smiles	zinc_id	prot_id	files.db2	substance.inchikey	net_charge	ph_mod_fk	substance.mwt	substance.logp	purchasable	reactive	features	tranche_name
CC1(C)C[C@@H]([NH2+]CCN2CCC([NH3+])CC2)c2cc([N+](=O)[O-])ccc21	ZINC000925813378	1206156853	/nfs/dbraw/zinc/15/68/53/1206156853.db2.gz	UPIRWUOCZHQNME-QGZVFWFLSA-N	2	0	332.448	2.330	10	5		EEBERP
CC[NH+]1CCN(CCC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872021338	1198027961	/nfs/dbraw/zinc/02/79/61/1198027961.db2.gz	BRXOZVLOZVTSFO-CQSZACIVSA-N	2	0	338.427	2.412	10	5		EEBERP
COC[C@H](CCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000423091825	240361469	/nfs/dbraw/zinc/36/14/69/240361469.db2.gz	YZGGQMBKTLXFBU-LBPRGKRZSA-N	2	0	335.326	2.457	10	5		EEBERP
CC(C)C[N@H+](C)CCCNCc1cc2c(cc1[N+](=O)[O-])OCCO2	ZINC000593646760	469077899	/nfs/dbraw/zinc/07/78/99/469077899.db2.gz	REXXIYNSUVAOKD-UHFFFAOYSA-N	2	0	337.420	2.434	10	5		EEBERP
C[C@@H]([NH2+]C[C@H](C)CN1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872031404	1198030358	/nfs/dbraw/zinc/03/03/58/1198030358.db2.gz	JMQGAZUXSXJUDP-UONOGXRCSA-N	2	0	338.427	2.268	10	5		EEBERP
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1	ZINC000923390179	789476262	/nfs/dbraw/zinc/47/62/62/789476262.db2.gz	UGWNSKMHIDHNHR-AEFFLSMTSA-N	2	0	333.432	2.340	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@]2(C1)CCCC[NH2+]2	ZINC000923537863	789741198	/nfs/dbraw/zinc/74/11/98/789741198.db2.gz	DZDBPRSMUCDUMJ-SFHVURJKSA-N	2	0	346.431	2.450	10	5		EEBERP
Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000925879503	1206163654	/nfs/dbraw/zinc/16/36/54/1206163654.db2.gz	GCUXUNAEXHSMFA-IVMMDQJWSA-N	2	0	329.404	2.135	10	5		EEBERP
Cc1nccn1C[C@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000246332506	160274592	/nfs/dbraw/zinc/27/45/92/160274592.db2.gz	SWKRWXFGQZKWMC-IAGOWNOFSA-N	2	0	330.388	2.298	10	5		EEBERP
C[N@@H+]1C[C@@]23CN(C[C@H](O)c4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3	ZINC001177009108	798693262	/nfs/dbraw/zinc/69/32/62/798693262.db2.gz	XPAUUVDLKBUVOD-GBESFXJTSA-N	2	0	345.443	2.436	10	5		EEBERP
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2	ZINC000925843442	1206159067	/nfs/dbraw/zinc/15/90/67/1206159067.db2.gz	QDOBNWYMSRSYJE-FDQGKXFDSA-N	2	0	346.431	2.434	10	5		EEBERP
[NH3+]C1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000600677917	468618778	/nfs/dbraw/zinc/61/87/78/468618778.db2.gz	LHTDZDFAPGVDGV-ZBFHGGJFSA-N	2	0	333.432	2.404	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1	ZINC000600763648	468651132	/nfs/dbraw/zinc/65/11/32/468651132.db2.gz	FZVQRPDOSMGNEB-KRWDZBQOSA-N	2	0	349.431	2.194	10	5		EEBERP
CN(c1ncnc(Nc2cc[nH+]cc2)c1[N+](=O)[O-])C1CC[NH+](C)CC1	ZINC000040586477	213354742	/nfs/dbraw/zinc/35/47/42/213354742.db2.gz	MTAQBFPXISELSC-UHFFFAOYSA-N	2	0	343.391	2.054	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1	ZINC000593731217	469112548	/nfs/dbraw/zinc/11/25/48/469112548.db2.gz	UQEGUABIWUXKBT-KYJSFNMBSA-N	2	0	349.431	2.464	10	5		EEBERP
C[NH+](C)CCC(=O)N[C@H]1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001267929845	1180779828	/nfs/dbraw/zinc/77/98/28/1180779828.db2.gz	SHDLBSFMMNNOCL-WKILWMFISA-N	2	0	348.447	2.064	10	5		EEBERP
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@@H]1CCC[NH2+]C1	ZINC000414835967	313100544	/nfs/dbraw/zinc/10/05/44/313100544.db2.gz	IXACSRMLFHGVAM-KGLIPLIRSA-N	2	0	334.420	2.291	10	5		EEBERP
Cn1cc(C[NH2+]CCCC[NH+](C)C)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000263842511	464213266	/nfs/dbraw/zinc/21/32/66/464213266.db2.gz	YNRHDCOKYVBTQN-UHFFFAOYSA-N	2	0	331.420	2.427	10	5		EEBERP
O=[N+]([O-])c1c(NC[C@H]2CCC[N@H+]2CCCO)ccc2cnccc21	ZINC000599086318	469113282	/nfs/dbraw/zinc/11/32/82/469113282.db2.gz	JKQBMKBXYFUBSB-CQSZACIVSA-N	2	0	330.388	2.402	10	5		EEBERP
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](n2cc(C[NH3+])nn2)C1	ZINC000420385710	467389224	/nfs/dbraw/zinc/38/92/24/467389224.db2.gz	UELCJNBUSMVVOR-MLGOLLRUSA-N	2	0	330.392	2.043	10	5		EEBERP
O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)n1	ZINC000925842162	1206159290	/nfs/dbraw/zinc/15/92/90/1206159290.db2.gz	XJFHGDVIRJRGIJ-LJIGWXMPSA-N	2	0	333.436	2.397	10	5		EEBERP
COc1cc(C[NH+]2CCC(C[NH+]3CCOCC3)CC2)ccc1[N+](=O)[O-]	ZINC000351970944	162008379	/nfs/dbraw/zinc/00/83/79/162008379.db2.gz	MJVPFRSJDHYWEB-UHFFFAOYSA-N	2	0	349.431	2.148	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1	ZINC000600768884	468652705	/nfs/dbraw/zinc/65/27/05/468652705.db2.gz	ZKUIFOHJBDCOOY-SFHVURJKSA-N	2	0	333.432	2.228	10	5		EEBERP
Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1	ZINC000925879502	1206163645	/nfs/dbraw/zinc/16/36/45/1206163645.db2.gz	GCUXUNAEXHSMFA-INWMFGNUSA-N	2	0	329.404	2.135	10	5		EEBERP
Cc1ccc(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1[N+](=O)[O-]	ZINC000600774364	468654153	/nfs/dbraw/zinc/65/41/53/468654153.db2.gz	PSXNGASPDZXNDR-QGZVFWFLSA-N	2	0	333.432	2.494	10	5		EEBERP
C[NH+](C)C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2Cl)C[C@H]1C[NH+](C)C	ZINC000866012714	1198454268	/nfs/dbraw/zinc/45/42/68/1198454268.db2.gz	ONOBOSGCAIKDIC-CHWSQXEVSA-N	2	0	340.855	2.424	10	5		EEBERP
CC[NH+]1CCN([C@H]2CC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000245924489	243171228	/nfs/dbraw/zinc/17/12/28/243171228.db2.gz	NXGVHYGBCQCVSC-QAPCUYQASA-N	2	0	332.448	2.368	10	5		EEBERP
CN1CCN([C@H]2CCCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000174898193	464466739	/nfs/dbraw/zinc/46/67/39/464466739.db2.gz	SRSBJNUAMCBAER-IBGZPJMESA-N	2	0	346.475	2.239	10	5		EEBERP
O=[N+]([O-])c1cccc(OCC[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)c1	ZINC000600768512	468652068	/nfs/dbraw/zinc/65/20/68/468652068.db2.gz	XCGMCXGVSVDNOH-GOSISDBHSA-N	2	0	349.431	2.064	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1	ZINC000600777302	468654953	/nfs/dbraw/zinc/65/49/53/468654953.db2.gz	ZHVMOKQOJACGHN-SFHVURJKSA-N	2	0	333.432	2.494	10	5		EEBERP
Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000925879387	1206163571	/nfs/dbraw/zinc/16/35/71/1206163571.db2.gz	CURJMOGCJSIOHK-INWMFGNUSA-N	2	0	329.404	2.135	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@H+]3CC[C@@H](CO)C3)CC2)cc1	ZINC000952993407	796139562	/nfs/dbraw/zinc/13/95/62/796139562.db2.gz	GWJIZOUWTRBGDN-GOSISDBHSA-N	2	0	347.459	2.164	10	5		EEBERP
CC[N@H+](CCNC(=O)C1([NH+](C)C)CCC1)Cc1cccc([N+](=O)[O-])c1	ZINC001480979031	1179414209	/nfs/dbraw/zinc/41/42/09/1179414209.db2.gz	TVDWRSOJUXKEFD-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
Cc1c(CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)cccc1[N+](=O)[O-]	ZINC000903510955	1240741544	/nfs/dbraw/zinc/74/15/44/1240741544.db2.gz	VMBXWUUVGMTKOI-HDICACEKSA-N	2	0	344.459	2.304	10	5		EEBERP
CC(C)[C@H]([NH3+])CC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000596103379	469156295	/nfs/dbraw/zinc/15/62/95/469156295.db2.gz	JZACECWGEUKANY-MRXNPFEDSA-N	2	0	331.420	2.458	10	5		EEBERP
CC(C)[N@H+](C)CC(=O)NCC1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCC1	ZINC001280544563	1324288155	/nfs/dbraw/zinc/28/81/55/1324288155.db2.gz	BPXZDDRPHFSXTE-UHFFFAOYSA-N	2	0	348.447	2.064	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000600768882	468652555	/nfs/dbraw/zinc/65/25/55/468652555.db2.gz	ZKUIFOHJBDCOOY-GOSISDBHSA-N	2	0	333.432	2.228	10	5		EEBERP
C[C@@H](CN(C)CCC[NH+](C)C)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000595061502	468750677	/nfs/dbraw/zinc/75/06/77/468750677.db2.gz	LOBPBCYTJUFSIM-WMLDXEAASA-N	2	0	334.464	2.444	10	5		EEBERP
Cc1c(NC(=O)[C@H](C)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC001560056131	1342506420	/nfs/dbraw/zinc/50/64/20/1342506420.db2.gz	YYNFWRALCGXBMF-ZNMIVQPWSA-N	2	0	346.431	2.114	10	5		EEBERP
CC(C)[NH+]1CCN(CCC[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)CC1	ZINC000554550757	468419457	/nfs/dbraw/zinc/41/94/57/468419457.db2.gz	NYOAWSZLJZMPKW-UHFFFAOYSA-N	2	0	346.475	2.369	10	5		EEBERP
O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1	ZINC000594973042	468734758	/nfs/dbraw/zinc/73/47/58/468734758.db2.gz	BYDNQUGJOIMVOD-IBGZPJMESA-N	2	0	341.411	2.451	10	5		EEBERP
CN(CC[NH2+]Cc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)[NH+]1CCCC1	ZINC001567542514	1342782996	/nfs/dbraw/zinc/78/29/96/1342782996.db2.gz	ZWVTZEUJSGPQOJ-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H](O)C[NH+]1CCCCC1)C1CC1	ZINC000151253631	463501800	/nfs/dbraw/zinc/50/18/00/463501800.db2.gz	BPNGSVAMSSJAIE-QZTJIDSGSA-N	2	0	347.459	2.352	10	5		EEBERP
Cc1c(NC(=O)CCN2C[C@@]3(C)C[NH2+]C[C@@]3(C)C2)cccc1[N+](=O)[O-]	ZINC000600750429	468648333	/nfs/dbraw/zinc/64/83/33/468648333.db2.gz	WHBIFKOJTOWDDB-HDICACEKSA-N	2	0	346.431	2.163	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1	ZINC000292218826	275395904	/nfs/dbraw/zinc/39/59/04/275395904.db2.gz	UWHZYKLKPXWXGQ-SFHVURJKSA-N	2	0	346.431	2.259	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000420359534	467377070	/nfs/dbraw/zinc/37/70/70/467377070.db2.gz	FUNGXCUWCUUAPN-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CCC([NH+]2CCNCC2)CC1	ZINC000415058091	467478563	/nfs/dbraw/zinc/47/85/63/467478563.db2.gz	SICSGNIDXSCZJB-HYXAFXHYSA-N	2	0	344.459	2.414	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000593729431	469112728	/nfs/dbraw/zinc/11/27/28/469112728.db2.gz	DTDMKFAERVPWJQ-JLSDUUJJSA-N	2	0	349.431	2.334	10	5		EEBERP
C[C@@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062065	1198038220	/nfs/dbraw/zinc/03/82/20/1198038220.db2.gz	COUMRIOKSOCZBZ-KBPBESRZSA-N	2	0	338.427	2.411	10	5		EEBERP
Cc1ccc(CNC[C@@H](O)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-]	ZINC000872231350	1198100662	/nfs/dbraw/zinc/10/06/62/1198100662.db2.gz	IMCFHTSWAGOCEK-GOSISDBHSA-N	2	0	343.427	2.486	10	5		EEBERP
Cc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000121099288	463078798	/nfs/dbraw/zinc/07/87/98/463078798.db2.gz	KTJDZNFEMZKASF-HNNXBMFYSA-N	2	0	335.448	2.428	10	5		EEBERP
C[C@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000185873481	463896199	/nfs/dbraw/zinc/89/61/99/463896199.db2.gz	XVHZEUWPBPKXPE-CYBMUJFWSA-N	2	0	340.855	2.364	10	5		EEBERP
O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CCC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)nc1	ZINC000923327745	789371073	/nfs/dbraw/zinc/37/10/73/789371073.db2.gz	UXUAHFVGDFHLII-UYTSQGDYSA-N	2	0	345.447	2.397	10	5		EEBERP
Cc1c([C@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)cccc1[N+](=O)[O-]	ZINC000925850572	1206160504	/nfs/dbraw/zinc/16/05/04/1206160504.db2.gz	JNCKQFQAXZTBKI-UONOGXRCSA-N	2	0	347.415	2.239	10	5		EEBERP
C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)[C@@H]1CN(C)CCN1C	ZINC001621533040	1352369224	/nfs/dbraw/zinc/36/92/24/1352369224.db2.gz	XNJWFURVGFZVPL-ABWVVVHMSA-N	2	0	332.448	2.222	10	5		EEBERP
O=[N+]([O-])c1ccc(OCC[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1	ZINC000600767974	468652129	/nfs/dbraw/zinc/65/21/29/468652129.db2.gz	VZRFYUBWYBPBAC-GOSISDBHSA-N	2	0	349.431	2.064	10	5		EEBERP
CC1(C)C[C@H]([NH2+]CCN2CCC([NH3+])CC2)c2cc([N+](=O)[O-])ccc21	ZINC000925813377	1206156950	/nfs/dbraw/zinc/15/69/50/1206156950.db2.gz	UPIRWUOCZHQNME-KRWDZBQOSA-N	2	0	332.448	2.330	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@H+]3CC[C@H](CO)C3)CC2)cc1	ZINC000952993408	796139182	/nfs/dbraw/zinc/13/91/82/796139182.db2.gz	GWJIZOUWTRBGDN-SFHVURJKSA-N	2	0	347.459	2.164	10	5		EEBERP
Cc1c(NC(=O)[C@@H](C)N2C[C@@H]3C[N@@H+](C)CC[C@@H]3C2)cccc1[N+](=O)[O-]	ZINC001560056130	1342506766	/nfs/dbraw/zinc/50/67/66/1342506766.db2.gz	YYNFWRALCGXBMF-KFWWJZLASA-N	2	0	346.431	2.114	10	5		EEBERP
C[C@@H](CN(C)CCC[NH+](C)C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F	ZINC000594961979	468732619	/nfs/dbraw/zinc/73/26/19/468732619.db2.gz	CFYWIQSKOBTLDG-ZDUSSCGKSA-N	2	0	326.416	2.096	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCC1	ZINC001318654855	1332573003	/nfs/dbraw/zinc/57/30/03/1332573003.db2.gz	RNCJLNHAZLIXMH-UHFFFAOYSA-N	2	0	348.447	2.065	10	5		EEBERP
C[C@@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H]1CC[NH3+]	ZINC000903978728	1242835046	/nfs/dbraw/zinc/83/50/46/1242835046.db2.gz	VUNHNAMGWVEVTD-UKRRQHHQSA-N	2	0	343.431	2.412	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[N@@H+](CCO)C3CC3)CC2)cc1	ZINC000952994422	796141050	/nfs/dbraw/zinc/14/10/50/796141050.db2.gz	PEUWYIFKNRZSBE-UHFFFAOYSA-N	2	0	347.459	2.306	10	5		EEBERP
Cc1nccn1C[C@H]1CCCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000178750090	463962376	/nfs/dbraw/zinc/96/23/76/463962376.db2.gz	PEUOTWRXJREMQU-CQSZACIVSA-N	2	0	343.387	2.203	10	5		EEBERP
CN(CCC[NH+](C)C)CCNc1ncc([N+](=O)[O-])cc1C(F)(F)F	ZINC000596424266	485612947	/nfs/dbraw/zinc/61/29/47/485612947.db2.gz	FDQNLOVYJVDNTA-UHFFFAOYSA-N	2	0	349.357	2.304	10	5		EEBERP
C[C@H](NCCN1CC[N@H+](C)C(C)(C)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069278	1198039668	/nfs/dbraw/zinc/03/96/68/1198039668.db2.gz	OIGOUQANWABQIW-ZDUSSCGKSA-N	2	0	338.427	2.411	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@]2(CC[NH2+]C2)C1	ZINC000420383340	467387385	/nfs/dbraw/zinc/38/73/85/467387385.db2.gz	STEZQXRGUJRNPA-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1	ZINC000594508145	468612031	/nfs/dbraw/zinc/61/20/31/468612031.db2.gz	BGPOSIXMSCYGID-HEHGZKQESA-N	2	0	334.420	2.242	10	5		EEBERP
Cc1c(NC(=O)CCN2CCC([NH+](C)C)CC2)cccc1[N+](=O)[O-]	ZINC000127871790	292332023	/nfs/dbraw/zinc/33/20/23/292332023.db2.gz	VJWXGZOPNCUIIX-UHFFFAOYSA-N	2	0	334.420	2.258	10	5		EEBERP
C[C@@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414948089	467456627	/nfs/dbraw/zinc/45/66/27/467456627.db2.gz	XLNZMCGWSCGGRW-WBMJQRKESA-N	2	0	329.404	2.083	10	5		EEBERP
C[NH+](C)C[C@@H]1CN(c2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C[NH+](C)C	ZINC000866012821	1198454188	/nfs/dbraw/zinc/45/41/88/1198454188.db2.gz	RHUHGRGYWRBIIF-CHWSQXEVSA-N	2	0	340.855	2.424	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000593729430	469112859	/nfs/dbraw/zinc/11/28/59/469112859.db2.gz	DTDMKFAERVPWJQ-FHLIZLRMSA-N	2	0	349.431	2.334	10	5		EEBERP
Cn1cc(C[NH2+]C[C@H]2C[C@@H]([NH+](C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000594520183	468614902	/nfs/dbraw/zinc/61/49/02/468614902.db2.gz	ILKVCLADRDNKQV-XFHMXUHZSA-N	2	0	343.431	2.425	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000592478664	468706565	/nfs/dbraw/zinc/70/65/65/468706565.db2.gz	HBKBIYQPDSGAND-YOEHRIQHSA-N	2	0	346.431	2.387	10	5		EEBERP
O=[N+]([O-])c1c(NC[C@@H]2CCC[N@H+]2CCCO)ccc2cnccc21	ZINC000599086317	469113031	/nfs/dbraw/zinc/11/30/31/469113031.db2.gz	JKQBMKBXYFUBSB-AWEZNQCLSA-N	2	0	330.388	2.402	10	5		EEBERP
COc1ccc(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1[N+](=O)[O-]	ZINC000600763770	468651207	/nfs/dbraw/zinc/65/12/07/468651207.db2.gz	HMEKLNCJHMODPA-INIZCTEOSA-N	2	0	349.431	2.194	10	5		EEBERP
C[N@H+](CCCCCC[NH3+])[C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872155582	1198061851	/nfs/dbraw/zinc/06/18/51/1198061851.db2.gz	RHIKBLMFCYFLAQ-MRXNPFEDSA-N	2	0	334.420	2.151	10	5		EEBERP
Cc1ccc(CNC[C@H](O)C[N@@H+](C)Cc2ccccc2)cc1[N+](=O)[O-]	ZINC000872231351	1198100684	/nfs/dbraw/zinc/10/06/84/1198100684.db2.gz	IMCFHTSWAGOCEK-SFHVURJKSA-N	2	0	343.427	2.486	10	5		EEBERP
CC[C@@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc([N+](=O)[O-])c1	ZINC000925857405	1206162187	/nfs/dbraw/zinc/16/21/87/1206162187.db2.gz	VEMHYHFHMAKHEQ-HZPDHXFCSA-N	2	0	347.415	2.321	10	5		EEBERP
O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CCC3C[C@H]4CC[C@@H](C3)[NH2+]4)C2)nc1	ZINC000923327746	789371629	/nfs/dbraw/zinc/37/16/29/789371629.db2.gz	UXUAHFVGDFHLII-WTXIUTQJSA-N	2	0	345.447	2.397	10	5		EEBERP
Cc1nccn1C[C@@H]1CCCN1CC(=O)Nc1ccccc1[N+](=O)[O-]	ZINC000178750075	463962480	/nfs/dbraw/zinc/96/24/80/463962480.db2.gz	PEUOTWRXJREMQU-AWEZNQCLSA-N	2	0	343.387	2.203	10	5		EEBERP
C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000423499100	466759216	/nfs/dbraw/zinc/75/92/16/466759216.db2.gz	ANIPWKQCMIESCG-OOHWJJMZSA-N	2	0	332.448	2.462	10	5		EEBERP
C[NH+](C)C[C@@H]1CN(c2ccc(Cl)cc2[N+](=O)[O-])C[C@H]1C[NH+](C)C	ZINC000866011550	1198454289	/nfs/dbraw/zinc/45/42/89/1198454289.db2.gz	GZXKSCLOXHVBHE-CHWSQXEVSA-N	2	0	340.855	2.424	10	5		EEBERP
Cc1c([C@@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)cccc1[N+](=O)[O-]	ZINC000925850571	1206160365	/nfs/dbraw/zinc/16/03/65/1206160365.db2.gz	JNCKQFQAXZTBKI-KGLIPLIRSA-N	2	0	347.415	2.239	10	5		EEBERP
CN1CCN([C@@H]2CCCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000174885479	464462820	/nfs/dbraw/zinc/46/28/20/464462820.db2.gz	FSIYHMFTYJQXEO-GOSISDBHSA-N	2	0	332.448	2.197	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1	ZINC000420383337	467387180	/nfs/dbraw/zinc/38/71/80/467387180.db2.gz	STEZQXRGUJRNPA-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000593729433	469112929	/nfs/dbraw/zinc/11/29/29/469112929.db2.gz	DTDMKFAERVPWJQ-ZTFGCOKTSA-N	2	0	349.431	2.334	10	5		EEBERP
CN1CCN([C@@H]2CCCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000174898178	464466513	/nfs/dbraw/zinc/46/65/13/464466513.db2.gz	SRSBJNUAMCBAER-LJQANCHMSA-N	2	0	346.475	2.239	10	5		EEBERP
C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000423512659	466762610	/nfs/dbraw/zinc/76/26/10/466762610.db2.gz	PBKKMNBPJKFXJW-ODIFPOPNSA-N	2	0	332.448	2.462	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000592478428	468706602	/nfs/dbraw/zinc/70/66/02/468706602.db2.gz	BGTYVOARRKQMHP-HUUCEWRRSA-N	2	0	346.431	2.387	10	5		EEBERP
COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@H]([NH3+])CCO2)cc1[N+](=O)[O-]	ZINC000593320435	468938287	/nfs/dbraw/zinc/93/82/87/468938287.db2.gz	IWITZBQQEKVRRK-RKVPGOIHSA-N	2	0	349.431	2.464	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)CCCC1	ZINC001481904942	1182918641	/nfs/dbraw/zinc/91/86/41/1182918641.db2.gz	JQSFLNXGSMYIHV-UHFFFAOYSA-N	2	0	348.447	2.065	10	5		EEBERP
C[C@@H]([NH2+][C@@H](C)CN(C)CCC[NH+](C)C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000850501337	1277250007	/nfs/dbraw/zinc/25/00/07/1277250007.db2.gz	NOFVWJARGQTFJU-UONOGXRCSA-N	2	0	337.468	2.100	10	5		EEBERP
O=C(C[N@@H+]1CCC[C@H](C2CC[NH2+]CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595901238	469071835	/nfs/dbraw/zinc/07/18/35/469071835.db2.gz	SSEGDHCNQDDFGA-HNNXBMFYSA-N	2	0	346.431	2.245	10	5		EEBERP
CC[C@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc([N+](=O)[O-])c1	ZINC000925857391	1206161676	/nfs/dbraw/zinc/16/16/76/1206161676.db2.gz	VEMHYHFHMAKHEQ-HOTGVXAUSA-N	2	0	347.415	2.321	10	5		EEBERP
C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000817983266	785132340	/nfs/dbraw/zinc/13/23/40/785132340.db2.gz	LLZIDSURNJOTEO-IUDNXUCKSA-N	2	0	347.463	2.044	10	5		EEBERP
C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1cccc([N+](=O)[O-])c1	ZINC000423512660	466762721	/nfs/dbraw/zinc/76/27/21/466762721.db2.gz	PBKKMNBPJKFXJW-OOHWJJMZSA-N	2	0	332.448	2.462	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2	ZINC000518187782	468108229	/nfs/dbraw/zinc/10/82/29/468108229.db2.gz	IIKLCPSEMNGTCD-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2	ZINC000925843446	1206159357	/nfs/dbraw/zinc/15/93/57/1206159357.db2.gz	QDOBNWYMSRSYJE-MZMPZRCHSA-N	2	0	346.431	2.434	10	5		EEBERP
O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H](O)C[NH+]1CCCCC1)C1CC1	ZINC000151253517	285161336	/nfs/dbraw/zinc/16/13/36/285161336.db2.gz	BPNGSVAMSSJAIE-ZWKOTPCHSA-N	2	0	347.459	2.352	10	5		EEBERP
C[C@@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc([N+](=O)[O-])cc1	ZINC000423499099	466759128	/nfs/dbraw/zinc/75/91/28/466759128.db2.gz	ANIPWKQCMIESCG-ODIFPOPNSA-N	2	0	332.448	2.462	10	5		EEBERP
O=[N+]([O-])c1ccc(C[NH2+]C2CCC(N3CC[NH2+]CC3)CC2)c(F)c1	ZINC000415061543	467478648	/nfs/dbraw/zinc/47/86/48/467478648.db2.gz	YJRRIWJPNKAZTN-UHFFFAOYSA-N	2	0	336.411	2.040	10	5		EEBERP
Cc1cc(N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])s1	ZINC000866011242	1198453697	/nfs/dbraw/zinc/45/36/97/1198453697.db2.gz	XIIGECJXBFKUSW-CHWSQXEVSA-N	2	0	326.466	2.140	10	5		EEBERP
CC[NH+]1CCN([C@@H](C)C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872022590	1198028006	/nfs/dbraw/zinc/02/80/06/1198028006.db2.gz	KAEMSIMRPUPHCX-KBPBESRZSA-N	2	0	338.427	2.411	10	5		EEBERP
C[C@H]1C[NH2+]CC[C@@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414948087	467456773	/nfs/dbraw/zinc/45/67/73/467456773.db2.gz	XLNZMCGWSCGGRW-LRDDRELGSA-N	2	0	329.404	2.083	10	5		EEBERP
O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1	ZINC000600768024	468652263	/nfs/dbraw/zinc/65/22/63/468652263.db2.gz	WOSGFAMHJCBTJC-MRXNPFEDSA-N	2	0	349.431	2.064	10	5		EEBERP
C[NH+](C)C[C@@H]1CN(c2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C[NH+](C)C	ZINC000866012120	1198454314	/nfs/dbraw/zinc/45/43/14/1198454314.db2.gz	QSVBOTLWAOQGLX-CHWSQXEVSA-N	2	0	340.855	2.424	10	5		EEBERP
COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@@H+]([C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2	ZINC000903492945	1240658873	/nfs/dbraw/zinc/65/88/73/1240658873.db2.gz	MIIFNVPOIACTNA-FLTUCWPJSA-N	2	0	347.415	2.177	10	5		EEBERP
Cc1ccc(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cc1[N+](=O)[O-]	ZINC000121099107	463078613	/nfs/dbraw/zinc/07/86/13/463078613.db2.gz	KTJDZNFEMZKASF-OAHLLOKOSA-N	2	0	335.448	2.428	10	5		EEBERP
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](n2cc(C[NH3+])nn2)C1	ZINC000420385707	467389968	/nfs/dbraw/zinc/38/99/68/467389968.db2.gz	UELCJNBUSMVVOR-LRDDRELGSA-N	2	0	330.392	2.043	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1)Nc1ccccc1[N+](=O)[O-]	ZINC000420389987	467390763	/nfs/dbraw/zinc/39/07/63/467390763.db2.gz	HQAVXNGULMUJHR-GOEBONIOSA-N	2	0	346.431	2.387	10	5		EEBERP
CC[NH+]1CCN([C@@H]2CC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)CC1	ZINC000245924486	535737964	/nfs/dbraw/zinc/73/79/64/535737964.db2.gz	NXGVHYGBCQCVSC-CRAIPNDOSA-N	2	0	332.448	2.368	10	5		EEBERP
O=[N+]([O-])c1ccc(CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)c(F)c1	ZINC000903508602	1240728464	/nfs/dbraw/zinc/72/84/64/1240728464.db2.gz	NPKOAOLQRKLFDQ-CALCHBBNSA-N	2	0	348.422	2.135	10	5		EEBERP
[NH3+]C1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000600677915	468618538	/nfs/dbraw/zinc/61/85/38/468618538.db2.gz	LHTDZDFAPGVDGV-GOEBONIOSA-N	2	0	333.432	2.404	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2C[NH2+]CCC2(F)F)n1	ZINC000925775427	1206152955	/nfs/dbraw/zinc/15/29/55/1206152955.db2.gz	GNNLLBZDNVUUSO-JHJVBQTASA-N	2	0	343.378	2.109	10	5		EEBERP
Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000925853440	1206160858	/nfs/dbraw/zinc/16/08/58/1206160858.db2.gz	JDDOUKVBFRBPPP-HIFRSBDPSA-N	2	0	347.415	2.239	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1	ZINC000593731219	469112351	/nfs/dbraw/zinc/11/23/51/469112351.db2.gz	UQEGUABIWUXKBT-LESCRADOSA-N	2	0	349.431	2.464	10	5		EEBERP
C[C@@H]1C[C@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000611273933	469217242	/nfs/dbraw/zinc/21/72/42/469217242.db2.gz	DRFWGHVRNJKCFE-TZMCWYRMSA-N	2	0	335.404	2.281	10	5		EEBERP
C[C@@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020290	1198026940	/nfs/dbraw/zinc/02/69/40/1198026940.db2.gz	FJQMEKUXIVYBSW-CYBMUJFWSA-N	2	0	338.427	2.411	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)n1	ZINC000925775429	1206153253	/nfs/dbraw/zinc/15/32/53/1206153253.db2.gz	GNNLLBZDNVUUSO-YNEHKIRRSA-N	2	0	343.378	2.109	10	5		EEBERP
O=[N+]([O-])c1ccccc1N1CC[NH+](CC2C[C@H]3CC[C@@H](C2)[NH2+]3)CC1	ZINC000903873885	1242265197	/nfs/dbraw/zinc/26/51/97/1242265197.db2.gz	ZWGRFNYHDBDWHQ-MQVJKMGUSA-N	2	0	330.432	2.247	10	5		EEBERP
[NH3+]CCCN1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1	ZINC000842472008	1315711710	/nfs/dbraw/zinc/71/17/10/1315711710.db2.gz	LTPUOEKQGPGIIH-UHFFFAOYSA-N	2	0	332.326	2.084	10	5		EEBERP
C[C@@H](CCN1CC[NH+](C)CC1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl	ZINC000185873465	463895921	/nfs/dbraw/zinc/89/59/21/463895921.db2.gz	XVHZEUWPBPKXPE-ZDUSSCGKSA-N	2	0	340.855	2.364	10	5		EEBERP
O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1CC[NH+](CCO)CC1)CCC2	ZINC000192838486	465008417	/nfs/dbraw/zinc/00/84/17/465008417.db2.gz	YHRIYFDJLTZAGK-SFHVURJKSA-N	2	0	333.432	2.266	10	5		EEBERP
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H](C3CC[NH2+]CC3)C2)c1	ZINC000923390184	789476301	/nfs/dbraw/zinc/47/63/01/789476301.db2.gz	UGWNSKMHIDHNHR-SJLPKXTDSA-N	2	0	333.432	2.340	10	5		EEBERP
Cc1cc(N[C@H]2CC[N@H+](CC(C)(C)O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000865999123	1198450229	/nfs/dbraw/zinc/45/02/29/1198450229.db2.gz	YLWIVFZFBYACLB-ZDUSSCGKSA-N	2	0	344.415	2.130	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CCN(C)C1CC[NH+](C)CC1	ZINC000289890130	275158832	/nfs/dbraw/zinc/15/88/32/275158832.db2.gz	SSWPNANBGBWXGB-UHFFFAOYSA-N	2	0	334.464	2.361	10	5		EEBERP
[NH3+]C1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000600677916	468618622	/nfs/dbraw/zinc/61/86/22/468618622.db2.gz	LHTDZDFAPGVDGV-HOCLYGCPSA-N	2	0	333.432	2.404	10	5		EEBERP
Cc1c(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cccc1[N+](=O)[O-]	ZINC000600766355	468652184	/nfs/dbraw/zinc/65/21/84/468652184.db2.gz	NZUFHLLNKOMDEH-KRWDZBQOSA-N	2	0	333.432	2.494	10	5		EEBERP
CC[NH+]1CCN([C@H](C)C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872022592	1198028579	/nfs/dbraw/zinc/02/85/79/1198028579.db2.gz	KAEMSIMRPUPHCX-KGLIPLIRSA-N	2	0	338.427	2.411	10	5		EEBERP
COC[C@H](CCC[NH3+])[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-]	ZINC000925764298	1206151521	/nfs/dbraw/zinc/15/15/21/1206151521.db2.gz	XYYJUJHOZVCWQI-LBPRGKRZSA-N	2	0	346.225	2.201	10	5		EEBERP
CN(CCCn1ccnc1)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1	ZINC001192928252	1282251251	/nfs/dbraw/zinc/25/12/51/1282251251.db2.gz	IBPIPGCVHOMLHP-UHFFFAOYSA-N	2	0	342.359	2.363	10	5		EEBERP
CN1CCN([C@H]2CCCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1	ZINC000174885495	464463348	/nfs/dbraw/zinc/46/33/48/464463348.db2.gz	FSIYHMFTYJQXEO-SFHVURJKSA-N	2	0	332.448	2.197	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])C1	ZINC000593728685	469111514	/nfs/dbraw/zinc/11/15/14/469111514.db2.gz	CIBMDFHWKRHESR-IIDMSEBBSA-N	2	0	349.431	2.334	10	5		EEBERP
O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1CC[NH+](CCO)CC1)CCC2	ZINC000192838473	239909507	/nfs/dbraw/zinc/90/95/07/239909507.db2.gz	YHRIYFDJLTZAGK-GOSISDBHSA-N	2	0	333.432	2.266	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H]([NH3+])C(C)(C)C1	ZINC000261713625	160410528	/nfs/dbraw/zinc/41/05/28/160410528.db2.gz	MUEGJWMUXQZXOL-OAHLLOKOSA-N	2	0	334.420	2.291	10	5		EEBERP
[NH3+]C1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCOCC1	ZINC000600677912	468618679	/nfs/dbraw/zinc/61/86/79/468618679.db2.gz	LHTDZDFAPGVDGV-GDBMZVCRSA-N	2	0	333.432	2.404	10	5		EEBERP
O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)n1	ZINC000925842159	1206159225	/nfs/dbraw/zinc/15/92/25/1206159225.db2.gz	XJFHGDVIRJRGIJ-JYYAWHABSA-N	2	0	333.436	2.397	10	5		EEBERP
Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000925853442	1206160950	/nfs/dbraw/zinc/16/09/50/1206160950.db2.gz	JDDOUKVBFRBPPP-ZFWWWQNUSA-N	2	0	347.415	2.239	10	5		EEBERP
Cc1c(C[C@H](C[NH3+])C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000903988872	1242892183	/nfs/dbraw/zinc/89/21/83/1242892183.db2.gz	ZQEBTNAVYZYBGY-TZMCWYRMSA-N	2	0	331.420	2.105	10	5		EEBERP
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@H]1CCC[NH2+]C1	ZINC000414835971	313100101	/nfs/dbraw/zinc/10/01/01/313100101.db2.gz	IXACSRMLFHGVAM-ZIAGYGMSSA-N	2	0	334.420	2.291	10	5		EEBERP
COc1ccc(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cc1[N+](=O)[O-]	ZINC000600764325	468651769	/nfs/dbraw/zinc/65/17/69/468651769.db2.gz	HMEKLNCJHMODPA-MRXNPFEDSA-N	2	0	349.431	2.194	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000292257119	464174842	/nfs/dbraw/zinc/17/48/42/464174842.db2.gz	YGKKCHAEZIWEIY-GOSISDBHSA-N	2	0	346.431	2.259	10	5		EEBERP
O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H](O)C[NH+]1CCCCC1)C1CC1	ZINC000151253463	463500321	/nfs/dbraw/zinc/50/03/21/463500321.db2.gz	BPNGSVAMSSJAIE-ROUUACIJSA-N	2	0	347.459	2.352	10	5		EEBERP
C[C@H]1C[C@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000611273930	469217920	/nfs/dbraw/zinc/21/79/20/469217920.db2.gz	DRFWGHVRNJKCFE-GXTWGEPZSA-N	2	0	335.404	2.281	10	5		EEBERP
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2	ZINC000925844196	1206159089	/nfs/dbraw/zinc/15/90/89/1206159089.db2.gz	WSLYLGWWFGIBTC-FDQGKXFDSA-N	2	0	346.431	2.434	10	5		EEBERP
O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(CO[C@H]2CC[NH2+]C2)CC1	ZINC000600768023	468652604	/nfs/dbraw/zinc/65/26/04/468652604.db2.gz	WOSGFAMHJCBTJC-INIZCTEOSA-N	2	0	349.431	2.064	10	5		EEBERP
C[C@@H](CN(C)CCC[NH+](C)C)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-]	ZINC000595061503	468750547	/nfs/dbraw/zinc/75/05/47/468750547.db2.gz	LOBPBCYTJUFSIM-YOEHRIQHSA-N	2	0	334.464	2.444	10	5		EEBERP
[NH3+][C@@H](C[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)C1CCCC1	ZINC000872158621	1198064286	/nfs/dbraw/zinc/06/42/86/1198064286.db2.gz	WIHCBWCUDOYPJJ-YOEHRIQHSA-N	2	0	335.452	2.411	10	5		EEBERP
[NH3+]C1CCN(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1	ZINC000925814873	1206156885	/nfs/dbraw/zinc/15/68/85/1206156885.db2.gz	MAPKWPMLNRGWND-YJBOKZPZSA-N	2	0	346.475	2.319	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1)Nc1ccccc1[N+](=O)[O-]	ZINC000420389991	467390363	/nfs/dbraw/zinc/39/03/63/467390363.db2.gz	HQAVXNGULMUJHR-ZBFHGGJFSA-N	2	0	346.431	2.387	10	5		EEBERP
O=[N+]([O-])c1ccc(OCC[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1	ZINC000600767979	468652673	/nfs/dbraw/zinc/65/26/73/468652673.db2.gz	VZRFYUBWYBPBAC-SFHVURJKSA-N	2	0	349.431	2.064	10	5		EEBERP
C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000596653319	469322810	/nfs/dbraw/zinc/32/28/10/469322810.db2.gz	JQPRHFSVLPFKMT-AWEZNQCLSA-N	2	0	348.447	2.236	10	5		EEBERP
C[C@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023592	1198028938	/nfs/dbraw/zinc/02/89/38/1198028938.db2.gz	SVVSFYXEBDJZEF-AWEZNQCLSA-N	2	0	338.427	2.412	10	5		EEBERP
C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)[C@H]1CN(C)CCN1C	ZINC001621533041	1352369341	/nfs/dbraw/zinc/36/93/41/1352369341.db2.gz	XNJWFURVGFZVPL-DJDSVLOFSA-N	2	0	332.448	2.222	10	5		EEBERP
C[C@@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041761	1198032964	/nfs/dbraw/zinc/03/29/64/1198032964.db2.gz	VRKJILMVJQQMRY-CYBMUJFWSA-N	2	0	338.427	2.411	10	5		EEBERP
C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)NCC[NH+](C)C)CC1	ZINC000195519190	464068208	/nfs/dbraw/zinc/06/82/08/464068208.db2.gz	WXEKACBUOUHCSZ-CQSZACIVSA-N	2	0	348.447	2.046	10	5		EEBERP
Cc1cc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)CC2)ncc1[N+](=O)[O-]	ZINC000301810939	466036888	/nfs/dbraw/zinc/03/68/88/466036888.db2.gz	BNSRLWPEYIDUKT-XYPWUTKMSA-N	2	0	345.447	2.045	10	5		EEBERP
Cn1ccnc1[C@@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000594509685	468612841	/nfs/dbraw/zinc/61/28/41/468612841.db2.gz	KIVQHZYWGKKGNB-XKQJLSEDSA-N	2	0	343.431	2.348	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000592478659	468706936	/nfs/dbraw/zinc/70/69/36/468706936.db2.gz	HBKBIYQPDSGAND-PBHICJAKSA-N	2	0	346.431	2.387	10	5		EEBERP
CC[C@H]([NH2+]C[C@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc([N+](=O)[O-])c1	ZINC000925857385	1206161858	/nfs/dbraw/zinc/16/18/58/1206161858.db2.gz	VEMHYHFHMAKHEQ-CVEARBPZSA-N	2	0	347.415	2.321	10	5		EEBERP
C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000193643834	160184411	/nfs/dbraw/zinc/18/44/11/160184411.db2.gz	JAIUPZPBHHBKHQ-FPMFFAJLSA-N	2	0	343.387	2.199	10	5		EEBERP
C[N@H+]1C[C@@H]2C[NH+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]2C1	ZINC000193608270	160183492	/nfs/dbraw/zinc/18/34/92/160183492.db2.gz	SOFRGXMEDIWVTK-GASCZTMLSA-N	2	0	342.399	2.286	10	5		EEBERP
Cn1ccnc1[C@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000593320868	468938245	/nfs/dbraw/zinc/93/82/45/468938245.db2.gz	UYFIXDQGAFMDAG-OAHLLOKOSA-N	2	0	329.404	2.136	10	5		EEBERP
CC[NH+]1CCN([C@@H](C)C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872022594	1198028695	/nfs/dbraw/zinc/02/86/95/1198028695.db2.gz	KAEMSIMRPUPHCX-UONOGXRCSA-N	2	0	338.427	2.411	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])C1	ZINC000593728688	469111741	/nfs/dbraw/zinc/11/17/41/469111741.db2.gz	CIBMDFHWKRHESR-VKJFTORMSA-N	2	0	349.431	2.334	10	5		EEBERP
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@@H]1CCC[NH2+]C1	ZINC000414835965	313100397	/nfs/dbraw/zinc/10/03/97/313100397.db2.gz	IXACSRMLFHGVAM-KBPBESRZSA-N	2	0	334.420	2.291	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@H]([C@@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000592478427	468706439	/nfs/dbraw/zinc/70/64/39/468706439.db2.gz	BGTYVOARRKQMHP-GJZGRUSLSA-N	2	0	346.431	2.387	10	5		EEBERP
[NH3+][C@H](C[C@@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)C1CCCC1	ZINC000872158619	1198064994	/nfs/dbraw/zinc/06/49/94/1198064994.db2.gz	WIHCBWCUDOYPJJ-WMLDXEAASA-N	2	0	335.452	2.411	10	5		EEBERP
O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc4c(c3)C[NH2+]CC4)CC2)n1	ZINC000568051708	319449083	/nfs/dbraw/zinc/44/90/83/319449083.db2.gz	ZVIVHXMONVJGBQ-UHFFFAOYSA-N	2	0	341.415	2.274	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000593730635	469112687	/nfs/dbraw/zinc/11/26/87/469112687.db2.gz	PCLNVIOPFLGJHZ-JLSDUUJJSA-N	2	0	349.431	2.334	10	5		EEBERP
C[NH2+]CCCC(=O)N1CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000596655666	469323965	/nfs/dbraw/zinc/32/39/65/469323965.db2.gz	WQHSQNPOMMFHJA-AWEZNQCLSA-N	2	0	348.447	2.236	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CC1CC[NH+](C[C@H](C)O)CC1	ZINC000183332889	235013691	/nfs/dbraw/zinc/01/36/91/235013691.db2.gz	MKASMZQRHPVAAC-HNNXBMFYSA-N	2	0	335.448	2.428	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@]2(CC[NH2+]C2)C1	ZINC000420359533	281017477	/nfs/dbraw/zinc/01/74/77/281017477.db2.gz	FUNGXCUWCUUAPN-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
Cn1ccnc1[C@@H]([NH2+]CCC1(C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1	ZINC000593320867	468938116	/nfs/dbraw/zinc/93/81/16/468938116.db2.gz	UYFIXDQGAFMDAG-HNNXBMFYSA-N	2	0	329.404	2.136	10	5		EEBERP
C[NH+](C)C[C@@H]1CN(c2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1C[NH+](C)C	ZINC000866012874	1198454459	/nfs/dbraw/zinc/45/44/59/1198454459.db2.gz	TZEGCADJQNXPFI-VXGBXAGGSA-N	2	0	342.390	2.049	10	5		EEBERP
C[C@@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414948088	467456222	/nfs/dbraw/zinc/45/62/22/467456222.db2.gz	XLNZMCGWSCGGRW-MLGOLLRUSA-N	2	0	329.404	2.083	10	5		EEBERP
C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1	ZINC000594510905	468613008	/nfs/dbraw/zinc/61/30/08/468613008.db2.gz	POVVZMGKMGZOQP-IOASZLSFSA-N	2	0	334.420	2.242	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)n1	ZINC000925842161	1206159311	/nfs/dbraw/zinc/15/93/11/1206159311.db2.gz	XJFHGDVIRJRGIJ-KLZNWCGWSA-N	2	0	333.436	2.397	10	5		EEBERP
Cc1c([C@@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)cccc1[N+](=O)[O-]	ZINC000925850573	1206160578	/nfs/dbraw/zinc/16/05/78/1206160578.db2.gz	JNCKQFQAXZTBKI-ZIAGYGMSSA-N	2	0	347.415	2.239	10	5		EEBERP
Cc1nccn1C[C@@H]1CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1	ZINC000246332497	160274220	/nfs/dbraw/zinc/27/42/20/160274220.db2.gz	SWKRWXFGQZKWMC-DLBZAZTESA-N	2	0	330.388	2.298	10	5		EEBERP
Cc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000284853332	464366140	/nfs/dbraw/zinc/36/61/40/464366140.db2.gz	DVDDRMJHGRGNFX-ROUUACIJSA-N	2	0	342.399	2.361	10	5		EEBERP
C[C@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CN1CC[NH+](C)CC1	ZINC000872031403	1198030272	/nfs/dbraw/zinc/03/02/72/1198030272.db2.gz	JMQGAZUXSXJUDP-KGLIPLIRSA-N	2	0	338.427	2.268	10	5		EEBERP
O=[N+]([O-])c1ccc(CCN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)cc1	ZINC000903510463	1240738313	/nfs/dbraw/zinc/73/83/13/1240738313.db2.gz	QLZKPXHZTZQBOJ-KDURUIRLSA-N	2	0	344.459	2.038	10	5		EEBERP
O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1	ZINC000776578678	577463029	/nfs/dbraw/zinc/46/30/29/577463029.db2.gz	IDTQSINMWDXDEJ-GOSISDBHSA-N	2	0	333.432	2.436	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(C1)CCCC[NH2+]2	ZINC000923537862	789740885	/nfs/dbraw/zinc/74/08/85/789740885.db2.gz	DZDBPRSMUCDUMJ-GOSISDBHSA-N	2	0	346.431	2.450	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1	ZINC000600777301	468655386	/nfs/dbraw/zinc/65/53/86/468655386.db2.gz	ZHVMOKQOJACGHN-GOSISDBHSA-N	2	0	333.432	2.494	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)C1	ZINC000593729432	469112337	/nfs/dbraw/zinc/11/23/37/469112337.db2.gz	DTDMKFAERVPWJQ-OLMNPRSZSA-N	2	0	349.431	2.334	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001483970579	1191131273	/nfs/dbraw/zinc/13/12/73/1191131273.db2.gz	DQBHJWFCUBVRNL-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
CC[C@@H]([NH2+]C[C@@H]1CC2(CC[NH2+]CC2)C(=O)O1)c1cccc([N+](=O)[O-])c1	ZINC000925857410	1206162218	/nfs/dbraw/zinc/16/22/18/1206162218.db2.gz	VEMHYHFHMAKHEQ-JKSUJKDBSA-N	2	0	347.415	2.321	10	5		EEBERP
C[N@H+](CCCCCC[NH3+])[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O	ZINC000872155581	1198061348	/nfs/dbraw/zinc/06/13/48/1198061348.db2.gz	RHIKBLMFCYFLAQ-INIZCTEOSA-N	2	0	334.420	2.151	10	5		EEBERP
C[C@@H]1C[NH2+]C[C@H]1CC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000903974884	1242813710	/nfs/dbraw/zinc/81/37/10/1242813710.db2.gz	VBWBEEGUCVHVMP-UKRRQHHQSA-N	2	0	343.431	2.331	10	5		EEBERP
O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1	ZINC000594973043	468735192	/nfs/dbraw/zinc/73/51/92/468735192.db2.gz	BYDNQUGJOIMVOD-LJQANCHMSA-N	2	0	341.411	2.451	10	5		EEBERP
C[C@@H](NCCN1CC[N@H+](C)C(C)(C)C1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872069277	1198039346	/nfs/dbraw/zinc/03/93/46/1198039346.db2.gz	OIGOUQANWABQIW-CYBMUJFWSA-N	2	0	338.427	2.411	10	5		EEBERP
Cc1cc(N2C[C@@H](C[NH+](C)C)[C@H](C[NH+](C)C)C2)c(F)cc1[N+](=O)[O-]	ZINC000866012334	1198454167	/nfs/dbraw/zinc/45/41/67/1198454167.db2.gz	YVBSLLDXEKMEPT-ZIAGYGMSSA-N	2	0	338.427	2.218	10	5		EEBERP
C[NH+](C)CCCN(CCC[NH+](C)C)c1ncc([N+](=O)[O-])cc1Cl	ZINC000176820275	464858901	/nfs/dbraw/zinc/85/89/01/464858901.db2.gz	BZCDBVMFVTVVEH-UHFFFAOYSA-N	2	0	343.859	2.353	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@@H]([C@H]2CCC[NH2+]2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000592478661	468706888	/nfs/dbraw/zinc/70/68/88/468706888.db2.gz	HBKBIYQPDSGAND-RHSMWYFYSA-N	2	0	346.431	2.387	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])C1	ZINC000593728686	469111408	/nfs/dbraw/zinc/11/14/08/469111408.db2.gz	CIBMDFHWKRHESR-RKVPGOIHSA-N	2	0	349.431	2.334	10	5		EEBERP
CN(CC[NH2+]Cc1cccc([N+](=O)[O-])c1)C(=O)CC[NH+]1CCCCC1	ZINC001493805987	1108685818	/nfs/dbraw/zinc/68/58/18/1108685818.db2.gz	CXEBYTYHFOBUFH-UHFFFAOYSA-N	2	0	348.447	2.019	10	5		EEBERP
Cc1c(NC(=O)CC[NH+]2CC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000292135091	275382039	/nfs/dbraw/zinc/38/20/39/275382039.db2.gz	LRKWGWCLFMRBQS-GOSISDBHSA-N	2	0	346.431	2.259	10	5		EEBERP
C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062066	1198038434	/nfs/dbraw/zinc/03/84/34/1198038434.db2.gz	COUMRIOKSOCZBZ-KGLIPLIRSA-N	2	0	338.427	2.411	10	5		EEBERP
C[NH+](C)C1(C(=O)NCCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CCC1	ZINC001264995224	1322843996	/nfs/dbraw/zinc/84/39/96/1322843996.db2.gz	XYUVKWUGFPOEFN-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1	ZINC000923390182	789475934	/nfs/dbraw/zinc/47/59/34/789475934.db2.gz	UGWNSKMHIDHNHR-FUHWJXTLSA-N	2	0	333.432	2.340	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C[NH+]2CCN(C)CC2)CC1	ZINC000289456591	275117344	/nfs/dbraw/zinc/11/73/44/275117344.db2.gz	NUMUPXLWSIQZQI-UHFFFAOYSA-N	2	0	346.475	2.363	10	5		EEBERP
C[C@@H]1C[C@H]([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C	ZINC000283173752	463792242	/nfs/dbraw/zinc/79/22/42/463792242.db2.gz	DSESRZRTLQSZDI-ZIAGYGMSSA-N	2	0	334.420	2.338	10	5		EEBERP
CC[NH+](CC)CC1CC[NH+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1	ZINC000057847438	463523295	/nfs/dbraw/zinc/52/32/95/463523295.db2.gz	SSYPNMNPBQTSHB-UHFFFAOYSA-N	2	0	348.447	2.248	10	5		EEBERP
COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1[N+](=O)[O-]	ZINC000593320432	468938041	/nfs/dbraw/zinc/93/80/41/468938041.db2.gz	IWITZBQQEKVRRK-DAYGRLMNSA-N	2	0	349.431	2.464	10	5		EEBERP
[NH3+][C@H](C[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)C1CCCC1	ZINC000872158617	1198064468	/nfs/dbraw/zinc/06/44/68/1198064468.db2.gz	WIHCBWCUDOYPJJ-RHSMWYFYSA-N	2	0	335.452	2.411	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CC[C@@]2(CC[N@@H+](C)C2)C1	ZINC000292218817	275395845	/nfs/dbraw/zinc/39/58/45/275395845.db2.gz	UWHZYKLKPXWXGQ-GOSISDBHSA-N	2	0	346.431	2.259	10	5		EEBERP
[NH3+]CCCOCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1	ZINC000600773383	468653309	/nfs/dbraw/zinc/65/33/09/468653309.db2.gz	HLCCQVVQZVEXHP-UHFFFAOYSA-N	2	0	336.417	2.173	10	5		EEBERP
Cc1ccc(C[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1[N+](=O)[O-]	ZINC000600774362	468654545	/nfs/dbraw/zinc/65/45/45/468654545.db2.gz	PSXNGASPDZXNDR-KRWDZBQOSA-N	2	0	333.432	2.494	10	5		EEBERP
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C	ZINC000903973851	1242809749	/nfs/dbraw/zinc/80/97/49/1242809749.db2.gz	HAIJGOQTMOGWIE-MGPQQGTHSA-N	2	0	334.420	2.147	10	5		EEBERP
Cc1ccc([C@@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000925853441	1206160837	/nfs/dbraw/zinc/16/08/37/1206160837.db2.gz	JDDOUKVBFRBPPP-UKRRQHHQSA-N	2	0	347.415	2.239	10	5		EEBERP
Cn1ccnc1[C@H]([NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1)c1ccc([N+](=O)[O-])cc1	ZINC000594509686	468612952	/nfs/dbraw/zinc/61/29/52/468612952.db2.gz	KIVQHZYWGKKGNB-XOKHGSTOSA-N	2	0	343.431	2.348	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000593730633	469113533	/nfs/dbraw/zinc/11/35/33/469113533.db2.gz	PCLNVIOPFLGJHZ-FHLIZLRMSA-N	2	0	349.431	2.334	10	5		EEBERP
[NH3+][C@@H](C[C@H]1CCC[N@H+](CCn2cc([N+](=O)[O-])cn2)C1)C1CCCC1	ZINC000872158614	1198064135	/nfs/dbraw/zinc/06/41/35/1198064135.db2.gz	WIHCBWCUDOYPJJ-PBHICJAKSA-N	2	0	335.452	2.411	10	5		EEBERP
C[C@H]1C[C@@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000611273931	469217896	/nfs/dbraw/zinc/21/78/96/469217896.db2.gz	DRFWGHVRNJKCFE-JSGCOSHPSA-N	2	0	335.404	2.281	10	5		EEBERP
CC[NH+]1CCN(CCC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872021337	1198028534	/nfs/dbraw/zinc/02/85/34/1198028534.db2.gz	BRXOZVLOZVTSFO-AWEZNQCLSA-N	2	0	338.427	2.412	10	5		EEBERP
O=[N+]([O-])c1cc(CN2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC[NH2+]CC2)cs1	ZINC000903510078	1240737002	/nfs/dbraw/zinc/73/70/02/1240737002.db2.gz	NLQYFHFMLMJIQN-GASCZTMLSA-N	2	0	336.461	2.057	10	5		EEBERP
C[C@@H](CN(C)CCC[NH+](C)C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1	ZINC000850501336	1277250418	/nfs/dbraw/zinc/25/04/18/1277250418.db2.gz	NOFVWJARGQTFJU-KBPBESRZSA-N	2	0	337.468	2.100	10	5		EEBERP
Cc1c(C[NH+]2CCC(CO[C@@H]3CC[NH2+]C3)CC2)cccc1[N+](=O)[O-]	ZINC000600766358	468652448	/nfs/dbraw/zinc/65/24/48/468652448.db2.gz	NZUFHLLNKOMDEH-QGZVFWFLSA-N	2	0	333.432	2.494	10	5		EEBERP
C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)[C@H]1CN(C)CCN1C	ZINC001621533042	1352369240	/nfs/dbraw/zinc/36/92/40/1352369240.db2.gz	XNJWFURVGFZVPL-QAEGFZEYSA-N	2	0	332.448	2.222	10	5		EEBERP
C[N@@H+]1C[C@@]23CN(C[C@@H](O)c4ccc([N+](=O)[O-])cc4)C[C@]2(C1)CCCC3	ZINC001177009109	798693113	/nfs/dbraw/zinc/69/31/13/798693113.db2.gz	XPAUUVDLKBUVOD-QRVBRYPASA-N	2	0	345.443	2.436	10	5		EEBERP
O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1	ZINC000153744287	462686291	/nfs/dbraw/zinc/68/62/91/462686291.db2.gz	UQTJULDLUXYCDR-GOSISDBHSA-N	2	0	333.432	2.436	10	5		EEBERP
C[N@@H+]1CCN(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1(C)C	ZINC000282500523	464842779	/nfs/dbraw/zinc/84/27/79/464842779.db2.gz	WOXIASQBVMSEEU-UHFFFAOYSA-N	2	0	340.855	2.364	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000420409506	467398930	/nfs/dbraw/zinc/39/89/30/467398930.db2.gz	XCWMLOYGSUEKGT-YOEHRIQHSA-N	2	0	346.431	2.387	10	5		EEBERP
C[C@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CN1CC[NH+](C)CC1	ZINC000872031405	1198030630	/nfs/dbraw/zinc/03/06/30/1198030630.db2.gz	JMQGAZUXSXJUDP-ZIAGYGMSSA-N	2	0	338.427	2.268	10	5		EEBERP
C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H]2C[N@@H+](C)C[C@@H]2C1	ZINC000193643851	160184888	/nfs/dbraw/zinc/18/48/88/160184888.db2.gz	JAIUPZPBHHBKHQ-BNOWGMLFSA-N	2	0	343.387	2.199	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2	ZINC000517937210	468102233	/nfs/dbraw/zinc/10/22/33/468102233.db2.gz	PBXVRUAEHDUYGX-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
[NH3+]C1CCN(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1	ZINC000925814870	1206156779	/nfs/dbraw/zinc/15/67/79/1206156779.db2.gz	MAPKWPMLNRGWND-CRAIPNDOSA-N	2	0	346.475	2.319	10	5		EEBERP
C[C@H](CCN1CC[NH+](C)CC1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062068	1198038263	/nfs/dbraw/zinc/03/82/63/1198038263.db2.gz	COUMRIOKSOCZBZ-ZIAGYGMSSA-N	2	0	338.427	2.411	10	5		EEBERP
Cc1c([C@H](C)[NH2+]C[C@@H]2CC3(CC[NH2+]CC3)C(=O)O2)cccc1[N+](=O)[O-]	ZINC000925850570	1206160473	/nfs/dbraw/zinc/16/04/73/1206160473.db2.gz	JNCKQFQAXZTBKI-KBPBESRZSA-N	2	0	347.415	2.239	10	5		EEBERP
C[NH2+]CCCC(=O)N1CCC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1	ZINC000596655668	469323680	/nfs/dbraw/zinc/32/36/80/469323680.db2.gz	WQHSQNPOMMFHJA-CQSZACIVSA-N	2	0	348.447	2.236	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2C[NH2+]CCC2(F)F)n1	ZINC000925775428	1206153024	/nfs/dbraw/zinc/15/30/24/1206153024.db2.gz	GNNLLBZDNVUUSO-RWMBFGLXSA-N	2	0	343.378	2.109	10	5		EEBERP
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@]12CCC[C@H]1[NH2+]CC2	ZINC000925844200	1206159368	/nfs/dbraw/zinc/15/93/68/1206159368.db2.gz	WSLYLGWWFGIBTC-MZMPZRCHSA-N	2	0	346.431	2.434	10	5		EEBERP
CCN(CC[NH2+]Cc1cccc([N+](=O)[O-])c1)C(=O)C1([NH+](C)C)CCC1	ZINC001320757164	1332947276	/nfs/dbraw/zinc/94/72/76/1332947276.db2.gz	ZMYLTRVZHWPDAI-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
C[C@@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CN1CC[NH+](C)CC1	ZINC000872031402	1198030840	/nfs/dbraw/zinc/03/08/40/1198030840.db2.gz	JMQGAZUXSXJUDP-KBPBESRZSA-N	2	0	338.427	2.268	10	5		EEBERP
Cn1cc(C[NH2+]CCC2(C[NH3+])CC2)c(-c2ccc([N+](=O)[O-])cc2)n1	ZINC000593314894	468936588	/nfs/dbraw/zinc/93/65/88/468936588.db2.gz	HJTGAPICFBEFSF-UHFFFAOYSA-N	2	0	329.404	2.214	10	5		EEBERP
C[C@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034426	1198032113	/nfs/dbraw/zinc/03/21/13/1198032113.db2.gz	OEABGLGGWBUHKE-AWEZNQCLSA-N	2	0	338.427	2.412	10	5		EEBERP
O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H](C3CC[NH2+]CC3)C2)c1	ZINC000923390187	789476178	/nfs/dbraw/zinc/47/61/78/789476178.db2.gz	UGWNSKMHIDHNHR-WMZOPIPTSA-N	2	0	333.432	2.340	10	5		EEBERP
CN(CCNC(=O)C(C)(C)[NH+]1CCCC1)Cc1ccccc1[N+](=O)[O-]	ZINC001690968351	1176394839	/nfs/dbraw/zinc/39/48/39/1176394839.db2.gz	SOOAOSHJYDRWHK-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
CCOc1ccc([C@H](C)[NH2+]CCN2CCC([NH3+])CC2)cc1[N+](=O)[O-]	ZINC000925816465	1206157214	/nfs/dbraw/zinc/15/72/14/1206157214.db2.gz	YEQUXSQXLZWNKW-ZDUSSCGKSA-N	2	0	336.436	2.067	10	5		EEBERP
O=[N+]([O-])c1cccc([C@@H]([NH2+]CCN2CC[NH2+]CC2)c2ccccc2)c1	ZINC000423204618	466696722	/nfs/dbraw/zinc/69/67/22/466696722.db2.gz	OBCNIXFHFFLGDE-IBGZPJMESA-N	2	0	340.427	2.179	10	5		EEBERP
C[C@H]1C[NH2+]CC[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1	ZINC000414948086	467456308	/nfs/dbraw/zinc/45/63/08/467456308.db2.gz	XLNZMCGWSCGGRW-BLLLJJGKSA-N	2	0	329.404	2.083	10	5		EEBERP
Cn1ccnc1[C@H]([NH2+]C[C@@H]1CC[C@H]([NH3+])C1)c1ccc([N+](=O)[O-])cc1	ZINC000925879388	1206163495	/nfs/dbraw/zinc/16/34/95/1206163495.db2.gz	CURJMOGCJSIOHK-IVMMDQJWSA-N	2	0	329.404	2.135	10	5		EEBERP
C[C@H]([NH2+]C1CCC([NH+]2CCNCC2)CC1)c1ccc(N)c([N+](=O)[O-])c1	ZINC000817983267	785132288	/nfs/dbraw/zinc/13/22/88/785132288.db2.gz	LLZIDSURNJOTEO-JEYLPNPQSA-N	2	0	347.463	2.044	10	5		EEBERP
O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(C[NH+]3CCCC3)CC2)c1	ZINC000153744347	462686755	/nfs/dbraw/zinc/68/67/55/462686755.db2.gz	UQTJULDLUXYCDR-SFHVURJKSA-N	2	0	333.432	2.436	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@H]1[C@H]1CC[NH2+]C1)Nc1ccccc1[N+](=O)[O-]	ZINC000420389989	467391184	/nfs/dbraw/zinc/39/11/84/467391184.db2.gz	HQAVXNGULMUJHR-HOCLYGCPSA-N	2	0	346.431	2.387	10	5		EEBERP
O=[N+]([O-])c1ccc(F)cc1CN1C[C@H]2CC[C@@H](C1)[N@H+]2C1CC[NH2+]CC1	ZINC000903510446	1240738469	/nfs/dbraw/zinc/73/84/69/1240738469.db2.gz	PRQZIWCSPVIRES-CALCHBBNSA-N	2	0	348.422	2.135	10	5		EEBERP
Cc1c(C[C@@H](C[NH3+])C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000903988871	1242891244	/nfs/dbraw/zinc/89/12/44/1242891244.db2.gz	ZQEBTNAVYZYBGY-OCCSQVGLSA-N	2	0	331.420	2.105	10	5		EEBERP
O=[N+]([O-])c1ccc(NCCC[NH+]2CCN(c3cc[nH+]cc3)CC2)cn1	ZINC000344441093	161227821	/nfs/dbraw/zinc/22/78/21/161227821.db2.gz	VGOITWGYPJDJFU-UHFFFAOYSA-N	2	0	342.403	2.009	10	5		EEBERP
Cc1c(NC(=O)CC[NH+]2CC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-]	ZINC000292135097	275382124	/nfs/dbraw/zinc/38/21/24/275382124.db2.gz	LRKWGWCLFMRBQS-SFHVURJKSA-N	2	0	346.431	2.259	10	5		EEBERP
Cc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000284853337	464366173	/nfs/dbraw/zinc/36/61/73/464366173.db2.gz	DVDDRMJHGRGNFX-ZWKOTPCHSA-N	2	0	342.399	2.361	10	5		EEBERP
C[C@@H]1C[C@@H](N(C)Cc2cc3c(cc2[N+](=O)[O-])OCCO3)CC[N@@H+]1C	ZINC000611273932	469217750	/nfs/dbraw/zinc/21/77/50/469217750.db2.gz	DRFWGHVRNJKCFE-OCCSQVGLSA-N	2	0	335.404	2.281	10	5		EEBERP
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@H]1CCC[NH2+]C1	ZINC000414835969	313100500	/nfs/dbraw/zinc/10/05/00/313100500.db2.gz	IXACSRMLFHGVAM-UONOGXRCSA-N	2	0	334.420	2.291	10	5		EEBERP
C[N@H+](CCNC(=O)CC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])cc1	ZINC001267232887	1178559259	/nfs/dbraw/zinc/55/92/59/1178559259.db2.gz	OLTQFFOEVFIDCJ-UHFFFAOYSA-N	2	0	348.447	2.019	10	5		EEBERP
COC(=O)[C@]12C[C@H]([NH3+])C[C@H]1C[N@@H+]([C@H](C)c1cc([N+](=O)[O-])ccc1C)C2	ZINC000903492946	1240658405	/nfs/dbraw/zinc/65/84/05/1240658405.db2.gz	MIIFNVPOIACTNA-NPSOMJIGSA-N	2	0	347.415	2.177	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000420409504	467398225	/nfs/dbraw/zinc/39/82/25/467398225.db2.gz	XCWMLOYGSUEKGT-RHSMWYFYSA-N	2	0	346.431	2.387	10	5		EEBERP
Cc1cc(NCCN(C)CCC[NH+](C)C)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000596423848	485612918	/nfs/dbraw/zinc/61/29/18/485612918.db2.gz	DDDCKNJWURZQRQ-UHFFFAOYSA-N	2	0	345.447	2.169	10	5		EEBERP
CN(CC[NH2+]Cc1ccccc1[N+](=O)[O-])C(=O)CC[NH+]1CCCCC1	ZINC001267117892	1178282845	/nfs/dbraw/zinc/28/28/45/1178282845.db2.gz	YJBXETAKHJCPAF-UHFFFAOYSA-N	2	0	348.447	2.019	10	5		EEBERP
C[NH+](C)[C@H]1C[C@@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1	ZINC000848558753	1338721692	/nfs/dbraw/zinc/72/16/92/1338721692.db2.gz	RRHKZOUWEYHDJU-UJKQEGAGSA-N	2	0	332.448	2.493	10	5		EEBERP
C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](n2cc(C[NH3+])nn2)C1	ZINC000420385713	467389662	/nfs/dbraw/zinc/38/96/62/467389662.db2.gz	UELCJNBUSMVVOR-WBMJQRKESA-N	2	0	330.392	2.043	10	5		EEBERP
Cc1c(C[N@@H+](C)CC2CC[NH+](C[C@@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000105862618	159309998	/nfs/dbraw/zinc/30/99/98/159309998.db2.gz	VNYJABSCHVONSZ-CQSZACIVSA-N	2	0	335.448	2.428	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@]2(C1)CCC[NH2+]C2	ZINC000518187785	468108137	/nfs/dbraw/zinc/10/81/37/468108137.db2.gz	IIKLCPSEMNGTCD-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
[NH3+]C1CCN(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1	ZINC000925814872	1206156904	/nfs/dbraw/zinc/15/69/04/1206156904.db2.gz	MAPKWPMLNRGWND-QAPCUYQASA-N	2	0	346.475	2.319	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CCCC1	ZINC001267841309	1180619370	/nfs/dbraw/zinc/61/93/70/1180619370.db2.gz	QJASQRJTZNKKFD-UHFFFAOYSA-N	2	0	348.447	2.065	10	5		EEBERP
C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC[C@@H]1C[NH2+]C[C@H]1C	ZINC000903973848	1242810448	/nfs/dbraw/zinc/81/04/48/1242810448.db2.gz	HAIJGOQTMOGWIE-HZSPNIEDSA-N	2	0	334.420	2.147	10	5		EEBERP
COc1cc(F)c([N+](=O)[O-])c(NCCN(C)CCC[NH+](C)C)c1	ZINC000853800041	1292459116	/nfs/dbraw/zinc/45/91/16/1292459116.db2.gz	YABYUMSYWIMXDR-UHFFFAOYSA-N	2	0	328.388	2.038	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@H]1[C@@H]1CC[NH2+]C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000420409503	467398342	/nfs/dbraw/zinc/39/83/42/467398342.db2.gz	XCWMLOYGSUEKGT-PBHICJAKSA-N	2	0	346.431	2.387	10	5		EEBERP
COC[C@@H](CCC[NH3+])[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1	ZINC000423091824	536596627	/nfs/dbraw/zinc/59/66/27/536596627.db2.gz	YZGGQMBKTLXFBU-GFCCVEGCSA-N	2	0	335.326	2.457	10	5		EEBERP
O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(C[NH+]3CCCC3)CC2)cc1	ZINC000776578682	577463036	/nfs/dbraw/zinc/46/30/36/577463036.db2.gz	IDTQSINMWDXDEJ-SFHVURJKSA-N	2	0	333.432	2.436	10	5		EEBERP
CN(CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)C(=O)CC[NH+]1CCCCC1	ZINC001267475217	1179110010	/nfs/dbraw/zinc/11/00/10/1179110010.db2.gz	YFGKVGQWDGUZDG-UHFFFAOYSA-N	2	0	348.447	2.019	10	5		EEBERP
[NH3+]C1CCN(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1	ZINC000925814871	1206156784	/nfs/dbraw/zinc/15/67/84/1206156784.db2.gz	MAPKWPMLNRGWND-MAUKXSAKSA-N	2	0	346.475	2.319	10	5		EEBERP
Cc1nccn1C[C@@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1	ZINC000154412440	462765493	/nfs/dbraw/zinc/76/54/93/462765493.db2.gz	SWKRWXFGQZKWMC-IRXDYDNUSA-N	2	0	330.388	2.298	10	5		EEBERP
O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H](O)C[NH+]1CCCCC1)C1CC1	ZINC000151253575	463500290	/nfs/dbraw/zinc/50/02/90/463500290.db2.gz	BPNGSVAMSSJAIE-MSOLQXFVSA-N	2	0	347.459	2.352	10	5		EEBERP
Cc1cc(N2CC[C@@H]3OCC[N@@H+](C)[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000284853318	464366336	/nfs/dbraw/zinc/36/63/36/464366336.db2.gz	DVDDRMJHGRGNFX-MSOLQXFVSA-N	2	0	342.399	2.361	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000592478426	468706302	/nfs/dbraw/zinc/70/63/02/468706302.db2.gz	BGTYVOARRKQMHP-CABCVRRESA-N	2	0	346.431	2.387	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(CO[C@@H]2CC[NH2+]C2)CC1	ZINC000600763649	468651102	/nfs/dbraw/zinc/65/11/02/468651102.db2.gz	FZVQRPDOSMGNEB-QGZVFWFLSA-N	2	0	349.431	2.194	10	5		EEBERP
CC(C)[NH2+]C1(CO)CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1	ZINC000599082729	469110795	/nfs/dbraw/zinc/11/07/95/469110795.db2.gz	GJFDAEYCAKGYAF-UHFFFAOYSA-N	2	0	344.415	2.472	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1	ZINC001270249920	1184959256	/nfs/dbraw/zinc/95/92/56/1184959256.db2.gz	ZVUKSJGHUTULAT-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
O=C(CCN1CC[C@]2(C1)CCCC[NH2+]2)Nc1ccc([N+](=O)[O-])cc1	ZINC000923539965	789744153	/nfs/dbraw/zinc/74/41/53/789744153.db2.gz	RGLUJJNSCDAVDF-KRWDZBQOSA-N	2	0	332.404	2.141	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)CC1CC[NH+](C[C@@H](C)O)CC1	ZINC000183332869	235013742	/nfs/dbraw/zinc/01/37/42/235013742.db2.gz	MKASMZQRHPVAAC-OAHLLOKOSA-N	2	0	335.448	2.428	10	5		EEBERP
CC[C@@H](CO)[NH+]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000272786301	269020586	/nfs/dbraw/zinc/02/05/86/269020586.db2.gz	BGWFFXMQSVFWLT-AWEZNQCLSA-N	2	0	344.415	2.344	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)CCN1CC[NH+](C)CC1	ZINC000185889202	463899972	/nfs/dbraw/zinc/89/99/72/463899972.db2.gz	YTCVVYCBZNNJEZ-UHFFFAOYSA-N	2	0	334.464	2.409	10	5		EEBERP
CCOc1ccc([C@@H](C)[NH2+]CCN2CCC([NH3+])CC2)cc1[N+](=O)[O-]	ZINC000925816464	1206157128	/nfs/dbraw/zinc/15/71/28/1206157128.db2.gz	YEQUXSQXLZWNKW-CYBMUJFWSA-N	2	0	336.436	2.067	10	5		EEBERP
C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1	ZINC000594508152	468611401	/nfs/dbraw/zinc/61/14/01/468611401.db2.gz	BGPOSIXMSCYGID-IOASZLSFSA-N	2	0	334.420	2.242	10	5		EEBERP
C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(C(=O)NCC[NH+](C)C)CC1	ZINC000195519189	140882216	/nfs/dbraw/zinc/88/22/16/140882216.db2.gz	WXEKACBUOUHCSZ-AWEZNQCLSA-N	2	0	348.447	2.046	10	5		EEBERP
Cc1c(NC(=O)CC[N@@H+]2CCC[C@]3(CC[NH2+]C3)C2)cccc1[N+](=O)[O-]	ZINC000420358890	467377226	/nfs/dbraw/zinc/37/72/26/467377226.db2.gz	FHVDYLZGXXITHE-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CCC([NH+]2CCNCC2)CC1	ZINC000415058090	467478473	/nfs/dbraw/zinc/47/84/73/467478473.db2.gz	SICSGNIDXSCZJB-HWKANZROSA-N	2	0	344.459	2.414	10	5		EEBERP
CC[NH+]1CCN([C@H](C)C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1	ZINC000872022596	1198028520	/nfs/dbraw/zinc/02/85/20/1198028520.db2.gz	KAEMSIMRPUPHCX-ZIAGYGMSSA-N	2	0	338.427	2.411	10	5		EEBERP
C[NH+](C)CCC(=O)N1CCC(C)([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1	ZINC001673982187	1356767263	/nfs/dbraw/zinc/76/72/63/1356767263.db2.gz	OQGLYMQCUOGSPN-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
Cc1ccc(C[NH2+]C2CCC([NH+]3CCNCC3)CC2)cc1[N+](=O)[O-]	ZINC000415050671	467476359	/nfs/dbraw/zinc/47/63/59/467476359.db2.gz	JAOVFHZYCDLSEQ-UHFFFAOYSA-N	2	0	332.448	2.209	10	5		EEBERP
C[C@@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022464	1198027724	/nfs/dbraw/zinc/02/77/24/1198027724.db2.gz	XGARSVIGGFBABN-CYBMUJFWSA-N	2	0	338.427	2.411	10	5		EEBERP
C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1C[C@@H]([NH+](C)C)C1	ZINC000594510904	468612795	/nfs/dbraw/zinc/61/27/95/468612795.db2.gz	POVVZMGKMGZOQP-HEHGZKQESA-N	2	0	334.420	2.242	10	5		EEBERP
C[NH2+]CCCC(=O)N1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1	ZINC000596653321	469323146	/nfs/dbraw/zinc/32/31/46/469323146.db2.gz	JQPRHFSVLPFKMT-CQSZACIVSA-N	2	0	348.447	2.236	10	5		EEBERP
C[N@@H+]1CCCN(CCC[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CC1	ZINC000729683876	576672072	/nfs/dbraw/zinc/67/20/72/576672072.db2.gz	FAISDJXVKZVXDM-UHFFFAOYSA-N	2	0	340.855	2.365	10	5		EEBERP
COC[C@@H](CCC[NH3+])[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-]	ZINC000925764295	1206151773	/nfs/dbraw/zinc/15/17/73/1206151773.db2.gz	XYYJUJHOZVCWQI-GFCCVEGCSA-N	2	0	346.225	2.201	10	5		EEBERP
CC[N+](CC)(CCO)Cc1ccc(C[N+](CC)(CC)CCO)cc1	ZINC000005688390	717101205	/nfs/dbraw/zinc/10/12/05/717101205.db2.gz	SUOQUTIAQQLGOV-UHFFFAOYSA-N	2	0	338.536	2.384	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000592478663	468706751	/nfs/dbraw/zinc/70/67/51/468706751.db2.gz	HBKBIYQPDSGAND-WMLDXEAASA-N	2	0	346.431	2.387	10	5		EEBERP
Cc1c(NC(=O)CC[N@@H+]2CC[C@]3(C2)CCC[NH2+]C3)cccc1[N+](=O)[O-]	ZINC000583694034	468742847	/nfs/dbraw/zinc/74/28/47/468742847.db2.gz	UDCGWUCMMUQQFF-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
Cc1ccc([C@H](C)[NH2+]C[C@H]2CC3(CC[NH2+]CC3)C(=O)O2)cc1[N+](=O)[O-]	ZINC000925853439	1206160848	/nfs/dbraw/zinc/16/08/48/1206160848.db2.gz	JDDOUKVBFRBPPP-DZGCQCFKSA-N	2	0	347.415	2.239	10	5		EEBERP
C[NH2+]CCOCC[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1	ZINC000706697603	785601989	/nfs/dbraw/zinc/60/19/89/785601989.db2.gz	NFDLYWFXNZRQPF-UHFFFAOYSA-N	2	0	346.225	2.025	10	5		EEBERP
C[C@H]([NH2+]C1CCN(CC[NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872022465	1198028596	/nfs/dbraw/zinc/02/85/96/1198028596.db2.gz	XGARSVIGGFBABN-ZDUSSCGKSA-N	2	0	338.427	2.411	10	5		EEBERP
O=[N+]([O-])c1cccc([C@H]([NH2+]CCN2CC[NH2+]CC2)c2ccccc2)c1	ZINC000423204619	466696327	/nfs/dbraw/zinc/69/63/27/466696327.db2.gz	OBCNIXFHFFLGDE-LJQANCHMSA-N	2	0	340.427	2.179	10	5		EEBERP
CN1CCC(CNc2ccc([N+](=O)[O-])cn2)([NH+]2CCCCC2)CC1	ZINC000301429611	465962092	/nfs/dbraw/zinc/96/20/92/465962092.db2.gz	FRFANPPAWHOELK-UHFFFAOYSA-N	2	0	333.436	2.352	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@@H]1[C@@H]1CC[NH2+]C1)Nc1ccccc1[N+](=O)[O-]	ZINC000420389985	467390381	/nfs/dbraw/zinc/39/03/81/467390381.db2.gz	HQAVXNGULMUJHR-GDBMZVCRSA-N	2	0	346.431	2.387	10	5		EEBERP
COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@H]([NH3+])CCO2)cc1[N+](=O)[O-]	ZINC000593320434	468937868	/nfs/dbraw/zinc/93/78/68/468937868.db2.gz	IWITZBQQEKVRRK-IIDMSEBBSA-N	2	0	349.431	2.464	10	5		EEBERP
C[C@H]([NH2+]CC(C)(C)N1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872020291	1198027125	/nfs/dbraw/zinc/02/71/25/1198027125.db2.gz	FJQMEKUXIVYBSW-ZDUSSCGKSA-N	2	0	338.427	2.411	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@]23CCC[C@H]2[NH2+]CC3)n1	ZINC000925842160	1206159292	/nfs/dbraw/zinc/15/92/92/1206159292.db2.gz	XJFHGDVIRJRGIJ-KCYZZUKISA-N	2	0	333.436	2.397	10	5		EEBERP
Cc1c(C[C@H](C[NH3+])C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000903988869	1242892018	/nfs/dbraw/zinc/89/20/18/1242892018.db2.gz	ZQEBTNAVYZYBGY-GXTWGEPZSA-N	2	0	331.420	2.105	10	5		EEBERP
CC[C@H](CO)[NH+]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1	ZINC000272786308	269020616	/nfs/dbraw/zinc/02/06/16/269020616.db2.gz	BGWFFXMQSVFWLT-CQSZACIVSA-N	2	0	344.415	2.344	10	5		EEBERP
O=[N+]([O-])c1cccc(OCC[NH+]2CCC(CO[C@H]3CC[NH2+]C3)CC2)c1	ZINC000600768513	468652749	/nfs/dbraw/zinc/65/27/49/468652749.db2.gz	XCGMCXGVSVDNOH-SFHVURJKSA-N	2	0	349.431	2.064	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@@H]2CCCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])C1	ZINC000593728687	469111075	/nfs/dbraw/zinc/11/10/75/469111075.db2.gz	CIBMDFHWKRHESR-RVKKMQEKSA-N	2	0	349.431	2.334	10	5		EEBERP
C[NH+](C)CCC(=O)NCC1([NH2+]Cc2ccc([N+](=O)[O-])cc2)CCCC1	ZINC001482227807	1184346539	/nfs/dbraw/zinc/34/65/39/1184346539.db2.gz	CPVPKFDWZWZDKH-UHFFFAOYSA-N	2	0	348.447	2.065	10	5		EEBERP
C[C@@H]([NH2+][C@@H](C)CCN1CC[NH+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872062067	1198037612	/nfs/dbraw/zinc/03/76/12/1198037612.db2.gz	COUMRIOKSOCZBZ-UONOGXRCSA-N	2	0	338.427	2.411	10	5		EEBERP
CC[N@H+](CCNC(=O)C1([NH+](C)C)CCC1)Cc1ccc([N+](=O)[O-])cc1	ZINC001317479635	1332259609	/nfs/dbraw/zinc/25/96/09/1332259609.db2.gz	JKVPVBDVMJHHSV-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
O=C(CC[N@@H+]1CCCC[C@@H]1[C@H]1CC[NH2+]C1)Nc1ccc([N+](=O)[O-])cc1	ZINC000420409505	467399180	/nfs/dbraw/zinc/39/91/80/467399180.db2.gz	XCWMLOYGSUEKGT-WMLDXEAASA-N	2	0	346.431	2.387	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@@H]([NH3+])CCO1	ZINC000593731224	469112997	/nfs/dbraw/zinc/11/29/97/469112997.db2.gz	UQEGUABIWUXKBT-YXJHDRRASA-N	2	0	349.431	2.464	10	5		EEBERP
O=[N+]([O-])c1ccn(C2CC[NH+](CCC3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)n1	ZINC000923374716	789456848	/nfs/dbraw/zinc/45/68/48/789456848.db2.gz	YPNIQPAMUKVDOC-GOOCMWNKSA-N	2	0	333.436	2.349	10	5		EEBERP
Cc1c(C[N@@H+](C)CC2CC[NH+](C[C@H](C)O)CC2)cccc1[N+](=O)[O-]	ZINC000105862621	159310169	/nfs/dbraw/zinc/31/01/69/159310169.db2.gz	VNYJABSCHVONSZ-AWEZNQCLSA-N	2	0	335.448	2.428	10	5		EEBERP
COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@H]1C[C@H]([NH3+])CCO1	ZINC000593731221	469113417	/nfs/dbraw/zinc/11/34/17/469113417.db2.gz	UQEGUABIWUXKBT-QGPMSJSTSA-N	2	0	349.431	2.464	10	5		EEBERP
C[C@@H]([NH2+]CCCC[NH+]1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872023593	1198028655	/nfs/dbraw/zinc/02/86/55/1198028655.db2.gz	SVVSFYXEBDJZEF-CQSZACIVSA-N	2	0	338.427	2.412	10	5		EEBERP
CN(CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)C(=O)C(C)(C)[NH+]1CCCC1	ZINC001567541744	1342782711	/nfs/dbraw/zinc/78/27/11/1342782711.db2.gz	BAGXLIWHEGHOJH-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC([NH+]2CCNCC2)CC1	ZINC000415050597	467475975	/nfs/dbraw/zinc/47/59/75/467475975.db2.gz	ISUXKHABFPQZGK-UHFFFAOYSA-N	2	0	332.448	2.209	10	5		EEBERP
O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2C[NH2+]CCC2(F)F)n1	ZINC000925775426	1206153120	/nfs/dbraw/zinc/15/31/20/1206153120.db2.gz	GNNLLBZDNVUUSO-FRRDWIJNSA-N	2	0	343.378	2.109	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C[NH+]2CCOCC2)CC1	ZINC000183265745	464837574	/nfs/dbraw/zinc/83/75/74/464837574.db2.gz	OTQACEAOPLBMGA-UHFFFAOYSA-N	2	0	333.432	2.447	10	5		EEBERP
CC[NH+]1CCN(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)CC1	ZINC000449743675	467704176	/nfs/dbraw/zinc/70/41/76/467704176.db2.gz	AGQBELIYNARPJM-UHFFFAOYSA-N	2	0	334.464	2.409	10	5		EEBERP
COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(C[NH+](C)C)CC2)c1	ZINC000589495070	468156414	/nfs/dbraw/zinc/15/64/14/468156414.db2.gz	QXULEYLVVNACRM-UHFFFAOYSA-N	2	0	335.404	2.155	10	5		EEBERP
Cc1cc(N2CC[C@H]3OCC[N@@H+](C)[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1	ZINC000284853325	464366511	/nfs/dbraw/zinc/36/65/11/464366511.db2.gz	DVDDRMJHGRGNFX-QZTJIDSGSA-N	2	0	342.399	2.361	10	5		EEBERP
Cc1c(NC(=O)CC[N@@H+]2CC[C@@]3(C2)CCC[NH2+]C3)cccc1[N+](=O)[O-]	ZINC000583694035	468742177	/nfs/dbraw/zinc/74/21/77/468742177.db2.gz	UDCGWUCMMUQQFF-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
Cc1c(NC(=O)CC[N@@H+]2CCC[C@@]3(CC[NH2+]C3)C2)cccc1[N+](=O)[O-]	ZINC000420358915	467377238	/nfs/dbraw/zinc/37/72/38/467377238.db2.gz	FHVDYLZGXXITHE-SFHVURJKSA-N	2	0	346.431	2.307	10	5		EEBERP
Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@]2(C1)CCC[NH2+]C2	ZINC000517937209	468102248	/nfs/dbraw/zinc/10/22/48/468102248.db2.gz	PBXVRUAEHDUYGX-GOSISDBHSA-N	2	0	346.431	2.307	10	5		EEBERP
[NH3+][C@@H]1CCO[C@H]([C@H]2CCCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000593730640	469113513	/nfs/dbraw/zinc/11/35/13/469113513.db2.gz	PCLNVIOPFLGJHZ-OLMNPRSZSA-N	2	0	349.431	2.334	10	5		EEBERP
O=[N+]([O-])c1cccc(N2CC[NH+](CC3C[C@H]4CC[C@@H](C3)[NH2+]4)CC2)c1	ZINC000903886420	1242324262	/nfs/dbraw/zinc/32/42/62/1242324262.db2.gz	SCEZPHUHMHVNIW-MQVJKMGUSA-N	2	0	330.432	2.247	10	5		EEBERP
C[NH+](C)CCC(=O)NC1(C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1	ZINC001270248674	1184957683	/nfs/dbraw/zinc/95/76/83/1184957683.db2.gz	GUZDWUUQOWUNTF-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
C[C@@H]([NH2+]CCCN1CCC[N@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872034427	1198031971	/nfs/dbraw/zinc/03/19/71/1198031971.db2.gz	OEABGLGGWBUHKE-CQSZACIVSA-N	2	0	338.427	2.412	10	5		EEBERP
[NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)C1	ZINC000593730646	469113440	/nfs/dbraw/zinc/11/34/40/469113440.db2.gz	PCLNVIOPFLGJHZ-ZTFGCOKTSA-N	2	0	349.431	2.334	10	5		EEBERP
C[C@H]([NH2+]CCN1CCC([NH+](C)C)CC1)c1c(F)cccc1[N+](=O)[O-]	ZINC000872041762	1198033444	/nfs/dbraw/zinc/03/34/44/1198033444.db2.gz	VRKJILMVJQQMRY-ZDUSSCGKSA-N	2	0	338.427	2.411	10	5		EEBERP
CN(CCC[NH2+]Cc1cccc([N+](=O)[O-])c1)C(=O)C1([NH+](C)C)CCC1	ZINC001569210627	1125166705	/nfs/dbraw/zinc/16/67/05/1125166705.db2.gz	ZPOXHXZOWCMDIF-UHFFFAOYSA-N	2	0	348.447	2.017	10	5		EEBERP
O=C(CC[N@@H+]1CCC[C@H]([C@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000592478429	468706765	/nfs/dbraw/zinc/70/67/65/468706765.db2.gz	BGTYVOARRKQMHP-LSDHHAIUSA-N	2	0	346.431	2.387	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CC[C@]2(CC[N@@H+](C)C2)C1	ZINC000292257124	464175056	/nfs/dbraw/zinc/17/50/56/464175056.db2.gz	YGKKCHAEZIWEIY-SFHVURJKSA-N	2	0	346.431	2.259	10	5		EEBERP
C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](n2cc(C[NH3+])nn2)C1	ZINC000420385704	467389303	/nfs/dbraw/zinc/38/93/03/467389303.db2.gz	UELCJNBUSMVVOR-BLLLJJGKSA-N	2	0	330.392	2.043	10	5		EEBERP
COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2C[C@@H]([NH3+])CCO2)cc1[N+](=O)[O-]	ZINC000593320433	468938685	/nfs/dbraw/zinc/93/86/85/468938685.db2.gz	IWITZBQQEKVRRK-HDMKZQKVSA-N	2	0	349.431	2.464	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(C[NH+]3CCC(O)CC3)CC2)cc1	ZINC000952993290	796139626	/nfs/dbraw/zinc/13/96/26/796139626.db2.gz	GHTIMNKVGFINKA-UHFFFAOYSA-N	2	0	347.459	2.306	10	5		EEBERP
O=[N+]([O-])c1ccc(CC[NH+]2CCC(O)(C[NH+]3CCCCC3)CC2)cc1	ZINC001473877890	1110583387	/nfs/dbraw/zinc/58/33/87/1110583387.db2.gz	YKKFNXMDGNAZIH-UHFFFAOYSA-N	2	0	347.459	2.450	10	5		EEBERP
C[NH+](C)CCCN(CCC[NH+](C)C)c1nc2cc([N+](=O)[O-])ccc2[nH]1	ZINC000297443225	294245556	/nfs/dbraw/zinc/24/55/56/294245556.db2.gz	IUUXQJLONYGBJG-UHFFFAOYSA-N	2	0	348.451	2.181	10	5		EEBERP
Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1	ZINC000933740761	676843340	/nfs/dbraw/zinc/84/33/40/676843340.db2.gz	QKYLSAMBVOXKRA-KDOFPFPSSA-N	2	0	346.431	2.115	10	5		EEBERP
O=C(C[N@@H+]1CCC[C@@H](C2CC[NH2+]CC2)C1)Nc1ccccc1[N+](=O)[O-]	ZINC000595901239	469072287	/nfs/dbraw/zinc/07/22/87/469072287.db2.gz	SSEGDHCNQDDFGA-OAHLLOKOSA-N	2	0	346.431	2.245	10	5		EEBERP
Cc1c(C[C@@H](C[NH3+])C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C	ZINC000903988870	1242892432	/nfs/dbraw/zinc/89/24/32/1242892432.db2.gz	ZQEBTNAVYZYBGY-JSGCOSHPSA-N	2	0	331.420	2.105	10	5		EEBERP
Cc1cc(C)c([N+](=O)[O-])c(N(CCC[NH+](C)C)CCC[NH+](C)C)n1	ZINC000359105925	164060234	/nfs/dbraw/zinc/06/02/34/164060234.db2.gz	XMVFRHDWOYMUPM-UHFFFAOYSA-N	2	0	337.468	2.316	10	5		EEBERP
O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc4c3CC[NH2+]C4)CC2)n1	ZINC000595890398	469065788	/nfs/dbraw/zinc/06/57/88/469065788.db2.gz	CXUMWHPVSODCLF-UHFFFAOYSA-N	2	0	341.415	2.274	10	5		EEBERP
C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)[C@@H]1CN(C)CCN1C	ZINC001621533043	1352369184	/nfs/dbraw/zinc/36/91/84/1352369184.db2.gz	XNJWFURVGFZVPL-WZEYAMKMSA-N	2	0	332.448	2.222	10	5		EEBERP