLOKOSA-N	0	0	356.334	2.558	50	5		FFBARN
COc1ccccc1NC(=O)COc1ccc(/C=C/[N+](=O)[O-])cc1OC	ZINC000001158011	506251952	/nfs/dbraw/zinc/25/19/52/506251952.db2.gz	HZLQAFLPOXBDTG-MDZDMXLPSA-N	0	0	358.350	2.969	50	5		FFBARN
Cc1c(Cl)cc(S(=O)(=O)N(C[C@@H]2CCOC2)C2CC2)cc1[N+](=O)[O-]	ZINC000032469291	506257431	/nfs/dbraw/zinc/25/74/31/506257431.db2.gz	PHSNJNYXBAHONP-NSHDSACASA-N	0	0	374.846	2.746	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(NC(=O)C2CC2)c1	ZINC000032764825	506291510	/nfs/dbraw/zinc/29/15/10/506291510.db2.gz	YBQKNZDGJXQBJC-UHFFFAOYSA-N	0	0	355.350	2.961	50	5		FFBARN
CCOc1ccc(Cl)cc1C=Cc1[nH]c2ncnn2c(=O)c1[N+](=O)[O-]	ZINC000033703579	506361594	/nfs/dbraw/zinc/36/15/94/506361594.db2.gz	CGDLDVUASFSFEH-HYXAFXHYSA-N	0	0	361.745	2.961	50	5		FFBARN
COc1cccc(OCCNc2cc(N3CCOCC3)ccc2[N+](=O)[O-])c1	ZINC000004181007	506364813	/nfs/dbraw/zinc/36/48/13/506364813.db2.gz	RSMIAYBJEBVZMI-UHFFFAOYSA-N	0	0	373.409	2.931	50	5		FFBARN
O=C1NC2(CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)Nc2ccccc21	ZINC000034812157	506372055	/nfs/dbraw/zinc/37/20/55/506372055.db2.gz	GPFKTTSEXRDHDH-UHFFFAOYSA-N	0	0	352.394	2.742	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3ccc(C)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000004703598	506390437	/nfs/dbraw/zinc/39/04/37/506390437.db2.gz	JZQFTVJTSWBTFP-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	ZINC000005049725	506417592	/nfs/dbraw/zinc/41/75/92/506417592.db2.gz	HEOHBUDHTPRGFE-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
NC(=O)c1ccsc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1	ZINC000005848207	506459485	/nfs/dbraw/zinc/45/94/85/506459485.db2.gz	YWNPATKLWPCOEN-UHFFFAOYSA-N	0	0	374.422	2.998	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1cccc2cccnc21	ZINC000009865558	506716550	/nfs/dbraw/zinc/71/65/50/506716550.db2.gz	GVRPDLMMLPDAQO-UHFFFAOYSA-N	0	0	350.334	2.512	50	5		FFBARN
Cc1cc(C)c2c(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)nn(C)c2n1	ZINC000012446566	506866592	/nfs/dbraw/zinc/86/65/92/506866592.db2.gz	ZPTDWEGMVXDPKQ-UHFFFAOYSA-N	0	0	370.325	2.654	50	5		FFBARN
O=[N+]([O-])c1ncccc1OS(=O)(=O)c1ccccc1OC(F)(F)F	ZINC000012516721	506870117	/nfs/dbraw/zinc/87/01/17/506870117.db2.gz	YRIAOWZQEXAHJG-UHFFFAOYSA-N	0	0	364.257	2.656	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1ccc(C(=O)NC2CC2)cc1	ZINC000012909736	506914842	/nfs/dbraw/zinc/91/48/42/506914842.db2.gz	SRJSQSHGYOHDSO-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)c1ccc([N+](=O)[O-])cn1	ZINC000012933584	506918490	/nfs/dbraw/zinc/91/84/90/506918490.db2.gz	XHKIXFGLBWMFFX-UHFFFAOYSA-N	0	0	368.315	2.918	50	5		FFBARN
CN(Cc1ccc(C(=O)NC2CC2)cc1)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000013022483	506925790	/nfs/dbraw/zinc/92/57/90/506925790.db2.gz	QJNKDNFKYNRYLV-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
O=[N+]([O-])c1cc(-c2nc(-c3cccnc3)no2)ccc1N1CCOCC1	ZINC000020897840	507238204	/nfs/dbraw/zinc/23/82/04/507238204.db2.gz	RGUJFDACBNKHOE-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
O=C(/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2)NCCc1ccccc1	ZINC000022836359	507312763	/nfs/dbraw/zinc/31/27/63/507312763.db2.gz	GFBXHAPCJUYVLV-VOTSOKGWSA-N	0	0	354.362	2.833	50	5		FFBARN
COCc1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000023047692	507326422	/nfs/dbraw/zinc/32/64/22/507326422.db2.gz	PATQMOLDDXVBAH-UHFFFAOYSA-N	0	0	359.334	2.965	50	5		FFBARN
COc1cc(C(=O)NCCOc2ccc(F)cc2)c([N+](=O)[O-])cc1OC	ZINC000023142400	507333038	/nfs/dbraw/zinc/33/30/38/507333038.db2.gz	DXDUYTOKIICBNV-UHFFFAOYSA-N	0	0	364.329	2.560	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1cnc2ccccc2n1	ZINC000024866286	507445369	/nfs/dbraw/zinc/44/53/69/507445369.db2.gz	BDGPPINSHSPQGO-UHFFFAOYSA-N	0	0	367.317	2.762	50	5		FFBARN
CN(Cc1cccc([N+](=O)[O-])c1)C(=O)C1CCN(C(=O)c2ccoc2)CC1	ZINC000024948501	507451437	/nfs/dbraw/zinc/45/14/37/507451437.db2.gz	HTIRIHAUQZFIJD-UHFFFAOYSA-N	0	0	371.393	2.699	50	5		FFBARN
O=C(COC(=O)c1ccccc1[N+](=O)[O-])N1CCCc2cccc(F)c21	ZINC000025264605	507481605	/nfs/dbraw/zinc/48/16/05/507481605.db2.gz	YSTQCWUBZOFVFP-UHFFFAOYSA-N	0	0	358.325	2.870	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(Cn2ccccc2=O)o1	ZINC000030807384	507813557	/nfs/dbraw/zinc/81/35/57/507813557.db2.gz	BVGOURHDTYHUGK-UHFFFAOYSA-N	0	0	354.318	2.755	50	5		FFBARN
Cc1cc(C2CCN([C@@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)n[nH]1	ZINC000095459842	508186534	/nfs/dbraw/zinc/18/65/34/508186534.db2.gz	HJEJCYSCVWETPC-ZDUSSCGKSA-N	0	0	357.414	2.833	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)N1CC=C(c2cncc(F)c2)CC1	ZINC000095468717	508187800	/nfs/dbraw/zinc/18/78/00/508187800.db2.gz	YZSPYERARSDSDX-UHFFFAOYSA-N	0	0	363.370	2.607	50	5		FFBARN
COc1cc(NCc2cccnc2N2CCOCC2)c(F)cc1[N+](=O)[O-]	ZINC000089423827	522746845	/nfs/dbraw/zinc/74/68/45/522746845.db2.gz	DAYSFJBFASHENH-UHFFFAOYSA-N	0	0	362.361	2.586	50	5		FFBARN
Cc1cccc(OCC(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)c1	ZINC000019790240	524714046	/nfs/dbraw/zinc/71/40/46/524714046.db2.gz	TXSACIWJICVRGO-UHFFFAOYSA-N	0	0	369.421	2.626	50	5		FFBARN
CN(C)c1ccc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1[N+](=O)[O-]	ZINC000009617064	203964243	/nfs/dbraw/zinc/96/42/43/203964243.db2.gz	NYZCOFYDAAWLNY-UHFFFAOYSA-N	0	0	368.393	2.805	50	5		FFBARN
COc1ccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1OC	ZINC000001041618	203976778	/nfs/dbraw/zinc/97/67/78/203976778.db2.gz	LPZZENADTAWWJF-RIYZIHGNSA-N	0	0	354.318	2.957	50	5		FFBARN
O=C(CSc1nccn1-c1ccc([N+](=O)[O-])cc1)NCc1ccco1	ZINC000002468352	204041281	/nfs/dbraw/zinc/04/12/81/204041281.db2.gz	BPTMPHGWXLBJLW-UHFFFAOYSA-N	0	0	358.379	2.782	50	5		FFBARN
Cc1sc2nc3c4ccccc4c(NCCCO)nn3c(=O)c2c1C	ZINC000001801667	204019489	/nfs/dbraw/zinc/01/94/89/204019489.db2.gz	UOQGIPAHPJPBCW-UHFFFAOYSA-N	0	0	354.435	2.869	50	5		FFBARN
O=C(CSc1nc(-c2cccc([N+](=O)[O-])c2)cs1)N1CCOCC1	ZINC000002890900	204066027	/nfs/dbraw/zinc/06/60/27/204066027.db2.gz	JTUOLOREPLMYPS-UHFFFAOYSA-N	0	0	365.436	2.669	50	5		FFBARN
COc1cccc(/C=C2/N=C(c3cc([N+](=O)[O-])ccc3OC)OC2=O)c1	ZINC000002941823	204069238	/nfs/dbraw/zinc/06/92/38/204069238.db2.gz	JXHBVUFPEIBMIA-OQLLNIDSSA-N	0	0	354.318	2.957	50	5		FFBARN
CCOc1ncccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003228341	204083822	/nfs/dbraw/zinc/08/38/22/204083822.db2.gz	RMTDLVVUIHXREV-LLVKDONJSA-N	0	0	359.338	2.573	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000003244987	204084290	/nfs/dbraw/zinc/08/42/90/204084290.db2.gz	RHTBBFYTGCNDIJ-INIZCTEOSA-N	0	0	354.362	2.687	50	5		FFBARN
O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)N1CCc2ccccc21	ZINC000003253829	204085952	/nfs/dbraw/zinc/08/59/52/204085952.db2.gz	DZYBUEGENUATGU-UHFFFAOYSA-N	0	0	360.753	2.994	50	5		FFBARN
Cc1cc(C(=O)COc2cccnc2[N+](=O)[O-])c(C)n1C[C@H]1CCCO1	ZINC000002653737	204049004	/nfs/dbraw/zinc/04/90/04/204049004.db2.gz	VGESANCCSAMMEP-CQSZACIVSA-N	0	0	359.382	2.849	50	5		FFBARN
COc1cc2c(cc1OC)CN(C(=O)COc1ccccc1[N+](=O)[O-])CC2	ZINC000002644516	204049250	/nfs/dbraw/zinc/04/92/50/204049250.db2.gz	MUPDGRRTHZAKSU-UHFFFAOYSA-N	0	0	372.377	2.576	50	5		FFBARN
O=C(c1ccccc1[N+](=O)[O-])N1CCC[C@@H](C(=O)N2CCCCCC2)C1	ZINC000002786817	204056604	/nfs/dbraw/zinc/05/66/04/204056604.db2.gz	JSVAKABNKQIUQO-OAHLLOKOSA-N	0	0	359.426	2.850	50	5		FFBARN
CC(C)CCNC(=O)C(=Cc1ccc([N+](=O)[O-])o1)C(=O)NCCC(C)C	ZINC000003321247	204091666	/nfs/dbraw/zinc/09/16/66/204091666.db2.gz	MKOCRGZJUCWLPC-UHFFFAOYSA-N	0	0	365.430	2.896	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000003905769	204115892	/nfs/dbraw/zinc/11/58/92/204115892.db2.gz	MJNXHNZYFAAQFQ-AWEZNQCLSA-N	0	0	365.411	2.519	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@H]2C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000004066657	204119113	/nfs/dbraw/zinc/11/91/13/204119113.db2.gz	MPOGNXFBWLAWGZ-QSGSBWRWSA-N	0	0	359.382	2.955	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccccc1	ZINC000004178462	204126590	/nfs/dbraw/zinc/12/65/90/204126590.db2.gz	JAUHORJDRCNGGT-UHFFFAOYSA-N	0	0	356.334	2.740	50	5		FFBARN
O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)OCc1ccccc1F	ZINC000003392641	204098218	/nfs/dbraw/zinc/09/82/18/204098218.db2.gz	SEBHCAYHVRBWHT-UHFFFAOYSA-N	0	0	366.732	2.861	50	5		FFBARN
Cc1ccc(C)c(OCCNS(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1	ZINC000005065605	204189800	/nfs/dbraw/zinc/18/98/00/204189800.db2.gz	KDKRGQIJHGSXSD-UHFFFAOYSA-N	0	0	364.423	2.877	50	5		FFBARN
CCc1ccccc1Nc1nc(N)nc(Cn2nc(C)c([N+](=O)[O-])c2C)n1	ZINC000005689412	204221336	/nfs/dbraw/zinc/22/13/36/204221336.db2.gz	CJAWVMNSBCQJBR-UHFFFAOYSA-N	0	0	368.401	2.530	50	5		FFBARN
O=C(OCCCCN1C(=O)c2ccccc2C1=O)c1cccc([N+](=O)[O-])c1	ZINC000007007616	204285878	/nfs/dbraw/zinc/28/58/78/204285878.db2.gz	OGULNHNBMXMMAX-UHFFFAOYSA-N	0	0	368.345	2.828	50	5		FFBARN
CNc1c(C(=O)Nc2ccc([N+](=O)[O-])cc2)cc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000008398898	204329803	/nfs/dbraw/zinc/32/98/03/204329803.db2.gz	SAJNOUYSRNAJRO-UHFFFAOYSA-N	0	0	361.270	2.705	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000008782331	204346264	/nfs/dbraw/zinc/34/62/64/204346264.db2.gz	AQWDCYWJRRZNPH-LBPRGKRZSA-N	0	0	361.398	2.723	50	5		FFBARN
COc1ccc2[nH]c(=NC(=O)c3ccc(OC)c([N+](=O)[O-])c3)sc2c1	ZINC000009111457	204354627	/nfs/dbraw/zinc/35/46/27/204354627.db2.gz	QZOCGWMMMVDSPF-UHFFFAOYSA-N	0	0	359.363	2.896	50	5		FFBARN
COC(=O)c1ccc(O[C@H](C)c2nc3ccccc3c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000009596669	204375420	/nfs/dbraw/zinc/37/54/20/204375420.db2.gz	HNHKLWBMTGXYRM-SNVBAGLBSA-N	0	0	369.333	2.758	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1-c1cccs1)NC[C@@H]1CCCO1	ZINC000009603112	204375870	/nfs/dbraw/zinc/37/58/70/204375870.db2.gz	JKIANHCSZVQKCX-ZDUSSCGKSA-N	0	0	362.407	2.997	50	5		FFBARN
C[C@H](OC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000012652756	204483540	/nfs/dbraw/zinc/48/35/40/204483540.db2.gz	SPJWEGXSEYKINW-ICIURTGMSA-N	0	0	374.393	2.860	50	5		FFBARN
C[C@@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1	ZINC000013284571	204527233	/nfs/dbraw/zinc/52/72/33/204527233.db2.gz	GZSNHBOFBZYOOY-SECBINFHSA-N	0	0	355.310	2.870	50	5		FFBARN
COC(=O)c1ccc(CN(C)Cn2ncc3cc([N+](=O)[O-])ccc32)cc1	ZINC000025476927	204837852	/nfs/dbraw/zinc/83/78/52/204837852.db2.gz	YRKJJNHXAQJVHC-UHFFFAOYSA-N	0	0	354.366	2.821	50	5		FFBARN
CC(C)NC(=O)N1CCC(C(=O)Nc2ccc(F)c([N+](=O)[O-])c2)CC1	ZINC000032913096	204945447	/nfs/dbraw/zinc/94/54/47/204945447.db2.gz	JVQOLFNGTJGDPO-UHFFFAOYSA-N	0	0	352.366	2.502	50	5		FFBARN
C[C@@H]1C[C@@H](OC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C(=O)O1	ZINC000032736101	204935906	/nfs/dbraw/zinc/93/59/06/204935906.db2.gz	XORVIMMOUXEBFR-MLGOLLRUSA-N	0	0	362.382	2.836	50	5		FFBARN
O=c1c2cc3c(ccn(C4CCCCCC4)c3=O)nc2ccn1CCO	ZINC000038829336	205043088	/nfs/dbraw/zinc/04/30/88/205043088.db2.gz	IYPSQPGOBYFUJD-UHFFFAOYSA-N	0	0	353.422	2.599	50	5		FFBARN
CCn1cc(NC(=O)Cn2c3ccccc3c(=O)c3ccccc32)ccc1=O	ZINC000047181242	205143313	/nfs/dbraw/zinc/14/33/13/205143313.db2.gz	VDWHRWAFABBWOB-UHFFFAOYSA-N	0	0	373.412	2.975	50	5		FFBARN
CC[C@@H]1CCCCN1C(=O)CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000048716799	205166648	/nfs/dbraw/zinc/16/66/48/205166648.db2.gz	RNSPYONRMNZAGF-OAHLLOKOSA-N	0	0	368.455	2.609	50	5		FFBARN
C[C@@H]1CN(C[C@@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000058160913	205252305	/nfs/dbraw/zinc/25/23/05/205252305.db2.gz	HPGJFSQSGOEBLG-VBQJREDUSA-N	0	0	362.430	2.700	50	5		FFBARN
Cc1c(CSc2nnc(N3CCOCC3)s2)cccc1[N+](=O)[O-]	ZINC000058167576	205253896	/nfs/dbraw/zinc/25/38/96/205253896.db2.gz	GUDVAYVSRLOUPT-UHFFFAOYSA-N	0	0	352.441	2.884	50	5		FFBARN
O=C(Cn1ccc([N+](=O)[O-])n1)NC1c2ccccc2Oc2ccccc21	ZINC000058250461	205267116	/nfs/dbraw/zinc/26/71/16/205267116.db2.gz	WPRWYLFJUYHDMK-UHFFFAOYSA-N	0	0	350.334	2.803	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)N(C)C[C@H]1COc2ccccc2O1	ZINC000065553179	205358100	/nfs/dbraw/zinc/35/81/00/205358100.db2.gz	IEDSBHSMBXQIOU-ZDUSSCGKSA-N	0	0	373.365	2.907	50	5		FFBARN
CN(Cc1ccc2c(c1)OCO2)C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000065719524	205361088	/nfs/dbraw/zinc/36/10/88/205361088.db2.gz	VDCANWWZUOENFX-UHFFFAOYSA-N	0	0	367.361	2.937	50	5		FFBARN
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(C)cc1Br	ZINC000065713370	205361465	/nfs/dbraw/zinc/36/14/65/205361465.db2.gz	HCVMUNOVCNKQHJ-UHFFFAOYSA-N	0	0	353.176	2.809	50	5		FFBARN
CC(=O)Nc1ccc(F)c(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)c1	ZINC000046354078	206079251	/nfs/dbraw/zinc/07/92/51/206079251.db2.gz	CRLXHOWWMQTFCV-UHFFFAOYSA-N	0	0	357.301	2.821	50	5		FFBARN
O=C(Nc1nnc(-c2ccc3c(c2)OCCO3)o1)c1ccc([N+](=O)[O-])cc1	ZINC000004264332	206172055	/nfs/dbraw/zinc/17/20/55/206172055.db2.gz	PCMOFNLTUNUHRN-UHFFFAOYSA-N	0	0	368.305	2.668	50	5		FFBARN
CN(C(=O)COC(=O)CSc1ccc([N+](=O)[O-])cc1)c1ccccc1	ZINC000004219474	206172471	/nfs/dbraw/zinc/17/24/71/206172471.db2.gz	JAQYNEFFVWKPIK-UHFFFAOYSA-N	0	0	360.391	2.893	50	5		FFBARN
CSc1ccccc1NC(=O)Cn1cnc2ccc([N+](=O)[O-])cc2c1=O	ZINC000004564004	206179328	/nfs/dbraw/zinc/17/93/28/206179328.db2.gz	KPWGCUAMWSEAEQ-UHFFFAOYSA-N	0	0	370.390	2.665	50	5		FFBARN
CCCNC(=O)COC(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1	ZINC000004839806	206181254	/nfs/dbraw/zinc/18/12/54/206181254.db2.gz	NOVVBJSMZVUIMN-UHFFFAOYSA-N	0	0	363.414	2.658	50	5		FFBARN
C[C@@H](OC(=O)c1ccc2c(c1)OCCO2)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007705937	206211090	/nfs/dbraw/zinc/21/10/90/206211090.db2.gz	CLHQAKMIHBZIGO-LLVKDONJSA-N	0	0	372.333	2.550	50	5		FFBARN
O=C(Cc1nnc2c3ccccc3ncn2c1=O)c1cc2ccccc2o1	ZINC000007716952	206212206	/nfs/dbraw/zinc/21/22/06/206212206.db2.gz	IJMCIGMSEDWWGS-UHFFFAOYSA-N	0	0	356.341	2.809	50	5		FFBARN
CC(=O)c1cccc(N2C(=O)C[C@H](Nc3cccc([N+](=O)[O-])c3)C2=O)c1	ZINC000102988240	206231983	/nfs/dbraw/zinc/23/19/83/206231983.db2.gz	GMSDXAPXLZZPHE-INIZCTEOSA-N	0	0	353.334	2.541	50	5		FFBARN
O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000103559628	206234398	/nfs/dbraw/zinc/23/43/98/206234398.db2.gz	ZHUAXXIMKWNYMN-ZFWWWQNUSA-N	0	0	371.736	2.541	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)C(=O)N(C)C2=O	ZINC000012750444	206294787	/nfs/dbraw/zinc/29/47/87/206294787.db2.gz	OXAKCDXSTHFLAB-LLVKDONJSA-N	0	0	367.361	2.654	50	5		FFBARN
COc1cccc2c1O[C@]1(N3CCOCC3)CCCC[C@@H]1[C@H]2C[N+](=O)[O-]	ZINC000013464385	206302954	/nfs/dbraw/zinc/30/29/54/206302954.db2.gz	WZXCWLCTYQZXIV-FRQCXROJSA-N	0	0	362.426	2.667	50	5		FFBARN
Cc1c(NC(=O)c2ccccc2OCC(=O)N(C)C)cccc1[N+](=O)[O-]	ZINC000019295151	206324592	/nfs/dbraw/zinc/32/45/92/206324592.db2.gz	UYPYYZVXTOIYGO-UHFFFAOYSA-N	0	0	357.366	2.623	50	5		FFBARN
CCOCCN1CCN(c2cc(OC)c([N+](=O)[O-])cc2F)C[C@H]1CC	ZINC000089949233	132200662	/nfs/dbraw/zinc/20/06/62/132200662.db2.gz	RNSPHRXIZOVOLO-CYBMUJFWSA-N	0	0	355.410	2.680	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCC[C@H](Cn3cncn3)C2)c(OC(F)F)c1	ZINC000096003762	132216917	/nfs/dbraw/zinc/21/69/17/132216917.db2.gz	OSBOBMORJYTUKZ-NSHDSACASA-N	0	0	353.329	2.704	50	5		FFBARN
O=C(Nc1ccc(N2CCOCC2)c(Cl)c1)c1ccc([N+](=O)[O-])o1	ZINC000000877460	132379097	/nfs/dbraw/zinc/37/90/97/132379097.db2.gz	WBHLXDZDOUCOGT-UHFFFAOYSA-N	0	0	351.746	2.930	50	5		FFBARN
CCOc1ccc(Nc2nc(N3CCOCC3)nc(C)c2[N+](=O)[O-])cc1	ZINC000004117477	132386390	/nfs/dbraw/zinc/38/63/90/132386390.db2.gz	XBLVBJXQYFKWSG-UHFFFAOYSA-N	0	0	359.386	2.672	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(CCOc3ccc(Cl)cc3)CC2)nc1	ZINC000012809261	132863481	/nfs/dbraw/zinc/86/34/81/132863481.db2.gz	OKOAJNFQGRJYOM-UHFFFAOYSA-N	0	0	362.817	2.844	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)O[C@@H](C)C3)n2)cc1C	ZINC000018251667	132886401	/nfs/dbraw/zinc/88/64/01/132886401.db2.gz	QDFXUIOFXRZTGV-BETUJISGSA-N	0	0	372.429	2.941	50	5		FFBARN
CCc1ccc(NC(=O)CCN2C(=O)COc3ccccc32)cc1[N+](=O)[O-]	ZINC000027312919	132916117	/nfs/dbraw/zinc/91/61/17/132916117.db2.gz	GRSDVAXGAAKDOW-UHFFFAOYSA-N	0	0	369.377	2.911	50	5		FFBARN
COc1ccc([N+](=O)[O-])c2c(CCN3C(=O)c4ccccc4C3=O)c[nH]c21	ZINC000000754080	506229068	/nfs/dbraw/zinc/22/90/68/506229068.db2.gz	PZNLUQGSTZTUSM-UHFFFAOYSA-N	0	0	365.345	2.923	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCN1C(=O)c2ccccc2C1=O	ZINC000000727748	506230081	/nfs/dbraw/zinc/23/00/81/506230081.db2.gz	MYZVMAFTZLDEEG-UHFFFAOYSA-N	0	0	367.361	2.918	50	5		FFBARN
Cc1cccc(N2C[C@@H](C(=O)OCc3ccc([N+](=O)[O-])cc3)CC2=O)c1	ZINC000001059188	506245731	/nfs/dbraw/zinc/24/57/31/506245731.db2.gz	SJVPWZTYFQKEPO-HNNXBMFYSA-N	0	0	354.362	3.000	50	5		FFBARN
COC(=O)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000001172491	506251382	/nfs/dbraw/zinc/25/13/82/506251382.db2.gz	WBUUPKYYLPLIDI-UHFFFAOYSA-N	0	0	359.363	2.508	50	5		FFBARN
COc1cc(Cl)c(S(=O)(=O)n2c(C)ncc2[N+](=O)[O-])cc1Cl	ZINC000001157440	506252079	/nfs/dbraw/zinc/25/20/79/506252079.db2.gz	FUAAABXLVCMDPA-UHFFFAOYSA-N	0	0	366.182	2.652	50	5		FFBARN
COc1ccc(NC(=O)Nc2ccc(-n3ccnc3)nc2)c([N+](=O)[O-])c1	ZINC000032824205	506300717	/nfs/dbraw/zinc/30/07/17/506300717.db2.gz	WJKUWKFXEOAHEX-UHFFFAOYSA-N	0	0	354.326	2.828	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@@H]1CCCN(C(=O)N(C)C)C1	ZINC000040092176	506466173	/nfs/dbraw/zinc/46/61/73/506466173.db2.gz	ZPVVOOIHZKMFJJ-UKRRQHHQSA-N	0	0	362.430	2.508	50	5		FFBARN
O=C(Nc1nc2c(s1)CCC2)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000008720835	506663880	/nfs/dbraw/zinc/66/38/80/506663880.db2.gz	XKXFJSPXKDBKEL-UHFFFAOYSA-N	0	0	374.422	2.629	50	5		FFBARN
CN1CCN(c2ccc(C(=O)NCC3CCCCC3)cc2[N+](=O)[O-])CC1	ZINC000008720840	506664624	/nfs/dbraw/zinc/66/46/24/506664624.db2.gz	CNBLJLDGYALKNG-UHFFFAOYSA-N	0	0	360.458	2.657	50	5		FFBARN
COc1cc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)ccc1N1CCCC1=O	ZINC000011445832	506777246	/nfs/dbraw/zinc/77/72/46/506777246.db2.gz	NSZWEKJGSGAIFU-UHFFFAOYSA-N	0	0	369.377	2.911	50	5		FFBARN
COC(=O)c1cc(C(=O)NCC2(c3ccccc3)CC2)cc([N+](=O)[O-])c1	ZINC000011750060	506793544	/nfs/dbraw/zinc/79/35/44/506793544.db2.gz	QGMUMAWRGYQRFY-UHFFFAOYSA-N	0	0	354.362	2.843	50	5		FFBARN
O=C(NC[C@@H]1CCCO1)c1ccccc1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000012136941	506822517	/nfs/dbraw/zinc/82/25/17/506822517.db2.gz	LHVGULBGGJTIQO-ZDUSSCGKSA-N	0	0	369.377	2.756	50	5		FFBARN
COc1ccc([C@H](NC(=O)c2ccccc2[N+](=O)[O-])c2nccn2C)cc1	ZINC000012519855	506870564	/nfs/dbraw/zinc/87/05/64/506870564.db2.gz	ALOWSMCYIMKVNX-KRWDZBQOSA-N	0	0	366.377	2.856	50	5		FFBARN
CN(Cc1cc([N+](=O)[O-])ccc1Cl)S(=O)(=O)N1CCCCCC1	ZINC000012752951	506896474	/nfs/dbraw/zinc/89/64/74/506896474.db2.gz	PNJIDWSHMRSKJD-UHFFFAOYSA-N	0	0	361.851	2.801	50	5		FFBARN
O=[N+]([O-])c1cnn(Cc2nnc(-c3ccc(Br)cc3)o2)c1	ZINC000012762942	506897107	/nfs/dbraw/zinc/89/71/07/506897107.db2.gz	BUPAMJWNANWXEN-UHFFFAOYSA-N	0	0	350.132	2.652	50	5		FFBARN
CON(C)C(=O)C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000014060764	506962422	/nfs/dbraw/zinc/96/24/22/506962422.db2.gz	KCQDSCCNEUJVSW-UHFFFAOYSA-N	0	0	361.320	2.850	50	5		FFBARN
COc1ccc(C(=O)N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000019553153	507178864	/nfs/dbraw/zinc/17/88/64/507178864.db2.gz	GRNQXQANLSSAAZ-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COc1cccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000019565306	507180762	/nfs/dbraw/zinc/18/07/62/507180762.db2.gz	FCEYNKZMRVVIST-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COc1cccc(C(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000019773529	507201285	/nfs/dbraw/zinc/20/12/85/507201285.db2.gz	AGAYPYXCWACMFZ-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COc1ccccc1C(=O)N1CCN(Cc2cccc([N+](=O)[O-])c2)CC1	ZINC000019832220	507203844	/nfs/dbraw/zinc/20/38/44/507203844.db2.gz	CBJJUUUARLHINE-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ncccc3C(F)(F)F)CC2)nc1	ZINC000020224058	507215814	/nfs/dbraw/zinc/21/58/14/507215814.db2.gz	XYSBNBDMPQPMLH-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
CCc1cc2c(ncnc2N[C@@H](CO)[C@H](O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000024060900	507389629	/nfs/dbraw/zinc/38/96/29/507389629.db2.gz	AQQIGBDKEACOEU-LSDHHAIUSA-N	0	0	374.422	2.668	50	5		FFBARN
CCOc1ccc(C(=O)NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1OCC	ZINC000024151649	507395178	/nfs/dbraw/zinc/39/51/78/507395178.db2.gz	DOXHBQWXTLHPAS-MRXNPFEDSA-N	0	0	374.393	2.856	50	5		FFBARN
Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000024562307	507419169	/nfs/dbraw/zinc/41/91/69/507419169.db2.gz	FASVLMYLLXMICX-CYBMUJFWSA-N	0	0	369.299	2.780	50	5		FFBARN
CN(CCOc1ccc(Cl)cc1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000024574349	507420945	/nfs/dbraw/zinc/42/09/45/507420945.db2.gz	ACZQTEUUBXOAAB-UHFFFAOYSA-N	0	0	363.801	2.858	50	5		FFBARN
COc1ccc(C(=O)C2CCN(C(=O)c3ccc([N+](=O)[O-])o3)CC2)cc1	ZINC000026130596	507560042	/nfs/dbraw/zinc/56/00/42/507560042.db2.gz	OPXCJTFLPMZASA-UHFFFAOYSA-N	0	0	358.350	2.932	50	5		FFBARN
Cc1nn(CN(C)CCOc2cccc(C)c2)c2ncc([N+](=O)[O-])cc12	ZINC000072312394	507775518	/nfs/dbraw/zinc/77/55/18/507775518.db2.gz	SUNHQCXBTJVWQY-UHFFFAOYSA-N	0	0	355.398	2.925	50	5		FFBARN
O=c1c2cc3c(ccn(-c4ccccn4)c3=O)nc2ccn1Cc1ccco1	ZINC000030907841	507814878	/nfs/dbraw/zinc/81/48/78/507814878.db2.gz	JNNNQPVWCAJSBJ-UHFFFAOYSA-N	0	0	370.368	2.737	50	5		FFBARN
Cc1cc(Oc2cc(C(=O)NCc3ccco3)nn2C)ccc1[N+](=O)[O-]	ZINC000096203778	508210103	/nfs/dbraw/zinc/21/01/03/508210103.db2.gz	MRFWEPAQDDUIFD-UHFFFAOYSA-N	0	0	356.338	2.952	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000100103791	508237991	/nfs/dbraw/zinc/23/79/91/508237991.db2.gz	OUYHHVXCWZAPMH-MRXNPFEDSA-N	0	0	360.366	2.566	50	5		FFBARN
Cc1cc2c(c(=O)[nH]1)C(=O)OC2=Cc1c[nH]nc1-c1cccc([N+](=O)[O-])c1	ZINC000100218399	508239060	/nfs/dbraw/zinc/23/90/60/508239060.db2.gz	BRHNCZMUTYQKOY-VGOFMYFVSA-N	0	0	364.317	2.650	50	5		FFBARN
O=[N+]([O-])c1cc(Cl)ccc1S(=O)(=O)NCc1noc2ccccc21	ZINC000225390567	509371519	/nfs/dbraw/zinc/37/15/19/509371519.db2.gz	NAMPEWLEWLXBDC-UHFFFAOYSA-N	0	0	367.770	2.868	50	5		FFBARN
COC(=O)c1cc(C)nc(NCCCCNc2ccccn2)c1[N+](=O)[O-]	ZINC000225819176	509390500	/nfs/dbraw/zinc/39/05/00/509390500.db2.gz	LDNUDCVSGGNZLZ-UHFFFAOYSA-N	0	0	359.386	2.784	50	5		FFBARN
C[C@@H](C(=O)N(C)Cc1ccc([N+](=O)[O-])cc1)n1c(=O)oc2ccccc21	ZINC000170596097	509674399	/nfs/dbraw/zinc/67/43/99/509674399.db2.gz	LROQLGQPZNTIPY-LBPRGKRZSA-N	0	0	355.350	2.722	50	5		FFBARN
Cc1ccccc1-c1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)n1C	ZINC000089696946	525017754	/nfs/dbraw/zinc/01/77/54/525017754.db2.gz	OIJWDKJKXZZLJT-UHFFFAOYSA-N	0	0	371.422	2.653	50	5		FFBARN
Cc1ccc(OCC(=O)N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000019790074	525380390	/nfs/dbraw/zinc/38/03/90/525380390.db2.gz	HEHWPJJECDMNTO-UHFFFAOYSA-N	0	0	369.421	2.626	50	5		FFBARN
O=C(C[C@H]1COCCN1CCOc1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000084374568	527178481	/nfs/dbraw/zinc/17/84/81/527178481.db2.gz	HHTGERKQWPLNIO-HNNXBMFYSA-N	0	0	360.366	2.540	50	5		FFBARN
CC[C@@H](C)NC(=O)COC(=O)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000004839941	535583239	/nfs/dbraw/zinc/58/32/39/535583239.db2.gz	RJVKPCMVLKDAQO-CYBMUJFWSA-N	0	0	363.414	2.657	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@@H](c2ccc([N+](=O)[O-])cc2)NC3=O)c1	ZINC000001404807	204004911	/nfs/dbraw/zinc/00/49/11/204004911.db2.gz	LUPIEKFEDTVFTP-OAHLLOKOSA-N	0	0	350.334	2.826	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)n1c(=O)oc2cc(Br)ccc21	ZINC000001439251	204007314	/nfs/dbraw/zinc/00/73/14/204007314.db2.gz	OURMTZBVCZIHKR-UHFFFAOYSA-N	0	0	363.123	2.954	50	5		FFBARN
O=C(NC[C@H]1OCCc2ccccc21)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000002316130	204034273	/nfs/dbraw/zinc/03/42/73/204034273.db2.gz	AGLICLBPFOMWMR-MRXNPFEDSA-N	0	0	357.322	2.547	50	5		FFBARN
CCOC(=O)[C@H](C)On1c2cc([N+](=O)[O-])ccc2nc1-c1ccccc1	ZINC000003063716	204076773	/nfs/dbraw/zinc/07/67/73/204076773.db2.gz	MYAXZVGAFGATAW-LBPRGKRZSA-N	0	0	355.350	2.992	50	5		FFBARN
COc1ccc(Cl)cc1NC(=O)COC(=O)c1ccc([N+](=O)[O-])o1	ZINC000002625612	204046252	/nfs/dbraw/zinc/04/62/52/204046252.db2.gz	ACZLJNONHRPGPE-UHFFFAOYSA-N	0	0	354.702	2.645	50	5		FFBARN
O=C(/C=C/c1ccc([N+](=O)[O-])cc1)OCC(=O)Nc1ccc(Cl)cn1	ZINC000002634595	204048018	/nfs/dbraw/zinc/04/80/18/204048018.db2.gz	IQCXJWKXZLHXLY-FPYGCLRLSA-N	0	0	361.741	2.838	50	5		FFBARN
Cc1ccc(NC(=O)Cn2nnc(-c3ccc(Cl)cc3)n2)cc1[N+](=O)[O-]	ZINC000003423962	204099455	/nfs/dbraw/zinc/09/94/55/204099455.db2.gz	RYHAQOYJKHBTFS-UHFFFAOYSA-N	0	0	372.772	2.849	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)NC2CCCCCCC2)cc1[N+](=O)[O-]	ZINC000003442520	204100760	/nfs/dbraw/zinc/10/07/60/204100760.db2.gz	MZXIQSBGQNWMBD-UHFFFAOYSA-N	0	0	364.398	2.989	50	5		FFBARN
COc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000004600365	204149248	/nfs/dbraw/zinc/14/92/48/204149248.db2.gz	SCPWJFDBJKKUOK-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
O=[N+]([O-])c1cccc(Cl)c1NCCNS(=O)(=O)c1ccccc1	ZINC000004603028	204150634	/nfs/dbraw/zinc/15/06/34/204150634.db2.gz	HKNHRQXCQCDBFV-UHFFFAOYSA-N	0	0	355.803	2.639	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)ccc21	ZINC000004601674	204150658	/nfs/dbraw/zinc/15/06/58/204150658.db2.gz	DLVMYFDVCHVYJL-UHFFFAOYSA-N	0	0	370.321	2.664	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])c(NC(=O)c2cccnc2)c1)c1cccnc1	ZINC000004628719	204151878	/nfs/dbraw/zinc/15/18/78/204151878.db2.gz	SZCPPYUOPPQPPX-UHFFFAOYSA-N	0	0	363.333	2.889	50	5		FFBARN
Cc1c(Nc2c3nonc3ccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C	ZINC000004658764	204153049	/nfs/dbraw/zinc/15/30/49/204153049.db2.gz	HUGVDLJPUISXLD-UHFFFAOYSA-N	0	0	366.337	2.672	50	5		FFBARN
CCCC1=Nc2ncnn2[C@@H](c2cccc([N+](=O)[O-])c2)C1C(=O)OCC	ZINC000004777015	204163216	/nfs/dbraw/zinc/16/32/16/204163216.db2.gz	PYNMSDZSXQLGKT-HNNXBMFYSA-N	0	0	357.370	2.819	50	5		FFBARN
COc1cc2nc(COc3ccc([N+](=O)[O-])cc3)oc(=O)c2cc1OC	ZINC000004499625	204142318	/nfs/dbraw/zinc/14/23/18/204142318.db2.gz	ATGSXKZTXZROOV-UHFFFAOYSA-N	0	0	358.306	2.692	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)N(c1ccccc1)C1CSC1	ZINC000004857135	204170409	/nfs/dbraw/zinc/17/04/09/204170409.db2.gz	JDRBTGHKLURGKX-UHFFFAOYSA-N	0	0	350.421	2.906	50	5		FFBARN
CCOc1ccc(NS(=O)(=O)c2ccc(OC)c([N+](=O)[O-])c2)cc1	ZINC000004980369	204182379	/nfs/dbraw/zinc/18/23/79/204182379.db2.gz	ZWTKBORAWASERZ-UHFFFAOYSA-N	0	0	352.368	2.803	50	5		FFBARN
O=C(Nc1ccc2c(c1)oc(=O)cc2C(F)(F)F)c1n[nH]cc1[N+](=O)[O-]	ZINC000006414087	204248171	/nfs/dbraw/zinc/24/81/71/204248171.db2.gz	NEGZHSZAZUECBP-UHFFFAOYSA-N	0	0	368.227	2.695	50	5		FFBARN
Cc1cccc2nc(COC(=O)/C=C/c3cccc([N+](=O)[O-])c3)cc(=O)n12	ZINC000007156499	204290503	/nfs/dbraw/zinc/29/05/03/204290503.db2.gz	MORJMESZWXIMOM-CMDGGOBGSA-N	0	0	365.345	2.668	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000007168674	204290608	/nfs/dbraw/zinc/29/06/08/204290608.db2.gz	QRDKQTJVNGWWIV-GFCCVEGCSA-N	0	0	355.350	2.738	50	5		FFBARN
Cc1nn(CC(C)C)c(C)c1CC(=O)NCCNc1ccc([N+](=O)[O-])cc1	ZINC000007256888	204293034	/nfs/dbraw/zinc/29/30/34/204293034.db2.gz	UQGAHVNOZLKBEJ-UHFFFAOYSA-N	0	0	373.457	2.835	50	5		FFBARN
COc1ccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c(F)c1	ZINC000007413962	204296702	/nfs/dbraw/zinc/29/67/02/204296702.db2.gz	LCTWZONOTPSPEU-UHFFFAOYSA-N	0	0	363.297	2.966	50	5		FFBARN
CSc1nc2oc3ccc(Br)cc3c(=O)c2c(=O)n1C	ZINC000006669601	204259942	/nfs/dbraw/zinc/25/99/42/204259942.db2.gz	ITTLCLUGGPEVCA-UHFFFAOYSA-N	0	0	353.197	2.524	50	5		FFBARN
CC1=C(C(=O)NC(C)(C)C)[C@H](c2cccc([N+](=O)[O-])c2)NC(=S)N1C	ZINC000006801741	204272124	/nfs/dbraw/zinc/27/21/24/204272124.db2.gz	UIJWYRRHBFPONU-AWEZNQCLSA-N	0	0	362.455	2.645	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1C(=O)OCC(=O)Nc1cc(C(C)(C)C)no1	ZINC000009544407	204373363	/nfs/dbraw/zinc/37/33/63/204373363.db2.gz	OFWOUTDWUYKEGB-UHFFFAOYSA-N	0	0	361.354	2.984	50	5		FFBARN
COc1ccc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2nccn2C)cc1	ZINC000008720047	204340645	/nfs/dbraw/zinc/34/06/45/204340645.db2.gz	JPHBXEHAFAEELC-KRWDZBQOSA-N	0	0	366.377	2.856	50	5		FFBARN
COc1cc(CC(=O)N2CCc3cc([N+](=O)[O-])ccc32)cc(OC)c1OC	ZINC000009690083	204378952	/nfs/dbraw/zinc/37/89/52/204378952.db2.gz	YMNRVXOSFACKLF-UHFFFAOYSA-N	0	0	372.377	2.752	50	5		FFBARN
COC(=O)c1cc(/C=C/C(=O)Nc2cc([N+](=O)[O-])ccc2OC)oc1C	ZINC000009950471	204387123	/nfs/dbraw/zinc/38/71/23/204387123.db2.gz	SSCMPTSACNQIQF-FNORWQNLSA-N	0	0	360.322	2.943	50	5		FFBARN
CC[C@H](CO)Nc1ccc(-c2n[nH]c(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000010257309	204393437	/nfs/dbraw/zinc/39/34/37/204393437.db2.gz	ZVPCIVRVOIEYAS-GFCCVEGCSA-N	0	0	354.366	2.681	50	5		FFBARN
C[C@@H](NC(=O)Cc1ccccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1	ZINC000012977935	204515578	/nfs/dbraw/zinc/51/55/78/204515578.db2.gz	KIWICBBSGCGUAZ-CYBMUJFWSA-N	0	0	351.366	2.595	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])NC[C@H]1CCN(c2ccccc2)C1	ZINC000024817241	204826062	/nfs/dbraw/zinc/82/60/62/204826062.db2.gz	SBYFUUPRYMSLBX-OAHLLOKOSA-N	0	0	355.394	2.616	50	5		FFBARN
C[C@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(OC(F)(F)F)cc1	ZINC000040074311	205052863	/nfs/dbraw/zinc/05/28/63/205052863.db2.gz	FGZHANYYWGRCFW-VIFPVBQESA-N	0	0	358.276	2.567	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H]1c1nnc2n1CCCCC2	ZINC000040080150	205053368	/nfs/dbraw/zinc/05/33/68/205053368.db2.gz	OXIJSLOQHDVNOJ-INIZCTEOSA-N	0	0	369.425	2.819	50	5		FFBARN
CCOc1ccc2c(c1)CN(C(=O)c1cc(F)cc([N+](=O)[O-])c1N)CC2	ZINC000058288437	205269072	/nfs/dbraw/zinc/26/90/72/205269072.db2.gz	QFMTZCXVCOYWAA-UHFFFAOYSA-N	0	0	359.357	2.913	50	5		FFBARN
O=C(N[C@H]1C[C@@H]1c1cccc(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000067092484	205367215	/nfs/dbraw/zinc/36/72/15/205367215.db2.gz	ZKAHCVKFLOWEGX-OCCSQVGLSA-N	0	0	358.325	2.791	50	5		FFBARN
COC(=O)CCCCCCNC(=O)Nc1ccc(OC)c([N+](=O)[O-])c1	ZINC000097164762	205901149	/nfs/dbraw/zinc/90/11/49/205901149.db2.gz	CBALPOPHIQFMEB-UHFFFAOYSA-N	0	0	353.375	2.848	50	5		FFBARN
CNC(=O)/C(=C/c1ccc(Cl)cc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000000978144	206143219	/nfs/dbraw/zinc/14/32/19/206143219.db2.gz	BRAFDKUAUPBIPX-GDNBJRDFSA-N	0	0	359.769	2.765	50	5		FFBARN
CCOC(=O)c1ccccc1NC(=O)COc1ccc(OC)cc1[N+](=O)[O-]	ZINC000003408438	206160425	/nfs/dbraw/zinc/16/04/25/206160425.db2.gz	MXLLQXSCVNRFTO-UHFFFAOYSA-N	0	0	374.349	2.798	50	5		FFBARN
CC(=O)NCCNC(=O)c1cc([N+](=O)[O-])ccc1Sc1ccccc1	ZINC000003333628	206161271	/nfs/dbraw/zinc/16/12/71/206161271.db2.gz	QJOFXVNNZAOJTR-UHFFFAOYSA-N	0	0	359.407	2.612	50	5		FFBARN
O=C(OCN1C(=O)c2ccccc2C1=O)c1ccc(Cl)cc1[N+](=O)[O-]	ZINC000005112834	206189200	/nfs/dbraw/zinc/18/92/00/206189200.db2.gz	XBZQRKMODDTVEY-UHFFFAOYSA-N	0	0	360.709	2.659	50	5		FFBARN
COc1cc(C(=O)OCC(=O)c2ccccc2F)c([N+](=O)[O-])cc1OC	ZINC000005246306	206189956	/nfs/dbraw/zinc/18/99/56/206189956.db2.gz	UUXGYODBUZXJRO-UHFFFAOYSA-N	0	0	363.297	2.791	50	5		FFBARN
O=C1CCCN1c1ccc(NS(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005329210	206193943	/nfs/dbraw/zinc/19/39/43/206193943.db2.gz	NPLHSDQVHDATNM-UHFFFAOYSA-N	0	0	361.379	2.522	50	5		FFBARN
CC(C)CCC[C@H](C)NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000007767098	206213130	/nfs/dbraw/zinc/21/31/30/206213130.db2.gz	OYOOZUKBRXVQLA-LBPRGKRZSA-N	0	0	361.398	2.522	50	5		FFBARN
COC(=O)c1ccc2c(c1)s/c(=N/C(=O)c1cccc([N+](=O)[O-])c1)n2C	ZINC000012180899	206288614	/nfs/dbraw/zinc/28/86/14/206288614.db2.gz	XJTNPMQNTKTQMU-ISLYRVAYSA-N	0	0	371.374	2.676	50	5		FFBARN
CC[C@@H](Sc1ncnc2[nH]cnc21)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000013572003	206303724	/nfs/dbraw/zinc/30/37/24/206303724.db2.gz	KLRWJKSIVSBIIS-LLVKDONJSA-N	0	0	358.383	2.771	50	5		FFBARN
COc1cccc2c1O[C@]1(N3CCOCC3)CCCC[C@H]1[C@H]2C[N+](=O)[O-]	ZINC000013464383	206303266	/nfs/dbraw/zinc/30/32/66/206303266.db2.gz	WZXCWLCTYQZXIV-TXPKVOOTSA-N	0	0	362.426	2.667	50	5		FFBARN
CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])n1	ZINC000015587204	206315416	/nfs/dbraw/zinc/31/54/16/206315416.db2.gz	CDHQHDBFOWOATK-UHFFFAOYSA-N	0	0	362.411	2.670	50	5		FFBARN
Cc1cc(S(=O)(=O)N2CCN=C2c2ccccc2)cc([N+](=O)[O-])c1C	ZINC000019619315	206325874	/nfs/dbraw/zinc/32/58/74/206325874.db2.gz	LUUQXHBJQXRMAD-UHFFFAOYSA-N	0	0	359.407	2.663	50	5		FFBARN
CN(C)[C@H](c1nnnn1-c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-]	ZINC000025178060	206335426	/nfs/dbraw/zinc/33/54/26/206335426.db2.gz	FVWXXRBKCJYWCC-HNNXBMFYSA-N	0	0	358.789	2.875	50	5		FFBARN
CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccccc1OC(F)F	ZINC000040089083	220878366	/nfs/dbraw/zinc/87/83/66/220878366.db2.gz	VNBMWHYJTJZHOU-GFCCVEGCSA-N	0	0	354.313	2.660	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC1	ZINC000001134459	132380466	/nfs/dbraw/zinc/38/04/66/132380466.db2.gz	PESXHAHKTNZJRN-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
CN1CCN(c2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2Cl)CC1	ZINC000004412830	132386956	/nfs/dbraw/zinc/38/69/56/132386956.db2.gz	MDXBSQDWOQSRFD-UHFFFAOYSA-N	0	0	364.789	2.845	50	5		FFBARN
O=C(C1=Cc2ccccc2OC1)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000008728081	132843736	/nfs/dbraw/zinc/84/37/36/132843736.db2.gz	SIKAKWXPYAIPHS-UHFFFAOYSA-N	0	0	365.389	2.719	50	5		FFBARN
COc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC[C@H](C)C3)n2)cc1	ZINC000009329408	132846090	/nfs/dbraw/zinc/84/60/90/132846090.db2.gz	FKQQMFUHQWFTST-NSHDSACASA-N	0	0	358.402	2.956	50	5		FFBARN
COC(=O)c1cccc2c3c([nH]c21)CCN(c1ccc([N+](=O)[O-])cn1)C3	ZINC000025577858	132914100	/nfs/dbraw/zinc/91/41/00/132914100.db2.gz	BLIQGUXVXMJPON-UHFFFAOYSA-N	0	0	352.350	2.820	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CCOC(=O)c1ccc(Br)cc1	ZINC000000799678	506234125	/nfs/dbraw/zinc/23/41/25/506234125.db2.gz	QZTGFZAJZYXXAE-UHFFFAOYSA-N	0	0	354.160	2.719	50	5		FFBARN
O=C(Nc1ccncc1)c1cc(C(=O)Nc2ccncc2)cc([N+](=O)[O-])c1	ZINC000000851636	506237027	/nfs/dbraw/zinc/23/70/27/506237027.db2.gz	OJGWZHQQMRONMV-UHFFFAOYSA-N	0	0	363.333	2.889	50	5		FFBARN
O=C(c1cc2cc([N+](=O)[O-])ccc2oc1=O)N1CCc2ccccc2C1	ZINC000000887205	506239130	/nfs/dbraw/zinc/23/91/30/506239130.db2.gz	QDKLSEVFHPGWDR-UHFFFAOYSA-N	0	0	350.330	2.900	50	5		FFBARN
COC(=O)c1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])cc1	ZINC000001189766	506254293	/nfs/dbraw/zinc/25/42/93/506254293.db2.gz	QSHUQGZPQRQIAG-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
COc1c(C)cccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000004866011	506401368	/nfs/dbraw/zinc/40/13/68/506401368.db2.gz	OHNOUFCJZOYCOF-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
CC1(C)OC(=O)C2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@H]32)C(=O)O1	ZINC000005515968	506445986	/nfs/dbraw/zinc/44/59/86/506445986.db2.gz	XDJPVSBZBVEMJZ-HNNXBMFYSA-N	0	0	374.393	2.722	50	5		FFBARN
CC(=O)Nc1ccc(C(=O)N2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-]	ZINC000006293847	506474172	/nfs/dbraw/zinc/47/41/72/506474172.db2.gz	YXGVPJYXVRAKFK-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
CC(=O)c1ccc(N2CCN(C(=O)c3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000007751592	506588092	/nfs/dbraw/zinc/58/80/92/506588092.db2.gz	VSZGDILAIIVNMW-UHFFFAOYSA-N	0	0	353.378	2.760	50	5		FFBARN
CCCCn1c2nc(-c3ccc(C)c([N+](=O)[O-])c3)n(CC)c2c(=O)[nH]c1=O	ZINC000012531676	506871564	/nfs/dbraw/zinc/87/15/64/506871564.db2.gz	CTBAJOXSOWBXQI-UHFFFAOYSA-N	0	0	371.397	2.590	50	5		FFBARN
O=C(NCC1(N2CCOCC2)CCCCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000012750907	506896404	/nfs/dbraw/zinc/89/64/04/506896404.db2.gz	YVBDXXJDMIJFKN-UHFFFAOYSA-N	0	0	362.430	2.751	50	5		FFBARN
Cc1ccc(OCCN(C)S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000014737440	506997790	/nfs/dbraw/zinc/99/77/90/506997790.db2.gz	XMUQBLJMEWCXBF-UHFFFAOYSA-N	0	0	350.396	2.603	50	5		FFBARN
COc1cc(N2CCN(Cc3ccccc3)CC2)c([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000019606439	507185708	/nfs/dbraw/zinc/18/57/08/507185708.db2.gz	WYWIESAVKJSHDH-UHFFFAOYSA-N	0	0	372.381	2.834	50	5		FFBARN
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1	ZINC000023054897	507326608	/nfs/dbraw/zinc/32/66/08/507326608.db2.gz	AKTDHUORLJJWPF-UHFFFAOYSA-N	0	0	362.769	2.992	50	5		FFBARN
COC(=O)C(C)(C)NC(=O)c1ccc(N2CCCCCC2)c([N+](=O)[O-])c1	ZINC000023176336	507337361	/nfs/dbraw/zinc/33/73/61/507337361.db2.gz	VXSBEKSWAGRPHY-UHFFFAOYSA-N	0	0	363.414	2.657	50	5		FFBARN
Cc1nn(C)c(NC[C@@H](O)COc2ccc(C(F)(F)F)cc2)c1[N+](=O)[O-]	ZINC000058160212	507376892	/nfs/dbraw/zinc/37/68/92/507376892.db2.gz	QFJLQBVTBBGUIW-LLVKDONJSA-N	0	0	374.319	2.507	50	5		FFBARN
O=C(Nc1ccc(NC(=O)[C@H]2CCCO2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000030175911	507803422	/nfs/dbraw/zinc/80/34/22/507803422.db2.gz	GLFPWIOYKXYHHP-MRXNPFEDSA-N	0	0	355.350	2.965	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCc1ccccc1OC(F)F	ZINC000030330862	507806818	/nfs/dbraw/zinc/80/68/18/507806818.db2.gz	UVQLHXUIGKSGAL-UHFFFAOYSA-N	0	0	372.349	2.983	50	5		FFBARN
CCCc1ccc(OCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000030835914	507813625	/nfs/dbraw/zinc/81/36/25/507813625.db2.gz	UAXPUGYAJNMCMV-UHFFFAOYSA-N	0	0	364.423	2.905	50	5		FFBARN
O=C(c1ccn(-c2cccc([N+](=O)[O-])c2)n1)N1CCn2c3ccccc3nc21	ZINC000031276992	507818786	/nfs/dbraw/zinc/81/87/86/507818786.db2.gz	AKWHLPMBSQXVQH-UHFFFAOYSA-N	0	0	374.360	2.791	50	5		FFBARN
O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)c1ccc(N2CCCC2=O)cc1	ZINC000089781076	507865873	/nfs/dbraw/zinc/86/58/73/507865873.db2.gz	JPUZXAFTZBCYAC-UHFFFAOYSA-N	0	0	365.349	2.850	50	5		FFBARN
COCc1cc([N+](=O)[O-])ccc1NC(=O)NCc1ccc(OC)c(O)c1	ZINC000079072999	507930487	/nfs/dbraw/zinc/93/04/87/507930487.db2.gz	QAEVUWNJQPFTMY-UHFFFAOYSA-N	0	0	361.354	2.777	50	5		FFBARN
COC(=O)c1ccc(N[C@@H]2CCc3nc(C(C)C)nn3C2)c([N+](=O)[O-])c1	ZINC000225384530	509369279	/nfs/dbraw/zinc/36/92/79/509369279.db2.gz	BSLJFLGXHIDATC-GFCCVEGCSA-N	0	0	359.386	2.523	50	5		FFBARN
C[C@@H]1CN(C[C@H]2CCCN2C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](C)O1	ZINC000229657182	509426531	/nfs/dbraw/zinc/42/65/31/509426531.db2.gz	HPGJFSQSGOEBLG-JKIFEVAISA-N	0	0	362.430	2.700	50	5		FFBARN
Cc1cccn2cc(CCNC(=O)N3Cc4ccc([N+](=O)[O-])cc4C3)nc12	ZINC000170649322	509698617	/nfs/dbraw/zinc/69/86/17/509698617.db2.gz	BNYUNOFPBBXYRZ-UHFFFAOYSA-N	0	0	365.393	2.819	50	5		FFBARN
Cc1nc([N+](=O)[O-])cn1CCC(=O)Nc1nc2ccc(Cl)nc2s1	ZINC000239722495	509840371	/nfs/dbraw/zinc/84/03/71/509840371.db2.gz	CCYHIUHWJDLXQH-UHFFFAOYSA-N	0	0	366.790	2.787	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)c1ccc(C(F)(F)F)nn1	ZINC000408516035	513083946	/nfs/dbraw/zinc/08/39/46/513083946.db2.gz	FPBMXYDLEYHPCR-UHFFFAOYSA-N	0	0	369.303	2.746	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)CC1	ZINC000000663188	524551401	/nfs/dbraw/zinc/55/14/01/524551401.db2.gz	DELWTZIFAJXCGJ-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1cccs1	ZINC000020910667	526469945	/nfs/dbraw/zinc/46/99/45/526469945.db2.gz	NSFWMSRLAMFAOD-UHFFFAOYSA-N	0	0	361.379	2.661	50	5		FFBARN
CCCn1c2ccccc2nc1NC(=O)Cn1nc(C)c([N+](=O)[O-])c1C	ZINC000009219544	571131598	/nfs/dbraw/zinc/13/15/98/571131598.db2.gz	KMMMHQJXDWQVOB-UHFFFAOYSA-N	0	0	356.386	2.807	50	5		FFBARN
COCCNC(=O)/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1	ZINC000050549770	963265662	/nfs/dbraw/zinc/26/56/62/963265662.db2.gz	TVTOHLYVSFPDEV-QINSGFPZSA-N	0	0	366.377	2.774	50	5		FFBARN
COc1ccccc1NC(=O)COC(=O)/C=C\c1ccccc1[N+](=O)[O-]	ZINC000034779865	989328216	/nfs/dbraw/zinc/32/82/16/989328216.db2.gz	DCPYRMVSWPXQQG-KHPPLWFESA-N	0	0	356.334	2.799	50	5		FFBARN
CCOC(=O)N(c1ccccc1)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000000939680	203965167	/nfs/dbraw/zinc/96/51/67/203965167.db2.gz	UIOUESMTWHRHKE-UHFFFAOYSA-N	0	0	350.352	2.947	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)NCCOc1ccc(Cl)cc1	ZINC000002461756	204039546	/nfs/dbraw/zinc/03/95/46/204039546.db2.gz	ZURZFQFIJVSRJE-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
Cc1c(N(C)C(=O)c2ccc([N+](=O)[O-])cc2)c(=O)n(-c2ccccc2)n1C	ZINC000001431550	204007332	/nfs/dbraw/zinc/00/73/32/204007332.db2.gz	YNKCIUROENHSIM-UHFFFAOYSA-N	0	0	366.377	2.669	50	5		FFBARN
Cc1sc(NC(=O)COc2ccc(C)cc2[N+](=O)[O-])c(C(N)=O)c1C	ZINC000002745058	204055055	/nfs/dbraw/zinc/05/50/55/204055055.db2.gz	MSOZNPOZXXRIFB-UHFFFAOYSA-N	0	0	363.395	2.698	50	5		FFBARN
O=C1C(=O)N(Cc2ccccc2Cl)C(=O)N1Cc1ccc([N+](=O)[O-])cc1	ZINC000004013550	204117979	/nfs/dbraw/zinc/11/79/79/204117979.db2.gz	AAMVBOZNQSWKJR-UHFFFAOYSA-N	0	0	373.752	2.739	50	5		FFBARN
CC(C)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O	ZINC000004039510	204118383	/nfs/dbraw/zinc/11/83/83/204118383.db2.gz	IZSYVWIYRQVJAT-MRXNPFEDSA-N	0	0	367.361	2.854	50	5		FFBARN
O=C1OC=C2Nc3cc4c(cc3[C@H](c3ccc([N+](=O)[O-])cc3)C12)OCO4	ZINC000004053900	204119397	/nfs/dbraw/zinc/11/93/97/204119397.db2.gz	UFLARJIDXUFMBO-INIZCTEOSA-N	0	0	352.302	2.692	50	5		FFBARN
Cc1ccn2c(c1)nc(=O)c1cc(S(=O)(=O)N3CCC(C)CC3)ccc12	ZINC000004708646	204157607	/nfs/dbraw/zinc/15/76/07/204157607.db2.gz	MOJQDLRCDHAOIR-UHFFFAOYSA-N	0	0	371.462	2.577	50	5		FFBARN
Cn1c(SCC(=O)Nc2ccccc2[N+](=O)[O-])nc2ccccc2c1=O	ZINC000004845409	204169702	/nfs/dbraw/zinc/16/97/02/204169702.db2.gz	WMTMMSCBMCVVGH-UHFFFAOYSA-N	0	0	370.390	2.573	50	5		FFBARN
CC(=O)c1c(C)[nH]c(C(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C	ZINC000004548367	204146076	/nfs/dbraw/zinc/14/60/76/204146076.db2.gz	AZHNNCREVDTUSI-LBPRGKRZSA-N	0	0	373.365	2.926	50	5		FFBARN
O=C(Nc1ccccc1)c1cccn(OCc2cccc([N+](=O)[O-])c2)c1=O	ZINC000005054672	204188532	/nfs/dbraw/zinc/18/85/32/204188532.db2.gz	KLMURSYAVNPWJD-UHFFFAOYSA-N	0	0	365.345	2.638	50	5		FFBARN
Nc1nc(NC[C@@H]2CCCO2)nc(Nc2ccc(Cl)cc2)c1[N+](=O)[O-]	ZINC000005067822	204189351	/nfs/dbraw/zinc/18/93/51/204189351.db2.gz	RCPDCWQZDGUROD-NSHDSACASA-N	0	0	364.793	2.955	50	5		FFBARN
O=C(Nc1nc2ccc(OC(F)F)cc2s1)c1n[nH]cc1[N+](=O)[O-]	ZINC000006448511	204248173	/nfs/dbraw/zinc/24/81/73/204248173.db2.gz	WDYZDUJCJAFZPQ-UHFFFAOYSA-N	0	0	355.282	2.781	50	5		FFBARN
COc1cc(NC(=O)CN(C)CCOc2ccccc2)c(C)cc1[N+](=O)[O-]	ZINC000006636864	204257487	/nfs/dbraw/zinc/25/74/87/204257487.db2.gz	SVUBXWDDLOONMZ-UHFFFAOYSA-N	0	0	373.409	2.861	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1OCC(=O)NCCCN(C)c1ccccc1	ZINC000007099198	204289317	/nfs/dbraw/zinc/28/93/17/204289317.db2.gz	XKLPKVDUGXUHPQ-UHFFFAOYSA-N	0	0	373.409	2.625	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)COc1cc(F)ccc1[N+](=O)[O-]	ZINC000007159121	204290298	/nfs/dbraw/zinc/29/02/98/204290298.db2.gz	AVZTVIBIXANXHR-LLVKDONJSA-N	0	0	373.340	2.877	50	5		FFBARN
CNS(=O)(=O)c1ccc(N2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1	ZINC000007981800	204312874	/nfs/dbraw/zinc/31/28/74/204312874.db2.gz	CSNDDISZFILDPE-ZDUSSCGKSA-N	0	0	367.452	2.906	50	5		FFBARN
Cc1cc(OCC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)ccc1[N+](=O)[O-]	ZINC000008252235	204324018	/nfs/dbraw/zinc/32/40/18/204324018.db2.gz	KSOOWNPEGBCHFQ-UHFFFAOYSA-N	0	0	357.366	2.729	50	5		FFBARN
O=C(NCCc1ccc(Cl)cc1Cl)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000008389562	204330281	/nfs/dbraw/zinc/33/02/81/204330281.db2.gz	YZQYMLKLIAZACS-UHFFFAOYSA-N	0	0	356.165	2.562	50	5		FFBARN
O=C(NCCCNC(=O)c1ccccc1[N+](=O)[O-])c1cc2ccccc2[nH]1	ZINC000008404244	204330383	/nfs/dbraw/zinc/33/03/83/204330383.db2.gz	GAJFOTHDPNWAMU-UHFFFAOYSA-N	0	0	366.377	2.626	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H](C)OC(=O)c1cccs1	ZINC000007533830	204300776	/nfs/dbraw/zinc/30/07/76/204300776.db2.gz	IBTCJZRIFZGDLN-SECBINFHSA-N	0	0	350.352	2.849	50	5		FFBARN
Cn1ccnc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	ZINC000009115210	204354354	/nfs/dbraw/zinc/35/43/54/204354354.db2.gz	XCUVNCZXFBHQPE-INIZCTEOSA-N	0	0	354.341	2.987	50	5		FFBARN
CNS(=O)(=O)c1ccc(Nc2ccc(OC(F)F)cc2)c([N+](=O)[O-])c1	ZINC000009471160	204369429	/nfs/dbraw/zinc/36/94/29/204369429.db2.gz	SCGYGKDWDXBTRO-UHFFFAOYSA-N	0	0	373.337	2.848	50	5		FFBARN
CN(C[C@H]1COc2ccccc2O1)C(=O)CSc1ccc([N+](=O)[O-])cc1	ZINC000013021794	204521389	/nfs/dbraw/zinc/52/13/89/204521389.db2.gz	VVJXVUIPVVCCIS-AWEZNQCLSA-N	0	0	374.418	2.985	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1cccs1	ZINC000015179646	204606276	/nfs/dbraw/zinc/60/62/76/204606276.db2.gz	RYNPLCHKEAQIKG-GFCCVEGCSA-N	0	0	361.423	2.996	50	5		FFBARN
O=C([C@H]1CC(=O)Nc2cc(F)ccc21)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000029888910	204905720	/nfs/dbraw/zinc/90/57/20/204905720.db2.gz	RSHWILZVBOOXSN-AWEZNQCLSA-N	0	0	355.325	2.749	50	5		FFBARN
CNc1ccc(C(=O)N[C@@H](CC(=O)OC)c2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000032821115	204940082	/nfs/dbraw/zinc/94/00/82/204940082.db2.gz	ORLJBBGGWVETFB-INIZCTEOSA-N	0	0	371.393	2.979	50	5		FFBARN
O=[N+]([O-])c1ccc(NCC2(c3ccc4c(c3)OCO4)CCOCC2)nc1	ZINC000058162555	205252700	/nfs/dbraw/zinc/25/27/00/205252700.db2.gz	DHSAUGKRLPFQJF-UHFFFAOYSA-N	0	0	357.366	2.879	50	5		FFBARN
CC(C)C(=O)N1CCC(C(=O)Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1	ZINC000079056817	205637052	/nfs/dbraw/zinc/63/70/52/205637052.db2.gz	RDEACWJKPTZOHJ-UHFFFAOYSA-N	0	0	370.409	2.976	50	5		FFBARN
CN(Cc1cnn(-c2ccccc2)c1)C(=O)CNc1ccccc1[N+](=O)[O-]	ZINC000048325696	206082915	/nfs/dbraw/zinc/08/29/15/206082915.db2.gz	TVHOXBCLEQRMDC-UHFFFAOYSA-N	0	0	365.393	2.851	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)CC2=O)cc1C	ZINC000004497045	206178628	/nfs/dbraw/zinc/17/86/28/206178628.db2.gz	QFXQJHXHLHQGRE-MRXNPFEDSA-N	0	0	367.405	2.676	50	5		FFBARN
CS(=O)(=O)c1ccccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000012793720	206297147	/nfs/dbraw/zinc/29/71/47/206297147.db2.gz	GSRAENRVRJKOQC-UHFFFAOYSA-N	0	0	354.771	2.904	50	5		FFBARN
CCCc1cc(=O)[nH]c(SCC(=O)Nc2ccc([N+](=O)[O-])cc2C)n1	ZINC000016045971	206317697	/nfs/dbraw/zinc/31/76/97/206317697.db2.gz	JJRHSIQSFHFFPX-UHFFFAOYSA-N	0	0	362.411	2.670	50	5		FFBARN
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000022278776	206369902	/nfs/dbraw/zinc/36/99/02/206369902.db2.gz	OQJPVKRWKWNNRT-UHFFFAOYSA-N	0	0	364.379	2.534	50	5		FFBARN
CC(=O)c1ccc(Sc2nnc(N3CCOCC3)s2)c([N+](=O)[O-])c1	ZINC000058163104	206391412	/nfs/dbraw/zinc/39/14/12/206391412.db2.gz	YJIMTAUSHMSTCZ-UHFFFAOYSA-N	0	0	366.424	2.637	50	5		FFBARN
CNC(=O)c1ccc(N[C@@H](C)COc2ccccc2OC)c([N+](=O)[O-])c1	ZINC000058172318	206396407	/nfs/dbraw/zinc/39/64/07/206396407.db2.gz	JDQWFXALXZUOJI-LBPRGKRZSA-N	0	0	359.382	2.842	50	5		FFBARN
CC(=O)c1ccc(N2CCN(c3cc(Cl)ncn3)CC2)c([N+](=O)[O-])c1	ZINC000095997023	132216780	/nfs/dbraw/zinc/21/67/80/132216780.db2.gz	MXUGCKIXGCKCSX-UHFFFAOYSA-N	0	0	361.789	2.567	50	5		FFBARN
C[C@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1	ZINC000008132127	132259465	/nfs/dbraw/zinc/25/94/65/132259465.db2.gz	FOAHQAYQBIMCRI-IUCAKERBSA-N	0	0	368.333	2.502	50	5		FFBARN
O=C(CNc1ccc(F)c([N+](=O)[O-])c1)Nc1ccc(N2CCOCC2)cc1	ZINC000007972822	132842068	/nfs/dbraw/zinc/84/20/68/132842068.db2.gz	GSICPYQETVXLMG-UHFFFAOYSA-N	0	0	374.372	2.621	50	5		FFBARN
C[C@H]1C(=O)N(c2ccc(F)cc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000037275670	132940712	/nfs/dbraw/zinc/94/07/12/132940712.db2.gz	UCAJHMREZQSYSF-LBPRGKRZSA-N	0	0	357.341	2.611	50	5		FFBARN
COc1ccc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1	ZINC000055543099	136126794	/nfs/dbraw/zinc/12/67/94/136126794.db2.gz	JZBSULNWXIPUAV-UHFFFAOYSA-N	0	0	357.410	2.934	50	5		FFBARN
CCN1CCN(c2nc(C)c([N+](=O)[O-])c(Nc3ccc(C)cc3)n2)CC1	ZINC000056905962	136127963	/nfs/dbraw/zinc/12/79/63/136127963.db2.gz	QRFGSOFQGMREEZ-UHFFFAOYSA-N	0	0	356.430	2.887	50	5		FFBARN
CC(=O)c1ccc(N2CCN(CCOc3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000069447872	136138059	/nfs/dbraw/zinc/13/80/59/136138059.db2.gz	XYBGJWLASJBIEV-UHFFFAOYSA-N	0	0	369.421	2.998	50	5		FFBARN
CCCC1=C[C@@](O)(C(F)(F)F)N(C(=O)Cc2ccc([N+](=O)[O-])cc2)N1	ZINC000000845887	506235052	/nfs/dbraw/zinc/23/50/52/506235052.db2.gz	HWKFJSRQQSFMRN-CQSZACIVSA-N	0	0	359.304	2.777	50	5		FFBARN
COc1ccccc1[C@@H]1c2c(c3ccccc3oc2=O)OC(N)=C1[N+](=O)[O-]	ZINC000000989292	506241935	/nfs/dbraw/zinc/24/19/35/506241935.db2.gz	WSGCDVOWKYOSPM-CQSZACIVSA-N	0	0	366.329	2.730	50	5		FFBARN
C[C@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000001025701	506243697	/nfs/dbraw/zinc/24/36/97/506243697.db2.gz	YVYVINMYBSLRMG-VOJFVSQTSA-N	0	0	372.333	2.815	50	5		FFBARN
COc1cc(C=C2NC(=S)NC2=O)ccc1Oc1ccc([N+](=O)[O-])cn1	ZINC000001029135	506243943	/nfs/dbraw/zinc/24/39/43/506243943.db2.gz	KJNJOHKKTPLNHY-IZZDOVSWSA-N	0	0	372.362	2.547	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc(C)c([N+](=O)[O-])c2)cc1	ZINC000001173522	506252206	/nfs/dbraw/zinc/25/22/06/506252206.db2.gz	QNYYHBDKOOZBOO-UHFFFAOYSA-N	0	0	372.406	2.988	50	5		FFBARN
O=C(NC[C@H](c1ccccc1)N1CCOCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000032779500	506295792	/nfs/dbraw/zinc/29/57/92/506295792.db2.gz	VDZZRAIYNHEZEC-GOSISDBHSA-N	0	0	370.409	2.790	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000032806089	506297234	/nfs/dbraw/zinc/29/72/34/506297234.db2.gz	VRUNKLDHQHJFSZ-SFHVURJKSA-N	0	0	370.409	2.790	50	5		FFBARN
Cc1noc(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000033086862	506334037	/nfs/dbraw/zinc/33/40/37/506334037.db2.gz	PJHICNZVRHATSJ-AWEZNQCLSA-N	0	0	351.384	2.725	50	5		FFBARN
O=c1c([N+](=O)[O-])c(N2CCOCC2)c2ccccc2n1Cc1ccccc1	ZINC000004264108	506368289	/nfs/dbraw/zinc/36/82/89/506368289.db2.gz	DHANKIRGNBQRIS-UHFFFAOYSA-N	0	0	365.389	2.795	50	5		FFBARN
COc1cccc(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)c1	ZINC000004977928	506411038	/nfs/dbraw/zinc/41/10/38/506411038.db2.gz	LYHDHDQOYKWABN-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
CN(Cc1ccccc1N1CCOCC1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000009119111	506684063	/nfs/dbraw/zinc/68/40/63/506684063.db2.gz	HUBZSKWBHDQCDD-UHFFFAOYSA-N	0	0	355.394	2.704	50	5		FFBARN
COCCNc1ccc(C(=O)N2CCc3sccc3C2)cc1[N+](=O)[O-]	ZINC000012216259	506836198	/nfs/dbraw/zinc/83/61/98/506836198.db2.gz	MLDFNSZEZBLINM-UHFFFAOYSA-N	0	0	361.423	2.913	50	5		FFBARN
O=C(CCNc1ccc([N+](=O)[O-])cn1)NCCc1c[nH]c2ccc(F)cc12	ZINC000013725369	506953263	/nfs/dbraw/zinc/95/32/63/506953263.db2.gz	UUJOGCHFBBOGAH-UHFFFAOYSA-N	0	0	371.372	2.771	50	5		FFBARN
O=[N+]([O-])c1cc(F)ccc1N1CCN(Cc2cn3ccccc3n2)CC1	ZINC000045615313	506991583	/nfs/dbraw/zinc/99/15/83/506991583.db2.gz	NZTRLHSVZXRBMO-UHFFFAOYSA-N	0	0	355.373	2.704	50	5		FFBARN
O=C(NCCSc1ccccc1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000015833470	507063492	/nfs/dbraw/zinc/06/34/92/507063492.db2.gz	UVUDKMGTMUHARJ-UHFFFAOYSA-N	0	0	369.406	2.698	50	5		FFBARN
Cc1cc(OCC2N=NC(=S)N2C[C@@H]2CCCO2)ccc1[N+](=O)[O-]	ZINC000017072692	507112827	/nfs/dbraw/zinc/11/28/27/507112827.db2.gz	GNJDQPIBRWZMTF-LBPRGKRZSA-N	0	0	350.400	2.541	50	5		FFBARN
Cn1ccnc1[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000017590102	507126266	/nfs/dbraw/zinc/12/62/66/507126266.db2.gz	OCEBNRBHZPEHHH-MRXNPFEDSA-N	0	0	351.366	2.629	50	5		FFBARN
CN1CCc2nc(NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)sc2C1	ZINC000018103972	507136918	/nfs/dbraw/zinc/13/69/18/507136918.db2.gz	KRPXBCNFKOWGQT-UHFFFAOYSA-N	0	0	373.438	2.866	50	5		FFBARN
Cc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@@H](C)O[C@@H](C)C3)n2)c1	ZINC000018114834	507138709	/nfs/dbraw/zinc/13/87/09/507138709.db2.gz	RXYPIRVTRFPUBB-TXEJJXNPSA-N	0	0	358.402	2.633	50	5		FFBARN
Cn1ccnc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1F	ZINC000018236574	507146979	/nfs/dbraw/zinc/14/69/79/507146979.db2.gz	BUOVZHWYFYGZGW-INIZCTEOSA-N	0	0	354.341	2.987	50	5		FFBARN
COC(=O)c1cccc(COC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1	ZINC000021326626	507250270	/nfs/dbraw/zinc/25/02/70/507250270.db2.gz	OXMTYWDODOKOJD-UHFFFAOYSA-N	0	0	373.317	2.525	50	5		FFBARN
O=c1c2cnc3nc4ccccc4n3c2ccn1-c1ccc2c(c1)OCO2	ZINC000022607822	507299689	/nfs/dbraw/zinc/29/96/89/507299689.db2.gz	IKGUCTAJIFGBJR-UHFFFAOYSA-N	0	0	356.341	2.915	50	5		FFBARN
COc1cc(/C=C2\SC(=N)NC2=O)ccc1Oc1ccc([N+](=O)[O-])cn1	ZINC000023128334	507331953	/nfs/dbraw/zinc/33/19/53/507331953.db2.gz	WCZDGRYMKSPZLK-QPEQYQDCSA-N	0	0	372.362	2.929	50	5		FFBARN
CS(=O)(=O)c1ccc(C(=O)Nc2cnc3ccccc3c2)cc1[N+](=O)[O-]	ZINC000025156148	507470530	/nfs/dbraw/zinc/47/05/30/507470530.db2.gz	IUMLYPGVRWSMCZ-UHFFFAOYSA-N	0	0	371.374	2.799	50	5		FFBARN
O=[N+]([O-])c1ccc2[nH]c(COCc3nc4cc([N+](=O)[O-])ccc4[nH]3)nc2c1	ZINC000071773618	507714783	/nfs/dbraw/zinc/71/47/83/507714783.db2.gz	ZQPXNYLXYNRFNP-UHFFFAOYSA-N	0	0	368.309	2.972	50	5	in-vitro	FFBARN
Cc1cc(=O)c(C(=O)OCc2ccc([N+](=O)[O-])cc2)nn1-c1ccccc1	ZINC000030745076	507812721	/nfs/dbraw/zinc/81/27/21/507812721.db2.gz	HUCRFIJTTDUJHU-UHFFFAOYSA-N	0	0	365.345	2.806	50	5		FFBARN
COc1cccc(N2CC[C@@H](C[NH2+]Cc3cc([O-])ccc3[N+](=O)[O-])C2)c1	ZINC000079046048	507927777	/nfs/dbraw/zinc/92/77/77/507927777.db2.gz	DEECICJYKMMRAY-AWEZNQCLSA-N	0	0	357.410	2.925	50	5		FFBARN
O=[N+]([O-])c1ccc(OCc2cc(-c3ccccc3)on2)c(-n2cnnn2)c1	ZINC000095438564	508185084	/nfs/dbraw/zinc/18/50/84/508185084.db2.gz	KLPMXGFUBSQJSZ-UHFFFAOYSA-N	0	0	364.321	2.805	50	5		FFBARN
CC(=O)c1ccc(NCc2nc3ccccc3c(=O)n2C)c([N+](=O)[O-])c1	ZINC000095467620	508187580	/nfs/dbraw/zinc/18/75/80/508187580.db2.gz	RFOCRYHXGQSPAL-UHFFFAOYSA-N	0	0	352.350	2.656	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccccc1Cl	ZINC000100852821	508240488	/nfs/dbraw/zinc/24/04/88/508240488.db2.gz	HQLLCKYHWPVNOU-HIFRSBDPSA-N	0	0	371.736	2.541	50	5		FFBARN
O=[N+]([O-])c1cccc(NC(=S)NCCn2cc(Br)cn2)c1	ZINC000001121620	219373745	/nfs/dbraw/zinc/37/37/45/219373745.db2.gz	SBUYLHFTIRCDMJ-UHFFFAOYSA-N	0	0	370.232	2.540	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N(C)C1CCCCC1	ZINC000000826479	203954837	/nfs/dbraw/zinc/95/48/37/203954837.db2.gz	LNLGGHUMQUQBCU-UHFFFAOYSA-N	0	0	359.224	2.653	50	5		FFBARN
O=C(COC(=O)c1cc2ccccc2oc1=O)c1ccc([N+](=O)[O-])cc1	ZINC000000853076	203957577	/nfs/dbraw/zinc/95/75/77/203957577.db2.gz	DGZDSGFNPOHLDI-UHFFFAOYSA-N	0	0	353.286	2.741	50	5		FFBARN
Cc1ccccc1-c1nc2s/c(=C\c3cccc([N+](=O)[O-])c3)c(=O)n2n1	ZINC000001316347	203997738	/nfs/dbraw/zinc/99/77/38/203997738.db2.gz	WZNVJKHGWHJFEE-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
Cn1c2ccccc2c2c(c1=O)[C@@H](c1cccc([N+](=O)[O-])c1)CC(=O)O2	ZINC000001427618	204007640	/nfs/dbraw/zinc/00/76/40/204007640.db2.gz	HMHMPPHSHXVNIE-CQSZACIVSA-N	0	0	350.330	2.888	50	5		FFBARN
COc1cc(C(C)=O)ccc1OC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000001800537	204020051	/nfs/dbraw/zinc/02/00/51/204020051.db2.gz	DHRMSFQJPBCMRA-UHFFFAOYSA-N	0	0	360.278	2.933	50	5		FFBARN
COc1cccc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c1OC	ZINC000002312846	204032898	/nfs/dbraw/zinc/03/28/98/204032898.db2.gz	JAFWNCONVGZGHQ-UVTDQMKNSA-N	0	0	354.318	2.957	50	5		FFBARN
COc1ccc(Cn2c(C)nc3c(c(=O)c4ccccc4n3C)c2=O)cc1	ZINC000002362222	204035566	/nfs/dbraw/zinc/03/55/66/204035566.db2.gz	RFCAHNGSLNKVGR-UHFFFAOYSA-N	0	0	361.401	2.614	50	5		FFBARN
O=C(CCC1CCCC1)Nc1cc(SC[C@H](O)CO)cc([N+](=O)[O-])c1	ZINC000002765315	204056052	/nfs/dbraw/zinc/05/60/52/204056052.db2.gz	UCFFGQHQRAPVFS-OAHLLOKOSA-N	0	0	368.455	2.949	50	5		FFBARN
CC(C)OC[C@@H]1C[C@@H](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000004132669	204123668	/nfs/dbraw/zinc/12/36/68/204123668.db2.gz	YBAGMGBNHBRAAY-DOMZBBRYSA-N	0	0	350.371	2.670	50	5		FFBARN
CSc1ncccc1C(=O)O[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003450901	204101492	/nfs/dbraw/zinc/10/14/92/204101492.db2.gz	LPLRJKPUFFNDFX-SNVBAGLBSA-N	0	0	361.379	2.896	50	5		FFBARN
CC(=O)Nc1cccc(C(=O)O[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000003519213	204104280	/nfs/dbraw/zinc/10/42/80/204104280.db2.gz	MVORXEHTAWONCD-LLVKDONJSA-N	0	0	371.349	2.737	50	5		FFBARN
COC(=O)C[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])N1CCC(C)CC1	ZINC000004653662	204151514	/nfs/dbraw/zinc/15/15/14/204151514.db2.gz	QCFINVNXBNIQLN-MRXNPFEDSA-N	0	0	363.414	2.505	50	5		FFBARN
COC(=O)[C@@H](C)N1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2Cl)C1=O	ZINC000004695146	204155561	/nfs/dbraw/zinc/15/55/61/204155561.db2.gz	WDMVEPJOKGCNPA-PKTIUJEHSA-N	0	0	370.770	2.846	50	5		FFBARN
CN1C2=C(C(=O)N(c3ccccc3)C2)[C@H](c2cccc([N+](=O)[O-])c2)NC1=O	ZINC000004727976	204159347	/nfs/dbraw/zinc/15/93/47/204159347.db2.gz	CPFFQGYMPDMGJD-KRWDZBQOSA-N	0	0	364.361	2.592	50	5		FFBARN
O=C(/C=C/c1ccc2c(c1)OCO2)OCC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000004836437	204167458	/nfs/dbraw/zinc/16/74/58/204167458.db2.gz	VYSSLRYUVJGNJG-SOFGYWHQSA-N	0	0	370.317	2.519	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCNc2c(Cl)cccc2[N+](=O)[O-])cc1	ZINC000004512950	204142831	/nfs/dbraw/zinc/14/28/31/204142831.db2.gz	KAHLTLPTEGBRDZ-UHFFFAOYSA-N	0	0	369.830	2.947	50	5		FFBARN
CC(=O)c1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc(N)c([N+](=O)[O-])c2)cc1	ZINC000004868528	204171936	/nfs/dbraw/zinc/17/19/36/204171936.db2.gz	DCDJTLSHNPCSEX-LLVKDONJSA-N	0	0	371.349	2.564	50	5		FFBARN
O=[N+]([O-])c1nn(-c2cccc(Cl)c2)[n+]([O-])c1NCCc1ccccc1	ZINC000004923641	204176654	/nfs/dbraw/zinc/17/66/54/204176654.db2.gz	BSOIETFQLQQPJI-UHFFFAOYSA-N	0	0	359.773	2.722	50	5		FFBARN
COc1ccc(CCNC(=O)c2noc(C(C)C)c2[N+](=O)[O-])cc1OC	ZINC000004937635	204178436	/nfs/dbraw/zinc/17/84/36/204178436.db2.gz	SGJSBIGVTQNROC-UHFFFAOYSA-N	0	0	363.370	2.696	50	5		FFBARN
CC(C)(C)NC(=O)c1ccc2c(c1)C(=O)N(c1ccc([N+](=O)[O-])cc1)C2=O	ZINC000005029817	204186470	/nfs/dbraw/zinc/18/64/70/204186470.db2.gz	ZXTTVJPEQCPPRM-UHFFFAOYSA-N	0	0	367.361	2.924	50	5		FFBARN
Cc1ccc(N2C(=O)C[C@@]3(CC(c4ccc([N+](=O)[O-])cc4)=NO3)C2=O)cc1	ZINC000005055027	204187941	/nfs/dbraw/zinc/18/79/41/204187941.db2.gz	MYWHFLYOLAXXJZ-IBGZPJMESA-N	0	0	365.345	2.730	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1cccc([N+](=O)[O-])c1)NC1CCCCC1	ZINC000005066490	204189701	/nfs/dbraw/zinc/18/97/01/204189701.db2.gz	PTHPHXTVFDPNIN-UHFFFAOYSA-N	0	0	362.382	2.550	50	5		FFBARN
COc1ccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)cc1OC	ZINC000005251727	204199731	/nfs/dbraw/zinc/19/97/31/204199731.db2.gz	ZYWYISXHNBWGKR-UHFFFAOYSA-N	0	0	356.342	2.640	50	5		FFBARN
O=C(NC(=S)Nc1cccc2nsnc21)c1ccc([N+](=O)[O-])cc1	ZINC000005716570	204221631	/nfs/dbraw/zinc/22/16/31/204221631.db2.gz	WJUZMJJPJJOMJI-UHFFFAOYSA-N	0	0	359.392	2.726	50	5		FFBARN
O=C(OCN1C(=O)c2ccccc2C1=O)c1cc(Cl)ccc1[N+](=O)[O-]	ZINC000006863019	204277310	/nfs/dbraw/zinc/27/73/10/204277310.db2.gz	HHFHRKHMVGDHGD-UHFFFAOYSA-N	0	0	360.709	2.659	50	5		FFBARN
CCN(CC)C(=O)[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000007920697	204309713	/nfs/dbraw/zinc/30/97/13/204309713.db2.gz	HSJOTVQVCWWXMD-QGZVFWFLSA-N	0	0	371.393	2.944	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)C1CCN(C(=O)c2ccco2)CC1	ZINC000008246562	204323773	/nfs/dbraw/zinc/32/37/73/204323773.db2.gz	MXWRKMCGOTVVIA-UHFFFAOYSA-N	0	0	373.365	2.687	50	5		FFBARN
O=C(Nn1cn[nH]c1=S)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1	ZINC000009221254	204358197	/nfs/dbraw/zinc/35/81/97/204358197.db2.gz	GINDEHAVIABJMX-UHFFFAOYSA-N	0	0	356.367	2.976	50	5		FFBARN
COc1ccc([C@]2(C)NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1	ZINC000009479602	204369511	/nfs/dbraw/zinc/36/95/11/204369511.db2.gz	BVZWNXWYYSKDDQ-SFHVURJKSA-N	0	0	355.350	2.571	50	5		FFBARN
O=C1C[C@@H](c2ccc([N+](=O)[O-])cc2)c2c(=O)[nH]c(-c3ccccc3)nc2N1	ZINC000008738975	204342403	/nfs/dbraw/zinc/34/24/03/204342403.db2.gz	HGFXAXKLPATAKY-AWEZNQCLSA-N	0	0	362.345	2.819	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H]1c1nnc2n1CCCCC2	ZINC000040080148	205053371	/nfs/dbraw/zinc/05/33/71/205053371.db2.gz	OXIJSLOQHDVNOJ-MRXNPFEDSA-N	0	0	369.425	2.819	50	5		FFBARN
CCc1ccc([C@H](NC(=O)Cn2cnc([N+](=O)[O-])n2)c2cccs2)cc1	ZINC000048224517	205152527	/nfs/dbraw/zinc/15/25/27/205152527.db2.gz	MIQYIZQSFPUZTG-INIZCTEOSA-N	0	0	371.422	2.716	50	5		FFBARN
NC(=O)c1ccc(CN(Cc2ccccc2)C[C@@H]2CCCO2)c([N+](=O)[O-])c1	ZINC000052866090	205188179	/nfs/dbraw/zinc/18/81/79/205188179.db2.gz	KBXGXWOCWASPKU-SFHVURJKSA-N	0	0	369.421	2.875	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cc(C(=O)OC)c1NCc1ccc(F)cc1	ZINC000096124725	205826393	/nfs/dbraw/zinc/82/63/93/205826393.db2.gz	JBZHFPAAMRRAGN-UHFFFAOYSA-N	0	0	362.313	2.919	50	5		FFBARN
C[C@H]1C(=O)N(CCOc2cccc([N+](=O)[O-])c2)C(=O)N1c1ccc(F)cc1	ZINC000047349483	206079411	/nfs/dbraw/zinc/07/94/11/206079411.db2.gz	GFSCMROHRBAVHR-LBPRGKRZSA-N	0	0	373.340	2.970	50	5		FFBARN
O=c1onc(-c2cccs2)n1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000048325697	206082433	/nfs/dbraw/zinc/08/24/33/206082433.db2.gz	PASFJSSQMMVEKD-UHFFFAOYSA-N	0	0	371.334	2.571	50	5		FFBARN
COC(=O)c1ccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1	ZINC000000822634	206133726	/nfs/dbraw/zinc/13/37/26/206133726.db2.gz	XRWOCUCLEOUEGJ-OQLLNIDSSA-N	0	0	352.302	2.726	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc(Br)cc1	ZINC000003232580	206158473	/nfs/dbraw/zinc/15/84/73/206158473.db2.gz	FFSWBIYPYHJPLJ-UHFFFAOYSA-N	0	0	369.127	2.746	50	5		FFBARN
COc1ccc(-c2nnc(NC(=O)c3ccc([N+](=O)[O-])cc3)o2)cc1OC	ZINC000005372336	206195041	/nfs/dbraw/zinc/19/50/41/206195041.db2.gz	WPGGZKMBELNMGY-UHFFFAOYSA-N	0	0	370.321	2.914	50	5		FFBARN
CCOC(=O)c1ccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)cc1	ZINC000005251700	206189543	/nfs/dbraw/zinc/18/95/43/206189543.db2.gz	VYQLQTFUKSMNLZ-UHFFFAOYSA-N	0	0	368.353	2.799	50	5		FFBARN
COC(=O)c1ccc(OCC(=O)Nc2cc(C)ccc2OC)c([N+](=O)[O-])c1	ZINC000007127723	206205495	/nfs/dbraw/zinc/20/54/95/206205495.db2.gz	LGFLGUIPFUFSCC-UHFFFAOYSA-N	0	0	374.349	2.716	50	5		FFBARN
CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@@H](c2ccccc2)NC(=O)N1	ZINC000005523515	206196417	/nfs/dbraw/zinc/19/64/17/206196417.db2.gz	KUCCOBNDXNQYHW-MRXNPFEDSA-N	0	0	352.350	2.861	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(NC(=O)Cn2ncc(Cl)c(Cl)c2=O)c1C	ZINC000006605196	206202201	/nfs/dbraw/zinc/20/22/01/206202201.db2.gz	JSFIOHWDLBFCDP-UHFFFAOYSA-N	0	0	371.180	2.714	50	5		FFBARN
Cn1cnc([N+](=O)[O-])c1Sc1ncnc2c1ncn2Cc1ccccc1	ZINC000000716536	206223322	/nfs/dbraw/zinc/22/33/22/206223322.db2.gz	XGWNOSOHTMKDCK-UHFFFAOYSA-N	0	0	367.394	2.668	50	5		FFBARN
Cc1c(C(=O)NC[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cccc1[N+](=O)[O-]	ZINC000008982040	206220233	/nfs/dbraw/zinc/22/02/33/206220233.db2.gz	RAUZEVDLSNADAZ-CYBMUJFWSA-N	0	0	371.368	2.825	50	5		FFBARN
C[C@@H](Nc1ccc([N+](=O)[O-])c2cnccc12)c1cccc(S(N)(=O)=O)c1	ZINC000058171906	206395112	/nfs/dbraw/zinc/39/51/12/206395112.db2.gz	ZDSSBIDBUGCZCK-LLVKDONJSA-N	0	0	372.406	2.964	50	5		FFBARN
CCOc1ccc(NC(=O)COC(=O)CCc2ccco2)c([N+](=O)[O-])c1	ZINC000024715110	206412241	/nfs/dbraw/zinc/41/22/41/206412241.db2.gz	KKGWHADZMSEKMS-UHFFFAOYSA-N	0	0	362.338	2.701	50	5		FFBARN
COc1ccc(C(=O)Nc2cccc(N3CCOC3=O)c2)cc1[N+](=O)[O-]	ZINC000031928015	206510698	/nfs/dbraw/zinc/51/06/98/206510698.db2.gz	KAWZSIQMFUBLAM-UHFFFAOYSA-N	0	0	357.322	2.812	50	5		FFBARN
Cc1ccccc1NC(=O)[C@@H](c1cccc([N+](=O)[O-])c1)N1CCOCC1	ZINC000020169471	220318439	/nfs/dbraw/zinc/31/84/39/220318439.db2.gz	JKHBSPQQKUMPNS-GOSISDBHSA-N	0	0	355.394	2.915	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1N1CCC(O)CC1	ZINC000048236297	221001935	/nfs/dbraw/zinc/00/19/35/221001935.db2.gz	UQICRDHFPOFAEI-UHFFFAOYSA-N	0	0	371.393	2.573	50	5		FFBARN
O=C(CN1CC(=O)Oc2ccccc21)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000000938291	132252501	/nfs/dbraw/zinc/25/25/01/132252501.db2.gz	ZIVXODQGLNIBFO-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])OCC(=O)N1CCCc2ccccc21	ZINC000003307655	132254334	/nfs/dbraw/zinc/25/43/34/132254334.db2.gz	JNMGKPDOFRVYKC-UHFFFAOYSA-N	0	0	354.362	2.660	50	5		FFBARN
O=[N+]([O-])c1cc(CN2CCN(c3ccc(F)cc3)CC2)c2c(c1)COCO2	ZINC000057478243	136129559	/nfs/dbraw/zinc/12/95/59/136129559.db2.gz	CVRFUMXGRIBYGL-UHFFFAOYSA-N	0	0	373.384	2.923	50	5		FFBARN
Cn1c2cc3nc4c5cccc6cccc(c(=O)n4c3cc2n(C)c1=O)c65	ZINC000000783631	506231920	/nfs/dbraw/zinc/23/19/20/506231920.db2.gz	SWQFKDAVOUQPIF-UHFFFAOYSA-N	0	0	354.369	2.782	50	5		FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000000845698	506235674	/nfs/dbraw/zinc/23/56/74/506235674.db2.gz	DIMRIHQLQXFZIA-MRXNPFEDSA-N	0	0	352.350	2.861	50	5		FFBARN
COc1cc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc(OC)c1	ZINC000000865231	506236920	/nfs/dbraw/zinc/23/69/20/506236920.db2.gz	IUNIQBKYVAPVTO-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
C[C@@H]1C(=O)N(c2ccccc2F)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000037521833	506427857	/nfs/dbraw/zinc/42/78/57/506427857.db2.gz	VWDFQILPHDOANP-GFCCVEGCSA-N	0	0	357.341	2.611	50	5		FFBARN
CN1CCN(c2ccc(C(=O)N3CCCCCCC3)cc2[N+](=O)[O-])CC1	ZINC000008726345	506664457	/nfs/dbraw/zinc/66/44/57/506664457.db2.gz	LEAICZPJSKDEJP-UHFFFAOYSA-N	0	0	360.458	2.753	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1ccc(F)c([N+](=O)[O-])c1	ZINC000011160995	506766773	/nfs/dbraw/zinc/76/67/73/506766773.db2.gz	PBZGYUCGDHESBK-LLVKDONJSA-N	0	0	372.356	2.910	50	5		FFBARN
Cc1sc2ncnc(N[C@H](CO)[C@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C	ZINC000011170300	506768240	/nfs/dbraw/zinc/76/82/40/506768240.db2.gz	HAGOYDBUFBWQDO-UKRRQHHQSA-N	0	0	374.422	2.723	50	5		FFBARN
O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1cccc(C(=O)NC2CC2)c1	ZINC000011234705	506769584	/nfs/dbraw/zinc/76/95/84/506769584.db2.gz	RARCRRIJCMNZNW-UHFFFAOYSA-N	0	0	373.340	2.644	50	5		FFBARN
Cc1ccccc1[C@@H](C)NC(=O)Cn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000014092828	506964648	/nfs/dbraw/zinc/96/46/48/506964648.db2.gz	PFBQTEPUMKSXLP-GFCCVEGCSA-N	0	0	355.350	2.689	50	5		FFBARN
O=[N+]([O-])c1cc(Br)cc2[nH]nc(I)c21	ZINC000014983659	507010072	/nfs/dbraw/zinc/01/00/72/507010072.db2.gz	XYFNADHXJUJAOA-UHFFFAOYSA-N	0	0	367.928	2.838	50	5		FFBARN
O=[N+]([O-])c1cc(F)ccc1N1CCN(Cc2ccc3c(c2)OCO3)CC1	ZINC000015208446	507025158	/nfs/dbraw/zinc/02/51/58/507025158.db2.gz	YLBZHPHLWOTYRL-UHFFFAOYSA-N	0	0	359.357	2.785	50	5		FFBARN
O=C(CSc1nc2ccccc2c(=O)[nH]1)Nc1cccc([N+](=O)[O-])c1	ZINC000015988010	507069182	/nfs/dbraw/zinc/06/91/82/507069182.db2.gz	ZBPNPYBVLCSWTF-UHFFFAOYSA-N	0	0	356.363	2.562	50	5		FFBARN
Cc1c(NC(=O)CN(C)Cc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-]	ZINC000019541860	507179028	/nfs/dbraw/zinc/17/90/28/507179028.db2.gz	XUFNXDWADJPFMU-UHFFFAOYSA-N	0	0	357.366	2.702	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)[C@@H](N1CCOCC1)/C(=C/C1(O)CCCCC1)O2	ZINC000019782221	507201606	/nfs/dbraw/zinc/20/16/06/507201606.db2.gz	NTHQPAPZADRELK-MTMYEVCSSA-N	0	0	360.410	2.940	50	5		FFBARN
c1nc2c3sc4nc(N5CCOCC5)c5c(c4c3ncn2n1)CCCC5	ZINC000020082118	507211122	/nfs/dbraw/zinc/21/11/22/507211122.db2.gz	HPFDGNLLWLLICC-UHFFFAOYSA-N	0	0	366.450	2.603	50	5		FFBARN
O=C(NCCc1cc(Cl)c2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1	ZINC000025044501	507460745	/nfs/dbraw/zinc/46/07/45/507460745.db2.gz	NGOPRPULBOUKJH-UHFFFAOYSA-N	0	0	362.769	2.992	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2ccccc2C1	ZINC000025315240	507487494	/nfs/dbraw/zinc/48/74/94/507487494.db2.gz	GYRRYVAAIRSSBJ-UHFFFAOYSA-N	0	0	355.394	2.852	50	5		FFBARN
O=C(COc1cccc(N2CCCC2=O)c1)OCc1cccc([N+](=O)[O-])c1	ZINC000025390230	507495636	/nfs/dbraw/zinc/49/56/36/507495636.db2.gz	JOHNZFHHWZBIEL-UHFFFAOYSA-N	0	0	370.361	2.844	50	5		FFBARN
CN(C)C(=O)COc1ccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1	ZINC000025991386	507549645	/nfs/dbraw/zinc/54/96/45/507549645.db2.gz	DFNSILZZHHNVQR-IZZDOVSWSA-N	0	0	369.377	2.714	50	5		FFBARN
COc1cc(OC)cc([C@H](Nc2ncccc2[N+](=O)[O-])c2nccn2C)c1	ZINC000028620309	507731247	/nfs/dbraw/zinc/73/12/47/507731247.db2.gz	AYHVBHLAEQJCMZ-INIZCTEOSA-N	0	0	369.381	2.942	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cc1)NCc1ccc(N2CCCC2)nc1	ZINC000030299319	507805515	/nfs/dbraw/zinc/80/55/15/507805515.db2.gz	OAUPCCHNGKPCSH-UHFFFAOYSA-N	0	0	372.450	2.999	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCCO2)c1ccn(-c2cccc([N+](=O)[O-])c2)n1	ZINC000031204809	507818183	/nfs/dbraw/zinc/81/81/83/507818183.db2.gz	BJCPDFRWBHDSTM-UHFFFAOYSA-N	0	0	366.333	2.804	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCN2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1	ZINC000031576752	507820432	/nfs/dbraw/zinc/82/04/32/507820432.db2.gz	ZJEOSBMNMHTBCP-UHFFFAOYSA-N	0	0	371.397	2.737	50	5		FFBARN
Cc1cccc(C(=O)N[C@@H](C)c2ccc3c(c2)NC(=O)CO3)c1[N+](=O)[O-]	ZINC000031737071	507821392	/nfs/dbraw/zinc/82/13/92/507821392.db2.gz	MIPJVBXLFOPWHQ-NSHDSACASA-N	0	0	355.350	2.725	50	5		FFBARN
CS(=O)(=O)Nc1ccc(Oc2ccc([N+](=O)[O-])c3cccnc23)cn1	ZINC000225533361	509375910	/nfs/dbraw/zinc/37/59/10/509375910.db2.gz	MUVXDNKLVZNSND-UHFFFAOYSA-N	0	0	360.351	2.702	50	5		FFBARN
C[C@H]1c2cccn2CCN1S(=O)(=O)c1cc(Cl)c([N+](=O)[O-])cc1F	ZINC000225832596	509389766	/nfs/dbraw/zinc/38/97/66/509389766.db2.gz	GXGXPJNUBPOMHH-VIFPVBQESA-N	0	0	373.793	2.954	50	5		FFBARN
CC(C)OC(=O)CNc1c([N+](=O)[O-])cc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000252548724	509850802	/nfs/dbraw/zinc/85/08/02/509850802.db2.gz	QHPSFQQASBMXOE-UHFFFAOYSA-N	0	0	351.237	2.885	50	5		FFBARN
COc1cccc(C(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)n(C)c2=N)c1	ZINC000334157516	511466534	/nfs/dbraw/zinc/46/65/34/511466534.db2.gz	FCBBIKBQXVALAP-UHFFFAOYSA-N	0	0	366.377	2.773	50	5		FFBARN
CCOc1ccc(CN2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000019789991	520971802	/nfs/dbraw/zinc/97/18/02/520971802.db2.gz	SDKNZFSOAWLOAT-UHFFFAOYSA-N	0	0	369.421	2.952	50	5		FFBARN
Cc1ccc(C(=O)[C@@H]2CCCN2S(=O)(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000049703897	570965601	/nfs/dbraw/zinc/96/56/01/570965601.db2.gz	KSCDCPSBDHWTEO-KRWDZBQOSA-N	0	0	374.418	2.939	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)/C=C\c2ccc([N+](=O)[O-])o2)CC1	ZINC000096911522	1012453472	/nfs/dbraw/zinc/45/34/72/1012453472.db2.gz	PJJDIEXJKRHFGV-VURMDHGXSA-N	0	0	357.366	2.558	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2cccc(C(C)=O)c2)cc1[N+](=O)[O-]	ZINC000000882013	203960853	/nfs/dbraw/zinc/96/08/53/203960853.db2.gz	ZKWAYHXCTNAVNJ-UHFFFAOYSA-N	0	0	373.390	2.933	50	5		FFBARN
O=C(Oc1cc(=O)oc2c3cccc4c3n(c(=O)c12)CC4)c1cccs1	ZINC000001036073	203975149	/nfs/dbraw/zinc/97/51/49/203975149.db2.gz	ZKQDGGLBERECBC-UHFFFAOYSA-N	0	0	365.366	2.945	50	5		FFBARN
COCCCn1c(=O)c2c(=O)c3ccccc3oc2nc1-c1ccco1	ZINC000002432932	204038433	/nfs/dbraw/zinc/03/84/33/204038433.db2.gz	DUXSLOAEPWIKKQ-UHFFFAOYSA-N	0	0	352.346	2.799	50	5		FFBARN
Cn1c2ccccc2c2c(c1=O)[C@H](c1ccc([N+](=O)[O-])cc1)CC(=O)O2	ZINC000001427905	204007447	/nfs/dbraw/zinc/00/74/47/204007447.db2.gz	JOACQBGALQTWTC-AWEZNQCLSA-N	0	0	350.330	2.888	50	5		FFBARN
COC(=O)Oc1c(Br)cc2oc(=O)sc2c1[N+](=O)[O-]	ZINC000001445389	204008672	/nfs/dbraw/zinc/00/86/72/204008672.db2.gz	IXXNRWWJTJCLIA-UHFFFAOYSA-N	0	0	350.102	2.670	50	5		FFBARN
CCn1cc(C(=O)Nc2cccc([N+](=O)[O-])c2)c(=O)c2ccc(C)nc21	ZINC000003017595	204074050	/nfs/dbraw/zinc/07/40/50/204074050.db2.gz	MKZBPPSUBWNLTM-UHFFFAOYSA-N	0	0	352.350	2.885	50	5		FFBARN
CCOC(=O)c1cc([N+](=O)[O-])ccc1OS(=O)(=O)c1ccc(C)cc1	ZINC000002837187	204061367	/nfs/dbraw/zinc/06/13/67/204061367.db2.gz	AQUORSRWZGWJHH-UHFFFAOYSA-N	0	0	365.363	2.848	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccccc21	ZINC000003317897	204091685	/nfs/dbraw/zinc/09/16/85/204091685.db2.gz	UAMLNRBXDNBWSP-UHFFFAOYSA-N	0	0	360.753	2.994	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1NCCc1ccccc1)[N-]C1(CCCCC1)[N+]2=O	ZINC000003901808	204114559	/nfs/dbraw/zinc/11/45/59/204114559.db2.gz	DLICXRANLDJSBY-UHFFFAOYSA-N	0	0	366.421	2.532	50	5		FFBARN
COC(=O)C(Cc1ccc(C)cc1)(C(=O)OC)c1ccc([N+](=O)[O-])cc1	ZINC000004072874	204119863	/nfs/dbraw/zinc/11/98/63/204119863.db2.gz	RPUBDPDYHCHCJZ-UHFFFAOYSA-N	0	0	357.362	2.730	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1Cc1nnc(SCc2cccc(F)c2)n1C	ZINC000004625594	204151280	/nfs/dbraw/zinc/15/12/80/204151280.db2.gz	STMKZCMTSNXUEJ-UHFFFAOYSA-N	0	0	362.390	2.708	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](C(=O)N2CCCCCC2)C1	ZINC000004746129	204160685	/nfs/dbraw/zinc/16/06/85/204160685.db2.gz	IZXVXUJJNOOBKR-MRXNPFEDSA-N	0	0	359.426	2.850	50	5		FFBARN
CCOC(=O)c1cccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)c1	ZINC000004754686	204162006	/nfs/dbraw/zinc/16/20/06/204162006.db2.gz	ZMIWHKGNDWERHR-UHFFFAOYSA-N	0	0	372.333	2.810	50	5		FFBARN
CC(C)N1c2ccccc2[C@@](O)(CC(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000004554714	204147190	/nfs/dbraw/zinc/14/71/90/204147190.db2.gz	MLUFEVAIXPEVKF-IBGZPJMESA-N	0	0	354.362	2.810	50	5		FFBARN
O=C1C[C@@]2(CC(c3cccc([N+](=O)[O-])c3)=NO2)C(=O)N1c1ccc(F)cc1	ZINC000005068944	204189050	/nfs/dbraw/zinc/18/90/50/204189050.db2.gz	WCPLZEBZUIBMNC-SFHVURJKSA-N	0	0	369.308	2.561	50	5		FFBARN
CCOC(=O)[C@H]1CCCN(C(=O)CSc2ccsc2[N+](=O)[O-])C1	ZINC000005069153	204189199	/nfs/dbraw/zinc/18/91/99/204189199.db2.gz	AGBJHLAQEOHRMC-JTQLQIEISA-N	0	0	358.441	2.550	50	5		FFBARN
Cc1[nH]c2ccccc2c1[C@@]1(O)c2cc([N+](=O)[O-])cc(C)c2N(C)C1=O	ZINC000005059936	204189335	/nfs/dbraw/zinc/18/93/35/204189335.db2.gz	XVOZWWNOGCQLKX-IBGZPJMESA-N	0	0	351.362	2.905	50	5		FFBARN
COc1n[nH]c(C(=O)Nc2ccc(Br)c(C)c2)c1[N+](=O)[O-]	ZINC000006527799	204251824	/nfs/dbraw/zinc/25/18/24/204251824.db2.gz	HTXWZXKCYXWRFV-UHFFFAOYSA-N	0	0	355.148	2.650	50	5		FFBARN
Cc1c(Cl)cc(S(=O)(=O)N[C@@H](C)c2ccccn2)cc1[N+](=O)[O-]	ZINC000007364746	204294883	/nfs/dbraw/zinc/29/48/83/204294883.db2.gz	OABATWFTLJKKCY-JTQLQIEISA-N	0	0	355.803	2.991	50	5		FFBARN
CCc1ccc2c(c1)[C@](O)(CC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C(=O)N2	ZINC000006758914	204266917	/nfs/dbraw/zinc/26/69/17/204266917.db2.gz	WBYTVVYNLDAZEU-LJQANCHMSA-N	0	0	370.361	2.579	50	5		FFBARN
COc1ccc(OCC(=O)NCCc2c[nH]c3ccccc23)c([N+](=O)[O-])c1	ZINC000008203198	204322180	/nfs/dbraw/zinc/32/21/80/204322180.db2.gz	XFVHPWHGIDUHJK-UHFFFAOYSA-N	0	0	369.377	2.822	50	5		FFBARN
COC(=O)[C@@H]1Cc2ccccc2CN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000009387404	204365477	/nfs/dbraw/zinc/36/54/77/204365477.db2.gz	CTMGTIPZTLEQTH-KRWDZBQOSA-N	0	0	354.362	2.643	50	5		FFBARN
CCN(CC)[C@@H](C(=O)NC1CCCC1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000036644159	204382210	/nfs/dbraw/zinc/38/22/10/204382210.db2.gz	LTSSQRZCUMEKCX-QGZVFWFLSA-N	0	0	363.414	2.765	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(NC(=O)C2CC2)cc1	ZINC000012435522	204463383	/nfs/dbraw/zinc/46/33/83/204463383.db2.gz	WQKANAGUSYOHEX-UHFFFAOYSA-N	0	0	355.350	2.961	50	5		FFBARN
COc1ccc(CC(=O)NCCc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1	ZINC000016143237	204631823	/nfs/dbraw/zinc/63/18/23/204631823.db2.gz	ZIBXKLYSCJEECS-UHFFFAOYSA-N	0	0	374.393	2.522	50	5		FFBARN
COc1cccc2c1O[C@]1(N3CCOCC3)CCCC[C@@H]1[C@@H]2C[N+](=O)[O-]	ZINC000020413951	204723817	/nfs/dbraw/zinc/72/38/17/204723817.db2.gz	WZXCWLCTYQZXIV-GPMSIDNRSA-N	0	0	362.426	2.667	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1Cn1cnc2sc3c(c2c1=O)CCC3	ZINC000022985426	204794177	/nfs/dbraw/zinc/79/41/77/204794177.db2.gz	GMQMRCTWJVYCNR-UHFFFAOYSA-N	0	0	357.391	2.912	50	5		FFBARN
Cc1nc(CCNC(=O)c2cnn(-c3ccc([N+](=O)[O-])cc3)c2)cs1	ZINC000040105422	205055292	/nfs/dbraw/zinc/05/52/92/205055292.db2.gz	WOYFVTUQMXMTNV-UHFFFAOYSA-N	0	0	357.395	2.518	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)N(C)Cc1cnc(C)s1	ZINC000047259175	205144235	/nfs/dbraw/zinc/14/42/35/205144235.db2.gz	IGQDFODUNWDQHQ-SNVBAGLBSA-N	0	0	364.427	2.827	50	5		FFBARN
Cc1c(C(=O)N[C@H](CN2CCCC2=O)c2ccccc2)cccc1[N+](=O)[O-]	ZINC000048956395	205167269	/nfs/dbraw/zinc/16/72/69/205167269.db2.gz	OCLMRJYGNSJFLQ-QGZVFWFLSA-N	0	0	367.405	2.997	50	5		FFBARN
Cc1ccc(C(=O)N2CCC(C(=O)NCc3ccco3)CC2)cc1[N+](=O)[O-]	ZINC000058367776	205273405	/nfs/dbraw/zinc/27/34/05/205273405.db2.gz	WCUIWMBVSIENEB-UHFFFAOYSA-N	0	0	371.393	2.665	50	5		FFBARN
CC[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C12CC3CC(CC(C3)C1)C2	ZINC000065478491	205354313	/nfs/dbraw/zinc/35/43/13/205354313.db2.gz	JLYMRUOSSURKPY-SJFHUFEGSA-N	0	0	373.453	2.868	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)N3C[C@H](C)C[C@@H](C)C3)c(=O)oc21	ZINC000001061193	206144597	/nfs/dbraw/zinc/14/45/97/206144597.db2.gz	ZGSQUCDIWPUGLR-GHMZBOCLSA-N	0	0	360.366	2.828	50	5		FFBARN
COC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccccc1OC	ZINC000004904338	206184939	/nfs/dbraw/zinc/18/49/39/206184939.db2.gz	RIHDLQASKNZDDH-PTNGSMBKSA-N	0	0	356.334	2.547	50	5		FFBARN
CCOC(=O)C1=C(C)N(C)C(=S)N[C@H]1c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007552114	206209972	/nfs/dbraw/zinc/20/99/72/206209972.db2.gz	XJYPUWTXLHFHQG-ZDUSSCGKSA-N	0	0	369.830	2.946	50	5		FFBARN
Cc1nc2sccc2c(=O)n1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007269678	206210083	/nfs/dbraw/zinc/21/00/83/206210083.db2.gz	FGPOFBYDMQNJPH-UHFFFAOYSA-N	0	0	364.770	2.712	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)Nc2ccc3c(c2)OCCO3)ccc1Cl	ZINC000007052131	206244065	/nfs/dbraw/zinc/24/40/65/206244065.db2.gz	ACRXDXOPEKGWON-UHFFFAOYSA-N	0	0	370.770	2.820	50	5		FFBARN
Cn1cccc1[C@H]1COCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000163938293	206234050	/nfs/dbraw/zinc/23/40/50/206234050.db2.gz	GXJGSCFEOMHWAZ-GOSISDBHSA-N	0	0	370.409	2.721	50	5		FFBARN
C[C@@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2	ZINC000014215488	206310981	/nfs/dbraw/zinc/31/09/81/206310981.db2.gz	SKNHVKKKWCAASB-GFCCVEGCSA-N	0	0	358.350	2.622	50	5		FFBARN
O=C(CSc1n[nH]c(-c2cccnc2)n1)Nc1ccc([N+](=O)[O-])cc1	ZINC000015913543	206316801	/nfs/dbraw/zinc/31/68/01/206316801.db2.gz	DJGCBSNDQKKEQF-UHFFFAOYSA-N	0	0	356.367	2.506	50	5		FFBARN
Cc1ccc(C(=O)Nc2ccc3nc4n(c(=O)c3c2)CCC4)cc1[N+](=O)[O-]	ZINC000032905781	206514702	/nfs/dbraw/zinc/51/47/02/206514702.db2.gz	LWNGCADGMPVAPC-UHFFFAOYSA-N	0	0	364.361	2.812	50	5		FFBARN
O=C(Nc1ccc2c(c1)CCO2)c1cccc([N+](=O)[O-])c1N1CCOCC1	ZINC000095988742	132216574	/nfs/dbraw/zinc/21/65/74/132216574.db2.gz	CKECGRNGCYSJCJ-UHFFFAOYSA-N	0	0	369.377	2.619	50	5		FFBARN
O=C(NCc1ccc(F)cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004660525	132387040	/nfs/dbraw/zinc/38/70/40/132387040.db2.gz	JQSZSEPCHAVESY-UHFFFAOYSA-N	0	0	359.357	2.501	50	5		FFBARN
O=[N+]([O-])c1cnc2ccc(Br)cc2c1N1CCC[C@@H](O)C1	ZINC000040071365	136119195	/nfs/dbraw/zinc/11/91/95/136119195.db2.gz	XDBKVWGNEBQJFJ-SNVBAGLBSA-N	0	0	352.188	2.867	50	5		FFBARN
Cc1cc(NC(=O)CN2CCN(c3ccccc3)CC2)c([N+](=O)[O-])cc1C	ZINC000057338179	136128640	/nfs/dbraw/zinc/12/86/40/136128640.db2.gz	VTYJMGXIUGTHTN-UHFFFAOYSA-N	0	0	368.437	2.972	50	5		FFBARN
O=C(Nc1nc2ccc([N+](=O)[O-])cc2s1)[C@@H]1COc2ccccc2O1	ZINC000000953141	506240640	/nfs/dbraw/zinc/24/06/40/506240640.db2.gz	AICVVEYTDPSICO-ZDUSSCGKSA-N	0	0	357.347	2.983	50	5		FFBARN
O=C(Oc1cc(=O)oc2c3cccc4c3n(c(=O)c12)CC4)c1ccccc1	ZINC000001036072	506243176	/nfs/dbraw/zinc/24/31/76/506243176.db2.gz	JFXJPALAKOIIEH-UHFFFAOYSA-N	0	0	359.337	2.883	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])c(C)c2)cc1	ZINC000001175176	506253913	/nfs/dbraw/zinc/25/39/13/506253913.db2.gz	IAECCXUAPKSNDA-UHFFFAOYSA-N	0	0	372.406	2.988	50	5		FFBARN
CN1CCN(c2c3cc(Br)ccc3ncc2[N+](=O)[O-])CC1	ZINC000032803808	506296642	/nfs/dbraw/zinc/29/66/42/506296642.db2.gz	RWZUCVVZNGJKIQ-UHFFFAOYSA-N	0	0	351.204	2.657	50	5		FFBARN
Cc1ccc2nc(COC(=O)c3cc4c(cc3[N+](=O)[O-])OCO4)cn2c1	ZINC000032830060	506300010	/nfs/dbraw/zinc/30/00/10/506300010.db2.gz	VYHDSWVAAKUCEW-UHFFFAOYSA-N	0	0	355.306	2.637	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(N2CCOCC2)cc1	ZINC000008728138	506664413	/nfs/dbraw/zinc/66/44/13/506664413.db2.gz	NMBWORYDZBKYGJ-UHFFFAOYSA-N	0	0	356.382	2.725	50	5		FFBARN
COCCOc1cc([N+](=O)[O-])c(C(=O)Nc2cccc(C)n2)cc1OC	ZINC000008720935	506664535	/nfs/dbraw/zinc/66/45/35/506664535.db2.gz	HBTFXVCOTMUFFZ-UHFFFAOYSA-N	0	0	361.354	2.584	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1cccc(Br)c1	ZINC000012533368	506871911	/nfs/dbraw/zinc/87/19/11/506871911.db2.gz	LQNXCWCEXQVEBM-UHFFFAOYSA-N	0	0	352.144	2.770	50	5		FFBARN
Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1F	ZINC000012634186	506888061	/nfs/dbraw/zinc/88/80/61/506888061.db2.gz	GBPZBLSHPLHIBM-UHFFFAOYSA-N	0	0	373.384	2.809	50	5		FFBARN
CN(Cc1cnn(-c2ccccc2)c1)C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000012942265	506917822	/nfs/dbraw/zinc/91/78/22/506917822.db2.gz	UOKKJCUZCQTYOR-UHFFFAOYSA-N	0	0	366.377	2.818	50	5		FFBARN
Cc1nn(CC(=O)NCCSCc2ccsc2)c(C)c1[N+](=O)[O-]	ZINC000014016660	506962843	/nfs/dbraw/zinc/96/28/43/506962843.db2.gz	LLVDNOBTQMVWGF-UHFFFAOYSA-N	0	0	354.457	2.519	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)NCCCCOc2ccccc2)cc1	ZINC000014097679	506965946	/nfs/dbraw/zinc/96/59/46/506965946.db2.gz	RBOFZTCFTMROIV-UHFFFAOYSA-N	0	0	350.396	2.732	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1C(=O)NC1CC1	ZINC000014136706	506970004	/nfs/dbraw/zinc/97/00/04/506970004.db2.gz	CYSWMHZHEWSDKV-UHFFFAOYSA-N	0	0	355.350	2.748	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1ccsc1	ZINC000015179664	507023376	/nfs/dbraw/zinc/02/33/76/507023376.db2.gz	ZYNOZGVLNBXGCU-GFCCVEGCSA-N	0	0	361.423	2.996	50	5		FFBARN
NC(=O)c1cc(Cl)ccc1OCc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000016662296	507101943	/nfs/dbraw/zinc/10/19/43/507101943.db2.gz	OSUCFEHCRDXSLV-UHFFFAOYSA-N	0	0	364.741	2.793	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCCN1C(=O)[C@H]2CC=CC[C@@H]2C1=O	ZINC000018227913	507146009	/nfs/dbraw/zinc/14/60/09/507146009.db2.gz	VDQCPZZGQXMZHZ-GJZGRUSLSA-N	0	0	371.393	2.573	50	5		FFBARN
COc1cccc(C(=O)N2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1	ZINC000019773755	507201152	/nfs/dbraw/zinc/20/11/52/507201152.db2.gz	UXAYPTFJHVQVRI-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COCCN1C(=O)c2[nH]nc(-c3ccco3)c2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000020744610	507233370	/nfs/dbraw/zinc/23/33/70/507233370.db2.gz	BNZJGZNFLPVPKA-QGZVFWFLSA-N	0	0	368.349	2.770	50	5		FFBARN
CSCC[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nnc2ccccn21	ZINC000020739271	507233943	/nfs/dbraw/zinc/23/39/43/507233943.db2.gz	PRCMQSYSBQWUIX-CQSZACIVSA-N	0	0	371.422	2.862	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cc(C(=O)OC)c1NCc1ccc(OC)cc1	ZINC000020863093	507235733	/nfs/dbraw/zinc/23/57/33/507235733.db2.gz	VOGLVMHKQIDOFO-UHFFFAOYSA-N	0	0	374.349	2.789	50	5		FFBARN
CC(=O)Oc1ccccc1[C@H]1OC(c2ccc([N+](=O)[O-])cc2)=NN1C(C)=O	ZINC000021092340	507243401	/nfs/dbraw/zinc/24/34/01/507243401.db2.gz	PCPPYMGAISXUIX-GOSISDBHSA-N	0	0	369.333	2.759	50	5		FFBARN
CCOC(=O)CCN(C(=O)c1ccc(NC)c([N+](=O)[O-])c1)c1ccccn1	ZINC000022011559	507277839	/nfs/dbraw/zinc/27/78/39/507277839.db2.gz	FYSFQBXGCDIVMA-UHFFFAOYSA-N	0	0	372.381	2.632	50	5		FFBARN
COC(=O)c1ccc([C@@H](C)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)o1	ZINC000025913125	507542541	/nfs/dbraw/zinc/54/25/41/507542541.db2.gz	UCABCPRUQVZHNN-CYBMUJFWSA-N	0	0	359.382	2.858	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(c2nnc3ccccn32)CC1	ZINC000028735684	507740767	/nfs/dbraw/zinc/74/07/67/507740767.db2.gz	CNEYDOYRMYPHSJ-UHFFFAOYSA-N	0	0	351.366	2.657	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])N1CCO[C@H](c2ccc(F)cc2)C1	ZINC000029112322	507760135	/nfs/dbraw/zinc/76/01/35/507760135.db2.gz	ZYMGVEULPRIKAF-KRWDZBQOSA-N	0	0	360.341	2.713	50	5		FFBARN
CS(=O)(=O)c1ccc(NCCCOCc2ccco2)c([N+](=O)[O-])c1	ZINC000029469441	507779234	/nfs/dbraw/zinc/77/92/34/507779234.db2.gz	BMQORKCOQKIRSR-UHFFFAOYSA-N	0	0	354.384	2.610	50	5		FFBARN
C[C@@H](CNC(=O)Cc1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1	ZINC000031964416	507822524	/nfs/dbraw/zinc/82/25/24/507822524.db2.gz	VAVCJTHAPOWNMK-ZDUSSCGKSA-N	0	0	359.451	2.762	50	5		FFBARN
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)C[C@H](NC(N)=O)c1cccs1)CC2	ZINC000095459638	508186708	/nfs/dbraw/zinc/18/67/08/508186708.db2.gz	HCJMPMWRFHXGDV-LBPRGKRZSA-N	0	0	374.422	2.654	50	5		FFBARN
O=C(CN1CCc2cc([N+](=O)[O-])ccc21)NC(=O)NCCC1=CCCCC1	ZINC000095469797	508187684	/nfs/dbraw/zinc/18/76/84/508187684.db2.gz	DTVHUMXDLJFCHK-UHFFFAOYSA-N	0	0	372.425	2.674	50	5		FFBARN
Cc1cc(C)[nH+]c(=N[N-]c2c([N+](=O)[O-])cc([N+](=O)[O-])c(C)c2[N+](=O)[O-])[nH]1	ZINC000100281195	508238965	/nfs/dbraw/zinc/23/89/65/508238965.db2.gz	GPWATPKPJJKWAV-UHFFFAOYSA-N	0	0	363.290	2.565	50	5		FFBARN
CC(=O)Nc1cccc2c1CCN(C(=O)COc1cccc([N+](=O)[O-])c1)C2	ZINC000083815578	508258935	/nfs/dbraw/zinc/25/89/35/508258935.db2.gz	CVKMJNUOLCNPND-UHFFFAOYSA-N	0	0	369.377	2.517	50	5		FFBARN
COCN1C(=O)CCc2cc(NC(=O)Cc3cccc([N+](=O)[O-])c3)ccc21	ZINC000170603882	509677855	/nfs/dbraw/zinc/67/78/55/509677855.db2.gz	QVYSMOVIUSELDE-UHFFFAOYSA-N	0	0	369.377	2.659	50	5		FFBARN
CN(c1ccccc1)c1cc(N2CCOCC2)c2nonc2c1[N+](=O)[O-]	ZINC000003904315	536298220	/nfs/dbraw/zinc/29/82/20/536298220.db2.gz	LOPRCKRCJFZQEX-UHFFFAOYSA-N	0	0	355.354	2.736	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1c2ccccc2[C@@H](C(N)=O)C[C@@H]1C	ZINC000058424536	536952195	/nfs/dbraw/zinc/95/21/95/536952195.db2.gz	BDHYBMIDMIUTTA-LRDDRELGSA-N	0	0	355.394	2.971	50	5		FFBARN
CC(=O)Oc1ccc2nc(COc3cccc([N+](=O)[O-])c3)oc(=O)c2c1	ZINC000001175426	1014445783	/nfs/dbraw/zinc/44/57/83/1014445783.db2.gz	SOHZQTQHWOQHKD-UHFFFAOYSA-N	0	0	356.290	2.601	50	5		FFBARN
O=C(C=Cc1cccc([N+](=O)[O-])c1)OCC(=O)c1ccc2c(c1)OCCO2	ZINC000033531186	990379777	/nfs/dbraw/zinc/37/97/77/990379777.db2.gz	IEWZESMJGOCYOB-DAXSKMNVSA-N	0	0	369.329	2.805	50	5		FFBARN
COc1cc(/C=C\C(=O)NC[C@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F	ZINC000096942913	1012484982	/nfs/dbraw/zinc/48/49/82/1012484982.db2.gz	TZXOEWRVZNDTDO-DOGVGXBMSA-N	0	0	372.324	2.513	50	5		FFBARN
Cc1nn(C)c(C(=O)NC(=S)Nc2cc([N+](=O)[O-])ccc2C)c1Cl	ZINC000001005769	219352403	/nfs/dbraw/zinc/35/24/03/219352403.db2.gz	QYBAUPOSVYDHDN-UHFFFAOYSA-N	0	0	367.818	2.725	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(c2ccc(C)cc2)C1	ZINC000001049091	219358337	/nfs/dbraw/zinc/35/83/37/219358337.db2.gz	GDXXJINLJNCHJR-ZDUSSCGKSA-N	0	0	369.377	2.903	50	5		FFBARN
C[C@@H](CNC(=O)[C@@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccc1	ZINC000022624160	209689361	/nfs/dbraw/zinc/68/93/61/209689361.db2.gz	VMASUPAYLKJTEN-QWHCGFSZSA-N	0	0	371.393	2.642	50	5		FFBARN
CCCC(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000004076435	209410825	/nfs/dbraw/zinc/41/08/25/209410825.db2.gz	UDDLNGXLSJHZGW-UHFFFAOYSA-N	0	0	355.397	2.623	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)COc2cc([N+](=O)[O-])ccc2OC)c1C	ZINC000009514670	219881766	/nfs/dbraw/zinc/88/17/66/219881766.db2.gz	UDMFRWIIGAVLMQ-UHFFFAOYSA-N	0	0	362.338	2.597	50	5		FFBARN
O=C1C[C@H](Nc2ccc3c(c2)CCC3)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000103713779	209254481	/nfs/dbraw/zinc/25/44/81/209254481.db2.gz	MLHPVCAHGILISS-KRWDZBQOSA-N	0	0	351.362	2.828	50	5		FFBARN
COc1ccc(C2=Nc3nnnn3[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000101113357	209222076	/nfs/dbraw/zinc/22/20/76/209222076.db2.gz	UZJQBHVQYUFLJL-INIZCTEOSA-N	0	0	350.338	2.646	50	5		FFBARN
COc1cccc(C2=Nc3nnnn3[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1	ZINC000101130730	209221501	/nfs/dbraw/zinc/22/15/01/209221501.db2.gz	XDISNZCHMFENGK-MRXNPFEDSA-N	0	0	350.338	2.646	50	5		FFBARN
COc1ccc(C(=O)Nc2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1OC	ZINC000000716118	206827345	/nfs/dbraw/zinc/82/73/45/206827345.db2.gz	QNOQRDCMVHJETD-UHFFFAOYSA-N	0	0	370.317	2.971	50	5		FFBARN
COC(=O)c1ccc(/C=C2\N=C(c3cccc([N+](=O)[O-])c3)OC2=O)cc1	ZINC000000822635	206836512	/nfs/dbraw/zinc/83/65/12/206836512.db2.gz	XRWOCUCLEOUEGJ-DHDCSXOGSA-N	0	0	352.302	2.726	50	5		FFBARN
O=c1oc2ccc(OS(=O)(=O)c3ccc([N+](=O)[O-])cc3)cc2s1	ZINC000002024271	206900669	/nfs/dbraw/zinc/90/06/69/206900669.db2.gz	GSEFQHILHWXQCY-UHFFFAOYSA-N	0	0	353.333	2.530	50	5	biogenic	FFBARN
C[C@H](CCc1ccccc1)NC(=O)COC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000002651372	206927154	/nfs/dbraw/zinc/92/71/54/206927154.db2.gz	WFDLJIGYXSJDJQ-CQSZACIVSA-N	0	0	356.378	2.889	50	5		FFBARN
O=C(Nc1cc2cccc([N+](=O)[O-])c2oc1=O)c1ccccc1[N+](=O)[O-]	ZINC000004644723	207033593	/nfs/dbraw/zinc/03/35/93/207033593.db2.gz	YPSAMKJAZJSJHC-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
O=[N+]([O-])c1cccc(/C=C2\CCc3cnn([C@@H]4CCS(=O)(=O)C4)c32)c1	ZINC000004945980	207065467	/nfs/dbraw/zinc/06/54/67/207065467.db2.gz	BONNIDXNLFPSSE-WDBUWWRISA-N	0	0	359.407	2.638	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cccn(Cc2ccccc2)c1=O	ZINC000004940320	207065799	/nfs/dbraw/zinc/06/57/99/207065799.db2.gz	ISJZWVHGIWRHLI-UHFFFAOYSA-N	0	0	356.363	2.514	50	5		FFBARN
Cc1cccc(C)c1OCC(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004916704	207061648	/nfs/dbraw/zinc/06/16/48/207061648.db2.gz	BPDVLDPACCWOQP-UHFFFAOYSA-N	0	0	358.350	2.772	50	5		FFBARN
CCOc1ccc(Nc2nc(NC[C@@H]3CCCO3)nc(N)c2[N+](=O)[O-])cc1	ZINC000005118906	207082151	/nfs/dbraw/zinc/08/21/51/207082151.db2.gz	ZXLLYTWXTRLCGH-ZDUSSCGKSA-N	0	0	374.401	2.700	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)COC(=O)c1n[nH]c2ccccc21	ZINC000005360330	207096141	/nfs/dbraw/zinc/09/61/41/207096141.db2.gz	NLBNRRNVDNAVFC-UHFFFAOYSA-N	0	0	354.322	2.575	50	5		FFBARN
CN(C)[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccccc1	ZINC000005688230	207112281	/nfs/dbraw/zinc/11/22/81/207112281.db2.gz	RWNDXGYKQFIYPY-QGZVFWFLSA-N	0	0	363.439	2.713	50	5		FFBARN
CCc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2NCCO)cc1	ZINC000006247139	207134350	/nfs/dbraw/zinc/13/43/50/207134350.db2.gz	GVWMZQVJLYHGCL-UHFFFAOYSA-N	0	0	372.377	2.601	50	5		FFBARN
C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CC(=O)Nc1cccc(F)c1	ZINC000006607331	207148702	/nfs/dbraw/zinc/14/87/02/207148702.db2.gz	AMZZRCVGOGLVNB-GFCCVEGCSA-N	0	0	374.372	2.631	50	5		FFBARN
O=C(CCn1cc(Cl)c([N+](=O)[O-])n1)Nc1ccc(Br)cn1	ZINC000006926617	207178419	/nfs/dbraw/zinc/17/84/19/207178419.db2.gz	WFVIOHICVACEGU-UHFFFAOYSA-N	0	0	374.582	2.631	50	5		FFBARN
C[C@@H]1c2ccsc2CCN1C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000007830042	207208996	/nfs/dbraw/zinc/20/89/96/207208996.db2.gz	ZREOGAHILSXRSR-GFCCVEGCSA-N	0	0	373.434	2.922	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NCCCn1cnc2ccccc21	ZINC000008174521	207222249	/nfs/dbraw/zinc/22/22/49/207222249.db2.gz	ODISWGWQNMEYCZ-UHFFFAOYSA-N	0	0	367.409	2.831	50	5		FFBARN
O=C(CCc1nc2ccccc2c(=O)[nH]1)OCc1cccc([N+](=O)[O-])c1	ZINC000008216247	207222863	/nfs/dbraw/zinc/22/28/63/207222863.db2.gz	YRZPAVJPYYRNGK-UHFFFAOYSA-N	0	0	353.334	2.507	50	5		FFBARN
COc1ccc(/C=C/C(=O)NCCC(=O)Nc2cccc([N+](=O)[O-])c2)cc1	ZINC000008286479	207227496	/nfs/dbraw/zinc/22/74/96/207227496.db2.gz	DGKHNIFXPPOBBU-JXMROGBWSA-N	0	0	369.377	2.762	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(C2CCCCC2)C1	ZINC000008782330	207249334	/nfs/dbraw/zinc/24/93/34/207249334.db2.gz	AQWDCYWJRRZNPH-GFCCVEGCSA-N	0	0	361.398	2.723	50	5		FFBARN
O=C(Nc1ccc(-c2nn3cnnc3s2)cc1)c1ccc([N+](=O)[O-])o1	ZINC000009427062	207271015	/nfs/dbraw/zinc/27/10/15/207271015.db2.gz	TXUVNEXLVYXNTI-UHFFFAOYSA-N	0	0	356.323	2.606	50	5		FFBARN
O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1Cc1cc(Cl)cc2c1OCOC2	ZINC000009482165	207274330	/nfs/dbraw/zinc/27/43/30/207274330.db2.gz	KZDLCGYDHVNKDC-UHFFFAOYSA-N	0	0	374.736	2.911	50	5		FFBARN
COc1ccc2[nH]c(=O)c(CN(C)C(=O)c3ccc([N+](=O)[O-])cc3)cc2c1	ZINC000009304029	207264870	/nfs/dbraw/zinc/26/48/70/207264870.db2.gz	PEVLPTOELYNAJX-UHFFFAOYSA-N	0	0	367.361	2.717	50	5		FFBARN
O=C(CCCn1cnc2ccccc2c1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000011867221	207327318	/nfs/dbraw/zinc/32/73/18/207327318.db2.gz	GDGCAGDMYGMBBK-UHFFFAOYSA-N	0	0	352.350	2.724	50	5		FFBARN
NC(=O)c1ccc(COC(=O)Cc2cccc3cccnc32)c([N+](=O)[O-])c1	ZINC000014151588	207505817	/nfs/dbraw/zinc/50/58/17/207505817.db2.gz	AHZJAQDFTICCFM-UHFFFAOYSA-N	0	0	365.345	2.528	50	5		FFBARN
O=C(NCCc1c[nH]c2ccccc12)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000015514543	207553814	/nfs/dbraw/zinc/55/38/14/207553814.db2.gz	WKPCUTZLWXYSNU-UHFFFAOYSA-N	0	0	367.361	2.820	50	5		FFBARN
COC(=O)c1cccc2c1CCCN2C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000025189641	207889386	/nfs/dbraw/zinc/88/93/86/207889386.db2.gz	RPZFLTULCGNCMA-UHFFFAOYSA-N	0	0	370.361	2.740	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCCNC(=O)c1ccco1	ZINC000025831992	207903818	/nfs/dbraw/zinc/90/38/18/207903818.db2.gz	SKBSZNNGXIGQKA-ZDUSSCGKSA-N	0	0	359.382	2.917	50	5		FFBARN
Cc1cc(=O)c(C(=O)OCc2cccc([N+](=O)[O-])c2)nn1-c1ccccc1	ZINC000025849340	207904031	/nfs/dbraw/zinc/90/40/31/207904031.db2.gz	LQHRUFJTGUAFKB-UHFFFAOYSA-N	0	0	365.345	2.806	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])N1CCN(C(=O)c2cccs2)CC1	ZINC000032721133	208037085	/nfs/dbraw/zinc/03/70/85/208037085.db2.gz	OZIXDSZJQFOGBW-UHFFFAOYSA-N	0	0	360.395	2.646	50	5		FFBARN
C[C@H](Oc1ccccc1Cl)C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032795472	208042657	/nfs/dbraw/zinc/04/26/57/208042657.db2.gz	PTGSXWLKPLXZLO-NHYWBVRUSA-N	0	0	364.785	2.865	50	5		FFBARN
Cc1ccccc1Cn1cnc2c(cnn2-c2ccc([N+](=O)[O-])cc2)c1=O	ZINC000032801747	208045377	/nfs/dbraw/zinc/04/53/77/208045377.db2.gz	IDATYNNPLMSUHE-UHFFFAOYSA-N	0	0	361.361	2.847	50	5		FFBARN
Cc1ccc(NC(=O)[C@@H]2CCCN(C(=O)N3CCCC3)C2)cc1[N+](=O)[O-]	ZINC000040089919	208226342	/nfs/dbraw/zinc/22/63/42/208226342.db2.gz	GTGXXRZQOKUBBH-CQSZACIVSA-N	0	0	360.414	2.770	50	5		FFBARN
Cc1cccc(C(=O)N[C@@H](C(=O)N2CCCC2)c2ccccc2)c1[N+](=O)[O-]	ZINC000040146355	208235432	/nfs/dbraw/zinc/23/54/32/208235432.db2.gz	SNSQOQYHSKABRI-QGZVFWFLSA-N	0	0	367.405	2.997	50	5		FFBARN
O=C(CSc1ccc([N+](=O)[O-])cc1)Nc1ncn(Cc2ccccc2)n1	ZINC000040155068	208238854	/nfs/dbraw/zinc/23/88/54/208238854.db2.gz	OGMYTJPBBNTHTN-UHFFFAOYSA-N	0	0	369.406	2.965	50	5		FFBARN
Cc1ccc([C@@H](O)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1	ZINC000041467938	208285543	/nfs/dbraw/zinc/28/55/43/208285543.db2.gz	CVLLEUBXKBBBOS-IBGZPJMESA-N	0	0	369.421	2.967	50	5		FFBARN
C[C@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2cccc(F)c2)C1=O	ZINC000041702212	208285914	/nfs/dbraw/zinc/28/59/14/208285914.db2.gz	AGQOARXMSCEVGG-GOSISDBHSA-N	0	0	373.340	2.580	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)NCCc1cc(F)cc2c1OCOC2	ZINC000057267469	208500387	/nfs/dbraw/zinc/50/03/87/208500387.db2.gz	WMVATEFMUORHFB-UHFFFAOYSA-N	0	0	360.341	2.502	50	5		FFBARN
COC(=O)[C@@H]1c2ccccc2CCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000095404775	209049642	/nfs/dbraw/zinc/04/96/42/209049642.db2.gz	UQGIPMSRDJABHI-KRWDZBQOSA-N	0	0	354.362	2.816	50	5		FFBARN
Cc1[nH]c(CN(C)C(=O)NC[C@@H]2CCCO2)nc1-c1cccc([N+](=O)[O-])c1	ZINC000095456166	209052531	/nfs/dbraw/zinc/05/25/31/209052531.db2.gz	UMJBZQYJFSYICD-HNNXBMFYSA-N	0	0	373.413	2.614	50	5		FFBARN
CC(C)(C)c1cn2nc(N3CCc4ncc([N+](=O)[O-])cc4C3)sc2n1	ZINC000095941743	209088627	/nfs/dbraw/zinc/08/86/27/209088627.db2.gz	NPHKZIUVPIXEID-UHFFFAOYSA-N	0	0	358.427	2.954	50	5		FFBARN
O=C(Nc1ccccc1CC[N+](=O)[O-])N1CCN(c2ccccc2)CC1	ZINC000001403005	132381813	/nfs/dbraw/zinc/38/18/13/132381813.db2.gz	PVFDVQDSCQPENE-UHFFFAOYSA-N	0	0	354.410	2.860	50	5		FFBARN
O=[N+]([O-])c1ccc(COc2nc3ccccc3nc2N2CCOCC2)cc1	ZINC000003352239	132385129	/nfs/dbraw/zinc/38/51/29/132385129.db2.gz	NYTNFAZPNKYXHY-UHFFFAOYSA-N	0	0	366.377	2.954	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@@H](C)O[C@H](C)C3)nc(N)c2[N+](=O)[O-])cc1C	ZINC000004306086	132386676	/nfs/dbraw/zinc/38/66/76/132386676.db2.gz	LTTZAUJAACBVAQ-CHWSQXEVSA-N	0	0	372.429	2.941	50	5		FFBARN
Cc1ccc(CCCC(=O)N2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1	ZINC000044499275	136121700	/nfs/dbraw/zinc/12/17/00/136121700.db2.gz	ZLMIBGMPQQVPLU-UHFFFAOYSA-N	0	0	368.437	2.970	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3cc(F)cc4c3OCOC4)CC2)cc1	ZINC000052658602	136124533	/nfs/dbraw/zinc/12/45/33/136124533.db2.gz	HOPLHGHUTSGSHA-UHFFFAOYSA-N	0	0	373.384	2.923	50	5		FFBARN
O=C(COC(=O)c1ccc(O)cc1)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000005694367	506454797	/nfs/dbraw/zinc/45/47/97/506454797.db2.gz	YONLRCCECQEEHX-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
CCn1ncc([N+](=O)[O-])c1C(=O)Nc1ccc(C(=O)N2CCCCC2)cc1	ZINC000001002313	506242351	/nfs/dbraw/zinc/24/23/51/506242351.db2.gz	AQABNQGRJQHTGF-UHFFFAOYSA-N	0	0	371.397	2.690	50	5		FFBARN
CCNS(=O)(=O)c1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1	ZINC000001120431	506250155	/nfs/dbraw/zinc/25/01/55/506250155.db2.gz	DBFUMXPRHSSCAB-UHFFFAOYSA-N	0	0	364.383	2.537	50	5		FFBARN
COc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000001176046	506254496	/nfs/dbraw/zinc/25/44/96/506254496.db2.gz	CRVJETNIKIGIGZ-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCOCCOCCO2	ZINC000002250484	506275524	/nfs/dbraw/zinc/27/55/24/506275524.db2.gz	MRHDJOZTJZLBJE-UHFFFAOYSA-N	0	0	373.361	2.630	50	5		FFBARN
COc1cccc(NC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000002871469	506298762	/nfs/dbraw/zinc/29/87/62/506298762.db2.gz	MWJNXRLNVYYGTM-GFCCVEGCSA-N	0	0	355.350	2.595	50	5		FFBARN
Cc1cc(OS(=O)(=O)c2cccc([N+](=O)[O-])c2)n(-c2ccccc2)n1	ZINC000003197885	506313738	/nfs/dbraw/zinc/31/37/38/506313738.db2.gz	HCWVVJOJHLQQNW-UHFFFAOYSA-N	0	0	359.363	2.857	50	5		FFBARN
O=C(OCc1cc(=O)n2c3ccccc3sc2n1)c1ccc([N+](=O)[O-])o1	ZINC000003416129	506329197	/nfs/dbraw/zinc/32/91/97/506329197.db2.gz	NYZBINAOPVGBOY-UHFFFAOYSA-N	0	0	371.330	2.767	50	5		FFBARN
C[C@H](Oc1ccc([N+](=O)[O-])cc1Cl)C(=O)Nc1ccc(C(N)=O)cc1	ZINC000003441569	506330866	/nfs/dbraw/zinc/33/08/66/506330866.db2.gz	DCLCTUKJTBRDJZ-VIFPVBQESA-N	0	0	363.757	2.753	50	5		FFBARN
CC(=O)Nc1cccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1	ZINC000003461476	506333098	/nfs/dbraw/zinc/33/30/98/506333098.db2.gz	HLHXXMRGACKXGQ-UHFFFAOYSA-N	0	0	372.333	2.777	50	5		FFBARN
Cc1c(Nc2ccc([N+](=O)[O-])c3nonc32)c(=O)n(-c2ccccc2)n1C	ZINC000003996201	506353044	/nfs/dbraw/zinc/35/30/44/506353044.db2.gz	FBRDXTDTENFTQZ-UHFFFAOYSA-N	0	0	366.337	2.672	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3ccccc3F)CC2)ccc1[N+](=O)[O-]	ZINC000004703588	506390401	/nfs/dbraw/zinc/39/04/01/506390401.db2.gz	NVSYVTQTDZZECR-UHFFFAOYSA-N	0	0	358.373	2.738	50	5		FFBARN
O=C(Nc1cccc(-c2ccc3nncn3n2)c1)c1cccc([N+](=O)[O-])c1	ZINC000005168566	506425262	/nfs/dbraw/zinc/42/52/62/506425262.db2.gz	HKPAZNIBQCODKR-UHFFFAOYSA-N	0	0	360.333	2.952	50	5		FFBARN
O=C(NC1(c2ccccc2)CCC1)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000040015884	506457678	/nfs/dbraw/zinc/45/76/78/506457678.db2.gz	WLUQMHRURQGBKW-UHFFFAOYSA-N	0	0	363.377	2.985	50	5		FFBARN
Cc1cccc2sc(NC(=O)CNC(=O)c3cccc([N+](=O)[O-])c3)nc21	ZINC000006868264	506514176	/nfs/dbraw/zinc/51/41/76/506514176.db2.gz	FFPJLASLNYTYSX-UHFFFAOYSA-N	0	0	370.390	2.881	50	5		FFBARN
Cc1c(C(=O)NC[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cccc1[N+](=O)[O-]	ZINC000008982035	506675790	/nfs/dbraw/zinc/67/57/90/506675790.db2.gz	RAUZEVDLSNADAZ-ZDUSSCGKSA-N	0	0	371.368	2.825	50	5		FFBARN
COc1ccc(OC)c(NC(=O)/C=C/c2cc3c(cc2[N+](=O)[O-])OCO3)c1	ZINC000009691545	506708905	/nfs/dbraw/zinc/70/89/05/506708905.db2.gz	QIOZAEBTIKJCIZ-ZZXKWVIFSA-N	0	0	372.333	2.993	50	5		FFBARN
CCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000010256051	506734575	/nfs/dbraw/zinc/73/45/75/506734575.db2.gz	YWNNLKDIXBISSD-INIZCTEOSA-N	0	0	373.796	2.956	50	5		FFBARN
CCn1c2cc3c(cc2s/c1=N/C(=O)c1ccc([N+](=O)[O-])o1)OCO3	ZINC000012080595	506813641	/nfs/dbraw/zinc/81/36/41/506813641.db2.gz	NNOMIWYOVQRHPZ-FOCLMDBBSA-N	0	0	361.335	2.694	50	5		FFBARN
CC(C)n1ncc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])cnc21	ZINC000012770510	506898345	/nfs/dbraw/zinc/89/83/45/506898345.db2.gz	IPRIZJGLHGUWHD-UHFFFAOYSA-N	0	0	355.354	2.938	50	5		FFBARN
C[C@H](NC(=O)COc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2	ZINC000014215489	506980112	/nfs/dbraw/zinc/98/01/12/506980112.db2.gz	SKNHVKKKWCAASB-LBPRGKRZSA-N	0	0	358.350	2.622	50	5		FFBARN
Cc1cc(C)c(NC(=O)CSc2nc(C)c(C)c(=O)[nH]2)c([N+](=O)[O-])c1	ZINC000014943629	507007148	/nfs/dbraw/zinc/00/71/48/507007148.db2.gz	CXLPNDLYRQZJLD-UHFFFAOYSA-N	0	0	362.411	2.643	50	5		FFBARN
O=C(NCc1ccc(CN2CCOCC2)cc1)Nc1ccccc1[N+](=O)[O-]	ZINC000024237494	507400442	/nfs/dbraw/zinc/40/04/42/507400442.db2.gz	FNWXOMMWZILXCA-UHFFFAOYSA-N	0	0	370.409	2.749	50	5		FFBARN
Cn1ccnc1C(=O)c1ccc(NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000024596462	507423243	/nfs/dbraw/zinc/42/32/43/507423243.db2.gz	XSIOTPJWZINQMK-UHFFFAOYSA-N	0	0	350.334	2.812	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)N(C)C[C@@H]1COc2ccccc2O1	ZINC000024659933	507427243	/nfs/dbraw/zinc/42/72/43/507427243.db2.gz	XHYUMJBVBBMQMU-CYBMUJFWSA-N	0	0	358.350	2.515	50	5		FFBARN
O=C(CCCn1cnc2ccccc2c1=O)Nc1cccc([N+](=O)[O-])c1	ZINC000024699328	507432141	/nfs/dbraw/zinc/43/21/41/507432141.db2.gz	SNIOJWZZIBGMGC-UHFFFAOYSA-N	0	0	352.350	2.724	50	5		FFBARN
CCC(CC)[C@H](CNC(=O)c1ccc([N+](=O)[O-])s1)N1CCOCC1	ZINC000024828870	507442125	/nfs/dbraw/zinc/44/21/25/507442125.db2.gz	NTRDCHNOQOADSC-ZDUSSCGKSA-N	0	0	355.460	2.523	50	5		FFBARN
CCc1c(C(=O)N(C)Cc2cc(C)on2)cnn1-c1ccc([N+](=O)[O-])cc1	ZINC000025139177	507470386	/nfs/dbraw/zinc/47/03/86/507470386.db2.gz	BZZPWQYHLLUBFM-UHFFFAOYSA-N	0	0	369.381	2.912	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccc(F)cc3[N+](=O)[O-])CC2)cc1	ZINC000029526476	507781447	/nfs/dbraw/zinc/78/14/47/507781447.db2.gz	QYASCNICDOLONL-UHFFFAOYSA-N	0	0	359.357	2.705	50	5		FFBARN
CCc1nc([C@@H](C)NC(=O)CCn2nc(C)c([N+](=O)[O-])c2C)cs1	ZINC000078616329	507889767	/nfs/dbraw/zinc/88/97/67/507889767.db2.gz	RTFNSFHTANTVFU-SECBINFHSA-N	0	0	351.432	2.695	50	5		FFBARN
O=C(c1ccccc1)c1ccc(-n2ccc(=O)c([N+](=O)[O-])c2)c([N+](=O)[O-])c1	ZINC000078968075	507920470	/nfs/dbraw/zinc/92/04/70/507920470.db2.gz	VSGXKLXVSCFAAZ-UHFFFAOYSA-N	0	0	365.301	2.885	50	5		FFBARN
COc1cc2s/c(=N\C(=O)c3ccccc3[N+](=O)[O-])n(C)c2cc1OC	ZINC000101035720	508240907	/nfs/dbraw/zinc/24/09/07/508240907.db2.gz	JJOBOOANXNUUNJ-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccccc3Cl)C2=C(O)N1c1cccc([N+](=O)[O-])c1	ZINC000103539520	508317806	/nfs/dbraw/zinc/31/78/06/508317806.db2.gz	VFNIMOBWDOSCKR-UKRRQHHQSA-N	0	0	371.736	2.541	50	5		FFBARN
O=C(NCc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1occc1Br	ZINC000225528629	509376295	/nfs/dbraw/zinc/37/62/95/509376295.db2.gz	LFIADABHGRWISS-UHFFFAOYSA-N	0	0	365.143	2.757	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@@H](c1cccs1)C1CCCC1	ZINC000084436922	571085798	/nfs/dbraw/zinc/08/57/98/571085798.db2.gz	HYEFCHKYCAFPFC-QGZVFWFLSA-N	0	0	361.423	2.866	50	5		FFBARN
CC(=O)Nc1cc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)ccc1C	ZINC000001122416	219374052	/nfs/dbraw/zinc/37/40/52/219374052.db2.gz	BIPDNXLDNRZSSG-UHFFFAOYSA-N	0	0	356.334	2.901	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC(=O)N(c2ccccc2)C1	ZINC000004496953	209422127	/nfs/dbraw/zinc/42/21/27/209422127.db2.gz	QYLZPDKKVYRBBP-MEODZPNASA-N	0	0	351.362	2.530	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)c3cccc([N+](=O)[O-])c3)CC2=O)cc1C	ZINC000004497024	209421494	/nfs/dbraw/zinc/42/14/94/209421494.db2.gz	ORGHUUTUJNJRGL-HNNXBMFYSA-N	0	0	353.378	2.747	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1cccc([N+](=O)[O-])c1	ZINC000100036965	209207922	/nfs/dbraw/zinc/20/79/22/209207922.db2.gz	ITAOFSSOVNYZCS-UHFFFAOYSA-N	0	0	374.393	2.956	50	5		FFBARN
Cc1ccccc1-c1nnc2s/c(=C\c3cccc([N+](=O)[O-])c3)c(=O)n21	ZINC000001802648	206895669	/nfs/dbraw/zinc/89/56/69/206895669.db2.gz	HCUMOOYUARLAOX-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
COc1ccc(C2=N/C(=C\c3cccc([N+](=O)[O-])c3)C(=O)O2)cc1OC	ZINC000004509296	207023771	/nfs/dbraw/zinc/02/37/71/207023771.db2.gz	MLLFXFYZQBJIGV-ZROIWOOFSA-N	0	0	354.318	2.957	50	5		FFBARN
COC(=O)Nc1ccc([N+](=O)[O-])cc1S(=O)(=O)Cc1ccccc1	ZINC000004548833	207027132	/nfs/dbraw/zinc/02/71/32/207027132.db2.gz	HIZSBAYWCGPICD-UHFFFAOYSA-N	0	0	350.352	2.747	50	5		FFBARN
CN1C2=C(C(=O)N(c3cccc([N+](=O)[O-])c3)C2)[C@H](c2ccccc2)NC1=O	ZINC000004776430	207048414	/nfs/dbraw/zinc/04/84/14/207048414.db2.gz	AHXNEKPTTGPJSV-KRWDZBQOSA-N	0	0	364.361	2.592	50	5		FFBARN
C[C@@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000004824136	207053459	/nfs/dbraw/zinc/05/34/59/207053459.db2.gz	ZRLXKBZYHIGTPK-SNVBAGLBSA-N	0	0	354.322	2.655	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])c1cccn(OCc2ccccc2)c1=O	ZINC000005054747	207076436	/nfs/dbraw/zinc/07/64/36/207076436.db2.gz	HWKHTWPSGPPIKE-UHFFFAOYSA-N	0	0	365.345	2.638	50	5		FFBARN
Cc1cccc(NC(=O)c2cccn(Cc3cccc([N+](=O)[O-])c3)c2=O)n1	ZINC000005270788	207091276	/nfs/dbraw/zinc/09/12/76/207091276.db2.gz	QQULQTXKKHVGGC-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
COc1cc(NC(=O)COC(=O)Cc2ccsc2)c(C)cc1[N+](=O)[O-]	ZINC000005679332	207112796	/nfs/dbraw/zinc/11/27/96/207112796.db2.gz	CCJDLENRHNVWJY-UHFFFAOYSA-N	0	0	364.379	2.698	50	5		FFBARN
C[C@@H](OC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000005785683	207116554	/nfs/dbraw/zinc/11/65/54/207116554.db2.gz	SPJWEGXSEYKINW-HABKJSAYSA-N	0	0	374.393	2.860	50	5		FFBARN
COc1ccc(O[C@H](C(=O)N2CCOCC2)c2ccccc2)c([N+](=O)[O-])c1	ZINC000006846900	207171940	/nfs/dbraw/zinc/17/19/40/207171940.db2.gz	JOULWPZMCBMWMR-SFHVURJKSA-N	0	0	372.377	2.582	50	5		FFBARN
C[C@@H]1CCCCN1C(=O)COc1cc(N2CCCC2=O)ccc1[N+](=O)[O-]	ZINC000008750028	207245931	/nfs/dbraw/zinc/24/59/31/207245931.db2.gz	ULPBOUMMCQNKGD-CYBMUJFWSA-N	0	0	361.398	2.501	50	5		FFBARN
Cc1nn(CC(=O)NCCSCc2ccccc2F)c(C)c1[N+](=O)[O-]	ZINC000008776694	207248869	/nfs/dbraw/zinc/24/88/69/207248869.db2.gz	WBUYHYLHZVCFMV-UHFFFAOYSA-N	0	0	366.418	2.597	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCC1(c2ccccc2)CC1	ZINC000008923820	207251039	/nfs/dbraw/zinc/25/10/39/207251039.db2.gz	KXKVACGHALGWDJ-UHFFFAOYSA-N	0	0	367.405	2.563	50	5		FFBARN
O=[N+]([O-])c1ccc(C2=NNC(=NCc3ccc4c(c3)OCO4)SC2)cc1	ZINC000008935716	207252687	/nfs/dbraw/zinc/25/26/87/207252687.db2.gz	ZEPDGULGCQGMSK-UHFFFAOYSA-N	0	0	370.390	2.920	50	5		FFBARN
COc1ccc([C@@]2(C)NC(=O)N(Cc3cccc([N+](=O)[O-])c3)C2=O)cc1	ZINC000009479603	207272908	/nfs/dbraw/zinc/27/29/08/207272908.db2.gz	BVZWNXWYYSKDDQ-GOSISDBHSA-N	0	0	355.350	2.571	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)N1CCC([C@@H](O)c2ccccc2)CC1	ZINC000023383567	207843586	/nfs/dbraw/zinc/84/35/86/207843586.db2.gz	NDRGXZWSFMQCIJ-FQEVSTJZSA-N	0	0	370.405	2.946	50	5		FFBARN
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)Cc1cccc([N+](=O)[O-])c1	ZINC000030967497	208008678	/nfs/dbraw/zinc/00/86/78/208008678.db2.gz	SDAXPMKVYFUQHI-UHFFFAOYSA-N	0	0	371.393	2.827	50	5		FFBARN
COc1ccc(NC(=O)N(C)Cc2ccc(O)c(OC)c2)c([N+](=O)[O-])c1	ZINC000032779467	208043958	/nfs/dbraw/zinc/04/39/58/208043958.db2.gz	BAFFHAYZFYALKK-UHFFFAOYSA-N	0	0	361.354	2.982	50	5		FFBARN
CN(CCOc1ccccc1)C(=O)CCn1ncc2ccc([N+](=O)[O-])cc21	ZINC000032932503	208058230	/nfs/dbraw/zinc/05/82/30/208058230.db2.gz	DGNJMWSLSYTXKL-UHFFFAOYSA-N	0	0	368.393	2.872	50	5		FFBARN
O=C(CCc1ccccc1)N1CCN(C(=O)c2ccc([N+](=O)[O-])s2)CC1	ZINC000032925028	208058574	/nfs/dbraw/zinc/05/85/74/208058574.db2.gz	SHMDAYHWGBNCEV-UHFFFAOYSA-N	0	0	373.434	2.574	50	5		FFBARN
CCc1onc(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000033087002	208071605	/nfs/dbraw/zinc/07/16/05/208071605.db2.gz	HVYRJNWHWJBWPB-ZDUSSCGKSA-N	0	0	365.411	2.979	50	5		FFBARN
O=C(Cn1cc(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1)NC1CC1	ZINC000052487505	208437983	/nfs/dbraw/zinc/43/79/83/208437983.db2.gz	ZNVIMKYYMGLGBA-UHFFFAOYSA-N	0	0	369.303	2.832	50	5		FFBARN
O=C(CCc1c[nH]c2ccccc12)N1CCc2ncc([N+](=O)[O-])cc2C1	ZINC000095464911	209055290	/nfs/dbraw/zinc/05/52/90/209055290.db2.gz	DWBUXHUSZPQEDL-UHFFFAOYSA-N	0	0	350.378	2.989	50	5		FFBARN
Cc1c(F)cc(S(=O)(=O)N2CCSc3ccncc32)cc1[N+](=O)[O-]	ZINC000097097220	132227600	/nfs/dbraw/zinc/22/76/00/132227600.db2.gz	BKCISTFQDHFNQR-UHFFFAOYSA-N	0	0	369.399	2.738	50	5		FFBARN
O=C(NCCc1ccc(F)cc1)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000004895660	132255229	/nfs/dbraw/zinc/25/52/29/132255229.db2.gz	QOTIIHIWQPRVJK-UHFFFAOYSA-N	0	0	373.384	2.543	50	5		FFBARN
CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccc([N+](=O)[O-])s1	ZINC000009154725	132844911	/nfs/dbraw/zinc/84/49/11/132844911.db2.gz	LPGXFFLAVFJHTM-UHFFFAOYSA-N	0	0	361.423	2.765	50	5		FFBARN
C[C@@H](NC(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000012555155	132860415	/nfs/dbraw/zinc/86/04/15/132860415.db2.gz	LQJLZRDOQKSJQQ-OAHLLOKOSA-N	0	0	368.437	2.838	50	5		FFBARN
COC(=O)c1ccc(Sc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1	ZINC000000715378	506229789	/nfs/dbraw/zinc/22/97/89/506229789.db2.gz	JHIIXCVQYBYCNN-UHFFFAOYSA-N	0	0	357.351	2.508	50	5		FFBARN
Cn1c2c(cn3c2c(Cc2ccccc2)nc2ccccc23)c(=O)n(C)c1=O	ZINC000000804794	506233819	/nfs/dbraw/zinc/23/38/19/506233819.db2.gz	PDMVYOPBHGRFDU-UHFFFAOYSA-N	0	0	370.412	2.629	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)n1nnc(-c2ccccc2)n1	ZINC000000976195	506242481	/nfs/dbraw/zinc/24/24/81/506242481.db2.gz	USXQMBHEOUYAAL-GFCCVEGCSA-N	0	0	352.354	2.756	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000001121206	506249937	/nfs/dbraw/zinc/24/99/37/506249937.db2.gz	GCDNKOMKMUVTPZ-UHFFFAOYSA-N	0	0	374.349	2.580	50	5		FFBARN
COc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])c(OC)c1	ZINC000001174204	506252151	/nfs/dbraw/zinc/25/21/51/506252151.db2.gz	BTWVFJHSSTZLQY-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CC(C)CNC(=O)c1cccc(NC(=O)COc2ccc([N+](=O)[O-])cc2)c1	ZINC000001145829	506252544	/nfs/dbraw/zinc/25/25/44/506252544.db2.gz	UUYCYQRUEGTFJD-UHFFFAOYSA-N	0	0	371.393	2.998	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000001212396	506256956	/nfs/dbraw/zinc/25/69/56/506256956.db2.gz	KTEOIVMFGWSIHU-WFASDCNBSA-N	0	0	371.315	2.777	50	5		FFBARN
O=[N+]([O-])c1ccc([C@H](O)CN2CCN(C/C=C/c3ccccc3)CC2)cc1	ZINC000001307399	506258842	/nfs/dbraw/zinc/25/88/42/506258842.db2.gz	OPZYKJXPYQSPLO-HXRGIAOBSA-N	0	0	367.449	2.959	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(Br)cc1F	ZINC000001428826	506262940	/nfs/dbraw/zinc/26/29/40/506262940.db2.gz	AAHNEBGOFGLWFO-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
Cc1sc(NC(=O)c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c(C(N)=O)c1C	ZINC000002790485	506293040	/nfs/dbraw/zinc/29/30/40/506293040.db2.gz	CAGDPKAGEFHCFD-UHFFFAOYSA-N	0	0	364.339	2.533	50	5		FFBARN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])o2)ccc1I	ZINC000002857611	506297839	/nfs/dbraw/zinc/29/78/39/506297839.db2.gz	BMGQUDYIWNBFAL-UHFFFAOYSA-N	0	0	373.106	2.748	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)Nc2ccccc2C(C)=O)cc1[N+](=O)[O-]	ZINC000003442129	506330570	/nfs/dbraw/zinc/33/05/70/506330570.db2.gz	QWLFYQDUDMMMBE-UHFFFAOYSA-N	0	0	372.333	2.602	50	5		FFBARN
Cc1ccc(CNC(=O)COC(=O)/C=C/c2ccccc2[N+](=O)[O-])cc1	ZINC000003414600	506329598	/nfs/dbraw/zinc/32/95/98/506329598.db2.gz	ZZRJQFFWJBUKBN-ZHACJKMWSA-N	0	0	354.362	2.776	50	5		FFBARN
O=C(NCCc1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1Cl	ZINC000003432036	506331329	/nfs/dbraw/zinc/33/13/29/506331329.db2.gz	HAEOVFBNCZMNII-UHFFFAOYSA-N	0	0	362.769	2.992	50	5		FFBARN
O=C(COC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)N1CCc2ccccc2C1	ZINC000003505110	506338003	/nfs/dbraw/zinc/33/80/03/506338003.db2.gz	JFJKHVMUXIUPRG-UHFFFAOYSA-N	0	0	374.780	2.990	50	5		FFBARN
COc1ccc(NC(=O)c2cc(OC)c(OC)c(OC)c2)c([N+](=O)[O-])c1	ZINC000003960317	506353002	/nfs/dbraw/zinc/35/30/02/506353002.db2.gz	CVHKFMZCEACBLK-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
C[C@@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)NCc1ccco1	ZINC000004219390	506365822	/nfs/dbraw/zinc/36/58/22/506365822.db2.gz	VLJVMVYVIJDSBT-LLVKDONJSA-N	0	0	364.379	2.528	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004497458	506379145	/nfs/dbraw/zinc/37/91/45/506379145.db2.gz	XEFBSKFOHDDEDX-ICSVTGKESA-N	0	0	369.352	2.669	50	5		FFBARN
Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)c1	ZINC000004998213	506412452	/nfs/dbraw/zinc/41/24/52/506412452.db2.gz	IVCCGMNRWPGBMX-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
C[C@H](CNC(=O)Cc1ccccc1[N+](=O)[O-])N1CCc2sccc2C1	ZINC000040074369	506462901	/nfs/dbraw/zinc/46/29/01/506462901.db2.gz	KLDSQJWSAZSEIY-CYBMUJFWSA-N	0	0	359.451	2.762	50	5		FFBARN
Cc1c(C(=O)OCC(=O)NCCSc2ccccc2)cccc1[N+](=O)[O-]	ZINC000007816377	506592778	/nfs/dbraw/zinc/59/27/78/506592778.db2.gz	IEMXOJIPGCYSQB-UHFFFAOYSA-N	0	0	374.418	2.969	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000008395611	506647428	/nfs/dbraw/zinc/64/74/28/506647428.db2.gz	HFFQWYLNHXYAPE-UHFFFAOYSA-N	0	0	369.377	2.886	50	5		FFBARN
O=C(Nc1nc2c(s1)CCC2)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000009368306	506693363	/nfs/dbraw/zinc/69/33/63/506693363.db2.gz	XSPWBDZUKARBOI-UHFFFAOYSA-N	0	0	374.422	2.629	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCCn1cnc2ccccc21	ZINC000012553980	506878772	/nfs/dbraw/zinc/87/87/72/506878772.db2.gz	HDSJWBZCJPZLKP-UHFFFAOYSA-N	0	0	374.422	2.622	50	5		FFBARN
O=C(CN1CCC([C@@H](O)c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000012745630	506893853	/nfs/dbraw/zinc/89/38/53/506893853.db2.gz	RBIAPBJCAPVDGO-FQEVSTJZSA-N	0	0	369.421	2.979	50	5		FFBARN
COc1cc(C(=O)N2CCO[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC	ZINC000012872047	506909545	/nfs/dbraw/zinc/90/95/45/506909545.db2.gz	HACKXOMHANMNDH-SFHVURJKSA-N	0	0	372.377	2.826	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NC[C@H]1CCCO1)c1cccc([N+](=O)[O-])c1	ZINC000012983267	506921633	/nfs/dbraw/zinc/92/16/33/506921633.db2.gz	JAAWEVYXTXXRAP-OAHLLOKOSA-N	0	0	369.377	2.756	50	5		FFBARN
CCn1ccc2c(OCC(=O)Nc3ccc([N+](=O)[O-])cc3)cccc2c1=O	ZINC000015882450	507065152	/nfs/dbraw/zinc/06/51/52/507065152.db2.gz	VYPGJRXDHTVMDN-UHFFFAOYSA-N	0	0	367.361	2.947	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@@H]1COc1cccc(C)c1	ZINC000021092375	507244170	/nfs/dbraw/zinc/24/41/70/507244170.db2.gz	GGZNDEPKFUXQAA-QGZVFWFLSA-N	0	0	355.350	2.849	50	5		FFBARN
COCCOc1cc([N+](=O)[O-])c(C(=O)NCCc2ccccc2)cc1OC	ZINC000023053439	507326758	/nfs/dbraw/zinc/32/67/58/507326758.db2.gz	JMRYJYZQVKEVTE-UHFFFAOYSA-N	0	0	374.393	2.601	50	5		FFBARN
O=C(NC[C@@H](c1ccc(F)cc1)N1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000023106150	507329525	/nfs/dbraw/zinc/32/95/25/507329525.db2.gz	KRUFHHHMHPBVPB-SFHVURJKSA-N	0	0	373.384	2.537	50	5		FFBARN
CCC(CC)[C@@H](CNC(=O)c1ccc([N+](=O)[O-])s1)N1CCOCC1	ZINC000024828869	507442089	/nfs/dbraw/zinc/44/20/89/507442089.db2.gz	NTRDCHNOQOADSC-CYBMUJFWSA-N	0	0	355.460	2.523	50	5		FFBARN
O=C(CNc1ccc([N+](=O)[O-])cn1)Nc1ccc(Br)cc1	ZINC000048356622	507507034	/nfs/dbraw/zinc/50/70/34/507507034.db2.gz	WAVIOJGYQHFBJL-UHFFFAOYSA-N	0	0	351.160	2.803	50	5		FFBARN
O=C(NCc1ccnc(-n2ccnc2)c1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000062581443	507676357	/nfs/dbraw/zinc/67/63/57/507676357.db2.gz	VNYONRLWONVLEL-UHFFFAOYSA-N	0	0	357.757	2.759	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3nc(-c4ccco4)no3)CC2)cc1	ZINC000030539361	507810133	/nfs/dbraw/zinc/81/01/33/507810133.db2.gz	XSTIBLIJVULEKQ-UHFFFAOYSA-N	0	0	355.354	2.560	50	5		FFBARN
Nc1nc2oc3ccccc3c(=O)c2cc1-c1nc2ccccc2c(=O)[nH]1	ZINC000094986178	508172096	/nfs/dbraw/zinc/17/20/96/508172096.db2.gz	PKVQBQROZUXJSC-UHFFFAOYSA-N	0	0	356.341	2.827	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@H]2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000245231336	520826774	/nfs/dbraw/zinc/82/67/74/520826774.db2.gz	BQRURLIZQQYDGS-HQQWDMGQSA-N	0	0	359.382	2.955	50	5		FFBARN
COC(=O)c1cccc([N+](=O)[O-])c1CN1CCN(c2ccc(F)cc2)CC1	ZINC000059846825	536814171	/nfs/dbraw/zinc/81/41/71/536814171.db2.gz	AUSDNLSXUAWTAE-UHFFFAOYSA-N	0	0	373.384	2.843	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)N[C@H](c1cccs1)C1CCCC1	ZINC000084436924	571085783	/nfs/dbraw/zinc/08/57/83/571085783.db2.gz	HYEFCHKYCAFPFC-KRWDZBQOSA-N	0	0	361.423	2.866	50	5		FFBARN
CCc1nn(C)c(NCCNc2ncccc2C(F)(F)F)c1[N+](=O)[O-]	ZINC000092828931	571199012	/nfs/dbraw/zinc/19/90/12/571199012.db2.gz	HRCVZCHUDIAHCQ-UHFFFAOYSA-N	0	0	358.324	2.829	50	5		FFBARN
O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)NC[C@@H]1COCCO1	ZINC000055846778	989162517	/nfs/dbraw/zinc/16/25/17/989162517.db2.gz	HVUQDSGJFLSYNO-FWPCIQOSSA-N	0	0	374.418	2.868	50	5		FFBARN
COc1ccc([C@H]2c3c(c4ccccc4oc3=O)OC(N)=C2[N+](=O)[O-])cc1	ZINC000001052025	219359332	/nfs/dbraw/zinc/35/93/32/219359332.db2.gz	QCYFEZFCQJBYAE-AWEZNQCLSA-N	0	0	366.329	2.730	50	5	biogenic	FFBARN
Cc1ccc(S(=O)(=O)NCCNc2cc(Cl)ccc2[N+](=O)[O-])cc1	ZINC000004689119	219595885	/nfs/dbraw/zinc/59/58/85/219595885.db2.gz	IXYAZYXJWPJRIW-UHFFFAOYSA-N	0	0	369.830	2.947	50	5		FFBARN
CNC(=O)c1ccc(CN(C(=O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1	ZINC000012972051	209574732	/nfs/dbraw/zinc/57/47/32/209574732.db2.gz	NWYQDEUTCYRHCG-UHFFFAOYSA-N	0	0	353.378	2.759	50	5		FFBARN
C[C@H](OC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007784113	209464937	/nfs/dbraw/zinc/46/49/37/209464937.db2.gz	AMEFUNNWFTYMKL-ICIURTGMSA-N	0	0	374.393	2.860	50	5		FFBARN
Cc1c(NC(=O)CCCN2C(=O)c3ccccc3C2=O)cccc1[N+](=O)[O-]	ZINC000007007480	209460225	/nfs/dbraw/zinc/46/02/25/209460225.db2.gz	LJZGAIIFAOHSNP-UHFFFAOYSA-N	0	0	367.361	2.918	50	5		FFBARN
COc1ccc(OC)c(-c2ccc(=O)n(Cc3cccc([N+](=O)[O-])c3)n2)c1	ZINC000005409581	209445061	/nfs/dbraw/zinc/44/50/61/209445061.db2.gz	NKMPQJQYXZDYJW-UHFFFAOYSA-N	0	0	367.361	2.884	50	5		FFBARN
Nn1c(Cc2ccc([N+](=O)[O-])cc2)nc2sc3c(c2c1=O)CCCC3	ZINC000004647433	209423424	/nfs/dbraw/zinc/42/34/24/209423424.db2.gz	YVSLZSXSXWSYMX-UHFFFAOYSA-N	0	0	356.407	2.550	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N2CCc3[nH]c4ccccc4c3C2)cc1	ZINC000002151230	209394372	/nfs/dbraw/zinc/39/43/72/209394372.db2.gz	GOCCNHJPWRWHDF-UHFFFAOYSA-N	0	0	357.391	2.823	50	5	biogenic	FFBARN
COC(=O)[C@@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000049632914	209339438	/nfs/dbraw/zinc/33/94/38/209339438.db2.gz	AYGOYWAIWYZKBX-OAHLLOKOSA-N	0	0	362.769	2.762	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1Cl	ZINC000104143648	209257899	/nfs/dbraw/zinc/25/78/99/209257899.db2.gz	MGRPETRMPPWKOG-UHFFFAOYSA-N	0	0	373.690	2.773	50	5		FFBARN
COc1cccc(C([O-])=CC(=O)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1	ZINC000101354952	209223982	/nfs/dbraw/zinc/22/39/82/209223982.db2.gz	CFDNRYJGWXENIR-UHFFFAOYSA-N	0	0	356.334	2.692	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(OC(F)(F)Cl)cc1	ZINC000001428853	206880991	/nfs/dbraw/zinc/88/09/91/206880991.db2.gz	UJRMCNHDNFXAKM-UHFFFAOYSA-N	0	0	360.704	2.906	50	5		FFBARN
Cc1cccc(-c2nc3s/c(=C\c4ccc([N+](=O)[O-])cc4)c(=O)n3n2)c1	ZINC000002323181	206910113	/nfs/dbraw/zinc/91/01/13/206910113.db2.gz	BRTWDLQKIKGNQK-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
COC(=O)c1ccc(COC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1	ZINC000003575805	206984662	/nfs/dbraw/zinc/98/46/62/206984662.db2.gz	ARGVIYKUDRZLCR-UHFFFAOYSA-N	0	0	373.317	2.525	50	5		FFBARN
O=[N+]([O-])c1cn2c(n1)OC[C@@H](OCc1ccc(OC(F)(F)F)cc1)C2	ZINC000003821675	206991631	/nfs/dbraw/zinc/99/16/31/206991631.db2.gz	ZLHZLMOSPGACSZ-NSHDSACASA-N	0	0	359.260	2.668	50	5	world	FFBARN
COc1ccc(NC(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)c(OC)c1	ZINC000003896275	206994223	/nfs/dbraw/zinc/99/42/23/206994223.db2.gz	GJFNLINQOPATRS-UHFFFAOYSA-N	0	0	362.386	2.844	50	5		FFBARN
C[C@@H]1CN(C(=S)SCC(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](C)O1	ZINC000004290000	207010837	/nfs/dbraw/zinc/01/08/37/207010837.db2.gz	KHKFASHXUMOSLQ-GHMZBOCLSA-N	0	0	354.453	2.905	50	5		FFBARN
CC(C)[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	ZINC000004159296	207003926	/nfs/dbraw/zinc/00/39/26/207003926.db2.gz	FSHWKQUBLNVXSS-MRXNPFEDSA-N	0	0	367.361	2.854	50	5		FFBARN
Cc1ccccc1-c1nnc2s/c(=C\c3ccc([N+](=O)[O-])cc3)c(=O)n21	ZINC000004815998	207051322	/nfs/dbraw/zinc/05/13/22/207051322.db2.gz	ITBAIPQIIFPTRC-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
Cc1ccc(-n2nnnc2SCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1	ZINC000004821378	207051501	/nfs/dbraw/zinc/05/15/01/207051501.db2.gz	LAEFJAKZLQOIHJ-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
COc1ccc(-n2nc([N+](=O)[O-])c(N[C@@H](C)c3ccccc3)[n+]2[O-])cc1	ZINC000004826616	207053190	/nfs/dbraw/zinc/05/31/90/207053190.db2.gz	JJFAVSFXVHZLIA-LBPRGKRZSA-N	0	0	355.354	2.596	50	5		FFBARN
COCCN(Cc1ccc(C)o1)C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000004923020	207062915	/nfs/dbraw/zinc/06/29/15/207062915.db2.gz	MCGHZTWIRCKHMC-UHFFFAOYSA-N	0	0	363.326	2.693	50	5		FFBARN
O=C(CSc1cccc[n+]1[O-])Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-]	ZINC000005446040	207100457	/nfs/dbraw/zinc/10/04/57/207100457.db2.gz	CLUNZLMEORKZJD-UHFFFAOYSA-N	0	0	373.312	2.978	50	5		FFBARN
CC[C@H](C)Nc1nc(N)c([N+](=O)[O-])c(Nc2cc(OC)ccc2OC)n1	ZINC000005516404	207103821	/nfs/dbraw/zinc/10/38/21/207103821.db2.gz	PRNSIJYOJBHTBQ-VIFPVBQESA-N	0	0	362.390	2.938	50	5		FFBARN
Cc1ccc(NC(=O)COC(=O)c2n[nH]c3ccccc32)cc1[N+](=O)[O-]	ZINC000006506481	207143919	/nfs/dbraw/zinc/14/39/19/207143919.db2.gz	PEZJLSLXDKAQFC-UHFFFAOYSA-N	0	0	354.322	2.575	50	5		FFBARN
C[C@H](OC(=O)c1ccc(Sc2ccc(F)cc2)c([N+](=O)[O-])c1)C(N)=O	ZINC000006788499	207164624	/nfs/dbraw/zinc/16/46/24/207164624.db2.gz	JAPQVJVDFCWHDY-VIFPVBQESA-N	0	0	364.354	2.916	50	5		FFBARN
Cc1ccc(OCCN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000006834750	207171233	/nfs/dbraw/zinc/17/12/33/207171233.db2.gz	BMHBMKXXTSYIBJ-IBGZPJMESA-N	0	0	369.377	2.749	50	5		FFBARN
Cc1ccccc1-c1nnn(CC(=O)Nc2ccc(C)c([N+](=O)[O-])c2)n1	ZINC000007015633	207183672	/nfs/dbraw/zinc/18/36/72/207183672.db2.gz	KIOHGIFJPCYGOA-UHFFFAOYSA-N	0	0	352.354	2.504	50	5		FFBARN
COc1cc(CCNC(=O)CCc2cccs2)c([N+](=O)[O-])cc1OC	ZINC000008704091	207241863	/nfs/dbraw/zinc/24/18/63/207241863.db2.gz	BYNJHZBZMFSCFU-UHFFFAOYSA-N	0	0	364.423	2.965	50	5		FFBARN
CCCNC(=O)CSc1nnc(Sc2ncccc2[N+](=O)[O-])s1	ZINC000008745621	207246013	/nfs/dbraw/zinc/24/60/13/207246013.db2.gz	ZLFYNUXFIZVMIN-UHFFFAOYSA-N	0	0	371.469	2.611	50	5		FFBARN
O=C(CCCNC(=O)c1ccsc1)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000012977053	207443141	/nfs/dbraw/zinc/44/31/41/207443141.db2.gz	CIKFOXWQOQGOBY-UHFFFAOYSA-N	0	0	351.359	2.944	50	5		FFBARN
CC(=O)c1cc2c(cc1NC(=O)COc1cc(C)ccc1[N+](=O)[O-])OCO2	ZINC000024542721	207868986	/nfs/dbraw/zinc/86/89/86/207868986.db2.gz	HUXNEUYOBDEGLI-UHFFFAOYSA-N	0	0	372.333	2.852	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NC1(CO)CCCC1	ZINC000079047836	208220381	/nfs/dbraw/zinc/22/03/81/208220381.db2.gz	DRXIVQDOISVFGB-UHFFFAOYSA-N	0	0	368.333	2.605	50	5		FFBARN
COc1ccccc1CN(CCO)C(=O)Nc1cc([N+](=O)[O-])ccc1C	ZINC000047323470	208375328	/nfs/dbraw/zinc/37/53/28/208375328.db2.gz	BQTHJLHTQYBOGC-UHFFFAOYSA-N	0	0	359.382	2.938	50	5		FFBARN
O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000048331444	208399569	/nfs/dbraw/zinc/39/95/69/208399569.db2.gz	JKLXBYNPXNNMMT-QZTJIDSGSA-N	0	0	362.389	2.821	50	5		FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@@H]1COc2ccccc2C1	ZINC000065488763	208682708	/nfs/dbraw/zinc/68/27/08/208682708.db2.gz	SFEYTLPPIQWXCO-CQSZACIVSA-N	0	0	365.389	2.917	50	5		FFBARN
CC(C)(C)NC(=O)N1CCC(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1	ZINC000095997017	209095279	/nfs/dbraw/zinc/09/52/79/209095279.db2.gz	IQEAFOWPUVGIBW-UHFFFAOYSA-N	0	0	365.390	2.887	50	5		FFBARN
COC(=O)C(C)(C)N(C)C(=O)c1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000095394048	209047162	/nfs/dbraw/zinc/04/71/62/209047162.db2.gz	OFIPJZBAYZDNGU-UHFFFAOYSA-N	0	0	363.395	2.742	50	5		FFBARN
O=C(NC[C@@H](O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000095451794	209051971	/nfs/dbraw/zinc/05/19/71/209051971.db2.gz	BMZABUPGGHWBCL-MRXNPFEDSA-N	0	0	355.325	2.746	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccc(F)cc3)CC2)cc1[N+](=O)[O-]	ZINC000000834224	132378855	/nfs/dbraw/zinc/37/88/55/132378855.db2.gz	IZEJKWNRMUXIST-UHFFFAOYSA-N	0	0	359.357	2.705	50	5		FFBARN
COc1ccc(Nc2nc(N3CCC[C@@H](C)C3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004306115	132386725	/nfs/dbraw/zinc/38/67/25/132386725.db2.gz	SKSKDYDNBCQNQF-LLVKDONJSA-N	0	0	358.402	2.956	50	5		FFBARN
COc1ccc(Nc2nc(N3CCC(C)CC3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004306111	132386772	/nfs/dbraw/zinc/38/67/72/132386772.db2.gz	VDRRIDNEFJFHSK-UHFFFAOYSA-N	0	0	358.402	2.956	50	5		FFBARN
O=C(NC1CCN(c2ccc([N+](=O)[O-])c3nonc32)CC1)c1ccccc1	ZINC000011380816	132850211	/nfs/dbraw/zinc/85/02/11/132850211.db2.gz	JXEDNKKVDJGPMC-UHFFFAOYSA-N	0	0	367.365	2.530	50	5		FFBARN
C[C@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)CCc1ccccc1	ZINC000037520514	132942540	/nfs/dbraw/zinc/94/25/40/132942540.db2.gz	GFGSOQYZVSMQIV-HNNXBMFYSA-N	0	0	367.405	2.791	50	5		FFBARN
C[C@H]1CC[C@@H](C(N)=O)CN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000042739828	136121395	/nfs/dbraw/zinc/12/13/95/136121395.db2.gz	CJKMKSPUALZAPQ-XJKSGUPXSA-N	0	0	367.405	2.916	50	5		FFBARN
C[C@@H](C(=O)N(C)c1ccccc1)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000057718119	136129965	/nfs/dbraw/zinc/12/99/65/136129965.db2.gz	OVLFURIZUOMSOC-INIZCTEOSA-N	0	0	368.437	2.768	50	5		FFBARN
COc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2)c(OC)cc1NC(C)=O	ZINC000000753072	506229863	/nfs/dbraw/zinc/22/98/63/506229863.db2.gz	IMKRITVNVYHLOJ-UHFFFAOYSA-N	0	0	359.338	2.823	50	5		FFBARN
CC(=O)N(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)c1ccc(Cl)cc1	ZINC000000711485	506229965	/nfs/dbraw/zinc/22/99/65/506229965.db2.gz	KOZQCBQMMNVGII-UHFFFAOYSA-N	0	0	373.752	2.855	50	5		FFBARN
O=C(Oc1cccc(C(=S)N2CCOCC2)c1)c1ccc([N+](=O)[O-])cc1	ZINC000000866316	506236770	/nfs/dbraw/zinc/23/67/70/506236770.db2.gz	UQEXAMAGTUGRSM-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
COc1ccc(NC(=O)c2nc(C)n(-c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000001397428	506260402	/nfs/dbraw/zinc/26/04/02/506260402.db2.gz	FJVBGQNYCHZKSI-UHFFFAOYSA-N	0	0	353.338	2.745	50	5		FFBARN
COc1cc2nc(COc3cccc([N+](=O)[O-])c3)oc(=O)c2cc1OC	ZINC000002313354	506276919	/nfs/dbraw/zinc/27/69/19/506276919.db2.gz	OENZHUMHSKFYSU-UHFFFAOYSA-N	0	0	358.306	2.692	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2nnc(CC(C)C)s2)cc([N+](=O)[O-])c1	ZINC000002642125	506284491	/nfs/dbraw/zinc/28/44/91/506284491.db2.gz	AGDDRJOVEWEYPU-UHFFFAOYSA-N	0	0	364.383	2.684	50	5		FFBARN
CO[C@@](F)(C(=O)Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)C(F)(F)F	ZINC000003672549	506349409	/nfs/dbraw/zinc/34/94/09/506349409.db2.gz	XWEKGMTXRSUTJU-JTQLQIEISA-N	0	0	355.200	2.624	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1C	ZINC000004497026	506377843	/nfs/dbraw/zinc/37/78/43/506377843.db2.gz	KQNBSGUPOVXELS-HNNXBMFYSA-N	0	0	353.378	2.747	50	5		FFBARN
Cc1ccc(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1	ZINC000004706771	506389473	/nfs/dbraw/zinc/38/94/73/506389473.db2.gz	SLBFRUFFIQGJBA-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
C[C@@H]1C(=O)N(c2ccc(F)cc2)CCN1C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000037275668	506422354	/nfs/dbraw/zinc/42/23/54/506422354.db2.gz	UCAJHMREZQSYSF-GFCCVEGCSA-N	0	0	357.341	2.611	50	5		FFBARN
C[C@H](OC(=O)c1n[nH]c2ccccc21)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000039588711	506455013	/nfs/dbraw/zinc/45/50/13/506455013.db2.gz	ORFABDSRIZOZMU-JTQLQIEISA-N	0	0	354.322	2.655	50	5		FFBARN
O=C(Nc1ccc2c(c1)CCC2)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1	ZINC000040103349	506467036	/nfs/dbraw/zinc/46/70/36/506467036.db2.gz	GITPENWLUGFBRK-UHFFFAOYSA-N	0	0	367.409	2.833	50	5		FFBARN
CC(C)CCC[C@@H](C)NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000007767091	506588236	/nfs/dbraw/zinc/58/82/36/506588236.db2.gz	OYOOZUKBRXVQLA-GFCCVEGCSA-N	0	0	361.398	2.522	50	5		FFBARN
Cc1nc2ccccn2c(=O)c1NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000009616747	506705039	/nfs/dbraw/zinc/70/50/39/506705039.db2.gz	AHWIXVZYHNUDGD-UHFFFAOYSA-N	0	0	358.741	2.817	50	5		FFBARN
C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc2[nH]c(=O)[nH]c2c1	ZINC000012772282	506900215	/nfs/dbraw/zinc/90/02/15/506900215.db2.gz	XFFDWWXKPBRSAP-SECBINFHSA-N	0	0	358.379	2.884	50	5		FFBARN
Cc1cc(C)n(-c2ccccc2NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)n1	ZINC000012974372	506919430	/nfs/dbraw/zinc/91/94/30/506919430.db2.gz	TYUJOIFXVHJMNI-UHFFFAOYSA-N	0	0	368.397	2.849	50	5		FFBARN
Cc1ccc(OS(=O)(=O)c2ccc3c(c2)OCCCO3)c([N+](=O)[O-])c1	ZINC000015328350	507033521	/nfs/dbraw/zinc/03/35/21/507033521.db2.gz	CTMUUTPSXVVQSW-UHFFFAOYSA-N	0	0	365.363	2.832	50	5		FFBARN
CC(C)C12CN3CC(C(C)C)(CN(C1)C3c1ccc([N+](=O)[O-])cc1)C2O	ZINC000019319649	507165042	/nfs/dbraw/zinc/16/50/42/507165042.db2.gz	IHSZGDDDEHANKE-UHFFFAOYSA-N	0	0	359.470	2.884	50	5	biogenic	FFBARN
CS(=O)(=O)c1ccc(NCCc2nc3ccccc3[nH]2)c([N+](=O)[O-])c1	ZINC000057877445	507347756	/nfs/dbraw/zinc/34/77/56/507347756.db2.gz	UNUCPJKPGIGDOJ-UHFFFAOYSA-N	0	0	360.395	2.529	50	5		FFBARN
O=[N+]([O-])c1cccc(-c2nccn2C[C@H](O)c2ccc3c(c2)OCCO3)c1	ZINC000058174320	507379040	/nfs/dbraw/zinc/37/90/40/507379040.db2.gz	MIALUKHMDJOXKP-INIZCTEOSA-N	0	0	367.361	2.963	50	5		FFBARN
Cc1ccc(C(=O)N[C@H](Cn2cncn2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000058268377	507396202	/nfs/dbraw/zinc/39/62/02/507396202.db2.gz	FWZAOEZKQBSTKI-MRXNPFEDSA-N	0	0	351.366	2.666	50	5		FFBARN
Cc1sc(C(=O)NC2CCN(C(=O)c3ccoc3)CC2)cc1[N+](=O)[O-]	ZINC000024467614	507413325	/nfs/dbraw/zinc/41/33/25/507413325.db2.gz	WFCSBPMKQGIHOC-UHFFFAOYSA-N	0	0	363.395	2.592	50	5		FFBARN
COC(=O)c1oc(CN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1C	ZINC000025913158	507542161	/nfs/dbraw/zinc/54/21/61/507542161.db2.gz	IDWVPOAKCVZIEV-UHFFFAOYSA-N	0	0	359.382	2.605	50	5		FFBARN
CS(=O)(=O)c1ccc(N[C@@H]2CCCC[C@@H]2n2cccn2)c([N+](=O)[O-])c1	ZINC000072307295	507773928	/nfs/dbraw/zinc/77/39/28/507773928.db2.gz	MSARCKFXDSCXHQ-HIFRSBDPSA-N	0	0	364.427	2.791	50	5		FFBARN
O=C(C1CC1)N1CCC[C@H](C(=O)N2CCCc3ccc([N+](=O)[O-])cc32)C1	ZINC000074017537	507977060	/nfs/dbraw/zinc/97/70/60/507977060.db2.gz	OGQLWOMJXDKHIG-HNNXBMFYSA-N	0	0	357.410	2.523	50	5		FFBARN
COC(=O)Cn1c2ccccc2s/c1=N\C(=O)c1ccccc1[N+](=O)[O-]	ZINC000100876308	508240491	/nfs/dbraw/zinc/24/04/91/508240491.db2.gz	PLLVCSRRRDKBMH-ZCXUNETKSA-N	0	0	371.374	2.525	50	5		FFBARN
COC(=O)c1sc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)nc1C	ZINC000225697336	509384412	/nfs/dbraw/zinc/38/44/12/509384412.db2.gz	DLVPEALSTGGYIQ-UHFFFAOYSA-N	0	0	353.331	2.846	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CCNC(=O)C[C@H]1c1ccccc1	ZINC000047175174	570881303	/nfs/dbraw/zinc/88/13/03/570881303.db2.gz	ANZCFXLZUCYXAI-BBVFFXRHSA-N	0	0	365.389	2.698	50	5		FFBARN
Cc1ccc(S(=O)(=O)n2cc(-c3ccc([N+](=O)[O-])cc3)c(N)n2)cc1	ZINC000001069831	727774392	/nfs/dbraw/zinc/77/43/92/727774392.db2.gz	FNBAWJUSOUNSPG-UHFFFAOYSA-N	0	0	358.379	2.586	50	5		FFBARN
CNC(=O)/C(=C/C=C\c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000005793644	977578042	/nfs/dbraw/zinc/57/80/42/977578042.db2.gz	ABADOHGDUGWOCM-NPFCYVKHSA-N	0	0	351.362	2.668	50	5		FFBARN
COC(=O)C1C(C)=NC(=S)N[C@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000001195066	1014454218	/nfs/dbraw/zinc/45/42/18/1014454218.db2.gz	MOOQUSCZFFANCL-HNNXBMFYSA-N	0	0	373.390	2.821	50	5		FFBARN
O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)NC[C@H]1COCCO1	ZINC000055846780	989162022	/nfs/dbraw/zinc/16/20/22/989162022.db2.gz	HVUQDSGJFLSYNO-WOLRVDTOSA-N	0	0	374.418	2.868	50	5		FFBARN
O=c1c(Cl)c(Cl)cnn1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000031840833	209847435	/nfs/dbraw/zinc/84/74/35/209847435.db2.gz	HHXFPOWTMMYCPH-UHFFFAOYSA-N	0	0	368.136	2.557	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)N1CCCCCC1	ZINC000001070717	219364058	/nfs/dbraw/zinc/36/40/58/219364058.db2.gz	KYOCEIQLAGTRRD-SNVBAGLBSA-N	0	0	359.224	2.826	50	5		FFBARN
Cc1sc(NC(=O)c2nn(C)cc2[N+](=O)[O-])c(C(=O)OC(C)C)c1C	ZINC000002749746	209396987	/nfs/dbraw/zinc/39/69/87/209396987.db2.gz	MHRLUNHFYVUSEJ-UHFFFAOYSA-N	0	0	366.399	2.824	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cn(Cc2c(Cl)ccc3cccnc32)c1=O	ZINC000048374617	209332676	/nfs/dbraw/zinc/33/26/76/209332676.db2.gz	RXVCWLMQWIIEJH-UHFFFAOYSA-N	0	0	373.752	2.793	50	5		FFBARN
O=C(N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)[C@@H]1C[C@H]1[N+](=O)[O-]	ZINC000106527180	209273780	/nfs/dbraw/zinc/27/37/80/209273780.db2.gz	NPTGIHFGCGXZJM-QGPMSJSTSA-N	0	0	368.368	2.698	50	5		FFBARN
O=[N+]([O-])c1cc2c(c([N+](=O)[O-])c1)-c1c(cc([N+](=O)[O-])cc1[N+](=O)[O-])C21N=N1	ZINC000103940550	209256765	/nfs/dbraw/zinc/25/67/65/209256765.db2.gz	JWJGZOULUOKBBO-UHFFFAOYSA-N	0	0	372.209	2.967	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)C1CCN(C(=O)c2ccco2)CC1	ZINC000019481836	220261354	/nfs/dbraw/zinc/26/13/54/220261354.db2.gz	IKDHVMUTGRSUQY-UHFFFAOYSA-N	0	0	358.350	2.783	50	5		FFBARN
Cc1c(N(C)C(=O)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C	ZINC000001186145	206865855	/nfs/dbraw/zinc/86/58/55/206865855.db2.gz	JGCWSSQRJGKTAB-UHFFFAOYSA-N	0	0	366.377	2.669	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCS(=O)(=O)Cc1ccccc1	ZINC000002876370	206941905	/nfs/dbraw/zinc/94/19/05/206941905.db2.gz	SUYNLNOEUKMLJL-UHFFFAOYSA-N	0	0	362.407	2.847	50	5		FFBARN
O=C(NCCOc1ccccc1Cl)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000003101361	206957159	/nfs/dbraw/zinc/95/71/59/206957159.db2.gz	GHCNVMSYRCZUKP-UHFFFAOYSA-N	0	0	365.729	2.965	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)c1ccccc1Br	ZINC000003300472	206967998	/nfs/dbraw/zinc/96/79/98/206967998.db2.gz	HQFKVXLZJPRBFD-UHFFFAOYSA-N	0	0	354.112	2.990	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1ccccc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004113428	207001451	/nfs/dbraw/zinc/00/14/51/207001451.db2.gz	PXXHQIOEPWWUNQ-UHFFFAOYSA-N	0	0	356.334	2.740	50	5		FFBARN
CC(=O)c1c(C)[nH]c(C(=O)O[C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C	ZINC000004548368	207026917	/nfs/dbraw/zinc/02/69/17/207026917.db2.gz	AZHNNCREVDTUSI-GFCCVEGCSA-N	0	0	373.365	2.926	50	5		FFBARN
Cc1nc([N+](=O)[O-])c(C(=O)OCc2ccccc2Br)n1C	ZINC000004625022	207033596	/nfs/dbraw/zinc/03/35/96/207033596.db2.gz	CKWLKJGHNMBAKZ-UHFFFAOYSA-N	0	0	354.160	2.756	50	5		FFBARN
CCCSc1cc(NCCCOC(C)=O)c([N+](=O)[O-])c2nonc21	ZINC000004677066	207036503	/nfs/dbraw/zinc/03/65/03/207036503.db2.gz	RSIJDVZLZTYWEK-UHFFFAOYSA-N	0	0	354.388	2.998	50	5		FFBARN
O=C(C=Cc1cccc([N+](=O)[O-])c1)OCC(=O)c1ccc2c(c1)OCCO2	ZINC000004870768	207056960	/nfs/dbraw/zinc/05/69/60/207056960.db2.gz	IEWZESMJGOCYOB-QPJJXVBHSA-N	0	0	369.329	2.805	50	5		FFBARN
O=C(COC(=O)CCC(=O)c1cccs1)Nc1cccc([N+](=O)[O-])c1	ZINC000004965160	207066694	/nfs/dbraw/zinc/06/66/94/207066694.db2.gz	NKRYIEJIRYETHC-UHFFFAOYSA-N	0	0	362.363	2.801	50	5		FFBARN
Nc1nc(NC[C@H]2CCCO2)nc(Nc2ccc(Cl)cc2)c1[N+](=O)[O-]	ZINC000005067829	207077547	/nfs/dbraw/zinc/07/75/47/207077547.db2.gz	RCPDCWQZDGUROD-LLVKDONJSA-N	0	0	364.793	2.955	50	5		FFBARN
O=C1C[C@]2(CC(c3ccc([N+](=O)[O-])cc3)=NO2)C(=O)N1c1ccc(F)cc1	ZINC000005066158	207077579	/nfs/dbraw/zinc/07/75/79/207077579.db2.gz	YWQPRQMRTVWFJR-GOSISDBHSA-N	0	0	369.308	2.561	50	5		FFBARN
COC(=O)c1ccc(COC(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cc1	ZINC000005363210	207095361	/nfs/dbraw/zinc/09/53/61/207095361.db2.gz	XITQKDBLVNANHI-UHFFFAOYSA-N	0	0	358.350	2.804	50	5		FFBARN
COc1ccc(C(=O)O[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000006055684	207127777	/nfs/dbraw/zinc/12/77/77/207127777.db2.gz	LYVQURAZXZZIKU-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
Cc1nn(CC(=O)N(C)Cc2c(F)cccc2Cl)c(C)c1[N+](=O)[O-]	ZINC000006507825	207143962	/nfs/dbraw/zinc/14/39/62/207143962.db2.gz	HEASFABXZPORMF-UHFFFAOYSA-N	0	0	354.769	2.859	50	5		FFBARN
Cn1ncc([N+](=O)[O-])c1C(=O)Nc1ccn(C23CC4CC(CC(C4)C2)C3)n1	ZINC000006827394	207170634	/nfs/dbraw/zinc/17/06/34/207170634.db2.gz	NHBUUPNPVLQJDK-UHFFFAOYSA-N	0	0	370.413	2.702	50	5		FFBARN
O=C(COc1cccc(N2CCCC2=O)c1)Nc1cccc([N+](=O)[O-])c1	ZINC000007063991	207185204	/nfs/dbraw/zinc/18/52/04/207185204.db2.gz	HOXHDBUGUADXCB-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
Cn1c(SCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)nnc1C1CC1	ZINC000007235595	207191140	/nfs/dbraw/zinc/19/11/40/207191140.db2.gz	TYHWKBFSCDIXCE-UHFFFAOYSA-N	0	0	367.818	2.985	50	5		FFBARN
Cc1ccc(NC(=O)CN(C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1	ZINC000007490221	207196451	/nfs/dbraw/zinc/19/64/51/207196451.db2.gz	FBSSKZQPLXDIHL-UHFFFAOYSA-N	0	0	371.393	2.840	50	5		FFBARN
Cc1c(NC(=O)C2CCN(C(=O)c3ccco3)CC2)cccc1[N+](=O)[O-]	ZINC000008246584	207224695	/nfs/dbraw/zinc/22/46/95/207224695.db2.gz	DOSZANVFBNTQFS-UHFFFAOYSA-N	0	0	357.366	2.987	50	5		FFBARN
COc1cccc(CN(C)S(=O)(=O)c2cc([N+](=O)[O-])ccc2C)c1	ZINC000008774371	207248937	/nfs/dbraw/zinc/24/89/37/207248937.db2.gz	DIDIFFTXHCZHPC-UHFFFAOYSA-N	0	0	350.396	2.733	50	5		FFBARN
Cn1ccnc1[C@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1F	ZINC000008719865	207243015	/nfs/dbraw/zinc/24/30/15/207243015.db2.gz	VFFKOZFUYFELRW-MRXNPFEDSA-N	0	0	369.356	2.768	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1cc(F)cc2c1OCOC2	ZINC000009154171	207260245	/nfs/dbraw/zinc/26/02/45/207260245.db2.gz	VUZXKYKNMXACKT-UHFFFAOYSA-N	0	0	362.313	2.790	50	5		FFBARN
Cn1ccnc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000009377752	207269287	/nfs/dbraw/zinc/26/92/87/207269287.db2.gz	PNDZIWVYHVNPPW-MRXNPFEDSA-N	0	0	354.341	2.987	50	5		FFBARN
O=[N+]([O-])c1ncccc1OCc1nnc(-c2ccc(Br)o2)o1	ZINC000009368881	207269867	/nfs/dbraw/zinc/26/98/67/207269867.db2.gz	DQWACAJMMCCAJN-UHFFFAOYSA-N	0	0	367.115	2.974	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccccc1N1CCCC1=O	ZINC000009687623	207281325	/nfs/dbraw/zinc/28/13/25/207281325.db2.gz	JULSECNVGWLQBZ-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
CC(=O)N1CCc2cc(N[C@@H](C)C(=O)Nc3ccc([N+](=O)[O-])cc3)ccc21	ZINC000012564891	207394362	/nfs/dbraw/zinc/39/43/62/207394362.db2.gz	LVXVFMVCNPPXAH-LBPRGKRZSA-N	0	0	368.393	2.943	50	5		FFBARN
Cc1ccc2[nH]cc(CCNS(=O)(=O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000013957957	207491066	/nfs/dbraw/zinc/49/10/66/207491066.db2.gz	OGPFSMYEOBKQSO-UHFFFAOYSA-N	0	0	359.407	2.906	50	5		FFBARN
CC(C)NC(=O)NC(=O)CNc1cc([N+](=O)[O-])ccc1Nc1ccccc1	ZINC000015333100	207551812	/nfs/dbraw/zinc/55/18/12/207551812.db2.gz	SOVAKXLYLVBVGD-UHFFFAOYSA-N	0	0	371.397	2.985	50	5		FFBARN
COc1ccc([C@H]2OC(c3cccc([N+](=O)[O-])c3)=NN2C(C)=O)cc1OC	ZINC000021091792	207761745	/nfs/dbraw/zinc/76/17/45/207761745.db2.gz	VWNROBOBYWLCIY-GOSISDBHSA-N	0	0	371.349	2.851	50	5		FFBARN
CCOc1ccc(OCC)c(NC(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c1	ZINC000024833498	207877021	/nfs/dbraw/zinc/87/70/21/207877021.db2.gz	RPUBONQRYJXQBR-UHFFFAOYSA-N	0	0	362.386	2.844	50	5		FFBARN
Cc1cc(NC(=O)C2CCN(C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)no1	ZINC000024239094	207865402	/nfs/dbraw/zinc/86/54/02/207865402.db2.gz	COIXFGMUSLPOPK-UHFFFAOYSA-N	0	0	373.369	2.774	50	5		FFBARN
O=C(Nc1ccc(CN2C(=O)CCC2=O)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000032779517	208043507	/nfs/dbraw/zinc/04/35/07/208043507.db2.gz	YOHURGHJWPEPEG-UHFFFAOYSA-N	0	0	368.349	2.888	50	5		FFBARN
CN(C)[C@@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccs1	ZINC000033012141	208065145	/nfs/dbraw/zinc/06/51/45/208065145.db2.gz	SMOAPABBSQMGMS-AWEZNQCLSA-N	0	0	369.468	2.775	50	5		FFBARN
CCc1onc(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000033087000	208071263	/nfs/dbraw/zinc/07/12/63/208071263.db2.gz	INNKLMPUOGPVFN-AWEZNQCLSA-N	0	0	365.411	2.979	50	5		FFBARN
CN(C)[C@@H](c1nnnn1-c1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1	ZINC000036062157	208144229	/nfs/dbraw/zinc/14/42/29/208144229.db2.gz	OAISGSZIIBEPRP-OAHLLOKOSA-N	0	0	358.789	2.875	50	5		FFBARN
CC(C)CN(CC(=O)Nc1nccs1)C(=O)c1cccc([N+](=O)[O-])c1	ZINC000040368184	208249791	/nfs/dbraw/zinc/24/97/91/208249791.db2.gz	GQYIQBLCHHLDOR-UHFFFAOYSA-N	0	0	362.411	2.788	50	5		FFBARN
O=C(c1cccc(CNc2ccc([N+](=O)[O-])cc2F)c1)N1CCOCC1	ZINC000058208846	208567707	/nfs/dbraw/zinc/56/77/07/208567707.db2.gz	FEXJLQSQKPKATN-UHFFFAOYSA-N	0	0	359.357	2.818	50	5		FFBARN
C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1	ZINC000063198625	208605856	/nfs/dbraw/zinc/60/58/56/208605856.db2.gz	UHSCZITXVCPKMP-CXAGYDPISA-N	0	0	362.407	2.746	50	5		FFBARN
Cc1nc2cc(NS(=O)(=O)Cc3ccccc3[N+](=O)[O-])ccc2n1C	ZINC000095995772	209093959	/nfs/dbraw/zinc/09/39/59/209093959.db2.gz	WMCKJUDQKMLINU-UHFFFAOYSA-N	0	0	360.395	2.732	50	5		FFBARN
Cc1cc(C2CCN([C@H](C)C(=O)Nc3cccc([N+](=O)[O-])c3)CC2)n[nH]1	ZINC000095459843	209054143	/nfs/dbraw/zinc/05/41/43/209054143.db2.gz	HJEJCYSCVWETPC-CYBMUJFWSA-N	0	0	357.414	2.833	50	5		FFBARN
Cc1ccc(CNC(=O)c2ccc(N3CCOCC3)c([N+](=O)[O-])c2)cc1	ZINC000004660528	132387033	/nfs/dbraw/zinc/38/70/33/132387033.db2.gz	FGALVMZNIYXVLR-UHFFFAOYSA-N	0	0	355.394	2.670	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(c2ccccc2C)CC1	ZINC000005701882	132829834	/nfs/dbraw/zinc/82/98/34/132829834.db2.gz	TUVPCCCXLWFFPT-UHFFFAOYSA-N	0	0	354.410	2.907	50	5		FFBARN
Cc1c(NC(=O)CCN2C(=O)COc3ccccc32)cccc1[N+](=O)[O-]	ZINC000008137067	132842989	/nfs/dbraw/zinc/84/29/89/132842989.db2.gz	DUVAJTNEZORUPB-UHFFFAOYSA-N	0	0	355.350	2.657	50	5		FFBARN
Cc1ccc2nc(C(=O)N3CCN(c4ccc([N+](=O)[O-])cc4)CC3)cn2c1	ZINC000012323640	132856109	/nfs/dbraw/zinc/85/61/09/132856109.db2.gz	UDVWVCSCNBSUMV-UHFFFAOYSA-N	0	0	365.393	2.513	50	5		FFBARN
Cc1cccc(C)c1NC(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000055345836	136126513	/nfs/dbraw/zinc/12/65/13/136126513.db2.gz	HNTREHRVXGKHJA-UHFFFAOYSA-N	0	0	368.437	2.972	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000000674548	506227568	/nfs/dbraw/zinc/22/75/68/506227568.db2.gz	OGKXZOFFFHQKHD-UHFFFAOYSA-N	0	0	358.379	2.680	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2c(CCN3C(=O)c4ccccc4C3=O)c[nH]c21	ZINC000000754071	506229663	/nfs/dbraw/zinc/22/96/63/506229663.db2.gz	YXNBRHLMSDMDDH-UHFFFAOYSA-N	0	0	365.345	2.923	50	5		FFBARN
O=C(COC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=O)c1ccccc1	ZINC000000807595	506233871	/nfs/dbraw/zinc/23/38/71/506233871.db2.gz	WRBPFVOCULDECR-UHFFFAOYSA-N	0	0	353.286	2.741	50	5		FFBARN
C[C@H](C(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	ZINC000000947369	506240975	/nfs/dbraw/zinc/24/09/75/506240975.db2.gz	YHOVPIUQSVDYHH-SECBINFHSA-N	0	0	373.752	2.871	50	5		FFBARN
CC(=O)Nc1cc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3)ccc2oc1=O	ZINC000001040703	506246394	/nfs/dbraw/zinc/24/63/94/506246394.db2.gz	JKPDDFFURJQHOM-UHFFFAOYSA-N	0	0	367.317	2.912	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1ccc(Br)cc1	ZINC000002634298	506285570	/nfs/dbraw/zinc/28/55/70/506285570.db2.gz	JHRNASCRBXAZSH-UHFFFAOYSA-N	0	0	352.144	2.770	50	5		FFBARN
Cc1nn(CCNC(=O)c2ccc([N+](=O)[O-])cc2)c(C)c1Br	ZINC000002796298	506293647	/nfs/dbraw/zinc/29/36/47/506293647.db2.gz	MRFLHXHJHUUXLO-UHFFFAOYSA-N	0	0	367.203	2.601	50	5		FFBARN
CCOC(=O)[C@@H](C)On1c2cc([N+](=O)[O-])ccc2nc1-c1ccccc1	ZINC000003063713	506309700	/nfs/dbraw/zinc/30/97/00/506309700.db2.gz	MYAXZVGAFGATAW-GFCCVEGCSA-N	0	0	355.350	2.992	50	5		FFBARN
CC(=O)c1ccc(NC(=O)[C@H](C)OC(=O)c2ccccc2[N+](=O)[O-])cc1	ZINC000003255989	506317519	/nfs/dbraw/zinc/31/75/19/506317519.db2.gz	VRVOZLYRINJWML-LBPRGKRZSA-N	0	0	356.334	2.981	50	5		FFBARN
O=C(/C=C/c1ccccc1[N+](=O)[O-])OCC(=O)N1CCc2ccccc21	ZINC000003275250	506318508	/nfs/dbraw/zinc/31/85/08/506318508.db2.gz	MPRZPTQWFGTDFU-MDZDMXLPSA-N	0	0	352.346	2.741	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccc(F)cc1	ZINC000003510034	506337656	/nfs/dbraw/zinc/33/76/56/506337656.db2.gz	UHPFMIOPFVEGKC-SNVBAGLBSA-N	0	0	362.313	2.927	50	5		FFBARN
CC(=O)Nc1cccc(C(=O)O[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000003519212	506339224	/nfs/dbraw/zinc/33/92/24/506339224.db2.gz	MVORXEHTAWONCD-NSHDSACASA-N	0	0	371.349	2.737	50	5		FFBARN
Cc1cc2ccccc2n1CCNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000004060469	506356188	/nfs/dbraw/zinc/35/61/88/506356188.db2.gz	PNIBXAHBFMNKQP-UHFFFAOYSA-N	0	0	359.407	2.836	50	5		FFBARN
O=C(Nc1ccc2c(c1)C(=O)NC2=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000004263875	506368066	/nfs/dbraw/zinc/36/80/66/506368066.db2.gz	IRLRLZFMSVQYDR-UHFFFAOYSA-N	0	0	367.342	2.945	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC(=O)N(c2cccc(F)c2)C1	ZINC000004497367	506379641	/nfs/dbraw/zinc/37/96/41/506379641.db2.gz	ZALQCFGNPVLOQL-WUKHSURWSA-N	0	0	369.352	2.669	50	5		FFBARN
COc1ccc(NC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1	ZINC000004983865	506411291	/nfs/dbraw/zinc/41/12/91/506411291.db2.gz	MRVQMVWSSALAHP-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
COC(=O)c1ccc(OCC(=O)N2CCCCCCC2)c([N+](=O)[O-])c1	ZINC000007086850	506532207	/nfs/dbraw/zinc/53/22/07/506532207.db2.gz	OMWOBNYSPVCKHP-UHFFFAOYSA-N	0	0	350.371	2.553	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ncccn3)CC2)cc1C(F)(F)F	ZINC000009470465	506697503	/nfs/dbraw/zinc/69/75/03/506697503.db2.gz	YBTFTGIMRJBAIW-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
CC(=O)Nc1cccc2c1CCN(C(=O)NCc1ccc([N+](=O)[O-])cc1)C2	ZINC000056458965	507018535	/nfs/dbraw/zinc/01/85/35/507018535.db2.gz	UENWMKZQBXTGIJ-UHFFFAOYSA-N	0	0	368.393	2.821	50	5		FFBARN
COc1ccc(CNC(=O)[C@@H](C)Oc2ccc([N+](=O)[O-])cc2)cc1OC	ZINC000015330788	507032702	/nfs/dbraw/zinc/03/27/02/507032702.db2.gz	QFWGAEPABZVWRU-GFCCVEGCSA-N	0	0	360.366	2.696	50	5		FFBARN
CC(C)(C)OC(=O)COC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000016247129	507079533	/nfs/dbraw/zinc/07/95/33/507079533.db2.gz	OLJWXKSGHIAQGT-UHFFFAOYSA-N	0	0	350.371	2.694	50	5		FFBARN
COC(=O)[C@H](Cc1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000016596046	507098935	/nfs/dbraw/zinc/09/89/35/507098935.db2.gz	AYGOYWAIWYZKBX-HNNXBMFYSA-N	0	0	362.769	2.762	50	5		FFBARN
COc1ccccc1CN1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000019570441	507180544	/nfs/dbraw/zinc/18/05/44/507180544.db2.gz	DIFVTZDHJJYHQI-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
C[C@H](Sc1nncn1Cc1ccco1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000022193494	507283357	/nfs/dbraw/zinc/28/33/57/507283357.db2.gz	RGNKMIGKUZTKFO-NSHDSACASA-N	0	0	373.394	2.947	50	5		FFBARN
C[C@@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2	ZINC000024227676	507399106	/nfs/dbraw/zinc/39/91/06/507399106.db2.gz	OVLZYDUNNNBTFM-GFCCVEGCSA-N	0	0	358.350	2.622	50	5		FFBARN
O=C(C1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1)N1CCCCCC1	ZINC000058304124	507403084	/nfs/dbraw/zinc/40/30/84/507403084.db2.gz	VWTOADNBDAPKKW-UHFFFAOYSA-N	0	0	371.441	2.862	50	5		FFBARN
Cc1nc(C(F)(F)F)ccc1C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000024562310	507419322	/nfs/dbraw/zinc/41/93/22/507419322.db2.gz	FASVLMYLLXMICX-ZDUSSCGKSA-N	0	0	369.299	2.780	50	5		FFBARN
C[C@H]1Cc2cc([N+](=O)[O-])ccc2N1Cn1nc(-c2cccs2)oc1=O	ZINC000024654878	507428025	/nfs/dbraw/zinc/42/80/25/507428025.db2.gz	JLFAFLKIMUAIPZ-JTQLQIEISA-N	0	0	358.379	2.882	50	5		FFBARN
C[C@H](C(=O)N(C)Cc1ccc([N+](=O)[O-])cc1)n1c(=O)oc2ccccc21	ZINC000170596098	509673805	/nfs/dbraw/zinc/67/38/05/509673805.db2.gz	LROQLGQPZNTIPY-GFCCVEGCSA-N	0	0	355.350	2.722	50	5		FFBARN
CC(C)CCNC(=O)C1CCN(Cn2ncc3ccc([N+](=O)[O-])cc32)CC1	ZINC000048253854	570940705	/nfs/dbraw/zinc/94/07/05/570940705.db2.gz	IRMHUHJADDQQKA-UHFFFAOYSA-N	0	0	373.457	2.776	50	5		FFBARN
COc1ccc(OC)c(NC(=O)/C=C\c2cc3c(cc2[N+](=O)[O-])OCO3)c1	ZINC000097997353	964230862	/nfs/dbraw/zinc/23/08/62/964230862.db2.gz	QIOZAEBTIKJCIZ-UTCJRWHESA-N	0	0	372.333	2.993	50	5		FFBARN
O=C(CSc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Nc1ccccn1	ZINC000001071900	219363863	/nfs/dbraw/zinc/36/38/63/219363863.db2.gz	WWUYWTAPPDQRGR-UHFFFAOYSA-N	0	0	357.351	2.771	50	5		FFBARN
O=C(Cn1cnnn1)Nc1cc([N+](=O)[O-])cc2oc(-c3ccccc3)cc21	ZINC000001089566	219368759	/nfs/dbraw/zinc/36/87/59/219368759.db2.gz	UEHIBTDOEZSAOB-UHFFFAOYSA-N	0	0	364.321	2.633	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)O[C@@]12CCOC(C)(C)C2	ZINC000001133612	219376641	/nfs/dbraw/zinc/37/66/41/219376641.db2.gz	HHSBXLGQZNIDHW-SCLBCKFNSA-N	0	0	362.382	2.733	50	5		FFBARN
COC(=O)c1cc(N[C@@H]2CCC(=O)N[C@H]2c2ccccc2)ccc1[N+](=O)[O-]	ZINC000225580842	209820500	/nfs/dbraw/zinc/82/05/00/209820500.db2.gz	LYDBQQOARJAVBH-QAPCUYQASA-N	0	0	369.377	2.813	50	5		FFBARN
COc1ccc(OC)c2c1s/c(=N\C(=O)c1ccccc1[N+](=O)[O-])n2C	ZINC000100909001	209485665	/nfs/dbraw/zinc/48/56/65/209485665.db2.gz	CUAKISPWXVOOLH-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
CCN(CC)S(=O)(=O)c1ccc(NCc2cccnc2)c([N+](=O)[O-])c1	ZINC000008147359	209468246	/nfs/dbraw/zinc/46/82/46/209468246.db2.gz	GETBQNDYJOHYES-UHFFFAOYSA-N	0	0	364.427	2.632	50	5		FFBARN
Cc1ccc(C(=O)N2NC(C3CC3)=C[C@@]2(O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000000651697	209375044	/nfs/dbraw/zinc/37/50/44/209375044.db2.gz	YPSVMXUOBUOBHI-CQSZACIVSA-N	0	0	357.288	2.766	50	5		FFBARN
COc1ccccc1NC(=O)c1cc(N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000009514451	219881876	/nfs/dbraw/zinc/88/18/76/219881876.db2.gz	LXXHPHPLQAWYSP-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
CNC(=O)/C(=C\C=C\c1ccccc1)NC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000100272204	209211362	/nfs/dbraw/zinc/21/13/62/209211362.db2.gz	ABADOHGDUGWOCM-BDKUJZOCSA-N	0	0	351.362	2.668	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(=O)n1CC(=O)Nc1cccc(C(F)(F)F)c1	ZINC000096552856	209154754	/nfs/dbraw/zinc/15/47/54/209154754.db2.gz	XAUWCYNQTSOLOL-UHFFFAOYSA-N	0	0	355.272	2.722	50	5		FFBARN
O=C(NC[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(OC(F)(F)F)cc1	ZINC000016488030	220185572	/nfs/dbraw/zinc/18/55/72/220185572.db2.gz	VTJQUVKJMFFHEZ-AWEZNQCLSA-N	0	0	370.283	2.957	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@H]1c1ccc(-c2cccc([N+](=O)[O-])c2)o1	ZINC000000833036	206837375	/nfs/dbraw/zinc/83/73/75/206837375.db2.gz	FYQDPZXRMZZOCL-HNNXBMFYSA-N	0	0	357.322	2.656	50	5		FFBARN
Cn1cnnc1SCc1cc(=O)c(OCc2cccc([N+](=O)[O-])c2)co1	ZINC000010220380	206876536	/nfs/dbraw/zinc/87/65/36/206876536.db2.gz	WXSNXZFASNDLMI-UHFFFAOYSA-N	0	0	374.378	2.548	50	5		FFBARN
Cc1cc2c(cc1C)N[C@H](CC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N2	ZINC000004189052	207006755	/nfs/dbraw/zinc/00/67/55/207006755.db2.gz	ZZYNTRUDMRKKLU-OAHLLOKOSA-N	0	0	354.366	2.973	50	5		FFBARN
CN1c2ccc(Cl)cc2[C@](O)(CC(=O)c2cccc([N+](=O)[O-])c2)C1=O	ZINC000004555357	207028210	/nfs/dbraw/zinc/02/82/10/207028210.db2.gz	SMDQRZLHQNTVLW-QGZVFWFLSA-N	0	0	360.753	2.685	50	5		FFBARN
COc1ccc(-n2c3ccccc3cc3c(=O)n(C)c(=O)nc2-3)cc1Cl	ZINC000004971735	207067346	/nfs/dbraw/zinc/06/73/46/207067346.db2.gz	SIXVXWPFSHVALZ-UHFFFAOYSA-N	0	0	367.792	2.851	50	5		FFBARN
CCOc1ccc(Nc2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])cc1	ZINC000005118910	207081952	/nfs/dbraw/zinc/08/19/52/207081952.db2.gz	ZXLLYTWXTRLCGH-CYBMUJFWSA-N	0	0	374.401	2.700	50	5		FFBARN
Cc1nc([N+](=O)[O-])c(Br)n1CC(=O)c1cccc([N+](=O)[O-])c1	ZINC000005642133	207110295	/nfs/dbraw/zinc/11/02/95/207110295.db2.gz	HJSADCRJJJNTCE-UHFFFAOYSA-N	0	0	369.131	2.653	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ncc(Cl)cc1Cl	ZINC000005559314	207106245	/nfs/dbraw/zinc/10/62/45/207106245.db2.gz	FYFKITKMIROERM-UHFFFAOYSA-N	0	0	360.109	2.685	50	5		FFBARN
Cc1ccc(NC(=O)COC(=O)c2n[nH]c3ccccc32)c([N+](=O)[O-])c1	ZINC000006516820	207144299	/nfs/dbraw/zinc/14/42/99/207144299.db2.gz	XJICGRXXOOLUQV-UHFFFAOYSA-N	0	0	354.322	2.575	50	5		FFBARN
O=[N+]([O-])c1cccc(C2=NNC(=NCc3ccc4c(c3)OCO4)SC2)c1	ZINC000006529039	207145530	/nfs/dbraw/zinc/14/55/30/207145530.db2.gz	KQLGPHLIABGMCD-UHFFFAOYSA-N	0	0	370.390	2.920	50	5		FFBARN
Cc1cc(NC(=O)COC(=O)c2ccccc2[N+](=O)[O-])c([N+](=O)[O-])cc1C	ZINC000006566424	207146177	/nfs/dbraw/zinc/14/61/77/207146177.db2.gz	XURADYZSTIOXGG-UHFFFAOYSA-N	0	0	373.321	2.915	50	5		FFBARN
Cc1cccn2c(=O)cc(COC(=O)c3cccc([N+](=O)[O-])c3C)nc12	ZINC000007155812	207188742	/nfs/dbraw/zinc/18/87/42/207188742.db2.gz	FRBIKXZLCYFOQB-UHFFFAOYSA-N	0	0	353.334	2.577	50	5		FFBARN
C/C=C/C=C/C(=O)OCC(=O)Nc1ccc([N+](=O)[O-])cc1Br	ZINC000007159391	207188839	/nfs/dbraw/zinc/18/88/39/207188839.db2.gz	RULGZPAOKWZVOZ-MQQKCMAXSA-N	0	0	369.171	2.971	50	5		FFBARN
COc1ccc(S(=O)(=O)Nc2ccc3oc(C)nc3c2)cc1[N+](=O)[O-]	ZINC000008110001	207219828	/nfs/dbraw/zinc/21/98/28/207219828.db2.gz	IISDVUGHKZAIHT-UHFFFAOYSA-N	0	0	363.351	2.854	50	5		FFBARN
CCN(CC)C(=O)[C@@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1	ZINC000007920699	207212182	/nfs/dbraw/zinc/21/21/82/207212182.db2.gz	HSJOTVQVCWWXMD-KRWDZBQOSA-N	0	0	371.393	2.944	50	5		FFBARN
CCc1cccc(OCC(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])c1	ZINC000008273192	207226235	/nfs/dbraw/zinc/22/62/35/207226235.db2.gz	LKVMDIGFZSRNNK-UHFFFAOYSA-N	0	0	358.350	2.718	50	5		FFBARN
O=c1c(-c2ccccc2)nnc2sc(-c3ccc([N+](=O)[O-])cc3)nn21	ZINC000008393689	207231919	/nfs/dbraw/zinc/23/19/19/207231919.db2.gz	AXXPDAJJBPETJI-UHFFFAOYSA-N	0	0	351.347	2.788	50	5		FFBARN
COc1ccc(OC)c(NC(=O)c2cc3c(cc2[N+](=O)[O-])OCCO3)c1	ZINC000008748786	207246673	/nfs/dbraw/zinc/24/66/73/207246673.db2.gz	ICXKQILQCXHPHR-UHFFFAOYSA-N	0	0	360.322	2.636	50	5		FFBARN
Cn1ccnc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(F)c1	ZINC000009115207	207258398	/nfs/dbraw/zinc/25/83/98/207258398.db2.gz	XCUVNCZXFBHQPE-MRXNPFEDSA-N	0	0	354.341	2.987	50	5		FFBARN
Cn1ccnc1[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F	ZINC000009364370	207268750	/nfs/dbraw/zinc/26/87/50/207268750.db2.gz	FQDLXRATLNOAHO-INIZCTEOSA-N	0	0	354.341	2.987	50	5		FFBARN
Cc1cc(C)nc(-n2nc3[nH]ccc(-c4cccc([N+](=O)[O-])c4)c-3c2=O)n1	ZINC000009483060	207274093	/nfs/dbraw/zinc/27/40/93/207274093.db2.gz	SGRQMXFVFLXBOX-UHFFFAOYSA-N	0	0	362.349	2.696	50	5		FFBARN
O=C(c1ccccc1F)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000036393213	207280640	/nfs/dbraw/zinc/28/06/40/207280640.db2.gz	YGRXSFRXAJQYAP-UHFFFAOYSA-N	0	0	373.384	2.571	50	5		FFBARN
CCN(c1ccc(NC(=O)Cn2cc([N+](=O)[O-])ccc2=O)cc1)C(C)C	ZINC000010246945	207297520	/nfs/dbraw/zinc/29/75/20/207297520.db2.gz	CMCTXIJDZKQNQJ-UHFFFAOYSA-N	0	0	358.398	2.630	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)COc2cc(F)ccc2[N+](=O)[O-])c1C	ZINC000009951820	207290914	/nfs/dbraw/zinc/29/09/14/207290914.db2.gz	HNHPDIRVYJIWBB-UHFFFAOYSA-N	0	0	350.302	2.727	50	5		FFBARN
CC(C)(C)c1ccc(C(=O)NCC(=O)NCc2ccco2)cc1[N+](=O)[O-]	ZINC000010031850	207293260	/nfs/dbraw/zinc/29/32/60/207293260.db2.gz	DIVWTXNCKFAABJ-UHFFFAOYSA-N	0	0	359.382	2.532	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000011229270	207310989	/nfs/dbraw/zinc/31/09/89/207310989.db2.gz	QIEIWWTZKAINAR-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
O=C(N/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)N1CCCCC1)c1ccco1	ZINC000015936907	207574871	/nfs/dbraw/zinc/57/48/71/207574871.db2.gz	MWGHFWSOUHCKHD-SSZFMOIBSA-N	0	0	369.377	2.971	50	5		FFBARN
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)Nc1cccc([N+](=O)[O-])c1	ZINC000032779503	208043572	/nfs/dbraw/zinc/04/35/72/208043572.db2.gz	YRDKLPOUZURCQE-SFHVURJKSA-N	0	0	370.409	2.790	50	5		FFBARN
CCc1onc(C)c1[C@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000033087007	208070689	/nfs/dbraw/zinc/07/06/89/208070689.db2.gz	SFTUPLCYUMFZCD-CQSZACIVSA-N	0	0	365.411	2.979	50	5		FFBARN
O=C(NCc1ccccc1F)c1cccc([N+](=O)[O-])c1N1CCOCC1	ZINC000095988662	132216453	/nfs/dbraw/zinc/21/64/53/132216453.db2.gz	RKCFYQHHIXCFRV-UHFFFAOYSA-N	0	0	359.357	2.501	50	5		FFBARN
CC(=O)c1ccc(N2CCN(Cc3c(C)noc3C)CC2)c([N+](=O)[O-])c1	ZINC000097054114	132227345	/nfs/dbraw/zinc/22/73/45/132227345.db2.gz	RYGIBZYFKXRKNP-UHFFFAOYSA-N	0	0	358.398	2.724	50	5		FFBARN
CCCN1CCN(C(=O)c2ccc(N3CCC[C@@H](C)C3)c([N+](=O)[O-])c2)CC1	ZINC000008341491	132259892	/nfs/dbraw/zinc/25/98/92/132259892.db2.gz	AVTHIVMCXVRDHM-MRXNPFEDSA-N	0	0	374.485	2.999	50	5		FFBARN
Cc1cccc(Nc2nc(N3C[C@@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])c1	ZINC000018037184	132885517	/nfs/dbraw/zinc/88/55/17/132885517.db2.gz	QBAOLCNCQYYCFT-TXEJJXNPSA-N	0	0	358.402	2.633	50	5		FFBARN
O=C(c1cc2ccccc2o1)N1CCN(c2ncccc2[N+](=O)[O-])CC1	ZINC000025580542	132914059	/nfs/dbraw/zinc/91/40/59/132914059.db2.gz	ZOCLSAQYSUNVPY-UHFFFAOYSA-N	0	0	352.350	2.698	50	5		FFBARN
O=[N+]([O-])c1cc(F)ccc1N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000057877336	136130382	/nfs/dbraw/zinc/13/03/82/136130382.db2.gz	ILPWPWMBYGEECB-UHFFFAOYSA-N	0	0	373.384	2.827	50	5		FFBARN
Cc1cc(C(=O)NC2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)no1	ZINC000058161757	136130443	/nfs/dbraw/zinc/13/04/43/136130443.db2.gz	ATQZAZULDZHAOM-UHFFFAOYSA-N	0	0	364.789	2.943	50	5		FFBARN
COc1ccc(OC)c(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)c1	ZINC000000652085	506226795	/nfs/dbraw/zinc/22/67/95/506226795.db2.gz	QLVFCBTWSCJGGX-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
COc1ccc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)cc1OC	ZINC000000865095	506236831	/nfs/dbraw/zinc/23/68/31/506236831.db2.gz	BJVGXVRPAWUVCR-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
COC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000001195000	506253679	/nfs/dbraw/zinc/25/36/79/506253679.db2.gz	PKSSXEOECMCCCI-OAHLLOKOSA-N	0	0	357.322	2.656	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000001212401	506257272	/nfs/dbraw/zinc/25/72/72/506257272.db2.gz	KTEOIVMFGWSIHU-IUODEOHRSA-N	0	0	371.315	2.777	50	5		FFBARN
Cn1c(=O)nc2n(-c3ccccc3F)c3cccc(Cl)c3cc-2c1=O	ZINC000002250089	506275663	/nfs/dbraw/zinc/27/56/63/506275663.db2.gz	NUTIVPNSRQRFAE-UHFFFAOYSA-N	0	0	355.756	2.982	50	5		FFBARN
CCOc1ccc2nc(NC(=O)c3nn(C)c(C)c3[N+](=O)[O-])sc2c1	ZINC000002761708	506289306	/nfs/dbraw/zinc/28/93/06/506289306.db2.gz	YEFPLTMDIGOEQA-UHFFFAOYSA-N	0	0	361.383	2.897	50	5		FFBARN
C[C@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc(Br)cc1F	ZINC000002794307	506293526	/nfs/dbraw/zinc/29/35/26/506293526.db2.gz	QUIYLDJCMVWFHM-MRVPVSSYSA-N	0	0	371.166	2.968	50	5		FFBARN
O=C(COC(=O)Cc1ccccc1[N+](=O)[O-])N[C@H]1CCCc2ccccc21	ZINC000003248466	506314692	/nfs/dbraw/zinc/31/46/92/506314692.db2.gz	CQLWEFOOTNUQQG-KRWDZBQOSA-N	0	0	368.389	2.874	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)Nc2ccc(C)c(F)c2)cc1[N+](=O)[O-]	ZINC000003441948	506331052	/nfs/dbraw/zinc/33/10/52/506331052.db2.gz	VWLGDGKHFGWIKH-UHFFFAOYSA-N	0	0	362.313	2.846	50	5		FFBARN
Cc1cc(OC(=O)c2cccc(Br)c2)c([N+](=O)[O-])c(=O)[nH]1	ZINC000004248364	506366228	/nfs/dbraw/zinc/36/62/28/506366228.db2.gz	GBOZLSVXNDYEDC-UHFFFAOYSA-N	0	0	353.128	2.573	50	5		FFBARN
Cc1ccccc1-c1nnc2s/c(=C/c3ccc([N+](=O)[O-])cc3)c(=O)n21	ZINC000005072286	506420286	/nfs/dbraw/zinc/42/02/86/506420286.db2.gz	ITBAIPQIIFPTRC-XNTDXEJSSA-N	0	0	364.386	2.582	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)[C@@H](C)OC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000005966143	506463849	/nfs/dbraw/zinc/46/38/49/506463849.db2.gz	BVUHETXGAQILNL-LLVKDONJSA-N	0	0	371.349	2.737	50	5		FFBARN
Cc1nnc([C@H](C)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)o1	ZINC000040152888	506476562	/nfs/dbraw/zinc/47/65/62/506476562.db2.gz	VIAXIKRWBUEDEC-JTQLQIEISA-N	0	0	351.794	2.823	50	5		FFBARN
CC(=O)Nc1cccc2c1CCN(CC(=O)Nc1ccccc1[N+](=O)[O-])C2	ZINC000054389897	506549199	/nfs/dbraw/zinc/54/91/99/506549199.db2.gz	WVNZWGSDBMQUPJ-UHFFFAOYSA-N	0	0	368.393	2.550	50	5		FFBARN
O=C(CCCS(=O)(=O)c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1	ZINC000010218967	506732649	/nfs/dbraw/zinc/73/26/49/506732649.db2.gz	RDFDIHOFASFIKM-UHFFFAOYSA-N	0	0	366.370	2.927	50	5		FFBARN
O=C(NCCc1c[nH]c2ccccc12)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000010326854	506738102	/nfs/dbraw/zinc/73/81/02/506738102.db2.gz	JKVBPUHKGJESMQ-UHFFFAOYSA-N	0	0	370.340	2.513	50	5		FFBARN
Cc1ccc(CNC(=O)c2ccc(N3CCN(C)CC3)c([N+](=O)[O-])c2)cc1	ZINC000012517348	506869926	/nfs/dbraw/zinc/86/99/26/506869926.db2.gz	VHFASSGZOQQOSL-UHFFFAOYSA-N	0	0	368.437	2.585	50	5		FFBARN
CCCCCOc1ccc(/C=C/c2c([N+](=O)[O-])c(=O)n(C)c(=O)n2C)cc1	ZINC000012731109	506891325	/nfs/dbraw/zinc/89/13/25/506891325.db2.gz	ZHONKXNEXKRGRA-FMIVXFBMSA-N	0	0	373.409	2.732	50	5		FFBARN
COc1cc(C(=O)Nc2ccc(N3CCCC3)nc2)c([N+](=O)[O-])cc1OC	ZINC000012766853	506898623	/nfs/dbraw/zinc/89/86/23/506898623.db2.gz	SOGHFYMQTOUBHR-UHFFFAOYSA-N	0	0	372.381	2.860	50	5		FFBARN
CCCN(CCC)S(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000012775940	506899973	/nfs/dbraw/zinc/89/99/73/506899973.db2.gz	OWOGAYAVZDASMU-UHFFFAOYSA-N	0	0	358.416	2.567	50	5		FFBARN
Cc1cc(C(=O)Nc2ccc(CN3C(=O)CCC3=O)cc2)ccc1[N+](=O)[O-]	ZINC000012852933	506909960	/nfs/dbraw/zinc/90/99/60/506909960.db2.gz	AUKPPBUZXQSNLJ-UHFFFAOYSA-N	0	0	367.361	2.805	50	5		FFBARN
COc1ccc(C(=O)NCc2ccc(N3CCCC3)nc2)cc1[N+](=O)[O-]	ZINC000012928247	506915812	/nfs/dbraw/zinc/91/58/12/506915812.db2.gz	RGFVANUWHBVYIB-UHFFFAOYSA-N	0	0	356.382	2.529	50	5		FFBARN
CCC(=O)Nc1ccc2nc3c(nc2c1)[nH]c(=O)n(C1CCCCC1)c3=O	ZINC000018039588	507133320	/nfs/dbraw/zinc/13/33/20/507133320.db2.gz	ZEUQUAXIKVZURF-UHFFFAOYSA-N	0	0	367.409	2.899	50	5		FFBARN
Cc1cccc2oc(=O)n(C3CCN(C(=O)c4ccc([N+](=O)[O-])o4)CC3)c21	ZINC000022624238	507301843	/nfs/dbraw/zinc/30/18/43/507301843.db2.gz	GYFQJUUEBXQNDJ-UHFFFAOYSA-N	0	0	371.349	2.881	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2csc(CCC(C)C)n2)c1	ZINC000058171036	507378185	/nfs/dbraw/zinc/37/81/85/507378185.db2.gz	AVEPQDVYPKUARO-UHFFFAOYSA-N	0	0	365.411	2.637	50	5		FFBARN
COc1ccc(OC)c2c1CN(C(=O)Nc1cccc([N+](=O)[O-])c1)C[C@@H]2O	ZINC000024238120	507400194	/nfs/dbraw/zinc/40/01/94/507400194.db2.gz	PAWQPWOLVNAACF-AWEZNQCLSA-N	0	0	373.365	2.693	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)NCC1(c2ccccc2)CCCCC1	ZINC000058342515	507406678	/nfs/dbraw/zinc/40/66/78/507406678.db2.gz	IRUQYXUEGKWBHW-UHFFFAOYSA-N	0	0	369.421	2.775	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2cccc(-c3nnco3)c2)cc([N+](=O)[O-])c1	ZINC000024743783	507434013	/nfs/dbraw/zinc/43/40/13/507434013.db2.gz	PNESOIFQXLJVMI-UHFFFAOYSA-N	0	0	368.305	2.684	50	5		FFBARN
CC(=O)Nc1cc(NC(C)=O)cc(C(=O)OCc2ccccc2[N+](=O)[O-])c1	ZINC000025115204	507467228	/nfs/dbraw/zinc/46/72/28/507467228.db2.gz	WSRJXFMCMKEEDO-UHFFFAOYSA-N	0	0	371.349	2.869	50	5		FFBARN
O=[N+]([O-])c1ccnn1Cc1nc(-c2cc(Br)cs2)no1	ZINC000048705926	507553056	/nfs/dbraw/zinc/55/30/56/507553056.db2.gz	QNWYPINAJOPMCI-UHFFFAOYSA-N	0	0	356.161	2.714	50	5		FFBARN
COc1cccc(OC)c1C(=O)/N=c1\sc2cc([N+](=O)[O-])ccc2n1C	ZINC000100815954	508240479	/nfs/dbraw/zinc/24/04/79/508240479.db2.gz	PVNIHMIGUDAVLW-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1[C@H](O)C(F)(F)F	ZINC000084351130	508275179	/nfs/dbraw/zinc/27/51/79/508275179.db2.gz	ICVYXCARHZLITJ-QWRGUYRKSA-N	0	0	352.696	2.776	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000084403367	508277540	/nfs/dbraw/zinc/27/75/40/508277540.db2.gz	PVHUJELLJLJGLN-INIZCTEOSA-N	0	0	360.366	2.566	50	5	world	FFBARN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)C[C@@H]1NC(=O)OC(C)(C)C	ZINC000170614765	509681855	/nfs/dbraw/zinc/68/18/55/509681855.db2.gz	GYHCJHVMWUHBGW-ZJUUUORDSA-N	0	0	355.416	2.642	50	5		FFBARN
CCOC(=O)CCN(Cc1cccnc1)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000089983697	520676118	/nfs/dbraw/zinc/67/61/18/520676118.db2.gz	QRSJDAMNVZWGSE-UHFFFAOYSA-N	0	0	374.353	2.858	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2cc(OC)ccc2OC)cc([N+](=O)[O-])c1	ZINC000001097968	219368315	/nfs/dbraw/zinc/36/83/15/219368315.db2.gz	OKKQTNSXXUKZQW-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)O[C@]12CCOC(C)(C)C2	ZINC000001133609	219376562	/nfs/dbraw/zinc/37/65/62/219376562.db2.gz	HHSBXLGQZNIDHW-ACJLOTCBSA-N	0	0	362.382	2.733	50	5		FFBARN
CC(C)(C)n1nc2c(c1NC(=O)c1ccccc1[N+](=O)[O-])C[S@@](=O)C2	ZINC000002724989	209396902	/nfs/dbraw/zinc/39/69/02/209396902.db2.gz	YYEFHZGUHGEGIC-VWLOTQADSA-N	0	0	362.411	2.561	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H](c1cccs1)N(C)C	ZINC000046033748	209328426	/nfs/dbraw/zinc/32/84/26/209328426.db2.gz	GEXXMJORDPSQJA-ZDUSSCGKSA-N	0	0	369.468	2.546	50	5		FFBARN
O=[N+]([O-])c1ccc(NNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c([N+](=O)[O-])c1	ZINC000100035799	209207874	/nfs/dbraw/zinc/20/78/74/209207874.db2.gz	BZLCFQVZHWYEBU-UHFFFAOYSA-N	0	0	364.230	2.758	50	5		FFBARN
Cc1cc(Oc2cc(C(=O)NCc3cccnc3)nn2C)ccc1[N+](=O)[O-]	ZINC000096203782	209133243	/nfs/dbraw/zinc/13/32/43/209133243.db2.gz	BHQGJNPBODXUED-UHFFFAOYSA-N	0	0	367.365	2.754	50	5		FFBARN
O=C(CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O)c1ccc(Cl)s1	ZINC000003304117	206799788	/nfs/dbraw/zinc/79/97/88/206799788.db2.gz	LKTVFXDKVHCEST-UHFFFAOYSA-N	0	0	350.739	2.789	50	5		FFBARN
COc1nn(-c2nc(-c3ccco3)cc(C(F)(F)F)n2)cc1[N+](=O)[O-]	ZINC000002498228	206919234	/nfs/dbraw/zinc/91/92/34/206919234.db2.gz	UEMGRLNWFFNKCA-UHFFFAOYSA-N	0	0	355.232	2.858	50	5		FFBARN
COc1ccc(C(=O)N2CCc3cc(OC)c(OC)cc3C2)cc1[N+](=O)[O-]	ZINC000002351205	206910640	/nfs/dbraw/zinc/91/06/40/206910640.db2.gz	WZBTWKIMBAEUMM-UHFFFAOYSA-N	0	0	372.377	2.819	50	5		FFBARN
CC(C)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)C(=O)N1CCCC1	ZINC000003363605	206973002	/nfs/dbraw/zinc/97/30/02/206973002.db2.gz	KTYKXJJSGNCKGY-AWEZNQCLSA-N	0	0	353.806	2.625	50	5		FFBARN
Cc1cc2c(cc1C)N[C@@H](CC(=O)Nc1ccccc1[N+](=O)[O-])C(=O)N2	ZINC000004189051	207006046	/nfs/dbraw/zinc/00/60/46/207006046.db2.gz	ZZYNTRUDMRKKLU-HNNXBMFYSA-N	0	0	354.366	2.973	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ccc(Cl)cn1	ZINC000004744829	207045146	/nfs/dbraw/zinc/04/51/46/207045146.db2.gz	YAFAKYAQJZMNKN-UHFFFAOYSA-N	0	0	374.582	2.549	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)OCC(=O)N1CCc2ccccc2C1	ZINC000004870781	207056591	/nfs/dbraw/zinc/05/65/91/207056591.db2.gz	DEVFHOLIBHSKAY-CMDGGOBGSA-N	0	0	366.373	2.736	50	5		FFBARN
COc1ccc(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cc1OC	ZINC000004905643	207059924	/nfs/dbraw/zinc/05/99/24/207059924.db2.gz	OGZFJENZZWGWPM-UHFFFAOYSA-N	0	0	352.368	2.759	50	5		FFBARN
CN1CCc2c(sc3c2C(=O)N[C@@H](/C=C\c2cccc([N+](=O)[O-])c2)N3)C1	ZINC000004908500	207061093	/nfs/dbraw/zinc/06/10/93/207061093.db2.gz	QOCHASNCRCUSRF-IYKSTZQJSA-N	0	0	370.434	2.839	50	5		FFBARN
Cc1cccc(CCNc2c([N+](=O)[O-])nn(-c3cccc(C)c3)[n+]2[O-])c1	ZINC000004922494	207062140	/nfs/dbraw/zinc/06/21/40/207062140.db2.gz	QYRKOMPYOKXVDQ-UHFFFAOYSA-N	0	0	353.382	2.685	50	5		FFBARN
Cc1ccc(NC(=O)COC(=O)[C@@]2(C)CC2(Cl)Cl)c([N+](=O)[O-])c1	ZINC000005031858	207074316	/nfs/dbraw/zinc/07/43/16/207074316.db2.gz	PCEOBFVMNKGCIX-CYBMUJFWSA-N	0	0	361.181	2.969	50	5		FFBARN
COc1cc2c(cc1OC)CN(CC(=O)Nc1cccc([N+](=O)[O-])c1)CC2	ZINC000005346188	207095008	/nfs/dbraw/zinc/09/50/08/207095008.db2.gz	LDMFRYFOMDOKAM-UHFFFAOYSA-N	0	0	371.393	2.609	50	5		FFBARN
CNc1ccc(C(=O)OCC(=O)NCCCc2ccccc2)cc1[N+](=O)[O-]	ZINC000005363798	207095626	/nfs/dbraw/zinc/09/56/26/207095626.db2.gz	ANZFUKKHVDUOOA-UHFFFAOYSA-N	0	0	371.393	2.542	50	5		FFBARN
O=[N+]([O-])/C=C1\CCCN1c1cc(O)c(N2CCC/C2=C\[N+](=O)[O-])cc1O	ZINC000005394727	207099035	/nfs/dbraw/zinc/09/90/35/207099035.db2.gz	QIQGKOLLASBSOU-WGDLNXRISA-N	0	0	362.342	2.534	50	5		FFBARN
O=C1N[C@]2(CCCc3sccc32)C(=O)N1Cc1ccccc1[N+](=O)[O-]	ZINC000005679375	207112205	/nfs/dbraw/zinc/11/22/05/207112205.db2.gz	QNHOEXRMIFUFGK-KRWDZBQOSA-N	0	0	357.391	2.940	50	5		FFBARN
C[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)c(Cl)c1	ZINC000006119770	207131047	/nfs/dbraw/zinc/13/10/47/207131047.db2.gz	ZBRFIFPAOBSBBE-VIFPVBQESA-N	0	0	370.192	2.941	50	5		FFBARN
C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)c1ccc(Cl)c(Cl)c1	ZINC000006119773	207130775	/nfs/dbraw/zinc/13/07/75/207130775.db2.gz	ZBRFIFPAOBSBBE-SECBINFHSA-N	0	0	370.192	2.941	50	5		FFBARN
NC(=O)c1ccc(SCC(=O)Nc2ccc(F)c(F)c2)c([N+](=O)[O-])c1	ZINC000005938073	207123251	/nfs/dbraw/zinc/12/32/51/207123251.db2.gz	PLHKAOPGLROYKZ-UHFFFAOYSA-N	0	0	367.333	2.703	50	5		FFBARN
CCN(CC(=O)Nc1c(F)cccc1F)C(=O)c1ccc([N+](=O)[O-])cc1	ZINC000006277875	207136215	/nfs/dbraw/zinc/13/62/15/207136215.db2.gz	SOXOBXYELHBCNH-UHFFFAOYSA-N	0	0	363.320	2.974	50	5		FFBARN
C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)CC(=O)Nc1cccc(F)c1	ZINC000006607326	207148941	/nfs/dbraw/zinc/14/89/41/207148941.db2.gz	AMZZRCVGOGLVNB-LBPRGKRZSA-N	0	0	374.372	2.631	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc2c(c1)OCCO2	ZINC000006528331	207144614	/nfs/dbraw/zinc/14/46/14/207144614.db2.gz	FAIAXBOHCCFEBE-UHFFFAOYSA-N	0	0	373.317	2.590	50	5		FFBARN
Cc1ccc(NC(=O)CN(C)CC(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-]	ZINC000006862258	207172444	/nfs/dbraw/zinc/17/24/44/207172444.db2.gz	HAMWQDKJPDFUTL-UHFFFAOYSA-N	0	0	374.372	2.551	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1cccc([N+](=O)[O-])c1	ZINC000007116090	207187579	/nfs/dbraw/zinc/18/75/79/207187579.db2.gz	KENHKOBTBRXPQP-LBPRGKRZSA-N	0	0	354.366	2.771	50	5		FFBARN
Cc1ccc(O[C@H](C(=O)N2CCOCC2)c2ccccc2)c([N+](=O)[O-])c1	ZINC000007181265	207189951	/nfs/dbraw/zinc/18/99/51/207189951.db2.gz	QGZIMLHSVWPOQZ-SFHVURJKSA-N	0	0	356.378	2.882	50	5		FFBARN
O=C(Cc1ccccc1[N+](=O)[O-])OCc1cc(=O)oc2cc(O)ccc12	ZINC000007780906	207207749	/nfs/dbraw/zinc/20/77/49/207207749.db2.gz	YFEKUDHUKPEXNH-UHFFFAOYSA-N	0	0	355.302	2.693	50	5		FFBARN
C[C@@H]1C[C@@H](C)CN(S(=O)(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1	ZINC000008055585	207217890	/nfs/dbraw/zinc/21/78/90/207217890.db2.gz	XCCZXZNJVFGKTM-ZIAGYGMSSA-N	0	0	367.471	2.862	50	5		FFBARN
O=C(NCc1ccc2c(c1)OCO2)c1cc([N+](=O)[O-])ccc1N1CCCC1	ZINC000007911653	207211335	/nfs/dbraw/zinc/21/13/35/207211335.db2.gz	IBMPZDVNNOKZIW-UHFFFAOYSA-N	0	0	369.377	2.854	50	5		FFBARN
COC[C@H](C)Nc1ccc(S(=O)(=O)N2CCCCCC2)cc1[N+](=O)[O-]	ZINC000012554228	207391268	/nfs/dbraw/zinc/39/12/68/207391268.db2.gz	FPDYGAZLTIMLDD-ZDUSSCGKSA-N	0	0	371.459	2.606	50	5		FFBARN
CN(C[C@H]1COc2ccccc2O1)C(=O)CCNc1ccccc1[N+](=O)[O-]	ZINC000012553005	207392071	/nfs/dbraw/zinc/39/20/71/207392071.db2.gz	AMYPGSFCIIQSPQ-AWEZNQCLSA-N	0	0	371.393	2.695	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NC[C@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000012567351	207393857	/nfs/dbraw/zinc/39/38/57/207393857.db2.gz	JZTLTBDIWIRNLD-OAHLLOKOSA-N	0	0	369.377	2.756	50	5		FFBARN
Cc1c(C(=O)O[C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1C	ZINC000013297792	207456238	/nfs/dbraw/zinc/45/62/38/207456238.db2.gz	PPRLBKFOXSOKEF-SNVBAGLBSA-N	0	0	357.326	2.605	50	5		FFBARN
CCOc1ccc(CN(C)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000022309791	207804648	/nfs/dbraw/zinc/80/46/48/207804648.db2.gz	NSJBFEHITWUTGM-UHFFFAOYSA-N	0	0	369.377	2.679	50	5		FFBARN
O=C(CN1CCO[C@@H](c2ccc(F)cc2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000029537940	207994380	/nfs/dbraw/zinc/99/43/80/207994380.db2.gz	RKIUHLJQCGPOCZ-QGZVFWFLSA-N	0	0	359.357	2.746	50	5		FFBARN
CCCc1nnc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)s1	ZINC000033245936	208076104	/nfs/dbraw/zinc/07/61/04/208076104.db2.gz	DESHPTLVVAKZQV-UHFFFAOYSA-N	0	0	358.383	2.837	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	ZINC000040073852	208223120	/nfs/dbraw/zinc/22/31/20/208223120.db2.gz	OFTDOLLULFXALW-JQWIXIFHSA-N	0	0	373.331	2.525	50	5		FFBARN
COc1ccc(C2(CNC(=O)c3ccc([N+](=O)[O-])o3)CCOCC2)cc1	ZINC000049513350	208419436	/nfs/dbraw/zinc/41/94/36/208419436.db2.gz	MKEANJBHOXDAJO-UHFFFAOYSA-N	0	0	360.366	2.675	50	5		FFBARN
C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])[C@@H]1CCCOC1	ZINC000095468375	209054919	/nfs/dbraw/zinc/05/49/19/209054919.db2.gz	BVGFCNDLPJIODT-NXEZZACHSA-N	0	0	364.370	2.818	50	5		FFBARN
O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCN(c2ccc(F)cc2)CC1	ZINC000002874862	132384313	/nfs/dbraw/zinc/38/43/13/132384313.db2.gz	NLLNFHRAAHLQQX-UHFFFAOYSA-N	0	0	374.328	2.605	50	5		FFBARN
CCOc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000003894029	132385850	/nfs/dbraw/zinc/38/58/50/132385850.db2.gz	YSILGSXMRAFGOO-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004305900	132386675	/nfs/dbraw/zinc/38/66/75/132386675.db2.gz	MOHGDLGFZCYOFA-RYUDHWBXSA-N	0	0	358.402	2.633	50	5		FFBARN
O=C(OCc1cccc(F)c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000005708568	132829820	/nfs/dbraw/zinc/82/98/20/132829820.db2.gz	AUFPFUSULKJTIB-UHFFFAOYSA-N	0	0	360.341	2.928	50	5		FFBARN
O=[N+]([O-])c1ccccc1N1CCN(Cc2nc(-c3ccco3)no2)CC1	ZINC000024831410	132912399	/nfs/dbraw/zinc/91/23/99/132912399.db2.gz	FDWIPXFKNCRKMJ-UHFFFAOYSA-N	0	0	355.354	2.560	50	5		FFBARN
O=[N+]([O-])c1cccc(N2CCN(CCOc3ccccc3[N+](=O)[O-])CC2)c1	ZINC000051855763	136124169	/nfs/dbraw/zinc/12/41/69/136124169.db2.gz	GKSDNAHMJSGPEU-UHFFFAOYSA-N	0	0	372.381	2.704	50	5		FFBARN
Cn1c2c(cn3c2c(-c2ccccc2)nc2ccccc23)c(=O)n(C)c1=O	ZINC000000804796	506233169	/nfs/dbraw/zinc/23/31/69/506233169.db2.gz	WHUMAZOVWRMIPK-UHFFFAOYSA-N	0	0	356.385	2.705	50	5		FFBARN
O=C(Cn1ccc([N+](=O)[O-])n1)Nc1nc(-c2c(F)cccc2F)cs1	ZINC000052778285	506248906	/nfs/dbraw/zinc/24/89/06/506248906.db2.gz	HEHZHLUMSUYGKW-UHFFFAOYSA-N	0	0	365.321	2.832	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)O[C@]12CCOC(C)(C)C2	ZINC000001133610	506250259	/nfs/dbraw/zinc/25/02/59/506250259.db2.gz	HHSBXLGQZNIDHW-UGSOOPFHSA-N	0	0	362.382	2.733	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)N[C@H](C)c1ccccc1	ZINC000001506577	506264142	/nfs/dbraw/zinc/26/41/42/506264142.db2.gz	HMJWKQGTDWANCX-SECBINFHSA-N	0	0	367.203	2.740	50	5		FFBARN
O=C(CC(=O)OCc1ccc([N+](=O)[O-])cc1)OCc1ccc([N+](=O)[O-])cc1	ZINC000001758174	506268642	/nfs/dbraw/zinc/26/86/42/506268642.db2.gz	RBVOYZBIDZCDBO-UHFFFAOYSA-N	0	0	374.305	2.680	50	5		FFBARN
O=C(Cn1cnc2c3ccccc3nnc2c1=O)c1ccc(Cl)cc1	ZINC000002585207	506283647	/nfs/dbraw/zinc/28/36/47/506283647.db2.gz	RVWJERCRAWDQLE-UHFFFAOYSA-N	0	0	350.765	2.876	50	5		FFBARN
O=C(COc1cccc(N2CCCC2=O)c1)Nc1ccc([N+](=O)[O-])cc1	ZINC000032765139	506291691	/nfs/dbraw/zinc/29/16/91/506291691.db2.gz	PXXIBKBSGUZSIM-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
CC(C)(C(=O)N1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1	ZINC000032770085	506293972	/nfs/dbraw/zinc/29/39/72/506293972.db2.gz	WYRVPDQSWXZKCZ-UHFFFAOYSA-N	0	0	354.410	2.616	50	5		FFBARN
Cn1nc([N+](=O)[O-])nc1Sc1nn(-c2ccccc2)c(=S)s1	ZINC000002812647	506297041	/nfs/dbraw/zinc/29/70/41/506297041.db2.gz	GTWAUJKYNVAJQD-UHFFFAOYSA-N	0	0	352.426	2.851	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)NCc1ccccc1OC(F)F	ZINC000032816486	506298584	/nfs/dbraw/zinc/29/85/84/506298584.db2.gz	MQFVMAYENXWAHD-UHFFFAOYSA-N	0	0	352.293	2.891	50	5		FFBARN
CCCCn1nnc(NC(=O)c2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1	ZINC000002865915	506298919	/nfs/dbraw/zinc/29/89/19/506298919.db2.gz	DXEUDVPRLPSOIN-UHFFFAOYSA-N	0	0	356.342	2.894	50	5		FFBARN
Cc1cc(C)c([N+](=O)[O-])cc1NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000003315965	506320066	/nfs/dbraw/zinc/32/00/66/506320066.db2.gz	UINRBNBKABDEFD-UHFFFAOYSA-N	0	0	368.437	2.972	50	5		FFBARN
COc1ccc(C(=O)NC[C@@H](C)N2CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000033055399	506328962	/nfs/dbraw/zinc/32/89/62/506328962.db2.gz	HSVKWHHSLFHOIM-CYBMUJFWSA-N	0	0	355.394	2.784	50	5		FFBARN
C[C@@H](NC(=O)COc1ncnc2cc([N+](=O)[O-])ccc21)c1ccccc1	ZINC000003445157	506332041	/nfs/dbraw/zinc/33/20/41/506332041.db2.gz	DHNNSMFJXPLJQL-GFCCVEGCSA-N	0	0	352.350	2.794	50	5		FFBARN
CC(C)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O	ZINC000004039509	506354370	/nfs/dbraw/zinc/35/43/70/506354370.db2.gz	IZSYVWIYRQVJAT-INIZCTEOSA-N	0	0	367.361	2.854	50	5		FFBARN
Cc1cccc(N2C(=S)N=NC2CNC(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000004059219	506357042	/nfs/dbraw/zinc/35/70/42/506357042.db2.gz	ZOTGFFMVUJCTON-UHFFFAOYSA-N	0	0	369.406	2.703	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N(c1ccccc1)[C@@H]1C=CS(=O)(=O)C1	ZINC000004159557	506363226	/nfs/dbraw/zinc/36/32/26/506363226.db2.gz	BFCKVHXWOYRZPY-MRXNPFEDSA-N	0	0	358.375	2.552	50	5		FFBARN
Cc1nn(C)c(C)c1[C@@H](C)NC(=O)Cn1ccc2cc([N+](=O)[O-])ccc21	ZINC000065901266	506389241	/nfs/dbraw/zinc/38/92/41/506389241.db2.gz	FERFMAYABZFBQA-LLVKDONJSA-N	0	0	355.398	2.777	50	5		FFBARN
O=C(CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccc2c(c1)CCN2	ZINC000036092330	506397223	/nfs/dbraw/zinc/39/72/23/506397223.db2.gz	YEBBTYSAEBBHFJ-UHFFFAOYSA-N	0	0	366.421	2.568	50	5		FFBARN
CN(CCc1ccccn1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000007716398	506584255	/nfs/dbraw/zinc/58/42/55/506584255.db2.gz	BWNRKSQXVYBLFD-UHFFFAOYSA-N	0	0	355.803	2.506	50	5		FFBARN
NC(=O)[C@H]1CCCN(c2ccc(C(=O)c3ccccc3)cc2[N+](=O)[O-])C1	ZINC000008053555	506617165	/nfs/dbraw/zinc/61/71/65/506617165.db2.gz	WROCKIVVNDNUMB-HNNXBMFYSA-N	0	0	353.378	2.528	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2=O)cc1	ZINC000008816495	506670996	/nfs/dbraw/zinc/67/09/96/506670996.db2.gz	KEWATXXRMVKPEP-ZDUSSCGKSA-N	0	0	369.377	2.903	50	5		FFBARN
NS(=O)(=O)c1cc([N+](=O)[O-])ccc1NCCCCOc1ccccc1	ZINC000009220960	506687629	/nfs/dbraw/zinc/68/76/29/506687629.db2.gz	JANUOIVHRJBGFB-UHFFFAOYSA-N	0	0	365.411	2.513	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccnn1C1CCCC1	ZINC000014231085	506979917	/nfs/dbraw/zinc/97/99/17/506979917.db2.gz	WCRAITNKHQEMMW-UHFFFAOYSA-N	0	0	371.397	2.665	50	5		FFBARN
CCOC(=O)[C@@H]1CCCN([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000015402202	507038439	/nfs/dbraw/zinc/03/84/39/507038439.db2.gz	XZLSFBUSSPXDLM-GXTWGEPZSA-N	0	0	374.397	2.981	50	5		FFBARN
C[C@@H]1CN(C(=S)SCC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000015935283	507067011	/nfs/dbraw/zinc/06/70/11/507067011.db2.gz	KHKFASHXUMOSLQ-PHIMTYICSA-N	0	0	354.453	2.905	50	5		FFBARN
O=[N+]([O-])c1ccccc1OS(=O)(=O)c1ccc2c(c1)OCCCO2	ZINC000016090202	507072166	/nfs/dbraw/zinc/07/21/66/507072166.db2.gz	VKWHPDNLBURWQJ-UHFFFAOYSA-N	0	0	351.336	2.524	50	5		FFBARN
Cn1ccnc1[C@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1ccccc1F	ZINC000018236575	507145914	/nfs/dbraw/zinc/14/59/14/507145914.db2.gz	BUOVZHWYFYGZGW-MRXNPFEDSA-N	0	0	354.341	2.987	50	5		FFBARN
COc1ccc(-c2nnc(COC(=O)c3ccc(N)c([N+](=O)[O-])c3)o2)cc1	ZINC000018321739	507147953	/nfs/dbraw/zinc/14/79/53/507147953.db2.gz	CYDOWTOBRJZYEV-UHFFFAOYSA-N	0	0	370.321	2.593	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])NCCOc1ccc(Cl)cc1	ZINC000021904402	507274597	/nfs/dbraw/zinc/27/45/97/507274597.db2.gz	MSHYRDWMKCDFTL-UHFFFAOYSA-N	0	0	350.758	2.822	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C(=O)CSc2ccccc21	ZINC000022864238	507317688	/nfs/dbraw/zinc/31/76/88/507317688.db2.gz	NOSNMTCLTCSEGU-UHFFFAOYSA-N	0	0	357.391	2.981	50	5		FFBARN
Cc1ccccc1CNC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000023077865	507328377	/nfs/dbraw/zinc/32/83/77/507328377.db2.gz	DYFBTCZRXPAWPF-UHFFFAOYSA-N	0	0	355.394	2.670	50	5		FFBARN
Cc1cc(NCc2cccc(C(=O)N3CCOCC3)c2)ccc1[N+](=O)[O-]	ZINC000058192485	507382165	/nfs/dbraw/zinc/38/21/65/507382165.db2.gz	HJGKLNUQVSBRRP-UHFFFAOYSA-N	0	0	355.394	2.988	50	5		FFBARN
C[C@H]1c2ccsc2CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000025382227	507496531	/nfs/dbraw/zinc/49/65/31/507496531.db2.gz	LEODFIQMFALFQX-NSHDSACASA-N	0	0	369.406	2.997	50	5		FFBARN
CCOC(=O)c1cc(C(=O)N(Cc2cccnc2)C2CC2)cc([N+](=O)[O-])c1	ZINC000028515535	507729742	/nfs/dbraw/zinc/72/97/42/507729742.db2.gz	NAOIXFFLIHCPPV-UHFFFAOYSA-N	0	0	369.377	2.971	50	5		FFBARN
CC[C@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CCO1	ZINC000029524454	507780836	/nfs/dbraw/zinc/78/08/36/507780836.db2.gz	NLJREYZGDKFHRI-VIFPVBQESA-N	0	0	368.333	2.504	50	5		FFBARN
NC(=O)[C@@H]1CCCCC[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000079097522	507933331	/nfs/dbraw/zinc/93/33/31/507933331.db2.gz	DVTUJJVOABWDJI-ZYHUDNBSSA-N	0	0	354.794	2.804	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N[C@@H]2CCOc3ccccc32)cc1F	ZINC000095978663	508200155	/nfs/dbraw/zinc/20/01/55/508200155.db2.gz	KHUCZWVKZXSASB-CYBMUJFWSA-N	0	0	352.343	2.536	50	5		FFBARN
O=C1[C@@H]2ON=C(c3ccc([N+](=O)[O-])cc3)[C@@H]2C(=O)N1c1ccccc1Cl	ZINC000103889824	508323760	/nfs/dbraw/zinc/32/37/60/508323760.db2.gz	HQLLCKYHWPVNOU-DZGCQCFKSA-N	0	0	371.736	2.541	50	5		FFBARN
COc1ccc(C(=O)Cn2cc(-c3cccc([N+](=O)[O-])c3)n(C)c2=N)cc1	ZINC000334157618	523596302	/nfs/dbraw/zinc/59/63/02/523596302.db2.gz	UEDNHHHRZARDTA-UHFFFAOYSA-N	0	0	366.377	2.773	50	5		FFBARN
O=C(/C=C\c1ccccc1[N+](=O)[O-])OCC(=O)N1CCc2ccccc21	ZINC000033827461	985631721	/nfs/dbraw/zinc/63/17/21/985631721.db2.gz	MPRZPTQWFGTDFU-KTKRTIGZSA-N	0	0	352.346	2.741	50	5		FFBARN
O=C(/C=C\c1ccc(-c2ccccc2[N+](=O)[O-])s1)N1CCNC(=O)CC1	ZINC000222163865	1009092895	/nfs/dbraw/zinc/09/28/95/1009092895.db2.gz	CHPSOOLJPOXEIR-VURMDHGXSA-N	0	0	371.418	2.685	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@@H]1COc2ccccc2O1	ZINC000030681975	209841238	/nfs/dbraw/zinc/84/12/38/209841238.db2.gz	XSBUFIAMLWSYMF-CYBMUJFWSA-N	0	0	358.350	2.658	50	5		FFBARN
CN(Cc1cccc([N+](=O)[O-])c1)C(=O)c1ccc(N2C(=O)CCC2=O)cc1	ZINC000024947005	209721678	/nfs/dbraw/zinc/72/16/78/209721678.db2.gz	HMKKTTNLVOJIOD-UHFFFAOYSA-N	0	0	367.361	2.520	50	5		FFBARN
CC(C)(C)n1nc2c(c1NC(=O)c1cccc([N+](=O)[O-])c1)C[S@@](=O)C2	ZINC000002724993	209396668	/nfs/dbraw/zinc/39/66/68/209396668.db2.gz	RMPIYPDSERDBCR-VWLOTQADSA-N	0	0	362.411	2.561	50	5		FFBARN
COc1cccc(C2=Nc3nnnn3[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1	ZINC000101130733	209222251	/nfs/dbraw/zinc/22/22/51/209222251.db2.gz	XDISNZCHMFENGK-INIZCTEOSA-N	0	0	350.338	2.646	50	5		FFBARN
CC1=NN(c2ccccc2)C(=O)[C@H]1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000100149385	209209805	/nfs/dbraw/zinc/20/98/05/209209805.db2.gz	IMURLUBIDTVTPB-OAHLLOKOSA-N	0	0	368.305	2.725	50	5		FFBARN
O=C(CCc1ccccc1)NCCc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000096278043	209148310	/nfs/dbraw/zinc/14/83/10/209148310.db2.gz	YTFLYJWAINJWNE-UHFFFAOYSA-N	0	0	366.377	2.936	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@]1(O)C(F)(F)F	ZINC000004725162	207042130	/nfs/dbraw/zinc/04/21/30/207042130.db2.gz	KVXMFALNGFOCRG-FZMZJTMJSA-N	0	0	357.288	2.848	50	5		FFBARN
C[C@H]1C[C@H](C)CN(c2c([N+](=O)[O-])nn(-c3ccc(Cl)cc3)[n+]2[O-])C1	ZINC000004923131	207062372	/nfs/dbraw/zinc/06/23/72/207062372.db2.gz	ATULDVMPMCBUKH-QWRGUYRKSA-N	0	0	351.794	2.550	50	5		FFBARN
Cc1ccc(OCC(=O)N[C@H](C)c2ccc(F)cc2F)c([N+](=O)[O-])n1	ZINC000004891735	207059274	/nfs/dbraw/zinc/05/92/74/207059274.db2.gz	CUFULODRDMTMSL-SNVBAGLBSA-N	0	0	351.309	2.833	50	5		FFBARN
CN(Cc1ccccc1)c1nc(N)c([N+](=O)[O-])c(NCc2ccco2)n1	ZINC000005030856	207074397	/nfs/dbraw/zinc/07/43/97/207074397.db2.gz	CCZORQRRQQYFSD-UHFFFAOYSA-N	0	0	354.370	2.809	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1c(F)cccc1F	ZINC000005536003	207104976	/nfs/dbraw/zinc/10/49/76/207104976.db2.gz	UFVRNKBBXQRNAY-UHFFFAOYSA-N	0	0	366.276	2.677	50	5		FFBARN
CCOC(=O)c1c(C)[nH]c(C(=O)COc2ccc(C)nc2[N+](=O)[O-])c1C	ZINC000005688784	207111658	/nfs/dbraw/zinc/11/16/58/207111658.db2.gz	HAXOKKDJIKSTAW-UHFFFAOYSA-N	0	0	361.354	2.682	50	5		FFBARN
Cc1ccc(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2NCCO)c(C)c1	ZINC000005688236	207111942	/nfs/dbraw/zinc/11/19/42/207111942.db2.gz	VJQCNYCHCKFWMZ-UHFFFAOYSA-N	0	0	372.377	2.656	50	5		FFBARN
O=C(COC(=O)c1ccccc1O)Nc1cc(Cl)ccc1[N+](=O)[O-]	ZINC000005754021	207115333	/nfs/dbraw/zinc/11/53/33/207115333.db2.gz	YEAYTLQCQCKJDW-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
CCN(Cc1ccc2c(c1)OCO2)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000007889618	207210286	/nfs/dbraw/zinc/21/02/86/207210286.db2.gz	SHDQXWAWZCMMPL-UHFFFAOYSA-N	0	0	358.350	2.751	50	5		FFBARN
Cn1nnnc1Sc1ccc(C(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-]	ZINC000008132370	207220870	/nfs/dbraw/zinc/22/08/70/207220870.db2.gz	RTGOBKTYVLCRQF-UHFFFAOYSA-N	0	0	374.357	2.661	50	5		FFBARN
CCOc1ccc(C(C)C)cc1S(=O)(=O)n1c(C)ncc1[N+](=O)[O-]	ZINC000008132595	207221156	/nfs/dbraw/zinc/22/11/56/207221156.db2.gz	XGTFZHBTEUYCSG-UHFFFAOYSA-N	0	0	353.400	2.859	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)C1CCN(C(=O)c2ccco2)CC1	ZINC000008246457	207225447	/nfs/dbraw/zinc/22/54/47/207225447.db2.gz	GCUDZHASKIFOOV-UHFFFAOYSA-N	0	0	357.366	2.987	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)Nc3ccc(F)c([N+](=O)[O-])c3)CC2=O)cc1	ZINC000008473888	207233247	/nfs/dbraw/zinc/23/32/47/207233247.db2.gz	GHARDRZHASZXPZ-NSHDSACASA-N	0	0	373.340	2.734	50	5		FFBARN
COc1ccc(N2C[C@@H](C(=O)Nc3ccc(C)cc3[N+](=O)[O-])CC2=O)cc1	ZINC000009226938	207262718	/nfs/dbraw/zinc/26/27/18/207262718.db2.gz	IVXYRPXXHODXQU-ZDUSSCGKSA-N	0	0	369.377	2.903	50	5		FFBARN
CCOc1ccccc1CN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000009457828	207272331	/nfs/dbraw/zinc/27/23/31/207272331.db2.gz	URNKMGNTWLAPGN-IBGZPJMESA-N	0	0	369.377	2.961	50	5		FFBARN
NC(=O)c1ccc(CSc2nc3cc(Cl)cnc3[nH]2)c([N+](=O)[O-])c1	ZINC000009318681	207266385	/nfs/dbraw/zinc/26/63/85/207266385.db2.gz	LSSLCUJMMIRWBO-UHFFFAOYSA-N	0	0	363.786	2.911	50	5		FFBARN
COc1cc(SC)ccc1C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000009689962	207281641	/nfs/dbraw/zinc/28/16/41/207281641.db2.gz	PECWJWVZBKLNIK-OAHLLOKOSA-N	0	0	362.407	2.789	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccccc1N1CCCC1=O	ZINC000009653704	207280492	/nfs/dbraw/zinc/28/04/92/207280492.db2.gz	IWTLPEAYOJQGOC-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1Cn1cccn1	ZINC000010235190	207298143	/nfs/dbraw/zinc/29/81/43/207298143.db2.gz	XFOFGADEXKVHEY-UHFFFAOYSA-N	0	0	366.377	2.778	50	5		FFBARN
COCCNc1ccc(C(=O)Nc2nc3c(s2)CCC3)cc1[N+](=O)[O-]	ZINC000012545187	207392526	/nfs/dbraw/zinc/39/25/26/207392526.db2.gz	LZOXDKGSAQMFPI-UHFFFAOYSA-N	0	0	362.411	2.851	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000013723545	207480288	/nfs/dbraw/zinc/48/02/88/207480288.db2.gz	SYZQGMJVPUYTFQ-CQSZACIVSA-N	0	0	351.366	2.657	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1cccc(S(C)(=O)=O)c1	ZINC000015179443	207547233	/nfs/dbraw/zinc/54/72/33/207547233.db2.gz	DCRFUJZGYBXJQO-LBPRGKRZSA-N	0	0	362.407	2.832	50	5		FFBARN
Cc1c(CSc2nnc(SCC(N)=O)s2)cccc1[N+](=O)[O-]	ZINC000040127510	207968358	/nfs/dbraw/zinc/96/83/58/207968358.db2.gz	YLCDIUMHXXVTNU-UHFFFAOYSA-N	0	0	356.454	2.624	50	5		FFBARN
Cc1nc2ccccc2nc1COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000032724218	208036891	/nfs/dbraw/zinc/03/68/91/208036891.db2.gz	RSEKPHUXUCEDDB-UHFFFAOYSA-N	0	0	367.317	2.932	50	5		FFBARN
CCc1sc(C(=O)NCC(=O)N2CCc3ccc([N+](=O)[O-])cc32)cc1C	ZINC000032809359	208045526	/nfs/dbraw/zinc/04/55/26/208045526.db2.gz	RKSWANONENEVIU-UHFFFAOYSA-N	0	0	373.434	2.846	50	5		FFBARN
Cc1nc(-c2c[nH]c(C(=O)NC[C@H](O)c3ccc([N+](=O)[O-])cc3)c2)cs1	ZINC000040012862	208217719	/nfs/dbraw/zinc/21/77/19/208217719.db2.gz	UYKKSYIMAXUXAH-INIZCTEOSA-N	0	0	372.406	2.818	50	5		FFBARN
O=C(NCc1ccncc1)c1cc(OCC(F)(F)F)ccc1[N+](=O)[O-]	ZINC000047698835	208382159	/nfs/dbraw/zinc/38/21/59/208382159.db2.gz	KUVAXTSDGONTMT-UHFFFAOYSA-N	0	0	355.272	2.861	50	5		FFBARN
CCCc1nc2c3ccccc3n(Cc3ccc([N+](=O)[O-])cc3)c(=O)n2n1	ZINC000065535127	208689767	/nfs/dbraw/zinc/68/97/67/208689767.db2.gz	SYMWSDIQOZVJDT-UHFFFAOYSA-N	0	0	363.377	2.953	50	5		FFBARN
Cn1ncc([N+](=O)[O-])c1C(=O)N[C@H]1CCCc2cc(OC(F)F)ccc21	ZINC000095452359	209052195	/nfs/dbraw/zinc/05/21/95/209052195.db2.gz	VYUGUCGNBOJKJI-LBPRGKRZSA-N	0	0	366.324	2.737	50	5		FFBARN
CCOc1cc(CNC(=O)c2ccc([N+](=O)[O-])c3cccnc23)ccn1	ZINC000095451650	209052418	/nfs/dbraw/zinc/05/24/18/209052418.db2.gz	NMKYRDGOQAXOGX-UHFFFAOYSA-N	0	0	352.350	2.867	50	5		FFBARN
O=[N+]([O-])c1ccc2c(c1)S(=O)(=O)N=C2Sc1nc2ccccc2o1	ZINC000095481803	209060203	/nfs/dbraw/zinc/06/02/03/209060203.db2.gz	OXMGWYNUZAYXBM-UHFFFAOYSA-N	0	0	361.360	2.977	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)C(=O)N1CCC(Oc2ccccc2)CC1	ZINC000095954947	209089534	/nfs/dbraw/zinc/08/95/34/209089534.db2.gz	GRQRGIVRUUSRGJ-UHFFFAOYSA-N	0	0	369.377	2.603	50	5		FFBARN
O=Cc1ccc(OCCCN2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000004038387	132386177	/nfs/dbraw/zinc/38/61/77/132386177.db2.gz	WFUWFTLMVVZELM-UHFFFAOYSA-N	0	0	369.421	2.998	50	5		FFBARN
O=C(Nc1cc(Cl)ccc1N1CCOCC1)c1ccc([N+](=O)[O-])o1	ZINC000006045134	132831189	/nfs/dbraw/zinc/83/11/89/132831189.db2.gz	XFSFWWPXAZJQDQ-UHFFFAOYSA-N	0	0	351.746	2.930	50	5		FFBARN
O=C(CN1CCN(c2ccccc2[N+](=O)[O-])CC1)N1CCCCCCC1	ZINC000057355158	136128706	/nfs/dbraw/zinc/12/87/06/136128706.db2.gz	MLBQKWJJSKHBOL-UHFFFAOYSA-N	0	0	360.458	2.510	50	5		FFBARN
COC(=O)c1ccc2[nH]c3c(c2c1)CN(c1ccc([N+](=O)[O-])cn1)CC3	ZINC000026725274	136153300	/nfs/dbraw/zinc/15/33/00/136153300.db2.gz	MQELOSKUXLSQNI-UHFFFAOYSA-N	0	0	352.350	2.820	50	5		FFBARN
COc1ccc(OC)c(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c1	ZINC000000725778	506230065	/nfs/dbraw/zinc/23/00/65/506230065.db2.gz	KCAMUKFRTFFPAJ-XNTDXEJSSA-N	0	0	354.318	2.957	50	5		FFBARN
O=C(NC(NC(=O)c1ccco1)c1cccc([N+](=O)[O-])c1)c1ccco1	ZINC000000872575	506237060	/nfs/dbraw/zinc/23/70/60/506237060.db2.gz	AXUMSHZHMQTPNE-UHFFFAOYSA-N	0	0	355.306	2.639	50	5		FFBARN
COC(=O)c1sc2ncn(Cc3ccc([N+](=O)[O-])cc3)c(=O)c2c1C	ZINC000000955583	506239803	/nfs/dbraw/zinc/23/98/03/506239803.db2.gz	UKZXFKFHGRHDDC-UHFFFAOYSA-N	0	0	359.363	2.510	50	5		FFBARN
CCOc1ccc(C(=O)NC(=S)Nc2ncccc2C)cc1[N+](=O)[O-]	ZINC000001173619	506251800	/nfs/dbraw/zinc/25/18/00/506251800.db2.gz	SMQOWIWVCZOOCH-UHFFFAOYSA-N	0	0	360.395	2.824	50	5		FFBARN
CC(C)(C)NC(=O)c1ccc(N2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1	ZINC000001234949	506256171	/nfs/dbraw/zinc/25/61/71/506256171.db2.gz	POSONQNTXRJMNC-UHFFFAOYSA-N	0	0	367.361	2.924	50	5		FFBARN
CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000001226953	506256496	/nfs/dbraw/zinc/25/64/96/506256496.db2.gz	PHTAMBMUQWHXLX-HNNXBMFYSA-N	0	0	356.334	2.558	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(=O)n(Cc2ccccc2)n1	ZINC000032517160	506262135	/nfs/dbraw/zinc/26/21/35/506262135.db2.gz	SPGKJOODEJZMOS-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
O=C(Nc1cc2cc([N+](=O)[O-])cc([N+](=O)[O-])c2oc1=O)c1ccccc1	ZINC000001836988	506268514	/nfs/dbraw/zinc/26/85/14/506268514.db2.gz	XVDZVGBBYMTCCL-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@@H](/C(Cl)=C/c2ccc([N+](=O)[O-])cc2)S1	ZINC000002461330	506279139	/nfs/dbraw/zinc/27/91/39/506279139.db2.gz	QCPYVXRTLMRYOQ-FFXRNRBCSA-N	0	0	368.802	2.503	50	5		FFBARN
COc1ccc(NC(=O)COC(=O)c2ccc([N+](=O)[O-])o2)cc1Cl	ZINC000002653721	506286893	/nfs/dbraw/zinc/28/68/93/506286893.db2.gz	ZDNUXKIAIPOJLN-UHFFFAOYSA-N	0	0	354.702	2.645	50	5		FFBARN
CCCCc1nnc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)s1	ZINC000002878030	506300326	/nfs/dbraw/zinc/30/03/26/506300326.db2.gz	PPDGBFXPYPAQNK-UHFFFAOYSA-N	0	0	364.383	2.828	50	5		FFBARN
O=C(COC(=O)c1ccccc1O)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000003272206	506316551	/nfs/dbraw/zinc/31/65/51/506316551.db2.gz	XONNYADLVZKXKQ-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1Cl)NCc1ccc2c(c1)OCO2	ZINC000003438403	506331092	/nfs/dbraw/zinc/33/10/92/506331092.db2.gz	CKEFQPSGJJAQPR-UHFFFAOYSA-N	0	0	364.741	2.672	50	5		FFBARN
Cc1c(Cl)cccc1NC(=O)CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000003598598	506346486	/nfs/dbraw/zinc/34/64/86/506346486.db2.gz	BCKONWLSTKTEDD-UHFFFAOYSA-N	0	0	373.752	2.791	50	5		FFBARN
O=C(NCc1cccnc1)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@H]12	ZINC000035870208	506390389	/nfs/dbraw/zinc/39/03/89/506390389.db2.gz	QVBRSFIHSOHDHL-PKOBYXMFSA-N	0	0	366.421	2.837	50	5		FFBARN
COc1cccc(OC)c1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000004834802	506397700	/nfs/dbraw/zinc/39/77/00/506397700.db2.gz	AWRHXWVOFFFZQX-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccccc3)CC2)cc1N1CCOCC1	ZINC000004846217	506398314	/nfs/dbraw/zinc/39/83/14/506398314.db2.gz	ZOVMAGGGZXUKOZ-UHFFFAOYSA-N	0	0	368.437	2.758	50	5		FFBARN
Cc1ccnc(NC(=O)c2cccn(Cc3cccc([N+](=O)[O-])c3)c2=O)c1	ZINC000005270784	506432383	/nfs/dbraw/zinc/43/23/83/506432383.db2.gz	LHSHIAZEECHMHY-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
COCCNC(=O)c1cc2c3ccccc3n3c2c(n1)c1ccccc1c3=O	ZINC000006624645	506492576	/nfs/dbraw/zinc/49/25/76/506492576.db2.gz	UGOULPOSCLJGAK-UHFFFAOYSA-N	0	0	371.396	2.968	50	5	biogenic	FFBARN
Cc1cccc(NC(=O)c2ccc(=O)n(Cc3cccc([N+](=O)[O-])c3)c2)n1	ZINC000010187975	506730283	/nfs/dbraw/zinc/73/02/83/506730283.db2.gz	AYYRYXXQJOCBIY-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
CN1CCN(C(=O)CCNc2ccccc2[N+](=O)[O-])[C@@H](c2ccccc2)C1	ZINC000055428173	506751034	/nfs/dbraw/zinc/75/10/34/506751034.db2.gz	SEAXFCHRQRVESK-LJQANCHMSA-N	0	0	368.437	2.912	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(S(=O)(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1	ZINC000012634337	506888213	/nfs/dbraw/zinc/88/82/13/506888213.db2.gz	XCCZXZNJVFGKTM-OKILXGFUSA-N	0	0	367.471	2.862	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)Oc1cc(F)ccc1[N+](=O)[O-]	ZINC000055949836	506894273	/nfs/dbraw/zinc/89/42/73/506894273.db2.gz	LARNJDAPYODIAK-UHFFFAOYSA-N	0	0	356.287	2.718	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)c1ccc2c(c1)OCC(=O)N2	ZINC000012809674	506906698	/nfs/dbraw/zinc/90/66/98/506906698.db2.gz	CXMWBGQGKLQZEH-NSHDSACASA-N	0	0	355.350	2.759	50	5		FFBARN
CCOC(=O)c1cc(C(=O)Nn2cnc3ccccc32)cc([N+](=O)[O-])c1	ZINC000012939483	506918275	/nfs/dbraw/zinc/91/82/75/506918275.db2.gz	RRQWZKFVZPOEJE-UHFFFAOYSA-N	0	0	354.322	2.505	50	5		FFBARN
C[C@@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@H](c2ccccc2)O1	ZINC000067892945	507042793	/nfs/dbraw/zinc/04/27/93/507042793.db2.gz	XZLZALHDVCQLTG-CXAGYDPISA-N	0	0	369.377	2.522	50	5		FFBARN
Cn1c2cn(C3CCCC3)c(-c3cccc([N+](=O)[O-])c3)c2c(=O)n(C)c1=O	ZINC000020443314	507222651	/nfs/dbraw/zinc/22/26/51/507222651.db2.gz	DVDSHGKOLZDTRM-UHFFFAOYSA-N	0	0	368.393	2.729	50	5		FFBARN
CCN(Cc1ccc2c(c1)OCO2)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000022278748	507287069	/nfs/dbraw/zinc/28/70/69/507287069.db2.gz	MKLLSHAZYSTIAX-UHFFFAOYSA-N	0	0	364.379	2.534	50	5		FFBARN
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1cccc([N+](=O)[O-])c1	ZINC000023106147	507329606	/nfs/dbraw/zinc/32/96/06/507329606.db2.gz	KRUFHHHMHPBVPB-GOSISDBHSA-N	0	0	373.384	2.537	50	5		FFBARN
O=C(Cn1c2ccccc2c(=O)c2ccccc21)NCCc1cccnc1	ZINC000023875322	507377723	/nfs/dbraw/zinc/37/77/23/507377723.db2.gz	BELFQLPHFHFENZ-UHFFFAOYSA-N	0	0	357.413	2.909	50	5		FFBARN
CCOc1ccc(C(=O)Nc2cc(C(=O)NC)ccc2C)cc1[N+](=O)[O-]	ZINC000024921794	507449021	/nfs/dbraw/zinc/44/90/21/507449021.db2.gz	KJKVWOPDBPLWJY-UHFFFAOYSA-N	0	0	357.366	2.914	50	5		FFBARN
O=C1N[C@H](c2cc3c(cc2[N+](=O)[O-])OCCO3)Nc2ccc(Cl)cc21	ZINC000063499418	507738808	/nfs/dbraw/zinc/73/88/08/507738808.db2.gz	VFFQQHZPSCWYLN-OAHLLOKOSA-N	0	0	361.741	2.874	50	5		FFBARN
O=C(NCCC(=O)N1CCc2ccc([N+](=O)[O-])cc21)Nc1ccccc1	ZINC000029251003	507771305	/nfs/dbraw/zinc/77/13/05/507771305.db2.gz	CZMAMGLNPOMDIE-UHFFFAOYSA-N	0	0	354.366	2.696	50	5		FFBARN
CCc1nnc(NC(=O)CSCc2ccc(OC)c([N+](=O)[O-])c2)s1	ZINC000031874922	507822187	/nfs/dbraw/zinc/82/21/87/507822187.db2.gz	DCNBAHQDYGLQOQ-UHFFFAOYSA-N	0	0	368.440	2.889	50	5		FFBARN
C[C@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1	ZINC000107135321	507835772	/nfs/dbraw/zinc/83/57/72/507835772.db2.gz	UHSCZITXVCPKMP-GUYCJALGSA-N	0	0	362.407	2.746	50	5		FFBARN
O=C(/C=C\c1ccccc1[N+](=O)[O-])NCc1cccc(Cn2cncn2)c1	ZINC000097220116	508221955	/nfs/dbraw/zinc/22/19/55/508221955.db2.gz	HVZMERIJTJIVOZ-HJWRWDBZSA-N	0	0	363.377	2.564	50	5		FFBARN
COc1ccc(OC)c2c1s/c(=N\C(=O)c1cccc([N+](=O)[O-])c1)n2C	ZINC000100908634	508240453	/nfs/dbraw/zinc/24/04/53/508240453.db2.gz	HSODIBXXDHOFII-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
COc1cc(CCO)cc(OC)c1OCCOc1cccc([N+](=O)[O-])c1	ZINC000225655198	509383015	/nfs/dbraw/zinc/38/30/15/509383015.db2.gz	DDGCOSJNIKCRJB-UHFFFAOYSA-N	0	0	363.366	2.605	50	5		FFBARN
O=C(NCCNc1ccc2cc(F)cc([N+](=O)[O-])c2n1)c1ccc(O)cc1	ZINC000170601993	509677201	/nfs/dbraw/zinc/67/72/01/509677201.db2.gz	UAZLGTZSQAVGTG-UHFFFAOYSA-N	0	0	370.340	2.830	50	5		FFBARN
CCCN(C[C@@H]1CCCCO1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000170622598	509683503	/nfs/dbraw/zinc/68/35/03/509683503.db2.gz	JMCHSPDNPGUQQM-HNNXBMFYSA-N	0	0	373.413	2.597	50	5		FFBARN
Cc1ccc2cc(CCNC(=O)c3ccccc3[N+](=O)[O-])c(=O)[nH]c2c1	ZINC000003911718	518189979	/nfs/dbraw/zinc/18/99/79/518189979.db2.gz	DYQMCODUMQZGMH-UHFFFAOYSA-N	0	0	351.362	2.717	50	5		FFBARN
O=C(CC1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1)N1CCCC1	ZINC000048272399	570939821	/nfs/dbraw/zinc/93/98/21/570939821.db2.gz	QXJADYACVFXLFN-UHFFFAOYSA-N	0	0	371.441	2.627	50	5		FFBARN
CN(C)c1ccc(NC(=O)COC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)cc1	ZINC000033603598	990477232	/nfs/dbraw/zinc/47/72/32/990477232.db2.gz	QNTNSOUSWAUHGV-XGICHPGQSA-N	0	0	369.377	2.856	50	5		FFBARN
C[C@H](OC(=O)c1ccc(N)c([N+](=O)[O-])c1)C(=O)N[C@@H]1CCC[C@@H](C)[C@@H]1C	ZINC000229744083	209873686	/nfs/dbraw/zinc/87/36/86/209873686.db2.gz	ZINVDDQTRNQZSD-OXJKWZBOSA-N	0	0	363.414	2.663	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CC(=O)Nc1ccc(Br)c(C)c1	ZINC000001070960	219364068	/nfs/dbraw/zinc/36/40/68/219364068.db2.gz	AXASLNUNYSXWDS-UHFFFAOYSA-N	0	0	353.176	2.809	50	5		FFBARN
CC(C)OC(=O)c1ccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000001117002	219372300	/nfs/dbraw/zinc/37/23/00/219372300.db2.gz	MQYJZTXJAZGQEP-UHFFFAOYSA-N	0	0	354.318	2.961	50	5		FFBARN
O=C(Oc1ccc(C(=S)N2CCOCC2)cc1)c1cccc([N+](=O)[O-])c1	ZINC000001161201	219383489	/nfs/dbraw/zinc/38/34/89/219383489.db2.gz	RWKZAWVAQIYASM-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
CCNC(=O)COc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1	ZINC000025647524	209741318	/nfs/dbraw/zinc/74/13/18/209741318.db2.gz	FGWPOPBUMXLTKG-UHFFFAOYSA-N	0	0	357.366	2.670	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H](c1cccs1)N(C)C	ZINC000046033749	209329234	/nfs/dbraw/zinc/32/92/34/209329234.db2.gz	GEXXMJORDPSQJA-CYBMUJFWSA-N	0	0	369.468	2.546	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)N3C[C@H](C)C[C@H](C)C3)c(=O)oc21	ZINC000016425500	220183543	/nfs/dbraw/zinc/18/35/43/220183543.db2.gz	ZGSQUCDIWPUGLR-PHIMTYICSA-N	0	0	360.366	2.828	50	5		FFBARN
CC1=C(C(=O)O[C@H]2CCC[C@@H]2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000000725262	206828291	/nfs/dbraw/zinc/82/82/91/206828291.db2.gz	BQRURLIZQQYDGS-JMPLFQLZSA-N	0	0	359.382	2.955	50	5		FFBARN
Cc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1C	ZINC000000850454	206840370	/nfs/dbraw/zinc/84/03/70/206840370.db2.gz	DBYOOKVCRCHKQD-UHFFFAOYSA-N	0	0	367.361	2.836	50	5		FFBARN
COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c1ccc([N+](=O)[O-])cc1	ZINC000002797120	206935629	/nfs/dbraw/zinc/93/56/29/206935629.db2.gz	MFTGCBMUTMFHIA-UHFFFAOYSA-N	0	0	360.366	2.516	50	5		FFBARN
C[C@@H](Oc1ccccc1)C(=O)OCc1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000002658735	206926533	/nfs/dbraw/zinc/92/65/33/206926533.db2.gz	OVTAKIKSRJRFSS-GFCCVEGCSA-N	0	0	359.334	2.972	50	5		FFBARN
CCn1ncc(Cl)c1C(=O)NC(=S)Nc1cc([N+](=O)[O-])ccc1C	ZINC000002776306	206932865	/nfs/dbraw/zinc/93/28/65/206932865.db2.gz	MBQTWFDNWYMKTA-UHFFFAOYSA-N	0	0	367.818	2.900	50	5		FFBARN
CCCOC(=O)c1ccc2c(c1)C(=O)N(c1ccc([N+](=O)[O-])cc1)C2=O	ZINC000004084443	207000227	/nfs/dbraw/zinc/00/02/27/207000227.db2.gz	XPKLYLBVBLYOJW-UHFFFAOYSA-N	0	0	354.318	2.962	50	5		FFBARN
CCOc1ccc(NC(=O)C[C@H]2Nc3ccccc3NC2=O)c([N+](=O)[O-])c1	ZINC000004047444	206999046	/nfs/dbraw/zinc/99/90/46/206999046.db2.gz	YZAXUUWFRMKAPT-OAHLLOKOSA-N	0	0	370.365	2.755	50	5		FFBARN
COc1ccc(CN2C(=O)N[C@@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1F	ZINC000004477681	207021222	/nfs/dbraw/zinc/02/12/22/207021222.db2.gz	AWVOUIINTTYJKJ-SFHVURJKSA-N	0	0	373.340	2.710	50	5		FFBARN
CC(C)N1c2ccccc2[C@](O)(CC(=O)c2ccccc2[N+](=O)[O-])C1=O	ZINC000004554713	207028449	/nfs/dbraw/zinc/02/84/49/207028449.db2.gz	MLUFEVAIXPEVKF-LJQANCHMSA-N	0	0	354.362	2.810	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])cn1)Nc1ccn(C23CC4CC(CC(C4)C2)C3)n1	ZINC000004652283	207033899	/nfs/dbraw/zinc/03/38/99/207033899.db2.gz	DIEAZPWXGZYEBL-UHFFFAOYSA-N	0	0	370.413	2.552	50	5		FFBARN
Cc1[nH][nH]c(=O)c1C(c1c(C)[nH][nH]c1=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000004678091	207036319	/nfs/dbraw/zinc/03/63/19/207036319.db2.gz	SMNMURMFSLUFNH-UHFFFAOYSA-N	0	0	363.761	2.903	50	5		FFBARN
O=C(CCC(=O)Nc1ccccc1[N+](=O)[O-])Nc1ccccc1[N+](=O)[O-]	ZINC000004670511	207037376	/nfs/dbraw/zinc/03/73/76/207037376.db2.gz	RURNYMLMBDZRRX-UHFFFAOYSA-N	0	0	358.310	2.860	50	5		FFBARN
CSc1ccc(C(=O)NC[C@H]2COc3ccccc3O2)cc1[N+](=O)[O-]	ZINC000005630941	207109753	/nfs/dbraw/zinc/10/97/53/207109753.db2.gz	YOMNNYBIAGAOGQ-LBPRGKRZSA-N	0	0	360.391	2.887	50	5		FFBARN
COc1ccc(C(=O)Nc2ccccc2C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000005550373	207105270	/nfs/dbraw/zinc/10/52/70/207105270.db2.gz	MTHVEVMTTNIORY-UHFFFAOYSA-N	0	0	355.350	2.748	50	5		FFBARN
C[C@@H](OC(=O)c1ccc(Sc2ccc(F)cc2)c([N+](=O)[O-])c1)C(N)=O	ZINC000006788501	207165485	/nfs/dbraw/zinc/16/54/85/207165485.db2.gz	JAPQVJVDFCWHDY-SECBINFHSA-N	0	0	364.354	2.916	50	5		FFBARN
CSC1=C([N+](=O)[O-])[C@@H](c2cccc(Br)c2)NC(=O)N1C	ZINC000008346053	207230862	/nfs/dbraw/zinc/23/08/62/207230862.db2.gz	WZZWKUXOFCNCHX-SECBINFHSA-N	0	0	358.217	2.954	50	5		FFBARN
CSc1ccc(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)cc1NC(C)=O	ZINC000008943153	207251808	/nfs/dbraw/zinc/25/18/08/207251808.db2.gz	SYCXVDKERCICFQ-UHFFFAOYSA-N	0	0	362.411	2.971	50	5		FFBARN
Cn1c(Sc2cc3c(cc2[N+](=O)[O-])OCCO3)nnc1C(F)(F)F	ZINC000009377542	207269334	/nfs/dbraw/zinc/26/93/34/207269334.db2.gz	NYBVWFFLQHYFMT-UHFFFAOYSA-N	0	0	362.289	2.665	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1ccsc1	ZINC000009751794	207285192	/nfs/dbraw/zinc/28/51/92/207285192.db2.gz	SGNBZELJUKHLJB-SECBINFHSA-N	0	0	350.352	2.849	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)OCC(=O)NC1CCCCCC1	ZINC000010051251	207293059	/nfs/dbraw/zinc/29/30/59/207293059.db2.gz	WXBDNIOOVJCNJA-UHFFFAOYSA-N	0	0	363.414	2.657	50	5		FFBARN
COC(=O)c1cccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1	ZINC000012547755	207391845	/nfs/dbraw/zinc/39/18/45/207391845.db2.gz	BZWGJXPKLMYNNY-UHFFFAOYSA-N	0	0	366.333	2.819	50	5		FFBARN
CCOc1cc2c(cc1CNC(=O)c1ccc(N)c([N+](=O)[O-])c1)O[C@H](C)C2	ZINC000012553530	207392225	/nfs/dbraw/zinc/39/22/25/207392225.db2.gz	BLAGSWLRYHYDPR-LLVKDONJSA-N	0	0	371.393	2.829	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NC[C@@H]1CCCO1)c1ccc([N+](=O)[O-])cc1	ZINC000012567350	207393459	/nfs/dbraw/zinc/39/34/59/207393459.db2.gz	JZTLTBDIWIRNLD-HNNXBMFYSA-N	0	0	369.377	2.756	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1S(=O)(=O)NCCSC1CCCC1	ZINC000032435052	208027310	/nfs/dbraw/zinc/02/73/10/208027310.db2.gz	WZROCIKZNZMGAQ-UHFFFAOYSA-N	0	0	360.457	2.558	50	5		FFBARN
O=C(NCc1cccnc1OCC(F)(F)F)c1ccc([N+](=O)[O-])cc1	ZINC000032817423	208044676	/nfs/dbraw/zinc/04/46/76/208044676.db2.gz	SOPILUVYBODWEK-UHFFFAOYSA-N	0	0	355.272	2.861	50	5		FFBARN
Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1-c1nccs1	ZINC000040161767	208239141	/nfs/dbraw/zinc/23/91/41/208239141.db2.gz	JOYCVPGLJZOIEI-UHFFFAOYSA-N	0	0	358.379	2.503	50	5		FFBARN
O=C1N[C@]2(CCCc3ccccc32)C(=O)N1Cc1ccccc1[N+](=O)[O-]	ZINC000041093883	208281081	/nfs/dbraw/zinc/28/10/81/208281081.db2.gz	BOIRDIKIVIBIMK-IBGZPJMESA-N	0	0	351.362	2.878	50	5		FFBARN
CN1CCN(c2ccc(C(=O)NC3CCCCCC3)cc2[N+](=O)[O-])CC1	ZINC000009379223	132379252	/nfs/dbraw/zinc/37/92/52/132379252.db2.gz	JWNBFXLUUOGICA-UHFFFAOYSA-N	0	0	360.458	2.799	50	5		FFBARN
CC(C)c1onc(C(=O)N2CCN(c3ccc(F)cc3)CC2)c1[N+](=O)[O-]	ZINC000004884886	132825169	/nfs/dbraw/zinc/82/51/69/132825169.db2.gz	MIPVPJOBPMNAQM-UHFFFAOYSA-N	0	0	362.361	2.808	50	5		FFBARN
CCCN1c2ccccc2[C@@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000001130027	506250022	/nfs/dbraw/zinc/25/00/22/506250022.db2.gz	JOGBLIXRZSBREG-IBGZPJMESA-N	0	0	354.362	2.812	50	5		FFBARN
CCC(=O)Nc1ccc(C(=O)OCC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000001164322	506252450	/nfs/dbraw/zinc/25/24/50/506252450.db2.gz	XQNVNGLZLHTPDF-UHFFFAOYSA-N	0	0	356.334	2.983	50	5		FFBARN
CCOC(=O)c1ccc(NC(=O)c2cc(C(=O)OC)cc([N+](=O)[O-])c2)cc1	ZINC000001207177	506253757	/nfs/dbraw/zinc/25/37/57/506253757.db2.gz	MYASFEVJZGISNQ-UHFFFAOYSA-N	0	0	372.333	2.810	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@H](/C(Cl)=C/c2ccc([N+](=O)[O-])cc2)S1	ZINC000002461336	506279684	/nfs/dbraw/zinc/27/96/84/506279684.db2.gz	QCPYVXRTLMRYOQ-OTAKNEKHSA-N	0	0	368.802	2.503	50	5		FFBARN
CC[C@@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000002847796	506297124	/nfs/dbraw/zinc/29/71/24/506297124.db2.gz	QKSQHYHIOGYKRK-SECBINFHSA-N	0	0	369.424	2.869	50	5		FFBARN
COC(=O)c1ccc(SCC(=O)N2CCC(C)CC2)c([N+](=O)[O-])c1	ZINC000003025076	506306677	/nfs/dbraw/zinc/30/66/77/506306677.db2.gz	QSMGHHDROSOCJL-UHFFFAOYSA-N	0	0	352.412	2.732	50	5	aggregator	FFBARN
CN(Cc1ccccc1)C(=O)COC(=O)/C=C/c1ccc([N+](=O)[O-])cc1	ZINC000003228635	506313466	/nfs/dbraw/zinc/31/34/66/506313466.db2.gz	GTSIYCGJRQJONS-FMIVXFBMSA-N	0	0	354.362	2.810	50	5		FFBARN
O=C(COC(=O)c1ccc2ccccc2n1)Nc1cccc([N+](=O)[O-])c1	ZINC000003234970	506314910	/nfs/dbraw/zinc/31/49/10/506314910.db2.gz	MGRRZKMDUJHERH-UHFFFAOYSA-N	0	0	351.318	2.939	50	5		FFBARN
CCCN(CCC)S(=O)(=O)c1ccc(N2CCCC2=O)c([N+](=O)[O-])c1	ZINC000004015977	506355322	/nfs/dbraw/zinc/35/53/22/506355322.db2.gz	MZPGTXFMMKKWGD-UHFFFAOYSA-N	0	0	369.443	2.532	50	5		FFBARN
CCOc1ccc(Cl)cc1C=Cc1[nH]c2ncnn2c(=O)c1[N+](=O)[O-]	ZINC000033703581	506361024	/nfs/dbraw/zinc/36/10/24/506361024.db2.gz	CGDLDVUASFSFEH-HWKANZROSA-N	0	0	361.745	2.961	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N(c1ccccc1)[C@H]1C=CS(=O)(=O)C1	ZINC000004159556	506361969	/nfs/dbraw/zinc/36/19/69/506361969.db2.gz	BFCKVHXWOYRZPY-INIZCTEOSA-N	0	0	358.375	2.552	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCC2)ccc1N1CCCCC1	ZINC000004158831	506362033	/nfs/dbraw/zinc/36/20/33/506362033.db2.gz	IORLNLAOSGDJDG-UHFFFAOYSA-N	0	0	353.444	2.760	50	5		FFBARN
Cc1c(C(=O)N[C@H]2CC(=O)N(c3ccc(F)cc3)C2)cccc1[N+](=O)[O-]	ZINC000004497408	506379610	/nfs/dbraw/zinc/37/96/10/506379610.db2.gz	IIVBJEQTFZFQQE-ZDUSSCGKSA-N	0	0	357.341	2.578	50	5		FFBARN
Cc1cccc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000005090773	506420332	/nfs/dbraw/zinc/42/03/32/506420332.db2.gz	SSNNIEJOWLQBMR-UHFFFAOYSA-N	0	0	355.394	2.631	50	5		FFBARN
CCc1nnc(NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)s1	ZINC000005200140	506429313	/nfs/dbraw/zinc/42/93/13/506429313.db2.gz	OICGHFKIRIKGMH-UHFFFAOYSA-N	0	0	361.427	2.864	50	5		FFBARN
COc1ccc(-c2nnc(NC(=O)c3cccc([N+](=O)[O-])c3)o2)cc1OC	ZINC000005372339	506439710	/nfs/dbraw/zinc/43/97/10/506439710.db2.gz	RVIAPHTXKZFDOX-UHFFFAOYSA-N	0	0	370.321	2.914	50	5		FFBARN
Cc1ccc(SCCNC(=O)COc2ccc(C)nc2[N+](=O)[O-])cc1	ZINC000005702281	506455210	/nfs/dbraw/zinc/45/52/10/506455210.db2.gz	LHWNOIPBTDOGKE-UHFFFAOYSA-N	0	0	361.423	2.894	50	5		FFBARN
Cc1cc(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c(C)n1Cc1ccco1	ZINC000005823054	506457825	/nfs/dbraw/zinc/45/78/25/506457825.db2.gz	OXIJWTQHXKJHEQ-UHFFFAOYSA-N	0	0	355.350	2.699	50	5		FFBARN
COc1cc(C(=O)NCCc2ccccc2)c([N+](=O)[O-])c(OC)c1OC	ZINC000012764253	506897391	/nfs/dbraw/zinc/89/73/91/506897391.db2.gz	OMSQRRYVLHKLJY-UHFFFAOYSA-N	0	0	360.366	2.593	50	5		FFBARN
CC(C)n1nnnc1S[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000012796089	506904744	/nfs/dbraw/zinc/90/47/44/506904744.db2.gz	FWOODOMMPJSBAC-QMMMGPOBSA-N	0	0	370.822	2.935	50	5		FFBARN
Cc1c(C(=O)O[C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cnn1C	ZINC000013297791	506936011	/nfs/dbraw/zinc/93/60/11/506936011.db2.gz	PPRLBKFOXSOKEF-JTQLQIEISA-N	0	0	357.326	2.605	50	5		FFBARN
C[C@H](OC(=O)c1ccc([N+](=O)[O-])o1)C(=O)Nc1ccccc1OC(F)F	ZINC000014083293	506963640	/nfs/dbraw/zinc/96/36/40/506963640.db2.gz	RDKXBTLBQNRCAF-QMMMGPOBSA-N	0	0	370.264	2.973	50	5		FFBARN
CNc1ccc(C(=O)NCCc2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-]	ZINC000014416008	506990270	/nfs/dbraw/zinc/99/02/70/506990270.db2.gz	VWVDHYYBFMGYEL-UHFFFAOYSA-N	0	0	365.393	2.795	50	5		FFBARN
O=[N+]([O-])c1cc(Cl)ccc1NCCNS(=O)(=O)Cc1ccccc1	ZINC000018194388	507145193	/nfs/dbraw/zinc/14/51/93/507145193.db2.gz	UUTJVVOKSOMBNU-UHFFFAOYSA-N	0	0	369.830	2.780	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@@H](c2cccc([N+](=O)[O-])c2)NC3=O)c1	ZINC000020213028	507215171	/nfs/dbraw/zinc/21/51/71/507215171.db2.gz	GNEYXNXFMRWMTJ-OAHLLOKOSA-N	0	0	350.334	2.826	50	5		FFBARN
COc1ccc(OC[C@@H]2OC(c3ccc([N+](=O)[O-])cc3)=NN2C(C)=O)cc1	ZINC000021092451	507243097	/nfs/dbraw/zinc/24/30/97/507243097.db2.gz	CVLYRTAIOOCHRU-KRWDZBQOSA-N	0	0	371.349	2.549	50	5		FFBARN
CCC(CC)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)N1CCOCC1	ZINC000022966325	507322048	/nfs/dbraw/zinc/32/20/48/507322048.db2.gz	ZUPWBRDXYNGFAJ-QGZVFWFLSA-N	0	0	364.446	2.853	50	5		FFBARN
CN(C)c1ccc(C(=O)N2CCN(Cc3cccs3)CC2)cc1[N+](=O)[O-]	ZINC000023735556	507369744	/nfs/dbraw/zinc/36/97/44/507369744.db2.gz	POFKZYPWLFRYJD-UHFFFAOYSA-N	0	0	374.466	2.680	50	5		FFBARN
Cc1c(C(=O)N2CCC(c3nnc4ccccn43)CC2)cccc1[N+](=O)[O-]	ZINC000024326257	507404850	/nfs/dbraw/zinc/40/48/50/507404850.db2.gz	WXBIFBHTWBSQEC-UHFFFAOYSA-N	0	0	365.393	2.966	50	5		FFBARN
CC(=O)N1c2ccc(C(=O)COc3ccc(C)nc3[N+](=O)[O-])cc2C[C@H]1C	ZINC000024827316	507440229	/nfs/dbraw/zinc/44/02/29/507440229.db2.gz	MITOECOVHJEIAT-GFCCVEGCSA-N	0	0	369.377	2.857	50	5		FFBARN
CCN(CC)S(=O)(=O)c1ccc(OCc2cc(C)no2)c([N+](=O)[O-])c1	ZINC000031076937	507817087	/nfs/dbraw/zinc/81/70/87/507817087.db2.gz	GKKXBQILRJOJEC-UHFFFAOYSA-N	0	0	369.399	2.501	50	5		FFBARN
COCc1cc([N+](=O)[O-])ccc1NC(=O)c1csc(-c2ncccn2)n1	ZINC000079071863	507930580	/nfs/dbraw/zinc/93/05/80/507930580.db2.gz	BKWSYMJIRUQYAQ-UHFFFAOYSA-N	0	0	371.378	2.907	50	5		FFBARN
CC(C)[C@@H](Oc1cccnc1[N+](=O)[O-])C(=O)N1CCc2ccccc2C1	ZINC000073815111	507958223	/nfs/dbraw/zinc/95/82/23/507958223.db2.gz	XIWPNAZWDRIJRW-QGZVFWFLSA-N	0	0	355.394	2.978	50	5		FFBARN
CCOC(=O)Cn1c2ccc([N+](=O)[O-])cc2s/c1=N\C(=O)C(C)(C)C	ZINC000100877339	508240472	/nfs/dbraw/zinc/24/04/72/508240472.db2.gz	NROYTEXHRGNWLP-ICFOKQHNSA-N	0	0	365.411	2.648	50	5		FFBARN
O=C1[C@@H]2ON=C(c3cccc([N+](=O)[O-])c3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000103559618	508317769	/nfs/dbraw/zinc/31/77/69/508317769.db2.gz	ZHUAXXIMKWNYMN-UKRRQHHQSA-N	0	0	371.736	2.541	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@H]1CCO[C@@]2(CCOC2)C1	ZINC000170591476	509673844	/nfs/dbraw/zinc/67/38/44/509673844.db2.gz	RAEGQMANDAUCEC-BONVTDFDSA-N	0	0	355.778	2.708	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CC[C@@H](O)C2)c(OC(F)F)c1Br	ZINC000252495509	509844157	/nfs/dbraw/zinc/84/41/57/509844157.db2.gz	ORWYAKDELHDTCG-ZCFIWIBFSA-N	0	0	353.119	2.530	50	5		FFBARN
O=c1nc2c3ccccc3nc(CSCCO)n2nc1-c1ccccc1	ZINC000253428469	509883062	/nfs/dbraw/zinc/88/30/62/509883062.db2.gz	AORYXNZAZKZUDK-UHFFFAOYSA-N	0	0	364.430	2.530	50	5		FFBARN
C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)NCc1cccc(N(C)C)n1	ZINC000089478866	525988927	/nfs/dbraw/zinc/98/89/27/525988927.db2.gz	FNVWTCMPGXCNOR-LBPRGKRZSA-N	0	0	360.439	2.853	50	5		FFBARN
Cc1ccc2[nH]c(=O)cc(C(=O)OCC(=O)c3ccc([N+](=O)[O-])cc3)c2c1	ZINC000008843230	526095084	/nfs/dbraw/zinc/09/50/84/526095084.db2.gz	UOUSQHGGHVQGPD-UHFFFAOYSA-N	0	0	366.329	2.784	50	5		FFBARN
COc1ccc(C(=O)N2N=C(C)C[C@@]2(O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000000711082	210263720	/nfs/dbraw/zinc/26/37/20/210263720.db2.gz	RFMNLAUYZCITQV-GOSISDBHSA-N	0	0	355.350	2.671	50	5		FFBARN
Cc1nc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)sc1C(=O)N(C)C	ZINC000001112863	219371259	/nfs/dbraw/zinc/37/12/59/219371259.db2.gz	YZGCPFMWCIGAMN-UHFFFAOYSA-N	0	0	368.802	2.967	50	5	aggregator	FFBARN
CCS(=O)(=O)c1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000005241402	219664144	/nfs/dbraw/zinc/66/41/44/219664144.db2.gz	VZOGCQNJJVKYOW-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(N2CCCCCC2)cc1	ZINC000007020478	219787669	/nfs/dbraw/zinc/78/76/69/219787669.db2.gz	MAOQGIAEVKGTOH-UHFFFAOYSA-N	0	0	370.409	2.776	50	5		FFBARN
O=c1c(C(F)(F)F)cccn1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000062579995	212030695	/nfs/dbraw/zinc/03/06/95/212030695.db2.gz	CGCRWPUOXMUVFW-UHFFFAOYSA-N	0	0	366.255	2.874	50	5		FFBARN
COc1cc(/C=C/C(=O)NC[C@@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F	ZINC000012824926	220035070	/nfs/dbraw/zinc/03/50/70/220035070.db2.gz	TZXOEWRVZNDTDO-ZWNMCFTASA-N	0	0	372.324	2.513	50	5		FFBARN
Cc1ccc(C(=O)N[C@@H](Cn2cncn2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000058268376	212001158	/nfs/dbraw/zinc/00/11/58/212001158.db2.gz	FWZAOEZKQBSTKI-INIZCTEOSA-N	0	0	351.366	2.666	50	5		FFBARN
Cc1sc(C(=O)N[C@H](Cn2cncn2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000058251432	212000585	/nfs/dbraw/zinc/00/05/85/212000585.db2.gz	JRLPOEZMINAASO-CYBMUJFWSA-N	0	0	357.395	2.728	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(-n2cncn2)c(F)c1	ZINC000058281599	212002133	/nfs/dbraw/zinc/00/21/33/212002133.db2.gz	QJICIEUVODWSBN-UHFFFAOYSA-N	0	0	370.344	2.633	50	5		FFBARN
Cc1cc([N+](=O)[O-])cc(S(=O)(=O)N(Cc2cnn(C)c2)C(C)C)c1C	ZINC000055299995	211944559	/nfs/dbraw/zinc/94/45/59/211944559.db2.gz	FBERDWHVBCEQRL-UHFFFAOYSA-N	0	0	366.443	2.544	50	5		FFBARN
CN(Cc1nc2ccccc2[nH]1)C(=O)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000028985889	211502275	/nfs/dbraw/zinc/50/22/75/211502275.db2.gz	YVXJMEYIJIXOPW-UHFFFAOYSA-N	0	0	368.349	2.515	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@H](c2nnc3ccccn32)C1	ZINC000027072686	211457879	/nfs/dbraw/zinc/45/78/79/211457879.db2.gz	OMOGZUDGBWJOTM-HNNXBMFYSA-N	0	0	365.393	2.586	50	5		FFBARN
Cc1sc(C(=O)Nc2ccccc2NS(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000024897180	211416127	/nfs/dbraw/zinc/41/61/27/211416127.db2.gz	YYVIIVKYNJTXQC-UHFFFAOYSA-N	0	0	355.397	2.589	50	5		FFBARN
COc1ccc(OC[C@H]2OC(c3ccc([N+](=O)[O-])cc3)=NN2C(C)=O)cc1	ZINC000021092456	211305550	/nfs/dbraw/zinc/30/55/50/211305550.db2.gz	CVLYRTAIOOCHRU-QGZVFWFLSA-N	0	0	371.349	2.549	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCN(C/C=C/c2ccccc2)CC1	ZINC000019536975	211231769	/nfs/dbraw/zinc/23/17/69/211231769.db2.gz	FHTCCXVIZMFBSW-QPJJXVBHSA-N	0	0	365.433	2.995	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1)NCc1ccc(Cn2cccn2)cc1	ZINC000016302244	211159038	/nfs/dbraw/zinc/15/90/38/211159038.db2.gz	UWKRDVLJIMMZRJ-UHFFFAOYSA-N	0	0	366.377	2.535	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000014239574	211087789	/nfs/dbraw/zinc/08/77/89/211087789.db2.gz	HWCXDEVVJCXHBI-INIZCTEOSA-N	0	0	367.405	2.933	50	5		FFBARN
CCN(C[C@@H]1COc2ccccc2O1)C(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000007889630	210758485	/nfs/dbraw/zinc/75/84/85/210758485.db2.gz	SEMNWEJMQKCKDK-MRXNPFEDSA-N	0	0	372.377	2.662	50	5		FFBARN
Cc1ccc(NC(=O)Cn2cnc3cc([N+](=O)[O-])ccc3c2=O)c(C)c1	ZINC000006083212	210655802	/nfs/dbraw/zinc/65/58/02/210655802.db2.gz	GLQRFBRYKBIKAS-UHFFFAOYSA-N	0	0	352.350	2.560	50	5		FFBARN
O=[N+]([O-])c1cc(I)cc(I)c1	ZINC000004830002	210568294	/nfs/dbraw/zinc/56/82/94/210568294.db2.gz	JIVYEUNBDFYQRD-UHFFFAOYSA-N	0	0	374.903	2.804	50	5		FFBARN
O=C(NC[C@@H]1CCCO1)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002843665	210428998	/nfs/dbraw/zinc/42/89/98/210428998.db2.gz	FMMQTKGJDMMCJJ-KRWDZBQOSA-N	0	0	369.377	2.756	50	5		FFBARN
O=C(NCCc1c[nH]c2ccccc12)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000002181374	210381609	/nfs/dbraw/zinc/38/16/09/210381609.db2.gz	JWRKIRHUYDKTTG-UHFFFAOYSA-N	0	0	354.322	2.957	50	5	biogenic	FFBARN
Cc1c([N+](=O)[O-])cc(C(=O)NCCc2nc3ccccc3[nH]2)cc1[N+](=O)[O-]	ZINC000001777888	210369062	/nfs/dbraw/zinc/36/90/62/210369062.db2.gz	OIHSEWGKXSGVDT-UHFFFAOYSA-N	0	0	369.337	2.660	50	5		FFBARN
O=c1c2cc(Br)ccc2nc(-c2ccc([N+](=O)[O-])cc2)n1[O-]	ZINC000001382213	210346187	/nfs/dbraw/zinc/34/61/87/210346187.db2.gz	VLJLVHOWNLXNQR-UHFFFAOYSA-N	0	0	362.139	2.972	50	5		FFBARN
Cc1cccc(-c2nc3s/c(=C\c4cccc([N+](=O)[O-])c4)c(=O)n3n2)c1	ZINC000001314991	210340928	/nfs/dbraw/zinc/34/09/28/210340928.db2.gz	HAGUVVPOKBRARU-GDNBJRDFSA-N	0	0	364.386	2.582	50	5		FFBARN
COc1cc2c(CCN3C(=O)c4ccccc4C3=O)c[nH]c2c([N+](=O)[O-])c1	ZINC000001304460	210340590	/nfs/dbraw/zinc/34/05/90/210340590.db2.gz	RUEQMJSFJFHIAN-UHFFFAOYSA-N	0	0	365.345	2.923	50	5		FFBARN
Cc1cc(=O)oc2cc(OCC(=O)N3CCCCCC3)c([N+](=O)[O-])cc12	ZINC000000937216	210292271	/nfs/dbraw/zinc/29/22/71/210292271.db2.gz	GJTCXBCOKCBXBQ-UHFFFAOYSA-N	0	0	360.366	2.791	50	5		FFBARN
COc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)cc1OC	ZINC000000887180	210287117	/nfs/dbraw/zinc/28/71/17/210287117.db2.gz	CISHSJHQTXNEEY-UHFFFAOYSA-N	0	0	370.317	2.971	50	5		FFBARN
O=C(Oc1cccc(C(=S)N2CCOCC2)c1)c1cccc([N+](=O)[O-])c1	ZINC000000866314	210284159	/nfs/dbraw/zinc/28/41/59/210284159.db2.gz	QZIWAMKUNUXLPB-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
COc1ccc(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c(OC)c1	ZINC000000851732	210280904	/nfs/dbraw/zinc/28/09/04/210280904.db2.gz	JKYZJMPNADPQKV-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)NC[C@@H](C)c1ccccc1	ZINC000022624162	220392310	/nfs/dbraw/zinc/39/23/10/220392310.db2.gz	VMASUPAYLKJTEN-CHWSQXEVSA-N	0	0	371.393	2.642	50	5		FFBARN
C[C@@H](CNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccc1	ZINC000022624164	220392584	/nfs/dbraw/zinc/39/25/84/220392584.db2.gz	VMASUPAYLKJTEN-STQMWFEESA-N	0	0	371.393	2.642	50	5		FFBARN
CN(C)C(=O)C[C@H](NC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000058162210	221100223	/nfs/dbraw/zinc/10/02/23/221100223.db2.gz	CSLQPGJYODGLOK-INIZCTEOSA-N	0	0	356.382	2.936	50	5		FFBARN
COC(=O)[C@@H]1C[C@@H]2CCCC[C@@H]2N1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000062580907	221140142	/nfs/dbraw/zinc/14/01/42/221140142.db2.gz	BRTBDCZMCJQSEH-NUTKFTJISA-N	0	0	358.398	2.708	50	5		FFBARN
O=[N+]([O-])c1ccccc1N1CCN(Cc2ccc3c(c2)OCCO3)CC1	ZINC000095351445	132206953	/nfs/dbraw/zinc/20/69/53/132206953.db2.gz	MZSQKQHDAFHRLF-UHFFFAOYSA-N	0	0	355.394	2.688	50	5		FFBARN
CC(=O)N1CCN(c2ccc([N+](=O)[O-])c(NCCc3ccccc3)c2)CC1	ZINC000004090633	132386352	/nfs/dbraw/zinc/38/63/52/132386352.db2.gz	MXVXCWKKMIMFFZ-UHFFFAOYSA-N	0	0	368.437	2.918	50	5		FFBARN
O=C(N1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(Cl)(Cl)Cl	ZINC000004371889	132823314	/nfs/dbraw/zinc/82/33/14/132823314.db2.gz	VRIFAUAOEHFWIG-UHFFFAOYSA-N	0	0	352.605	2.614	50	5		FFBARN
Cc1cc(N2CCN(Cc3cn4ccccc4n3)CC2)ccc1[N+](=O)[O-]	ZINC000051499444	136124128	/nfs/dbraw/zinc/12/41/28/136124128.db2.gz	HECISLAWTRDJMA-UHFFFAOYSA-N	0	0	351.410	2.873	50	5		FFBARN
COC(=O)[C@@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(O)c1	ZINC000095451200	221905740	/nfs/dbraw/zinc/90/57/40/221905740.db2.gz	KAJUUWKRALPGOD-AWEZNQCLSA-N	0	0	364.741	2.598	50	5		FFBARN
O=C(/C=C/c1ccccc1)NCc1nc(-c2cccc([N+](=O)[O-])c2)no1	ZINC000096277209	222108873	/nfs/dbraw/zinc/10/88/73/222108873.db2.gz	FNAHURGGEQBPLZ-MDZDMXLPSA-N	0	0	350.334	2.974	50	5		FFBARN
CCOC(=O)c1cc2c(nc3c(C)cccn3c2=O)n([C@H](C)CC)c1=N	ZINC000100628087	222248409	/nfs/dbraw/zinc/24/84/09/222248409.db2.gz	ROFHMABAQPCCMX-GFCCVEGCSA-N	0	0	354.410	2.585	50	5		FFBARN
COCCn1c2ccc([N+](=O)[O-])cc2sc1=NC(=O)Cc1ccccc1	ZINC000100872716	222255034	/nfs/dbraw/zinc/25/50/34/222255034.db2.gz	VZSPDSSSUIYYFT-HNENSFHCSA-N	0	0	371.418	2.927	50	5		FFBARN
O=C(N[C@H]1CCOc2ccccc21)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000032722334	506284093	/nfs/dbraw/zinc/28/40/93/506284093.db2.gz	DQJWIRHEHMKXKU-ZDUSSCGKSA-N	0	0	356.334	2.620	50	5		FFBARN
O=[N+]([O-])c1cc(CSc2nnnn2-c2ccccc2)c2c(c1)COCO2	ZINC000002658794	506286241	/nfs/dbraw/zinc/28/62/41/506286241.db2.gz	FMXKNHIIEKHECE-UHFFFAOYSA-N	0	0	371.378	2.729	50	5		FFBARN
O=C(Cn1cnc2cc([N+](=O)[O-])ccc2c1=O)NC1CCCCCCC1	ZINC000003431591	506330808	/nfs/dbraw/zinc/33/08/08/506330808.db2.gz	PQBJREKBVZLZMU-UHFFFAOYSA-N	0	0	358.398	2.534	50	5		FFBARN
CCc1onc(C)c1[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000033087006	506334887	/nfs/dbraw/zinc/33/48/87/506334887.db2.gz	SFTUPLCYUMFZCD-AWEZNQCLSA-N	0	0	365.411	2.979	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@@H]2C)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000004066659	506356814	/nfs/dbraw/zinc/35/68/14/506356814.db2.gz	MPOGNXFBWLAWGZ-DRZCJDIDSA-N	0	0	359.382	2.955	50	5		FFBARN
Cc1cc(C(=O)N2NC(C3CC3)=C[C@]2(O)C(F)(F)F)ccc1[N+](=O)[O-]	ZINC000004178892	506364075	/nfs/dbraw/zinc/36/40/75/506364075.db2.gz	CSSXDVLYMNYVJB-AWEZNQCLSA-N	0	0	357.288	2.766	50	5		FFBARN
Cc1cc(C)n2nc(SCC(=O)Nc3c(C)cccc3[N+](=O)[O-])nc2n1	ZINC000004523445	506380664	/nfs/dbraw/zinc/38/06/64/506380664.db2.gz	LLFOTFJDRDVNEQ-UHFFFAOYSA-N	0	0	372.410	2.689	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCN(Cc2nc(C3CC3)cs2)CC1	ZINC000035596831	506388482	/nfs/dbraw/zinc/38/84/82/506388482.db2.gz	XRPHLXMJYDWKIC-UHFFFAOYSA-N	0	0	372.450	2.887	50	5		FFBARN
O=C(NCc1cccs1)c1cc([N+](=O)[O-])nn1Cc1ccccc1F	ZINC000004772573	506393343	/nfs/dbraw/zinc/39/33/43/506393343.db2.gz	VFXFKJPFSVHKBG-UHFFFAOYSA-N	0	0	360.370	2.970	50	5		FFBARN
COc1ccc2c(c1OC)C(=O)O[C@H]2Nc1ccc([N+](=O)[O-])cc1OC	ZINC000004794601	506395943	/nfs/dbraw/zinc/39/59/43/506395943.db2.gz	XWIVCJAERNSSLQ-MRXNPFEDSA-N	0	0	360.322	2.902	50	5		FFBARN
O=C(Nc1ccc2c[nH]nc2c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004864239	506400374	/nfs/dbraw/zinc/40/03/74/506400374.db2.gz	TWKWEMZPZIAFEL-UHFFFAOYSA-N	0	0	367.365	2.560	50	5		FFBARN
COc1cccc(-c2cc(C(F)(F)F)nc(-n3cnc([N+](=O)[O-])n3)n2)c1	ZINC000004881461	506402805	/nfs/dbraw/zinc/40/28/05/506402805.db2.gz	WXSBWXGPZWGCHF-UHFFFAOYSA-N	0	0	366.259	2.660	50	5		FFBARN
COc1ccccc1N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000036396709	506406914	/nfs/dbraw/zinc/40/69/14/506406914.db2.gz	LNCXKKLBHOUKAR-UHFFFAOYSA-N	0	0	357.410	2.804	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)[C@@H]1CC(=O)O[C@@]12CCOC(C)(C)C2	ZINC000005024678	506416335	/nfs/dbraw/zinc/41/63/35/506416335.db2.gz	WPPNCEUAUFTUKU-SCLBCKFNSA-N	0	0	362.382	2.733	50	5		FFBARN
Cc1ccc(-c2cc(N)n(S(=O)(=O)c3cccc([N+](=O)[O-])c3)n2)cc1	ZINC000005034751	506416823	/nfs/dbraw/zinc/41/68/23/506416823.db2.gz	WPOMGKHHAJJFDY-UHFFFAOYSA-N	0	0	358.379	2.586	50	5		FFBARN
Cc1ccc(-c2nnn(CC(=O)Nc3cc(C)c(C)cc3[N+](=O)[O-])n2)cc1	ZINC000005036524	506417169	/nfs/dbraw/zinc/41/71/69/506417169.db2.gz	MOLYNYHKYACJAH-UHFFFAOYSA-N	0	0	366.381	2.812	50	5		FFBARN
O=C1C[C@]2(CC(c3cccc([N+](=O)[O-])c3)=NO2)C(=O)N1c1ccc(F)cc1	ZINC000005068946	506418805	/nfs/dbraw/zinc/41/88/05/506418805.db2.gz	WCPLZEBZUIBMNC-GOSISDBHSA-N	0	0	369.308	2.561	50	5		FFBARN
CCOC(=O)C[C@@H]1COc2ccccc2N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000005598216	506449067	/nfs/dbraw/zinc/44/90/67/506449067.db2.gz	JHFVDALEAIDZSI-OAHLLOKOSA-N	0	0	370.361	2.956	50	5		FFBARN
C[C@@H](NC(=O)Cn1cc([N+](=O)[O-])cn1)c1ccc(OC(F)(F)F)cc1	ZINC000040074312	506463169	/nfs/dbraw/zinc/46/31/69/506463169.db2.gz	FGZHANYYWGRCFW-SECBINFHSA-N	0	0	358.276	2.567	50	5		FFBARN
O=[N+]([O-])c1ccccc1S(=O)(=O)[N-]c1ccc2c(c1)OCCCO2	ZINC000005985631	506463382	/nfs/dbraw/zinc/46/33/82/506463382.db2.gz	AWAAWOZHGHYGRZ-UHFFFAOYSA-N	0	0	350.352	2.557	50	5		FFBARN
O=C(COc1ccc(-c2nnco2)cc1)Nc1cc([N+](=O)[O-])ccc1F	ZINC000006561700	506488937	/nfs/dbraw/zinc/48/89/37/506488937.db2.gz	MJPGERSQAQIRQL-UHFFFAOYSA-N	0	0	358.285	2.801	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N(CC(C)C)CC(C)C)cc1[N+](=O)[O-]	ZINC000007007541	506526066	/nfs/dbraw/zinc/52/60/66/506526066.db2.gz	BHQGIFJGNYDUKC-UHFFFAOYSA-N	0	0	366.414	2.901	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)COc1cc(F)ccc1[N+](=O)[O-]	ZINC000007159125	506538781	/nfs/dbraw/zinc/53/87/81/506538781.db2.gz	AVZTVIBIXANXHR-NSHDSACASA-N	0	0	373.340	2.877	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)Nc1ccc(N2CCCC2=O)cc1	ZINC000007544386	506569337	/nfs/dbraw/zinc/56/93/37/506569337.db2.gz	OWLJXUHRXZICGR-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2ccc(F)cc2)C1=O	ZINC000008645841	506660918	/nfs/dbraw/zinc/66/09/18/506660918.db2.gz	JYFHXRYGALUOTQ-SFHVURJKSA-N	0	0	373.340	2.580	50	5		FFBARN
O=C(/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2)Nc1nnc(C2CC2)s1	ZINC000009156156	506684788	/nfs/dbraw/zinc/68/47/88/506684788.db2.gz	LGKUNGKZWHZIDW-ONEGZZNKSA-N	0	0	374.378	2.842	50	5		FFBARN
CCOC(=O)c1c(N)c(C(=O)c2cccc([N+](=O)[O-])c2)n2ccccc12	ZINC000009316410	506689653	/nfs/dbraw/zinc/68/96/53/506689653.db2.gz	WDQZWXJAKGBKHT-UHFFFAOYSA-N	0	0	353.334	2.837	50	5		FFBARN
Cc1ccnc(NC(=O)CCCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c1	ZINC000009339372	506691104	/nfs/dbraw/zinc/69/11/04/506691104.db2.gz	ZBGMOKIXCNTKRC-UHFFFAOYSA-N	0	0	356.338	2.625	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)N1CCC[C@H]1c1ccccc1	ZINC000009895297	506715417	/nfs/dbraw/zinc/71/54/17/506715417.db2.gz	XHZDIIOHLQCHLU-KRWDZBQOSA-N	0	0	353.378	2.688	50	5		FFBARN
O=C(NC1CCCCC1)NC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1	ZINC000055409715	506746556	/nfs/dbraw/zinc/74/65/56/506746556.db2.gz	GFXKNFGQJZIMAG-UHFFFAOYSA-N	0	0	374.441	2.831	50	5		FFBARN
Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@H](c1ccsc1)N(C)C	ZINC000046033665	507065881	/nfs/dbraw/zinc/06/58/81/507065881.db2.gz	NGXVFBIZRNBEIY-CQSZACIVSA-N	0	0	369.468	2.546	50	5		FFBARN
CN1CCN(c2ccc(-c3nc(-c4ccco4)no3)cc2[N+](=O)[O-])CC1	ZINC000020898099	507238051	/nfs/dbraw/zinc/23/80/51/507238051.db2.gz	IMGIGVKXMZBOPB-UHFFFAOYSA-N	0	0	355.354	2.657	50	5		FFBARN
Cc1cc(=O)c(C(=O)NC2CCC(C)CC2)nn1-c1ccccc1[N+](=O)[O-]	ZINC000024643337	507425435	/nfs/dbraw/zinc/42/54/35/507425435.db2.gz	LXNVEOQZYJZTSM-UHFFFAOYSA-N	0	0	370.409	2.758	50	5		FFBARN
O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1cccc([N+](=O)[O-])c1	ZINC000048957435	507581925	/nfs/dbraw/zinc/58/19/25/507581925.db2.gz	IBMDWVRNOOQAAP-QGZVFWFLSA-N	0	0	353.378	2.688	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1N(C)C[C@H]1COc2ccccc2O1	ZINC000030681980	507812144	/nfs/dbraw/zinc/81/21/44/507812144.db2.gz	XSBUFIAMLWSYMF-ZDUSSCGKSA-N	0	0	358.350	2.658	50	5		FFBARN
COC(=O)[C@H]1c2ccccc2CCN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000095404774	508184436	/nfs/dbraw/zinc/18/44/36/508184436.db2.gz	UQGIPMSRDJABHI-QGZVFWFLSA-N	0	0	354.362	2.816	50	5		FFBARN
O=C(Nc1ccn(-c2cccc(C(F)(F)F)c2)n1)c1cc([N+](=O)[O-])n[nH]1	ZINC000239527608	509839279	/nfs/dbraw/zinc/83/92/79/509839279.db2.gz	ATKKKBWCIRXHRH-UHFFFAOYSA-N	0	0	366.259	2.775	50	5		FFBARN
CC(=O)NC(=O)c1cc2cc([N+](=O)[O-])ccc2oc1=Nc1cccc(F)c1	ZINC000252677598	509858204	/nfs/dbraw/zinc/85/82/04/509858204.db2.gz	ZGACXOKONRARAS-UHFFFAOYSA-N	0	0	369.308	2.989	50	5		FFBARN
O=[N+]([O-])c1cc(N[C@@H]2C[C@@H](O)[C@@H](O)CO2)cc(Sc2ccccc2)c1	ZINC000217507857	527338763	/nfs/dbraw/zinc/33/87/63/527338763.db2.gz	AQFSCHZBYWUHCK-IKGGRYGDSA-N	0	0	362.407	2.626	50	5	biogenic,in-vitro	FFBARN
Cc1ccc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)cc1-n1cnnn1	ZINC000098006649	1013262792	/nfs/dbraw/zinc/26/27/92/1013262792.db2.gz	BWISWZKADDQIAC-VURMDHGXSA-N	0	0	350.338	2.531	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)NCCc1ccc2c(c1)OCCO2	ZINC000033470258	990332546	/nfs/dbraw/zinc/33/25/46/990332546.db2.gz	WMTVBDBTRWWWMF-ALCCZGGFSA-N	0	0	354.362	2.738	50	5		FFBARN
COC(=O)c1ccccc1NC(=O)/C=C\c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000096878917	1012428888	/nfs/dbraw/zinc/42/88/88/1012428888.db2.gz	BWKUEYZJMFDNIB-SREVYHEPSA-N	0	0	370.317	2.762	50	5		FFBARN
CCOc1ccc(NC(=O)COC(=O)/C=C\c2ccco2)c([N+](=O)[O-])c1	ZINC000034744827	1018703698	/nfs/dbraw/zinc/70/36/98/1018703698.db2.gz	QJCWNMFDBYSREG-VURMDHGXSA-N	0	0	360.322	2.782	50	5		FFBARN
CS(=O)(=O)c1cc([N+](=O)[O-])c(Br)cc1OC(F)(F)F	ZINC000217049296	222669602	/nfs/dbraw/zinc/66/96/02/222669602.db2.gz	SNJGGEKRDSOIGK-UHFFFAOYSA-N	0	0	364.095	2.659	50	5		FFBARN
Nc1ncc(Br)cc1CNc1ncc([N+](=O)[O-])cc1Cl	ZINC000225814610	222871245	/nfs/dbraw/zinc/87/12/45/222871245.db2.gz	MOLIBYHQKOSPAP-UHFFFAOYSA-N	0	0	358.583	2.995	50	5		FFBARN
CN(C)C(=O)N1CCC(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)CC1	ZINC000042391357	211778829	/nfs/dbraw/zinc/77/88/29/211778829.db2.gz	OVLSXMQBKFCNSQ-UHFFFAOYSA-N	0	0	354.794	2.580	50	5		FFBARN
Cc1ccc([C@H](O)CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cc1	ZINC000041467937	211773127	/nfs/dbraw/zinc/77/31/27/211773127.db2.gz	CVLLEUBXKBBBOS-LJQANCHMSA-N	0	0	369.421	2.967	50	5		FFBARN
Cc1c(NC(=O)CN(C)C[C@@H]2COc3ccccc3O2)cccc1[N+](=O)[O-]	ZINC000016629149	220188666	/nfs/dbraw/zinc/18/86/66/220188666.db2.gz	IZRKMCDRNDRTCL-CQSZACIVSA-N	0	0	371.393	2.614	50	5		FFBARN
Cc1ccc(NC(=O)CN(C)C[C@H]2COc3ccccc3O2)c([N+](=O)[O-])c1	ZINC000016629021	220188820	/nfs/dbraw/zinc/18/88/20/220188820.db2.gz	DGBRYFZVVXWHCY-AWEZNQCLSA-N	0	0	371.393	2.614	50	5		FFBARN
O=C(NC1CCN(c2nc3ccccn3c2[N+](=O)[O-])CC1)c1ccccc1	ZINC000032869744	211568921	/nfs/dbraw/zinc/56/89/21/211568921.db2.gz	FFNWACZYKJQINM-UHFFFAOYSA-N	0	0	365.393	2.641	50	5		FFBARN
CC(=O)N1CCC(NC(=O)c2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000032740461	211557459	/nfs/dbraw/zinc/55/74/59/211557459.db2.gz	UVRRWVZHEUZWIL-UHFFFAOYSA-N	0	0	357.366	2.596	50	5		FFBARN
O=[N+]([O-])c1ccc(NC[C@]2(N3CCOCC3)CCSC2)c(Cl)c1	ZINC000029625766	211514998	/nfs/dbraw/zinc/51/49/98/211514998.db2.gz	KEWAEMIWBRFVTD-OAHLLOKOSA-N	0	0	357.863	2.868	50	5		FFBARN
O=C(NC[C@H](c1ccc(F)cc1)N1CCOCC1)c1ccccc1[N+](=O)[O-]	ZINC000023106243	211375567	/nfs/dbraw/zinc/37/55/67/211375567.db2.gz	PFAZKEGDIWUYGC-GOSISDBHSA-N	0	0	373.384	2.537	50	5		FFBARN
COCCN1C(=O)c2[nH]nc(-c3ccco3)c2[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000020728356	211293781	/nfs/dbraw/zinc/29/37/81/211293781.db2.gz	KHYSDGCCUXHNPZ-KRWDZBQOSA-N	0	0	368.349	2.770	50	5		FFBARN
COc1ccccc1C(=O)N1CCN(Cc2ccccc2[N+](=O)[O-])CC1	ZINC000019568787	211234664	/nfs/dbraw/zinc/23/46/64/211234664.db2.gz	SNIQBFQFFDQBKX-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
Cc1onc(C(=O)N2CCSCC2)c1COc1ccc([N+](=O)[O-])cc1	ZINC000013641269	211046599	/nfs/dbraw/zinc/04/65/99/211046599.db2.gz	LNMPHZZVSBGQHG-UHFFFAOYSA-N	0	0	363.395	2.659	50	5		FFBARN
Cc1ccccc1CN(C)C(=O)c1ccc(S(C)(=O)=O)c([N+](=O)[O-])c1	ZINC000013140970	211025968	/nfs/dbraw/zinc/02/59/68/211025968.db2.gz	GRSMWKXOSSZNEY-UHFFFAOYSA-N	0	0	362.407	2.579	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)Oc1ccc2c(c1)CCC(=O)N2	ZINC000012973599	211014063	/nfs/dbraw/zinc/01/40/63/211014063.db2.gz	PUATXPBZPHVJEL-UHFFFAOYSA-N	0	0	362.363	2.556	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)COc1ncnc2ccccc21	ZINC000005504582	210624486	/nfs/dbraw/zinc/62/44/86/210624486.db2.gz	OSZDYQCLKQNFMH-UHFFFAOYSA-N	0	0	354.322	2.564	50	5		FFBARN
CCSc1nnc(NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)s1	ZINC000005199179	210607136	/nfs/dbraw/zinc/60/71/36/210607136.db2.gz	ROJWYGFDNBTDEG-UHFFFAOYSA-N	0	0	353.429	2.877	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1ccc2c(c1)CCC2	ZINC000003556156	210486802	/nfs/dbraw/zinc/48/68/02/210486802.db2.gz	SHFFOVDPHLYJKC-UHFFFAOYSA-N	0	0	353.378	2.842	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1C[C@@H](C)C(=O)Nc1ccc2c(C)cc(=O)oc2c1	ZINC000002792439	210423318	/nfs/dbraw/zinc/42/33/18/210423318.db2.gz	PEPNUZKIIGGHNL-LLVKDONJSA-N	0	0	370.365	2.789	50	5		FFBARN
C[C@H](NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)c1nc2ccccc2[nH]1	ZINC000002332753	210392170	/nfs/dbraw/zinc/39/21/70/210392170.db2.gz	GZSNHBOFBZYOOY-VIFPVBQESA-N	0	0	355.310	2.870	50	5		FFBARN
CCOP(=O)(CC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1)OCC	ZINC000002238678	210384790	/nfs/dbraw/zinc/38/47/90/210384790.db2.gz	NKHHASVMIDJUJI-UHFFFAOYSA-N	0	0	359.271	2.587	50	5		FFBARN
CCOC(=O)c1ccccc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000001774451	210369609	/nfs/dbraw/zinc/36/96/09/210369609.db2.gz	XMARCAMAKFUDRW-UHFFFAOYSA-N	0	0	359.294	2.932	50	5		FFBARN
COc1ccc(CN2CCN(Cc3ccccc3[N+](=O)[O-])CC2)cc1OC	ZINC000001178834	210330804	/nfs/dbraw/zinc/33/08/04/210330804.db2.gz	LRQSBCVLDRWODQ-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
CC(C)NS(=O)(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000001076790	210313809	/nfs/dbraw/zinc/31/38/09/210313809.db2.gz	JPFFICDRTSCXGY-UHFFFAOYSA-N	0	0	363.395	2.534	50	5		FFBARN
C[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000001025702	210302999	/nfs/dbraw/zinc/30/29/99/210302999.db2.gz	YVYVINMYBSLRMG-ZMZPIMSZSA-N	0	0	372.333	2.815	50	5		FFBARN
Cc1c([N+](=O)[O-])c(C(=O)Nc2ccc(C)cc2Br)nn1C	ZINC000001002161	210299963	/nfs/dbraw/zinc/29/99/63/210299963.db2.gz	LRZDLHSLVBFKDW-UHFFFAOYSA-N	0	0	353.176	2.960	50	5		FFBARN
O=C(NCCOc1ccc2c(c1)OCO2)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000022480550	220388952	/nfs/dbraw/zinc/38/89/52/220388952.db2.gz	DFDGJGKUHPJWDU-UHFFFAOYSA-N	0	0	364.741	2.786	50	5		FFBARN
Cn1ccnc1C(=O)c1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1	ZINC000024596569	220452518	/nfs/dbraw/zinc/45/25/18/220452518.db2.gz	SIPQOXOABRDWOP-UHFFFAOYSA-N	0	0	364.361	2.741	50	5		FFBARN
O=[N+]([O-])c1c(Nc2ccc(N3CCCS3(=O)=O)cc2)nc2ccccn21	ZINC000026710820	220519832	/nfs/dbraw/zinc/51/98/32/220519832.db2.gz	QXVNJLCYFOUWDN-UHFFFAOYSA-N	0	0	373.394	2.526	50	5		FFBARN
COC(=O)Nc1ccc(CNC(=O)CCNc2ccccc2[N+](=O)[O-])cc1	ZINC000032935167	220701572	/nfs/dbraw/zinc/70/15/72/220701572.db2.gz	HXTYHRDHTAIPEO-UHFFFAOYSA-N	0	0	372.381	2.892	50	5		FFBARN
Cc1c(C(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-]	ZINC000065523922	221229318	/nfs/dbraw/zinc/22/93/18/221229318.db2.gz	UHUNUHLDKDLQHK-KRWDZBQOSA-N	0	0	353.378	2.607	50	5		FFBARN
O=C(N[C@@H]1C[C@@H]1c1cccc(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000067092486	221247689	/nfs/dbraw/zinc/24/76/89/221247689.db2.gz	ZKAHCVKFLOWEGX-TZMCWYRMSA-N	0	0	358.325	2.791	50	5		FFBARN
O=C(Nc1cc(F)cc(F)c1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000004668088	132387016	/nfs/dbraw/zinc/38/70/16/132387016.db2.gz	KKYHNEJSIGUVTN-UHFFFAOYSA-N	0	0	363.320	2.962	50	5		FFBARN
COc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC[C@@H](C)C3)n2)c1	ZINC000009287318	132845043	/nfs/dbraw/zinc/84/50/43/132845043.db2.gz	QNQDZMIKRKEKIE-LLVKDONJSA-N	0	0	358.402	2.956	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cn2)C1	ZINC000047254701	136122689	/nfs/dbraw/zinc/12/26/89/136122689.db2.gz	CXEJXUSHYUGXQS-LLVKDONJSA-N	0	0	361.789	2.893	50	5		FFBARN
O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CCS(=O)(=O)CC1	ZINC000057839957	136130130	/nfs/dbraw/zinc/13/01/30/136130130.db2.gz	COEOBIYPODHOFA-UHFFFAOYSA-N	0	0	358.725	2.502	50	5		FFBARN
CCOC(=O)c1cc([N+](=O)[O-])ccc1N1CCN(c2ccccc2O)CC1	ZINC000068873668	136137972	/nfs/dbraw/zinc/13/79/72/136137972.db2.gz	IXDGSVSNLJFITJ-UHFFFAOYSA-N	0	0	371.393	2.804	50	5		FFBARN
CCCOc1cc(NS(=O)(=O)c2ccc(N)cc2)cc([N+](=O)[O-])c1	ZINC000096319151	222114441	/nfs/dbraw/zinc/11/44/41/222114441.db2.gz	IOOVWKCMWKTAGE-UHFFFAOYSA-N	0	0	351.384	2.767	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1cccc(Cl)c1	ZINC000100905211	222256282	/nfs/dbraw/zinc/25/62/82/222256282.db2.gz	GHCHCBRODQXBLY-HIFRSBDPSA-N	0	0	371.736	2.541	50	5		FFBARN
Cc1ncc([N+](=O)[O-])n1CCSc1nnnn1-c1ccccc1Cl	ZINC000001135793	506249343	/nfs/dbraw/zinc/24/93/43/506249343.db2.gz	JPXRROIMZVFJFZ-UHFFFAOYSA-N	0	0	365.806	2.521	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CCN2C(C)=O	ZINC000032744511	506290138	/nfs/dbraw/zinc/29/01/38/506290138.db2.gz	ZPZLMDSXQABYEW-UHFFFAOYSA-N	0	0	355.350	2.765	50	5		FFBARN
O=C(NCc1ccccc1Cl)[C@@H]1CC(=O)N(c2cccc([N+](=O)[O-])c2)C1	ZINC000002943488	506304173	/nfs/dbraw/zinc/30/41/73/506304173.db2.gz	LOHBODDNWAYKQV-CYBMUJFWSA-N	0	0	373.796	2.918	50	5		FFBARN
CCOc1cc(C=O)ccc1OS(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000002984658	506305263	/nfs/dbraw/zinc/30/52/63/506305263.db2.gz	PYLTWQWPPRNEAL-UHFFFAOYSA-N	0	0	351.336	2.574	50	5		FFBARN
Cc1cc2ccccc2n1CC(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000053275090	506346438	/nfs/dbraw/zinc/34/64/38/506346438.db2.gz	SGYBPUFNOYTURJ-SFHVURJKSA-N	0	0	353.378	2.708	50	5		FFBARN
COC(=O)c1ccc(NS(=O)(=O)c2cc([N+](=O)[O-])c(C)cc2C)cc1	ZINC000004263273	506368456	/nfs/dbraw/zinc/36/84/56/506368456.db2.gz	BKDQBVAUBLOYDY-UHFFFAOYSA-N	0	0	364.379	2.799	50	5		FFBARN
CC(=O)Nc1ccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)cc1	ZINC000004331238	506373325	/nfs/dbraw/zinc/37/33/25/506373325.db2.gz	UILQGZNPRZDMOC-UHFFFAOYSA-N	0	0	353.342	2.581	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)c3cccc([N+](=O)[O-])c3C)CC2=O)cc1	ZINC000004496975	506377925	/nfs/dbraw/zinc/37/79/25/506377925.db2.gz	IJNAQBVGUSJWIQ-CQSZACIVSA-N	0	0	353.378	2.747	50	5		FFBARN
O=C(Nc1ccc2[nH]c(=O)[nH]c2c1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000004677714	506388735	/nfs/dbraw/zinc/38/87/35/506388735.db2.gz	NWDFJWRJLFKXRQ-UHFFFAOYSA-N	0	0	367.365	2.617	50	5		FFBARN
Nc1ccc(C(=O)OCC(=O)N[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	ZINC000004869353	506400998	/nfs/dbraw/zinc/40/09/98/506400998.db2.gz	UBLHRGKGNJHOGP-INIZCTEOSA-N	0	0	369.377	2.528	50	5		FFBARN
Cc1ccc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)cc1	ZINC000004900098	506404561	/nfs/dbraw/zinc/40/45/61/506404561.db2.gz	KDUFLICVOCFXBO-UHFFFAOYSA-N	0	0	355.394	2.670	50	5		FFBARN
Cc1noc2nc(-c3cccc([N+](=O)[O-])c3)cc(C(=O)N3CCOCC3)c12	ZINC000036618416	506408479	/nfs/dbraw/zinc/40/84/79/506408479.db2.gz	SSELLZHLAIOGOH-UHFFFAOYSA-N	0	0	368.349	2.579	50	5		FFBARN
C[C@H]1CCN2c3ccc([N+](=O)[O-])cc3CC3(C(=O)OC(C)(C)OC3=O)[C@@H]2C1	ZINC000005425032	506441298	/nfs/dbraw/zinc/44/12/98/506441298.db2.gz	ACHWJVLPCCQNFU-NHYWBVRUSA-N	0	0	374.393	2.578	50	5		FFBARN
Cn1c2ccccc2c(N2CCN(c3ccccc3)CC2)c([N+](=O)[O-])c1=O	ZINC000005516055	506446265	/nfs/dbraw/zinc/44/62/65/506446265.db2.gz	JAYUXOZIOMNQSZ-UHFFFAOYSA-N	0	0	364.405	2.773	50	5		FFBARN
COc1ccc(CC(=O)OCc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)cc1	ZINC000005937796	506460819	/nfs/dbraw/zinc/46/08/19/506460819.db2.gz	MEWKAQRZAYNODT-UHFFFAOYSA-N	0	0	369.333	2.939	50	5		FFBARN
C[C@H]1CCN(C(=O)Cn2cc([N+](=O)[O-])ccc2=O)c2ccccc2S1	ZINC000006119859	506468100	/nfs/dbraw/zinc/46/81/00/506468100.db2.gz	WKFMCUDMOTZUJS-LBPRGKRZSA-N	0	0	359.407	2.674	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000006219949	506471515	/nfs/dbraw/zinc/47/15/15/506471515.db2.gz	RKNBAVFJIFKPLP-UHFFFAOYSA-N	0	0	360.322	2.651	50	5		FFBARN
O=C(NCc1ccccc1)c1cccn2c(=O)c3cc4c(cc3nc12)OCO4	ZINC000006918941	506517065	/nfs/dbraw/zinc/51/70/65/506517065.db2.gz	XNZMCWDQNYIARQ-UHFFFAOYSA-N	0	0	373.368	2.506	50	5		FFBARN
COc1ccccc1C(=O)NCCC(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000006948263	506519124	/nfs/dbraw/zinc/51/91/24/506519124.db2.gz	YWIFUQQDBWLUDG-UHFFFAOYSA-N	0	0	361.329	2.501	50	5		FFBARN
C[C@@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1cccc([N+](=O)[O-])c1	ZINC000007116089	506535368	/nfs/dbraw/zinc/53/53/68/506535368.db2.gz	KENHKOBTBRXPQP-GFCCVEGCSA-N	0	0	354.366	2.771	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccccc1[N+](=O)[O-]	ZINC000007169332	506540397	/nfs/dbraw/zinc/54/03/97/506540397.db2.gz	BEVQSYZHIPLEDZ-LBPRGKRZSA-N	0	0	355.350	2.738	50	5		FFBARN
COc1ccc(S(=O)(=O)Nc2ccc(F)c([N+](=O)[O-])c2)cc1OC	ZINC000007405694	506559873	/nfs/dbraw/zinc/55/98/73/506559873.db2.gz	VKZFWEVPJAIIDZ-UHFFFAOYSA-N	0	0	356.331	2.552	50	5		FFBARN
COc1cc2c(cc1OC)CN(c1nc3sccn3c1[N+](=O)[O-])CC2	ZINC000008318578	506641318	/nfs/dbraw/zinc/64/13/18/506641318.db2.gz	QHSFMCBBMMRROV-UHFFFAOYSA-N	0	0	360.395	2.884	50	5		FFBARN
COC(=O)c1scc([N+](=O)[O-])c1-c1c([N+](=O)[O-])csc1C(=O)OC	ZINC000008431228	506651231	/nfs/dbraw/zinc/65/12/31/506651231.db2.gz	KCCWYZAUZHHJSK-UHFFFAOYSA-N	0	0	372.336	2.866	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)N3C[C@@H](C)O[C@H](C)C3)cc2)c(C)c1[N+](=O)[O-]	ZINC000008883720	506671953	/nfs/dbraw/zinc/67/19/53/506671953.db2.gz	QBNSSDGKSSNULY-CHWSQXEVSA-N	0	0	372.425	2.706	50	5		FFBARN
COc1cc(CSc2nnc(C)n2C)c([N+](=O)[O-])cc1OC(F)F	ZINC000009726370	506710484	/nfs/dbraw/zinc/71/04/84/506710484.db2.gz	MPUNNFHEGYZXJR-UHFFFAOYSA-N	0	0	360.342	2.934	50	5		FFBARN
O=C(CNC(=O)c1cccc([N+](=O)[O-])c1)Nc1ccc(N2CCCC2)cc1	ZINC000010430205	506743076	/nfs/dbraw/zinc/74/30/76/506743076.db2.gz	ANGXDEKKDNLAJT-UHFFFAOYSA-N	0	0	368.393	2.564	50	5		FFBARN
COc1ccc(-c2nonc2NC(=O)c2cccc([N+](=O)[O-])c2)cc1OC	ZINC000011913835	506803902	/nfs/dbraw/zinc/80/39/02/506803902.db2.gz	BNSPJDXTIBQXKY-UHFFFAOYSA-N	0	0	370.321	2.914	50	5		FFBARN
COc1ccc(NC(=O)[C@@]2(C)Cc3ccccc3C(=O)O2)c([N+](=O)[O-])c1	ZINC000012292945	506845264	/nfs/dbraw/zinc/84/52/64/506845264.db2.gz	HWPKHOXDOFYEDE-GOSISDBHSA-N	0	0	356.334	2.714	50	5		FFBARN
O=C(CN1CCC([C@H](O)c2ccccc2)CC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000012745625	506893947	/nfs/dbraw/zinc/89/39/47/506893947.db2.gz	RBIAPBJCAPVDGO-HXUWFJFHSA-N	0	0	369.421	2.979	50	5		FFBARN
O=C(CCn1nc(-c2cccs2)oc1=O)Nc1cccc([N+](=O)[O-])c1	ZINC000012808605	506904595	/nfs/dbraw/zinc/90/45/95/506904595.db2.gz	OWHUYPPIPKGWAB-UHFFFAOYSA-N	0	0	360.351	2.502	50	5		FFBARN
O=[N+]([O-])c1ccccc1NCCNS(=O)(=O)c1ccc(F)c(Cl)c1	ZINC000017333107	507122265	/nfs/dbraw/zinc/12/22/65/507122265.db2.gz	BRFULBDRYGWVTE-UHFFFAOYSA-N	0	0	373.793	2.778	50	5		FFBARN
CCN(CC)C(=O)c1ccccc1NCc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000058178002	507380600	/nfs/dbraw/zinc/38/06/00/507380600.db2.gz	NXYGCRCBNMARCI-UHFFFAOYSA-N	0	0	370.409	2.788	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])N1CCC[C@@H]1C(=O)Nc1ccccc1	ZINC000024984848	507454053	/nfs/dbraw/zinc/45/40/53/507454053.db2.gz	RWYLASQGIZNBJY-MRXNPFEDSA-N	0	0	369.377	2.603	50	5		FFBARN
COCCNc1ccc([N+](=O)[O-])cc1C(=O)N1CCc2sccc2C1	ZINC000025325303	507489809	/nfs/dbraw/zinc/48/98/09/507489809.db2.gz	OZYWPVCQCRPVQF-UHFFFAOYSA-N	0	0	361.423	2.913	50	5		FFBARN
CS(=O)(=O)c1ccc(C(=O)N2CCCCc3ccccc32)cc1[N+](=O)[O-]	ZINC000049726910	507635566	/nfs/dbraw/zinc/63/55/66/507635566.db2.gz	RKCXPVKJKOBHPM-UHFFFAOYSA-N	0	0	374.418	2.981	50	5		FFBARN
COC(=O)[C@@H]1CCC[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000079066048	507929901	/nfs/dbraw/zinc/92/99/01/507929901.db2.gz	HAFUARRUPOPNEI-ZJUUUORDSA-N	0	0	373.312	2.659	50	5		FFBARN
COC(=O)c1ccc(N[C@H]2CCc3nc(C(C)C)nn3C2)c([N+](=O)[O-])c1	ZINC000225384563	509368659	/nfs/dbraw/zinc/36/86/59/509368659.db2.gz	BSLJFLGXHIDATC-LBPRGKRZSA-N	0	0	359.386	2.523	50	5		FFBARN
Cc1c([N+](=O)[O-])ccc(F)c1NS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000225708025	509383383	/nfs/dbraw/zinc/38/33/83/509383383.db2.gz	GCOHWULTZHLYCU-UHFFFAOYSA-N	0	0	355.303	2.751	50	5		FFBARN
COc1cccc(OC)c1Sc1nc2ccccn2c(=O)c1[N+](=O)[O-]	ZINC000170606343	509677825	/nfs/dbraw/zinc/67/78/25/509677825.db2.gz	REUKSUUIZJPYME-UHFFFAOYSA-N	0	0	359.363	2.771	50	5		FFBARN
COc1ccc(NCc2ccc(C(N)=O)cc2[N+](=O)[O-])cc1OC(F)F	ZINC000044758806	570898965	/nfs/dbraw/zinc/89/89/65/570898965.db2.gz	ONDDSXDVQMZSFA-UHFFFAOYSA-N	0	0	367.308	2.916	50	5		FFBARN
COc1cc(C)nc(N2C(=O)c3cccc4c([N+](=O)[O-])ccc(c43)C2=O)n1	ZINC000824541294	999227406	/nfs/dbraw/zinc/22/74/06/999227406.db2.gz	UXIIUJLNQJKJEJ-UHFFFAOYSA-N	0	0	364.317	2.656	50	5		FFBARN
O=c1[nH]c2ccccc2nc1/C=C\c1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000096919810	1012457729	/nfs/dbraw/zinc/45/77/29/1012457729.db2.gz	CULCUUBQPMUEKI-WAYWQWQTSA-N	0	0	351.318	2.868	50	5		FFBARN
COc1cc(/C=C\C(=O)Nc2ccn(C)n2)c([N+](=O)[O-])cc1OC(F)F	ZINC000096935590	1012470875	/nfs/dbraw/zinc/47/08/75/1012470875.db2.gz	XKAVQBSSDJNORE-ARJAWSKDSA-N	0	0	368.296	2.590	50	5		FFBARN
CN1CCCN(C[C@H](O)COc2cccc([N+](=O)[O-])c2)c2ccccc21	ZINC000170634522	222610105	/nfs/dbraw/zinc/61/01/05/222610105.db2.gz	PHAGQYLSRDGKRY-INIZCTEOSA-N	0	0	357.410	2.681	50	5		FFBARN
Cc1cc(NC(=O)CSc2nccn2-c2ccc([N+](=O)[O-])cc2)no1	ZINC000002468359	219446178	/nfs/dbraw/zinc/44/61/78/219446178.db2.gz	DJABOXNFCHUEBL-UHFFFAOYSA-N	0	0	359.367	2.808	50	5		FFBARN
O=C(NC[C@H]1CC(=O)N(c2ccc(Cl)cc2)C1)c1ccc([N+](=O)[O-])o1	ZINC000008985023	219873083	/nfs/dbraw/zinc/87/30/83/219873083.db2.gz	UNUCUPKQIRPWIE-SNVBAGLBSA-N	0	0	363.757	2.624	50	5		FFBARN
Cc1c(NC(=O)CN(C)C[C@H]2COc3ccccc3O2)cccc1[N+](=O)[O-]	ZINC000016629151	220189264	/nfs/dbraw/zinc/18/92/64/220189264.db2.gz	IZRKMCDRNDRTCL-AWEZNQCLSA-N	0	0	371.393	2.614	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)NCc1ccccc1Cn1ccnc1	ZINC000032902835	211571270	/nfs/dbraw/zinc/57/12/70/211571270.db2.gz	SGXVLKXKBWSBOV-UHFFFAOYSA-N	0	0	365.393	2.811	50	5		FFBARN
O=C(NCc1ccc(C(=O)N2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000025326932	211429074	/nfs/dbraw/zinc/42/90/74/211429074.db2.gz	UXXFXLAMJUTGHN-UHFFFAOYSA-N	0	0	353.378	2.761	50	5		FFBARN
CC[C@@H]1CN(C(=O)Cn2c3ccccc3c(=O)c3ccccc32)CCO1	ZINC000023894137	211397426	/nfs/dbraw/zinc/39/74/26/211397426.db2.gz	QWGCSWMDKVRYCC-OAHLLOKOSA-N	0	0	350.418	2.792	50	5		FFBARN
Cc1ccc(NC(=O)[C@H](c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	ZINC000022028043	211335784	/nfs/dbraw/zinc/33/57/84/211335784.db2.gz	VJXJVGFTMDIEQI-SFHVURJKSA-N	0	0	355.394	2.915	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1	ZINC000020895549	211299604	/nfs/dbraw/zinc/29/96/04/211299604.db2.gz	BJXLKFMVYHTHBP-HNNXBMFYSA-N	0	0	374.378	2.856	50	5		FFBARN
O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)NCCc1ccccc1	ZINC000015987791	211151621	/nfs/dbraw/zinc/15/16/21/211151621.db2.gz	QPMOIIUXQNCCII-UHFFFAOYSA-N	0	0	356.407	2.922	50	5		FFBARN
COC(=O)c1cc(C(=O)N(C)Cc2cccc(OC)c2)cc([N+](=O)[O-])c1	ZINC000015354709	211126552	/nfs/dbraw/zinc/12/65/52/211126552.db2.gz	ZXYDWQSSOWJNDL-UHFFFAOYSA-N	0	0	358.350	2.662	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(N2CCCC2=O)cc1	ZINC000014216033	211086014	/nfs/dbraw/zinc/08/60/14/211086014.db2.gz	PEAKPAUBGDWZFD-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
Cc1cc(C(=O)NC[C@H](c2ccccc2)N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000013012392	211021295	/nfs/dbraw/zinc/02/12/95/211021295.db2.gz	LBQHNOACDHSBFA-LJQANCHMSA-N	0	0	369.421	2.707	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OCC(=O)c2c[nH]c(C(=O)N3CCCC3)c2)c1	ZINC000012877843	211001841	/nfs/dbraw/zinc/00/18/41/211001841.db2.gz	YYIPOAPZQYRTEG-UHFFFAOYSA-N	0	0	357.366	2.729	50	5		FFBARN
COC(=O)c1cc(NC(=O)COc2ccccc2[N+](=O)[O-])c(F)cc1F	ZINC000012796982	210994954	/nfs/dbraw/zinc/99/49/54/210994954.db2.gz	MXJMXBIOIYPKHA-UHFFFAOYSA-N	0	0	366.276	2.677	50	5		FFBARN
CC(C)n1nnnc1S[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000012796092	210993772	/nfs/dbraw/zinc/99/37/72/210993772.db2.gz	FWOODOMMPJSBAC-MRVPVSSYSA-N	0	0	370.822	2.935	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)[C@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000009872459	210854772	/nfs/dbraw/zinc/85/47/72/210854772.db2.gz	KDQXGJOFPDSXPH-LBPRGKRZSA-N	0	0	356.334	2.981	50	5		FFBARN
O=c1c(-c2ccccc2)nnc2sc(-c3cccc([N+](=O)[O-])c3)nn21	ZINC000008393688	210784796	/nfs/dbraw/zinc/78/47/96/210784796.db2.gz	CSAMCMLFZGQZGD-UHFFFAOYSA-N	0	0	351.347	2.788	50	5		FFBARN
NC(=O)COC(=O)c1ccc(Sc2ccc(F)cc2)c([N+](=O)[O-])c1	ZINC000007002978	210723644	/nfs/dbraw/zinc/72/36/44/210723644.db2.gz	OSIDXZMUOZWTCA-UHFFFAOYSA-N	0	0	350.327	2.527	50	5		FFBARN
CCOC(=O)CN1C(=O)S/C(=C/c2cc([N+](=O)[O-])ccc2Cl)C1=O	ZINC000004694629	210553967	/nfs/dbraw/zinc/55/39/67/210553967.db2.gz	QDXIARCHQRYFLK-IZZDOVSWSA-N	0	0	370.770	2.848	50	5		FFBARN
O=[N+]([O-])c1cc(NS(=O)(=O)c2ccc3c(c2)OCCCO3)ccc1F	ZINC000003399203	210473763	/nfs/dbraw/zinc/47/37/63/210473763.db2.gz	XWJGBHHMPXGZMH-UHFFFAOYSA-N	0	0	368.342	2.696	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1CCNC(=S)Nc1ccccc1OC(F)F	ZINC000002728248	210416902	/nfs/dbraw/zinc/41/69/02/210416902.db2.gz	POZNPLOUDUCREZ-UHFFFAOYSA-N	0	0	371.369	2.688	50	5		FFBARN
CCCOC(=O)c1ccc2c(c1)C(=O)N(c1cccc([N+](=O)[O-])c1)C2=O	ZINC000002062750	210377987	/nfs/dbraw/zinc/37/79/87/210377987.db2.gz	HKJSYQBWZHJHMJ-UHFFFAOYSA-N	0	0	354.318	2.962	50	5		FFBARN
COc1ccc2[nH]cc(CCN3C(=O)c4cccc([N+](=O)[O-])c4C3=O)c2c1	ZINC000002204753	210383469	/nfs/dbraw/zinc/38/34/69/210383469.db2.gz	APFPVFXWFVTEMN-UHFFFAOYSA-N	0	0	365.345	2.923	50	5		FFBARN
CCc1nc2oc3cc(OC)ccc3c(=O)c2c(=O)n1Cc1ccco1	ZINC000002198264	210382892	/nfs/dbraw/zinc/38/28/92/210382892.db2.gz	BKAPQHUNEAUVSH-UHFFFAOYSA-N	0	0	352.346	2.715	50	5		FFBARN
CC(=O)Nc1ccccc1C(=O)OCC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000001858835	210372396	/nfs/dbraw/zinc/37/23/96/210372396.db2.gz	IDDACQXORKKQSH-UHFFFAOYSA-N	0	0	356.334	2.901	50	5		FFBARN
CCCN1c2ccccc2[C@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000001130028	210321488	/nfs/dbraw/zinc/32/14/88/210321488.db2.gz	JOGBLIXRZSBREG-LJQANCHMSA-N	0	0	354.362	2.812	50	5		FFBARN
COc1ccccc1NC(=O)Cn1nc([N+](=O)[O-])c(Br)c1C	ZINC000001068959	210312560	/nfs/dbraw/zinc/31/25/60/210312560.db2.gz	GCOIFZPDHXLLFA-UHFFFAOYSA-N	0	0	369.175	2.510	50	5		FFBARN
Cc1cc(C)cc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000000850455	210280787	/nfs/dbraw/zinc/28/07/87/210280787.db2.gz	MIJLYXYYCZIKER-UHFFFAOYSA-N	0	0	367.361	2.836	50	5		FFBARN
CCc1ccccc1NC(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000000850456	210280186	/nfs/dbraw/zinc/28/01/86/210280186.db2.gz	HJFYMVSMAPBPOT-UHFFFAOYSA-N	0	0	367.361	2.782	50	5		FFBARN
C[C@H](OC(=O)CSc1ccc([N+](=O)[O-])cc1)C(=O)N1CCC(C)CC1	ZINC000009352474	210273140	/nfs/dbraw/zinc/27/31/40/210273140.db2.gz	AXLBDAUGIXOSCB-ZDUSSCGKSA-N	0	0	366.439	2.877	50	5		FFBARN
C[C@H](Oc1ccc(Cl)cc1)C(=O)NC[C@@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032999817	220708503	/nfs/dbraw/zinc/70/85/03/220708503.db2.gz	RNRXZSOEXYIMOG-MEDUHNTESA-N	0	0	364.785	2.865	50	5		FFBARN
Nc1nccc([C@@H]2CCCN(c3ccc4ncccc4c3[N+](=O)[O-])C2)n1	ZINC000170616223	132264756	/nfs/dbraw/zinc/26/47/56/132264756.db2.gz	GMVVDXBMOXVDST-GFCCVEGCSA-N	0	0	350.382	2.899	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccc(Cl)nn3)CC2)cc1NC1CC1	ZINC000004091919	132386356	/nfs/dbraw/zinc/38/63/56/132386356.db2.gz	LSANJHICYUOMAV-UHFFFAOYSA-N	0	0	374.832	2.939	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@@H](C)O[C@H](C)C3)nc(N)c2[N+](=O)[O-])cc1	ZINC000004305899	132386654	/nfs/dbraw/zinc/38/66/54/132386654.db2.gz	MOHGDLGFZCYOFA-VXGBXAGGSA-N	0	0	358.402	2.633	50	5		FFBARN
CNc1cc(N2CCN(C(=O)c3ccc(OC)cc3)CC2)ccc1[N+](=O)[O-]	ZINC000004311943	132386810	/nfs/dbraw/zinc/38/68/10/132386810.db2.gz	VBUMZXDOJRETGM-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
CN(Cc1ccccc1N1CCOCC1)C(=O)c1ccccc1[N+](=O)[O-]	ZINC000024191499	132910642	/nfs/dbraw/zinc/91/06/42/132910642.db2.gz	WELUAALLSZMUGD-UHFFFAOYSA-N	0	0	355.394	2.704	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)[C@@H]1CCCN(c2ncccc2[N+](=O)[O-])C1	ZINC000047254607	136122683	/nfs/dbraw/zinc/12/26/83/136122683.db2.gz	RUGQCLOPRATAQH-LLVKDONJSA-N	0	0	361.789	2.893	50	5		FFBARN
O=C(Cn1ccc2ccccc21)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000032070927	506227857	/nfs/dbraw/zinc/22/78/57/506227857.db2.gz	ZEYYQBBACFOGSI-UHFFFAOYSA-N	0	0	364.405	2.898	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)N(C)c3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000032769189	506293473	/nfs/dbraw/zinc/29/34/73/506293473.db2.gz	RQTLYFPQIMGMPR-CYBMUJFWSA-N	0	0	369.377	2.619	50	5		FFBARN
Cc1cc(NC(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)no1	ZINC000002866235	506298374	/nfs/dbraw/zinc/29/83/74/506298374.db2.gz	WRBNRGGGQOYZRB-UHFFFAOYSA-N	0	0	361.339	2.672	50	5		FFBARN
CCOC(=O)CSc1ccc(C(=O)N2CCCCC2)cc1[N+](=O)[O-]	ZINC000003020312	506306482	/nfs/dbraw/zinc/30/64/82/506306482.db2.gz	JAJIBRRFPNTGOL-UHFFFAOYSA-N	0	0	352.412	2.876	50	5		FFBARN
CC(C)CC[C@H](C)NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000032895368	506307708	/nfs/dbraw/zinc/30/77/08/506307708.db2.gz	OOMOHJAYGPKCNF-LBPRGKRZSA-N	0	0	372.443	2.859	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000003092317	506309503	/nfs/dbraw/zinc/30/95/03/506309503.db2.gz	YMUNHWZQVPHLKF-MRXNPFEDSA-N	0	0	356.294	2.742	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000003244989	506315093	/nfs/dbraw/zinc/31/50/93/506315093.db2.gz	RHTBBFYTGCNDIJ-MRXNPFEDSA-N	0	0	354.362	2.687	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1cc([N+](=O)[O-])ccc1Cl	ZINC000003264127	506316244	/nfs/dbraw/zinc/31/62/44/506316244.db2.gz	CMGIJBOQYXTBNQ-UHFFFAOYSA-N	0	0	369.673	2.545	50	5		FFBARN
O=C(Nc1cccc2c1C(=O)NC2=O)c1cc2cc([N+](=O)[O-])ccc2s1	ZINC000004078786	506356246	/nfs/dbraw/zinc/35/62/46/506356246.db2.gz	FVHJAVCXENAJOF-UHFFFAOYSA-N	0	0	367.342	2.945	50	5		FFBARN
COC(=O)[C@H]1Cc2c3ccccc3[nH]c2[C@@H](c2ccc([N+](=O)[O-])cc2)N1	ZINC000034792226	506370059	/nfs/dbraw/zinc/37/00/59/506370059.db2.gz	PMTFLAWFQMHLPS-IAGOWNOFSA-N	0	0	351.362	2.853	50	5		FFBARN
C[C@H]1CC(=O)N(c2ccc(NCCc3ccccn3)c([N+](=O)[O-])c2)C1=O	ZINC000004684330	506388561	/nfs/dbraw/zinc/38/85/61/506388561.db2.gz	IUGRUUIVGOQHNP-LBPRGKRZSA-N	0	0	354.366	2.544	50	5		FFBARN
COCCNC(=O)c1sc2nc(-c3cccc([N+](=O)[O-])c3)cn2c1C	ZINC000004931081	506406543	/nfs/dbraw/zinc/40/65/43/506406543.db2.gz	MVNMBFWAYYQHHC-UHFFFAOYSA-N	0	0	360.395	2.656	50	5		FFBARN
COc1cccc(N2C[C@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)c1	ZINC000005028128	506415477	/nfs/dbraw/zinc/41/54/77/506415477.db2.gz	HBRDOGLWOVYKGX-GFCCVEGCSA-N	0	0	355.350	2.595	50	5		FFBARN
O=C(Cn1c(=O)oc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]1c1cccs1	ZINC000036735380	506416585	/nfs/dbraw/zinc/41/65/85/506416585.db2.gz	QRMSKZNRBIVRRH-LBPRGKRZSA-N	0	0	373.390	2.928	50	5		FFBARN
COCCn1c2nc3ccccc3nc2c2c1nc(C)n(CC(C)C)c2=O	ZINC000005065409	506418721	/nfs/dbraw/zinc/41/87/21/506418721.db2.gz	CMXDBENZJGFOLP-UHFFFAOYSA-N	0	0	365.437	2.905	50	5		FFBARN
O=C(Oc1ccccc1C(=S)N1CCOCC1)c1ccc([N+](=O)[O-])cc1	ZINC000005092014	506420690	/nfs/dbraw/zinc/42/06/90/506420690.db2.gz	IAXHQNUAFYGEFG-UHFFFAOYSA-N	0	0	372.402	2.822	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1sccc1C	ZINC000005110659	506422789	/nfs/dbraw/zinc/42/27/89/506422789.db2.gz	WRMXCFSMSABQOY-UHFFFAOYSA-N	0	0	350.352	2.769	50	5		FFBARN
COc1ccc(OC)c(Nc2nc(N3CCCCC3)nc(N)c2[N+](=O)[O-])c1	ZINC000005137602	506424593	/nfs/dbraw/zinc/42/45/93/506424593.db2.gz	UOCMRPJVIOEWKN-UHFFFAOYSA-N	0	0	374.401	2.718	50	5		FFBARN
Nc1nc(Nc2cccc(Cl)c2)nc(NC[C@H]2CCCO2)c1[N+](=O)[O-]	ZINC000005195909	506428745	/nfs/dbraw/zinc/42/87/45/506428745.db2.gz	CFGJJTDJZIRDAB-LLVKDONJSA-N	0	0	364.793	2.955	50	5		FFBARN
O=C1N[C@@H](Cc2c[nH]c3ccccc23)C(=O)N1Cc1cccc([N+](=O)[O-])c1	ZINC000006974735	506521772	/nfs/dbraw/zinc/52/17/72/506521772.db2.gz	KMSDGVGSVCQZLP-KRWDZBQOSA-N	0	0	364.361	2.739	50	5		FFBARN
COc1cc(NC(=O)CSc2nnc(C(C)C)[nH]2)c(C)cc1[N+](=O)[O-]	ZINC000007166856	506540138	/nfs/dbraw/zinc/54/01/38/506540138.db2.gz	UUDBAWJGPBINKH-UHFFFAOYSA-N	0	0	365.415	2.884	50	5		FFBARN
COc1cc(C)c(C(C)C)cc1S(=O)(=O)n1c(C)ncc1[N+](=O)[O-]	ZINC000007425122	506561827	/nfs/dbraw/zinc/56/18/27/506561827.db2.gz	YCOIACLJUBXJIM-UHFFFAOYSA-N	0	0	353.400	2.777	50	5		FFBARN
COc1ccc(-c2noc(CNC(=O)c3ccc([N+](=O)[O-])c(C)c3)n2)cc1	ZINC000007759570	506587622	/nfs/dbraw/zinc/58/76/22/506587622.db2.gz	BAPAZZPWHUHMCL-UHFFFAOYSA-N	0	0	368.349	2.892	50	5		FFBARN
CN1CCN(c2ccc(C(=O)N3CCc4ccccc43)cc2[N+](=O)[O-])CC1	ZINC000008706843	506661740	/nfs/dbraw/zinc/66/17/40/506661740.db2.gz	IBOPATNJOZXTBK-UHFFFAOYSA-N	0	0	366.421	2.550	50	5		FFBARN
CSc1nc2nc(C)c(CC(=O)Nc3cccc([N+](=O)[O-])c3)c(C)n2n1	ZINC000008941948	506673949	/nfs/dbraw/zinc/67/39/49/506673949.db2.gz	LYGZADYEYVRXJG-UHFFFAOYSA-N	0	0	372.410	2.552	50	5		FFBARN
CC(=O)NC(=O)c1cc2ccccc2o/c1=N\c1cccc([N+](=O)[O-])c1	ZINC000009553794	506703363	/nfs/dbraw/zinc/70/33/63/506703363.db2.gz	TZJISOAEYVVLOB-ZZEZOPTASA-N	0	0	351.318	2.850	50	5		FFBARN
Cc1sc2ncnc(N[C@H](CO)[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2c1C	ZINC000011170345	506767876	/nfs/dbraw/zinc/76/78/76/506767876.db2.gz	HAGOYDBUFBWQDO-HIFRSBDPSA-N	0	0	374.422	2.723	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2ccc3c(c2)OCCCO3)cc([N+](=O)[O-])c1	ZINC000011758866	506793703	/nfs/dbraw/zinc/79/37/03/506793703.db2.gz	GLHWKYYGTUHOFG-UHFFFAOYSA-N	0	0	372.333	2.795	50	5		FFBARN
COc1ccc(NC(=O)CNc2cc(NC(C)=O)ccc2C)c([N+](=O)[O-])c1	ZINC000055841756	506867535	/nfs/dbraw/zinc/86/75/35/506867535.db2.gz	YGSALVPJZCKDIF-UHFFFAOYSA-N	0	0	372.381	2.921	50	5		FFBARN
NS(=O)(=O)c1ccc(N2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1	ZINC000012552717	506878461	/nfs/dbraw/zinc/87/84/61/506878461.db2.gz	ZPDGYXSSTKHYEA-GFCCVEGCSA-N	0	0	353.425	2.645	50	5		FFBARN
CNc1ccc(C(=O)Nc2cccc(C(=O)NC3CC3)c2)cc1[N+](=O)[O-]	ZINC000012564224	506880473	/nfs/dbraw/zinc/88/04/73/506880473.db2.gz	BYGVVHUKGXUFLH-UHFFFAOYSA-N	0	0	354.366	2.781	50	5		FFBARN
CNc1ccc(C(=O)NCc2ccc(Cn3cccn3)cc2)cc1[N+](=O)[O-]	ZINC000012625831	506886181	/nfs/dbraw/zinc/88/61/81/506886181.db2.gz	UNKVDCHYQNYXHI-UHFFFAOYSA-N	0	0	365.393	2.811	50	5		FFBARN
Cc1nn(-c2ccccc2)c(C)c1C(=O)OCCn1c(C)ncc1[N+](=O)[O-]	ZINC000056219306	506963950	/nfs/dbraw/zinc/96/39/50/506963950.db2.gz	NYGWJCUVLWBZDU-UHFFFAOYSA-N	0	0	369.381	2.759	50	5		FFBARN
NC(=O)c1ccc(NCC2(c3cccc(F)c3)CCOCC2)c([N+](=O)[O-])c1	ZINC000058160192	507376478	/nfs/dbraw/zinc/37/64/78/507376478.db2.gz	KTODGGRZDWZBRZ-UHFFFAOYSA-N	0	0	373.384	2.993	50	5		FFBARN
CN(Cc1ccc(F)cc1F)c1ccc(S(C)(=O)=O)cc1[N+](=O)[O-]	ZINC000024207307	507397535	/nfs/dbraw/zinc/39/75/35/507397535.db2.gz	MYWZTLHWTOTOSO-UHFFFAOYSA-N	0	0	356.350	2.913	50	5		FFBARN
COc1ccc(-c2csc(NC(=O)CCn3cnc([N+](=O)[O-])c3)n2)cc1	ZINC000024576205	507421281	/nfs/dbraw/zinc/42/12/81/507421281.db2.gz	AOAUHZDUEPVUKU-UHFFFAOYSA-N	0	0	373.394	2.952	50	5		FFBARN
CN(C)c1ccc2cc3ccc(N(C)C)cc3[n+](CCCC(=O)[O-])c2c1	ZINC000025758037	507529039	/nfs/dbraw/zinc/52/90/39/507529039.db2.gz	MKQMNDVKTPYYKZ-UHFFFAOYSA-O	0	0	352.458	2.709	50	5	in-vitro	FFBARN
Cc1nccn1-c1ccc([C@H](C)Nc2ncc([N+](=O)[O-])cc2C(N)=O)cc1	ZINC000075106775	508083464	/nfs/dbraw/zinc/08/34/64/508083464.db2.gz	UNQMMXLYDVRILT-NSHDSACASA-N	0	0	366.381	2.756	50	5		FFBARN
Cc1cc2c(nc3sc(=Cc4ccc([N+](=O)[O-])cc4)c(=O)n23)c(C)c1	ZINC000252666035	509858465	/nfs/dbraw/zinc/85/84/65/509858465.db2.gz	AHCYICCWJXFIIP-UHFFFAOYSA-N	0	0	351.387	2.982	50	5		FFBARN
COC(=O)c1cccc([N+](=O)[O-])c1CN1CCN(c2ccccc2)CC1	ZINC000059846816	536813335	/nfs/dbraw/zinc/81/33/35/536813335.db2.gz	ITZNCTTVIPOHOY-UHFFFAOYSA-N	0	0	355.394	2.704	50	5		FFBARN
COCC(=O)Nc1ccc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)cc1	ZINC000097002939	1012541712	/nfs/dbraw/zinc/54/17/12/1012541712.db2.gz	LKBSKLSPHMBUQD-YHYXMXQVSA-N	0	0	355.350	2.832	50	5		FFBARN
Cc1ccc(-n2c(SCC(N)=O)nnc2-c2ccc([N+](=O)[O-])cc2)cc1	ZINC000000907436	219338600	/nfs/dbraw/zinc/33/86/00/219338600.db2.gz	AMGDDTKSHLMZRH-UHFFFAOYSA-N	0	0	369.406	2.728	50	5		FFBARN
NC(=O)c1ccc(NCCNc2ncccc2C(F)(F)F)c([N+](=O)[O-])c1	ZINC000058130492	211986189	/nfs/dbraw/zinc/98/61/89/211986189.db2.gz	RJFKQAADFOPHFN-UHFFFAOYSA-N	0	0	369.303	2.632	50	5		FFBARN
CCN(C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1)c1ccc(F)cc1	ZINC000057745153	211979816	/nfs/dbraw/zinc/97/98/16/211979816.db2.gz	QHCBCZXUZKTCRU-UHFFFAOYSA-N	0	0	355.329	2.981	50	5		FFBARN
NS(=O)(=O)c1ccc(N2CCC[C@@H]2c2cccc(F)c2)c([N+](=O)[O-])c1	ZINC000052510583	211909193	/nfs/dbraw/zinc/90/91/93/211909193.db2.gz	WQHUMCQYBVNQAV-CQSZACIVSA-N	0	0	365.386	2.723	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)n1	ZINC000016671819	220191084	/nfs/dbraw/zinc/19/10/84/220191084.db2.gz	CWQXJBVFJGEMMP-SREVYHEPSA-N	0	0	361.379	2.809	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCCNC(=O)c1ccco1	ZINC000025831986	211437474	/nfs/dbraw/zinc/43/74/74/211437474.db2.gz	SKBSZNNGXIGQKA-CYBMUJFWSA-N	0	0	359.382	2.917	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H](CN1CCOCC1)c1ccccc1	ZINC000017743617	211187179	/nfs/dbraw/zinc/18/71/79/211187179.db2.gz	VCDWSEMBMCQXCZ-SFHVURJKSA-N	0	0	370.409	2.790	50	5		FFBARN
Cc1nn(Cc2c(C)onc2C(=O)NC2CCCCC2)c(C)c1[N+](=O)[O-]	ZINC000017074398	211177744	/nfs/dbraw/zinc/17/77/44/211177744.db2.gz	OTIUOUZMNXFCAJ-UHFFFAOYSA-N	0	0	361.402	2.815	50	5		FFBARN
CCn1ccc2c(OCC(=O)Nc3cccc([N+](=O)[O-])c3)cccc2c1=O	ZINC000015882449	211149528	/nfs/dbraw/zinc/14/95/28/211149528.db2.gz	DMHULJWLJDGOFL-UHFFFAOYSA-N	0	0	367.361	2.947	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1cccs1	ZINC000015179647	211124045	/nfs/dbraw/zinc/12/40/45/211124045.db2.gz	RYNPLCHKEAQIKG-LBPRGKRZSA-N	0	0	361.423	2.996	50	5		FFBARN
Cn1nnnc1-c1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1	ZINC000014517077	211092910	/nfs/dbraw/zinc/09/29/10/211092910.db2.gz	FJFIMURAVYKTBE-UHFFFAOYSA-N	0	0	358.745	2.691	50	5		FFBARN
C[C@@H]1Cc2ccccc2N1C(=O)COc1ncnc2cc([N+](=O)[O-])ccc21	ZINC000013778618	211058945	/nfs/dbraw/zinc/05/89/45/211058945.db2.gz	RBCAWXOIKOQVAI-GFCCVEGCSA-N	0	0	364.361	2.895	50	5		FFBARN
CC(C)NC(=O)c1ccc(NCc2cn3ccccc3n2)c([N+](=O)[O-])c1	ZINC000009156650	210818513	/nfs/dbraw/zinc/81/85/13/210818513.db2.gz	AWLKZLBFSHUTLP-UHFFFAOYSA-N	0	0	353.382	2.993	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)COC(=O)c1ccc(C)c(F)c1	ZINC000008259610	210776852	/nfs/dbraw/zinc/77/68/52/210776852.db2.gz	VQSMFNVGNKXQRL-UHFFFAOYSA-N	0	0	362.313	2.846	50	5		FFBARN
CCOCCCNC(=O)CSc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000007777005	210754553	/nfs/dbraw/zinc/75/45/53/210754553.db2.gz	XYPNCWJDMLWDFR-UHFFFAOYSA-N	0	0	355.441	2.839	50	5		FFBARN
C[C@@H](OC(=O)c1cc([N+](=O)[O-])ccc1N)C(=O)Nc1ccc(F)cc1F	ZINC000007206849	210731306	/nfs/dbraw/zinc/73/13/06/210731306.db2.gz	ROIBIMQEYMNOSD-MRVPVSSYSA-N	0	0	365.292	2.639	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)c1cc(OC)c(OC)c(OC)c1	ZINC000005915877	210648343	/nfs/dbraw/zinc/64/83/43/210648343.db2.gz	FSIOCWKHEYLWTM-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
Cc1ccc(-c2c3c(cn2C(C)(C)C)n(C)c(=O)n(C)c3=O)cc1[N+](=O)[O-]	ZINC000005345707	210615450	/nfs/dbraw/zinc/61/54/50/210615450.db2.gz	GVFIRPGYLRBFFO-UHFFFAOYSA-N	0	0	370.409	2.677	50	5		FFBARN
COc1cccc(Nc2nc(N)c([N+](=O)[O-])c(NCc3ccco3)n2)c1	ZINC000005161849	210604224	/nfs/dbraw/zinc/60/42/24/210604224.db2.gz	UHBLKYYIRALZHO-UHFFFAOYSA-N	0	0	356.342	2.924	50	5		FFBARN
CN1C2=C(C(=O)N(c3ccc([N+](=O)[O-])cc3)C2)[C@@H](c2ccccc2)NC1=O	ZINC000004726735	210556354	/nfs/dbraw/zinc/55/63/54/210556354.db2.gz	ZPXSNTMZLSLATH-QGZVFWFLSA-N	0	0	364.361	2.592	50	5		FFBARN
COc1ccc(OC)c(C2=N/C(=C\c3ccc([N+](=O)[O-])cc3)C(=O)O2)c1	ZINC000004589578	210543695	/nfs/dbraw/zinc/54/36/95/210543695.db2.gz	WMHUNQWRELLKHZ-DHDCSXOGSA-N	0	0	354.318	2.957	50	5		FFBARN
Cn1c(-c2cccc([N+](=O)[O-])c2)cnc1NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000004385535	210528899	/nfs/dbraw/zinc/52/88/99/210528899.db2.gz	ZLBRTCUWFVSGLS-UHFFFAOYSA-N	0	0	367.321	2.578	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Sc1nnc2ccccn21	ZINC000003496135	210482640	/nfs/dbraw/zinc/48/26/40/210482640.db2.gz	WZLIPQCLVGWGPE-JTQLQIEISA-N	0	0	373.394	2.765	50	5		FFBARN
O=C(N/C(=C/c1ccco1)C(=O)N1CCCCC1)c1ccc([N+](=O)[O-])cc1	ZINC000001232198	210337999	/nfs/dbraw/zinc/33/79/99/210337999.db2.gz	PIGGNSAHTIZGIE-GHRIWEEISA-N	0	0	369.377	2.971	50	5		FFBARN
CCOC(=O)C1=C(N)Oc2cc(O)ccc2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000001226952	210337593	/nfs/dbraw/zinc/33/75/93/210337593.db2.gz	PHTAMBMUQWHXLX-OAHLLOKOSA-N	0	0	356.334	2.558	50	5		FFBARN
COC(=O)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2C)cc1	ZINC000001179741	210330664	/nfs/dbraw/zinc/33/06/64/210330664.db2.gz	OBIIAKPYPMKNKK-UHFFFAOYSA-N	0	0	373.390	2.817	50	5		FFBARN
CSc1cccc(NC(=O)Cn2cc(Br)c([N+](=O)[O-])n2)c1	ZINC000001125770	210321849	/nfs/dbraw/zinc/32/18/49/210321849.db2.gz	WXYIWVUKIXHYQC-UHFFFAOYSA-N	0	0	371.216	2.914	50	5		FFBARN
O=C(NC[C@H]1CCCO1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000001115107	210319266	/nfs/dbraw/zinc/31/92/66/210319266.db2.gz	ANXRXBJOHOQQPE-QGZVFWFLSA-N	0	0	369.377	2.756	50	5		FFBARN
COc1ccc(OC)c(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000000865123	210282354	/nfs/dbraw/zinc/28/23/54/210282354.db2.gz	KJJAGWYTCOJMBK-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCO)c(NCc2nc(-c3ccsc3)no2)c1	ZINC000022025012	220373516	/nfs/dbraw/zinc/37/35/16/220373516.db2.gz	GNOHIFYNNRVTQE-UHFFFAOYSA-N	0	0	361.383	2.723	50	5		FFBARN
Cc1c(C(=O)N2CCNC(=O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-]	ZINC000065523920	221229093	/nfs/dbraw/zinc/22/90/93/221229093.db2.gz	UHUNUHLDKDLQHK-QGZVFWFLSA-N	0	0	353.378	2.607	50	5		FFBARN
COc1cc(Br)c(I)c([N+](=O)[O-])c1	ZINC000067799987	221287014	/nfs/dbraw/zinc/28/70/14/221287014.db2.gz	APJYPPWBWCHKCJ-UHFFFAOYSA-N	0	0	357.929	2.971	50	5		FFBARN
C[C@H](Oc1ccccc1)C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000004663476	132387032	/nfs/dbraw/zinc/38/70/32/132387032.db2.gz	MCUKTXHBDIWXGN-HNNXBMFYSA-N	0	0	355.394	2.711	50	5		FFBARN
O=C(c1ccccc1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1N1CCOCC1	ZINC000004256055	132823172	/nfs/dbraw/zinc/82/31/72/132823172.db2.gz	GQFSJGWSUGXZBP-UHFFFAOYSA-N	0	0	357.322	2.571	50	5		FFBARN
CCCC(=O)N1CCN(c2cc(N3CCCC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000004543813	132823513	/nfs/dbraw/zinc/82/35/13/132823513.db2.gz	SZCMJOCTBQJMDW-UHFFFAOYSA-N	0	0	364.421	2.783	50	5		FFBARN
Cc1onc(C(=O)N2CCN(c3cc(Cl)ccc3C)CC2)c1[N+](=O)[O-]	ZINC000004884878	132825126	/nfs/dbraw/zinc/82/51/26/132825126.db2.gz	HWJBINJCVFJUPX-UHFFFAOYSA-N	0	0	364.789	2.815	50	5		FFBARN
C[C@H]1CC[C@H](C(N)=O)CN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000042739824	136121388	/nfs/dbraw/zinc/12/13/88/136121388.db2.gz	CJKMKSPUALZAPQ-BBRMVZONSA-N	0	0	367.405	2.916	50	5		FFBARN
C[C@H](C(=O)N1[C@@H](C)CCC[C@@H]1C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000057722458	136130051	/nfs/dbraw/zinc/13/00/51/136130051.db2.gz	GZNWYFRJXODHLJ-YESZJQIVSA-N	0	0	374.485	2.895	50	5		FFBARN
O=C1[C@@H]2ON=C(c3cccc([N+](=O)[O-])c3)[C@@H]2C(=O)N1c1ccc(Cl)cc1	ZINC000103559623	222337864	/nfs/dbraw/zinc/33/78/64/222337864.db2.gz	ZHUAXXIMKWNYMN-DZGCQCFKSA-N	0	0	371.736	2.541	50	5		FFBARN
COc1ccc(C(C)=O)cc1COC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000032724192	506283688	/nfs/dbraw/zinc/28/36/88/506283688.db2.gz	HGCKDNHHQWLASI-UHFFFAOYSA-N	0	0	373.317	2.892	50	5		FFBARN
Cc1nnc2sc(-c3ccc(NC(=O)c4ccc([N+](=O)[O-])o4)cc3)nn12	ZINC000002850417	506295949	/nfs/dbraw/zinc/29/59/49/506295949.db2.gz	OERUKUITIZTOHQ-UHFFFAOYSA-N	0	0	370.350	2.915	50	5		FFBARN
CC(C)CC[C@@H](C)NS(=O)(=O)c1cc2c(cc1[N+](=O)[O-])OCCCO2	ZINC000032895367	506306597	/nfs/dbraw/zinc/30/65/97/506306597.db2.gz	OOMOHJAYGPKCNF-GFCCVEGCSA-N	0	0	372.443	2.859	50	5		FFBARN
COc1ccc(S(=O)(=O)N2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1	ZINC000032895761	506307732	/nfs/dbraw/zinc/30/77/32/506307732.db2.gz	RFUDXXKSNXOMHX-CQSZACIVSA-N	0	0	363.395	2.524	50	5		FFBARN
C[C@@H](Oc1ccc(Cl)cc1)C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032999818	506322968	/nfs/dbraw/zinc/32/29/68/506322968.db2.gz	RNRXZSOEXYIMOG-BZNIZROVSA-N	0	0	364.785	2.865	50	5		FFBARN
O=C(COC(=O)c1c(F)cccc1F)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000003397174	506327238	/nfs/dbraw/zinc/32/72/38/506327238.db2.gz	NJDKNFDCGXMTGX-UHFFFAOYSA-N	0	0	354.240	2.808	50	5		FFBARN
C[C@@H]1C[C@H](C)CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000003499594	506336135	/nfs/dbraw/zinc/33/61/35/506336135.db2.gz	CFHIAQAMZOBSFA-PHIMTYICSA-N	0	0	354.790	2.910	50	5		FFBARN
CC(C)OC[C@@H]1C[C@H](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000004132660	506360940	/nfs/dbraw/zinc/36/09/40/506360940.db2.gz	YBAGMGBNHBRAAY-WFASDCNBSA-N	0	0	350.371	2.670	50	5		FFBARN
CC(=O)OCCN1C(=O)c2ccc(Oc3cccc([N+](=O)[O-])c3)cc2C1=O	ZINC000004156828	506362219	/nfs/dbraw/zinc/36/22/19/506362219.db2.gz	OTCIHBPMXXWCQC-UHFFFAOYSA-N	0	0	370.317	2.546	50	5		FFBARN
O=[N+]([O-])c1c2nonc2c(NCCc2ccccc2)cc1N1CCOCC1	ZINC000004367369	506372956	/nfs/dbraw/zinc/37/29/56/506372956.db2.gz	PGYPKSVMTJVJNA-UHFFFAOYSA-N	0	0	369.381	2.622	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004497457	506378906	/nfs/dbraw/zinc/37/89/06/506378906.db2.gz	XEFBSKFOHDDEDX-ITOFIOBYSA-N	0	0	369.352	2.669	50	5		FFBARN
O=C(CSc1nncn1-c1ccccc1)Nc1ccccc1[N+](=O)[O-]	ZINC000004835265	506397537	/nfs/dbraw/zinc/39/75/37/506397537.db2.gz	XIKRFMWQJYUUPM-UHFFFAOYSA-N	0	0	355.379	2.906	50	5		FFBARN
Cc1cc2nc3s/c(=C/c4ccccc4[N+](=O)[O-])c(=O)n3c2cc1C	ZINC000004854401	506398793	/nfs/dbraw/zinc/39/87/93/506398793.db2.gz	FZQOGKWKGUUQDQ-CXUHLZMHSA-N	0	0	351.387	2.982	50	5		FFBARN
COC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(=O)c1ccc(OC)cc1	ZINC000004893250	506402028	/nfs/dbraw/zinc/40/20/28/506402028.db2.gz	JAWGLPSGCCLFJW-WJDWOHSUSA-N	0	0	356.334	2.547	50	5		FFBARN
COc1cccc(Nc2nc(N)c([N+](=O)[O-])c(N3CCC(C)CC3)n2)c1	ZINC000005215536	506428735	/nfs/dbraw/zinc/42/87/35/506428735.db2.gz	NUFCRLVVDKIKIW-UHFFFAOYSA-N	0	0	358.402	2.956	50	5		FFBARN
Cc1ccc(OCCC(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000005261921	506431550	/nfs/dbraw/zinc/43/15/50/506431550.db2.gz	VFRNOWMOZGRZES-UHFFFAOYSA-N	0	0	358.350	2.854	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)c1cc(C)nc2c1c(C)nn2C	ZINC000040040445	506459392	/nfs/dbraw/zinc/45/93/92/506459392.db2.gz	ZNLOCQKWEMGQCZ-UHFFFAOYSA-N	0	0	355.354	2.754	50	5		FFBARN
CC(C)CCC(=O)N1CCN(C(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000040157620	506477208	/nfs/dbraw/zinc/47/72/08/506477208.db2.gz	OQTWGLLWLCCYBI-UHFFFAOYSA-N	0	0	367.833	2.969	50	5		FFBARN
CCCNS(=O)(=O)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000007262429	506548507	/nfs/dbraw/zinc/54/85/07/506548507.db2.gz	ITGNZNGTHSHVFL-UHFFFAOYSA-N	0	0	363.395	2.535	50	5		FFBARN
Cc1ccc(S(=O)(=O)NCCCn2cnc3ccccc32)cc1[N+](=O)[O-]	ZINC000007364910	506556064	/nfs/dbraw/zinc/55/60/64/506556064.db2.gz	OVYLIIODSARJDL-UHFFFAOYSA-N	0	0	374.422	2.622	50	5		FFBARN
Cc1cc(C)n(-c2nc(C)cc(NC[C@H](O)c3ccc([N+](=O)[O-])cc3)n2)n1	ZINC000007596881	506573200	/nfs/dbraw/zinc/57/32/00/506573200.db2.gz	OVYNNACINRERGO-INIZCTEOSA-N	0	0	368.397	2.641	50	5		FFBARN
O=C(CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21)NCc1ccc(F)cc1	ZINC000008136660	506626042	/nfs/dbraw/zinc/62/60/42/506626042.db2.gz	RGIJPYHJFJCVHF-UHFFFAOYSA-N	0	0	373.340	2.738	50	5		FFBARN
Cc1nn(Cc2cc3c(cc2Br)OCO3)c(C)c1[N+](=O)[O-]	ZINC000008428005	506648928	/nfs/dbraw/zinc/64/89/28/506648928.db2.gz	UUVBQKLCVWMTBL-UHFFFAOYSA-N	0	0	354.160	2.948	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCNC(=O)/C=C/c1ccccc1	ZINC000008986798	506676094	/nfs/dbraw/zinc/67/60/94/506676094.db2.gz	WDDHEWDVHJGXEY-JXMROGBWSA-N	0	0	369.377	2.762	50	5		FFBARN
O=C(Nn1cnc2ccccc21)C1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000009155704	506683262	/nfs/dbraw/zinc/68/32/62/506683262.db2.gz	XIIHWRGLFOTSMR-UHFFFAOYSA-N	0	0	365.393	2.931	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)Nc1c(C)cc(C)cc1C	ZINC000009155779	506684080	/nfs/dbraw/zinc/68/40/80/506684080.db2.gz	JFTQVENYBXECHF-UHFFFAOYSA-N	0	0	370.409	2.930	50	5		FFBARN
COCCNc1ccc(C(=O)Nc2nc(C)c(C)s2)cc1[N+](=O)[O-]	ZINC000009368781	506694955	/nfs/dbraw/zinc/69/49/55/506694955.db2.gz	JNLAMVYIAHQNDU-UHFFFAOYSA-N	0	0	350.400	2.979	50	5		FFBARN
CCn1nnnc1SCc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-]	ZINC000009726380	506710400	/nfs/dbraw/zinc/71/04/00/506710400.db2.gz	ISLLXNPXWLQPHH-UHFFFAOYSA-N	0	0	361.330	2.504	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000009872468	506716348	/nfs/dbraw/zinc/71/63/48/506716348.db2.gz	KDQXGJOFPDSXPH-GFCCVEGCSA-N	0	0	356.334	2.981	50	5		FFBARN
Cc1nn(CC(=O)N[C@@H]2CCSc3c(F)cccc32)c(C)c1[N+](=O)[O-]	ZINC000012621690	506885924	/nfs/dbraw/zinc/88/59/24/506885924.db2.gz	JOSGTTZBTWEDFX-CYBMUJFWSA-N	0	0	364.402	2.901	50	5		FFBARN
O=C(Cn1cc([N+](=O)[O-])ccc1=O)Nc1ccc(OC(F)F)c(Cl)c1	ZINC000012684973	506889415	/nfs/dbraw/zinc/88/94/15/506889415.db2.gz	OBDLYENFZCIBHH-UHFFFAOYSA-N	0	0	373.699	2.650	50	5		FFBARN
Cc1ccc(C(=O)N[C@H](CN2CCOCC2)c2ccccc2)cc1[N+](=O)[O-]	ZINC000012754109	506896457	/nfs/dbraw/zinc/89/64/57/506896457.db2.gz	HXFBLJSCNRFMHI-GOSISDBHSA-N	0	0	369.421	2.707	50	5		FFBARN
CN(Cc1ccc(C(=O)NCC(F)(F)F)cc1)c1ncccc1[N+](=O)[O-]	ZINC000012914866	506912957	/nfs/dbraw/zinc/91/29/57/506912957.db2.gz	LYZBGWFZRFCJIJ-UHFFFAOYSA-N	0	0	368.315	2.918	50	5		FFBARN
CN(C)C1=N[C@@H]2Nc3ccccc3N(C)[C@@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000013894519	506957173	/nfs/dbraw/zinc/95/71/73/506957173.db2.gz	PZFWIEROOQOKSF-KSZLIROESA-N	0	0	351.410	2.909	50	5		FFBARN
O=C(CCC(=O)N1CCN(c2ccccc2[N+](=O)[O-])CC1)c1ccccc1	ZINC000018077021	507135282	/nfs/dbraw/zinc/13/52/82/507135282.db2.gz	AILUHYCGBUTUSQ-UHFFFAOYSA-N	0	0	367.405	2.907	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c1	ZINC000024542429	507418399	/nfs/dbraw/zinc/41/83/99/507418399.db2.gz	BCKZHRLONMPWLR-UHFFFAOYSA-N	0	0	371.393	2.757	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1N1CCc2cc(OC)c(OC)cc2C1	ZINC000024754087	507435709	/nfs/dbraw/zinc/43/57/09/507435709.db2.gz	GOGYCGGAKOBZMM-UHFFFAOYSA-N	0	0	372.377	2.961	50	5		FFBARN
Cc1cc(C(=O)Nc2nc(-c3c[nH]c(C(N)=O)c3)cs2)ccc1[N+](=O)[O-]	ZINC000024925492	507450079	/nfs/dbraw/zinc/45/00/79/507450079.db2.gz	AUOHOJQUZWSPNG-UHFFFAOYSA-N	0	0	371.378	2.706	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])o1)N1CCN(c2ccc(C(F)(F)F)cn2)CC1	ZINC000024940794	507450779	/nfs/dbraw/zinc/45/07/79/507450779.db2.gz	FONPGJWDOOKMCX-UHFFFAOYSA-N	0	0	370.287	2.564	50	5		FFBARN
COCCN(Cc1ccccc1)S(=O)(=O)c1cccc([N+](=O)[O-])c1C	ZINC000027974407	507698937	/nfs/dbraw/zinc/69/89/37/507698937.db2.gz	SESSNRZYYPEBRV-UHFFFAOYSA-N	0	0	364.423	2.741	50	5		FFBARN
CS(=O)(=O)c1ccc(N[C@H]2CCCC[C@@H]2n2cccn2)c([N+](=O)[O-])c1	ZINC000072307296	507773975	/nfs/dbraw/zinc/77/39/75/507773975.db2.gz	MSARCKFXDSCXHQ-ZFWWWQNUSA-N	0	0	364.427	2.791	50	5		FFBARN
COC(=O)[C@H](C)[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000072310572	507774953	/nfs/dbraw/zinc/77/49/53/507774953.db2.gz	HVJBRRRDWRNNBG-ACJLOTCBSA-N	0	0	372.377	2.640	50	5		FFBARN
Cc1nn(CN2CCO[C@@H](c3ccc(F)cc3)C2)c2ncc([N+](=O)[O-])cc12	ZINC000072312378	507775202	/nfs/dbraw/zinc/77/52/02/507775202.db2.gz	CGRBSCZKGPCJQX-QGZVFWFLSA-N	0	0	371.372	2.818	50	5		FFBARN
COC(=O)[C@H]1CCC[C@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000079066071	507930022	/nfs/dbraw/zinc/93/00/22/507930022.db2.gz	HAFUARRUPOPNEI-VHSXEESVSA-N	0	0	373.312	2.659	50	5		FFBARN
CC(C)(C)OC(=O)N1CCCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000075572691	508118647	/nfs/dbraw/zinc/11/86/47/508118647.db2.gz	QXPXWKJEXBMIDR-UHFFFAOYSA-N	0	0	365.430	2.916	50	5		FFBARN
C[C@@H](Nc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-])[C@H]1CCCOC1	ZINC000095468377	508187791	/nfs/dbraw/zinc/18/77/91/508187791.db2.gz	BVGFCNDLPJIODT-ZJUUUORDSA-N	0	0	364.370	2.818	50	5		FFBARN
CCOC(=O)CC[C@H]1CCCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C1	ZINC000095973231	508199759	/nfs/dbraw/zinc/19/97/59/508199759.db2.gz	BHZCRWPGRJCGJZ-GFCCVEGCSA-N	0	0	374.397	2.667	50	5		FFBARN
O=c1[nH]c(=O)c2c([nH]1)OC(c1ccccc1)=C[C@@H]2c1ccc([N+](=O)[O-])cc1	ZINC000226761551	509403707	/nfs/dbraw/zinc/40/37/07/509403707.db2.gz	WVLRBYLKNTXSLT-CQSZACIVSA-N	0	0	363.329	2.537	50	5		FFBARN
CN(CCc1nccs1)C(=O)c1cc([N+](=O)[O-])ncc1Br	ZINC000241588003	509843633	/nfs/dbraw/zinc/84/36/33/509843633.db2.gz	OYWAOXDVBWXNRH-UHFFFAOYSA-N	0	0	371.216	2.524	50	5		FFBARN
COc1ccc(-c2cn(CC(=O)c3cccc([N+](=O)[O-])c3)c(=N)n2C)cc1	ZINC000334157583	523141983	/nfs/dbraw/zinc/14/19/83/523141983.db2.gz	OWYCANQIEIMTDP-UHFFFAOYSA-N	0	0	366.377	2.773	50	5		FFBARN
Cc1cccc(NC(=O)CNC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c1C	ZINC000097674682	959561091	/nfs/dbraw/zinc/56/10/91/959561091.db2.gz	MLDVVCHMSWBXBU-FLIBITNWSA-N	0	0	353.378	2.980	50	5		FFBARN
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)OCc1ccccc1Cl	ZINC000000714713	210264807	/nfs/dbraw/zinc/26/48/07/210264807.db2.gz	QWOQIHMNPSLUJD-UHFFFAOYSA-N	0	0	374.736	2.588	50	5		FFBARN
Cc1cc(C)n(Cc2ccc(NC(=O)c3c([N+](=O)[O-])c(C)nn3C)cc2)n1	ZINC000000653469	210258101	/nfs/dbraw/zinc/25/81/01/210258101.db2.gz	IQONDRRSCZJQFY-UHFFFAOYSA-N	0	0	368.397	2.751	50	5		FFBARN
O=C(CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O)C12CC3CC(CC(C3)C1)C2	ZINC000004433818	219574922	/nfs/dbraw/zinc/57/49/22/219574922.db2.gz	BRIVYPPDFQPRDW-UHFFFAOYSA-N	0	0	368.389	2.976	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccccc1OC(F)F	ZINC000005505922	219685916	/nfs/dbraw/zinc/68/59/16/219685916.db2.gz	XUNYZMICTBNVQM-UHFFFAOYSA-N	0	0	356.237	2.585	50	5		FFBARN
O=[N+]([O-])c1cccnc1NCC1(c2ccc3c(c2)OCO3)CCOCC1	ZINC000058357442	212006481	/nfs/dbraw/zinc/00/64/81/212006481.db2.gz	AVZWGUXLOSTBPH-UHFFFAOYSA-N	0	0	357.366	2.879	50	5		FFBARN
C[C@@H](NC(=O)c1ccc(Nc2ccccc2)c([N+](=O)[O-])c1)c1nncn1C	ZINC000032933547	211576141	/nfs/dbraw/zinc/57/61/41/211576141.db2.gz	AWESZJPDHWPJCV-GFCCVEGCSA-N	0	0	366.381	2.958	50	5		FFBARN
Cc1nc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)nn1-c1ccc(F)cc1	ZINC000032883635	211569946	/nfs/dbraw/zinc/56/99/46/211569946.db2.gz	PBRHRBRBBQGPKT-UHFFFAOYSA-N	0	0	367.340	2.826	50	5		FFBARN
O=C(c1ccccc1[N+](=O)[O-])N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000024141746	211403071	/nfs/dbraw/zinc/40/30/71/211403071.db2.gz	SPVGGUMGMGEVAU-UHFFFAOYSA-N	0	0	359.426	2.850	50	5		FFBARN
N=C1NC(=O)/C(=C/c2ccc(-c3cc([N+](=O)[O-])cc([N+](=O)[O-])c3)o2)S1	ZINC000023128327	211378268	/nfs/dbraw/zinc/37/82/68/211378268.db2.gz	QBMPYODSXJTLAD-SDQBBNPISA-N	0	0	360.307	2.902	50	5		FFBARN
CC(=O)c1ccccc1NC(=O)[C@@H](C)OC(=O)c1ccccc1[N+](=O)[O-]	ZINC000022414482	211350115	/nfs/dbraw/zinc/35/01/15/211350115.db2.gz	VEMSFNOEZYETHS-GFCCVEGCSA-N	0	0	356.334	2.981	50	5		FFBARN
COc1ccc(C2=NN(C(C)=O)[C@@H](c3ccccc3[N+](=O)[O-])O2)c(OC)c1	ZINC000021092054	211306167	/nfs/dbraw/zinc/30/61/67/211306167.db2.gz	XEANMPLZOUVGIP-GOSISDBHSA-N	0	0	371.349	2.851	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@H](c2cccc([N+](=O)[O-])c2)NC3=O)c1	ZINC000020213025	211273468	/nfs/dbraw/zinc/27/34/68/211273468.db2.gz	GNEYXNXFMRWMTJ-HNNXBMFYSA-N	0	0	350.334	2.826	50	5		FFBARN
CC[C@H]1c2ccsc2CCN1C(=O)CNC(=O)c1cccc([N+](=O)[O-])c1	ZINC000016778376	211168112	/nfs/dbraw/zinc/16/81/12/211168112.db2.gz	XYSFQFUFBWYIJA-HNNXBMFYSA-N	0	0	373.434	2.922	50	5		FFBARN
CC(=O)c1ccc(NC(=O)c2ccc(-n3cncn3)c([N+](=O)[O-])c2)cc1	ZINC000015934734	211151034	/nfs/dbraw/zinc/15/10/34/211151034.db2.gz	ARFZSWSLCQJSPT-UHFFFAOYSA-N	0	0	351.322	2.630	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000014239577	211086841	/nfs/dbraw/zinc/08/68/41/211086841.db2.gz	HWCXDEVVJCXHBI-MRXNPFEDSA-N	0	0	367.405	2.933	50	5		FFBARN
COc1ccccc1NC(=O)/C(=C/c1cccc([N+](=O)[O-])c1)NC(C)=O	ZINC000014019565	211069557	/nfs/dbraw/zinc/06/95/57/211069557.db2.gz	DRHMNFAQZKWPQI-WJDWOHSUSA-N	0	0	355.350	2.719	50	5		FFBARN
O=c1[nH]c2ccccc2nc1/C=C/c1cc([N+](=O)[O-])cc2c1OCOC2	ZINC000008216320	210775053	/nfs/dbraw/zinc/77/50/53/210775053.db2.gz	CULCUUBQPMUEKI-AATRIKPKSA-N	0	0	351.318	2.868	50	5		FFBARN
CC[C@@H](C)Nc1nc(N)c([N+](=O)[O-])c(Nc2cc(OC)ccc2OC)n1	ZINC000005516403	210625185	/nfs/dbraw/zinc/62/51/85/210625185.db2.gz	PRNSIJYOJBHTBQ-SECBINFHSA-N	0	0	362.390	2.938	50	5		FFBARN
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCCCC3)c1ccc([N+](=O)[O-])o1	ZINC000005140163	210601798	/nfs/dbraw/zinc/60/17/98/210601798.db2.gz	SKCUUQKKDLCTAT-UHFFFAOYSA-N	0	0	368.349	2.876	50	5		FFBARN
CSc1cccc(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c1	ZINC000003299024	210464466	/nfs/dbraw/zinc/46/44/66/210464466.db2.gz	GLUWOEQVPSSFGK-UHFFFAOYSA-N	0	0	371.374	2.551	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C1=N/C(=C/c2ccccc2[N+](=O)[O-])C(=O)O1	ZINC000002941870	210438639	/nfs/dbraw/zinc/43/86/39/210438639.db2.gz	SVASWLLHYOUGLU-MDWZMJQESA-N	0	0	369.289	2.856	50	5		FFBARN
Cc1ccc(C(=O)CSc2nnnn2-c2ccccc2)cc1[N+](=O)[O-]	ZINC000002643534	210410635	/nfs/dbraw/zinc/41/06/35/210410635.db2.gz	BYWYMUBWGGGGOE-UHFFFAOYSA-N	0	0	355.379	2.854	50	5		FFBARN
CC(=O)Nc1ccc(NC(=O)c2c([N+](=O)[O-])c(C(C)(C)C)nn2C)cc1	ZINC000002291385	210388218	/nfs/dbraw/zinc/38/82/18/210388218.db2.gz	DIQCCSDLDCZJLJ-UHFFFAOYSA-N	0	0	359.386	2.837	50	5		FFBARN
COc1ccccc1C(=O)N1CCN(Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC000019789908	220297315	/nfs/dbraw/zinc/29/73/15/220297315.db2.gz	AXRVKIGBKOINMK-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
COC(=O)c1ccc(Cn2cc(C(F)(F)F)cc([N+](=O)[O-])c2=O)cc1	ZINC000001400103	210349964	/nfs/dbraw/zinc/34/99/64/210349964.db2.gz	VQXUQVFAAXKZLR-UHFFFAOYSA-N	0	0	356.256	2.610	50	5		FFBARN
Cc1cc(C(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)ccc1[N+](=O)[O-]	ZINC000010325099	210355008	/nfs/dbraw/zinc/35/50/08/210355008.db2.gz	XIDJNSKAGJLWMU-UHFFFAOYSA-N	0	0	364.361	2.916	50	5		FFBARN
CCOC(=O)C1=C(c2ccccc2)NC(=O)N[C@@H]1c1cccc([N+](=O)[O-])c1	ZINC000001232837	210337949	/nfs/dbraw/zinc/33/79/49/210337949.db2.gz	MOTQRVGPHVHLKA-QGZVFWFLSA-N	0	0	367.361	2.923	50	5		FFBARN
O=C(CCCS(=O)(=O)c1ccc(F)cc1)Nc1cccc([N+](=O)[O-])c1	ZINC000010218969	210345197	/nfs/dbraw/zinc/34/51/97/210345197.db2.gz	ACWNNYISXZZFNF-UHFFFAOYSA-N	0	0	366.370	2.927	50	5		FFBARN
CN1c2ccc(Cl)cc2[C@@](O)(CC(=O)c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000001068084	210311072	/nfs/dbraw/zinc/31/10/72/210311072.db2.gz	JHFISHRHNDISFW-KRWDZBQOSA-N	0	0	360.753	2.685	50	5		FFBARN
Cc1cc(C(=O)N(Cc2ccc(C(N)=O)cc2)C2CC2)ccc1[N+](=O)[O-]	ZINC000029263494	220599658	/nfs/dbraw/zinc/59/96/58/220599658.db2.gz	SGFMANZQEAMJJK-UHFFFAOYSA-N	0	0	353.378	2.807	50	5		FFBARN
CC(=O)c1ccc(N2CCCN(C(=O)c3ccccn3)CC2)c([N+](=O)[O-])c1	ZINC000057140624	221083937	/nfs/dbraw/zinc/08/39/37/221083937.db2.gz	RDEUANAJRRXZRY-UHFFFAOYSA-N	0	0	368.393	2.545	50	5		FFBARN
COC(=O)[C@@H](C)[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccccc1	ZINC000072310571	221463289	/nfs/dbraw/zinc/46/32/89/221463289.db2.gz	HVJBRRRDWRNNBG-UGSOOPFHSA-N	0	0	372.377	2.640	50	5		FFBARN
O=C1OCC2=C1[C@@H](c1cccc([N+](=O)[O-])c1)CC(=O)N2c1ccccc1	ZINC000001427637	132381949	/nfs/dbraw/zinc/38/19/49/132381949.db2.gz	QVDLNTUYXVITKV-OAHLLOKOSA-N	0	0	350.330	2.926	50	5		FFBARN
Cc1ccc2c(c1)CCCN2CN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000004116429	132386431	/nfs/dbraw/zinc/38/64/31/132386431.db2.gz	RLSUPCOCBRGASP-UHFFFAOYSA-N	0	0	351.362	2.910	50	5		FFBARN
CN(C)C1=N[C@@H]2Nc3ccccc3N(C)[C@H]2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000004663455	132387089	/nfs/dbraw/zinc/38/70/89/132387089.db2.gz	PZFWIEROOQOKSF-BZSNNMDCSA-N	0	0	351.410	2.909	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NCC(=O)N1CCN(c2ccccc2)CC1	ZINC000009322141	132845097	/nfs/dbraw/zinc/84/50/97/132845097.db2.gz	OQNBWELVEJFKDO-UHFFFAOYSA-N	0	0	354.410	2.664	50	5		FFBARN
O=C(c1ccco1)N1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1	ZINC000012557957	132860795	/nfs/dbraw/zinc/86/07/95/132860795.db2.gz	HKWUNVYRKKZQEC-UHFFFAOYSA-N	0	0	352.350	2.698	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCO2)N1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000054373589	136125502	/nfs/dbraw/zinc/12/55/02/136125502.db2.gz	AOUDPFVDTBOHDB-UHFFFAOYSA-N	0	0	370.365	2.678	50	5		FFBARN
COc1ccc(OC)c2c1s/c(=N\C(=O)c1ccc([N+](=O)[O-])cc1)n2C	ZINC000100908617	222256359	/nfs/dbraw/zinc/25/63/59/222256359.db2.gz	KMNJZZFPKJFCGJ-ZCXUNETKSA-N	0	0	373.390	2.906	50	5		FFBARN
Cc1cc([N+](=O)[O-])nn1C[C@H](C)C(=O)Nc1ccc2c(C)cc(=O)oc2c1	ZINC000002792438	506293327	/nfs/dbraw/zinc/29/33/27/506293327.db2.gz	PEPNUZKIIGGHNL-NSHDSACASA-N	0	0	370.365	2.789	50	5		FFBARN
Cc1sc2ncn3nc([C@@H](C)Cn4cc([N+](=O)[O-])cn4)nc3c2c1C	ZINC000002808437	506294907	/nfs/dbraw/zinc/29/49/07/506294907.db2.gz	DBXHBSYTVCHDTC-QMMMGPOBSA-N	0	0	357.399	2.864	50	5		FFBARN
O=C([O-])[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC1=CCCCC1	ZINC000002852847	506298196	/nfs/dbraw/zinc/29/81/96/506298196.db2.gz	QXGYVMCWQXLZCL-MRXNPFEDSA-N	0	0	361.398	2.857	50	5		FFBARN
Cc1sc(NC(=O)[C@H](C)Oc2ccc([N+](=O)[O-])cc2)c(C(N)=O)c1C	ZINC000002872827	506299973	/nfs/dbraw/zinc/29/99/73/506299973.db2.gz	RTTQPRFCXLPWPB-VIFPVBQESA-N	0	0	363.395	2.778	50	5		FFBARN
C[C@@H]1Cc2ccccc2N1C(=O)COC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000003217722	506312975	/nfs/dbraw/zinc/31/29/75/506312975.db2.gz	CSUXYACMXJPLPJ-CYBMUJFWSA-N	0	0	354.362	2.658	50	5		FFBARN
CN(C)c1ccc(C(=O)c2ccc(N(C)C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-]	ZINC000003896959	506352142	/nfs/dbraw/zinc/35/21/42/506352142.db2.gz	ZVDVILJUONZMJX-UHFFFAOYSA-N	0	0	358.354	2.866	50	5		FFBARN
O=C1CN=C(c2cc([N+](=O)[O-])ccc2Cl)c2cc([N+](=O)[O-])ccc2N1	ZINC000004006279	506355545	/nfs/dbraw/zinc/35/55/45/506355545.db2.gz	RUBWZOGBNBSYPE-UHFFFAOYSA-N	0	0	360.713	2.946	50	5		FFBARN
COc1cc2c(cc1OC)[C@H](c1ccccc1[N+](=O)[O-])C1=C(COC1=O)N2	ZINC000004052202	506356541	/nfs/dbraw/zinc/35/65/41/506356541.db2.gz	YDHPPZOOSRLYLB-KRWDZBQOSA-N	0	0	368.345	2.980	50	5		FFBARN
CC(C)OC[C@H]1C[C@@H](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C(=O)O1	ZINC000004132672	506360164	/nfs/dbraw/zinc/36/01/64/506360164.db2.gz	YBAGMGBNHBRAAY-IUODEOHRSA-N	0	0	350.371	2.670	50	5		FFBARN
O=C(CSc1nnnn1C1CCCCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000004581376	506382753	/nfs/dbraw/zinc/38/27/53/506382753.db2.gz	KTHSDSVHULHESF-UHFFFAOYSA-N	0	0	362.415	2.817	50	5		FFBARN
O=C(NC1CCCC1)[C@H](c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCCC1	ZINC000036067085	506394283	/nfs/dbraw/zinc/39/42/83/506394283.db2.gz	LFAVGASHZDCQGC-KRWDZBQOSA-N	0	0	361.398	2.519	50	5		FFBARN
COC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)NC(=O)c1ccc(OC)cc1	ZINC000004903213	506403763	/nfs/dbraw/zinc/40/37/63/506403763.db2.gz	FUXNGMKZXYBNPL-WJDWOHSUSA-N	0	0	356.334	2.547	50	5		FFBARN
COc1ccc2cc3c(N)nn(C(=O)c4cccc([N+](=O)[O-])c4)c3nc2c1	ZINC000004939926	506408059	/nfs/dbraw/zinc/40/80/59/506408059.db2.gz	FFXGMMIVOJYTIM-UHFFFAOYSA-N	0	0	363.333	2.772	50	5		FFBARN
O=C(CCCN1C(=O)c2ccccc2C1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000005061033	506418694	/nfs/dbraw/zinc/41/86/94/506418694.db2.gz	MHWRZVHRHIAXTA-UHFFFAOYSA-N	0	0	353.334	2.610	50	5		FFBARN
Cc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)C(=O)[C@H]2C)cc1	ZINC000037275866	506423344	/nfs/dbraw/zinc/42/33/44/506423344.db2.gz	IKQUFFXPOUOJQI-CQSZACIVSA-N	0	0	353.378	2.781	50	5		FFBARN
COc1cc(OC)c(OC)cc1CNC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000005246198	506432445	/nfs/dbraw/zinc/43/24/45/506432445.db2.gz	DTRFTQSOTOYKTI-UHFFFAOYSA-N	0	0	360.366	2.859	50	5		FFBARN
C[C@H]1C[C@@H]1C(=O)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000005262009	506432530	/nfs/dbraw/zinc/43/25/30/506432530.db2.gz	IFQUJLWLDGVOAR-JQWIXIFHSA-N	0	0	357.332	2.918	50	5		FFBARN
O=C(COC(=O)c1ccccc1O)Nc1ccc(Cl)cc1[N+](=O)[O-]	ZINC000005754025	506456386	/nfs/dbraw/zinc/45/63/86/506456386.db2.gz	POKGGTBJOHEQIS-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
CC(C)(C)OC(=O)N1CCC(C(=O)NCc2ccccc2[N+](=O)[O-])CC1	ZINC000053867062	506457219	/nfs/dbraw/zinc/45/72/19/506457219.db2.gz	VRMDDAABGHKHNE-UHFFFAOYSA-N	0	0	363.414	2.858	50	5		FFBARN
C[C@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@H]1CC(=O)N(CC(F)(F)F)C1	ZINC000040073853	506463041	/nfs/dbraw/zinc/46/30/41/506463041.db2.gz	OFTDOLLULFXALW-PWSUYJOCSA-N	0	0	373.331	2.525	50	5		FFBARN
CN(Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(N2CCCC2=O)cc1	ZINC000040074145	506463062	/nfs/dbraw/zinc/46/30/62/506463062.db2.gz	VFXBLGVTBSBQLN-UHFFFAOYSA-N	0	0	353.378	2.994	50	5		FFBARN
Cc1nc(C)c(C(=O)OCC(=O)Nc2cc([N+](=O)[O-])ccc2F)s1	ZINC000006367413	506478747	/nfs/dbraw/zinc/47/87/47/506478747.db2.gz	FNBWBSQZLOSYAM-UHFFFAOYSA-N	0	0	353.331	2.603	50	5		FFBARN
Cc1ccccc1-c1nc2s/c(=C/c3ccccc3[N+](=O)[O-])c(=O)n2n1	ZINC000006479620	506484836	/nfs/dbraw/zinc/48/48/36/506484836.db2.gz	VJTJVIUWMNXCRK-XNTDXEJSSA-N	0	0	364.386	2.582	50	5		FFBARN
NS(=O)(=O)c1ccc(CCNc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000006560336	506489257	/nfs/dbraw/zinc/48/92/57/506489257.db2.gz	ZJSSLUQVYPGWPT-UHFFFAOYSA-N	0	0	355.803	2.550	50	5		FFBARN
COc1cccc(C(=O)O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)c1	ZINC000006586985	506489308	/nfs/dbraw/zinc/48/93/08/506489308.db2.gz	FNSGJYWLRRUWEB-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
O=C(N=c1[nH]c2ccccc2[nH]1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000006971241	506522159	/nfs/dbraw/zinc/52/21/59/506522159.db2.gz	XLKURYJTCZMIBE-UHFFFAOYSA-N	0	0	351.366	2.746	50	5		FFBARN
CCc1ccc(OCC(=O)OCC(=O)Nc2ccccc2[N+](=O)[O-])cc1	ZINC000007975634	506608391	/nfs/dbraw/zinc/60/83/91/506608391.db2.gz	UOPIMAUYMXNRNZ-UHFFFAOYSA-N	0	0	358.350	2.718	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)N2CCCCCC2)ccc1N1CCCC1	ZINC000008055532	506617935	/nfs/dbraw/zinc/61/79/35/506617935.db2.gz	ROBWSXGOAOMNJH-UHFFFAOYSA-N	0	0	353.444	2.760	50	5		FFBARN
CNS(=O)(=O)c1ccc(N(C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000042619966	506642060	/nfs/dbraw/zinc/64/20/60/506642060.db2.gz	QMSYZEJNNJEYSO-HNNXBMFYSA-N	0	0	361.423	2.627	50	5		FFBARN
Cc1nn(CC(=O)NCCc2ccc(C(F)(F)F)cc2)c(C)c1[N+](=O)[O-]	ZINC000009114105	506683890	/nfs/dbraw/zinc/68/38/90/506683890.db2.gz	MYBDOEXGCACKKJ-UHFFFAOYSA-N	0	0	370.331	2.786	50	5		FFBARN
O=C1c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2-c2c1cc([N+](=O)[O-])cc2[N+](=O)[O-]	ZINC000043439551	506743516	/nfs/dbraw/zinc/74/35/16/506743516.db2.gz	JOERSAVCLPYNIZ-UHFFFAOYSA-N	0	0	360.194	2.531	50	5		FFBARN
Cn1c2cc3c(cc2s/c1=N/C(=O)c1ccc([N+](=O)[O-])cc1)OCO3	ZINC000012080581	506813893	/nfs/dbraw/zinc/81/38/93/506813893.db2.gz	BVYNBMCOSMNBMQ-WUKNDPDISA-N	0	0	357.347	2.618	50	5		FFBARN
O=C(CSc1nc2cc(Cl)ccc2s1)Nc1nonc1[N+](=O)[O-]	ZINC000012375121	506856282	/nfs/dbraw/zinc/85/62/82/506856282.db2.gz	OEXFFTALKYAMRG-UHFFFAOYSA-N	0	0	371.787	2.972	50	5		FFBARN
C[C@@H]1CN(C(=O)CSc2nc3ccc([N+](=O)[O-])cc3s2)C[C@H](C)O1	ZINC000012588366	506882782	/nfs/dbraw/zinc/88/27/82/506882782.db2.gz	JDSHPJUFWJGPDF-AOOOYVTPSA-N	0	0	367.452	2.932	50	5		FFBARN
O=[N+]([O-])c1ccc(-c2ncn(C[C@H](O)COc3ccc(Cl)cc3)n2)cc1	ZINC000046060820	507070601	/nfs/dbraw/zinc/07/06/01/507070601.db2.gz	XCPIKHAKBZVUPW-HNNXBMFYSA-N	0	0	374.784	2.947	50	5		FFBARN
O=C(c1noc2c1CCCCC2)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000020458074	507221835	/nfs/dbraw/zinc/22/18/35/507221835.db2.gz	JIDQYDRCDMRWGJ-UHFFFAOYSA-N	0	0	370.409	2.814	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1NC1CCN(C(=O)c2ccoc2)CC1	ZINC000024207261	507398212	/nfs/dbraw/zinc/39/82/12/507398212.db2.gz	MPNDWAXGSBZPIS-UHFFFAOYSA-N	0	0	373.365	2.691	50	5		FFBARN
COc1cc(CNC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)ccn1	ZINC000024438882	507412107	/nfs/dbraw/zinc/41/21/07/507412107.db2.gz	SUIAEJITSDGKKA-UHFFFAOYSA-N	0	0	356.382	2.529	50	5		FFBARN
CC[C@@H](C)NC(=O)c1cccc(CNC(=O)c2cc([N+](=O)[O-])cnc2C)c1	ZINC000048310741	507499918	/nfs/dbraw/zinc/49/99/18/507499918.db2.gz	BOZVPGSQZLKCGB-GFCCVEGCSA-N	0	0	370.409	2.757	50	5		FFBARN
O=C(NCCN1CCN(c2ccccc2)CC1)Nc1ccccc1[N+](=O)[O-]	ZINC000027352884	507649055	/nfs/dbraw/zinc/64/90/55/507649055.db2.gz	WQVWRDVTEDFIKW-UHFFFAOYSA-N	0	0	369.425	2.539	50	5		FFBARN
CS(=O)(=O)c1ccc(N[C@H]2CCCC[C@H]2n2cccn2)c([N+](=O)[O-])c1	ZINC000072307298	507773983	/nfs/dbraw/zinc/77/39/83/507773983.db2.gz	MSARCKFXDSCXHQ-DZGCQCFKSA-N	0	0	364.427	2.791	50	5		FFBARN
Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1ccc(Br)c(C)c1	ZINC000072332121	507777475	/nfs/dbraw/zinc/77/74/75/507777475.db2.gz	ZMSQUDJAVONSEY-UHFFFAOYSA-N	0	0	353.176	2.809	50	5		FFBARN
Cc1nccn1-c1ccc([C@@H](C)Nc2ncc([N+](=O)[O-])cc2C(N)=O)cc1	ZINC000075106774	508083079	/nfs/dbraw/zinc/08/30/79/508083079.db2.gz	UNQMMXLYDVRILT-LLVKDONJSA-N	0	0	366.381	2.756	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]1[C@H](O)C(F)(F)F	ZINC000084351127	508274993	/nfs/dbraw/zinc/27/49/93/508274993.db2.gz	ICVYXCARHZLITJ-MNOVXSKESA-N	0	0	352.696	2.776	50	5		FFBARN
CCN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)N1C[C@H](C)C[C@@H](C)C1	ZINC000229581105	509427058	/nfs/dbraw/zinc/42/70/58/509427058.db2.gz	PQITVPCOANDADM-ZIAGYGMSSA-N	0	0	355.460	2.639	50	5		FFBARN
C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)C[C@H]1NC(=O)OC(C)(C)C	ZINC000170614767	509681124	/nfs/dbraw/zinc/68/11/24/509681124.db2.gz	GYHCJHVMWUHBGW-NXEZZACHSA-N	0	0	355.416	2.642	50	5		FFBARN
CCCN(C[C@H]1CCCCO1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000170622702	509683372	/nfs/dbraw/zinc/68/33/72/509683372.db2.gz	XRYHNSRIHUJKSL-OAHLLOKOSA-N	0	0	356.444	2.873	50	5		FFBARN
CCCN(C[C@H]1CCCCO1)C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000170622599	509683780	/nfs/dbraw/zinc/68/37/80/509683780.db2.gz	JMCHSPDNPGUQQM-OAHLLOKOSA-N	0	0	373.413	2.597	50	5		FFBARN
Cc1cccc(OCC(=O)N2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000019841673	524714396	/nfs/dbraw/zinc/71/43/96/524714396.db2.gz	NJTFPTJRPPYYRZ-UHFFFAOYSA-N	0	0	369.421	2.626	50	5		FFBARN
CCOC(=O)Cc1csc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)n1	ZINC000009108592	571132395	/nfs/dbraw/zinc/13/23/95/571132395.db2.gz	CWQXJBVFJGEMMP-VOTSOKGWSA-N	0	0	361.379	2.809	50	5		FFBARN
CCOC(=O)/C(Sc1ccccc1[N+](=O)[O-])=C(/C)N1CCOCC1	ZINC000005505710	727781336	/nfs/dbraw/zinc/78/13/36/727781336.db2.gz	MNYCSLVEKNMBBY-NTCAYCPXSA-N	0	0	352.412	2.814	50	5		FFBARN
O=C(/C=C\c1ccco1)OCC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000033497410	990359981	/nfs/dbraw/zinc/35/99/81/990359981.db2.gz	PGENCDOCGQKBTC-XQRVVYSFSA-N	0	0	373.346	2.993	50	5		FFBARN
COc1ccccc1CNC(=O)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000000669079	210259875	/nfs/dbraw/zinc/25/98/75/210259875.db2.gz	HUHKRQGPONYJGP-UHFFFAOYSA-N	0	0	366.377	2.778	50	5		FFBARN
Cc1ccc2c(c1)nc1c3ccc4c(=O)[nH]c(=O)c5ccc(c(=O)n21)c3c45	ZINC000000629084	210252820	/nfs/dbraw/zinc/25/28/20/210252820.db2.gz	UTKNJTHGYOGYSD-UHFFFAOYSA-N	0	0	353.337	2.540	50	5		FFBARN
C[C@H](Cn1cc(Br)cn1)C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000002794300	210078120	/nfs/dbraw/zinc/07/81/20/210078120.db2.gz	HULNVIFMCCNGPD-MRVPVSSYSA-N	0	0	371.166	2.968	50	5		FFBARN
NC(=O)Cn1c2ccc(Br)cc2c2nc3ccccc3nc21	ZINC000001409212	210075355	/nfs/dbraw/zinc/07/53/55/210075355.db2.gz	GPHKZCYWCVJIKE-UHFFFAOYSA-N	0	0	355.195	2.986	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)[C@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000007985493	219838133	/nfs/dbraw/zinc/83/81/33/219838133.db2.gz	KKXRQLPQMWKDJK-KRWDZBQOSA-N	0	0	368.389	2.729	50	5		FFBARN
O=C(NCCCCn1ccnc1)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000058202133	211994455	/nfs/dbraw/zinc/99/44/55/211994455.db2.gz	MIGDMJDSKUWOMA-UHFFFAOYSA-N	0	0	357.414	2.602	50	5		FFBARN
O=c1c2nnc(-c3ccc([N+](=O)[O-])cc3)n2ccn1-c1ccc(F)c(F)c1	ZINC000017169435	220209757	/nfs/dbraw/zinc/20/97/57/220209757.db2.gz	MIRASXQZNGNASA-UHFFFAOYSA-N	0	0	369.287	2.734	50	5		FFBARN
CN(C)c1ccc([N+](=O)[O-])cc1C(=O)N(C)Cc1ccc2c(c1)OCCO2	ZINC000023789593	211396936	/nfs/dbraw/zinc/39/69/36/211396936.db2.gz	ZYEGTNAAOKSKDT-UHFFFAOYSA-N	0	0	371.393	2.704	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@H]1COc1ccc(C)cc1	ZINC000021092371	211306507	/nfs/dbraw/zinc/30/65/07/211306507.db2.gz	BGBRONAMAWNKHG-KRWDZBQOSA-N	0	0	355.350	2.849	50	5		FFBARN
Cc1cc(C(=O)Nc2ccc(CN3CCOCC3)cc2)ccc1[N+](=O)[O-]	ZINC000019683127	211245957	/nfs/dbraw/zinc/24/59/57/211245957.db2.gz	UXWWZIBEALPRCP-UHFFFAOYSA-N	0	0	355.394	2.988	50	5		FFBARN
O=C(CCn1cnc2sccc2c1=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000014266713	211090017	/nfs/dbraw/zinc/09/00/17/211090017.db2.gz	JVYGEKIHPPNWFH-UHFFFAOYSA-N	0	0	362.342	2.534	50	5		FFBARN
Cc1c(NC(=O)c2ccc(CN3C(=O)CCC3=O)cc2)cccc1[N+](=O)[O-]	ZINC000012994919	211016978	/nfs/dbraw/zinc/01/69/78/211016978.db2.gz	VRFZDBDZSJLARR-UHFFFAOYSA-N	0	0	367.361	2.805	50	5		FFBARN
Cc1ccc(NC(=O)CSc2nc3ccccc3c(=O)[nH]2)cc1[N+](=O)[O-]	ZINC000011535519	210885983	/nfs/dbraw/zinc/88/59/83/210885983.db2.gz	WRRIKMRCMWZIGX-UHFFFAOYSA-N	0	0	370.390	2.871	50	5		FFBARN
COc1ccc(NC(C)=O)cc1NC(=O)COc1ccc([N+](=O)[O-])c(C)c1	ZINC000007549591	210744262	/nfs/dbraw/zinc/74/42/62/210744262.db2.gz	BLKOLOMRZLIXTJ-UHFFFAOYSA-N	0	0	373.365	2.888	50	5		FFBARN
O=C(CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCC(=O)c1ccc[nH]1	ZINC000005688238	210634515	/nfs/dbraw/zinc/63/45/15/210634515.db2.gz	LMZYYUYGLJVMCV-UHFFFAOYSA-N	0	0	371.271	2.780	50	5		FFBARN
Cc1cc(OC(=O)c2ccc([N+](=O)[O-])cc2)ccc1N1C(=O)CCC1=O	ZINC000005063684	210596645	/nfs/dbraw/zinc/59/66/45/210596645.db2.gz	AFXVLFUOLYJPSB-UHFFFAOYSA-N	0	0	354.318	2.776	50	5		FFBARN
C[C@H]1C[C@H](C)CN(C(=O)COC(=O)c2ccc([N+](=O)[O-])cc2Cl)C1	ZINC000003499598	210484195	/nfs/dbraw/zinc/48/41/95/210484195.db2.gz	CFHIAQAMZOBSFA-QWRGUYRKSA-N	0	0	354.790	2.910	50	5		FFBARN
O=C(CNC(=O)c1ccc([N+](=O)[O-])cc1)Nc1cccc(C(F)(F)F)c1	ZINC000002871495	210433984	/nfs/dbraw/zinc/43/39/84/210433984.db2.gz	USACMETWBLKACZ-UHFFFAOYSA-N	0	0	367.283	2.982	50	5		FFBARN
COc1cc([C@@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])ccc1OCc1ccccc1	ZINC000002503850	210403195	/nfs/dbraw/zinc/40/31/95/210403195.db2.gz	ZCSAVJRPGZHZHC-KXBFYZLASA-N	0	0	356.378	2.871	50	5		FFBARN
COc1cc(OC)cc(C(=O)NC(=S)Nc2cccc([N+](=O)[O-])c2)c1	ZINC000001179960	210330607	/nfs/dbraw/zinc/33/06/07/210330607.db2.gz	GMOJTNLFDPNWPZ-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
COc1ccc(/C=C2/N=C(c3cccc([N+](=O)[O-])c3)OC2=O)c(OC)c1	ZINC000001091032	210316806	/nfs/dbraw/zinc/31/68/06/210316806.db2.gz	WIFNLBHEKDZGCJ-OQLLNIDSSA-N	0	0	354.318	2.957	50	5		FFBARN
COc1cc(/C=C/[N+](=O)[O-])ccc1OC(=O)[C@@H]1COc2ccccc2O1	ZINC000000943472	210292163	/nfs/dbraw/zinc/29/21/63/210292163.db2.gz	WPWDBNBDESFBDS-IJDCCNJMSA-N	0	0	357.318	2.688	50	5		FFBARN
Cn1c(SCC(=O)Nc2cccc([N+](=O)[O-])c2)nnc1-c1ccncc1	ZINC000000897168	210288879	/nfs/dbraw/zinc/28/88/79/210288879.db2.gz	QYOZLVVKGFWVMB-UHFFFAOYSA-N	0	0	370.394	2.516	50	5		FFBARN
COc1cc(CN2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc(OC)c1	ZINC000000865176	210282264	/nfs/dbraw/zinc/28/22/64/210282264.db2.gz	OUNPRFGKKREEDF-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
COC(=O)c1ccc(/C=C2\N=C(c3ccc([N+](=O)[O-])cc3)OC2=O)cc1	ZINC000000822633	210275656	/nfs/dbraw/zinc/27/56/56/210275656.db2.gz	LWCWMGPPLZYHPT-GDNBJRDFSA-N	0	0	352.302	2.726	50	5		FFBARN
Cc1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1NS(C)(=O)=O	ZINC000031112223	220632180	/nfs/dbraw/zinc/63/21/80/220632180.db2.gz	UELIQWWBEZBABO-UHFFFAOYSA-N	0	0	363.395	2.835	50	5		FFBARN
CCN(CC)S(=O)(=O)c1ccc(N2CCC(C)CC2)c([N+](=O)[O-])c1	ZINC000008149563	132259631	/nfs/dbraw/zinc/25/96/31/132259631.db2.gz	VUCOHANFTLNFLQ-UHFFFAOYSA-N	0	0	355.460	2.862	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])N1CCN(c2ccc(F)cc2)CC1	ZINC000002806698	132384002	/nfs/dbraw/zinc/38/40/02/132384002.db2.gz	OOXDYYTXNJEAGS-UHFFFAOYSA-N	0	0	374.328	2.605	50	5		FFBARN
CC[C@@H]1CN(c2ccc(S(=O)(=O)C(F)(F)F)cc2[N+](=O)[O-])CCO1	ZINC000029524453	132920635	/nfs/dbraw/zinc/92/06/35/132920635.db2.gz	NLJREYZGDKFHRI-SECBINFHSA-N	0	0	368.333	2.504	50	5		FFBARN
CN(C)c1nccc(CN(C)c2ccc(Br)cc2[N+](=O)[O-])n1	ZINC000095460571	221910894	/nfs/dbraw/zinc/91/08/94/221910894.db2.gz	MOQUNENCSQMKAU-UHFFFAOYSA-N	0	0	366.219	2.850	50	5		FFBARN
Cc1cccc(-c2noc(CCNC(=O)c3cccc([N+](=O)[O-])c3)n2)c1	ZINC000096293207	222112163	/nfs/dbraw/zinc/11/21/63/222112163.db2.gz	WTAKOPWHPIZGNP-UHFFFAOYSA-N	0	0	352.350	2.926	50	5		FFBARN
O=C(/C=C\c1cc([N+](=O)[O-])cc2c1OCOC2)NCCc1ccccc1	ZINC000096911600	222139009	/nfs/dbraw/zinc/13/90/09/222139009.db2.gz	GFBXHAPCJUYVLV-SREVYHEPSA-N	0	0	354.362	2.833	50	5		FFBARN
COc1cccc(C2=Nc3nnnn3[C@@H](c3cccc([N+](=O)[O-])c3)C2)c1	ZINC000101034429	222260246	/nfs/dbraw/zinc/26/02/46/222260246.db2.gz	ZPEKGOTWIKTCFG-MRXNPFEDSA-N	0	0	350.338	2.646	50	5		FFBARN
O=C(NCC1N=NC(=S)N1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1	ZINC000004059218	263331024	/nfs/dbraw/zinc/33/10/24/263331024.db2.gz	WQQXAJJJCQOCBH-UHFFFAOYSA-N	0	0	373.369	2.533	50	5		FFBARN
NC(=O)c1c(NC(=O)/C=C/c2ccc([N+](=O)[O-])o2)sc2c1CCCC2	ZINC000002761038	506290319	/nfs/dbraw/zinc/29/03/19/506290319.db2.gz	WONGNDCFXIIJFL-FNORWQNLSA-N	0	0	361.379	2.879	50	5		FFBARN
CCNC(=O)[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)OCc1ccccc1	ZINC000002864629	506298911	/nfs/dbraw/zinc/29/89/11/506298911.db2.gz	QLCFPHQDBYDXAX-QGZVFWFLSA-N	0	0	371.393	2.568	50	5		FFBARN
O=C(CCC(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1)NC1CCCCC1	ZINC000003004390	506305604	/nfs/dbraw/zinc/30/56/04/506305604.db2.gz	LZLANBSFUYYSLR-UHFFFAOYSA-N	0	0	362.382	2.550	50	5		FFBARN
COC(=O)c1ccc(SCC(=O)NCCc2ccccc2)c([N+](=O)[O-])c1	ZINC000003032003	506306602	/nfs/dbraw/zinc/30/66/02/506306602.db2.gz	AXVXEJUSTXGHNB-UHFFFAOYSA-N	0	0	374.418	2.832	50	5		FFBARN
CCCN(CC(F)(F)F)S(=O)(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000032916490	506312793	/nfs/dbraw/zinc/31/27/93/506312793.db2.gz	WZDBOBBHHBRRDL-UHFFFAOYSA-N	0	0	356.322	2.566	50	5		FFBARN
Cc1nc(CC(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)cs1	ZINC000003301597	506320580	/nfs/dbraw/zinc/32/05/80/506320580.db2.gz	WYPMUQPYWMAQJS-UHFFFAOYSA-N	0	0	350.352	2.512	50	5		FFBARN
O=C(COC(=O)c1cc([N+](=O)[O-])ccc1Cl)NCCc1ccccc1	ZINC000003349622	506324690	/nfs/dbraw/zinc/32/46/90/506324690.db2.gz	VVSDYVGVDYHAFF-UHFFFAOYSA-N	0	0	362.769	2.764	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)Oc1ccc(F)c(F)c1	ZINC000003432147	506330486	/nfs/dbraw/zinc/33/04/86/506330486.db2.gz	POYGPBREFUVIIM-UHFFFAOYSA-N	0	0	350.277	2.599	50	5		FFBARN
Cc1ccc2c(CN3C(=O)c4ccc([N+](=O)[O-])cc4C3=O)cc(=O)oc2c1	ZINC000003415586	506329141	/nfs/dbraw/zinc/32/91/41/506329141.db2.gz	GAMSCCHHFQOSRD-UHFFFAOYSA-N	0	0	364.313	2.806	50	5		FFBARN
COc1cccc2c1ccn(CC(=O)Nc1ccc([N+](=O)[O-])cc1)c2=O	ZINC000004292193	506370242	/nfs/dbraw/zinc/37/02/42/506370242.db2.gz	ARYDMBINPBYPAY-UHFFFAOYSA-N	0	0	353.334	2.557	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)Cc3ccc([N+](=O)[O-])cc3)CC2=O)cc1C	ZINC000004497046	506377721	/nfs/dbraw/zinc/37/77/21/506377721.db2.gz	QFXQJHXHLHQGRE-INIZCTEOSA-N	0	0	367.405	2.676	50	5		FFBARN
Cc1c(C(=O)N[C@@H]2CC(=O)N(c3ccc(F)cc3)C2)cccc1[N+](=O)[O-]	ZINC000004497407	506378452	/nfs/dbraw/zinc/37/84/52/506378452.db2.gz	IIVBJEQTFZFQQE-CYBMUJFWSA-N	0	0	357.341	2.578	50	5		FFBARN
COC(CNC(=O)c1ccc(N2CCc3ccccc32)c([N+](=O)[O-])c1)OC	ZINC000004660561	506386551	/nfs/dbraw/zinc/38/65/51/506386551.db2.gz	IYAGELTYGVQHSV-UHFFFAOYSA-N	0	0	371.393	2.638	50	5		FFBARN
COc1ccc(/C=C/C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000004901100	506404159	/nfs/dbraw/zinc/40/41/59/506404159.db2.gz	VRAUMVFKGVMFIU-NYYWCZLTSA-N	0	0	367.405	2.965	50	5		FFBARN
O=C(CS(=O)(=O)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000005014178	506414570	/nfs/dbraw/zinc/41/45/70/506414570.db2.gz	ZCTQUBIPWYNITN-UHFFFAOYSA-N	0	0	368.798	2.802	50	5		FFBARN
Cc1cccc(Nc2nc(N3C[C@@H](C)O[C@H](C)C3)nc(N)c2[N+](=O)[O-])c1	ZINC000005068639	506418868	/nfs/dbraw/zinc/41/88/68/506418868.db2.gz	QBAOLCNCQYYCFT-VXGBXAGGSA-N	0	0	358.402	2.633	50	5		FFBARN
Cc1ccc(N2C(=O)C[C@]3(CC(c4cccc([N+](=O)[O-])c4)=NO3)C2=O)cc1	ZINC000005053148	506419742	/nfs/dbraw/zinc/41/97/42/506419742.db2.gz	IFOQFYBTRATCGS-LJQANCHMSA-N	0	0	365.345	2.730	50	5		FFBARN
C[C@H]1C(=O)N(c2ccc([N+](=O)[O-])cc2)CCN1C(=O)c1ccc(F)cc1	ZINC000037522068	506427604	/nfs/dbraw/zinc/42/76/04/506427604.db2.gz	RMILMMJFRNEBFL-LBPRGKRZSA-N	0	0	357.341	2.611	50	5		FFBARN
CCOC(=O)c1ccc(NC(=S)NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000005499816	506445515	/nfs/dbraw/zinc/44/55/15/506445515.db2.gz	XMQWLMBQIJGUJK-UHFFFAOYSA-N	0	0	373.390	2.898	50	5		FFBARN
Cn1c(=O)nc(SCC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc21	ZINC000005712931	506455183	/nfs/dbraw/zinc/45/51/83/506455183.db2.gz	IIBKJKDGNBTINP-UHFFFAOYSA-N	0	0	355.375	2.817	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)[C@@H]1CC(=O)N(CC(F)(F)F)C1	ZINC000040073850	506463282	/nfs/dbraw/zinc/46/32/82/506463282.db2.gz	OFTDOLLULFXALW-CMPLNLGQSA-N	0	0	373.331	2.525	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)C1=NN(Cc2ccc(F)cc2)C(=O)CC1	ZINC000040141394	506471888	/nfs/dbraw/zinc/47/18/88/506471888.db2.gz	SITHSCKFWKNQDM-UHFFFAOYSA-N	0	0	370.340	2.851	50	5		FFBARN
CCN(CC)c1ccc(Nc2ccc(S(C)(=O)=O)cc2[N+](=O)[O-])cn1	ZINC000040153724	506475824	/nfs/dbraw/zinc/47/58/24/506475824.db2.gz	ZDMZHPTYDVYASP-UHFFFAOYSA-N	0	0	364.427	2.983	50	5		FFBARN
CCc1ccc2c(c1)[C@@](O)(CC(=O)c1ccc(OC)c([N+](=O)[O-])c1)C(=O)N2	ZINC000006758915	506504064	/nfs/dbraw/zinc/50/40/64/506504064.db2.gz	WBYTVVYNLDAZEU-IBGZPJMESA-N	0	0	370.361	2.579	50	5		FFBARN
C[C@@H]1c2cccn2CCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000006949125	506518749	/nfs/dbraw/zinc/51/87/49/506518749.db2.gz	DCUHILDHKMSKBV-SNVBAGLBSA-N	0	0	355.803	2.815	50	5		FFBARN
CCn1c2ccccc2c2cc(NC(=O)Cn3cnc([N+](=O)[O-])n3)ccc21	ZINC000007453859	506564163	/nfs/dbraw/zinc/56/41/63/506564163.db2.gz	AVZAGYWHQDOWEU-UHFFFAOYSA-N	0	0	364.365	2.953	50	5		FFBARN
CSc1ncccc1C(=O)O[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007657629	506578510	/nfs/dbraw/zinc/57/85/10/506578510.db2.gz	XUVLJKVZRVYPLY-JTQLQIEISA-N	0	0	361.379	2.896	50	5		FFBARN
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)Nc1ccccc1Cl	ZINC000007749965	506588139	/nfs/dbraw/zinc/58/81/39/506588139.db2.gz	HNQHRAXJUCJOPA-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
C[C@H]1c2ccsc2CCN1C(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000007830045	506594701	/nfs/dbraw/zinc/59/47/01/506594701.db2.gz	ZREOGAHILSXRSR-LBPRGKRZSA-N	0	0	373.434	2.922	50	5		FFBARN
Cc1nn(Cc2ccc(C(=O)NCc3ccccn3)cc2)c(C)c1[N+](=O)[O-]	ZINC000008073259	506619776	/nfs/dbraw/zinc/61/97/76/506619776.db2.gz	HOMMWUODDJOANS-UHFFFAOYSA-N	0	0	365.393	2.781	50	5		FFBARN
COc1cccc2c(=O)c3c(O)cc(OCC(=O)OC(C)C)cc3oc12	ZINC000008235660	506634920	/nfs/dbraw/zinc/63/49/20/506634920.db2.gz	QRBDPEJMKXGTGY-UHFFFAOYSA-N	0	0	358.346	2.991	50	5	biogenic	FFBARN
Cc1cccc([N+](=O)[O-])c1NC(=O)COc1ccc(Cl)cc1C(N)=O	ZINC000008752067	506667668	/nfs/dbraw/zinc/66/76/68/506667668.db2.gz	ZIFMUAUWWATVJN-UHFFFAOYSA-N	0	0	363.757	2.673	50	5		FFBARN
Cc1ccc(NC(=O)CCn2c(=O)oc3cc([N+](=O)[O-])ccc32)c(O)c1	ZINC000008771266	506669159	/nfs/dbraw/zinc/66/91/59/506669159.db2.gz	BXBFMVOJXWVFII-UHFFFAOYSA-N	0	0	357.322	2.546	50	5		FFBARN
COc1cccc(C(=O)OCc2cc([N+](=O)[O-])cc3c2OCOC3)c1O	ZINC000009255702	506687460	/nfs/dbraw/zinc/68/74/60/506687460.db2.gz	SLIRONZFRJIRNB-UHFFFAOYSA-N	0	0	361.306	2.533	50	5		FFBARN
O=C(/C=C/c1ccc(-c2ccccc2[N+](=O)[O-])s1)NC[C@@H]1COCCO1	ZINC000055846779	506868767	/nfs/dbraw/zinc/86/87/67/506868767.db2.gz	HVUQDSGJFLSYNO-STMXVASLSA-N	0	0	374.418	2.868	50	5		FFBARN
CC(C)(C)NC(=O)[C@H]1Cc2ccccc2CN1c1ncccc1[N+](=O)[O-]	ZINC000020386076	507220866	/nfs/dbraw/zinc/22/08/66/507220866.db2.gz	HCVVKYGIOCDOEX-MRXNPFEDSA-N	0	0	354.410	2.836	50	5		FFBARN
COc1ccc(CN(C)Cn2nc(C)c([N+](=O)[O-])c2C)c(OC)c1OC	ZINC000058160838	507377220	/nfs/dbraw/zinc/37/72/20/507377220.db2.gz	QYELXSGQXYSTAK-UHFFFAOYSA-N	0	0	364.402	2.523	50	5		FFBARN
COc1ccc(NC(=O)N(C)C[C@@H]2COc3ccccc3O2)c([N+](=O)[O-])c1	ZINC000024690750	507430916	/nfs/dbraw/zinc/43/09/16/507430916.db2.gz	XFMNRDNTXIWODR-CYBMUJFWSA-N	0	0	373.365	2.907	50	5		FFBARN
C[C@@H]1CCC[C@H](C)N1C(=O)CN1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000024796409	507438340	/nfs/dbraw/zinc/43/83/40/507438340.db2.gz	ZIKRIZPVJWAUGF-IYBDPMFKSA-N	0	0	360.458	2.506	50	5		FFBARN
C[C@@H]1c2ccsc2CCN1C(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000025382230	507496754	/nfs/dbraw/zinc/49/67/54/507496754.db2.gz	LEODFIQMFALFQX-LLVKDONJSA-N	0	0	369.406	2.997	50	5		FFBARN
O=C(NCc1ccc(-n2ccnc2)nc1)c1ccc([N+](=O)[O-])cc1Cl	ZINC000031909690	507822281	/nfs/dbraw/zinc/82/22/81/507822281.db2.gz	MYDDVFLPWZKDEQ-UHFFFAOYSA-N	0	0	357.757	2.759	50	5		FFBARN
Cc1nc2cc(NS(=O)(=O)CCc3ccccc3[N+](=O)[O-])ccc2n1C	ZINC000089721619	507859409	/nfs/dbraw/zinc/85/94/09/507859409.db2.gz	BOWNUVSWCISZAL-UHFFFAOYSA-N	0	0	374.422	2.774	50	5		FFBARN
O=S(=O)(CCNc1ncnc2cc3ccccc3cc21)NCC1CCC1	ZINC000095437093	508185072	/nfs/dbraw/zinc/18/50/72/508185072.db2.gz	DJNZRIDEPOJYAE-UHFFFAOYSA-N	0	0	370.478	2.914	50	5		FFBARN
COc1ccc2c(c1)CCCN(c1cc3nc[nH]c(=O)c3cc1[N+](=O)[O-])C2	ZINC000170621102	509683539	/nfs/dbraw/zinc/68/35/39/509683539.db2.gz	HAVLBOAOYVTXCM-UHFFFAOYSA-N	0	0	366.377	2.793	50	5		FFBARN
Cc1nn(CCC(=O)Nc2nc(-c3ccccc3)ns2)c(C)c1[N+](=O)[O-]	ZINC000263657968	510772903	/nfs/dbraw/zinc/77/29/03/510772903.db2.gz	ITHVZDCONRZXSK-UHFFFAOYSA-N	0	0	372.410	2.955	50	5		FFBARN
CC(=O)N[C@H]1Cc2ccccc2N(C(=O)c2cc(Cl)cc([N+](=O)[O-])c2)C1	ZINC000095972518	534673872	/nfs/dbraw/zinc/67/38/72/534673872.db2.gz	JZMYRNYFXCNJNS-HNNXBMFYSA-N	0	0	373.796	2.956	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)CC1	ZINC000000805352	537066837	/nfs/dbraw/zinc/06/68/37/537066837.db2.gz	KNVCIGJMUWZNAX-UHFFFAOYSA-N	0	0	355.394	2.874	50	5		FFBARN
Cc1nn(C)c(N2CCN(C(=O)c3ccc(C(C)C)cc3)CC2)c1[N+](=O)[O-]	ZINC000047331254	570885261	/nfs/dbraw/zinc/88/52/61/570885261.db2.gz	YXGXMNFVXCEJAS-UHFFFAOYSA-N	0	0	371.441	2.723	50	5		FFBARN
Cc1c(NC(=O)/C=C\c2ccc([N+](=O)[O-])o2)c(=O)n(-c2ccccc2)n1C	ZINC000097998602	1013244513	/nfs/dbraw/zinc/24/45/13/1013244513.db2.gz	ASBKXIFBRMYLGP-NTMALXAHSA-N	0	0	368.349	2.638	50	5		FFBARN
Cc1ccc(CNC(=O)COC(=O)/C=C\c2ccccc2[N+](=O)[O-])cc1	ZINC000097655829	1012920249	/nfs/dbraw/zinc/92/02/49/1012920249.db2.gz	ZZRJQFFWJBUKBN-KHPPLWFESA-N	0	0	354.362	2.776	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)Nc1ccc2c(c1)OCO2	ZINC000035145432	1019302160	/nfs/dbraw/zinc/30/21/60/1019302160.db2.gz	QQSOIOXLTIDWMH-BAQGIRSFSA-N	0	0	370.317	2.519	50	5		FFBARN
COC(=O)C1=C(C)NC(C)=C(C(=O)OC(C)C)[C@H]1c1ccccc1[N+](=O)[O-]	ZINC000000628571	210253890	/nfs/dbraw/zinc/25/38/90/210253890.db2.gz	RSTVYACYSIEKFX-KRWDZBQOSA-N	0	0	374.393	2.954	50	5		FFBARN
COC(=O)c1cc(C(=O)Nc2nnc(C(C)(C)C)s2)cc([N+](=O)[O-])c1	ZINC000002991647	219480214	/nfs/dbraw/zinc/48/02/14/219480214.db2.gz	SUAIPJKWKYHPKE-UHFFFAOYSA-N	0	0	364.383	2.783	50	5		FFBARN
Cc1ccc(C(=O)CSc2nnnn2-c2ccc(O)cc2)cc1[N+](=O)[O-]	ZINC000008428343	219862502	/nfs/dbraw/zinc/86/25/02/219862502.db2.gz	KDFSUMSAEGGCNZ-UHFFFAOYSA-N	0	0	371.378	2.560	50	5		FFBARN
COc1ccc(C)cc1NC(=O)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000058264170	212000892	/nfs/dbraw/zinc/00/08/92/212000892.db2.gz	MNRZSTVNLXHNJP-UHFFFAOYSA-N	0	0	367.365	2.809	50	5		FFBARN
Cc1nnc([C@H](NC(=O)c2ccc([N+](=O)[O-])cc2)c2ccccc2)n1C	ZINC000058306716	212003214	/nfs/dbraw/zinc/00/32/14/212003214.db2.gz	CJNZJOPFXWNLNV-MRXNPFEDSA-N	0	0	351.366	2.551	50	5		FFBARN
O=C(/C=C/c1ccccc1[N+](=O)[O-])NCc1cccc(Cn2cncn2)c1	ZINC000058280989	212001879	/nfs/dbraw/zinc/00/18/79/212001879.db2.gz	HVZMERIJTJIVOZ-CMDGGOBGSA-N	0	0	363.377	2.564	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])c(=O)n(Cc2ccc(Cl)cc2Cl)c1	ZINC000041744554	211774158	/nfs/dbraw/zinc/77/41/58/211774158.db2.gz	QYRMJZGBNYJSRY-UHFFFAOYSA-N	0	0	357.149	2.898	50	5		FFBARN
O=C(CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])NC[C@@H]1CCCO1	ZINC000032780744	211562305	/nfs/dbraw/zinc/56/23/05/211562305.db2.gz	XGQPVXVIGBMEFH-NSHDSACASA-N	0	0	361.320	2.711	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC=C1N=C(c2ccccc2F)OC1=O	ZINC000027499501	211465281	/nfs/dbraw/zinc/46/52/81/211465281.db2.gz	AZBWVIVSUMUBAJ-ZROIWOOFSA-N	0	0	357.297	2.999	50	5		FFBARN
Cc1cc(C)n(-c2ccc(NC(=O)Cc3ccccc3[N+](=O)[O-])cn2)n1	ZINC000024785561	211414337	/nfs/dbraw/zinc/41/43/37/211414337.db2.gz	QQOVGQSMTBLUGB-UHFFFAOYSA-N	0	0	351.366	2.974	50	5		FFBARN
C[C@H](NC(=O)COc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2	ZINC000024227685	211403937	/nfs/dbraw/zinc/40/39/37/211403937.db2.gz	OVLZYDUNNNBTFM-LBPRGKRZSA-N	0	0	358.350	2.622	50	5		FFBARN
CSc1ccc(C(=O)N2CCN(Cc3ccncc3)CC2)cc1[N+](=O)[O-]	ZINC000023800936	211397246	/nfs/dbraw/zinc/39/72/46/211397246.db2.gz	YGCWOOHYISTNTA-UHFFFAOYSA-N	0	0	372.450	2.670	50	5		FFBARN
CC(=O)NC1=NN(C(C)=O)[C@@H](c2ccc(-c3cccc([N+](=O)[O-])c3)o2)S1	ZINC000020895547	211298454	/nfs/dbraw/zinc/29/84/54/211298454.db2.gz	BJXLKFMVYHTHBP-OAHLLOKOSA-N	0	0	374.378	2.856	50	5		FFBARN
Cc1cc(C)c2c(n1)sc1c2nnn(-c2cccc([N+](=O)[O-])c2)c1=O	ZINC000020446335	211280060	/nfs/dbraw/zinc/28/00/60/211280060.db2.gz	KJPCRJYYLHPLRJ-UHFFFAOYSA-N	0	0	353.363	2.915	50	5		FFBARN
Cc1c(NC(=O)c2ccc(CN3CCOCC3)cc2)cccc1[N+](=O)[O-]	ZINC000020363372	211277303	/nfs/dbraw/zinc/27/73/03/211277303.db2.gz	POPXVLNFILMSBX-UHFFFAOYSA-N	0	0	355.394	2.988	50	5		FFBARN
Cc1cccn2c(=O)c(NC(=O)c3ccc([N+](=O)[O-])c(C)c3)c(C)nc12	ZINC000015865281	211148432	/nfs/dbraw/zinc/14/84/32/211148432.db2.gz	DUSTULLSZQSFMP-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
Cc1c(C(=O)Nc2ccc(F)c(NS(C)(=O)=O)c2)cccc1[N+](=O)[O-]	ZINC000012911613	211007802	/nfs/dbraw/zinc/00/78/02/211007802.db2.gz	WCXSJKORCOBMDE-UHFFFAOYSA-N	0	0	367.358	2.666	50	5		FFBARN
COc1cc(C(=O)N2CCO[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC	ZINC000012872040	211002692	/nfs/dbraw/zinc/00/26/92/211002692.db2.gz	HACKXOMHANMNDH-GOSISDBHSA-N	0	0	372.377	2.826	50	5		FFBARN
O=c1c([N+](=O)[O-])c(Nc2ccc3c(c2)OCCCO3)nc2ccccn21	ZINC000012537363	210966045	/nfs/dbraw/zinc/96/60/45/210966045.db2.gz	HYEXHHBYCUOFIU-UHFFFAOYSA-N	0	0	354.322	2.508	50	5		FFBARN
O=c1c2cnn(-c3ccc(F)cc3)c2ncn1Cc1ccc([N+](=O)[O-])cc1	ZINC000005139284	210602502	/nfs/dbraw/zinc/60/25/02/210602502.db2.gz	AHPHAAKNWWOCJY-UHFFFAOYSA-N	0	0	365.324	2.678	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1)c1cccn(OCc2ccccc2)c1=O	ZINC000005054755	210595815	/nfs/dbraw/zinc/59/58/15/210595815.db2.gz	SZIHJKDKTIQPJG-UHFFFAOYSA-N	0	0	365.345	2.638	50	5		FFBARN
CC(=O)N/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000004526249	210537969	/nfs/dbraw/zinc/53/79/69/210537969.db2.gz	GRGHBYBZGDBHNJ-MHWRWJLKSA-N	0	0	370.321	2.619	50	5		FFBARN
O=C(c1c([N+](=O)[O-])cc(Oc2ccccc2)cc1[N+](=O)[O-])N1CCOCC1	ZINC000004547584	210539447	/nfs/dbraw/zinc/53/94/47/210539447.db2.gz	PCUWUBZRGVJUOH-UHFFFAOYSA-N	0	0	373.321	2.768	50	5		FFBARN
CCNC(=O)[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=O)OCc1ccccc1	ZINC000002864630	210431241	/nfs/dbraw/zinc/43/12/41/210431241.db2.gz	QLCFPHQDBYDXAX-KRWDZBQOSA-N	0	0	371.393	2.568	50	5		FFBARN
Cn1c(=O)nc2n(Cc3ccccc3)c3cccc(Cl)c3cc-2c1=O	ZINC000002234972	210385279	/nfs/dbraw/zinc/38/52/79/210385279.db2.gz	YDDXVVWBVJHQBB-UHFFFAOYSA-N	0	0	351.793	2.902	50	5		FFBARN
COC(=O)c1sccc1OS(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000002162803	210382247	/nfs/dbraw/zinc/38/22/47/210382247.db2.gz	DGOXCGCZEGEKBV-UHFFFAOYSA-N	0	0	357.365	2.519	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1-c1ccc([N+](=O)[O-])cc1C(=O)OC	ZINC000001717038	210368144	/nfs/dbraw/zinc/36/81/44/210368144.db2.gz	DGANXQLLXWERMX-UHFFFAOYSA-N	0	0	360.278	2.743	50	5		FFBARN
COc1ccc(C(=O)Cn2c(C)nc([N+](=O)[O-])c2Br)cc1	ZINC000001301737	210341561	/nfs/dbraw/zinc/34/15/61/210341561.db2.gz	RDSWBYNHWGGNGU-UHFFFAOYSA-N	0	0	354.160	2.754	50	5		FFBARN
CC(C)CNC(=O)c1cccc(NC(=O)COc2cccc([N+](=O)[O-])c2)c1	ZINC000001148190	210326195	/nfs/dbraw/zinc/32/61/95/210326195.db2.gz	HWDUFEFJQPMAKT-UHFFFAOYSA-N	0	0	371.393	2.998	50	5		FFBARN
CCOC(=O)c1cnn(-c2ccccc2)c1NC(=O)c1ccc([N+](=O)[O-])o1	ZINC000001122140	210319285	/nfs/dbraw/zinc/31/92/85/210319285.db2.gz	PPTQFUVKBSSMME-UHFFFAOYSA-N	0	0	370.321	2.803	50	5		FFBARN
CC(=O)Nc1ccc(C2=N/C(=C/c3cccc([N+](=O)[O-])c3)C(=O)O2)cc1	ZINC000000880342	210285110	/nfs/dbraw/zinc/28/51/10/210285110.db2.gz	KAOMMPSPHYWBNG-MHWRWJLKSA-N	0	0	351.318	2.898	50	5		FFBARN
COc1cc(NC(=O)Cn2nc(C(F)(F)F)cc2C)cc([N+](=O)[O-])c1	ZINC000000825511	210276757	/nfs/dbraw/zinc/27/67/57/210276757.db2.gz	VBXMKVWEISVKEP-UHFFFAOYSA-N	0	0	358.276	2.766	50	5		FFBARN
Cc1c(NC(=O)c2cccc([N+](=O)[O-])c2)c(=O)n(-c2ccccc2)n1C	ZINC000000822427	210275637	/nfs/dbraw/zinc/27/56/37/210275637.db2.gz	WRLBLWGLQQXHBP-UHFFFAOYSA-N	0	0	352.350	2.645	50	5		FFBARN
CCOC(=O)N1CCC(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)CC1	ZINC000024471052	220448461	/nfs/dbraw/zinc/44/84/61/220448461.db2.gz	YRENPOULLYVUIW-UHFFFAOYSA-N	0	0	355.778	2.599	50	5		FFBARN
CCc1ccc(NC(=O)c2cccc(NS(C)(=O)=O)c2)cc1[N+](=O)[O-]	ZINC000032031234	220651990	/nfs/dbraw/zinc/65/19/90/220651990.db2.gz	LOTJPEKIOKCTLY-UHFFFAOYSA-N	0	0	363.395	2.781	50	5		FFBARN
Cc1c([N+](=O)[O-])cccc1S(=O)(=O)Nc1cccc(-n2cccn2)c1	ZINC000048355186	221009780	/nfs/dbraw/zinc/00/97/80/221009780.db2.gz	CZFHFVWRSMXAMD-UHFFFAOYSA-N	0	0	358.379	2.890	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])cn(Cc2c(C)cc(C)c(C(C)=O)c2C)c1=O	ZINC000048186429	221000997	/nfs/dbraw/zinc/00/09/97/221000997.db2.gz	VIAPWMLKYBDMLB-UHFFFAOYSA-N	0	0	372.377	2.719	50	5		FFBARN
CCn1c(CNC(=O)COc2ccccc2[N+](=O)[O-])nc2ccccc21	ZINC000057995763	221096435	/nfs/dbraw/zinc/09/64/35/221096435.db2.gz	HRMXCKMRXUKPPR-UHFFFAOYSA-N	0	0	354.366	2.660	50	5		FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCc1ccc2c(c1)OCO2	ZINC000058066762	221098543	/nfs/dbraw/zinc/09/85/43/221098543.db2.gz	MZBZXXZOUOAMAS-UHFFFAOYSA-N	0	0	353.334	2.595	50	5		FFBARN
O=C(N[C@H]1C[C@H]1c1cccc(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000067092483	221247175	/nfs/dbraw/zinc/24/71/75/221247175.db2.gz	ZKAHCVKFLOWEGX-JSGCOSHPSA-N	0	0	358.325	2.791	50	5		FFBARN
COC(=O)/C=C\CN1C(=O)[C@@H](c2ccccc2)Oc2cc([N+](=O)[O-])ccc21	ZINC000097406793	132228921	/nfs/dbraw/zinc/22/89/21/132228921.db2.gz	UIMZWCJZDWWSCW-GNJLHFKMSA-N	0	0	368.345	2.791	50	5		FFBARN
Cc1cc(C)c([N+](=O)[O-])c(N2CCN(c3cc(C4(C)CC4)[nH]n3)CC2)n1	ZINC000225814521	132286733	/nfs/dbraw/zinc/28/67/33/132286733.db2.gz	RJQCQATTYDTJGI-UHFFFAOYSA-N	0	0	356.430	2.708	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OCC(=O)N2CCN(c3ccccc3)CC2)c1	ZINC000009368921	132378881	/nfs/dbraw/zinc/37/88/81/132378881.db2.gz	VAKNZMFHWGZBQV-UHFFFAOYSA-N	0	0	355.394	2.631	50	5		FFBARN
Cc1ccc(Nc2nc(N3C[C@H](C)O[C@@H](C)C3)nc(N)c2[N+](=O)[O-])cc1C	ZINC000004306087	132386775	/nfs/dbraw/zinc/38/67/75/132386775.db2.gz	LTTZAUJAACBVAQ-STQMWFEESA-N	0	0	372.429	2.941	50	5		FFBARN
C[C@@H](CC(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1ccccc1	ZINC000057140764	136128297	/nfs/dbraw/zinc/12/82/97/136128297.db2.gz	AXPDEFGTVXIDLW-HNNXBMFYSA-N	0	0	354.410	2.832	50	5		FFBARN
O=C(NCc1cccnc1)c1ccc(NCc2cccnc2)c([N+](=O)[O-])c1	ZINC000096361334	222117645	/nfs/dbraw/zinc/11/76/45/222117645.db2.gz	XLJGWPQWBCROLR-UHFFFAOYSA-N	0	0	363.377	2.927	50	5		FFBARN
O=C1[C@H]2ON=C(c3cccc([N+](=O)[O-])c3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000101075087	222261000	/nfs/dbraw/zinc/26/10/00/222261000.db2.gz	ZHUAXXIMKWNYMN-HIFRSBDPSA-N	0	0	371.736	2.541	50	5		FFBARN
CCOC(=O)[C@@H]1CCCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000104810592	222361625	/nfs/dbraw/zinc/36/16/25/222361625.db2.gz	XZLSFBUSSPXDLM-TZMCWYRMSA-N	0	0	374.397	2.981	50	5		FFBARN
Cc1cc(C(=O)COc2cccnc2[N+](=O)[O-])c(C)n1C[C@@H]1CCCO1	ZINC000002653738	506287052	/nfs/dbraw/zinc/28/70/52/506287052.db2.gz	VGESANCCSAMMEP-AWEZNQCLSA-N	0	0	359.382	2.849	50	5		FFBARN
C[C@@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1ccc(Br)cc1F	ZINC000002794306	506293390	/nfs/dbraw/zinc/29/33/90/506293390.db2.gz	QUIYLDJCMVWFHM-QMMMGPOBSA-N	0	0	371.166	2.968	50	5		FFBARN
C[C@@H](Oc1ccccc1Cl)C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032795471	506296947	/nfs/dbraw/zinc/29/69/47/506296947.db2.gz	PTGSXWLKPLXZLO-ABAIWWIYSA-N	0	0	364.785	2.865	50	5		FFBARN
O=[N+]([O-])c1ccn(C(=S)Nc2cnn(Cc3ccccc3Cl)c2)n1	ZINC000002802534	506294988	/nfs/dbraw/zinc/29/49/88/506294988.db2.gz	XEODITMINQITSR-UHFFFAOYSA-N	0	0	362.802	2.935	50	5		FFBARN
Cc1cccc(C(=O)N2CCC[C@@H]2c2nnc3ccccn32)c1[N+](=O)[O-]	ZINC000032809040	506298387	/nfs/dbraw/zinc/29/83/87/506298387.db2.gz	LSUHIEGVHWQQDA-CQSZACIVSA-N	0	0	351.366	2.923	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@H](C)C(=O)NCc1cccs1	ZINC000002884713	506300424	/nfs/dbraw/zinc/30/04/24/506300424.db2.gz	BZHVCOXKGFTLAZ-MRVPVSSYSA-N	0	0	373.232	2.801	50	5		FFBARN
Cc1noc2nc(C)cc(C(=O)NCCNc3ccc([N+](=O)[O-])cc3)c12	ZINC000032870502	506305730	/nfs/dbraw/zinc/30/57/30/506305730.db2.gz	FXXFFFNJKBHIND-UHFFFAOYSA-N	0	0	355.354	2.590	50	5		FFBARN
COc1ccc(OC)c(S(=O)(=O)Oc2ccc(C)cc2[N+](=O)[O-])c1	ZINC000003120043	506311167	/nfs/dbraw/zinc/31/11/67/506311167.db2.gz	UEDMIWPXGSNVMO-UHFFFAOYSA-N	0	0	353.352	2.688	50	5		FFBARN
C[C@H]1Cc2ccccc2N1C(=O)COC(=O)Cc1ccccc1[N+](=O)[O-]	ZINC000003217721	506313689	/nfs/dbraw/zinc/31/36/89/506313689.db2.gz	CSUXYACMXJPLPJ-ZDUSSCGKSA-N	0	0	354.362	2.658	50	5		FFBARN
C[C@H](NC(=O)COc1ncnc2cc([N+](=O)[O-])ccc21)c1ccccc1	ZINC000003445154	506331110	/nfs/dbraw/zinc/33/11/10/506331110.db2.gz	DHNNSMFJXPLJQL-LBPRGKRZSA-N	0	0	352.350	2.794	50	5		FFBARN
CCOc1ccccc1NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000003472538	506333760	/nfs/dbraw/zinc/33/37/60/506333760.db2.gz	DNDZWUWVOWTWBN-UHFFFAOYSA-N	0	0	357.366	2.752	50	5		FFBARN
O=[N+]([O-])c1c2nonc2c(SCc2ccco2)cc1NCCCO	ZINC000004672880	506386804	/nfs/dbraw/zinc/38/68/04/506386804.db2.gz	HLYQFJBEFRRTJU-UHFFFAOYSA-N	0	0	350.356	2.811	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1NC2=C(CCCC2)[C@@]1(O)C(F)(F)F	ZINC000004725158	506390892	/nfs/dbraw/zinc/39/08/92/506390892.db2.gz	KVXMFALNGFOCRG-BXUZGUMPSA-N	0	0	357.288	2.848	50	5		FFBARN
O=C(NC1CCCC1)[C@@H](c1cc2c(cc1[N+](=O)[O-])OCO2)N1CCCC1	ZINC000036067086	506394130	/nfs/dbraw/zinc/39/41/30/506394130.db2.gz	LFAVGASHZDCQGC-QGZVFWFLSA-N	0	0	361.398	2.519	50	5		FFBARN
CCN1C(=O)c2ccc(C(=O)Nc3ccc(C)cc3[N+](=O)[O-])cc2C1=O	ZINC000004865359	506401150	/nfs/dbraw/zinc/40/11/50/506401150.db2.gz	CQPLRBOZGSQXAT-UHFFFAOYSA-N	0	0	353.334	2.771	50	5		FFBARN
O=[N+]([O-])c1cccc(S(=O)(=O)NCCOc2ccc(Cl)cc2)c1	ZINC000004892769	506402506	/nfs/dbraw/zinc/40/25/06/506402506.db2.gz	CCPCLARWZSOHFM-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
COc1cc(NC(=O)COC(=O)/C=C/c2ccco2)c(C)cc1[N+](=O)[O-]	ZINC000005113212	506422283	/nfs/dbraw/zinc/42/22/83/506422283.db2.gz	XARJOJHOAJUDBZ-AATRIKPKSA-N	0	0	360.322	2.700	50	5		FFBARN
O=C(Nc1ccc2nc3n(c(=O)c2c1)CCCC3)c1cccc([N+](=O)[O-])c1	ZINC000005139790	506423918	/nfs/dbraw/zinc/42/39/18/506423918.db2.gz	CMEBOQLOPXZYKI-UHFFFAOYSA-N	0	0	364.361	2.893	50	5		FFBARN
O=C(COC(=O)c1n[nH]c2ccccc21)Nc1ccc(Cl)c([N+](=O)[O-])c1	ZINC000005360854	506437981	/nfs/dbraw/zinc/43/79/81/506437981.db2.gz	YDCAHMATCMAFNI-UHFFFAOYSA-N	0	0	374.740	2.920	50	5		FFBARN
Cc1ccc(OCC(=O)Nc2ccc(N3CCOCC3)cc2)c([N+](=O)[O-])c1	ZINC000007047408	506528260	/nfs/dbraw/zinc/52/82/60/506528260.db2.gz	BHBRUQNMHNRRPB-UHFFFAOYSA-N	0	0	371.393	2.757	50	5		FFBARN
CCN1C[C@@H](CN(C)C(=O)c2cccc([N+](=O)[O-])c2)Oc2ccccc21	ZINC000007256942	506547402	/nfs/dbraw/zinc/54/74/02/506547402.db2.gz	WLRIWXKAFJKISR-MRXNPFEDSA-N	0	0	355.394	2.954	50	5		FFBARN
C[C@@H](C(=O)Nc1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000007400519	506560421	/nfs/dbraw/zinc/56/04/21/506560421.db2.gz	VEOCWHNCHDGZED-JTQLQIEISA-N	0	0	352.343	2.535	50	5		FFBARN
Cc1cc(NC(=O)Cn2cnc3sccc3c2=O)c([N+](=O)[O-])cc1C	ZINC000007495041	506567740	/nfs/dbraw/zinc/56/77/40/506567740.db2.gz	YYANWJMJFRERKU-UHFFFAOYSA-N	0	0	358.379	2.622	50	5		FFBARN
COc1ccccc1CCC(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000007802829	506590692	/nfs/dbraw/zinc/59/06/92/506590692.db2.gz	LOJWCDIIQAEDMQ-UHFFFAOYSA-N	0	0	369.421	2.885	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(C)c1OCc1ccc(S(=O)(=O)N(C)C)o1	ZINC000042157159	506604117	/nfs/dbraw/zinc/60/41/17/506604117.db2.gz	QXNLYGCRUWVARV-UHFFFAOYSA-N	0	0	354.384	2.634	50	5		FFBARN
COC(=O)c1ccsc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1	ZINC000008618121	506660953	/nfs/dbraw/zinc/66/09/53/506660953.db2.gz	XFPYZJQQAWFWSU-UHFFFAOYSA-N	0	0	351.296	2.603	50	5		FFBARN
Cc1ccn2c(c1)nc(C)c(NC(=O)c1cccc([N+](=O)[O-])c1C)c2=O	ZINC000008611684	506660995	/nfs/dbraw/zinc/66/09/95/506660995.db2.gz	GPJVSQZGAOXHIW-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
CC(=O)N1CCN(c2ccc(C(=O)Nc3ccccc3)cc2[N+](=O)[O-])CC1	ZINC000008720399	506663594	/nfs/dbraw/zinc/66/35/94/506663594.db2.gz	NHIRHOVRIDOTGI-UHFFFAOYSA-N	0	0	368.393	2.516	50	5		FFBARN
CN(Cc1ccc2c(c1)OCO2)c1ccc(C(=O)NC2CC2)cc1[N+](=O)[O-]	ZINC000008745692	506665466	/nfs/dbraw/zinc/66/54/66/506665466.db2.gz	OINWBJOEKIKZAW-UHFFFAOYSA-N	0	0	369.377	2.852	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000008774508	506668876	/nfs/dbraw/zinc/66/88/76/506668876.db2.gz	LAJDIPFYTDHEJJ-UHFFFAOYSA-N	0	0	374.349	2.959	50	5		FFBARN
O=C(NC1CC1)N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000008779795	506669343	/nfs/dbraw/zinc/66/93/43/506669343.db2.gz	LOOGFRWMZSRHIE-UHFFFAOYSA-N	0	0	358.320	2.608	50	5		FFBARN
O=C1NC(=S)NC(=O)C12Cc1cc([N+](=O)[O-])ccc1N1CCCCC[C@H]12	ZINC000009009367	506677402	/nfs/dbraw/zinc/67/74/02/506677402.db2.gz	IJBKDEZOSVNXCY-ZDUSSCGKSA-N	0	0	374.422	2.669	50	5		FFBARN
COc1ccc(C)cc1NC(=O)CCn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000009387572	506695795	/nfs/dbraw/zinc/69/57/95/506695795.db2.gz	FKWAJGAOQRWFCV-UHFFFAOYSA-N	0	0	371.349	2.849	50	5		FFBARN
Cc1ccc(NC(=O)CNc2ccccc2C(=O)NC2CC2)c([N+](=O)[O-])c1	ZINC000010755728	506753234	/nfs/dbraw/zinc/75/32/34/506753234.db2.gz	RBOIXACOKDWLKF-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCCO2)C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12	ZINC000012375155	506856029	/nfs/dbraw/zinc/85/60/29/506856029.db2.gz	WNZGURYHRFQFJS-UHFFFAOYSA-N	0	0	367.317	2.669	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCn1cnc2sccc2c1=O	ZINC000012822521	506905507	/nfs/dbraw/zinc/90/55/07/506905507.db2.gz	PYRQMWSQLDVFHJ-UHFFFAOYSA-N	0	0	358.379	2.703	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1ccc(C(=O)NC2CC2)cc1	ZINC000012915971	506915735	/nfs/dbraw/zinc/91/57/35/506915735.db2.gz	DZTBUMVDWBAGAI-UHFFFAOYSA-N	0	0	355.350	2.505	50	5		FFBARN
CCCCOC[C@@H](O)CN1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000019286095	507161589	/nfs/dbraw/zinc/16/15/89/507161589.db2.gz	FDXAGIZWXPMQSZ-HNNXBMFYSA-N	0	0	371.865	2.548	50	5		FFBARN
O=c1ccc(-c2cccc([N+](=O)[O-])c2)nn1C[C@@H](O)c1ccc(F)c(F)c1	ZINC000057770754	507323787	/nfs/dbraw/zinc/32/37/87/507323787.db2.gz	QXYHUWDOKDUKSY-QGZVFWFLSA-N	0	0	373.315	2.830	50	5		FFBARN
Cc1cccc(C(=O)N2CCC(C(=O)Nc3ccncc3)CC2)c1[N+](=O)[O-]	ZINC000024700478	507432786	/nfs/dbraw/zinc/43/27/86/507432786.db2.gz	OYXJJLYKEGJEJU-UHFFFAOYSA-N	0	0	368.393	2.789	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)NCc1cccc(Cn2ccnc2)c1	ZINC000024753584	507434858	/nfs/dbraw/zinc/43/48/58/507434858.db2.gz	JCISFMTXLWJAGP-UHFFFAOYSA-N	0	0	350.378	2.699	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCN(c2ccccc2)C1	ZINC000024816110	507440721	/nfs/dbraw/zinc/44/07/21/507440721.db2.gz	MOTUNAAJWIRQAQ-CQSZACIVSA-N	0	0	355.394	2.860	50	5		FFBARN
COC(=O)c1cccc2c1CCCN2C(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000025190257	507473973	/nfs/dbraw/zinc/47/39/73/507473973.db2.gz	IPMZSDLSOMZJBY-UHFFFAOYSA-N	0	0	370.361	2.983	50	5		FFBARN
C[C@@H](NC(=O)Cn1cnc([N+](=O)[O-])n1)c1ccc(-c2ccccc2)cc1	ZINC000048224444	507483087	/nfs/dbraw/zinc/48/30/87/507483087.db2.gz	WBYWXMXIJWXRON-CYBMUJFWSA-N	0	0	351.366	2.731	50	5		FFBARN
O=C(NCCN1CCN(c2ccccc2)CC1)Nc1cccc([N+](=O)[O-])c1	ZINC000027352888	507650294	/nfs/dbraw/zinc/65/02/94/507650294.db2.gz	RLLJXFHFOYXDGI-UHFFFAOYSA-N	0	0	369.425	2.539	50	5		FFBARN
CNc1ccc(C(=O)c2ccccc2C(=O)NCCCOC)cc1[N+](=O)[O-]	ZINC000028270618	507716947	/nfs/dbraw/zinc/71/69/47/507716947.db2.gz	TZXBHIRCHHRRTM-UHFFFAOYSA-N	0	0	371.393	2.634	50	5		FFBARN
O=[N+]([O-])c1ccc(NC[C@@]2(N3CCOCC3)CCSC2)c(Cl)c1	ZINC000029625764	507784712	/nfs/dbraw/zinc/78/47/12/507784712.db2.gz	KEWAEMIWBRFVTD-HNNXBMFYSA-N	0	0	357.863	2.868	50	5		FFBARN
CSc1ncc(Cl)c(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)n1	ZINC000029888597	507794261	/nfs/dbraw/zinc/79/42/61/507794261.db2.gz	GFIFCHBJDOOLSP-UHFFFAOYSA-N	0	0	350.787	2.963	50	5		FFBARN
O=C(Cn1cnc2c3ccccc3oc2c1=O)Nc1ccccc1[N+](=O)[O-]	ZINC000031744191	507821363	/nfs/dbraw/zinc/82/13/63/507821363.db2.gz	JDQVTIQLOKUHGW-UHFFFAOYSA-N	0	0	364.317	2.690	50	5		FFBARN
O=[N+]([O-])c1ccccc1CCS(=O)(=O)N1CCc2ccc(F)cc21	ZINC000089813905	507869524	/nfs/dbraw/zinc/86/95/24/507869524.db2.gz	OOYGIMWLLDTDFJ-UHFFFAOYSA-N	0	0	350.371	2.669	50	5		FFBARN
CCN(CC)c1ccc(CNC(=O)c2cc(C)cc([N+](=O)[O-])c2N)cn1	ZINC000075583728	508119623	/nfs/dbraw/zinc/11/96/23/508119623.db2.gz	FCODSSRQKCYPBT-UHFFFAOYSA-N	0	0	357.414	2.657	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCO[C@]2(CCOC2)C1	ZINC000170591473	509674629	/nfs/dbraw/zinc/67/46/29/509674629.db2.gz	RAEGQMANDAUCEC-MEBBXXQBSA-N	0	0	355.778	2.708	50	5		FFBARN
O=c1c([N+](=O)[O-])c(NCc2nc(-c3cccs3)c[nH]2)nc2ccccn21	ZINC000170619608	509683000	/nfs/dbraw/zinc/68/30/00/509683000.db2.gz	HNFOZVLFECYWJP-UHFFFAOYSA-N	0	0	368.378	2.666	50	5		FFBARN
Cc1cc2c(nc3sc(=Cc4cccc([N+](=O)[O-])c4)c(=O)n23)c(C)c1	ZINC000252668418	509858741	/nfs/dbraw/zinc/85/87/41/509858741.db2.gz	FBWXKJIGXMPRRK-UHFFFAOYSA-N	0	0	351.387	2.982	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)/C=C/c2cccc([N+](=O)[O-])c2)CC1	ZINC000002309966	537063067	/nfs/dbraw/zinc/06/30/67/537063067.db2.gz	NUKOAACTLSCAKB-MDZDMXLPSA-N	0	0	367.405	2.965	50	5		FFBARN
CCn1c(C)cc(C(=O)Cn2cnc3ccc([N+](=O)[O-])cc3c2=O)c1C	ZINC000004515729	219582230	/nfs/dbraw/zinc/58/22/30/219582230.db2.gz	UHANPSZHSHWEES-UHFFFAOYSA-N	0	0	354.366	2.626	50	5		FFBARN
COc1cccc(C(=O)O[C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1OC	ZINC000005536487	219687912	/nfs/dbraw/zinc/68/79/12/219687912.db2.gz	QUCZBVKIBRHIMZ-NSHDSACASA-N	0	0	374.349	2.796	50	5		FFBARN
O=C(N[C@H](CN1CCCC1=O)c1ccccc1)c1cc(F)ccc1[N+](=O)[O-]	ZINC000063505953	212031552	/nfs/dbraw/zinc/03/15/52/212031552.db2.gz	IYRNLBCAYYSNDH-MRXNPFEDSA-N	0	0	371.368	2.827	50	5		FFBARN
Cc1nn(C)c2c1[C@H](c1cc3c(cc1[N+](=O)[O-])OCO3)SCC(=O)N2	ZINC000061720332	212024778	/nfs/dbraw/zinc/02/47/78/212024778.db2.gz	QLRWYZBWWFANFG-AWEZNQCLSA-N	0	0	362.367	2.790	50	5		FFBARN
C[C@@H]1C(=O)N(CCOc2ccccc2[N+](=O)[O-])C(=O)N1c1ccccc1	ZINC000047354740	211851923	/nfs/dbraw/zinc/85/19/23/211851923.db2.gz	DSXBVNKYVMQZAB-CYBMUJFWSA-N	0	0	355.350	2.831	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)C[C@H]1COc2ccccc2O1	ZINC000016629064	220189285	/nfs/dbraw/zinc/18/92/85/220189285.db2.gz	CEAUWPWQLKZKKF-HNNXBMFYSA-N	0	0	371.393	2.614	50	5		FFBARN
CC[C@@H]1CCCN(C(=O)c2cc(OC)c(OC)c(OC)c2[N+](=O)[O-])C1	ZINC000031681221	211536532	/nfs/dbraw/zinc/53/65/32/211536532.db2.gz	PLCRRNWRJCVTSB-LLVKDONJSA-N	0	0	352.387	2.883	50	5		FFBARN
CCNc1nnc(Sc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])nc1NCC	ZINC000019898250	211261634	/nfs/dbraw/zinc/26/16/34/211261634.db2.gz	NLCHLIDJCVVUAX-UHFFFAOYSA-N	0	0	365.375	2.703	50	5		FFBARN
COc1ccc(NC(=O)[C@@H](c2ccc([N+](=O)[O-])cc2)N2CCOCC2)cc1	ZINC000019537569	211230864	/nfs/dbraw/zinc/23/08/64/211230864.db2.gz	WECIXYSOMPRLQC-GOSISDBHSA-N	0	0	371.393	2.615	50	5		FFBARN
COC(=O)c1cc(C(=O)N(C)Cc2ccccc2OC)cc([N+](=O)[O-])c1	ZINC000018076263	211190565	/nfs/dbraw/zinc/19/05/65/211190565.db2.gz	TVDDVUYQGWGYLD-UHFFFAOYSA-N	0	0	358.350	2.662	50	5		FFBARN
O=C(Nc1ccccc1C(=O)NCc1cccnc1)c1ccc([N+](=O)[O-])o1	ZINC000010313147	210868605	/nfs/dbraw/zinc/86/86/05/210868605.db2.gz	PZAPPZAKGBGFIC-UHFFFAOYSA-N	0	0	366.333	2.765	50	5		FFBARN
O=C(/C=C/c1cc2c(cc1[N+](=O)[O-])OCO2)Nc1nc2c(s1)CCC2	ZINC000008772554	210803592	/nfs/dbraw/zinc/80/35/92/210803592.db2.gz	BEJHYJPZCIOIGH-SNAWJCMRSA-N	0	0	359.363	2.921	50	5		FFBARN
Cc1csc(NC(=O)c2cccn(Cc3cccc([N+](=O)[O-])c3)c2=O)n1	ZINC000005270797	210610754	/nfs/dbraw/zinc/61/07/54/210610754.db2.gz	CDHZKYVAILKPBG-UHFFFAOYSA-N	0	0	370.390	2.822	50	5		FFBARN
O=C(Nc1ncc([N+](=O)[O-])s1)c1cccn(Cc2cccc(F)c2)c1=O	ZINC000005268873	210610443	/nfs/dbraw/zinc/61/04/43/210610443.db2.gz	BXUFCCWEUWLFAT-UHFFFAOYSA-N	0	0	374.353	2.653	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)n1nnc(-c2ccccc2)n1	ZINC000004954327	210584053	/nfs/dbraw/zinc/58/40/53/210584053.db2.gz	USXQMBHEOUYAAL-LBPRGKRZSA-N	0	0	352.354	2.756	50	5		FFBARN
O=[N+]([O-])c1cc(Cl)ccc1NCCNS(=O)(=O)c1ccccc1	ZINC000004413888	210529545	/nfs/dbraw/zinc/52/95/45/210529545.db2.gz	BNFUQHXBLOXZCU-UHFFFAOYSA-N	0	0	355.803	2.639	50	5		FFBARN
COc1cccc(Nc2cc(NCCCO)c([N+](=O)[O-])c3nonc32)c1	ZINC000004193975	210515800	/nfs/dbraw/zinc/51/58/00/210515800.db2.gz	QPRQSBVBPSWRFU-UHFFFAOYSA-N	0	0	359.342	2.678	50	5		FFBARN
CN(C)C(=O)N[C@@H](Nc1cccc([N+](=O)[O-])c1)C(Cl)(Cl)Cl	ZINC000003130612	210451112	/nfs/dbraw/zinc/45/11/12/210451112.db2.gz	KLSOBTYDYWNKQL-SECBINFHSA-N	0	0	355.609	2.974	50	5		FFBARN
COCCn1c(=O)c2c(=O)c3ccccc3n(C)c2nc1-c1cccs1	ZINC000002435760	210398533	/nfs/dbraw/zinc/39/85/33/210398533.db2.gz	QMFWGABCPBLJKX-UHFFFAOYSA-N	0	0	367.430	2.623	50	5		FFBARN
CCNC(=O)[C@@H]1Cc2ccccc2N1C(=O)/C=C\c1ccc([N+](=O)[O-])cc1	ZINC000010256133	210347219	/nfs/dbraw/zinc/34/72/19/210347219.db2.gz	XURUAVUHBHPUTH-DVESRUBUSA-N	0	0	365.389	2.702	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1[C@@H](C)C(=O)N1CCCCCC1	ZINC000001070716	210312717	/nfs/dbraw/zinc/31/27/17/210312717.db2.gz	KYOCEIQLAGTRRD-JTQLQIEISA-N	0	0	359.224	2.826	50	5		FFBARN
O=C(NC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1	ZINC000001044209	210307971	/nfs/dbraw/zinc/30/79/71/210307971.db2.gz	NUWIEYLKIGKZSB-UHFFFAOYSA-N	0	0	353.378	2.629	50	5		FFBARN
COc1ccccc1NC(=S)NC(=O)c1ccc(OC)c([N+](=O)[O-])c1	ZINC000000881998	210285849	/nfs/dbraw/zinc/28/58/49/210285849.db2.gz	QRCQLXNSLAKCFA-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CCOC(=O)N1CCC(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000024470876	220449166	/nfs/dbraw/zinc/44/91/66/220449166.db2.gz	XLKHIZCYZGAVAM-UHFFFAOYSA-N	0	0	355.778	2.599	50	5		FFBARN
Cc1cccc(C(=O)Nc2ccc(OCC(=O)N(C)C)cc2)c1[N+](=O)[O-]	ZINC000025654365	220495582	/nfs/dbraw/zinc/49/55/82/220495582.db2.gz	KFTAYNBSNKUKEA-UHFFFAOYSA-N	0	0	357.366	2.623	50	5		FFBARN
COc1ccc(C(=O)N(C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000055841001	221075028	/nfs/dbraw/zinc/07/50/28/221075028.db2.gz	ZXPMBJLDSVLTQQ-UHFFFAOYSA-N	0	0	357.366	2.866	50	5		FFBARN
O=C1N[C@@H](c2cc3c(cc2[N+](=O)[O-])OCCO3)Nc2ccc(Cl)cc21	ZINC000067965053	221309334	/nfs/dbraw/zinc/30/93/34/221309334.db2.gz	VFFQQHZPSCWYLN-HNNXBMFYSA-N	0	0	361.741	2.874	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCC[C@@H](Cn3cncn3)C2)c(OC(F)F)c1	ZINC000096003763	132217104	/nfs/dbraw/zinc/21/71/04/132217104.db2.gz	OSBOBMORJYTUKZ-LLVKDONJSA-N	0	0	353.329	2.704	50	5		FFBARN
CC(=O)c1ccc(N2CCN(C(=O)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000001054623	132252390	/nfs/dbraw/zinc/25/23/90/132252390.db2.gz	ZGPOITSNDNMJTD-UHFFFAOYSA-N	0	0	367.405	2.689	50	5		FFBARN
CCOc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000000994809	132379404	/nfs/dbraw/zinc/37/94/04/132379404.db2.gz	UAFPQVIVIAPOCE-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
COc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1OC	ZINC000003879291	132385914	/nfs/dbraw/zinc/38/59/14/132385914.db2.gz	STQYRPAUAWNWLB-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
C[C@@H](Oc1ccc([N+](=O)[O-])cc1)C(=O)N1CCN(c2ccccc2)CC1	ZINC000004750299	132824561	/nfs/dbraw/zinc/82/45/61/132824561.db2.gz	XXJSKDGDYGAJDD-OAHLLOKOSA-N	0	0	355.394	2.711	50	5		FFBARN
Cc1cc(C(=O)N2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)on1	ZINC000018043090	132885598	/nfs/dbraw/zinc/88/55/98/132885598.db2.gz	SRNNXNFZAOJHGJ-UHFFFAOYSA-N	0	0	350.762	2.507	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)C1=NN(c2ccccc2)C(=O)CC1	ZINC000024068443	132910394	/nfs/dbraw/zinc/91/03/94/132910394.db2.gz	JIZXICPKOHKGMY-UHFFFAOYSA-N	0	0	356.313	2.855	50	5		FFBARN
CC(C)C(=O)N1CCN(c2ccc([N+](=O)[O-])c(N3CCCCC3)c2)CC1	ZINC000004125315	136151764	/nfs/dbraw/zinc/15/17/64/136151764.db2.gz	BAHIDTAWPMECKG-UHFFFAOYSA-N	0	0	360.458	2.890	50	5		FFBARN
Cc1cc(C)n(-c2cc(N3CCN(C(=O)C(C)C)CC3)ccc2[N+](=O)[O-])n1	ZINC000004138178	136151765	/nfs/dbraw/zinc/15/17/65/136151765.db2.gz	RFUUELPADMJWJP-UHFFFAOYSA-N	0	0	371.441	2.702	50	5		FFBARN
CCOC(=O)c1cc2c(nc3c(C)cccn3c2=O)n(C2CCCC2)c1=N	ZINC000100627852	222248406	/nfs/dbraw/zinc/24/84/06/222248406.db2.gz	BANGRHOAXNTBCA-UHFFFAOYSA-N	0	0	366.421	2.729	50	5		FFBARN
COc1ccc(C2=Nc3nnnn3[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1	ZINC000101113355	222262030	/nfs/dbraw/zinc/26/20/30/222262030.db2.gz	UZJQBHVQYUFLJL-MRXNPFEDSA-N	0	0	350.338	2.646	50	5		FFBARN
C[C@H](Cn1cc(Br)cn1)C(=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000002794343	506293346	/nfs/dbraw/zinc/29/33/46/506293346.db2.gz	DVDPFIUSOUWDJF-MRVPVSSYSA-N	0	0	371.166	2.968	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc(N(C)C)cc2)cc1[N+](=O)[O-]	ZINC000002982121	506305427	/nfs/dbraw/zinc/30/54/27/506305427.db2.gz	HYTIFPXKHMPIKD-UHFFFAOYSA-N	0	0	374.422	2.796	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)NCc1ccc(Cl)cc1	ZINC000003479989	506335008	/nfs/dbraw/zinc/33/50/08/506335008.db2.gz	KUJQCOJWDBXPOY-UHFFFAOYSA-N	0	0	361.785	2.685	50	5		FFBARN
COc1cc(OC)cc(C(=O)NC(=S)Nc2ccccc2[N+](=O)[O-])c1	ZINC000004090909	506359179	/nfs/dbraw/zinc/35/91/79/506359179.db2.gz	HEHAJNQVBZSNFZ-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CC(=O)Nc1cccc(OCCCNC(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000004321582	506371763	/nfs/dbraw/zinc/37/17/63/506371763.db2.gz	IFPRHISSEVLKHB-UHFFFAOYSA-N	0	0	357.366	2.752	50	5		FFBARN
COc1ccc(Nc2cc(C)nc(-n3cc([N+](=O)[O-])cn3)n2)c(OC)c1	ZINC000004331227	506373712	/nfs/dbraw/zinc/37/37/12/506373712.db2.gz	CEUGQUOCWYTVKP-UHFFFAOYSA-N	0	0	356.342	2.640	50	5		FFBARN
CCCCOC(=O)C1C(C)=Nc2ncnn2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000004598017	506385143	/nfs/dbraw/zinc/38/51/43/506385143.db2.gz	XXRODLHIWLMQOX-HNNXBMFYSA-N	0	0	357.370	2.819	50	5		FFBARN
CC(=O)OCCCNc1cc(SC(C)C)c2nonc2c1[N+](=O)[O-]	ZINC000004677063	506387842	/nfs/dbraw/zinc/38/78/42/506387842.db2.gz	QDFVTWXWAOOYCL-UHFFFAOYSA-N	0	0	354.388	2.997	50	5		FFBARN
COc1ccc(-n2nc([N+](=O)[O-])c(NCCC3=CCCCC3)[n+]2[O-])cc1	ZINC000004813785	506396560	/nfs/dbraw/zinc/39/65/60/506396560.db2.gz	VJNCCYQQDJEHCF-UHFFFAOYSA-N	0	0	359.386	2.725	50	5		FFBARN
O=C(c1cccc(F)c1)N1CCN(CCOc2cccc([N+](=O)[O-])c2)CC1	ZINC000036397106	506405929	/nfs/dbraw/zinc/40/59/29/506405929.db2.gz	RKDRNMNBDMFXQG-UHFFFAOYSA-N	0	0	373.384	2.571	50	5		FFBARN
COc1ccc(OC)c(Nc2nc(N)c([N+](=O)[O-])c(N3CCCCC3)n2)c1	ZINC000005025523	506416020	/nfs/dbraw/zinc/41/60/20/506416020.db2.gz	HYGZRQCVAOIELA-UHFFFAOYSA-N	0	0	374.401	2.718	50	5		FFBARN
CCOc1ccc(Nc2nc(N)c([N+](=O)[O-])c(NC[C@H]3CCCO3)n2)cc1	ZINC000005156257	506425701	/nfs/dbraw/zinc/42/57/01/506425701.db2.gz	JDDJTSKADSLOJO-CYBMUJFWSA-N	0	0	374.401	2.700	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)c1ccc(N2C(=O)CCC2=O)cc1	ZINC000005193203	506427697	/nfs/dbraw/zinc/42/76/97/506427697.db2.gz	PXSALUOJKXDDBG-UHFFFAOYSA-N	0	0	369.333	2.509	50	5		FFBARN
O=c1[nH]c(=O)c2ccc3c(=O)n4c5ccc(Cl)cc5nc4c4ccc1c2c43	ZINC000005236081	506430795	/nfs/dbraw/zinc/43/07/95/506430795.db2.gz	HOAYRMINLQLMQP-UHFFFAOYSA-N	0	0	373.755	2.885	50	5		FFBARN
COc1ccc(N2C(=S)N=NC2[C@@H](C)n2nc(C)c([N+](=O)[O-])c2C)cc1	ZINC000005425136	506441169	/nfs/dbraw/zinc/44/11/69/506441169.db2.gz	PFWAGGOPWGRCFP-LLVKDONJSA-N	0	0	374.426	2.895	50	5		FFBARN
O=C(CSc1n[nH]c(-c2ccncc2)n1)Nc1cccc([N+](=O)[O-])c1	ZINC000005532732	506447335	/nfs/dbraw/zinc/44/73/35/506447335.db2.gz	GMFNPSLGYLKBLK-UHFFFAOYSA-N	0	0	356.367	2.506	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-]	ZINC000005578889	506450495	/nfs/dbraw/zinc/45/04/95/506450495.db2.gz	JGTSZIGTNBSIDY-UHFFFAOYSA-N	0	0	374.349	2.959	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])N1CCC(Cc2ccccc2)CC1	ZINC000005688723	506452439	/nfs/dbraw/zinc/45/24/39/506452439.db2.gz	YKYOAIUBJPNMBR-UHFFFAOYSA-N	0	0	355.394	2.850	50	5		FFBARN
Cc1ncc([N+](=O)[O-])cc1C(=O)NCCOc1cccc2c1OC(C)(C)C2	ZINC000040074734	506462795	/nfs/dbraw/zinc/46/27/95/506462795.db2.gz	UVBCJBACZYNCMY-UHFFFAOYSA-N	0	0	371.393	2.821	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCCc2ccccc21	ZINC000006231906	506473181	/nfs/dbraw/zinc/47/31/81/506473181.db2.gz	JANOUNNGYZQEKN-GOSISDBHSA-N	0	0	367.405	2.909	50	5		FFBARN
Cc1ccc(C)c(C(=O)COC(=O)c2cc([N+](=O)[O-])ccc2NCCO)c1	ZINC000006465297	506484805	/nfs/dbraw/zinc/48/48/05/506484805.db2.gz	MYKFXDBIHNIJAK-UHFFFAOYSA-N	0	0	372.377	2.656	50	5		FFBARN
O=C(OCc1nnc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CC1(Cl)Cl	ZINC000007985766	506609728	/nfs/dbraw/zinc/60/97/28/506609728.db2.gz	UUZQEJJBOIPIFG-VIFPVBQESA-N	0	0	358.137	2.882	50	5		FFBARN
C[C@@H](NC(=O)CNC(=O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1	ZINC000008033818	506615810	/nfs/dbraw/zinc/61/58/10/506615810.db2.gz	IYGQXDAUGHOYIM-LLVKDONJSA-N	0	0	361.785	2.855	50	5		FFBARN
CCN1C[C@@H](CN(C)C(=O)c2ccc(N)c([N+](=O)[O-])c2)Oc2ccccc21	ZINC000009117716	506682796	/nfs/dbraw/zinc/68/27/96/506682796.db2.gz	ZDBRJUPIVAJRIY-CQSZACIVSA-N	0	0	370.409	2.537	50	5		FFBARN
COc1ccccc1[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)c1nccn1C	ZINC000009319056	506690262	/nfs/dbraw/zinc/69/02/62/506690262.db2.gz	CZXDJCAODQHRPD-QGZVFWFLSA-N	0	0	366.377	2.856	50	5		FFBARN
Cc1ccc(Nc2nc(N)c([N+](=O)[O-])c(N3C[C@H](C)O[C@@H](C)C3)n2)cc1C	ZINC000009328245	506691118	/nfs/dbraw/zinc/69/11/18/506691118.db2.gz	QDFXUIOFXRZTGV-STQMWFEESA-N	0	0	372.429	2.941	50	5		FFBARN
O=[N+]([O-])c1cc(-c2noc(-c3cccnc3)n2)ccc1N1CCOCC1	ZINC000009669027	506707153	/nfs/dbraw/zinc/70/71/53/506707153.db2.gz	JVDFTKIHDVMVNH-UHFFFAOYSA-N	0	0	353.338	2.543	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1ccsc1	ZINC000009751786	506711004	/nfs/dbraw/zinc/71/10/04/506711004.db2.gz	SGNBZELJUKHLJB-VIFPVBQESA-N	0	0	350.352	2.849	50	5		FFBARN
COc1ccc(CN(C)C(=O)COc2ccc([N+](=O)[O-])cc2)c(OC)c1	ZINC000009882298	506715706	/nfs/dbraw/zinc/71/57/06/506715706.db2.gz	OJEPNNHQEHONOE-UHFFFAOYSA-N	0	0	360.366	2.649	50	5		FFBARN
CSc1cc(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)ccc1NC(C)=O	ZINC000043241985	506719965	/nfs/dbraw/zinc/71/99/65/506719965.db2.gz	IDCCZCSHBKRDJW-UHFFFAOYSA-N	0	0	362.411	2.971	50	5		FFBARN
C[C@@H](Nc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2	ZINC000010643216	506749951	/nfs/dbraw/zinc/74/99/51/506749951.db2.gz	CBOKUTJNFQEMMN-SNVBAGLBSA-N	0	0	364.379	2.900	50	5		FFBARN
CC(=O)c1ccc(NC(=O)COC(=O)C=Cc2ccc([N+](=O)[O-])cc2)cc1	ZINC000012380143	506855951	/nfs/dbraw/zinc/85/59/51/506855951.db2.gz	IYEIXPMOAACOGH-NYYWCZLTSA-N	0	0	368.345	2.993	50	5		FFBARN
COc1ccc(NC(=O)CNc2ccc(C)c(NC(C)=O)c2)c([N+](=O)[O-])c1	ZINC000055859837	506870096	/nfs/dbraw/zinc/87/00/96/506870096.db2.gz	RRWSGJDVAVGEEU-UHFFFAOYSA-N	0	0	372.381	2.921	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)COc3ccccc3[N+](=O)[O-])ccc21	ZINC000012772770	506899704	/nfs/dbraw/zinc/89/97/04/506899704.db2.gz	FELWBKAZUOCRTF-UHFFFAOYSA-N	0	0	355.350	2.521	50	5		FFBARN
CCN(Cc1cccc(F)c1)C(=O)[C@@H](C)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000057637838	507297871	/nfs/dbraw/zinc/29/78/71/507297871.db2.gz	SWPWUUBGCGGTOG-CYBMUJFWSA-N	0	0	373.384	2.901	50	5		FFBARN
Cc1nc([N+](=O)[O-])cn1CC(=O)N(C)Cc1ccc(Br)s1	ZINC000058139337	507375173	/nfs/dbraw/zinc/37/51/73/507375173.db2.gz	NOVPMLYUAYLSLB-UHFFFAOYSA-N	0	0	373.232	2.582	50	5		FFBARN
O=C1c2cccc([N+](=O)[O-])c2C(=O)N1CN1CC=C(c2ccccc2)CC1	ZINC000025718987	507526504	/nfs/dbraw/zinc/52/65/04/507526504.db2.gz	ITIUPXXGHIVDQA-UHFFFAOYSA-N	0	0	363.373	2.938	50	5		FFBARN
CCN(c1ccc(F)cc1)S(=O)(=O)c1cc([N+](=O)[O-])ccc1OC	ZINC000030497197	507809440	/nfs/dbraw/zinc/80/94/40/507809440.db2.gz	USHJWBHWQMUDHH-UHFFFAOYSA-N	0	0	354.359	2.958	50	5		FFBARN
O=C(CCOc1ccc([N+](=O)[O-])cc1)NCc1cnn(-c2ccccc2)c1	ZINC000031537257	507819975	/nfs/dbraw/zinc/81/99/75/507819975.db2.gz	LUCNNAIYOZBTNO-UHFFFAOYSA-N	0	0	366.377	2.866	50	5		FFBARN
Cc1nn(-c2ccc(C)cc2)c(C)c1NC(=O)Cn1cnc([N+](=O)[O-])c1	ZINC000031804698	507821719	/nfs/dbraw/zinc/82/17/19/507821719.db2.gz	YSWDQXCROMGSPB-UHFFFAOYSA-N	0	0	354.370	2.541	50	5		FFBARN
C[C@]1(c2cccnc2)NC(=O)N(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O	ZINC000079107333	507933911	/nfs/dbraw/zinc/93/39/11/507933911.db2.gz	QTFLHBBJVOPIDW-MRXNPFEDSA-N	0	0	360.757	2.610	50	5		FFBARN
C[C@H]1CN(C(=O)c2ccc([N+](=O)[O-])s2)C[C@H]1NC(=O)OC(C)(C)C	ZINC000170614768	509681745	/nfs/dbraw/zinc/68/17/45/509681745.db2.gz	GYHCJHVMWUHBGW-VHSXEESVSA-N	0	0	355.416	2.642	50	5		FFBARN
C[C@@H]1CCCN(C(=O)CSc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1	ZINC000019829789	524194516	/nfs/dbraw/zinc/19/45/16/524194516.db2.gz	GCUKHTDZLPLLRI-LLVKDONJSA-N	0	0	362.411	2.995	50	5		FFBARN
Cc1ccc(CN(C)C(=O)c2cc([N+](=O)[O-])ccc2N2CCOCC2)o1	ZINC000049931298	570966532	/nfs/dbraw/zinc/96/65/32/570966532.db2.gz	BDHLNCCDTZPFAN-UHFFFAOYSA-N	0	0	359.382	2.605	50	5		FFBARN
O=C(NN1C(=O)c2cccc3cc([N+](=O)[O-])cc(c32)C1=O)c1ccccc1	ZINC000000805777	219323504	/nfs/dbraw/zinc/32/35/04/219323504.db2.gz	PZAVAWKGSISMRG-UHFFFAOYSA-N	0	0	361.313	2.689	50	5		FFBARN
CN1C(=O)c2ccccc2Sc2cc([N+](=O)[O-])ccc2S1(=O)=O	ZINC000001044312	219357339	/nfs/dbraw/zinc/35/73/39/219357339.db2.gz	KAAIQWKJMYDEPA-UHFFFAOYSA-N	0	0	350.377	2.520	50	5		FFBARN
Cc1ccc(-c2cn(S(=O)(=O)c3cccc([N+](=O)[O-])c3)nc2N)cc1	ZINC000001067533	219362752	/nfs/dbraw/zinc/36/27/52/219362752.db2.gz	WKBGLKXXAOQOFG-UHFFFAOYSA-N	0	0	358.379	2.586	50	5		FFBARN
COc1ccc(C=O)cc1Cn1nc([N+](=O)[O-])c(Br)c1C	ZINC000001088624	219367092	/nfs/dbraw/zinc/36/70/92/219367092.db2.gz	HLUMMWOBUTUHOW-UHFFFAOYSA-N	0	0	354.160	2.732	50	5		FFBARN
CC(C)[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C(=O)c2ccccc2C1=O	ZINC000001135050	219377717	/nfs/dbraw/zinc/37/77/17/219377717.db2.gz	PXZWHUIBYSXGBD-MRXNPFEDSA-N	0	0	367.361	2.854	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)N1CCC(C(=O)N2CCCCCC2)CC1	ZINC000001134465	219378393	/nfs/dbraw/zinc/37/83/93/219378393.db2.gz	HVUMUAKEOOJCRB-UHFFFAOYSA-N	0	0	359.426	2.850	50	5		FFBARN
Cc1ccc(C)c(NC(=O)[C@H](C)N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000001151299	219381573	/nfs/dbraw/zinc/38/15/73/219381573.db2.gz	DLUDDBQXJIEHFI-LBPRGKRZSA-N	0	0	367.361	2.835	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)c1ccc(Br)cc1	ZINC000001188770	219387637	/nfs/dbraw/zinc/38/76/37/219387637.db2.gz	CSIFBJSKOCUZTO-UHFFFAOYSA-N	0	0	354.112	2.990	50	5		FFBARN
COc1cccc(-c2n[nH]c3c2[C@H](c2ccc([N+](=O)[O-])cc2)NC3=O)c1	ZINC000001404805	219403142	/nfs/dbraw/zinc/40/31/42/219403142.db2.gz	LUPIEKFEDTVFTP-HNNXBMFYSA-N	0	0	350.334	2.826	50	5		FFBARN
COCCn1cnc2c(c3nc4ccccc4nc3n2-c2ccccc2)c1=O	ZINC000002302985	219436752	/nfs/dbraw/zinc/43/67/52/219436752.db2.gz	NIVHDRKQTGZRCO-UHFFFAOYSA-N	0	0	371.400	2.930	50	5		FFBARN
C[C@@H](Cn1cc([N+](=O)[O-])cn1)C(=O)Nc1c(F)c(F)c(F)c(F)c1F	ZINC000002793589	219465562	/nfs/dbraw/zinc/46/55/62/219465562.db2.gz	FDOFMVIIBPEJIH-YFKPBYRVSA-N	0	0	364.230	2.762	50	5		FFBARN
O=C(COC(=O)c1cc(Cl)ccc1[N+](=O)[O-])N1CCc2ccccc21	ZINC000003248055	219495237	/nfs/dbraw/zinc/49/52/37/219495237.db2.gz	HMIIPVQKCHWTJT-UHFFFAOYSA-N	0	0	360.753	2.994	50	5		FFBARN
CN(C)/[S@@](=N\S(=O)(=O)c1ccccc1)c1ccccc1[N+](=O)[O-]	ZINC000004531383	219584433	/nfs/dbraw/zinc/58/44/33/219584433.db2.gz	ZRQYBSVXJKCNGY-QFIPXVFZSA-N	0	0	353.425	2.621	50	5		FFBARN
Cc1ccc(OCC(=O)N[C@@H](C)c2ccc(F)cc2F)c([N+](=O)[O-])n1	ZINC000004891731	219620407	/nfs/dbraw/zinc/62/04/07/219620407.db2.gz	CUFULODRDMTMSL-JTQLQIEISA-N	0	0	351.309	2.833	50	5		FFBARN
CC1=C(C(=O)Nc2cccc([N+](=O)[O-])c2)[C@H](c2ccccc2)NC(=O)N1	ZINC000005523341	219686639	/nfs/dbraw/zinc/68/66/39/219686639.db2.gz	KUCCOBNDXNQYHW-INIZCTEOSA-N	0	0	352.350	2.861	50	5		FFBARN
O=C(COc1cc(F)ccc1[N+](=O)[O-])Nc1ccc(N2CCCC2=O)cc1	ZINC000006991245	219786193	/nfs/dbraw/zinc/78/61/93/219786193.db2.gz	GECNVBJJVXRWFV-UHFFFAOYSA-N	0	0	373.340	2.878	50	5		FFBARN
Cc1ccc(NC(=O)[C@H](C)OC(=O)c2cc([N+](=O)[O-])ccc2N)cc1F	ZINC000007206877	219794960	/nfs/dbraw/zinc/79/49/60/219794960.db2.gz	VWASLTIPHQXGQI-JTQLQIEISA-N	0	0	361.329	2.809	50	5		FFBARN
CC(=O)N1N=C(c2c(C)nc3ccccn32)O[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000012966840	220045997	/nfs/dbraw/zinc/04/59/97/220045997.db2.gz	BYEMPVFEQRWDEO-SFHVURJKSA-N	0	0	365.349	2.790	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)COc3ccc([N+](=O)[O-])c(C)c3)ccc21	ZINC000012973226	220047569	/nfs/dbraw/zinc/04/75/69/220047569.db2.gz	ZEGHVAQLRHGUFQ-UHFFFAOYSA-N	0	0	369.377	2.830	50	5		FFBARN
C[C@H]1Cc2ccccc2N1C(=O)COc1ncnc2cc([N+](=O)[O-])ccc21	ZINC000013778621	220094647	/nfs/dbraw/zinc/09/46/47/220094647.db2.gz	RBCAWXOIKOQVAI-LBPRGKRZSA-N	0	0	364.361	2.895	50	5		FFBARN
O=c1ccc([N+](=O)[O-])cn1Cc1csc(COc2ccc(F)cc2)n1	ZINC000014901922	220134900	/nfs/dbraw/zinc/13/49/00/220134900.db2.gz	SMYIWOBEBAIKOS-UHFFFAOYSA-N	0	0	361.354	2.979	50	5		FFBARN
O=C1NC(=S)NC1=Cc1ccccc1OCc1ccc([N+](=O)[O-])cc1	ZINC000015220082	220149824	/nfs/dbraw/zinc/14/98/24/220149824.db2.gz	JXQBSAJWWSYQLE-ZROIWOOFSA-N	0	0	355.375	2.519	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OCC)C1c1ccc([N+](=O)[O-])o1	ZINC000019802124	220298286	/nfs/dbraw/zinc/29/82/86/220298286.db2.gz	VTLVRMDPKYYQLS-UHFFFAOYSA-N	0	0	364.354	2.549	50	5		FFBARN
COc1ccc([C@@H]2OC(c3cccc([N+](=O)[O-])c3)=NN2C(C)=O)cc1OC	ZINC000021091788	220350562	/nfs/dbraw/zinc/35/05/62/220350562.db2.gz	VWNROBOBYWLCIY-SFHVURJKSA-N	0	0	371.349	2.851	50	5		FFBARN
C[C@@H](C(=O)NCCNc1ccccc1[N+](=O)[O-])n1cnc2ccccc21	ZINC000032914261	220698911	/nfs/dbraw/zinc/69/89/11/220698911.db2.gz	NEWCKTGXVGNKLO-ZDUSSCGKSA-N	0	0	353.382	2.734	50	5		FFBARN
COc1ccc(C)cc1NC(=O)Cn1cc(Br)c([N+](=O)[O-])n1	ZINC000054919584	221056515	/nfs/dbraw/zinc/05/65/15/221056515.db2.gz	LUNWGTAVKCSIJV-UHFFFAOYSA-N	0	0	369.175	2.510	50	5		FFBARN
O=C(N[C@@H]1C[C@H]1c1cccc(F)c1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000067092485	221247275	/nfs/dbraw/zinc/24/72/75/221247275.db2.gz	ZKAHCVKFLOWEGX-GXTWGEPZSA-N	0	0	358.325	2.791	50	5		FFBARN
O=C(NCCc1ccccn1)C1CCN(c2ccccc2[N+](=O)[O-])CC1	ZINC000009367873	132846236	/nfs/dbraw/zinc/84/62/36/132846236.db2.gz	VNZAZYCCRMPCMZ-UHFFFAOYSA-N	0	0	354.410	2.565	50	5		FFBARN
O=C(C1CCN(c2ncccc2[N+](=O)[O-])CC1)N1CCc2ccccc2C1	ZINC000030859176	132922105	/nfs/dbraw/zinc/92/21/05/132922105.db2.gz	WNZWVDITEHCSEY-UHFFFAOYSA-N	0	0	366.421	2.791	50	5		FFBARN
Cc1ccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H](C)C2=O)cc1F	ZINC000037520830	132942601	/nfs/dbraw/zinc/94/26/01/132942601.db2.gz	GGPCYFLHQXMQBX-ZDUSSCGKSA-N	0	0	371.368	2.920	50	5		FFBARN
Cc1cc(C)nc(N2CCCN(c3nc4cc([N+](=O)[O-])ccc4[nH]3)CC2)n1	ZINC000097166115	222166472	/nfs/dbraw/zinc/16/64/72/222166472.db2.gz	FOAJVHXJEWUTED-UHFFFAOYSA-N	0	0	367.413	2.595	50	5		FFBARN
Cc1ccccc1-c1nnc2s/c(=C/c3cccc([N+](=O)[O-])c3)c(=O)n21	ZINC000004501504	263333865	/nfs/dbraw/zinc/33/38/65/263333865.db2.gz	HCUMOOYUARLAOX-XNTDXEJSSA-N	0	0	364.386	2.582	50	5		FFBARN
C[C@@H](NC(=O)CCNC(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1	ZINC000007304069	263350221	/nfs/dbraw/zinc/35/02/21/263350221.db2.gz	SPCQQWJKQKZAPB-GFCCVEGCSA-N	0	0	359.357	2.731	50	5		FFBARN
C[C@@H](NC(=O)c1cccc([N+](=O)[O-])c1)C(=O)N(C)[C@@H]1CCc2ccccc21	ZINC000058412590	263415969	/nfs/dbraw/zinc/41/59/69/263415969.db2.gz	KAFWQVMBCYOQJE-FZKQIMNGSA-N	0	0	367.405	2.859	50	5		FFBARN
CCCNC(=O)c1cccc(Cn2cc(Br)c([N+](=O)[O-])n2)c1	ZINC000002102279	506272758	/nfs/dbraw/zinc/27/27/58/506272758.db2.gz	NIYIDGPBRKIGMD-UHFFFAOYSA-N	0	0	367.203	2.742	50	5		FFBARN
O=c1c([N+](=O)[O-])c(NCc2ncc(-c3ccccc3)o2)nc2ccccn21	ZINC000032911802	506311081	/nfs/dbraw/zinc/31/10/81/506311081.db2.gz	ASMUURAPQBFJJD-UHFFFAOYSA-N	0	0	363.333	2.870	50	5		FFBARN
CCCNC(=O)c1cc([N+](=O)[O-])cc2c1-c1ccc([N+](=O)[O-])cc1C2=O	ZINC000003138259	506311300	/nfs/dbraw/zinc/31/13/00/506311300.db2.gz	QPUUQDFDMFDQNG-UHFFFAOYSA-N	0	0	355.306	2.854	50	5		FFBARN
O=c1[nH]c(=O)c2c([nH]1)OC(c1ccccc1)=C[C@H]2c1cccc([N+](=O)[O-])c1	ZINC000003166491	506311847	/nfs/dbraw/zinc/31/18/47/506311847.db2.gz	ZNNDXCMITIUCOL-AWEZNQCLSA-N	0	0	363.329	2.949	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)Nc1ccc2c(c1)OCO2	ZINC000003385737	506326259	/nfs/dbraw/zinc/32/62/59/506326259.db2.gz	DEHPEAZJRPMAHS-JTQLQIEISA-N	0	0	359.338	2.771	50	5		FFBARN
COc1ccc(C(=O)NC[C@H](C)N2CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000033055400	506329915	/nfs/dbraw/zinc/32/99/15/506329915.db2.gz	HSVKWHHSLFHOIM-ZDUSSCGKSA-N	0	0	355.394	2.784	50	5		FFBARN
NC(=O)CSc1nnc(Sc2ccc(Cl)cc2[N+](=O)[O-])s1	ZINC000003425378	506330830	/nfs/dbraw/zinc/33/08/30/506330830.db2.gz	YBDNYYHJYIWWFI-UHFFFAOYSA-N	0	0	362.845	2.828	50	5		FFBARN
O=C(COc1cccnc1[N+](=O)[O-])Nc1ccc(Br)cc1F	ZINC000003450319	506331926	/nfs/dbraw/zinc/33/19/26/506331926.db2.gz	NBBSAUMSDKIXRO-UHFFFAOYSA-N	0	0	370.134	2.909	50	5		FFBARN
Cc1cc(C(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)c(C)n1C1CC1	ZINC000003461083	506334138	/nfs/dbraw/zinc/33/41/38/506334138.db2.gz	YCTXTOUMOFNXPB-UHFFFAOYSA-N	0	0	367.361	2.827	50	5		FFBARN
CC(C)[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C(=O)c2ccccc2C1=O	ZINC000004159295	506362018	/nfs/dbraw/zinc/36/20/18/506362018.db2.gz	FSHWKQUBLNVXSS-INIZCTEOSA-N	0	0	367.361	2.854	50	5		FFBARN
O=C(OCc1ccc([N+](=O)[O-])cc1)c1ccc(N2C(=O)CCC2=O)cc1	ZINC000004351855	506372879	/nfs/dbraw/zinc/37/28/79/506372879.db2.gz	RYKYZXNSQRDMAI-UHFFFAOYSA-N	0	0	354.318	2.605	50	5		FFBARN
CCOc1ccc(N2C[C@@H](C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2=O)cc1	ZINC000005028137	506415550	/nfs/dbraw/zinc/41/55/50/506415550.db2.gz	UKCLBBXGBLYMRR-ZDUSSCGKSA-N	0	0	369.377	2.985	50	5		FFBARN
O=C(Cn1cnc([N+](=O)[O-])c1[N+](=O)[O-])Nc1ccc(Cl)cc1Cl	ZINC000005125730	506424507	/nfs/dbraw/zinc/42/45/07/506424507.db2.gz	CSSXMNRARWFYIA-UHFFFAOYSA-N	0	0	360.113	2.645	50	5		FFBARN
CCS(=O)(=O)c1ccc(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000005241836	506430585	/nfs/dbraw/zinc/43/05/85/506430585.db2.gz	WRHQCSJFMMGFCR-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
O=C(Cn1nc(-c2cccs2)ccc1=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000005388080	506438610	/nfs/dbraw/zinc/43/86/10/506438610.db2.gz	UEUDPTYLPAVYND-UHFFFAOYSA-N	0	0	356.363	2.519	50	5		FFBARN
O=C(Cn1nc(-c2ccccc2)ccc1=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000005388291	506439917	/nfs/dbraw/zinc/43/99/17/506439917.db2.gz	NCQKDIFGQWYCKY-UHFFFAOYSA-N	0	0	368.324	2.596	50	5		FFBARN
CC1(C)OC(=O)C2(Cc3cc([N+](=O)[O-])ccc3N3CCCCC[C@@H]32)C(=O)O1	ZINC000005515967	506445536	/nfs/dbraw/zinc/44/55/36/506445536.db2.gz	XDJPVSBZBVEMJZ-OAHLLOKOSA-N	0	0	374.393	2.722	50	5		FFBARN
O=C(COC(=O)c1n[nH]c2ccccc21)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000005560495	506448443	/nfs/dbraw/zinc/44/84/43/506448443.db2.gz	DXMQNYDKFALNOH-UHFFFAOYSA-N	0	0	374.740	2.920	50	5		FFBARN
Cc1c(CN2C(=O)N[C@@]3(CCOc4ccccc43)C2=O)cccc1[N+](=O)[O-]	ZINC000040116447	506467754	/nfs/dbraw/zinc/46/77/54/506467754.db2.gz	MEILLDTXXUMGHS-LJQANCHMSA-N	0	0	367.361	2.633	50	5		FFBARN
O=C(Cn1nnc(-c2ccccc2)n1)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000006566198	506489161	/nfs/dbraw/zinc/48/91/61/506489161.db2.gz	NCKHHGMXYQHHEM-UHFFFAOYSA-N	0	0	358.745	2.540	50	5		FFBARN
Cc1ccc(F)cc1NC(=O)CSc1ccc(C(N)=O)cc1[N+](=O)[O-]	ZINC000006787034	506506569	/nfs/dbraw/zinc/50/65/69/506506569.db2.gz	VHSMDQSJWBMNBU-UHFFFAOYSA-N	0	0	363.370	2.872	50	5		FFBARN
O=c1[nH]c(SCc2cc([N+](=O)[O-])cc3c2OCOC3)nc2ccccc21	ZINC000006909566	506515782	/nfs/dbraw/zinc/51/57/82/506515782.db2.gz	PRMACPRXDDNUQL-UHFFFAOYSA-N	0	0	371.374	2.990	50	5		FFBARN
COC(=O)c1cc(C(=O)N[C@H]2CCOc3ccccc32)cc([N+](=O)[O-])c1	ZINC000007215176	506543750	/nfs/dbraw/zinc/54/37/50/506543750.db2.gz	KFTJXGCKTDVWDO-HNNXBMFYSA-N	0	0	356.334	2.635	50	5		FFBARN
COCCNC(=O)/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc2ccccc2[nH]1	ZINC000007738235	506585707	/nfs/dbraw/zinc/58/57/07/506585707.db2.gz	TVTOHLYVSFPDEV-NTCAYCPXSA-N	0	0	366.377	2.774	50	5		FFBARN
COc1cccc(CNC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)c1	ZINC000009156689	506686002	/nfs/dbraw/zinc/68/60/02/506686002.db2.gz	XDOXAXOYSOHGQJ-UHFFFAOYSA-N	0	0	352.350	2.719	50	5		FFBARN
Cc1nc2ccccn2c(=O)c1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000010608677	506748484	/nfs/dbraw/zinc/74/84/84/506748484.db2.gz	GBSGFJILSZQLHB-UHFFFAOYSA-N	0	0	358.741	2.817	50	5		FFBARN
O=C(NC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1	ZINC000010779026	506753151	/nfs/dbraw/zinc/75/31/51/506753151.db2.gz	QLBKPORNCWIFKV-UHFFFAOYSA-N	0	0	353.378	2.629	50	5		FFBARN
COc1cc(CCNC(=O)CCc2ccccc2O)c([N+](=O)[O-])cc1OC	ZINC000011081577	506764543	/nfs/dbraw/zinc/76/45/43/506764543.db2.gz	SSQNKOKPPMHALS-UHFFFAOYSA-N	0	0	374.393	2.609	50	5		FFBARN
Cc1ccc(OCCNC(=O)CCn2ncc3ccc([N+](=O)[O-])cc32)cc1	ZINC000044292468	506829593	/nfs/dbraw/zinc/82/95/93/506829593.db2.gz	UZFQZZGEEJALLX-UHFFFAOYSA-N	0	0	368.393	2.838	50	5		FFBARN
COc1ccc(S(=O)(=O)N2CCC[C@H]2c2ccncc2)cc1[N+](=O)[O-]	ZINC000024434519	507410981	/nfs/dbraw/zinc/41/09/81/507410981.db2.gz	OXFKTUZQNIJSFE-AWEZNQCLSA-N	0	0	363.395	2.524	50	5		FFBARN
CCN(CC(=O)Nc1ccc2c(c1)OCCO2)Cc1ccccc1[N+](=O)[O-]	ZINC000024820901	507440588	/nfs/dbraw/zinc/44/05/88/507440588.db2.gz	QVENDSXDCGCYLB-UHFFFAOYSA-N	0	0	371.393	2.827	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CCN3C(C)=O)c1	ZINC000060063803	507512541	/nfs/dbraw/zinc/51/25/41/507512541.db2.gz	SKIKSXFHFXQJQL-UHFFFAOYSA-N	0	0	355.350	2.765	50	5		FFBARN
COc1cc(OC)cc([C@@H](Nc2ncccc2[N+](=O)[O-])c2nccn2C)c1	ZINC000028620307	507731319	/nfs/dbraw/zinc/73/13/19/507731319.db2.gz	AYHVBHLAEQJCMZ-MRXNPFEDSA-N	0	0	369.381	2.942	50	5		FFBARN
Cc1ccc([N+](=O)[O-])c(OCCC(=O)NCc2ccc3c(c2)OCO3)c1	ZINC000031550298	507820182	/nfs/dbraw/zinc/82/01/82/507820182.db2.gz	YVBANBYZRMLKTC-UHFFFAOYSA-N	0	0	358.350	2.717	50	5		FFBARN
CC(=O)CC(C)(C)NC(=O)CCN(C)Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000095469908	508187597	/nfs/dbraw/zinc/18/75/97/508187597.db2.gz	ZORUYOXEFXEZTK-UHFFFAOYSA-N	0	0	369.849	2.944	50	5		FFBARN
CN(CCn1cccn1)C(=O)Cn1c2ccccc2c2ccccc2c1=O	ZINC000095525627	508195467	/nfs/dbraw/zinc/19/54/67/508195467.db2.gz	SMCANRYFVPRZBU-UHFFFAOYSA-N	0	0	360.417	2.510	50	5		FFBARN
O=C(NC1CC1)[C@@H]1CCCN1c1ccc([N+](=O)[O-])cc1Br	ZINC000225505109	509374093	/nfs/dbraw/zinc/37/40/93/509374093.db2.gz	PUZUKOAZBVKFQL-ZDUSSCGKSA-N	0	0	354.204	2.605	50	5		FFBARN
O=c1c2nnc(-c3cccc([N+](=O)[O-])c3)n2ccn1-c1ccc(F)cc1	ZINC000225534292	509375448	/nfs/dbraw/zinc/37/54/48/509375448.db2.gz	RICCXQQCZGMIRY-UHFFFAOYSA-N	0	0	351.297	2.595	50	5		FFBARN
CN(C)c1nc(Nc2ccc([N+](=O)[O-])cc2)nc(OCC(F)(F)F)n1	ZINC000003877358	727777522	/nfs/dbraw/zinc/77/75/22/727777522.db2.gz	NPFSWQWYKLHWPI-UHFFFAOYSA-N	0	0	358.280	2.531	50	5		FFBARN
COc1ccc(Oc2ccc(/C=C3/NC(=S)NC3=O)cc2[N+](=O)[O-])cc1	ZINC000102988473	977421488	/nfs/dbraw/zinc/42/14/88/977421488.db2.gz	IPSZERRUGPVSQK-MDWZMJQESA-N	0	0	371.374	2.741	50	5		FFBARN
COC(=O)C1C(C)=NC(=S)N[C@@H]1c1ccc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000001195064	1014454791	/nfs/dbraw/zinc/45/47/91/1014454791.db2.gz	MOOQUSCZFFANCL-OAHLLOKOSA-N	0	0	373.390	2.821	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)N1CCC(N2CCCCC2=O)CC1	ZINC000089780786	1025778365	/nfs/dbraw/zinc/77/83/65/1025778365.db2.gz	ZXCCOYOOYMYAQX-BQYQJAHWSA-N	0	0	357.410	2.612	50	5		FFBARN
COc1cc([C@H]2NC(=O)CC[C@@H]2[N+](=O)[O-])ccc1OCc1ccccc1	ZINC000000815841	219325265	/nfs/dbraw/zinc/32/52/65/219325265.db2.gz	ZCSAVJRPGZHZHC-HNAYVOBHSA-N	0	0	356.378	2.871	50	5		FFBARN
COC(=O)c1ccc(C(=O)OC)c(NC(=O)c2cccc([N+](=O)[O-])c2C)c1	ZINC000000805351	219323420	/nfs/dbraw/zinc/32/34/20/219323420.db2.gz	SNGUEEWWFIOXRJ-UHFFFAOYSA-N	0	0	372.333	2.729	50	5		FFBARN
COc1ccc(OC)c(NC(=O)c2cc3cc([N+](=O)[O-])ccc3oc2=O)c1	ZINC000000851116	219330786	/nfs/dbraw/zinc/33/07/86/219330786.db2.gz	NUUGPLCEWPBYGR-UHFFFAOYSA-N	0	0	370.317	2.971	50	5		FFBARN
COc1ccc(CN2CCN(Cc3ccc([N+](=O)[O-])cc3)CC2)c(OC)c1	ZINC000000865094	219333372	/nfs/dbraw/zinc/33/33/72/219333372.db2.gz	VUMYGOSIHKJNFT-UHFFFAOYSA-N	0	0	371.437	2.930	50	5		FFBARN
CCOC(=O)c1ccc([N-]S(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000000836905	219328863	/nfs/dbraw/zinc/32/88/63/219328863.db2.gz	IHLBCCOGPJOUTI-UHFFFAOYSA-N	0	0	350.352	2.572	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2cccc([N+](=O)[O-])c2)cc1OC	ZINC000000881631	219335734	/nfs/dbraw/zinc/33/57/34/219335734.db2.gz	HRBMPQMISYPVPD-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
CC1(C)c2ccccc2N(CC(N)=O)[C@]12C=Cc1cc([N+](=O)[O-])ccc1O2	ZINC000001097740	219368874	/nfs/dbraw/zinc/36/88/74/219368874.db2.gz	XABQINSAZCFVGT-FQEVSTJZSA-N	0	0	365.389	2.980	50	5		FFBARN
COC(=O)C1=CN(C(C)C)C=C(C(=O)OC)C1c1ccc(C)c([N+](=O)[O-])c1	ZINC000001123363	219373942	/nfs/dbraw/zinc/37/39/42/219373942.db2.gz	HXQQQVWXCTZYPP-UHFFFAOYSA-N	0	0	374.393	2.825	50	5		FFBARN
O=C(CSc1nc2cc([N+](=O)[O-])ccc2[nH]1)Nc1ccc2c(c1)OCO2	ZINC000001230509	219391048	/nfs/dbraw/zinc/39/10/48/219391048.db2.gz	OUYDNPSROZCRIG-UHFFFAOYSA-N	0	0	372.362	2.931	50	5		FFBARN
COc1cc(C=O)ccc1OCCOCCOc1ccc([N+](=O)[O-])cc1	ZINC000002985279	219480839	/nfs/dbraw/zinc/48/08/39/219480839.db2.gz	WLXYTYDSOKYZCZ-UHFFFAOYSA-N	0	0	361.350	2.890	50	5		FFBARN
COc1cccc(CNC(=O)c2cccn3c(=O)c4ccccc4nc23)c1	ZINC000002957252	219478062	/nfs/dbraw/zinc/47/80/62/219478062.db2.gz	PXAIUNKFJKQPHV-UHFFFAOYSA-N	0	0	359.385	2.786	50	5		FFBARN
C[C@H](OC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003237427	219493855	/nfs/dbraw/zinc/49/38/55/219493855.db2.gz	PJAOFMOGBOGEOF-JTQLQIEISA-N	0	0	358.306	2.508	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1cccs1	ZINC000003247212	219495248	/nfs/dbraw/zinc/49/52/48/219495248.db2.gz	RPQOZNUNJVDZQN-SECBINFHSA-N	0	0	350.352	2.849	50	5		FFBARN
Cc1ccc(C(=O)OCCCn2c(=O)[nH]c3ccccc32)cc1[N+](=O)[O-]	ZINC000003568287	219520200	/nfs/dbraw/zinc/52/02/00/219520200.db2.gz	LDDJUIKCHZHKJO-UHFFFAOYSA-N	0	0	355.350	2.793	50	5		FFBARN
CCCCCOC(=O)C1C(C)=Nc2nnnn2[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000004878510	219618282	/nfs/dbraw/zinc/61/82/82/219618282.db2.gz	CBMDBAWSGPOXKP-HNNXBMFYSA-N	0	0	372.385	2.604	50	5		FFBARN
Cc1nn(CCC2N=NC(=S)N2c2ccc(F)cc2)c(C)c1[N+](=O)[O-]	ZINC000005424959	219677309	/nfs/dbraw/zinc/67/73/09/219677309.db2.gz	UTWNOXOOVFQNDD-UHFFFAOYSA-N	0	0	362.390	2.659	50	5		FFBARN
Cn1c2cc3c(cc2s/c1=N/C(=O)c1ccc([N+](=O)[O-])cc1)OCCO3	ZINC000012080582	219951605	/nfs/dbraw/zinc/95/16/05/219951605.db2.gz	MGJDANCIOVAILM-ISLYRVAYSA-N	0	0	371.374	2.660	50	5		FFBARN
O=C(c1cccc([N+](=O)[O-])c1)N1CCC(n2c(=O)[nH]c3ccccc32)CC1	ZINC000012584277	220009265	/nfs/dbraw/zinc/00/92/65/220009265.db2.gz	XHODAKLIAAQHSD-UHFFFAOYSA-N	0	0	366.377	2.715	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(CN2C(=O)CCC2=O)cc1	ZINC000012814014	220033068	/nfs/dbraw/zinc/03/30/68/220033068.db2.gz	CTZKLYJQEMISRW-UHFFFAOYSA-N	0	0	367.361	2.805	50	5		FFBARN
CCCCNC(=O)/C(=C\c1ccc([N+](=O)[O-])o1)NC(=O)c1ccccc1	ZINC000013124308	220059120	/nfs/dbraw/zinc/05/91/20/220059120.db2.gz	ZRYDZTLWQUNUOL-NTCAYCPXSA-N	0	0	357.366	2.875	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])o1)Nc1ccc(N2CCCC2)cc1	ZINC000015642472	220158343	/nfs/dbraw/zinc/15/83/43/220158343.db2.gz	TTYYODRFAINJCV-UHFFFAOYSA-N	0	0	359.338	2.584	50	5		FFBARN
CC(=O)c1cc2c(cc1NC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)OCO2	ZINC000016321905	220182483	/nfs/dbraw/zinc/18/24/83/220182483.db2.gz	RSKYQCKAKWEWIP-UHFFFAOYSA-N	0	0	373.277	2.687	50	5		FFBARN
C[C@@H]1CC(=O)N(Cc2ccc([N+](=O)[O-])cc2)c2ccccc2S1(=O)=O	ZINC000017244165	220211190	/nfs/dbraw/zinc/21/11/90/220211190.db2.gz	IFEFDAMGVMCTAA-GFCCVEGCSA-N	0	0	360.391	2.694	50	5		FFBARN
COCCNc1ccc(C(=O)N(C)Cc2ccccc2OC)cc1[N+](=O)[O-]	ZINC000018076525	220222816	/nfs/dbraw/zinc/22/28/16/220222816.db2.gz	HBODWEPSMLAWDB-UHFFFAOYSA-N	0	0	373.409	2.934	50	5		FFBARN
CCN(Cc1c(C)nn(CC)c1C)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000020608167	220336799	/nfs/dbraw/zinc/33/67/99/220336799.db2.gz	CPQRHFOKUKFTDA-UHFFFAOYSA-N	0	0	366.443	2.639	50	5		FFBARN
COCCN1C(=O)c2[nH]nc(-c3ccco3)c2[C@H]1c1cccc([N+](=O)[O-])c1	ZINC000020728359	220338607	/nfs/dbraw/zinc/33/86/07/220338607.db2.gz	KHYSDGCCUXHNPZ-QGZVFWFLSA-N	0	0	368.349	2.770	50	5		FFBARN
O=C(Cc1csc(-c2ccco2)n1)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000025354252	220483062	/nfs/dbraw/zinc/48/30/62/220483062.db2.gz	OWWIGJPHWDAIGX-AWEZNQCLSA-N	0	0	373.390	2.704	50	5		FFBARN
O=C(Cc1ccc([N+](=O)[O-])cc1)N1CCC[C@@H](c2nnc3ccccn32)C1	ZINC000027072681	220528810	/nfs/dbraw/zinc/52/88/10/220528810.db2.gz	OMOGZUDGBWJOTM-OAHLLOKOSA-N	0	0	365.393	2.586	50	5		FFBARN
C[C@@H](Cc1cccc(Cl)c1)Nc1ccc([N+](=O)[O-])cc1S(N)(=O)=O	ZINC000052280561	221038143	/nfs/dbraw/zinc/03/81/43/221038143.db2.gz	GSDYBWIHURLKRZ-JTQLQIEISA-N	0	0	369.830	2.939	50	5		FFBARN
CCN(C(=O)Cn1cc(Br)c([N+](=O)[O-])n1)c1ccccc1	ZINC000054919630	221056209	/nfs/dbraw/zinc/05/62/09/221056209.db2.gz	HAVFIWFZEDDMMZ-UHFFFAOYSA-N	0	0	353.176	2.607	50	5		FFBARN
O=[N+]([O-])c1nn(Cc2nc(Cc3ccccc3)no2)cc1Br	ZINC000054919004	221056247	/nfs/dbraw/zinc/05/62/47/221056247.db2.gz	VWUZYDMAOKVBRR-UHFFFAOYSA-N	0	0	364.159	2.576	50	5		FFBARN
CCc1ccccc1NC(=O)CN(C)C(=O)c1cc(F)cc([N+](=O)[O-])c1N	ZINC000058202081	221106084	/nfs/dbraw/zinc/10/60/84/221106084.db2.gz	PSEBWKCLAWJFCI-UHFFFAOYSA-N	0	0	374.372	2.589	50	5		FFBARN
CNS(=O)(=O)c1ccc(N2CC3C[C@@H]4CC2C[C@H](C3)C4)c([N+](=O)[O-])c1	ZINC000065946856	221238117	/nfs/dbraw/zinc/23/81/17/221238117.db2.gz	HCGVKMYAVBBWNC-VTXSZYRJSA-N	0	0	365.455	2.518	50	5		FFBARN
O=C(NC1N=NC(=S)S1)c1ccc(N2CCCCC2)c([N+](=O)[O-])c1	ZINC000006547981	132258867	/nfs/dbraw/zinc/25/88/67/132258867.db2.gz	XLFCVEFDVAITIP-UHFFFAOYSA-N	0	0	365.440	2.978	50	5		FFBARN
O=C(c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1)N1CCN(c2ccccc2F)CC1	ZINC000003378750	132385268	/nfs/dbraw/zinc/38/52/68/132385268.db2.gz	UAMPFYRAYMRDAW-UHFFFAOYSA-N	0	0	374.328	2.605	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1	ZINC000005129925	132826921	/nfs/dbraw/zinc/82/69/21/132826921.db2.gz	FEMBIFRXUOMPNV-UHFFFAOYSA-N	0	0	357.322	2.571	50	5		FFBARN
Cc1ccc(F)cc1NC(=O)CN1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000052537612	136124443	/nfs/dbraw/zinc/12/44/43/136124443.db2.gz	IHDISYWBDMSBPC-UHFFFAOYSA-N	0	0	372.400	2.803	50	5		FFBARN
O=C(Cc1ccc(F)cc1)NCc1nc(-c2ccc([N+](=O)[O-])cc2)no1	ZINC000096290236	222111057	/nfs/dbraw/zinc/11/10/57/222111057.db2.gz	BYOLIVJRRDYLDN-UHFFFAOYSA-N	0	0	356.313	2.643	50	5		FFBARN
COc1ccc(C2=Nc3nnnn3[C@@H](c3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000101087618	222261651	/nfs/dbraw/zinc/26/16/51/222261651.db2.gz	DQJDCGNUPMGCGZ-MRXNPFEDSA-N	0	0	350.338	2.646	50	5		FFBARN
CC1=C(C(=O)O[C@H]2CCC[C@H]2C)[C@@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000004256031	263332073	/nfs/dbraw/zinc/33/20/73/263332073.db2.gz	BQRURLIZQQYDGS-FUEDEBDSSA-N	0	0	359.382	2.955	50	5		FFBARN
CN1C(=O)c2ccc(NC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)cc2C1=O	ZINC000001004633	506243201	/nfs/dbraw/zinc/24/32/01/506243201.db2.gz	VYRCZEDGKVOYMC-UHFFFAOYSA-N	0	0	359.725	2.726	50	5		FFBARN
CC(=O)Oc1ccccc1/C=C1/N=C(c2cccc([N+](=O)[O-])c2)OC1=O	ZINC000001041627	506246086	/nfs/dbraw/zinc/24/60/86/506246086.db2.gz	IQOVOFWOBPQWQT-XNTDXEJSSA-N	0	0	352.302	2.865	50	5		FFBARN
CCOC(=O)CSc1ncc(OC)c(Oc2cccc([N+](=O)[O-])c2)n1	ZINC000001388543	506260484	/nfs/dbraw/zinc/26/04/84/506260484.db2.gz	YMQVOQRNZOIUCX-UHFFFAOYSA-N	0	0	365.367	2.841	50	5		FFBARN
CCOc1ccc(NC(=O)[C@@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2)cc1	ZINC000001444842	506262176	/nfs/dbraw/zinc/26/21/76/506262176.db2.gz	OBCUDWKLYZOFNW-CYBMUJFWSA-N	0	0	369.377	2.985	50	5		FFBARN
COc1ccc(C(=O)c2ccccc2)c(Oc2nc([N+](=O)[O-])nn2C)c1	ZINC000001432498	506262276	/nfs/dbraw/zinc/26/22/76/506262276.db2.gz	BOHXTROWWCXLSH-UHFFFAOYSA-N	0	0	354.322	2.755	50	5		FFBARN
Cn1c(SCC(=O)c2cccc([N+](=O)[O-])c2)nnc1-c1cccnc1	ZINC000032579393	506266203	/nfs/dbraw/zinc/26/62/03/506266203.db2.gz	BSXLBKUFYGFBHE-UHFFFAOYSA-N	0	0	355.379	2.760	50	5		FFBARN
O=C(Nc1cccc2ccccc21)c1ccn(Cn2cc([N+](=O)[O-])cn2)n1	ZINC000002787912	506293556	/nfs/dbraw/zinc/29/35/56/506293556.db2.gz	RAFRFWIMAJDURO-UHFFFAOYSA-N	0	0	362.349	2.899	50	5		FFBARN
CCc1c(C)sc2ncn3nc(CCn4cc([N+](=O)[O-])cn4)nc3c12	ZINC000002809004	506294303	/nfs/dbraw/zinc/29/43/03/506294303.db2.gz	UVHOZNGDKCFTJF-UHFFFAOYSA-N	0	0	357.399	2.557	50	5		FFBARN
COc1ccc(CSCC(=O)Nc2nnc(C)s2)cc1[N+](=O)[O-]	ZINC000032816030	506298238	/nfs/dbraw/zinc/29/82/38/506298238.db2.gz	SEUDTDZONVCBPH-UHFFFAOYSA-N	0	0	354.413	2.635	50	5		FFBARN
CNc1ccc(C(=O)N[C@H](CC(=O)OC)c2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000032821116	506300301	/nfs/dbraw/zinc/30/03/01/506300301.db2.gz	ORLJBBGGWVETFB-MRXNPFEDSA-N	0	0	371.393	2.979	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@@H](C)OC(=O)c1cc(C)oc1C	ZINC000003290455	506319116	/nfs/dbraw/zinc/31/91/16/506319116.db2.gz	LYPPFSPOHLULTD-LLVKDONJSA-N	0	0	362.338	2.997	50	5		FFBARN
C[C@H](Oc1ccc(Cl)cc1)C(=O)NC[C@H](O)c1ccc([N+](=O)[O-])cc1	ZINC000032999819	506322935	/nfs/dbraw/zinc/32/29/35/506322935.db2.gz	RNRXZSOEXYIMOG-ZBEGNZNMSA-N	0	0	364.785	2.865	50	5		FFBARN
Cn1nc(C(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c2ccccc2c1=O	ZINC000003342947	506324568	/nfs/dbraw/zinc/32/45/68/506324568.db2.gz	AYJPGDDWCBYDCO-UHFFFAOYSA-N	0	0	358.741	2.747	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(C/C=C/c3ccccc3)CC2)c2nonc21	ZINC000033014474	506324911	/nfs/dbraw/zinc/32/49/11/506324911.db2.gz	UDRLTKXJBIYZKL-QPJJXVBHSA-N	0	0	365.393	2.966	50	5		FFBARN
Cc1noc(C)c1[C@@H]1CCCN1S(=O)(=O)c1ccccc1[N+](=O)[O-]	ZINC000033086868	506333942	/nfs/dbraw/zinc/33/39/42/506333942.db2.gz	VAEYXXSCLDTCQC-ZDUSSCGKSA-N	0	0	351.384	2.725	50	5		FFBARN
COc1ccccc1-c1nnc(SCc2ccc([N+](=O)[O-])cc2)n1N	ZINC000003600264	506345821	/nfs/dbraw/zinc/34/58/21/506345821.db2.gz	DIMJFOPYXYWHGM-UHFFFAOYSA-N	0	0	357.395	2.868	50	5		FFBARN
C[C@H]1CN(C(=S)SCC(=O)c2ccc([N+](=O)[O-])cc2)C[C@H](C)O1	ZINC000004289999	506369528	/nfs/dbraw/zinc/36/95/28/506369528.db2.gz	KHKFASHXUMOSLQ-QWRGUYRKSA-N	0	0	354.453	2.905	50	5		FFBARN
COc1ccc(OCc2cccc(C(=O)Nn3cc([N+](=O)[O-])cn3)c2)cc1	ZINC000004652267	506387156	/nfs/dbraw/zinc/38/71/56/506387156.db2.gz	KZASASKOUULWBZ-UHFFFAOYSA-N	0	0	368.349	2.763	50	5		FFBARN
COc1cccc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)c1	ZINC000005049440	506417706	/nfs/dbraw/zinc/41/77/06/506417706.db2.gz	XUPWXLOPCYFDQV-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
Cc1ccccc1N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)[C@H](C)C1=O	ZINC000037521087	506427064	/nfs/dbraw/zinc/42/70/64/506427064.db2.gz	XJPNZAWXJJTKAX-CQSZACIVSA-N	0	0	353.378	2.781	50	5		FFBARN
Cc1cc(C(=O)OCC(=O)c2ccc3c(c2)OCCO3)ccc1[N+](=O)[O-]	ZINC000005635193	506450850	/nfs/dbraw/zinc/45/08/50/506450850.db2.gz	MYTVFUMKUBSJMC-UHFFFAOYSA-N	0	0	357.318	2.714	50	5		FFBARN
COC(=O)c1c2c(sc1NC(=O)c1n[nH]cc1[N+](=O)[O-])CCCCC2	ZINC000006265872	506474578	/nfs/dbraw/zinc/47/45/78/506474578.db2.gz	SEFCBKZUFNRYGX-UHFFFAOYSA-N	0	0	364.383	2.687	50	5		FFBARN
Cc1ccc(OCCOC(=O)c2cc([N+](=O)[O-])ccc2NCCO)cc1	ZINC000006465275	506484074	/nfs/dbraw/zinc/48/40/74/506484074.db2.gz	VRHKWEIGNSTFRK-UHFFFAOYSA-N	0	0	360.366	2.543	50	5		FFBARN
Cc1ccc(OCCN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1	ZINC000006834720	506509858	/nfs/dbraw/zinc/50/98/58/506509858.db2.gz	BMHBMKXXTSYIBJ-LJQANCHMSA-N	0	0	369.377	2.749	50	5		FFBARN
COc1ccccc1NC(=O)/C(=C\c1cccc([N+](=O)[O-])c1)NC(C)=O	ZINC000006856851	506512332	/nfs/dbraw/zinc/51/23/32/506512332.db2.gz	DRHMNFAQZKWPQI-LFIBNONCSA-N	0	0	355.350	2.719	50	5		FFBARN
O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCN(c2ncccn2)CC1	ZINC000006923550	506517569	/nfs/dbraw/zinc/51/75/69/506517569.db2.gz	MLRPCMMCTVJKRW-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
C[C@H](NS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnc2)cc1	ZINC000007050173	506529031	/nfs/dbraw/zinc/52/90/31/506529031.db2.gz	BHKMOWCNDZUTNE-ZDUSSCGKSA-N	0	0	372.406	2.820	50	5		FFBARN
CS(=O)(=O)c1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1	ZINC000007725062	506584285	/nfs/dbraw/zinc/58/42/85/506584285.db2.gz	WVKKGWOSCSRPAP-UHFFFAOYSA-N	0	0	354.771	2.904	50	5		FFBARN
CC(=O)c1cccc(N2C(=O)C[C@@H](Nc3cccc([N+](=O)[O-])c3)C2=O)c1	ZINC000008024971	506614529	/nfs/dbraw/zinc/61/45/29/506614529.db2.gz	GMSDXAPXLZZPHE-MRXNPFEDSA-N	0	0	353.334	2.541	50	5		FFBARN
CNc1ccc(S(=O)(=O)N(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-]	ZINC000008747671	506666024	/nfs/dbraw/zinc/66/60/24/506666024.db2.gz	KHPIFFZFUNILLY-UHFFFAOYSA-N	0	0	353.375	2.596	50	5		FFBARN
Cc1cccnc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000008779761	506669042	/nfs/dbraw/zinc/66/90/42/506669042.db2.gz	ZJDXVOAFOLOIHF-UHFFFAOYSA-N	0	0	356.338	2.625	50	5		FFBARN
O=c1c2cc([N+](=O)[O-])ccc2ncn1Cc1cc2c(c(Cl)c1)OCO2	ZINC000008777947	506669249	/nfs/dbraw/zinc/66/92/49/506669249.db2.gz	LSPCRLYTMWCYIQ-UHFFFAOYSA-N	0	0	359.725	2.735	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000008816108	506671009	/nfs/dbraw/zinc/67/10/09/506671009.db2.gz	CDAXJNZGDXIOSF-NSHDSACASA-N	0	0	373.340	2.734	50	5		FFBARN
CN(Cc1ccc(Cl)cc1Cl)C(=O)c1cc([N+](=O)[O-])c[nH]c1=O	ZINC000009216966	506687694	/nfs/dbraw/zinc/68/76/94/506687694.db2.gz	NBXMUWJXEMMEOS-UHFFFAOYSA-N	0	0	356.165	2.862	50	5		FFBARN
Cn1ccnc1[C@@H](Nc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(F)c1	ZINC000009367242	506694034	/nfs/dbraw/zinc/69/40/34/506694034.db2.gz	NFOLPKLEDLMHRR-INIZCTEOSA-N	0	0	369.356	2.768	50	5		FFBARN
Cc1nc2ccc(Cl)cn2c(=O)c1NC(=O)c1ccccc1[N+](=O)[O-]	ZINC000009616924	506704846	/nfs/dbraw/zinc/70/48/46/506704846.db2.gz	VAYMMKMLTYQBOU-UHFFFAOYSA-N	0	0	358.741	2.817	50	5		FFBARN
O=C(CNc1ccc(F)c([N+](=O)[O-])c1)Nc1cccc(C(=O)NC2CC2)c1	ZINC000011549557	506782163	/nfs/dbraw/zinc/78/21/63/506782163.db2.gz	JIWPHTYBXKWTLM-UHFFFAOYSA-N	0	0	372.356	2.677	50	5		FFBARN
C[C@H](NC(=O)c1ccc(N2CCN(C)CC2)c([N+](=O)[O-])c1)c1ccccc1	ZINC000012555157	506877885	/nfs/dbraw/zinc/87/78/85/506877885.db2.gz	LQJLZRDOQKSJQQ-HNNXBMFYSA-N	0	0	368.437	2.838	50	5		FFBARN
Cc1ccc(OCCN(C)S(=O)(=O)Cc2ccc([N+](=O)[O-])cc2)cc1	ZINC000045798689	507023642	/nfs/dbraw/zinc/02/36/42/507023642.db2.gz	ZCXMMSWGSJCBFT-UHFFFAOYSA-N	0	0	364.423	2.744	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccc(C(F)(F)F)cn3)CC2)nc1	ZINC000020223961	507215004	/nfs/dbraw/zinc/21/50/04/507215004.db2.gz	RBQKWOPXUZSMJK-UHFFFAOYSA-N	0	0	353.304	2.730	50	5		FFBARN
COc1ncccc1CNC(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1	ZINC000023101783	507328166	/nfs/dbraw/zinc/32/81/66/507328166.db2.gz	YMJOGQIDYHNSMN-UHFFFAOYSA-N	0	0	356.382	2.529	50	5		FFBARN
COc1ccc(NC(=O)NCCc2ccc3c(c2)OCO3)c([N+](=O)[O-])c1	ZINC000023394454	507350100	/nfs/dbraw/zinc/35/01/00/507350100.db2.gz	PZOQRRXZAJGKID-UHFFFAOYSA-N	0	0	359.338	2.696	50	5		FFBARN
COC(=O)c1cccc2c3c([nH]c21)CCN(C(=O)c1ccc([N+](=O)[O-])o1)C3	ZINC000024555436	507420163	/nfs/dbraw/zinc/42/01/63/507420163.db2.gz	PYXXRGAQPUYBMY-UHFFFAOYSA-N	0	0	369.333	2.654	50	5		FFBARN
CN(C)C(=O)COc1ccc(NC(=O)Nc2cccc([N+](=O)[O-])c2)cc1	ZINC000024747547	507435414	/nfs/dbraw/zinc/43/54/14/507435414.db2.gz	YOPCKAVQZHYMAI-UHFFFAOYSA-N	0	0	358.354	2.706	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCc2ccccc21	ZINC000025051513	507460829	/nfs/dbraw/zinc/46/08/29/507460829.db2.gz	DYMDKPSKJYYJBL-QGZVFWFLSA-N	0	0	353.378	2.518	50	5		FFBARN
CN(C)c1ccc(C(=O)N2CCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-]	ZINC000030764657	507813073	/nfs/dbraw/zinc/81/30/73/507813073.db2.gz	OATBDYWNXASIAU-GOSISDBHSA-N	0	0	355.394	2.875	50	5		FFBARN
Cc1cccc(C(=O)N[C@H](C)c2ccc3c(c2)NC(=O)CO3)c1[N+](=O)[O-]	ZINC000031737068	507821372	/nfs/dbraw/zinc/82/13/72/507821372.db2.gz	MIPJVBXLFOPWHQ-LLVKDONJSA-N	0	0	355.350	2.725	50	5		FFBARN
NC(=O)[C@H]1CCCCC[C@H]1NC(=O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000079097516	507933220	/nfs/dbraw/zinc/93/32/20/507933220.db2.gz	DVTUJJVOABWDJI-CMPLNLGQSA-N	0	0	354.794	2.804	50	5		FFBARN
COC(=O)c1ccc(OCc2nc3oc(C)c(C)c3c(N)n2)c([N+](=O)[O-])c1	ZINC000084061856	508264233	/nfs/dbraw/zinc/26/42/33/508264233.db2.gz	BVCJWGCQQAXCJN-UHFFFAOYSA-N	0	0	372.337	2.696	50	5		FFBARN
CC1CCN(c2ccc([N+](=O)[O-])cc2C(=O)N2C[C@@H]3CC[C@@H](O)[C@H]3C2)CC1	ZINC000239667456	521044566	/nfs/dbraw/zinc/04/45/66/521044566.db2.gz	BQEWZZCEKPLKQB-UCLAIMLFSA-N	0	0	373.453	2.674	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1c2ccccc2[C@@H](C(N)=O)C[C@H]1C	ZINC000058424533	536952095	/nfs/dbraw/zinc/95/20/95/536952095.db2.gz	BDHYBMIDMIUTTA-WBMJQRKESA-N	0	0	355.394	2.971	50	5		FFBARN
O=[N+]([O-])c1c(N2CCC(c3nncn3C3CC3)CC2)nc2ccccn21	ZINC000084606555	571092639	/nfs/dbraw/zinc/09/26/39/571092639.db2.gz	CCWXITHRIYBZRV-UHFFFAOYSA-N	0	0	353.386	2.553	50	5		FFBARN
O=C(/C=C\c1cccc([N+](=O)[O-])c1)OCC(=O)Nc1ccc(Cl)cn1	ZINC000097656199	728483584	/nfs/dbraw/zinc/48/35/84/728483584.db2.gz	XNFCJGALSAKTFI-DAXSKMNVSA-N	0	0	361.741	2.838	50	5		FFBARN
COc1cccc(/C=C\C(=O)OCC(=O)Nc2ccc(F)c([N+](=O)[O-])c2)c1	ZINC000006373217	976596484	/nfs/dbraw/zinc/59/64/84/976596484.db2.gz	VUXUBKLEUZBWQW-YVMONPNESA-N	0	0	374.324	2.938	50	5		FFBARN
O=C1c2cccc3c([N+](=O)[O-])ccc(c23)C(=O)N1c1nc(F)cc(F)n1	ZINC000826559558	1010469859	/nfs/dbraw/zinc/46/98/59/1010469859.db2.gz	PLAJBYPLZBOEEC-UHFFFAOYSA-N	0	0	356.244	2.617	50	5		FFBARN
O=C(/C=C\c1ccc([N+](=O)[O-])cc1)OCC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000035079768	1019197151	/nfs/dbraw/zinc/19/71/51/1019197151.db2.gz	DFCXNDRVQKGYSN-TWGQIWQCSA-N	0	0	371.305	2.698	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)N(Cc2ccco2)C[C@H]2CCCO2)cc1	ZINC000000741529	219317915	/nfs/dbraw/zinc/31/79/15/219317915.db2.gz	QWMXGYWEVDLTOP-OAHLLOKOSA-N	0	0	366.395	2.558	50	5		FFBARN
COc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)c(OC)cc1NC(C)=O	ZINC000000790039	219321254	/nfs/dbraw/zinc/32/12/54/219321254.db2.gz	KGBLHZRMMORURV-UHFFFAOYSA-N	0	0	359.338	2.823	50	5		FFBARN
CC[C@@H]1CCCCN1C(=O)Cn1nc([N+](=O)[O-])c(Br)c1C	ZINC000000756436	219319271	/nfs/dbraw/zinc/31/92/71/219319271.db2.gz	VMSZQHJEPVIJKC-SNVBAGLBSA-N	0	0	359.224	2.653	50	5		FFBARN
CC1=C(C(=O)OCc2ccccc2)[C@@H](c2cccc([N+](=O)[O-])c2)NC(=O)N1	ZINC000000820536	219325542	/nfs/dbraw/zinc/32/55/42/219325542.db2.gz	KOFRKMPTJWTECN-QGZVFWFLSA-N	0	0	367.361	2.966	50	5		FFBARN
COc1cc([N+](=O)[O-])cc2cc(C(=O)NCc3ccccc3)c(=O)oc21	ZINC000000789079	219321809	/nfs/dbraw/zinc/32/18/09/219321809.db2.gz	NHTZPUMNFXWBAK-UHFFFAOYSA-N	0	0	354.318	2.640	50	5		FFBARN
NC(=O)c1c(NC(=O)Cc2ccc([N+](=O)[O-])cc2)sc2c1CCCC2	ZINC000000799354	219322692	/nfs/dbraw/zinc/32/26/92/219322692.db2.gz	MMBDOZYLAJKSRI-UHFFFAOYSA-N	0	0	359.407	2.815	50	5		FFBARN
Cc1cc(C)n(C(=O)[C@@H](C)n2nc([N+](=O)[O-])c(Br)c2C)n1	ZINC000001070880	219364367	/nfs/dbraw/zinc/36/43/67/219364367.db2.gz	SPOUKAGICWHNJR-SECBINFHSA-N	0	0	356.180	2.577	50	5		FFBARN
CCC1(C)CN(c2ccc([N+](=O)[O-])cc2S(=O)(=O)N2CCCC2)C1	ZINC000241515521	222919052	/nfs/dbraw/zinc/91/90/52/222919052.db2.gz	OFYYRYQDDJJITA-UHFFFAOYSA-N	0	0	353.444	2.616	50	5		FFBARN
CC(C)c1ccc(NC(=O)CN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)cc1	ZINC000003598603	219521502	/nfs/dbraw/zinc/52/15/02/219521502.db2.gz	PRGWNJNUTDPBHW-UHFFFAOYSA-N	0	0	367.361	2.953	50	5		FFBARN
CC(C)OC(=O)c1ccc2c(c1)C(=O)N(c1ccc([N+](=O)[O-])cc1)C2=O	ZINC000004084445	219540427	/nfs/dbraw/zinc/54/04/27/219540427.db2.gz	OHJKTKPYJMTDKU-UHFFFAOYSA-N	0	0	354.318	2.961	50	5		FFBARN
O=[N+]([O-])c1cc(N[C@@H]2C[C@H](O)[C@H](O)CO2)cc(Sc2ccccc2)c1	ZINC000004571265	219587564	/nfs/dbraw/zinc/58/75/64/219587564.db2.gz	AQFSCHZBYWUHCK-BBWFWOEESA-N	0	0	362.407	2.626	50	5	biogenic,in-vitro	FFBARN
CN1C2=C(C(=O)N(c3ccccc3)C2)[C@@H](c2cccc([N+](=O)[O-])c2)NC1=O	ZINC000004727978	219601280	/nfs/dbraw/zinc/60/12/80/219601280.db2.gz	CPFFQGYMPDMGJD-QGZVFWFLSA-N	0	0	364.361	2.592	50	5		FFBARN
O=[N+]([O-])c1cc2c(cc1CN1CCN(Cc3ccccc3)CC1)OCO2	ZINC000004978708	219633387	/nfs/dbraw/zinc/63/33/87/219633387.db2.gz	PVVKLIZOBXBTER-UHFFFAOYSA-N	0	0	355.394	2.641	50	5		FFBARN
O=C(Nc1ccc(F)c(F)c1F)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000009154498	219875155	/nfs/dbraw/zinc/87/51/55/219875155.db2.gz	PRFDATGGIRIZDX-UHFFFAOYSA-N	0	0	363.255	2.845	50	5		FFBARN
C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)C(=O)CCNC(=O)c1ccccc1	ZINC000015178975	220149471	/nfs/dbraw/zinc/14/94/71/220149471.db2.gz	RMTCALJDOSLXRR-AWEZNQCLSA-N	0	0	355.394	2.934	50	5		FFBARN
COCCNc1ccc(C(=O)N2CCc3ccccc3C2)cc1[N+](=O)[O-]	ZINC000015627429	220158087	/nfs/dbraw/zinc/15/80/87/220158087.db2.gz	AOPWKWURZTUPNV-UHFFFAOYSA-N	0	0	355.394	2.852	50	5		FFBARN
CCCCN(C)C(=O)C1CCN(Cn2ncc3cc([N+](=O)[O-])ccc32)CC1	ZINC000048273903	221004204	/nfs/dbraw/zinc/00/42/04/221004204.db2.gz	FZSBXZBIHQEZEG-UHFFFAOYSA-N	0	0	373.457	2.873	50	5		FFBARN
O=C(NCc1ccc2c(c1)OCO2)c1cccn2c(=O)c3ccccc3nc12	ZINC000051317268	221034524	/nfs/dbraw/zinc/03/45/24/221034524.db2.gz	UVTCYGJCKZZKED-UHFFFAOYSA-N	0	0	373.368	2.506	50	5		FFBARN
Cc1cccc(C(=O)N2CCN(CCc3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000053666662	221047675	/nfs/dbraw/zinc/04/76/75/221047675.db2.gz	FIWCPNHOEOMYNC-UHFFFAOYSA-N	0	0	353.422	2.904	50	5		FFBARN
COC(=O)c1cc(C(=O)N(C)c2ccc(F)c(F)c2)cc([N+](=O)[O-])c1	ZINC000056226180	221079113	/nfs/dbraw/zinc/07/91/13/221079113.db2.gz	CGAHKCWTJCVCPW-UHFFFAOYSA-N	0	0	350.277	2.936	50	5		FFBARN
CCOC(=O)c1[nH]c2ccc([N+](=O)[O-])cc2c1I	ZINC000063110824	221142560	/nfs/dbraw/zinc/14/25/60/221142560.db2.gz	ZKUXGUWRSZESPV-UHFFFAOYSA-N	0	0	360.107	2.857	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCCc1c[nH]c2ccccc12	ZINC000072236006	221451964	/nfs/dbraw/zinc/45/19/64/221451964.db2.gz	XJCZRJJQLGJFNZ-UHFFFAOYSA-N	0	0	359.407	2.906	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCC(n3cncn3)CC2)c(Br)c1	ZINC000084351033	132198803	/nfs/dbraw/zinc/19/88/03/132198803.db2.gz	MMWPUODFNJACMI-UHFFFAOYSA-N	0	0	352.192	2.790	50	5		FFBARN
CC(C)Oc1cccc(C(=O)N2CCN(c3cccc([N+](=O)[O-])c3)CC2)n1	ZINC000169031085	132261591	/nfs/dbraw/zinc/26/15/91/132261591.db2.gz	XHOBRDVNKLHWPQ-UHFFFAOYSA-N	0	0	370.409	2.739	50	5		FFBARN
CNc1cc(N2CCN(C(=O)Cc3ccccc3)CC2)ccc1[N+](=O)[O-]	ZINC000004703642	132824069	/nfs/dbraw/zinc/82/40/69/132824069.db2.gz	FXJQDQGHDFGLAM-UHFFFAOYSA-N	0	0	354.410	2.528	50	5		FFBARN
C[C@@H](NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccs1	ZINC000012641004	132861935	/nfs/dbraw/zinc/86/19/35/132861935.db2.gz	HXAUYUDOXCNCQJ-GFCCVEGCSA-N	0	0	361.423	2.984	50	5		FFBARN
C[C@@H]1CC[C@@H](C(N)=O)CN1c1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-]	ZINC000042739826	136121349	/nfs/dbraw/zinc/12/13/49/136121349.db2.gz	CJKMKSPUALZAPQ-CZUORRHYSA-N	0	0	367.405	2.916	50	5		FFBARN
O=[N+]([O-])c1cccnc1NCc1ccc(N2CCCC[C@H]2CCO)nc1	ZINC000047253880	136122754	/nfs/dbraw/zinc/12/27/54/136122754.db2.gz	KOWVYTZJOIKDRE-HNNXBMFYSA-N	0	0	357.414	2.738	50	5		FFBARN
CCOC(=O)C1=C(C)NC(C)=C(C(=O)OC)[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000100103788	222235714	/nfs/dbraw/zinc/23/57/14/222235714.db2.gz	OUYHHVXCWZAPMH-INIZCTEOSA-N	0	0	360.366	2.566	50	5		FFBARN
Cc1ccc(N2C(=O)[C@H]3ON=C(c4ccc([N+](=O)[O-])cc4)C3=C2O)c(C)c1	ZINC000100886691	222256913	/nfs/dbraw/zinc/25/69/13/222256913.db2.gz	PEODFDAIUIXEHI-WBVHZDCISA-N	0	0	365.345	2.504	50	5		FFBARN
CC1=C(C(=O)O[C@@H]2CCC[C@@H]2C)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000101106474	222262302	/nfs/dbraw/zinc/26/23/02/222262302.db2.gz	BQRURLIZQQYDGS-JJMVLAAESA-N	0	0	359.382	2.955	50	5		FFBARN
Cc1noc(-c2ccccc2OCC(=O)Nc2ccccc2[N+](=O)[O-])n1	ZINC000008586921	263356758	/nfs/dbraw/zinc/35/67/58/263356758.db2.gz	UJDNSYJRSZUSIP-UHFFFAOYSA-N	0	0	354.322	2.971	50	5		FFBARN
Cc1sc(C(=O)N2CCN(C(=O)c3ccc(C)cc3)CC2)cc1[N+](=O)[O-]	ZINC000032357778	506244646	/nfs/dbraw/zinc/24/46/46/506244646.db2.gz	BFUONOQPINHPAB-UHFFFAOYSA-N	0	0	373.434	2.871	50	5		FFBARN
COCCCn1c2nc3ccccc3nc2c2c1ncn(CC(C)C)c2=O	ZINC000002251766	506276337	/nfs/dbraw/zinc/27/63/37/506276337.db2.gz	CEVXOFMZRXVAMK-UHFFFAOYSA-N	0	0	365.437	2.987	50	5		FFBARN
O=C(OCc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccc2c(c1)OCO2	ZINC000002660310	506287058	/nfs/dbraw/zinc/28/70/58/506287058.db2.gz	ZPUACVNQUKNVKJ-UHFFFAOYSA-N	0	0	359.290	2.547	50	5		FFBARN
O=C(NC[C@@H](c1ccccc1)N1CCOCC1)Nc1ccccc1[N+](=O)[O-]	ZINC000032779501	506295692	/nfs/dbraw/zinc/29/56/92/506295692.db2.gz	VDZZRAIYNHEZEC-SFHVURJKSA-N	0	0	370.409	2.790	50	5		FFBARN
O=[N+]([O-])c1ccc(S(=O)(=O)NCCOc2ccccc2Cl)cc1	ZINC000002870082	506298698	/nfs/dbraw/zinc/29/86/98/506298698.db2.gz	DAPUUGKSAKUHTL-UHFFFAOYSA-N	0	0	356.787	2.606	50	5		FFBARN
COCCn1c(C)c(C)nc1SCC(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000032893937	506307819	/nfs/dbraw/zinc/30/78/19/506307819.db2.gz	DYDGNEUUBCDNPW-UHFFFAOYSA-N	0	0	364.427	2.785	50	5		FFBARN
CC(C)c1ccc(NC(=O)CN2C(=O)c3ccc([N+](=O)[O-])cc3C2=O)cc1	ZINC000003245293	506314733	/nfs/dbraw/zinc/31/47/33/506314733.db2.gz	JXKSFXLBAWVROT-UHFFFAOYSA-N	0	0	367.361	2.953	50	5		FFBARN
CN(C)[C@H](CNc1ccc(S(C)(=O)=O)cc1[N+](=O)[O-])c1cccs1	ZINC000033012142	506325060	/nfs/dbraw/zinc/32/50/60/506325060.db2.gz	SMOAPABBSQMGMS-CQSZACIVSA-N	0	0	369.468	2.775	50	5		FFBARN
Cc1c(C(=O)O[C@@H](C)C(=O)Nc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-]	ZINC000003444344	506331138	/nfs/dbraw/zinc/33/11/38/506331138.db2.gz	BYIJPDZLRANBQP-NSHDSACASA-N	0	0	372.333	2.816	50	5		FFBARN
Cc1ccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)cc1-n1cnnn1	ZINC000033082015	506334795	/nfs/dbraw/zinc/33/47/95/506334795.db2.gz	BWISWZKADDQIAC-SOFGYWHQSA-N	0	0	350.338	2.531	50	5		FFBARN
O=C(/C=C/c1cccc([N+](=O)[O-])c1)NCCc1ccc2c(c1)OCCO2	ZINC000003560272	506343332	/nfs/dbraw/zinc/34/33/32/506343332.db2.gz	WMTVBDBTRWWWMF-FNORWQNLSA-N	0	0	354.362	2.738	50	5		FFBARN
COC(=O)c1cccc([N+](=O)[O-])c1-c1c(C(=O)OC)cccc1[N+](=O)[O-]	ZINC000003844129	506349380	/nfs/dbraw/zinc/34/93/80/506349380.db2.gz	VWKXXMPVBIQLRJ-UHFFFAOYSA-N	0	0	360.278	2.743	50	5		FFBARN
O=C1N[C@]2(CCCc3ccccc32)C(=O)N1Cc1cccc([N+](=O)[O-])c1	ZINC000003600577	506346745	/nfs/dbraw/zinc/34/67/45/506346745.db2.gz	JVSRRVCVRQPUBJ-IBGZPJMESA-N	0	0	351.362	2.878	50	5		FFBARN
COC(=O)C[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])N1CCC(C)CC1	ZINC000004653663	506387023	/nfs/dbraw/zinc/38/70/23/506387023.db2.gz	QCFINVNXBNIQLN-INIZCTEOSA-N	0	0	363.414	2.505	50	5		FFBARN
CCOC(=O)C1CCN(C(=O)CSCc2ccc([N+](=O)[O-])cc2)CC1	ZINC000004872598	506402165	/nfs/dbraw/zinc/40/21/65/506402165.db2.gz	YKVHDLCEEPTSJS-UHFFFAOYSA-N	0	0	366.439	2.630	50	5		FFBARN
CN(C)c1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000005014613	506413807	/nfs/dbraw/zinc/41/38/07/506413807.db2.gz	IDIDSOHCHNOYBX-UHFFFAOYSA-N	0	0	354.410	2.623	50	5		FFBARN
O=C(COC(=O)c1ccccc1[N+](=O)[O-])NC12CC3CC(CC(C3)C1)C2	ZINC000005032393	506415945	/nfs/dbraw/zinc/41/59/45/506415945.db2.gz	DCKHAACMYYNWPF-UHFFFAOYSA-N	0	0	358.394	2.837	50	5		FFBARN
Cc1cc(C)cc(OCC(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000005019572	506416320	/nfs/dbraw/zinc/41/63/20/506416320.db2.gz	JABLZIFOQSQEKY-UHFFFAOYSA-N	0	0	369.421	2.939	50	5		FFBARN
CCOC(=O)[C@@H]1CCCN(C(=O)CSc2ccsc2[N+](=O)[O-])C1	ZINC000005069150	506419109	/nfs/dbraw/zinc/41/91/09/506419109.db2.gz	AGBJHLAQEOHRMC-SNVBAGLBSA-N	0	0	358.441	2.550	50	5		FFBARN
Nc1cc(N2CCN(C(=O)c3ccccc3)CC2)c(Cl)cc1[N+](=O)[O-]	ZINC000005331584	506437808	/nfs/dbraw/zinc/43/78/08/506437808.db2.gz	GLXMWURIEUYVFY-UHFFFAOYSA-N	0	0	360.801	2.793	50	5		FFBARN
CCOC(=O)C[C@H]1COc2ccccc2N1C(=O)c1cccc([N+](=O)[O-])c1	ZINC000005598222	506450246	/nfs/dbraw/zinc/45/02/46/506450246.db2.gz	JHFVDALEAIDZSI-HNNXBMFYSA-N	0	0	370.361	2.956	50	5		FFBARN
CS(=O)(=O)c1ccc(SCC(=O)Oc2ccccc2)c([N+](=O)[O-])c1	ZINC000006174216	506469486	/nfs/dbraw/zinc/46/94/86/506469486.db2.gz	ICRUBRPYPCBACF-UHFFFAOYSA-N	0	0	367.404	2.696	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])N1CCNC(=O)C[C@@H]1c1ccccc1	ZINC000040149956	506474365	/nfs/dbraw/zinc/47/43/65/506474365.db2.gz	ATJWHVPFADMVRU-MRXNPFEDSA-N	0	0	354.366	2.690	50	5		FFBARN
CC(C)NS(=O)(=O)c1ccc(NCCCOC(C)C)c([N+](=O)[O-])c1	ZINC000006507656	506486367	/nfs/dbraw/zinc/48/63/67/506486367.db2.gz	LFCLKILMWLKYKH-UHFFFAOYSA-N	0	0	359.448	2.509	50	5		FFBARN
CNc1ccc(C(=O)OCC(=O)Nc2cccc(C(C)=O)c2)cc1[N+](=O)[O-]	ZINC000006790107	506507008	/nfs/dbraw/zinc/50/70/08/506507008.db2.gz	HZHSYXCPBZRANY-UHFFFAOYSA-N	0	0	371.349	2.635	50	5		FFBARN
C[C@@H](OC(=O)C1C[C@H]2CCC[C@@H](C1)C2=O)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000007784116	506590133	/nfs/dbraw/zinc/59/01/33/506590133.db2.gz	AMEFUNNWFTYMKL-HABKJSAYSA-N	0	0	374.393	2.860	50	5		FFBARN
COc1ccc(S(=O)(=O)NCc2cccc(Cl)c2)cc1[N+](=O)[O-]	ZINC000007778370	506590139	/nfs/dbraw/zinc/59/01/39/506590139.db2.gz	QGJYBZZKHCUQPG-UHFFFAOYSA-N	0	0	356.787	2.735	50	5		FFBARN
COC(=O)c1cc(CNc2nc3sccn3c2[N+](=O)[O-])ccc1OC	ZINC000008318441	506642225	/nfs/dbraw/zinc/64/22/25/506642225.db2.gz	XIBUNGHKDBFECA-UHFFFAOYSA-N	0	0	362.367	2.711	50	5		FFBARN
C[C@@]1(c2ccc([N+](=O)[O-])cc2)NC(=O)N(CCOc2ccccc2F)C1=O	ZINC000008646114	506660810	/nfs/dbraw/zinc/66/08/10/506660810.db2.gz	ZKVMERISSMCANS-SFHVURJKSA-N	0	0	373.340	2.580	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)Nc3cccc([N+](=O)[O-])c3C)CC2=O)cc1	ZINC000008816494	506671209	/nfs/dbraw/zinc/67/12/09/506671209.db2.gz	KEWATXXRMVKPEP-CYBMUJFWSA-N	0	0	369.377	2.903	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c1C	ZINC000008921587	506672790	/nfs/dbraw/zinc/67/27/90/506672790.db2.gz	RQOOBGLPDWWFAC-UHFFFAOYSA-N	0	0	374.349	2.674	50	5		FFBARN
CNc1ccc([N+](=O)[O-])cc1C(=O)NCC(=O)Nc1c(C)cccc1C	ZINC000009337367	506691088	/nfs/dbraw/zinc/69/10/88/506691088.db2.gz	YKWFVEUQGITEPR-UHFFFAOYSA-N	0	0	356.382	2.622	50	5		FFBARN
Cc1ccc(C(=O)NCC(=O)N[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-]	ZINC000009388995	506694895	/nfs/dbraw/zinc/69/48/95/506694895.db2.gz	VDSGMMJOCAORRZ-KRWDZBQOSA-N	0	0	367.405	2.827	50	5		FFBARN
O=C(COc1ccc([N+](=O)[O-])cc1-c1cccs1)NC[C@H]1CCCO1	ZINC000009603118	506705613	/nfs/dbraw/zinc/70/56/13/506705613.db2.gz	JKIANHCSZVQKCX-CYBMUJFWSA-N	0	0	362.407	2.997	50	5		FFBARN
O=C(CSc1nnc(-c2ccncc2)o1)Nc1ccc([N+](=O)[O-])cc1	ZINC000010188222	506730163	/nfs/dbraw/zinc/73/01/63/506730163.db2.gz	GOILBZJHZFLHDT-UHFFFAOYSA-N	0	0	357.351	2.771	50	5		FFBARN
Cc1c(C(=O)Nc2ccc(-c3ccc(=O)n(C)n3)cc2)cccc1[N+](=O)[O-]	ZINC000010325259	506736961	/nfs/dbraw/zinc/73/69/61/506736961.db2.gz	IAYXUCSBBXRJEK-UHFFFAOYSA-N	0	0	364.361	2.916	50	5		FFBARN
COc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C(=O)N(C)C)ccc2C)c1	ZINC000067548778	506922329	/nfs/dbraw/zinc/92/23/29/506922329.db2.gz	GCVQOCIACOEVGE-UHFFFAOYSA-N	0	0	357.366	2.866	50	5		FFBARN
Cc1cccc(C(=O)NCc2ccc(CN3CCOCC3)cc2)c1[N+](=O)[O-]	ZINC000023731610	507369142	/nfs/dbraw/zinc/36/91/42/507369142.db2.gz	NVYIAHIEIMKEKB-UHFFFAOYSA-N	0	0	369.421	2.665	50	5		FFBARN
O=C(COC(=O)c1cc(Cl)ccc1O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000024170831	507397352	/nfs/dbraw/zinc/39/73/52/507397352.db2.gz	BOYIBCHGHXLXTO-UHFFFAOYSA-N	0	0	368.704	2.888	50	5		FFBARN
Cc1cccc(NC(=O)NCC(=O)N(C)Cc2ccccc2[N+](=O)[O-])c1	ZINC000025007177	507459060	/nfs/dbraw/zinc/45/90/60/507459060.db2.gz	UPCUQYKXIOAYFC-UHFFFAOYSA-N	0	0	356.382	2.683	50	5		FFBARN
CN(C)[C@@H](c1nnnn1-c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-]	ZINC000025178070	507472196	/nfs/dbraw/zinc/47/21/96/507472196.db2.gz	FVWXXRBKCJYWCC-OAHLLOKOSA-N	0	0	358.789	2.875	50	5		FFBARN
O=c1[nH]cnc2cc(NC[C@H](O)c3ccc(Cl)cc3)c([N+](=O)[O-])cc12	ZINC000030860190	507813940	/nfs/dbraw/zinc/81/39/40/507813940.db2.gz	JOIVSCLAHVQNBA-HNNXBMFYSA-N	0	0	360.757	2.630	50	5		FFBARN
COc1ccc(OC)c2c1CN(CCc1ccc([N+](=O)[O-])cc1)C[C@H]2O	ZINC000052561537	507813996	/nfs/dbraw/zinc/81/39/96/507813996.db2.gz	AIAGFMJWJZZASO-MRXNPFEDSA-N	0	0	358.394	2.704	50	5		FFBARN
C[C@@]1(c2cccnc2)NC(=O)N(Cc2ccc(Cl)c([N+](=O)[O-])c2)C1=O	ZINC000079107329	507933909	/nfs/dbraw/zinc/93/39/09/507933909.db2.gz	QTFLHBBJVOPIDW-INIZCTEOSA-N	0	0	360.757	2.610	50	5		FFBARN
O=C(C1CCCCC1)N1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1	ZINC000075107671	508083541	/nfs/dbraw/zinc/08/35/41/508083541.db2.gz	XUJZYMXAKWYMAX-UHFFFAOYSA-N	0	0	372.425	2.961	50	5		FFBARN
COC(=O)[C@H](NC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccc(O)c1	ZINC000095451199	508185943	/nfs/dbraw/zinc/18/59/43/508185943.db2.gz	KAJUUWKRALPGOD-CQSZACIVSA-N	0	0	364.741	2.598	50	5		FFBARN
Cc1ccc(OCC(=O)N2CCN(Cc3cccc([N+](=O)[O-])c3)CC2)cc1	ZINC000019789402	525379881	/nfs/dbraw/zinc/37/98/81/525379881.db2.gz	JFCMVSHSEPODEA-UHFFFAOYSA-N	0	0	369.421	2.626	50	5		FFBARN
CCC(=O)N1CCN(c2cc(N3CCCCC3)c(F)cc2[N+](=O)[O-])CC1	ZINC000003894057	535308239	/nfs/dbraw/zinc/30/82/39/535308239.db2.gz	QPFFUOYDTULCKV-UHFFFAOYSA-N	0	0	364.421	2.783	50	5		FFBARN
Cc1c(CS(=O)(=O)CC(=O)N[C@H]2CCCC[C@@H]2C)cccc1[N+](=O)[O-]	ZINC000048718151	570959045	/nfs/dbraw/zinc/95/90/45/570959045.db2.gz	JYPFLKWDNVGMHW-WFASDCNBSA-N	0	0	368.455	2.513	50	5		FFBARN
COc1ccc(C(=O)N2N=C(C)C[C@]2(O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000000711081	219316015	/nfs/dbraw/zinc/31/60/15/219316015.db2.gz	RFMNLAUYZCITQV-SFHVURJKSA-N	0	0	355.350	2.671	50	5		FFBARN
COc1cccc([C@H]2c3c(c4ccccc4oc3=O)OC(N)=C2[N+](=O)[O-])c1	ZINC000000716293	219316420	/nfs/dbraw/zinc/31/64/20/219316420.db2.gz	SJLQZJOQJWFCNE-AWEZNQCLSA-N	0	0	366.329	2.730	50	5	biogenic	FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccccc2[N+](=O)[O-])NC(=O)N1	ZINC000000956668	219346663	/nfs/dbraw/zinc/34/66/63/219346663.db2.gz	KIPYWUZZUCRLHD-INIZCTEOSA-N	0	0	352.350	2.861	50	5		FFBARN
O=C(NC[C@@H]1CCCO1)c1ccc(NC(=O)c2cccc([N+](=O)[O-])c2)cc1	ZINC000001115110	219372052	/nfs/dbraw/zinc/37/20/52/219372052.db2.gz	ANXRXBJOHOQQPE-KRWDZBQOSA-N	0	0	369.377	2.756	50	5		FFBARN
O=C(Nc1ccc2c(c1)OCO2)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000002761522	219462460	/nfs/dbraw/zinc/46/24/60/219462460.db2.gz	FHPBHPMUKCSSJB-UHFFFAOYSA-N	0	0	366.333	2.821	50	5		FFBARN
COc1ccc(CNC(=O)c2ccccc2Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000002796325	219466079	/nfs/dbraw/zinc/46/60/79/219466079.db2.gz	DEXQUEGUCSOGPR-UHFFFAOYSA-N	0	0	366.377	2.778	50	5		FFBARN
COC(=O)c1ccc(SCC(=O)NCc2ccccc2)c([N+](=O)[O-])c1	ZINC000003032016	219483521	/nfs/dbraw/zinc/48/35/21/219483521.db2.gz	OEBOCDGPJZNEGH-UHFFFAOYSA-N	0	0	360.391	2.790	50	5		FFBARN
COc1ccc(-c2n[nH]c3c2[C@@H](c2cccc([N+](=O)[O-])c2)NC3=O)cc1	ZINC000004929065	219625189	/nfs/dbraw/zinc/62/51/89/219625189.db2.gz	PISQTRPMTCIXLO-OAHLLOKOSA-N	0	0	350.334	2.826	50	5		FFBARN
COc1cccc([C@H](NC(=O)c2cccc([N+](=O)[O-])c2)c2nccn2C)c1	ZINC000008719933	219867559	/nfs/dbraw/zinc/86/75/59/219867559.db2.gz	UMQOUODXEOYPFC-KRWDZBQOSA-N	0	0	366.377	2.856	50	5		FFBARN
COc1ccc(-c2nonc2NC(=O)COc2ccc([N+](=O)[O-])cc2)cc1	ZINC000008916341	219871587	/nfs/dbraw/zinc/87/15/87/219871587.db2.gz	OVWOUEQEKORRNZ-UHFFFAOYSA-N	0	0	370.321	2.671	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CN1C(=O)N[C@@](C)(c2ccc(C)cc2)C1=O	ZINC000009585680	219883306	/nfs/dbraw/zinc/88/33/06/219883306.db2.gz	XZYXGSPMEYZVQA-IBGZPJMESA-N	0	0	369.377	2.879	50	5		FFBARN
CN(C)c1ccc(C(=O)/N=c2/sc3cc([N+](=O)[O-])ccc3n2C)cc1	ZINC000011666974	219925080	/nfs/dbraw/zinc/92/50/80/219925080.db2.gz	GQHFKFJCGARCST-ISLYRVAYSA-N	0	0	356.407	2.955	50	5		FFBARN
Cc1cc(C(=O)NC[C@@H](c2ccccc2)N2CCOCC2)ccc1[N+](=O)[O-]	ZINC000013012393	220053717	/nfs/dbraw/zinc/05/37/17/220053717.db2.gz	LBQHNOACDHSBFA-IBGZPJMESA-N	0	0	369.421	2.707	50	5		FFBARN
Cc1nn(Cc2nnc(-c3ccc(Br)o3)o2)c(C)c1[N+](=O)[O-]	ZINC000013985206	220100444	/nfs/dbraw/zinc/10/04/44/220100444.db2.gz	RALUKKYQPHGWOC-UHFFFAOYSA-N	0	0	368.147	2.862	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)N1CCN(Cc2ccccc2)CC1	ZINC000019801769	220298650	/nfs/dbraw/zinc/29/86/50/220298650.db2.gz	SBAHYSSAAWFZNI-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
Nc1ccc(C(=O)N2CC=C(c3c[nH]c4ncccc34)CC2)cc1[N+](=O)[O-]	ZINC000032795916	220681106	/nfs/dbraw/zinc/68/11/06/220681106.db2.gz	ZJCOZXPYACOVTR-UHFFFAOYSA-N	0	0	363.377	2.983	50	5		FFBARN
CC[C@H]1CCCCN1C(=O)CS(=O)(=O)Cc1cccc([N+](=O)[O-])c1C	ZINC000048716801	221014654	/nfs/dbraw/zinc/01/46/54/221014654.db2.gz	RNSPYONRMNZAGF-HNNXBMFYSA-N	0	0	368.455	2.609	50	5		FFBARN
CS(=O)(=O)c1ccc(SC[C@H](O)c2ccccc2)c([N+](=O)[O-])c1	ZINC000052427077	221038063	/nfs/dbraw/zinc/03/80/63/221038063.db2.gz	YYNSPUXYKXKGGB-AWEZNQCLSA-N	0	0	353.421	2.824	50	5		FFBARN
COc1ccccc1C1(CNc2c([N+](=O)[O-])c(C)nn2C)CCOCC1	ZINC000057150127	221083809	/nfs/dbraw/zinc/08/38/09/221083809.db2.gz	OOYNSKWDEXVJLV-UHFFFAOYSA-N	0	0	360.414	2.806	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)COc1ccc([N+](=O)[O-])cc1F	ZINC000059012092	221123985	/nfs/dbraw/zinc/12/39/85/221123985.db2.gz	LYVWCYFYFXHVHV-NSHDSACASA-N	0	0	373.340	2.877	50	5		FFBARN
O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NC[C@H]1COc2ccccc2O1	ZINC000058357583	221115623	/nfs/dbraw/zinc/11/56/23/221115623.db2.gz	WUWAPXAHYCZGNV-HNNXBMFYSA-N	0	0	367.361	2.506	50	5		FFBARN
COC(=O)[C@@H]1C[C@H]2CCCC[C@@H]2N1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000062580910	221140551	/nfs/dbraw/zinc/14/05/51/221140551.db2.gz	BRTBDCZMCJQSEH-PVUWLOKVSA-N	0	0	358.398	2.708	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(c3ccc([N+](=O)[O-])cc3[N+](=O)[O-])CC2)cc1	ZINC000100514696	132232742	/nfs/dbraw/zinc/23/27/42/132232742.db2.gz	WVQOHYAIIJNDHE-UHFFFAOYSA-N	0	0	373.325	2.738	50	5		FFBARN
Cc1sc2nc3c4ccccc4c(N4CCOCC4)nn3c(=O)c2c1C	ZINC000000952401	132252315	/nfs/dbraw/zinc/25/23/15/132252315.db2.gz	SLKIEBZHNAITAI-UHFFFAOYSA-N	0	0	366.446	2.911	50	5		FFBARN
CCOc1ccc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000004044705	132386238	/nfs/dbraw/zinc/38/62/38/132386238.db2.gz	AZYUZEOHLIFOLL-UHFFFAOYSA-N	0	0	355.394	2.956	50	5		FFBARN
C[C@H](OCc1ccccc1)C(=O)N1CCN(c2cccc([N+](=O)[O-])c2)CC1	ZINC000048261321	136123034	/nfs/dbraw/zinc/12/30/34/136123034.db2.gz	WFRZHEHKYQCVJF-INIZCTEOSA-N	0	0	369.421	2.849	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@H]1[C@@H](O)C(F)(F)F	ZINC000084351135	221721270	/nfs/dbraw/zinc/72/12/70/221721270.db2.gz	ICVYXCARHZLITJ-WDEREUQCSA-N	0	0	352.696	2.776	50	5		FFBARN
COc1ccc(S(=O)(=O)Nc2cccc([N+](=O)[O-])c2C)cc1OC	ZINC000001120463	263142772	/nfs/dbraw/zinc/14/27/72/263142772.db2.gz	VQAHPNAXXUEGTR-UHFFFAOYSA-N	0	0	352.368	2.721	50	5		FFBARN
O=[N+]([O-])c1cc(S(=O)(=O)C(F)(F)F)ccc1NCC(F)(F)F	ZINC000004058860	263331341	/nfs/dbraw/zinc/33/13/41/263331341.db2.gz	MOKHUTYZCDPAPD-UHFFFAOYSA-N	0	0	352.212	2.863	50	5		FFBARN
O=C(COc1ccc(Br)cc1)Nc1ccc([N+](=O)[O-])cn1	ZINC000004998944	263337728	/nfs/dbraw/zinc/33/77/28/263337728.db2.gz	DQFMJNQKUOADQD-UHFFFAOYSA-N	0	0	352.144	2.770	50	5		FFBARN
Cc1ccnc(NC(=O)c2ccn(COc3ccccc3[N+](=O)[O-])n2)c1	ZINC000006789982	263346981	/nfs/dbraw/zinc/34/69/81/263346981.db2.gz	CRSLQJUIQQQCQG-UHFFFAOYSA-N	0	0	353.338	2.784	50	5		FFBARN
COc1ccc(OC)c(NC(=O)CCCn2nc(C)c([N+](=O)[O-])c2C)c1	ZINC000001432081	506262948	/nfs/dbraw/zinc/26/29/48/506262948.db2.gz	HGHOTAFSXHIFMZ-UHFFFAOYSA-N	0	0	362.386	2.844	50	5		FFBARN
Cc1c(Br)c([N+](=O)[O-])nn1CC(=O)Nc1ccccc1F	ZINC000001429834	506262954	/nfs/dbraw/zinc/26/29/54/506262954.db2.gz	FRACQPPJVOJAKE-UHFFFAOYSA-N	0	0	357.139	2.640	50	5		FFBARN
Cc1cccc(C(=O)N2CCC[C@H]2c2nnc3ccccn32)c1[N+](=O)[O-]	ZINC000032809042	506297655	/nfs/dbraw/zinc/29/76/55/506297655.db2.gz	LSUHIEGVHWQQDA-AWEZNQCLSA-N	0	0	351.366	2.923	50	5		FFBARN
COc1ccc(CNC(=O)c2cccn3c(=O)c4ccccc4nc23)cc1	ZINC000002957218	506303258	/nfs/dbraw/zinc/30/32/58/506303258.db2.gz	BZURJDOLFYWTLE-UHFFFAOYSA-N	0	0	359.385	2.786	50	5		FFBARN
COc1ccccc1/C=C1/N=C(c2cc([N+](=O)[O-])ccc2OC)OC1=O	ZINC000002941848	506303588	/nfs/dbraw/zinc/30/35/88/506303588.db2.gz	VHKMIDRRHDNOJR-NTEUORMPSA-N	0	0	354.318	2.957	50	5		FFBARN
CC(=O)Nc1ccc(S(=O)(=O)Oc2ccc(C)cc2[N+](=O)[O-])cc1	ZINC000003131816	506311271	/nfs/dbraw/zinc/31/12/71/506311271.db2.gz	GKJAVKYPUCNKAQ-UHFFFAOYSA-N	0	0	350.352	2.629	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)c1cccs1	ZINC000003247210	506315265	/nfs/dbraw/zinc/31/52/65/506315265.db2.gz	RPQOZNUNJVDZQN-VIFPVBQESA-N	0	0	350.352	2.849	50	5		FFBARN
O=C(CSc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)Nc1nccs1	ZINC000033004122	506323620	/nfs/dbraw/zinc/32/36/20/506323620.db2.gz	UPZYSFFUEYBBQA-UHFFFAOYSA-N	0	0	363.380	2.832	50	5		FFBARN
Cc1c(C(=O)O[C@H](C)C(=O)Nc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-]	ZINC000003444346	506330974	/nfs/dbraw/zinc/33/09/74/506330974.db2.gz	BYIJPDZLRANBQP-LLVKDONJSA-N	0	0	372.333	2.816	50	5		FFBARN
COC(=O)[C@@H]1Cc2c3ccccc3[nH]c2[C@@H](c2ccc([N+](=O)[O-])cc2)N1	ZINC000034792224	506370818	/nfs/dbraw/zinc/37/08/18/506370818.db2.gz	PMTFLAWFQMHLPS-DLBZAZTESA-N	0	0	351.362	2.853	50	5		FFBARN
CCCCN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCS(=O)(=O)C1	ZINC000004504731	506379212	/nfs/dbraw/zinc/37/92/12/506379212.db2.gz	HXZZPKLZSWGFKM-GFCCVEGCSA-N	0	0	374.846	2.678	50	5		FFBARN
COc1ccc(C(=O)NC(=S)Nc2ccc([N+](=O)[O-])cc2OC)cc1	ZINC000004547809	506381294	/nfs/dbraw/zinc/38/12/94/506381294.db2.gz	PZKNOFLTFPAVAU-UHFFFAOYSA-N	0	0	361.379	2.739	50	5		FFBARN
O=C(/N=S(\c1ccc([N+](=O)[O-])cc1)N1CCOCC1)c1ccccc1	ZINC000004566432	506382900	/nfs/dbraw/zinc/38/29/00/506382900.db2.gz	DSIPGUFAZKKWDE-UHFFFAOYSA-N	0	0	359.407	2.843	50	5		FFBARN
COc1ccc(N2C[C@H](C(=O)Nc3cc([N+](=O)[O-])ccc3C)CC2=O)cc1	ZINC000004810651	506395393	/nfs/dbraw/zinc/39/53/93/506395393.db2.gz	VHACDOGHTZMDTR-CYBMUJFWSA-N	0	0	369.377	2.903	50	5		FFBARN
O=C(c1ccc(F)c(F)c1)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000004819017	506396610	/nfs/dbraw/zinc/39/66/10/506396610.db2.gz	XDMBTRVEOYZCLL-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
CCC(=O)Nc1ccccc1C(=O)OCC(=O)c1cccc([N+](=O)[O-])c1	ZINC000004865426	506401359	/nfs/dbraw/zinc/40/13/59/506401359.db2.gz	BIFBLDNMPJYXFG-UHFFFAOYSA-N	0	0	356.334	2.983	50	5		FFBARN
COC(=O)c1c(C)[nH]c(C(=O)[C@H](C)Oc2ccc(C)nc2[N+](=O)[O-])c1C	ZINC000004892280	506402149	/nfs/dbraw/zinc/40/21/49/506402149.db2.gz	PDWXFNJCERRSAF-NSHDSACASA-N	0	0	361.354	2.680	50	5		FFBARN
COc1cc(OC)cc(C(=O)N2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000004901135	506404599	/nfs/dbraw/zinc/40/45/99/506404599.db2.gz	USKUPAZOICTJRU-UHFFFAOYSA-N	0	0	371.393	2.574	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)[C@H](C)OC(=O)/C=C/c1ccco1	ZINC000004966350	506409973	/nfs/dbraw/zinc/40/99/73/506409973.db2.gz	OPMXSIXCOQQFQO-IOCXFXADSA-N	0	0	360.322	2.780	50	5		FFBARN
Cc1[nH]c2ccccc2c1[C@]1(O)c2cc([N+](=O)[O-])cc(C)c2N(C)C1=O	ZINC000005059935	506419804	/nfs/dbraw/zinc/41/98/04/506419804.db2.gz	XVOZWWNOGCQLKX-LJQANCHMSA-N	0	0	351.362	2.905	50	5		FFBARN
COc1ccc(OC)c(-c2ccc(=O)n(Cc3ccc([N+](=O)[O-])cc3)n2)c1	ZINC000005409630	506441388	/nfs/dbraw/zinc/44/13/88/506441388.db2.gz	NQVFDHOZKZSTJC-UHFFFAOYSA-N	0	0	367.361	2.884	50	5		FFBARN
Cc1nn(CCC2N=NC(=S)N2Cc2ccccc2)c(C)c1[N+](=O)[O-]	ZINC000005433625	506442801	/nfs/dbraw/zinc/44/28/01/506442801.db2.gz	OMSNSKWKSRBRAT-UHFFFAOYSA-N	0	0	358.427	2.579	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)Cc1ccc(-n2cccn2)cc1	ZINC000040130833	506471922	/nfs/dbraw/zinc/47/19/22/506471922.db2.gz	MQRVMUYRQNHENH-UHFFFAOYSA-N	0	0	352.350	2.970	50	5		FFBARN
O=C(CCNC(=O)c1ccc([N+](=O)[O-])cc1)N[C@H]1CCCc2ccccc21	ZINC000006231905	506473202	/nfs/dbraw/zinc/47/32/02/506473202.db2.gz	JANOUNNGYZQEKN-SFHVURJKSA-N	0	0	367.405	2.909	50	5		FFBARN
Cc1nc(-c2cccc(NS(=O)(=O)c3ccc(C)c([N+](=O)[O-])c3)c2)n[nH]1	ZINC000040152672	506475240	/nfs/dbraw/zinc/47/52/40/506475240.db2.gz	BQPWAVKSDSMLCD-UHFFFAOYSA-N	0	0	373.394	2.798	50	5		FFBARN
COc1ccc(N2C(=O)C[C@@H](Nc3cc(C)ccc3C)C2=O)c([N+](=O)[O-])c1	ZINC000006331528	506477935	/nfs/dbraw/zinc/47/79/35/506477935.db2.gz	XEDUUWVZSSPUND-OAHLLOKOSA-N	0	0	369.377	2.964	50	5		FFBARN
COC(=O)c1ccc(O[C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2OC)cc1	ZINC000006404814	506480522	/nfs/dbraw/zinc/48/05/22/506480522.db2.gz	MMHARGKHJJNSDN-LLVKDONJSA-N	0	0	374.349	2.796	50	5		FFBARN
CNS(=O)(=O)c1ccc(N(C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1	ZINC000042619965	506642320	/nfs/dbraw/zinc/64/23/20/506642320.db2.gz	QMSYZEJNNJEYSO-OAHLLOKOSA-N	0	0	361.423	2.627	50	5		FFBARN
COC(=O)[C@H]1Cc2ccccc2CN1C(=O)c1ccc([N+](=O)[O-])c(C)c1	ZINC000009387400	506696073	/nfs/dbraw/zinc/69/60/73/506696073.db2.gz	CTMGTIPZTLEQTH-QGZVFWFLSA-N	0	0	354.362	2.643	50	5		FFBARN
COc1ccccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000009515912	506701717	/nfs/dbraw/zinc/70/17/17/506701717.db2.gz	KLEDRJPEPMLETR-UHFFFAOYSA-N	0	0	371.349	2.930	50	5		FFBARN
Cc1cc(NC(=O)[C@H](c2ccccc2)n2nc(C)c([N+](=O)[O-])c2C)no1	ZINC000010214884	506731881	/nfs/dbraw/zinc/73/18/81/506731881.db2.gz	UVGGINHZSMDCAF-INIZCTEOSA-N	0	0	355.354	2.933	50	5		FFBARN
COc1ccc(NC(=O)[C@]2(C)Cc3ccccc3C(=O)O2)c([N+](=O)[O-])c1	ZINC000012292949	506844379	/nfs/dbraw/zinc/84/43/79/506844379.db2.gz	HWPKHOXDOFYEDE-SFHVURJKSA-N	0	0	356.334	2.714	50	5		FFBARN
Cc1cccc(C(=O)N2CCC[C@H](C(=O)Nc3ccccn3)C2)c1[N+](=O)[O-]	ZINC000047237148	507288822	/nfs/dbraw/zinc/28/88/22/507288822.db2.gz	CZCAGSJEPUJQBI-AWEZNQCLSA-N	0	0	368.393	2.789	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CCn1c(=O)oc2ccccc21	ZINC000022862670	507317062	/nfs/dbraw/zinc/31/70/62/507317062.db2.gz	GODGDPOVIHWLHH-UHFFFAOYSA-N	0	0	357.322	2.540	50	5		FFBARN
O=[N+]([O-])c1ccc(Cl)c(S(=O)(=O)NCCOc2ccc(F)cc2)c1	ZINC000023143461	507333700	/nfs/dbraw/zinc/33/37/00/507333700.db2.gz	NBDXWITYRSBVAV-UHFFFAOYSA-N	0	0	374.777	2.745	50	5		FFBARN
CCN(Cc1ccccc1[N+](=O)[O-])C(=O)c1cccc(S(C)(=O)=O)c1	ZINC000047547676	507355207	/nfs/dbraw/zinc/35/52/07/507355207.db2.gz	WXHRCEGNQGTEGN-UHFFFAOYSA-N	0	0	362.407	2.661	50	5		FFBARN
CCCCc1oc2ccccc2c1CN(C)C(=O)Cn1cnc([N+](=O)[O-])n1	ZINC000058052604	507367332	/nfs/dbraw/zinc/36/73/32/507367332.db2.gz	FWPQQEPMXHOBAQ-UHFFFAOYSA-N	0	0	371.397	2.934	50	5		FFBARN
COc1ccc(CCNC(=O)COc2ccc(Cl)cc2[N+](=O)[O-])cc1	ZINC000025098709	507467374	/nfs/dbraw/zinc/46/73/74/507467374.db2.gz	KBUSRONNYFTGBC-UHFFFAOYSA-N	0	0	364.785	2.995	50	5		FFBARN
CC(C)(C)OC(=O)N1CCN(C(=O)c2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000072481736	507798424	/nfs/dbraw/zinc/79/84/24/507798424.db2.gz	RASQJXBIQRHSRB-UHFFFAOYSA-N	0	0	369.805	2.941	50	5		FFBARN
COc1cc(C(=O)Nc2cc(C)ncn2)c([N+](=O)[O-])cc1OC(F)F	ZINC000095401688	508184173	/nfs/dbraw/zinc/18/41/73/508184173.db2.gz	IXOXKNVJAPEGJW-UHFFFAOYSA-N	0	0	354.269	2.556	50	5		FFBARN
CCOC(=O)CCN(Cc1cccnc1)C(=O)Nc1ccc([N+](=O)[O-])cc1	ZINC000095462244	508187291	/nfs/dbraw/zinc/18/72/91/508187291.db2.gz	RYPGYBDXLNYCOL-UHFFFAOYSA-N	0	0	372.381	2.977	50	5		FFBARN
COC(=O)c1cccc(NC(=O)CN2CCCc3c([N+](=O)[O-])cccc32)c1	ZINC000089406942	522223832	/nfs/dbraw/zinc/22/38/32/522223832.db2.gz	CISCEDWYEJEFLN-UHFFFAOYSA-N	0	0	369.377	2.773	50	5		FFBARN
Cc1nnc(SCCn2cc([N+](=O)[O-])ccc2=O)n1-c1ccccc1C	ZINC000089697058	526385521	/nfs/dbraw/zinc/38/55/21/526385521.db2.gz	DJUPQDDMTBLQDX-UHFFFAOYSA-N	0	0	371.422	2.746	50	5		FFBARN
CCN(Cc1ccccc1[N+](=O)[O-])S(=O)(=O)N1C[C@H](C)C[C@H](C)C1	ZINC000047608146	570893082	/nfs/dbraw/zinc/89/30/82/570893082.db2.gz	PQITVPCOANDADM-OKILXGFUSA-N	0	0	355.460	2.639	50	5		FFBARN
Cc1cccn2cc(CNC(=O)c3cc([N+](=O)[O-])ccc3N(C)C)nc12	ZINC000078596529	571212452	/nfs/dbraw/zinc/21/24/52/571212452.db2.gz	ZWPCGWUILWIGMK-UHFFFAOYSA-N	0	0	353.382	2.547	50	5		FFBARN
COC(=O)[C@@H](Cc1ccccc1)NC(=O)/C=C/c1cccc([N+](=O)[O-])c1	ZINC000002831268	966389595	/nfs/dbraw/zinc/38/95/95/966389595.db2.gz	GQMMCGGEGLZMNF-SXSDINLZSA-N	0	0	354.362	2.509	50	5		FFBARN
CCC(=O)Nc1ccccc1C(=O)OCC(=O)c1ccc([N+](=O)[O-])cc1	ZINC000001164920	219384145	/nfs/dbraw/zinc/38/41/45/219384145.db2.gz	JWKDQMFMASXOJI-UHFFFAOYSA-N	0	0	356.334	2.983	50	5		FFBARN
CC(=O)Nc1ccc(NC(=S)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000001183983	219386400	/nfs/dbraw/zinc/38/64/00/219386400.db2.gz	ZQNFVGKGUPZBEW-UHFFFAOYSA-N	0	0	358.379	2.680	50	5		FFBARN
COCCC1(CNc2cc3c(cc2[N+](=O)[O-])n(C)c(=O)n3C)CCCC1	ZINC000225822440	222872098	/nfs/dbraw/zinc/87/20/98/222872098.db2.gz	KCEFGSRMQREQBQ-UHFFFAOYSA-N	0	0	362.430	2.794	50	5		FFBARN
O=[N+]([O-])C1(Br)CC2CC(C1)CC(Br)([N+](=O)[O-])C2	ZINC000002028673	219424099	/nfs/dbraw/zinc/42/40/99/219424099.db2.gz	QTCHKPTZWKEOEH-UHFFFAOYSA-N	0	0	372.013	2.932	50	5		FFBARN
CCc1c(C)sc2ncn3nc(Cn4nc(C)c([N+](=O)[O-])c4C)nc3c12	ZINC000002809036	219468218	/nfs/dbraw/zinc/46/82/18/219468218.db2.gz	SNXCVYUYDWMUIR-UHFFFAOYSA-N	0	0	371.426	2.980	50	5		FFBARN
C[C@@H](OC(=O)c1ccc2c(c1)OCO2)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000003237428	219493843	/nfs/dbraw/zinc/49/38/43/219493843.db2.gz	PJAOFMOGBOGEOF-SNVBAGLBSA-N	0	0	358.306	2.508	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(Cc2ccccc2)C1	ZINC000003407203	219507850	/nfs/dbraw/zinc/50/78/50/219507850.db2.gz	MWUZMCTYZYVMQS-CYBMUJFWSA-N	0	0	357.341	2.721	50	5		FFBARN
O=C1C=C(c2ccc(F)cc2)OCN1Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000004174663	219552361	/nfs/dbraw/zinc/55/23/61/219552361.db2.gz	AALGFUUJXSXHJI-UHFFFAOYSA-N	0	0	374.284	2.826	50	5		FFBARN
C[C@H]1CC(=O)Nc2ccccc2N1C(=O)CNc1ccc(F)c([N+](=O)[O-])c1	ZINC000011161010	219916818	/nfs/dbraw/zinc/91/68/18/219916818.db2.gz	PBZGYUCGDHESBK-NSHDSACASA-N	0	0	372.356	2.910	50	5		FFBARN
COc1cc(/C=C/C(=O)NC[C@H]2CCCO2)c([N+](=O)[O-])cc1OC(F)F	ZINC000012824928	220034623	/nfs/dbraw/zinc/03/46/23/220034623.db2.gz	TZXOEWRVZNDTDO-SGUJLRQBSA-N	0	0	372.324	2.513	50	5		FFBARN
C[C@@H](OC(=O)[C@@H]1COc2ccccc2C1)C(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000016293429	220182540	/nfs/dbraw/zinc/18/25/40/220182540.db2.gz	STDQQYVZASSCNS-OCCSQVGLSA-N	0	0	370.361	2.716	50	5		FFBARN
CN(Cc1nc2ccccc2c(=O)[nH]1)C(=O)c1ccc([N+](=O)[O-])cc1Cl	ZINC000018100133	220223917	/nfs/dbraw/zinc/22/39/17/220223917.db2.gz	HAOGXWHBBMVDFV-UHFFFAOYSA-N	0	0	372.768	2.757	50	5		FFBARN
COc1ccc(C(=O)CSc2n[nH]c(-c3ccco3)n2)cc1[N+](=O)[O-]	ZINC000018136938	220224682	/nfs/dbraw/zinc/22/46/82/220224682.db2.gz	NVFXBYVTLSRIRQ-UHFFFAOYSA-N	0	0	360.351	2.957	50	5		FFBARN
CC(=O)N1N=C(c2cccc([N+](=O)[O-])c2)O[C@H]1COc1cccc(C)c1	ZINC000021092377	220350612	/nfs/dbraw/zinc/35/06/12/220350612.db2.gz	GGZNDEPKFUXQAA-KRWDZBQOSA-N	0	0	355.350	2.849	50	5		FFBARN
C[C@@H](Sc1nncn1Cc1ccco1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000022193491	220378438	/nfs/dbraw/zinc/37/84/38/220378438.db2.gz	RGNKMIGKUZTKFO-LLVKDONJSA-N	0	0	373.394	2.947	50	5		FFBARN
COc1ccc(N2C(=O)/C(=C\c3ccc[nH]3)N(C)C2=S)c([N+](=O)[O-])c1	ZINC000022625675	220392110	/nfs/dbraw/zinc/39/21/10/220392110.db2.gz	KOXMKLAAXRSFBB-RIYZIHGNSA-N	0	0	358.379	2.536	50	5		FFBARN
Cc1c(Cl)cc(S(=O)(=O)N(C[C@H]2CCOC2)C2CC2)cc1[N+](=O)[O-]	ZINC000032469294	220662609	/nfs/dbraw/zinc/66/26/09/220662609.db2.gz	PHSNJNYXBAHONP-LLVKDONJSA-N	0	0	374.846	2.746	50	5		FFBARN
O=C(NCc1cn(-c2ccccc2)nc1-c1ccccc1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000048331445	221007809	/nfs/dbraw/zinc/00/78/09/221007809.db2.gz	JKLXBYNPXNNMMT-ZWKOTPCHSA-N	0	0	362.389	2.821	50	5		FFBARN
COC(=O)c1cc([N+](=O)[O-])ccc1N[C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1	ZINC000048366847	221011601	/nfs/dbraw/zinc/01/16/01/221011601.db2.gz	ZZQPMVATNKUTNW-VIFPVBQESA-N	0	0	356.338	2.724	50	5		FFBARN
Cc1c(C(=O)N[C@@H](CN2CCCC2=O)c2ccccc2)cccc1[N+](=O)[O-]	ZINC000048956394	221015674	/nfs/dbraw/zinc/01/56/74/221015674.db2.gz	OCLMRJYGNSJFLQ-KRWDZBQOSA-N	0	0	367.405	2.997	50	5		FFBARN
C[C@@H](Nc1ccc(CC(=O)N(C)C)cc1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000056171544	221078091	/nfs/dbraw/zinc/07/80/91/221078091.db2.gz	OOLORNRLAXTBMW-CYBMUJFWSA-N	0	0	370.409	2.665	50	5		FFBARN
Cc1nc(NCCCn2ccnc2)nc(NCc2ccco2)c1[N+](=O)[O-]	ZINC000056905991	221082234	/nfs/dbraw/zinc/08/22/34/221082234.db2.gz	YNTAOLHFISPDOO-UHFFFAOYSA-N	0	0	357.374	2.597	50	5		FFBARN
COCCN1C(=O)[C@@H](Oc2ccc(F)cc2)[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000058085174	221098322	/nfs/dbraw/zinc/09/83/22/221098322.db2.gz	PVHVWPYMSZGGGR-IRXDYDNUSA-N	0	0	360.341	2.711	50	5		FFBARN
COc1ccc(N(C)C(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)cn1	ZINC000058356315	221115843	/nfs/dbraw/zinc/11/58/43/221115843.db2.gz	MEGLZYSABKTJFK-UHFFFAOYSA-N	0	0	356.382	2.875	50	5		FFBARN
CC[C@H](NC(=O)Cn1cc([N+](=O)[O-])ccc1=O)C12CC3CC(CC(C3)C1)C2	ZINC000065478488	221224382	/nfs/dbraw/zinc/22/43/82/221224382.db2.gz	JLYMRUOSSURKPY-SOZFHFLDSA-N	0	0	373.453	2.868	50	5		FFBARN
Cc1ncccc1NC(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000072305552	221460530	/nfs/dbraw/zinc/46/05/30/221460530.db2.gz	GYQOYBCEHRNBQP-UHFFFAOYSA-N	0	0	356.338	2.625	50	5		FFBARN
CCCN1CCN(C(=O)c2ccc(N3CCC[C@H](C)C3)c([N+](=O)[O-])c2)CC1	ZINC000008341489	132260042	/nfs/dbraw/zinc/26/00/42/132260042.db2.gz	AVTHIVMCXVRDHM-INIZCTEOSA-N	0	0	374.485	2.999	50	5		FFBARN
NC(=O)c1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1N1CCCCC1	ZINC000002878527	132384325	/nfs/dbraw/zinc/38/43/25/132384325.db2.gz	KTUDQRFWRTURBT-UHFFFAOYSA-N	0	0	368.393	2.936	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1ccc(Cl)cc1	ZINC000100903922	222256318	/nfs/dbraw/zinc/25/63/18/222256318.db2.gz	TXQJNUPPOMOQKK-HIFRSBDPSA-N	0	0	371.736	2.541	50	5		FFBARN
O=C(N[C@H](Cn1cnc2ccccc21)c1ccc(F)cc1)[C@H]1C[C@H]1[N+](=O)[O-]	ZINC000106527182	222386076	/nfs/dbraw/zinc/38/60/76/222386076.db2.gz	NPTGIHFGCGXZJM-YXJHDRRASA-N	0	0	368.368	2.698	50	5		FFBARN
COc1ccc(C)cc1NC(=O)c1ccc(-n2cncn2)c([N+](=O)[O-])c1	ZINC000009643749	263362438	/nfs/dbraw/zinc/36/24/38/263362438.db2.gz	DUAJOCCPJIFNKC-UHFFFAOYSA-N	0	0	353.338	2.745	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)NCCCc1nc2ccccc2[nH]1	ZINC000028938286	263390442	/nfs/dbraw/zinc/39/04/42/263390442.db2.gz	FHMCCXQRIYKRTH-UHFFFAOYSA-N	0	0	354.366	2.599	50	5		FFBARN
CCOc1ccc(C(=O)NC(=S)Nc2cc(C)ccn2)cc1[N+](=O)[O-]	ZINC000001174335	506251708	/nfs/dbraw/zinc/25/17/08/506251708.db2.gz	ONLCRVHXXZVMIE-UHFFFAOYSA-N	0	0	360.395	2.824	50	5		FFBARN
COC(=O)c1ccccc1NC(=S)NC(=O)c1cccc([N+](=O)[O-])c1C	ZINC000001181264	506254025	/nfs/dbraw/zinc/25/40/25/506254025.db2.gz	VVTUNMLLUZHRFW-UHFFFAOYSA-N	0	0	373.390	2.817	50	5		FFBARN
O=C(OCc1nnc(-c2ccccc2)o1)c1cc2c(cc1[N+](=O)[O-])OCO2	ZINC000032724194	506283661	/nfs/dbraw/zinc/28/36/61/506283661.db2.gz	YXLZQVYJHFQBQU-UHFFFAOYSA-N	0	0	369.289	2.731	50	5		FFBARN
CC[C@H](C)C(=O)Nc1ncc(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)s1	ZINC000002847797	506296936	/nfs/dbraw/zinc/29/69/36/506296936.db2.gz	QKSQHYHIOGYKRK-VIFPVBQESA-N	0	0	369.424	2.869	50	5		FFBARN
Cc1ccc(SCCNS(=O)(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000002872408	506299991	/nfs/dbraw/zinc/29/99/91/506299991.db2.gz	MAKKGOWVDKTEGB-UHFFFAOYSA-N	0	0	352.437	2.974	50	5		FFBARN
CCC(CC)CN(CC(=O)OC)S(=O)(=O)c1cc([N+](=O)[O-])ccc1C	ZINC000032916525	506313369	/nfs/dbraw/zinc/31/33/69/506313369.db2.gz	HCYBVZJMTXCPCV-UHFFFAOYSA-N	0	0	372.443	2.503	50	5		FFBARN
Cc1cc(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(C)n1C[C@H]1CCCO1	ZINC000003446149	506332898	/nfs/dbraw/zinc/33/28/98/506332898.db2.gz	SOISTCMZBZSBBV-OAHLLOKOSA-N	0	0	360.414	2.888	50	5		FFBARN
Cc1noc(C)c1[C@@H]1CCCN1S(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000033086876	506334356	/nfs/dbraw/zinc/33/43/56/506334356.db2.gz	IRJNAAZVVZCTEP-AWEZNQCLSA-N	0	0	351.384	2.725	50	5		FFBARN
O=C1N[C@@]2(CCCc3ccccc32)C(=O)N1Cc1cccc([N+](=O)[O-])c1	ZINC000003600575	506346451	/nfs/dbraw/zinc/34/64/51/506346451.db2.gz	JVSRRVCVRQPUBJ-LJQANCHMSA-N	0	0	351.362	2.878	50	5		FFBARN
CN1C(=O)c2ccc(NC(=O)/C=C/c3ccc([N+](=O)[O-])s3)cc2C1=O	ZINC000004079250	506357304	/nfs/dbraw/zinc/35/73/04/506357304.db2.gz	VCDHYGXUMVUBGB-ZZXKWVIFSA-N	0	0	357.347	2.534	50	5		FFBARN
Cc1nc(N2CCOCC2)nc(Nc2ccc(F)cc2F)c1[N+](=O)[O-]	ZINC000004143213	506362810	/nfs/dbraw/zinc/36/28/10/506362810.db2.gz	YHAQZMZRZCFCBB-UHFFFAOYSA-N	0	0	351.313	2.552	50	5		FFBARN
Cc1ccc(N2C[C@H](NC(=O)c3ccccc3[N+](=O)[O-])CC2=O)cc1C	ZINC000004497021	506377666	/nfs/dbraw/zinc/37/76/66/506377666.db2.gz	UFBOURGUGADEMV-CQSZACIVSA-N	0	0	353.378	2.747	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)Cn1ccc2ccccc2c1=O	ZINC000004563220	506382973	/nfs/dbraw/zinc/38/29/73/506382973.db2.gz	GLLWBTCBVMSCQC-UHFFFAOYSA-N	0	0	353.334	2.557	50	5		FFBARN
COc1ccccc1NC(=O)c1cc([N+](=O)[O-])ccc1N1CCOCC1	ZINC000004733259	506392164	/nfs/dbraw/zinc/39/21/64/506392164.db2.gz	PBAFZRYSUKIANY-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
CCN1c2ccc([N+](=O)[O-])cc2[C@@](O)(CC(=O)c2ccc(F)cc2)C1=O	ZINC000005013646	506414363	/nfs/dbraw/zinc/41/43/63/506414363.db2.gz	XCJZWQGDTOQNQW-SFHVURJKSA-N	0	0	358.325	2.561	50	5		FFBARN
O=C(CN1C(=O)COc2ccc(Cl)cc21)Nc1ccc([N+](=O)[O-])cc1	ZINC000005027799	506416089	/nfs/dbraw/zinc/41/60/89/506416089.db2.gz	TZFLVJABSLZUAB-UHFFFAOYSA-N	0	0	361.741	2.612	50	5		FFBARN
Cc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)c([N+](=O)[O-])c1	ZINC000005042639	506417799	/nfs/dbraw/zinc/41/77/99/506417799.db2.gz	QVGDDVWSITUGIE-UHFFFAOYSA-N	0	0	370.394	2.610	50	5		FFBARN
COc1ccc(C(=O)Nc2cc(OC)c(OC)c(OC)c2)cc1[N+](=O)[O-]	ZINC000005577529	506449495	/nfs/dbraw/zinc/44/94/95/506449495.db2.gz	WSIFKKPIIVSLNR-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
Cc1nc(-c2c[nH]c(C(=O)NC[C@@H](O)c3ccc([N+](=O)[O-])cc3)c2)cs1	ZINC000040012863	506458095	/nfs/dbraw/zinc/45/80/95/506458095.db2.gz	UYKKSYIMAXUXAH-MRXNPFEDSA-N	0	0	372.406	2.818	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1NC(=O)CSc1nnc(C(C)C)[nH]1	ZINC000005862163	506459916	/nfs/dbraw/zinc/45/99/16/506459916.db2.gz	VKCKRUGCNLMNSR-UHFFFAOYSA-N	0	0	351.388	2.576	50	5		FFBARN
O=C(Cc1c[nH]c2ccccc12)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000005895430	506461875	/nfs/dbraw/zinc/46/18/75/506461875.db2.gz	LGLLUFITDKFRNK-UHFFFAOYSA-N	0	0	364.405	2.967	50	5		FFBARN
O=C(Cn1cc(Br)c([N+](=O)[O-])n1)Nc1cccc(Cl)c1	ZINC000040445608	506483208	/nfs/dbraw/zinc/48/32/08/506483208.db2.gz	RHTNHLNLQNMDSL-UHFFFAOYSA-N	0	0	359.567	2.846	50	5		FFBARN
COc1cccc(C(=O)OCC(=O)Nc2cc(OC)c([N+](=O)[O-])cc2C)c1	ZINC000006604427	506490671	/nfs/dbraw/zinc/49/06/71/506490671.db2.gz	IZILSZUVMZMIGE-UHFFFAOYSA-N	0	0	374.349	2.716	50	5		FFBARN
CCCCCCn1c(=O)[nH]c2nc3cc(NC(=O)CC)ccc3nc2c1=O	ZINC000006733132	506502376	/nfs/dbraw/zinc/50/23/76/506502376.db2.gz	BMEBCTKUSFQMOV-UHFFFAOYSA-N	0	0	369.425	2.562	50	5		FFBARN
O=C(Nc1ccccc1[N+](=O)[O-])c1cc2ncc(Br)cn2n1	ZINC000006926978	506517072	/nfs/dbraw/zinc/51/70/72/506517072.db2.gz	JVYKTLORYAOARW-UHFFFAOYSA-N	0	0	362.143	2.652	50	5		FFBARN
CCOc1ccc(OCCn2cnc3ccc([N+](=O)[O-])cc3c2=O)cc1	ZINC000007005836	506525497	/nfs/dbraw/zinc/52/54/97/506525497.db2.gz	GGGORGGWCUXQHP-UHFFFAOYSA-N	0	0	355.350	2.782	50	5		FFBARN
CCOC(=O)C1=C(C)N(C)C(=S)N[C@@H]1c1ccc(Cl)c([N+](=O)[O-])c1	ZINC000007552111	506569797	/nfs/dbraw/zinc/56/97/97/506569797.db2.gz	XJYPUWTXLHFHQG-CYBMUJFWSA-N	0	0	369.830	2.946	50	5		FFBARN
C[C@@H]1Oc2ccc(NC(=O)/C=C/c3ccccc3[N+](=O)[O-])cc2NC1=O	ZINC000008014267	506613818	/nfs/dbraw/zinc/61/38/18/506613818.db2.gz	ZGDNMUOFPATBPP-LAHYYIKRSA-N	0	0	353.334	2.966	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C(=O)NCCn1c(C)nc2ccccc21	ZINC000008135700	506625298	/nfs/dbraw/zinc/62/52/98/506625298.db2.gz	IAHYQEXHAAZERQ-UHFFFAOYSA-N	0	0	354.366	2.692	50	5		FFBARN
Cc1cnc(C(=O)NCCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1	ZINC000008143772	506625974	/nfs/dbraw/zinc/62/59/74/506625974.db2.gz	OIWIHQTXDHHHGN-UHFFFAOYSA-N	0	0	369.303	2.554	50	5		FFBARN
CCNC(=O)[C@H]1Cc2ccccc2N1C(=O)c1cc([N+](=O)[O-])ccc1Cl	ZINC000010256052	506734003	/nfs/dbraw/zinc/73/40/03/506734003.db2.gz	YWNNLKDIXBISSD-MRXNPFEDSA-N	0	0	373.796	2.956	50	5		FFBARN
Cc1ccc(OCC(=O)Nc2ccc(OC(F)F)cc2)c([N+](=O)[O-])n1	ZINC000013285267	506936317	/nfs/dbraw/zinc/93/63/17/506936317.db2.gz	FRKFSPWQPNRMGL-UHFFFAOYSA-N	0	0	353.281	2.917	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)[C@H]1CCCN(C(=O)c2ccoc2)C1	ZINC000023053876	507326914	/nfs/dbraw/zinc/32/69/14/507326914.db2.gz	IYCASLIKKATXCH-ZDUSSCGKSA-N	0	0	357.366	2.987	50	5		FFBARN
COc1ccc(CN2CCN(C(=O)c3ccccc3[N+](=O)[O-])CC2)cc1	ZINC000024118269	507394668	/nfs/dbraw/zinc/39/46/68/507394668.db2.gz	VFBXHOXXKPRHQN-UHFFFAOYSA-N	0	0	355.394	2.561	50	5		FFBARN
O=C(NCc1ccccn1)[C@H]1Cc2cc([N+](=O)[O-])ccc2N2CCCC[C@@H]12	ZINC000024536508	507418230	/nfs/dbraw/zinc/41/82/30/507418230.db2.gz	CITKAHJLPPLHFL-HKUYNNGSSA-N	0	0	366.421	2.837	50	5		FFBARN
COc1cc(NC(C)=O)c(C(=O)OCc2ccccc2[N+](=O)[O-])cc1OC	ZINC000025121421	507469419	/nfs/dbraw/zinc/46/94/19/507469419.db2.gz	MJZMTKGYGUCTSV-UHFFFAOYSA-N	0	0	374.349	2.927	50	5		FFBARN
CC(=O)N1CCc2cc(C(=O)N(C)Cc3cccc([N+](=O)[O-])c3)ccc21	ZINC000025254803	507480764	/nfs/dbraw/zinc/48/07/64/507480764.db2.gz	CBHVLYZMYLOCID-UHFFFAOYSA-N	0	0	353.378	2.776	50	5		FFBARN
COC(=O)[C@H]1CCC[C@@H]1NC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F	ZINC000079066057	507929944	/nfs/dbraw/zinc/92/99/44/507929944.db2.gz	HAFUARRUPOPNEI-UWVGGRQHSA-N	0	0	373.312	2.659	50	5		FFBARN
O=C(NC[C@H](O)c1ccc(F)cc1)c1ccc([N+](=O)[O-])c2cccnc12	ZINC000095451793	508185777	/nfs/dbraw/zinc/18/57/77/508185777.db2.gz	BMZABUPGGHWBCL-INIZCTEOSA-N	0	0	355.325	2.746	50	5		FFBARN
Cc1cc2c(cc1[N+](=O)[O-])N(C(=O)C[C@@H](NC(N)=O)c1cccs1)CC2	ZINC000095459639	508186713	/nfs/dbraw/zinc/18/67/13/508186713.db2.gz	HCJMPMWRFHXGDV-GFCCVEGCSA-N	0	0	374.422	2.654	50	5		FFBARN
CCOC(=O)C(C)(C(=O)OCC)c1ccc([N+](=O)[O-])cc1Br	ZINC000116850486	508568015	/nfs/dbraw/zinc/56/80/15/508568015.db2.gz	KMTCLWUMAULDAN-UHFFFAOYSA-N	0	0	374.187	2.741	50	5		FFBARN
O=C(Nc1cc([N+](=O)[O-])ccc1OC(F)F)N1CCOC2(CCC2)C1	ZINC000159469868	508846816	/nfs/dbraw/zinc/84/68/16/508846816.db2.gz	BVMIMQAORNPTJX-UHFFFAOYSA-N	0	0	357.313	2.983	50	5		FFBARN
Cn1cccc1[C@@H]1COCCN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1	ZINC000163938171	509444621	/nfs/dbraw/zinc/44/46/21/509444621.db2.gz	GXJGSCFEOMHWAZ-SFHVURJKSA-N	0	0	370.409	2.721	50	5		FFBARN
COc1ccc(-c2cc([N+](=O)[O-])ccc2OCC(=O)N2CCCC2=O)cc1	ZINC000031752480	518143922	/nfs/dbraw/zinc/14/39/22/518143922.db2.gz	MSTZEXZXVCHFJW-UHFFFAOYSA-N	0	0	370.361	2.798	50	5		FFBARN
C/C=C(/C(=O)OCc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O	ZINC000000689861	219314069	/nfs/dbraw/zinc/31/40/69/219314069.db2.gz	NXGYZDFEJQLMRA-CFZMTHNTSA-N	0	0	366.329	2.838	50	5		FFBARN
O=C(CCC1CCCC1)N1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000000779551	219318864	/nfs/dbraw/zinc/31/88/64/219318864.db2.gz	HYUAXEKSVNIREO-UHFFFAOYSA-N	0	0	359.426	2.850	50	5		FFBARN
COc1ccc(OC)c(NC(=O)c2cc(OC)c(OC)cc2[N+](=O)[O-])c1	ZINC000000851731	219330595	/nfs/dbraw/zinc/33/05/95/219330595.db2.gz	GIRPOJOFUQRBDZ-UHFFFAOYSA-N	0	0	362.338	2.882	50	5		FFBARN
O=C(Nc1cccnc1)c1cc(C(=O)Nc2cccnc2)cc([N+](=O)[O-])c1	ZINC000000851637	219331048	/nfs/dbraw/zinc/33/10/48/219331048.db2.gz	CIEQIXCKHCPMGN-UHFFFAOYSA-N	0	0	363.333	2.889	50	5		FFBARN
CCOC(=O)c1c(C)c(C)sc1NC(=O)Cn1nc([N+](=O)[O-])cc1C	ZINC000000845092	219329598	/nfs/dbraw/zinc/32/95/98/219329598.db2.gz	ACEJDFDKPLXIRT-UHFFFAOYSA-N	0	0	366.399	2.593	50	5		FFBARN
CC1(C)c2ccccc2N(CC(N)=O)[C@@]12C=Cc1cc([N+](=O)[O-])ccc1O2	ZINC000001097741	219368078	/nfs/dbraw/zinc/36/80/78/219368078.db2.gz	XABQINSAZCFVGT-HXUWFJFHSA-N	0	0	365.389	2.980	50	5		FFBARN
COC(=O)c1cc(OC)c(OC)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000001125339	219375422	/nfs/dbraw/zinc/37/54/22/219375422.db2.gz	JTXCACZCFMAOAR-UHFFFAOYSA-N	0	0	374.349	2.959	50	5		FFBARN
COC(=O)c1ccccc1NC(=S)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000001157126	219382517	/nfs/dbraw/zinc/38/25/17/219382517.db2.gz	WOICTZPCOYIIQD-UHFFFAOYSA-N	0	0	359.363	2.508	50	5		FFBARN
O=C(Nc1cc2cccc([N+](=O)[O-])c2oc1=O)c1ccc([N+](=O)[O-])cc1	ZINC000004423172	219575563	/nfs/dbraw/zinc/57/55/63/219575563.db2.gz	ARLBMOXREALSAQ-UHFFFAOYSA-N	0	0	355.262	2.862	50	5		FFBARN
CC(C)CN(C(=O)c1ccc(Cl)c([N+](=O)[O-])c1)[C@H]1CCS(=O)(=O)C1	ZINC000004504736	219581236	/nfs/dbraw/zinc/58/12/36/219581236.db2.gz	VTXWKGZIJTYWBF-LBPRGKRZSA-N	0	0	374.846	2.534	50	5		FFBARN
NC(=S)Nc1c(Br)cc([N+](=O)[O-])cc1Br	ZINC000005092674	219649941	/nfs/dbraw/zinc/64/99/41/219649941.db2.gz	PLMPJKISULNZGB-UHFFFAOYSA-N	0	0	355.011	2.775	50	5		FFBARN
CCS(=O)(=O)c1ccc(C(=O)Nc2ccc(OC)cc2[N+](=O)[O-])cc1	ZINC000005241838	219663975	/nfs/dbraw/zinc/66/39/75/219663975.db2.gz	CXFRIFOLUCHBOH-UHFFFAOYSA-N	0	0	364.379	2.649	50	5		FFBARN
Cc1cccc(Cn2cccc(C(=O)Nc3ncc([N+](=O)[O-])s3)c2=O)c1	ZINC000005269769	219667093	/nfs/dbraw/zinc/66/70/93/219667093.db2.gz	CZPVJRIKIUAIOY-UHFFFAOYSA-N	0	0	370.390	2.822	50	5		FFBARN
COc1cc(OC)c(OC)cc1CNc1nc2sccn2c1[N+](=O)[O-]	ZINC000008374930	219861409	/nfs/dbraw/zinc/86/14/09/219861409.db2.gz	KKYLWJJXSHXPGX-UHFFFAOYSA-N	0	0	364.383	2.942	50	5		FFBARN
CC(=O)N/C(=C\c1cccc([N+](=O)[O-])c1)C(=O)N(C)Cc1ccccc1	ZINC000012137711	219958676	/nfs/dbraw/zinc/95/86/76/219958676.db2.gz	NNTGRSLZYVEVIO-PDGQHHTCSA-N	0	0	353.378	2.730	50	5		FFBARN
C[C@@H](Sc1nnnn1C1CCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1	ZINC000012765628	220027030	/nfs/dbraw/zinc/02/70/30/220027030.db2.gz	VRXMLUVDYJFFBT-SNVBAGLBSA-N	0	0	362.415	2.816	50	5		FFBARN
COC(=O)c1cc(C(=O)NCc2nccc3ccccc32)cc([N+](=O)[O-])c1	ZINC000014387416	220123473	/nfs/dbraw/zinc/12/34/73/220123473.db2.gz	SBZLUBPPXJTPLB-UHFFFAOYSA-N	0	0	365.345	2.860	50	5		FFBARN
Cc1ccn2c(=O)cc(COC(=O)c3ccc(Cl)c([N+](=O)[O-])c3)nc2c1	ZINC000014754041	220132499	/nfs/dbraw/zinc/13/24/99/220132499.db2.gz	CTXABLWUTNOQIB-UHFFFAOYSA-N	0	0	373.752	2.922	50	5		FFBARN
COC(=O)C1CCN([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1	ZINC000015413020	220154115	/nfs/dbraw/zinc/15/41/15/220154115.db2.gz	PIXUGZRHZKHPMJ-LLVKDONJSA-N	0	0	360.370	2.591	50	5		FFBARN
COC(=O)c1cc(C(=O)OCc2cn3cccc(C)c3n2)cc([N+](=O)[O-])c1	ZINC000016209911	220179781	/nfs/dbraw/zinc/17/97/81/220179781.db2.gz	HIHFODAWWOBRLW-UHFFFAOYSA-N	0	0	369.333	2.695	50	5		FFBARN
O=[N+]([O-])c1ccc(OS(=O)(=O)c2ccc3c(c2)OCCCO3)cc1	ZINC000016089708	220177270	/nfs/dbraw/zinc/17/72/70/220177270.db2.gz	GRJJNDYFYFMKBC-UHFFFAOYSA-N	0	0	351.336	2.524	50	5		FFBARN
CN(Cc1ccccc1)C(=O)CCCn1c(=O)oc2cc([N+](=O)[O-])ccc21	ZINC000017334526	220213822	/nfs/dbraw/zinc/21/38/22/220213822.db2.gz	YUPPCORSGUSZNJ-UHFFFAOYSA-N	0	0	369.377	2.942	50	5		FFBARN
Cc1ccccc1NC(=O)[C@H](c1cccc([N+](=O)[O-])c1)N1CCOCC1	ZINC000020169470	220318754	/nfs/dbraw/zinc/31/87/54/220318754.db2.gz	JKHBSPQQKUMPNS-SFHVURJKSA-N	0	0	355.394	2.915	50	5		FFBARN
COc1cc2c(cc1OC)[C@H](c1cc3c(cc1[N+](=O)[O-])OCO3)NCC2	ZINC000022204769	220378498	/nfs/dbraw/zinc/37/84/98/220378498.db2.gz	DDEZIWSQYMTURV-GOSISDBHSA-N	0	0	358.350	2.576	50	5		FFBARN
CN(C)c1ccc(C(=O)Nc2ccc(N3CCCC3)nc2)cc1[N+](=O)[O-]	ZINC000022388533	220384975	/nfs/dbraw/zinc/38/49/75/220384975.db2.gz	TWIJAYLKXLJKDR-UHFFFAOYSA-N	0	0	355.398	2.908	50	5		FFBARN
COc1ccc(N2C(=O)/C(=C\c3ccco3)N(C)C2=S)c([N+](=O)[O-])c1	ZINC000022628758	220392734	/nfs/dbraw/zinc/39/27/34/220392734.db2.gz	MEMOMWIYGZMGRO-NTEUORMPSA-N	0	0	359.363	2.801	50	5		FFBARN
C[C@H](CNC(=O)[C@H](C)OC(=O)c1cc([N+](=O)[O-])ccc1N)c1ccccc1	ZINC000022624166	220393243	/nfs/dbraw/zinc/39/32/43/220393243.db2.gz	VMASUPAYLKJTEN-OLZOCXBDSA-N	0	0	371.393	2.642	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@@H]1CC(=O)N(CCc2ccccc2)C1	ZINC000024836434	220464149	/nfs/dbraw/zinc/46/41/49/220464149.db2.gz	ZJKBYHDTNFTYQY-CQSZACIVSA-N	0	0	371.368	2.764	50	5		FFBARN
CCCCn1nc(C(=O)N(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1=O	ZINC000025831291	220499636	/nfs/dbraw/zinc/49/96/36/220499636.db2.gz	HLFNWRZLTRQOSG-ZDUSSCGKSA-N	0	0	358.398	2.785	50	5		FFBARN
O=C1C[C@@H](Nc2ccc3c(c2)CCC3)C(=O)N1c1cccc([N+](=O)[O-])c1	ZINC000050784393	221033381	/nfs/dbraw/zinc/03/33/81/221033381.db2.gz	MLHPVCAHGILISS-QGZVFWFLSA-N	0	0	351.362	2.828	50	5		FFBARN
Cc1ccc(C(=O)N2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)cc1	ZINC000052752467	221038759	/nfs/dbraw/zinc/03/87/59/221038759.db2.gz	KGZFLXQJLFXVJM-UHFFFAOYSA-N	0	0	353.422	2.904	50	5		FFBARN
C[C@@H]1CN(C(=O)C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H](c2ccccc2)O1	ZINC000067892947	221301626	/nfs/dbraw/zinc/30/16/26/221301626.db2.gz	XZLZALHDVCQLTG-DYVFJYSZSA-N	0	0	369.377	2.522	50	5		FFBARN
COc1ccccc1N1CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1	ZINC000004845189	132824884	/nfs/dbraw/zinc/82/48/84/132824884.db2.gz	IWJCKYJUYFYUGO-UHFFFAOYSA-N	0	0	356.382	2.958	50	5		FFBARN
CC1CCN(c2nc(NCCc3ccccc3)nc(N)c2[N+](=O)[O-])CC1	ZINC000005029561	132826070	/nfs/dbraw/zinc/82/60/70/132826070.db2.gz	KBRQCFPSAGMMSM-UHFFFAOYSA-N	0	0	356.430	2.858	50	5		FFBARN
COc1ccccc1N1CCN(Cc2cc3c(cc2[N+](=O)[O-])OCO3)CC1	ZINC000055543279	136127059	/nfs/dbraw/zinc/12/70/59/136127059.db2.gz	ZTEIYXMVCAZBAL-UHFFFAOYSA-N	0	0	371.393	2.654	50	5		FFBARN
CCOC(=O)c1cc2c(nc3ccc(C)cn3c2=O)n(C2CCCC2)c1=N	ZINC000100662470	222249651	/nfs/dbraw/zinc/24/96/51/222249651.db2.gz	NRFRKGCYESXEBH-UHFFFAOYSA-N	0	0	366.421	2.729	50	5		FFBARN
O=C1[C@H]2ON=C(c3ccc([N+](=O)[O-])cc3)C2=C(O)N1c1cccc(Cl)c1	ZINC000103529690	222339026	/nfs/dbraw/zinc/33/90/26/222339026.db2.gz	GHCHCBRODQXBLY-ZFWWWQNUSA-N	0	0	371.736	2.541	50	5		FFBARN
Cc1ccc(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c(C)c1	ZINC000002829682	506296503	/nfs/dbraw/zinc/29/65/03/506296503.db2.gz	IAHFSYZURXZZIJ-UHFFFAOYSA-N	0	0	367.361	2.836	50	5		FFBARN
Cc1sc(NC(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)c(C(N)=O)c1C	ZINC000002897970	506299663	/nfs/dbraw/zinc/29/96/63/506299663.db2.gz	ITVCZMHJWYYTMJ-UHFFFAOYSA-N	0	0	364.339	2.533	50	5		FFBARN
O=C(Cn1c2ccccc2nc1NCCCO)c1ccc([N+](=O)[O-])cc1	ZINC000002901809	506301974	/nfs/dbraw/zinc/30/19/74/506301974.db2.gz	GFEKXGKKHDYWBS-UHFFFAOYSA-N	0	0	354.366	2.622	50	5		FFBARN
COC(=O)c1cccc(NC(=S)NC(=O)c2csc([N+](=O)[O-])c2)c1	ZINC000003138724	506311457	/nfs/dbraw/zinc/31/14/57/506311457.db2.gz	DCCPIOWYYFEEBW-UHFFFAOYSA-N	0	0	365.392	2.570	50	5		FFBARN
O=[N+]([O-])c1cc(Nc2ncnc3n[nH]c(Br)c32)ccc1F	ZINC000032919176	506312872	/nfs/dbraw/zinc/31/28/72/506312872.db2.gz	QNPJBZYLVWQCAM-UHFFFAOYSA-N	0	0	353.111	2.906	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)NCc1cccs1	ZINC000003247471	506315494	/nfs/dbraw/zinc/31/54/94/506315494.db2.gz	IPADVPAQUHHXBE-UHFFFAOYSA-N	0	0	354.771	2.783	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)Nc2cc(F)ccc2F)cc1[N+](=O)[O-]	ZINC000003441938	506331260	/nfs/dbraw/zinc/33/12/60/506331260.db2.gz	OEDCGTDCCPCFMK-UHFFFAOYSA-N	0	0	366.276	2.677	50	5		FFBARN
COc1ccc(C(=O)O[C@H](C)C(=O)N2CCc3ccccc32)cc1[N+](=O)[O-]	ZINC000003544703	506341127	/nfs/dbraw/zinc/34/11/27/506341127.db2.gz	OBNDKLBEIRCITQ-GFCCVEGCSA-N	0	0	370.361	2.738	50	5		FFBARN
COc1ccc(CN2C(=O)N[C@](C)(c3ccc([N+](=O)[O-])cc3)C2=O)cc1F	ZINC000004477683	506376212	/nfs/dbraw/zinc/37/62/12/506376212.db2.gz	AWVOUIINTTYJKJ-GOSISDBHSA-N	0	0	373.340	2.710	50	5		FFBARN
O=C(c1ccc(F)c(F)c1)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000004498407	506379650	/nfs/dbraw/zinc/37/96/50/506379650.db2.gz	DWJSTRZDUMYITK-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
O=C(c1cccc(F)c1F)N1CCN(c2ccc(F)cc2[N+](=O)[O-])CC1	ZINC000004819092	506397192	/nfs/dbraw/zinc/39/71/92/506397192.db2.gz	JXJMLAOEXSRGPD-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
O=[N+]([O-])c1nn(-c2ccc(Cl)cc2)[n+]([O-])c1NCc1ccc(F)cc1	ZINC000004922905	506406535	/nfs/dbraw/zinc/40/65/35/506406535.db2.gz	PTHLAYYYUYHWPV-UHFFFAOYSA-N	0	0	363.736	2.819	50	5		FFBARN
CCOC(=O)c1ccccc1OC(=O)c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000004946750	506409812	/nfs/dbraw/zinc/40/98/12/506409812.db2.gz	CYTYGDLVQJUYRH-UHFFFAOYSA-N	0	0	360.278	2.899	50	5		FFBARN
CC(=O)c1ccc(Oc2nc(N3CCOCC3)nc(C)c2[N+](=O)[O-])cc1	ZINC000005024699	506416158	/nfs/dbraw/zinc/41/61/58/506416158.db2.gz	FLYWBFXZPVFBIU-UHFFFAOYSA-N	0	0	358.354	2.525	50	5		FFBARN
COc1cc(NC(=O)COC(=O)c2ccc(F)cc2)c(C)cc1[N+](=O)[O-]	ZINC000005061978	506418991	/nfs/dbraw/zinc/41/89/91/506418991.db2.gz	HPZRATUXVKZUKN-UHFFFAOYSA-N	0	0	362.313	2.846	50	5		FFBARN
Cc1ccccc1C(=O)N1CCN(c2ccc([N+](=O)[O-])cc2)C(=O)[C@@H]1C	ZINC000037520887	506427592	/nfs/dbraw/zinc/42/75/92/506427592.db2.gz	RBZIDSJCBNFLJI-AWEZNQCLSA-N	0	0	353.378	2.781	50	5		FFBARN
CCOc1ncccc1C(=O)OCc1nnc(-c2ccc([N+](=O)[O-])cc2)o1	ZINC000007063912	506531370	/nfs/dbraw/zinc/53/13/70/506531370.db2.gz	HEAGDQATUILKQL-UHFFFAOYSA-N	0	0	370.321	2.796	50	5		FFBARN
C[C@@H](OC(=O)c1ccc([N+](=O)[O-])cc1)C(=O)N(C)Cc1cccc(F)c1	ZINC000007338978	506553773	/nfs/dbraw/zinc/55/37/73/506553773.db2.gz	PGHPDQLKGAWVOK-GFCCVEGCSA-N	0	0	360.341	2.938	50	5		FFBARN
O=C(NCCCOCc1ccccc1)c1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000008943601	506674414	/nfs/dbraw/zinc/67/44/14/506674414.db2.gz	ZQSKXLDFJUUFME-UHFFFAOYSA-N	0	0	372.377	2.703	50	5		FFBARN
Cc1csc(Sc2ccc(C(=O)N3CCOCC3)cc2[N+](=O)[O-])n1	ZINC000009155458	506683106	/nfs/dbraw/zinc/68/31/06/506683106.db2.gz	ZRWUCSQSSBQCLP-UHFFFAOYSA-N	0	0	365.436	2.983	50	5		FFBARN
NC(=O)c1ccc(CSc2n[nH]c(-c3ccccc3)n2)c([N+](=O)[O-])c1	ZINC000009456846	506697866	/nfs/dbraw/zinc/69/78/66/506697866.db2.gz	UWHJSLRGZXVGNO-UHFFFAOYSA-N	0	0	355.379	2.771	50	5		FFBARN
COCC(=O)n1nc(-c2cccs2)nc1NCc1cccc([N+](=O)[O-])c1	ZINC000009667656	506707269	/nfs/dbraw/zinc/70/72/69/506707269.db2.gz	GNPLJUWCDSANQS-UHFFFAOYSA-N	0	0	373.394	2.814	50	5		FFBARN
C[C@H](NC(=O)c1ccc(N2CCOCC2)c([N+](=O)[O-])c1)c1cccs1	ZINC000012641009	506887754	/nfs/dbraw/zinc/88/77/54/506887754.db2.gz	HXAUYUDOXCNCQJ-LBPRGKRZSA-N	0	0	361.423	2.984	50	5		FFBARN
O=[N+]([O-])c1ccccc1N1CCN(Cc2cc(F)cc3c2OCOC3)CC1	ZINC000012635524	506887982	/nfs/dbraw/zinc/88/79/82/506887982.db2.gz	DWBHTSBNBVVYNM-UHFFFAOYSA-N	0	0	373.384	2.923	50	5		FFBARN
Cc1cc(N2CCN(c3ncccn3)CC2)nc2ccc([N+](=O)[O-])cc12	ZINC000020104180	507211137	/nfs/dbraw/zinc/21/11/37/507211137.db2.gz	CEDGMJITDCEYOW-UHFFFAOYSA-N	0	0	350.382	2.568	50	5		FFBARN
CC(C)(C)OC(=O)NC1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])CC1	ZINC000047524021	507350090	/nfs/dbraw/zinc/35/00/90/507350090.db2.gz	LHNUVRMVMYPJCN-UHFFFAOYSA-N	0	0	363.414	2.653	50	5		FFBARN
Cc1cccc(C(=O)N2CCC(c3nnc4ccccn43)CC2)c1[N+](=O)[O-]	ZINC000023695962	507367901	/nfs/dbraw/zinc/36/79/01/507367901.db2.gz	FOIJGVLPPABMMX-UHFFFAOYSA-N	0	0	365.393	2.966	50	5		FFBARN
Cc1c(NC(=O)N2CCNC(=O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-]	ZINC000058060581	507368298	/nfs/dbraw/zinc/36/82/98/507368298.db2.gz	PPRPZOGJMJJLBW-KRWDZBQOSA-N	0	0	368.393	2.998	50	5		FFBARN
Cc1ccc([C@@H](CN2CCOCC2)NC(=O)c2ccc([N+](=O)[O-])cc2)cc1	ZINC000024684697	507429489	/nfs/dbraw/zinc/42/94/89/507429489.db2.gz	SLXSFRVZCMGNGM-LJQANCHMSA-N	0	0	369.421	2.707	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])N1CCO[C@@H](c2ccc(F)cc2)C1	ZINC000029112323	507760671	/nfs/dbraw/zinc/76/06/71/507760671.db2.gz	ZYMGVEULPRIKAF-QGZVFWFLSA-N	0	0	360.341	2.713	50	5		FFBARN
O=[N+]([O-])c1c(NC[C@H](c2ccccc2)N2CCOCC2)nc2ccccn21	ZINC000029525991	507781391	/nfs/dbraw/zinc/78/13/91/507781391.db2.gz	MWVQZDVKVIMQHC-MRXNPFEDSA-N	0	0	367.409	2.728	50	5		FFBARN
O=c1[nH]cnc2cc(NC[C@@H](O)c3ccc(Cl)cc3)c([N+](=O)[O-])cc12	ZINC000030860196	507813841	/nfs/dbraw/zinc/81/38/41/507813841.db2.gz	JOIVSCLAHVQNBA-OAHLLOKOSA-N	0	0	360.757	2.630	50	5		FFBARN
O=C(Nc1cccc([N+](=O)[O-])c1)[C@@H]1CSCN1C(=O)c1ccccc1	ZINC000073445305	507922053	/nfs/dbraw/zinc/92/20/53/507922053.db2.gz	XFYWKQQJMULFPC-HNNXBMFYSA-N	0	0	357.391	2.749	50	5		FFBARN
CNC(=O)c1ccc(N(C[C@@H](O)c2ccc(F)cc2)C2CC2)c([N+](=O)[O-])c1	ZINC000079063918	507929395	/nfs/dbraw/zinc/92/93/95/507929395.db2.gz	DUBHVLQSGJKYHF-GOSISDBHSA-N	0	0	373.384	2.796	50	5		FFBARN
Cc1cc(C(=O)N2CC(C(=O)OCc3ccccc3)C2)ccc1[N+](=O)[O-]	ZINC000095467388	508187994	/nfs/dbraw/zinc/18/79/94/508187994.db2.gz	AWVPIWMXUAPWFM-UHFFFAOYSA-N	0	0	354.362	2.719	50	5		FFBARN
COC(=O)[C@H](C)NC(=O)c1ccc(N2CCCCCCC2)c([N+](=O)[O-])c1	ZINC000084098746	508265710	/nfs/dbraw/zinc/26/57/10/508265710.db2.gz	ZJKKCJCRSNTBOX-ZDUSSCGKSA-N	0	0	363.414	2.657	50	5		FFBARN
O=C(Nc1ccc([N+](=O)[O-])cc1Cl)N[C@@H]1CCO[C@@]2(CCOC2)C1	ZINC000170591475	509673590	/nfs/dbraw/zinc/67/35/90/509673590.db2.gz	RAEGQMANDAUCEC-BMIGLBTASA-N	0	0	355.778	2.708	50	5		FFBARN
O=C([C@@H]1CC(c2cccc(F)c2)=NO1)N1CCc2ccc([N+](=O)[O-])cc21	ZINC000084372085	571084030	/nfs/dbraw/zinc/08/40/30/571084030.db2.gz	YMRKNKLCPUXQMJ-KRWDZBQOSA-N	0	0	355.325	2.816	50	5		FFBARN
Cc1ccc(C)c(NC(=O)CCN2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000000850453	219330934	/nfs/dbraw/zinc/33/09/34/219330934.db2.gz	DYZLQXWROYSUMX-UHFFFAOYSA-N	0	0	367.361	2.836	50	5		FFBARN
Cc1c(NC(=O)c2ccccc2[N+](=O)[O-])c(=O)n(-c2ccccc2)n1C	ZINC000000831021	219328072	/nfs/dbraw/zinc/32/80/72/219328072.db2.gz	PAVVSKVHJMHZFM-UHFFFAOYSA-N	0	0	352.350	2.645	50	5		FFBARN
Cc1cc2c(cc1C)N[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)C(=O)N2	ZINC000000950770	219345208	/nfs/dbraw/zinc/34/52/08/219345208.db2.gz	BGJCZCQNWVBJRB-INIZCTEOSA-N	0	0	354.366	2.973	50	5		FFBARN
C[C@@H]1CN(C(=O)c2ccc3c(c2)OCO3)O[C@H](c2cccc([N+](=O)[O-])c2)O1	ZINC000001025705	219355201	/nfs/dbraw/zinc/35/52/01/219355201.db2.gz	YVYVINMYBSLRMG-ADLMAVQZSA-N	0	0	372.333	2.815	50	5		FFBARN
CCCN1C=C(C(=O)OC)C(c2ccc([N+](=O)[O-])cc2)C(C(=O)OC)=C1	ZINC000001140918	219378993	/nfs/dbraw/zinc/37/89/93/219378993.db2.gz	ZCFJDMYOKWWWOY-UHFFFAOYSA-N	0	0	360.366	2.518	50	5		FFBARN
COc1ccc(CCNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)cc1OC	ZINC000001284535	219393554	/nfs/dbraw/zinc/39/35/54/219393554.db2.gz	GLSRZMDWKUCKGN-UHFFFAOYSA-N	0	0	374.393	2.658	50	5		FFBARN
COc1ccc(/C=C2\N=C(c3ccc(OC)c([N+](=O)[O-])c3)OC2=O)cc1	ZINC000001507439	219409127	/nfs/dbraw/zinc/40/91/27/219409127.db2.gz	GYUODZJJJGHZPX-ZROIWOOFSA-N	0	0	354.318	2.957	50	5		FFBARN
CCn1ncc(Br)c1C(=O)Nc1cc([N+](=O)[O-])ccc1F	ZINC000002763793	219462571	/nfs/dbraw/zinc/46/25/71/219462571.db2.gz	XAPHOPGLQCGWKO-UHFFFAOYSA-N	0	0	357.139	2.965	50	5		FFBARN
COc1ccc(Nc2cc(NCCCO)c([N+](=O)[O-])c3nonc32)cc1	ZINC000004193986	219555168	/nfs/dbraw/zinc/55/51/68/219555168.db2.gz	WEDXGHLYUPODEI-UHFFFAOYSA-N	0	0	359.342	2.678	50	5		FFBARN
CCCc1ccccc1OCCNS(=O)(=O)c1cccc([N+](=O)[O-])c1	ZINC000004825482	219610159	/nfs/dbraw/zinc/61/01/59/219610159.db2.gz	VRZXBMAWKMJYEX-UHFFFAOYSA-N	0	0	364.423	2.905	50	5		FFBARN
O=C(CNc1cccc([N+](=O)[O-])c1)Nc1ccc(N2CCCC2=O)cc1	ZINC000007339822	219801450	/nfs/dbraw/zinc/80/14/50/219801450.db2.gz	ALWSHPWGBQHVJI-UHFFFAOYSA-N	0	0	354.366	2.772	50	5		FFBARN
Cc1c(-c2nc(-c3ccc4c(c3)[nH]c(=O)n4C)no2)cccc1[N+](=O)[O-]	ZINC000008600754	219864404	/nfs/dbraw/zinc/86/44/04/219864404.db2.gz	IRSNXQVBKQIGFE-UHFFFAOYSA-N	0	0	351.322	2.800	50	5		FFBARN
Cc1nn(CC(=O)NCCCCOc2ccc(F)cc2)c(C)c1[N+](=O)[O-]	ZINC000009154150	219875239	/nfs/dbraw/zinc/87/52/39/219875239.db2.gz	NTOCTUSQFBHSHC-UHFFFAOYSA-N	0	0	364.377	2.523	50	5		FFBARN
Cc1c(C(=O)Nc2cccc(-c3ccc(=O)n(C)n3)c2)cccc1[N+](=O)[O-]	ZINC000010325017	219899318	/nfs/dbraw/zinc/89/93/18/219899318.db2.gz	WHSSFIWHQUDWNF-UHFFFAOYSA-N	0	0	364.361	2.916	50	5		FFBARN
COc1ccc(C(=O)OCC(=O)N2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-]	ZINC000012600639	220011853	/nfs/dbraw/zinc/01/18/53/220011853.db2.gz	WPANGOPXLGEYEI-TXEJJXNPSA-N	0	0	350.371	2.550	50	5		FFBARN
O=C(Cc1nn2cnc3ccccc3c2nc1=O)c1ccc(Cl)cc1	ZINC000014241045	220118571	/nfs/dbraw/zinc/11/85/71/220118571.db2.gz	RRMGROACRYOMJT-UHFFFAOYSA-N	0	0	350.765	2.717	50	5		FFBARN
Cc1nnc(SCC(=O)Nc2c3ccccc3nc3ccccc32)n1C	ZINC000019851624	220302302	/nfs/dbraw/zinc/30/23/02/220302302.db2.gz	SJEWMNVTFUQJEK-UHFFFAOYSA-N	0	0	363.446	2.978	50	5		FFBARN
CC(=O)Oc1ccc(C2=NN(C(C)=O)[C@@H](c3cccc([N+](=O)[O-])c3)O2)cc1	ZINC000021091261	220350869	/nfs/dbraw/zinc/35/08/69/220350869.db2.gz	ALSRCGSHWIRCFQ-GOSISDBHSA-N	0	0	369.333	2.759	50	5		FFBARN
CCOc1ccc(NC(=O)COc2ccc(C(=O)OC)cc2[N+](=O)[O-])cc1	ZINC000022222779	220378750	/nfs/dbraw/zinc/37/87/50/220378750.db2.gz	MTLFHFJTHHPWOH-UHFFFAOYSA-N	0	0	374.349	2.798	50	5		FFBARN
CCC(CC)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)N1CCOCC1	ZINC000022966328	220407690	/nfs/dbraw/zinc/40/76/90/220407690.db2.gz	ZUPWBRDXYNGFAJ-KRWDZBQOSA-N	0	0	364.446	2.853	50	5		FFBARN
Cc1nn(CC(=O)OCc2nc(-c3ccc(C)cc3)no2)c(C)c1[N+](=O)[O-]	ZINC000025117888	220475634	/nfs/dbraw/zinc/47/56/34/220475634.db2.gz	BVPHVTZEFZYPBF-UHFFFAOYSA-N	0	0	371.353	2.510	50	5		FFBARN
O=C(Cn1cccc(C(F)(F)F)c1=O)Nc1ccc(F)c([N+](=O)[O-])c1	ZINC000024933386	220466804	/nfs/dbraw/zinc/46/68/04/220466804.db2.gz	LMENJIXMEMYBKL-UHFFFAOYSA-N	0	0	359.235	2.553	50	5		FFBARN
Cc1nn(CC(=O)N[C@@H](c2nc3ccccc3[nH]2)C(C)C)c(C)c1[N+](=O)[O-]	ZINC000045673317	220974072	/nfs/dbraw/zinc/97/40/72/220974072.db2.gz	XSGDUXBTXNHONQ-MRXNPFEDSA-N	0	0	370.413	2.798	50	5		FFBARN
C[C@H]1C(=O)N(CCOc2ccccc2[N+](=O)[O-])C(=O)N1c1ccc(F)cc1	ZINC000047349475	220992409	/nfs/dbraw/zinc/99/24/09/220992409.db2.gz	CQMVVYVCZZNXIY-LBPRGKRZSA-N	0	0	373.340	2.970	50	5		FFBARN
O=[N+]([O-])c1nn(Cc2nc(-c3cccs3)no2)cc1Br	ZINC000048628723	221014509	/nfs/dbraw/zinc/01/45/09/221014509.db2.gz	WKDRFQZSGIBXQC-UHFFFAOYSA-N	0	0	356.161	2.714	50	5		FFBARN
CS(=O)(=O)c1ccc(C(=O)NC2(c3ccccc3)CCC2)cc1[N+](=O)[O-]	ZINC000053473054	221045816	/nfs/dbraw/zinc/04/58/16/221045816.db2.gz	UGKGSMLCCUOCIK-UHFFFAOYSA-N	0	0	374.418	2.808	50	5		FFBARN
CCOc1cc([C@@H]2OC(c3ccccc3[N+](=O)[O-])=NN2C(C)=O)ccc1O	ZINC000064819693	221152552	/nfs/dbraw/zinc/15/25/52/221152552.db2.gz	LTSAEAKSVGCHNU-SFHVURJKSA-N	0	0	371.349	2.938	50	5		FFBARN
CCOC(=O)c1ncn(C2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)c1N	ZINC000225648121	132285602	/nfs/dbraw/zinc/28/56/02/132285602.db2.gz	CIRAQNRGMZELSY-UHFFFAOYSA-N	0	0	373.413	2.700	50	5		FFBARN
O=[N+]([O-])c1ccc(NCCN2CCOc3nc4ccccc4nc32)cc1	ZINC000003894388	132385888	/nfs/dbraw/zinc/38/58/88/132385888.db2.gz	DDOGPNRYQMCWLT-UHFFFAOYSA-N	0	0	351.366	2.849	50	5		FFBARN
COc1ccccc1Nc1nc(N2CCC[C@@H](C)C2)nc(N)c1[N+](=O)[O-]	ZINC000004306397	132386650	/nfs/dbraw/zinc/38/66/50/132386650.db2.gz	BBOZDBRGTFIUCJ-LLVKDONJSA-N	0	0	358.402	2.956	50	5		FFBARN
Cc1cccc(N2CCN(C(=O)c3ccc([N+](=O)[O-])cc3)[C@@H](C)C2=O)c1	ZINC000037275777	132940709	/nfs/dbraw/zinc/94/07/09/132940709.db2.gz	FFIADHLFTCVJKC-AWEZNQCLSA-N	0	0	353.378	2.781	50	5		FFBARN
C[C@H](C(=O)N1[C@H](C)CCC[C@H]1C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000057722462	136129951	/nfs/dbraw/zinc/12/99/51/136129951.db2.gz	GZNWYFRJXODHLJ-BRWVUGGUSA-N	0	0	374.485	2.895	50	5		FFBARN
O=C(c1ccc(F)cc1F)N1CCN(c2ccc([N+](=O)[O-])cc2F)CC1	ZINC000004132280	136151753	/nfs/dbraw/zinc/15/17/53/136151753.db2.gz	BSCFTVMFCQZTEB-UHFFFAOYSA-N	0	0	365.311	2.975	50	5		FFBARN
O=[N+]([O-])c1ccc(N2CCN(Cc3nc4ccccc4s3)CC2)cn1	ZINC000023466450	136152889	/nfs/dbraw/zinc/15/28/89/136152889.db2.gz	OZABYZOSCZHHBI-UHFFFAOYSA-N	0	0	355.423	2.922	50	5		FFBARN
COC(=O)c1ccc2[nH]c3c(c2c1)CN(c1ncccc1[N+](=O)[O-])CC3	ZINC000026725253	136153282	/nfs/dbraw/zinc/15/32/82/136153282.db2.gz	ABGOVEDPVOKCOS-UHFFFAOYSA-N	0	0	352.350	2.820	50	5		FFBARN
O=C(COc1ccccc1[N+](=O)[O-])Nc1cccc(N2CCCC2=O)c1	ZINC000009653705	263362189	/nfs/dbraw/zinc/36/21/89/263362189.db2.gz	DZEHZHKJZREVPJ-UHFFFAOYSA-N	0	0	355.350	2.739	50	5		FFBARN
CCCOc1ccc(NS(=O)(=O)c2ccc(N)cc2)cc1[N+](=O)[O-]	ZINC000002187198	506274676	/nfs/dbraw/zinc/27/46/76/506274676.db2.gz	IESIFPXPIFIATM-UHFFFAOYSA-N	0	0	351.384	2.767	50	5		FFBARN
Cc1nn(CCCNC(=O)c2ccc([N+](=O)[O-])cc2)cc1Br	ZINC000002796431	506292794	/nfs/dbraw/zinc/29/27/94/506292794.db2.gz	BYBWBGCNJGELDG-UHFFFAOYSA-N	0	0	367.203	2.682	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1C1=N/C(=C/c2cccc([N+](=O)[O-])c2)C(=O)O1	ZINC000002941838	506303395	/nfs/dbraw/zinc/30/33/95/506303395.db2.gz	MXEGGTVECOTYMD-RIYZIHGNSA-N	0	0	369.289	2.856	50	5		FFBARN
O=C(COC(=O)c1ccc([N+](=O)[O-])cc1Cl)N1CCc2ccccc2C1	ZINC000003263181	506317356	/nfs/dbraw/zinc/31/73/56/506317356.db2.gz	DPRIGCXRUMMRKW-UHFFFAOYSA-N	0	0	374.780	2.990	50	5		FFBARN
Cc1cc(C(=O)Cn2nc(C)c([N+](=O)[O-])c2C)c(C)n1C[C@@H]1CCCO1	ZINC000003446152	506331828	/nfs/dbraw/zinc/33/18/28/506331828.db2.gz	SOISTCMZBZSBBV-HNNXBMFYSA-N	0	0	360.414	2.888	50	5		FFBARN
Cc1ccccc1Nc1nc(N)nc(COc2ccc([N+](=O)[O-])cc2)n1	ZINC000003515257	506339821	/nfs/dbraw/zinc/33/98/21/506339821.db2.gz	DFZACSSLFPDSMJ-UHFFFAOYSA-N	0	0	352.354	2.993	50	5		FFBARN
CO[C@](F)(C(=O)Nc1cc([N+](=O)[O-])cc([N+](=O)[O-])c1C)C(F)(F)F	ZINC000003672550	506350115	/nfs/dbraw/zinc/35/01/15/506350115.db2.gz	XWEKGMTXRSUTJU-SNVBAGLBSA-N	0	0	355.200	2.624	50	5		FFBARN
CCSCCOC(=O)C1=C(C)NC(=O)N[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000003905768	506351458	/nfs/dbraw/zinc/35/14/58/506351458.db2.gz	MJNXHNZYFAAQFQ-CQSZACIVSA-N	0	0	365.411	2.519	50	5		FFBARN
O=c1oc2ccc(NS(=O)(=O)c3cccc([N+](=O)[O-])c3)cc2s1	ZINC000003893932	506351567	/nfs/dbraw/zinc/35/15/67/506351567.db2.gz	APMLNRWZQCEEDI-UHFFFAOYSA-N	0	0	352.349	2.564	50	5		FFBARN
Cc1cc([N+](=O)[O-])ccc1NC(=O)CCCN1C(=O)c2ccccc2C1=O	ZINC000004016308	506355557	/nfs/dbraw/zinc/35/55/57/506355557.db2.gz	AMYMVWNCRTYYGK-UHFFFAOYSA-N	0	0	367.361	2.918	50	5		FFBARN
O=C1OC=C2Nc3cc4c(cc3[C@@H](c3ccc([N+](=O)[O-])cc3)C12)OCO4	ZINC000004053898	506357054	/nfs/dbraw/zinc/35/70/54/506357054.db2.gz	UFLARJIDXUFMBO-MRXNPFEDSA-N	0	0	352.302	2.692	50	5		FFBARN
CCOc1ccc(C(=O)Oc2cc(C)[nH]c(=O)c2[N+](=O)[O-])cc1OCC	ZINC000004248354	506366087	/nfs/dbraw/zinc/36/60/87/506366087.db2.gz	VGAZORBCXSCIDE-UHFFFAOYSA-N	0	0	362.338	2.608	50	5		FFBARN
Cc1c([N+](=O)[O-])c([N+](=O)[O-])nn1CC(=O)Nc1ccccc1C(F)(F)F	ZINC000004578189	506383921	/nfs/dbraw/zinc/38/39/21/506383921.db2.gz	VKJBFLBHCWJCBU-UHFFFAOYSA-N	0	0	373.247	2.665	50	5		FFBARN
Cc1ccc(-c2noc(CCNC(=O)c3ccc([N+](=O)[O-])cc3)n2)cc1	ZINC000035673130	506388941	/nfs/dbraw/zinc/38/89/41/506388941.db2.gz	AQTYUIOTDKXIPJ-UHFFFAOYSA-N	0	0	352.350	2.926	50	5		FFBARN
C[C@@H](CCc1ccccc1)Nc1c([N+](=O)[O-])nn(-c2ccccc2)[n+]1[O-]	ZINC000004807394	506394956	/nfs/dbraw/zinc/39/49/56/506394956.db2.gz	UEVHHEURSMYBKQ-AWEZNQCLSA-N	0	0	353.382	2.847	50	5		FFBARN
CCCCCOC(=O)C1C(C)=Nc2nnnn2[C@@H]1c1ccc([N+](=O)[O-])cc1	ZINC000004878505	506402893	/nfs/dbraw/zinc/40/28/93/506402893.db2.gz	CBMDBAWSGPOXKP-OAHLLOKOSA-N	0	0	372.385	2.604	50	5		FFBARN
Nc1nc(NC[C@H]2CCCO2)nc(Nc2cccc(Cl)c2)c1[N+](=O)[O-]	ZINC000005094201	506420455	/nfs/dbraw/zinc/42/04/55/506420455.db2.gz	AADOHPJLNNJGGG-LLVKDONJSA-N	0	0	364.793	2.955	50	5		FFBARN
O=c1c2cnn(-c3ccc(F)cc3)c2ncn1Cc1cccc([N+](=O)[O-])c1	ZINC000005139370	506424381	/nfs/dbraw/zinc/42/43/81/506424381.db2.gz	IXTUVYOIFCXLDB-UHFFFAOYSA-N	0	0	365.324	2.678	50	5		FFBARN
O=C(c1ccco1)N1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1	ZINC000005181405	506427117	/nfs/dbraw/zinc/42/71/17/506427117.db2.gz	ODZLZXCYTNVHAC-UHFFFAOYSA-N	0	0	358.379	2.760	50	5		FFBARN
NC(=O)c1ccc(N2CCN(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])c1	ZINC000005637995	506451559	/nfs/dbraw/zinc/45/15/59/506451559.db2.gz	IREQKSCFEMNBQY-UHFFFAOYSA-N	0	0	360.801	2.674	50	5		FFBARN
COc1ccc(NC=C2N=C(c3ccccc3F)OC2=O)c([N+](=O)[O-])c1	ZINC000006170308	506469607	/nfs/dbraw/zinc/46/96/07/506469607.db2.gz	BUICEWIFWXQIGH-ZROIWOOFSA-N	0	0	357.297	2.999	50	5		FFBARN
CCNc1ccc(C(=O)OCC(=O)NCc2ccc(C)cc2)cc1[N+](=O)[O-]	ZINC000006318877	506475585	/nfs/dbraw/zinc/47/55/85/506475585.db2.gz	DELIWSZKXUKAJS-UHFFFAOYSA-N	0	0	371.393	2.808	50	5		FFBARN
O=C(N1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1)C(F)(F)F	ZINC000006700760	506499159	/nfs/dbraw/zinc/49/91/59/506499159.db2.gz	SNTKABFEXCLYIE-UHFFFAOYSA-N	0	0	371.237	2.825	50	5		FFBARN
O=C(CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1)N1CCc2ccccc2C1	ZINC000006786729	506507602	/nfs/dbraw/zinc/50/76/02/506507602.db2.gz	NVVDOSCOUAEQLA-UHFFFAOYSA-N	0	0	373.796	2.563	50	5		FFBARN
COc1ccc(NC(C)=O)cc1NC(=O)CNc1cccc([N+](=O)[O-])c1	ZINC000007339892	506553670	/nfs/dbraw/zinc/55/36/70/506553670.db2.gz	NNKXXBSAAUSFPX-UHFFFAOYSA-N	0	0	358.354	2.612	50	5		FFBARN
O=C(NCCCNC(=O)c1ccc([N+](=O)[O-])cc1Cl)c1cccs1	ZINC000008402401	506647931	/nfs/dbraw/zinc/64/79/31/506647931.db2.gz	ZDJFEQFZQZEDGN-UHFFFAOYSA-N	0	0	367.814	2.860	50	5		FFBARN
CC(=O)N1CCN(c2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1	ZINC000008777190	506669031	/nfs/dbraw/zinc/66/90/31/506669031.db2.gz	ANVNOHKPYWNUCF-UHFFFAOYSA-N	0	0	351.712	2.936	50	5		FFBARN
Cc1c(NC(=O)CN2C(=O)CSc3ccccc32)cccc1[N+](=O)[O-]	ZINC000009691787	506709081	/nfs/dbraw/zinc/70/90/81/506709081.db2.gz	FYINEDKDJLPFEY-UHFFFAOYSA-N	0	0	357.391	2.981	50	5		FFBARN
Cc1ccnc(NC(=O)c2ccc(=O)n(Cc3cccc([N+](=O)[O-])c3)c2)c1	ZINC000010187973	506730296	/nfs/dbraw/zinc/73/02/96/506730296.db2.gz	QNTZVYBWFSIQCG-UHFFFAOYSA-N	0	0	364.361	2.761	50	5		FFBARN
CCn1nc(C(=O)N2CCc3ccc([N+](=O)[O-])cc32)c2ccccc2c1=O	ZINC000011655524	506785714	/nfs/dbraw/zinc/78/57/14/506785714.db2.gz	VQMSFAAEGAIKPO-UHFFFAOYSA-N	0	0	364.361	2.528	50	5		FFBARN
CCn1ccnc1S[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1OC	ZINC000011889034	506801187	/nfs/dbraw/zinc/80/11/87/506801187.db2.gz	PPOBIMFSRPEDOB-SNVBAGLBSA-N	0	0	350.400	2.939	50	5		FFBARN
Cc1ccc(CNC(=O)c2cc(N3CCOCC3)ccc2[N+](=O)[O-])cc1F	ZINC000012746571	506894208	/nfs/dbraw/zinc/89/42/08/506894208.db2.gz	YYVDNMSKXGEBKG-UHFFFAOYSA-N	0	0	373.384	2.809	50	5		FFBARN
Cc1ccc2ncn(Cc3cc([N+](=O)[O-])cc4c3OCOC4)c(=O)c2c1	ZINC000047369836	507317426	/nfs/dbraw/zinc/31/74/26/507317426.db2.gz	SYGGEKUUDTYFIZ-UHFFFAOYSA-N	0	0	353.334	2.528	50	5		FFBARN
O=C(COc1cccc([N+](=O)[O-])c1)Nc1cccc(Cn2ccnc2)c1	ZINC000025181020	507472334	/nfs/dbraw/zinc/47/23/34/507472334.db2.gz	ZKBWBPSZFYUPEC-UHFFFAOYSA-N	0	0	352.350	2.857	50	5		FFBARN
CCOc1ccc(-c2nn3c(=S)nc4ccccc4c3[nH]c2=O)cc1	ZINC000071924198	507724971	/nfs/dbraw/zinc/72/49/71/507724971.db2.gz	JZXLFBUCZAAIIU-UHFFFAOYSA-N	0	0	350.403	2.992	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccc([N+](=O)[O-])cc1[N+](=O)[O-]	ZINC000072400616	507783204	/nfs/dbraw/zinc/78/32/04/507783204.db2.gz	FAFWLBOSKDZHKI-UHFFFAOYSA-N	0	0	362.210	2.550	50	5	in-vitro	FFBARN
CCOCc1ccccc1CNS(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000030519338	507809592	/nfs/dbraw/zinc/80/95/92/507809592.db2.gz	GFVMFDHPMBUHAC-UHFFFAOYSA-N	0	0	350.396	2.610	50	5		FFBARN
COc1cccc(N2CC[C@H](C[NH2+]Cc3cc([O-])ccc3[N+](=O)[O-])C2)c1	ZINC000079046040	507927750	/nfs/dbraw/zinc/92/77/50/507927750.db2.gz	DEECICJYKMMRAY-CQSZACIVSA-N	0	0	357.410	2.925	50	5		FFBARN
O=C(c1ccc([N+](=O)[O-])cc1Cl)N1CCC[C@@H]1[C@@H](O)C(F)(F)F	ZINC000084351134	508275142	/nfs/dbraw/zinc/27/51/42/508275142.db2.gz	ICVYXCARHZLITJ-GHMZBOCLSA-N	0	0	352.696	2.776	50	5		FFBARN
COC(=O)[C@@H]1C[C@H]2CCCC[C@H]2N1Cn1ncc2cc([N+](=O)[O-])ccc21	ZINC000245224694	509885109	/nfs/dbraw/zinc/88/51/09/509885109.db2.gz	BRTBDCZMCJQSEH-VMGRFDJRSA-N	0	0	358.398	2.708	50	5		FFBARN
COc1ccccc1NC(=O)COc1ccc(/C=C\[N+](=O)[O-])cc1OC	ZINC000004844871	518169887	/nfs/dbraw/zinc/16/98/87/518169887.db2.gz	HZLQAFLPOXBDTG-KTKRTIGZSA-N	0	0	358.350	2.969	50	5		FFBARN
CC(C)(C(=O)N1CCN(c2ccc([N+](=O)[O-])cn2)CC1)c1ccccc1	ZINC000012907097	535023116	/nfs/dbraw/zinc/02/31/16/535023116.db2.gz	QOBWNFJRZAMALW-UHFFFAOYSA-N	0	0	354.410	2.616	50	5		FFBARN
C[C@@H](C(=O)N1[C@H](C)CCC[C@@H]1C)N1CCN(c2ccc([N+](=O)[O-])cc2)CC1	ZINC000104887736	570864123	/nfs/dbraw/zinc/86/41/23/570864123.db2.gz	GZNWYFRJXODHLJ-BBWFWOEESA-N	0	0	374.485	2.895	50	5		FFBARN
C/C=C(\C(=O)OCc1ccc([N+](=O)[O-])cc1)N1C(=O)c2ccccc2C1=O	ZINC000000689860	219314117	/nfs/dbraw/zinc/31/41/17/219314117.db2.gz	NXGYZDFEJQLMRA-APQPDGGLSA-N	0	0	366.329	2.838	50	5		FFBARN
CC1=C(C(=O)Nc2ccccc2)[C@H](c2ccc([N+](=O)[O-])cc2)NC(=O)N1	ZINC000000845699	219329594	/nfs/dbraw/zinc/32/95/94/219329594.db2.gz	DIMRIHQLQXFZIA-INIZCTEOSA-N	0	0	352.350	2.861	50	5		FFBARN
CC(C)(C)NC(=O)c1cccc(N2C(=O)c3cccc([N+](=O)[O-])c3C2=O)c1	ZINC000001201639	219388037	/nfs/dbraw/zinc/38/80/37/219388037.db2.gz	SBZRPAILPABNES-UHFFFAOYSA-N	0	0	367.361	2.924	50	5		FFBARN
C[C@@H](Oc1cc(F)ccc1[N+](=O)[O-])C(=O)Nc1ccc2c(c1)OCCO2	ZINC000003514719	219516216	/nfs/dbraw/zinc/51/62/16/219516216.db2.gz	UBIXWXRIMDOWPB-SNVBAGLBSA-N	0	0	362.313	2.911	50	5		FFBARN
CCOC(=O)c1c(NC(=O)c2cc(C)on2)c2cc([N+](=O)[O-])ccc2n1C	ZINC000004307621	219563756	/nfs/dbraw/zinc/56/37/56/219563756.db2.gz	TXYZJUYONKONNO-UHFFFAOYSA-N	0	0	372.337	2.812	50	5		FFBARN
COc1ccccc1NC(=O)c1cc2cc([N+](=O)[O-])cc(OC)c2oc1=O	ZINC000004742613	219603815	/nfs/dbraw/zinc/60/38/15/219603815.db2.gz	VQCNCABNLFYSLM-UHFFFAOYSA-N	0	0	370.317	2.971	50	5		FFBARN
CNc1ccccc1C(=O)OCC(=O)Nc1cc(OC)c([N+](=O)[O-])cc1C	ZINC000004826414	219609868	/nfs/dbraw/zinc/60/98/68/219609868.db2.gz	YPOKQEKKMIVWFN-UHFFFAOYSA-N	0	0	373.365	2.749	50	5		FFBARN
COc1ccc(S(=O)(=O)n2c(C)ncc2[N+](=O)[O-])cc1C(C)(C)C	ZINC000004937464	219626935	/nfs/dbraw/zinc/62/69/35/219626935.db2.gz	ZUJRENWIZSFROR-UHFFFAOYSA-N	0	0	353.400	2.643	50	5		FFBARN
Cc1ccc(Nc2nc(NC[C@H]3CCCO3)nc(N)c2[N+](=O)[O-])cc1C	ZINC000005100915	219649892	/nfs/dbraw/zinc/64/98/92/219649892.db2.gz	CHQQAIWDGSVMBJ-CYBMUJFWSA-N	0	0	358.402	2.918	50	5		FFBARN
Cn1c2ccccc2nc1SCC(=O)NC(=O)c1cccc([N+](=O)[O-])c1	ZINC000012537807	220004817	/nfs/dbraw/zinc/00/48/17/220004817.db2.gz	RFTJITLLQOSGHX-UHFFFAOYSA-N	0	0	370.390	2.530	50	5		FFBARN
CC(=O)N1CCc2cc(NC(=O)COc3ccc([N+](=O)[O-])cc3)ccc21	ZINC000012864556	220036959	/nfs/dbraw/zinc/03/69/59/220036959.db2.gz	KUQAWZZODYGSKP-UHFFFAOYSA-N	0	0	355.350	2.521	50	5		FFBARN
O=C(/C=C/c1ccccc1[N+](=O)[O-])N1CCN(Cc2ccccc2)CC1	ZINC000015345317	220152772	/nfs/dbraw/zinc/15/27/72/220152772.db2.gz	BXKHMHZEBAUFHU-ZHACJKMWSA-N	0	0	351.406	2.952	50	5		FFBARN
Cc1ccc(C(=O)Nc2c(C)nc3c(C)cccn3c2=O)cc1[N+](=O)[O-]	ZINC000015865278	220169711	/nfs/dbraw/zinc/16/97/11/220169711.db2.gz	DDOJNRYMNBVJFU-UHFFFAOYSA-N	0	0	352.350	2.780	50	5		FFBARN
COc1ccc(C(=O)CSc2n[nH]c(-c3ccncc3)n2)cc1[N+](=O)[O-]	ZINC000018115974	220223471	/nfs/dbraw/zinc/22/34/71/220223471.db2.gz	QWVZQTKGZKJXIP-UHFFFAOYSA-N	0	0	371.378	2.759	50	5		FFBARN
CC(C)c1onc(C(=O)N2CCN(Cc3ccccc3)CC2)c1[N+](=O)[O-]	ZINC000020285405	220319843	/nfs/dbraw/zinc/31/98/43/220319843.db2.gz	LANGVIPZIQGPJB-UHFFFAOYSA-N	0	0	358.398	2.664	50	5		FFBARN
CC(=O)N1N=C(c2ccc([N+](=O)[O-])cc2)O[C@H]1c1ccc([N+](=O)[O-])cc1	ZINC000020945992	220346496	/nfs/dbraw/zinc/34/64/96/220346496.db2.gz	ARYSLTABGDLXAB-INIZCTEOSA-N	0	0	356.294	2.742	50	5		FFBARN
COc1ccc(OC)c(C(=O)COC(=O)c2c(C)cccc2[N+](=O)[O-])c1	ZINC000022003906	220373825	/nfs/dbraw/zinc/37/38/25/220373825.db2.gz	SUBWOPJLRZPSFW-UHFFFAOYSA-N	0	0	359.334	2.960	50	5		FFBARN
Cc1nn(C[C@H](O)COc2cccc(C(F)(F)F)c2)c(C)c1[N+](=O)[O-]	ZINC000058160923	221100667	/nfs/dbraw/zinc/10/06/67/221100667.db2.gz	HRGKHVYTIWXQHJ-LBPRGKRZSA-N	0	0	359.304	2.867	50	5		FFBARN
CNC(=O)c1ccc(N[C@H](C)COc2ccccc2OC)c([N+](=O)[O-])c1	ZINC000058172319	221102741	/nfs/dbraw/zinc/10/27/41/221102741.db2.gz	JDQWFXALXZUOJI-GFCCVEGCSA-N	0	0	359.382	2.842	50	5		FFBARN
CNC(=O)c1cc(Cl)ccc1NC(=O)c1ccc(NC)c([N+](=O)[O-])c1	ZINC000058248120	221111543	/nfs/dbraw/zinc/11/15/43/221111543.db2.gz	PHANVSJYDJEATK-UHFFFAOYSA-N	0	0	362.773	2.902	50	5		FFBARN
COc1ccc([N+](=O)[O-])cc1CSc1nnc(N2CCOCC2)s1	ZINC000058358114	221115478	/nfs/dbraw/zinc/11/54/78/221115478.db2.gz	IQWKXHKHJVDAJB-UHFFFAOYSA-N	0	0	368.440	2.584	50	5		FFBARN
Cc1ccc([N+](=O)[O-])cc1NC(=O)N1CCNC(=O)C[C@H]1c1ccccc1	ZINC000065552232	221232337	/nfs/dbraw/zinc/23/23/37/221232337.db2.gz	UDALQDAVGPXFMW-KRWDZBQOSA-N	0	0	368.393	2.998	50	5		FFBARN
C[C@@H]1CCN2c3ccc([N+](=O)[O-])cc3CC3(C(=O)OC(C)(C)OC3=O)[C@H]2C1	ZINC000245324821	132376629	/nfs/dbraw/zinc/37/66/29/132376629.db2.gz	ACHWJVLPCCQNFU-IAQYHMDHSA-N	0	0	374.393	2.578	50	5		FFBARN
COc1ccc(C(=O)Nc2ccccc2N2CCOCC2)cc1[N+](=O)[O-]	ZINC000001113662	132380236	/nfs/dbraw/zinc/38/02/36/132380236.db2.gz	SFJJYELEPFGWSA-UHFFFAOYSA-N	0	0	357.366	2.692	50	5		FFBARN
C[C@@H]1CCCN(c2nc(NCCc3ccccc3)nc(N)c2[N+](=O)[O-])C1	ZINC000005159015	132827186	/nfs/dbraw/zinc/82/71/86/132827186.db2.gz	YAPPHPYDVHGGIW-CYBMUJFWSA-N	0	0	356.430	2.858	50	5		FFBARN
O=C(CN1C(=O)COc2ccc([N+](=O)[O-])cc21)N(C1CC1)C1CCCCC1	ZINC000045490159	132951888	/nfs/dbraw/zinc/95/18/88/132951888.db2.gz	YVYDGOZINARKJD-UHFFFAOYSA-N	0	0	373.409	2.644	50	5		FFBARN
O=C(Nc1ccc(Cl)cn1)[C@H]1CCCN(c2ncccc2[N+](=O)[O-])C1	ZINC000047254605	136122784	/nfs/dbraw/zinc/12/27/84/136122784.db2.gz	RUGQCLOPRATAQH-NSHDSACASA-N	0	0	361.789	2.893	50	5		FFBARN
Cc1cc(N2CCC3(CC2)OCCO3)nc(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000054389817	136125513	/nfs/dbraw/zinc/12/55/13/136125513.db2.gz	VVPNSBKBMRJFLE-UHFFFAOYSA-N	0	0	356.382	2.704	50	5		FFBARN
CC(C)(C)C1CCN(S(=O)(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1	ZINC000089642969	221741078	/nfs/dbraw/zinc/74/10/78/221741078.db2.gz	KFYMLZBGNGGSMP-UHFFFAOYSA-N	0	0	367.471	2.960	50	5		FFBARN
CC(C)CSCCN1C(=O)N[C@@](C)(c2ccc([N+](=O)[O-])cc2)C1=O	ZINC000095446967	221905065	/nfs/dbraw/zinc/90/50/65/221905065.db2.gz	WCACOVMKXZBUJG-INIZCTEOSA-N	0	0	351.428	2.751	50	5		FFBARN
Cc1[nH]nc(C(=O)OCc2ccc(F)cc2Br)c1[N+](=O)[O-]	ZINC000096012738	221991996	/nfs/dbraw/zinc/99/19/96/221991996.db2.gz	CUJQZAZOESMAHF-UHFFFAOYSA-N	0	0	358.123	2.885	50	5		FFBARN
C[C@@H]1CN(S(=O)(=O)c2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1	ZINC000107135326	222390605	/nfs/dbraw/zinc/39/06/05/222390605.db2.gz	UHSCZITXVCPKMP-DYVFJYSZSA-N	0	0	362.407	2.746	50	5		FFBARN
Cc1noc(-c2ccccc2OCC(=O)Nc2cccc([N+](=O)[O-])c2)n1	ZINC000008586923	263356696	/nfs/dbraw/zinc/35/66/96/263356696.db2.gz	XWUAONDIABWHSU-UHFFFAOYSA-N	0	0	354.322	2.971	50	5		FFBARN
C[C@H]1C[C@H](OC(=O)c2ccc(N3CCCCCC3)c([N+](=O)[O-])c2)C(=O)O1	ZINC000032736104	506288407	/nfs/dbraw/zinc/28/84/07/506288407.db2.gz	XORVIMMOUXEBFR-LRDDRELGSA-N	0	0	362.382	2.836	50	5		FFBARN
COc1ccc(OC)c([C@@H](C)NS(=O)(=O)c2ccc([N+](=O)[O-])cc2)c1	ZINC000002781346	506293256	/nfs/dbraw/zinc/29/32/56/506293256.db2.gz	SMFJOJSHMQWUBA-LLVKDONJSA-N	0	0	366.395	2.652	50	5		FFBARN
O=C(NOCc1ccccc1)c1ccc(Cn2cc([N+](=O)[O-])cn2)cc1	ZINC000002794312	506292919	/nfs/dbraw/zinc/29/29/19/506292919.db2.gz	KWZWYZKFDHIJKO-UHFFFAOYSA-N	0	0	352.350	2.701	50	5		FFBARN
Cc1nc2ccccc2nc1CCNC(=O)COc1ccc([N+](=O)[O-])cc1	ZINC000032818977	506298754	/nfs/dbraw/zinc/29/87/54/506298754.db2.gz	UXOKQGSAAKNEGB-UHFFFAOYSA-N	0	0	366.377	2.584	50	5		FFBARN
CCN(CC)C(=O)CN1CCCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1	ZINC000032809890	506299178	/nfs/dbraw/zinc/29/91/78/506299178.db2.gz	NNLOVROZLYRZSA-UHFFFAOYSA-N	0	0	368.865	2.629	50	5		FFBARN
COC(=O)c1ccc(S(=O)(=O)c2ccc(Cl)cc2)c([N+](=O)[O-])c1	ZINC000003028978	506306781	/nfs/dbraw/zinc/30/67/81/506306781.db2.gz	GUCNDGIQGPKICW-UHFFFAOYSA-N	0	0	355.755	2.868	50	5		FFBARN
CC(C)(C)NS(=O)(=O)c1ccc(N2CCCSCC2)c([N+](=O)[O-])c1	ZINC000065612831	506334573	/nfs/dbraw/zinc/33/45/73/506334573.db2.gz	DBXHOVKBGLLBIX-UHFFFAOYSA-N	0	0	373.500	2.615	50	5		FFBARN
Cc1[nH]c2ccccc2c1C(=O)CN1C(=O)c2ccc([N+](=O)[O-])cc2C1=O	ZINC000003602196	506345516	/nfs/dbraw/zinc/34/55/16/506345516.db2.gz	QNFLYQSHTSHLDQ-UHFFFAOYSA-N	0	0	363.329	2.863	50	5		FFBARN
COCCNc1ccc(-c2nn(C)c(=O)c3ccccc32)cc1[N+](=O)[O-]	ZINC000004164423	506362333	/nfs/dbraw/zinc/36/23/33/506362333.db2.gz	IMOQBLIKAYXTAO-UHFFFAOYSA-N	0	0	354.366	2.567	50	5		FFBARN
CCn1cc(Br)c(C(=O)Nc2ccc([N+](=O)[O-])cc2OC)n1	ZINC000004185926	506364009	/nfs/dbraw/zinc/36/40/09/506364009.db2.gz	WXLGCCFRFVYARH-UHFFFAOYSA-N	0	0	369.175	2.835	50	5		FFBARN
Cc1ccc(N2C[C@@H](NC(=O)c3ccc(C)c([N+](=O)[O-])c3)CC2=O)cc1	ZINC000004496978	506378100	/nfs/dbraw/zinc/37/81/00/506378100.db2.gz	BSBAYAVOQRCQLD-HNNXBMFYSA-N	0	0	353.378	2.747	50	5		FFBARN
O=C(Nc1ccc(F)c([N+](=O)[O-])c1)[C@H]1CC(=O)N(c2ccc(F)cc2)C1	ZINC000004732007	506390970	/nfs/dbraw/zinc/39/09/70/506390970.db2.gz	DNFDTQYMAZDDGR-JTQLQIEISA-N	0	0	361.304	2.865	50	5		FFBARN
CCOC(=O)CCc1cc2c3ccccc3oc(=O)c2c(NC(C)=O)n1	ZINC000004742918	506391400	/nfs/dbraw/zinc/39/14/00/506391400.db2.gz	AYNXWODCVPAVON-UHFFFAOYSA-N	0	0	354.362	2.795	50	5		FFBARN
O=C(/C=C(\c1ccccc1)N1CCOCC1)Nc1ccc([N+](=O)[O-])cc1	ZINC000004812052	506395657	/nfs/dbraw/zinc/39/56/57/506395657.db2.gz	GLWIZCWLGOTQJV-NBVRZTHBSA-N	0	0	353.378	2.907	50	5		FFBARN
COc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2N2CCN(C)CC2)cc1	ZINC000005049782	506417452	/nfs/dbraw/zinc/41/74/52/506417452.db2.gz	GQYVNBZYWISKPY-UHFFFAOYSA-N	0	0	370.409	2.608	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)COC(=O)c1sccc1C	ZINC000005110686	506423086	/nfs/dbraw/zinc/42/30/86/506423086.db2.gz	IQZYBXHWBCAQSA-UHFFFAOYSA-N	0	0	350.352	2.769	50	5		FFBARN
O=C(COC(=O)c1ccccc1O)Nc1ccc([N+](=O)[O-])cc1Cl	ZINC000005783805	506456603	/nfs/dbraw/zinc/45/66/03/506456603.db2.gz	HUBJCGLEJUDYHV-UHFFFAOYSA-N	0	0	350.714	2.749	50	5		FFBARN
Cc1nn(CC(=O)OCC(=O)c2ccc(Cl)s2)c(C)c1[N+](=O)[O-]	ZINC000006070850	506466605	/nfs/dbraw/zinc/46/66/05/506466605.db2.gz	VIUTXJXUHSAYFM-UHFFFAOYSA-N	0	0	357.775	2.549	50	5		FFBARN
Cc1ccccc1COC(=O)CCN1C(=O)c2cccc([N+](=O)[O-])c2C1=O	ZINC000006082955	506466772	/nfs/dbraw/zinc/46/67/72/506466772.db2.gz	UYMQIOSYGQKMHE-UHFFFAOYSA-N	0	0	368.345	2.633	50	5		FFBARN
O=C(/C=C/c1ccco1)OCC(=O)Nc1nc2ccc([N+](=O)[O-])cc2s1	ZINC000006561721	506489556	/nfs/dbraw/zinc/48/95/56/506489556.db2.gz	PGENCDOCGQKBTC-GQCTYLIASA-N	0	0	373.346	2.993	50	5		FFBARN
CNc1ncnc2c1C(c1cccc([N+](=O)[O-])c1)c1c(NC)ncnc1O2	ZINC000006857755	506512513	/nfs/dbraw/zinc/51/25/13/506512513.db2.gz	LGYRXFBMENOWLP-UHFFFAOYSA-N	0	0	365.353	2.544	50	5		FFBARN
O=C(C=Cc1ccccc1[N+](=O)[O-])OCC(=O)c1ccc2c(c1)OCO2	ZINC000006947026	506518987	/nfs/dbraw/zinc/51/89/87/506518987.db2.gz	KFVPQYVRTCZARP-SOFGYWHQSA-N	0	0	355.302	2.763	50	5		FFBARN
Nc1ccc(NS(=O)(=O)c2ccc(C(F)(F)F)cc2)cc1[N+](=O)[O-]	ZINC000007357431	506556404	/nfs/dbraw/zinc/55/64/04/506556404.db2.gz	GDNRRFLZGGODMP-UHFFFAOYSA-N	0	0	361.301	2.997	50	5		FFBARN
C[C@H](C(=O)Nc1ccc(F)cc1)S(=O)(=O)c1ccc([N+](=O)[O-])cc1	ZINC000007400520	506560257	/nfs/dbraw/zinc/56/02/57/506560257.db2.gz	VEOCWHNCHDGZED-SNVBAGLBSA-N	0	0	352.343	2.535	50	5		FFBARN
Cc1ccc(OCC(=O)OCC(=O)Nc2ccc(C)cc2[N+](=O)[O-])cc1	ZINC000007777171	506589954	/nfs/dbraw/zinc/58/99/54/506589954.db2.gz	UTVUCCOBMZLCBZ-UHFFFAOYSA-N	0	0	358.350	2.772	50	5		FFBARN
COc1cc([N+](=O)[O-])ccc1NC(=O)[C@H]1CC(=O)N(C2CCCCC2)C1	ZINC000009095370	506681347	/nfs/dbraw/zinc/68/13/47/506681347.db2.gz	AMDZRNDCEUFLMT-LBPRGKRZSA-N	0	0	361.398	2.723	50	5		FFBARN
CCn1c2ccccc2nc1NC(=O)c1ccc(N(C)C)c([N+](=O)[O-])c1	ZINC000010651209	506750120	/nfs/dbraw/zinc/75/01/20/506750120.db2.gz	UFRGHBNGNXTSNG-UHFFFAOYSA-N	0	0	353.382	2.705	50	5		FFBARN
Cc1c(NCC(=O)Nc2cccc(C(=O)NC3CC3)c2)cccc1[N+](=O)[O-]	ZINC000011550139	506782089	/nfs/dbraw/zinc/78/20/89/506782089.db2.gz	AYEZXLYZIYUTGH-UHFFFAOYSA-N	0	0	368.393	2.846	50	5		FFBARN
Cc1ccc(-c2nnc(CNC(=O)COc3ccccc3[N+](=O)[O-])o2)cc1	ZINC000046085566	507074870	/nfs/dbraw/zinc/07/48/70/507074870.db2.gz	DQHCJBHKBKJRRQ-UHFFFAOYSA-N	0	0	368.349	2.648	50	5		FFBARN
COC(=O)COc1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)s2)c1	ZINC000024953095	507452227	/nfs/dbraw/zinc/45/22/27/507452227.db2.gz	BNBJSYLCRHYCEX-UHFFFAOYSA-N	0	0	350.352	2.769	50	5		FFBARN
CCOc1ccc(C(=O)Nc2cccnc2-n2cccn2)cc1[N+](=O)[O-]	ZINC000025010305	507459808	/nfs/dbraw/zinc/45/98/08/507459808.db2.gz	CVRDRYSIMBYGRG-UHFFFAOYSA-N	0	0	353.338	2.827	50	5		FFBARN
Cc1csc2nc(COC(=O)c3ccc(C)c([N+](=O)[O-])c3)cc(=O)n12	ZINC000025187332	507474995	/nfs/dbraw/zinc/47/49/95/507474995.db2.gz	GNLYZTJWYMEFKH-UHFFFAOYSA-N	0	0	359.363	2.638	50	5		FFBARN
CCOC(=O)CCN(Cc1cccnc1)C(=O)c1ccc(C)c([N+](=O)[O-])c1	ZINC000060098242	507514041	/nfs/dbraw/zinc/51/40/41/507514041.db2.gz	SORGJQQWHKOHAG-UHFFFAOYSA-N	0	0	371.393	2.894	50	5		FFBARN
Cn1cnc([N+](=O)[O-])c1NCc1ccc(C(=O)N2CCCCCC2)cc1	ZINC000029625277	507784582	/nfs/dbraw/zinc/78/45/82/507784582.db2.gz	SHHWMQNGLCKWMJ-UHFFFAOYSA-N	0	0	357.414	2.957	50	5		FFBARN
CC[C@@H](C)N(CC(=O)OC(C)(C)C)C(=O)c1cccc([N+](=O)[O-])c1N	ZINC000089942262	507888328	/nfs/dbraw/zinc/88/83/28/507888328.db2.gz	NKFICAAIQLJONM-LLVKDONJSA-N	0	0	351.403	2.759	50	5		FFBARN
CNC(=O)c1ccc(N(C[C@H](O)c2ccc(F)cc2)C2CC2)c([N+](=O)[O-])c1	ZINC000079063911	507929504	/nfs/dbraw/zinc/92/95/04/507929504.db2.gz	DUBHVLQSGJKYHF-SFHVURJKSA-N	0	0	373.384	2.796	50	5		FFBARN
CC(C)(O)C(C)(C)Nc1ccc(S(=O)(=O)C(F)(F)F)cc1[N+](=O)[O-]	ZINC000095997025	508200851	/nfs/dbraw/zinc/20/08/51/508200851.db2.gz	BBFOQKAEAVNFIX-UHFFFAOYSA-N	0	0	370.349	2.850	50	5		FFBARN
COc1ccc(NC(=O)[C@H](c2cccc([N+](=O)[O-])c2)N2CCOCC2)cc1	ZINC000096602153	508215144	/nfs/dbraw/zinc/21/51/44/508215144.db2.gz	SCNHRRIFRQDCJH-SFHVURJKSA-N	0	0	371.393	2.615	50	5		FFBARN
NC(=O)c1c2c(sc1C(=O)Nc1ccc([N+](=O)[O-])s1)CCCC2	ZINC000225548395	509376473	/nfs/dbraw/zinc/37/64/73/509376473.db2.gz	DUEUWPKNRMBBFW-UHFFFAOYSA-N	0	0	351.409	2.948	50	5		FFBARN
COC(=O)N1CCC([C@@H](C)NC(=O)c2cc([N+](=O)[O-])c(C)s2)CC1	ZINC000170600790	509676299	/nfs/dbraw/zinc/67/62/99/509676299.db2.gz	CNGHCPGQXMQKCP-SECBINFHSA-N	0	0	355.416	2.561	50	5		FFBARN
CCOC(=O)c1cc(C(=O)n2ccccc2=NC(C)C)cc([N+](=O)[O-])c1	ZINC000252457549	509836565	/nfs/dbraw/zinc/83/65/65/509836565.db2.gz	QPRKFRSFGDCUPD-UHFFFAOYSA-N	0	0	357.366	2.571	50	5		FFBARN
COc1cccc(CN2CCN(C(=O)Nc3ccc([N+](=O)[O-])cc3)CC2)c1	ZINC000020274201	525942749	/nfs/dbraw/zinc/94/27/49/525942749.db2.gz	IVVOJLJNYYBAOM-UHFFFAOYSA-N	0	0	370.409	2.953	50	5		FFBARN
O=C(CNC(=O)c1c(Cl)cccc1[N+](=O)[O-])NCC1(C2CC2)CCC1	ZINC000089768009	526850354	/nfs/dbraw/zinc/85/03/54/526850354.db2.gz	OPFOVJCHWQLPJJ-UHFFFAOYSA-N	0	0	365.817	2.675	50	5		FFBARN
O=[N+]([O-])c1c2nonc2c(Sc2nc3ccccc3o2)cc1NCCO	ZINC000020680016	527323551	/nfs/dbraw/zinc/32/35/51/527323551.db2.gz	RGDCVNXAVHYXLQ-UHFFFAOYSA-N	0	0	373.350	2.828	50	5		FFBARN