smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CC[N@H+](CCCNC(=O)CC(C)(C)C)Cc1c([N+](=O)[O-])ncn1C ZINC001566540302 1125709732 /nfs/dbraw/zinc/70/97/32/1125709732.db2.gz GNFJFBAPZSXNHF-UHFFFAOYSA-N 1 1 339.440 2.093 10 5 EEBEMO CC[N@@H+](CCCNC(=O)CC(C)(C)C)Cc1c([N+](=O)[O-])ncn1C ZINC001566540302 1125709737 /nfs/dbraw/zinc/70/97/37/1125709737.db2.gz GNFJFBAPZSXNHF-UHFFFAOYSA-N 1 1 339.440 2.093 10 5 EEBEMO O=C(NCC[NH+]1CCC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001446541578 1101003422 /nfs/dbraw/zinc/00/34/22/1101003422.db2.gz YQQRMTOXBOYGBJ-UHFFFAOYSA-N 1 1 326.356 2.092 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)CCc1ccon1 ZINC001496744003 1101384799 /nfs/dbraw/zinc/38/47/99/1101384799.db2.gz IPUMQCOBDRCIKW-UHFFFAOYSA-N 1 1 346.387 2.106 10 5 EEBEMO C[C@@H](C(=O)N1C[C@@H]2C[N@H+](C)CC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1F ZINC001452719915 1105661830 /nfs/dbraw/zinc/66/18/30/1105661830.db2.gz APRLWZBVHDKYMS-UPJWGTAASA-N 1 1 335.379 2.248 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3ccc(NC4CC4)c([N+](=O)[O-])c3)[C@H]2C1 ZINC001529267891 1121384092 /nfs/dbraw/zinc/38/40/92/1121384092.db2.gz JSCZJZFGSWYJCX-AEGPPILISA-N 1 1 344.415 2.239 10 5 EEBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(F)(F)F ZINC001568476064 1124535755 /nfs/dbraw/zinc/53/57/55/1124535755.db2.gz NLCPWPMAVXKBFH-UHFFFAOYSA-N 1 1 333.310 2.437 10 5 EEBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)CC(F)(F)F ZINC001568476064 1124535765 /nfs/dbraw/zinc/53/57/65/1124535765.db2.gz NLCPWPMAVXKBFH-UHFFFAOYSA-N 1 1 333.310 2.437 10 5 EEBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451258909 243052136 /nfs/dbraw/zinc/05/21/36/243052136.db2.gz XAWUCTIPOXGXGX-GXTWGEPZSA-N 1 1 332.360 2.238 10 5 EEBEMO CC[N@@H+](C)C[C@H]1CCN(C(=O)c2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000174532541 207027898 /nfs/dbraw/zinc/02/78/98/207027898.db2.gz UBVUUHMEGFRYSE-GFCCVEGCSA-N 1 1 330.388 2.490 10 5 EEBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000177179155 207303220 /nfs/dbraw/zinc/30/32/20/207303220.db2.gz DUQDTTWLNOFANI-AWEZNQCLSA-N 1 1 343.387 2.203 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H]2CCC[N@H+]2C[C@H]1C ZINC000249264197 160377334 /nfs/dbraw/zinc/37/73/34/160377334.db2.gz IJUUOQGZRSUNMZ-YPMHNXCESA-N 1 1 334.376 2.304 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000245443679 160235434 /nfs/dbraw/zinc/23/54/34/160235434.db2.gz XKBPXFAHIQCNRF-ZBFHGGJFSA-N 1 1 346.431 2.400 10 5 EEBEMO CO[C@@H]1CC[C@H]2OCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000246420188 160278079 /nfs/dbraw/zinc/27/80/79/160278079.db2.gz IGINUDVEFBGIRH-IXDOHACOSA-N 1 1 336.388 2.242 10 5 EEBEMO CO[C@@H]1CC[C@H]2OCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000246420188 160278080 /nfs/dbraw/zinc/27/80/80/160278080.db2.gz IGINUDVEFBGIRH-IXDOHACOSA-N 1 1 336.388 2.242 10 5 EEBEMO CCOCC[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000247385384 160323334 /nfs/dbraw/zinc/32/33/34/160323334.db2.gz WKPNBCYVBSTIFI-OAHLLOKOSA-N 1 1 337.420 2.016 10 5 EEBEMO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1N1CCOCC1 ZINC000248415998 160345081 /nfs/dbraw/zinc/34/50/81/160345081.db2.gz ILUMGNBXARDVRR-BLLLJJGKSA-N 1 1 339.823 2.401 10 5 EEBEMO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1N1CCOCC1 ZINC000248415998 160345083 /nfs/dbraw/zinc/34/50/83/160345083.db2.gz ILUMGNBXARDVRR-BLLLJJGKSA-N 1 1 339.823 2.401 10 5 EEBEMO COc1cc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)ccc1[N+](=O)[O-] ZINC000352541529 162178581 /nfs/dbraw/zinc/17/85/81/162178581.db2.gz YXGMLUHOZLNEDV-INIZCTEOSA-N 1 1 349.431 2.290 10 5 EEBEMO O=C(Nc1cccc([N+](=O)[O-])c1)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000414668645 313060076 /nfs/dbraw/zinc/06/00/76/313060076.db2.gz YXGOHBKBTPUSDZ-HNNXBMFYSA-N 1 1 327.344 2.168 10 5 EEBEMO O=C(C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000441278814 315178142 /nfs/dbraw/zinc/17/81/42/315178142.db2.gz QMSPIWKHZATQFG-UONOGXRCSA-N 1 1 333.388 2.282 10 5 EEBEMO O=C(C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000441278814 315178146 /nfs/dbraw/zinc/17/81/46/315178146.db2.gz QMSPIWKHZATQFG-UONOGXRCSA-N 1 1 333.388 2.282 10 5 EEBEMO Cc1ccnc([C@@H]2CC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000576238015 320153962 /nfs/dbraw/zinc/15/39/62/320153962.db2.gz QKHLTJHCOUPANV-CQSZACIVSA-N 1 1 340.383 2.387 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000296028146 465056259 /nfs/dbraw/zinc/05/62/59/465056259.db2.gz ZNZRUGNRWBYLJY-UKRRQHHQSA-N 1 1 347.415 2.499 10 5 EEBEMO CC[C@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000117307619 462799209 /nfs/dbraw/zinc/79/92/09/462799209.db2.gz RQUVLCMVXNTBCG-FSNWXROXSA-N 1 1 347.415 2.177 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CNc1cc2c(cc1[N+](=O)[O-])CCC(=O)N2 ZINC000171218014 463816604 /nfs/dbraw/zinc/81/66/04/463816604.db2.gz WOIXZWAHEPINQP-ZDUSSCGKSA-N 1 1 348.403 2.002 10 5 EEBEMO COC(=O)[C@H](C1CC1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000359584290 465469788 /nfs/dbraw/zinc/46/97/88/465469788.db2.gz AAFGTWMYAASEAX-INIZCTEOSA-N 1 1 334.372 2.390 10 5 EEBEMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](S(=O)(=O)N(C)C)C1 ZINC000285515395 464592995 /nfs/dbraw/zinc/59/29/95/464592995.db2.gz GGQODDIXABKTCJ-QWHCGFSZSA-N 1 1 341.433 2.012 10 5 EEBEMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@@H](S(=O)(=O)N(C)C)C1 ZINC000285515395 464592998 /nfs/dbraw/zinc/59/29/98/464592998.db2.gz GGQODDIXABKTCJ-QWHCGFSZSA-N 1 1 341.433 2.012 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000252443699 464956488 /nfs/dbraw/zinc/95/64/88/464956488.db2.gz NVNXHVOZHUHUJR-GDBMZVCRSA-N 1 1 346.431 2.400 10 5 EEBEMO Cc1ccncc1N1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000340105012 465770868 /nfs/dbraw/zinc/77/08/68/465770868.db2.gz KSHDYVCCLKERRU-UHFFFAOYSA-N 1 1 342.399 2.499 10 5 EEBEMO O=C(N[C@H]1CC[N@H+]2CCCC[C@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000299508958 465780573 /nfs/dbraw/zinc/78/05/73/465780573.db2.gz BBFADOYJXCDVIM-JKSUJKDBSA-N 1 1 328.372 2.433 10 5 EEBEMO CCN1C(=O)N=NC1C1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000367012553 466071273 /nfs/dbraw/zinc/07/12/73/466071273.db2.gz BGLHMYAWQIYPCF-UHFFFAOYSA-N 1 1 349.366 2.431 10 5 EEBEMO Cn1nccc1C1=CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000367531198 466396577 /nfs/dbraw/zinc/39/65/77/466396577.db2.gz MSGAFWVUYLJROO-UHFFFAOYSA-N 1 1 328.372 2.496 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CCCC[C@H]1[NH+]1CCOCC1 ZINC000372800091 466593945 /nfs/dbraw/zinc/59/39/45/466593945.db2.gz GSRSBCSKCCMDNE-DLBZAZTESA-N 1 1 347.415 2.276 10 5 EEBEMO CCOc1cc(C[N@H+]2CCCC[C@H]2[C@@H]2CNC(=O)C2)ccc1[N+](=O)[O-] ZINC000372804192 466595686 /nfs/dbraw/zinc/59/56/86/466595686.db2.gz FEWIRSGPFVZHSI-GJZGRUSLSA-N 1 1 347.415 2.484 10 5 EEBEMO O=C(CC[N@@H+]1CCOC[C@@H]1CC(F)F)Nc1ccc([N+](=O)[O-])cc1 ZINC000411721306 466886006 /nfs/dbraw/zinc/88/60/06/466886006.db2.gz HZWDZXQWYLXENU-ZDUSSCGKSA-N 1 1 343.330 2.279 10 5 EEBEMO O=C(CC[N@H+]1CCOC[C@@H]1CC(F)F)Nc1ccc([N+](=O)[O-])cc1 ZINC000411721306 466886013 /nfs/dbraw/zinc/88/60/13/466886013.db2.gz HZWDZXQWYLXENU-ZDUSSCGKSA-N 1 1 343.330 2.279 10 5 EEBEMO Cc1cnc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)c([N+](=O)[O-])c1 ZINC000407996652 467492096 /nfs/dbraw/zinc/49/20/96/467492096.db2.gz SITKYEAQVOPGEV-XYPWUTKMSA-N 1 1 345.447 2.045 10 5 EEBEMO O=C(Cc1cccc([N+](=O)[O-])c1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456989244 467726712 /nfs/dbraw/zinc/72/67/12/467726712.db2.gz KXHIXJCOAHJAEM-KRWDZBQOSA-N 1 1 325.368 2.310 10 5 EEBEMO Nc1c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)cc(F)cc1[N+](=O)[O-] ZINC000600472056 468567799 /nfs/dbraw/zinc/56/77/99/468567799.db2.gz MKFOARGEAHEUPM-GFCCVEGCSA-N 1 1 336.367 2.063 10 5 EEBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(N)c1F)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591770 468629870 /nfs/dbraw/zinc/62/98/70/468629870.db2.gz KAVPXYQSQZOODG-MXWKQRLJSA-N 1 1 326.372 2.226 10 5 EEBEMO C[C@H](CNc1ccc([N+](=O)[O-])c(N)c1F)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591770 468629872 /nfs/dbraw/zinc/62/98/72/468629872.db2.gz KAVPXYQSQZOODG-MXWKQRLJSA-N 1 1 326.372 2.226 10 5 EEBEMO C[C@H](Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C)C1=CC[N@@H+](C)CC1 ZINC000601139639 468757939 /nfs/dbraw/zinc/75/79/39/468757939.db2.gz LCTIESDYMYIGQN-QMMMGPOBSA-N 1 1 333.314 2.409 10 5 EEBEMO Cc1cc(S(=O)(=O)N(C)c2cc[nH+]c(C)c2)c([N+](=O)[O-])s1 ZINC000601394801 468856724 /nfs/dbraw/zinc/85/67/24/468856724.db2.gz YMUYLUWRTVDLAG-UHFFFAOYSA-N 1 1 327.387 2.493 10 5 EEBEMO CN(C(=O)C[N@@H+]1CC[C@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000593119156 468878179 /nfs/dbraw/zinc/87/81/79/468878179.db2.gz VDOZWXPVNAUMHQ-AWEZNQCLSA-N 1 1 325.315 2.289 10 5 EEBEMO CN(C(=O)C[N@H+]1CC[C@]2(CC2(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000593119156 468878185 /nfs/dbraw/zinc/87/81/85/468878185.db2.gz VDOZWXPVNAUMHQ-AWEZNQCLSA-N 1 1 325.315 2.289 10 5 EEBEMO CCC1([NH+]2CCCC2)CCN(C(=O)c2n[nH]c(C)c2[N+](=O)[O-])CC1 ZINC000601743583 469000850 /nfs/dbraw/zinc/00/08/50/469000850.db2.gz BTSWIZZBBWTHNE-UHFFFAOYSA-N 1 1 335.408 2.107 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC[C@H]1C1(O)CC1 ZINC000562683928 469034453 /nfs/dbraw/zinc/03/44/53/469034453.db2.gz NEOGTIMCQGSLIX-HNNXBMFYSA-N 1 1 333.388 2.221 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCC[C@H]1C1(O)CC1 ZINC000562683928 469034458 /nfs/dbraw/zinc/03/44/58/469034458.db2.gz NEOGTIMCQGSLIX-HNNXBMFYSA-N 1 1 333.388 2.221 10 5 EEBEMO CCOc1ccc([C@H](C)[NH2+][C@H](CO)c2ccnn2C)cc1[N+](=O)[O-] ZINC000599052932 469101601 /nfs/dbraw/zinc/10/16/01/469101601.db2.gz BRIQMUVBPPWOPR-WCQYABFASA-N 1 1 334.376 2.111 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ccc([N+](=O)[O-])c(C)n2)cc1 ZINC000599141108 469133949 /nfs/dbraw/zinc/13/39/49/469133949.db2.gz WXRQNZCLCQXSQM-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EEBEMO CCOC(=O)c1ccnc(NC[C@H]2CC[N@H+]2C(C)(C)C)c1[N+](=O)[O-] ZINC000596308780 469239703 /nfs/dbraw/zinc/23/97/03/469239703.db2.gz UTGMYCOKBPMEIT-LLVKDONJSA-N 1 1 336.392 2.451 10 5 EEBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ccc([N+](=O)[O-])c(N)c1F ZINC000596360092 469249715 /nfs/dbraw/zinc/24/97/15/469249715.db2.gz HGAZYKVNCDOJBV-NSHDSACASA-N 1 1 327.404 2.000 10 5 EEBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ccc([N+](=O)[O-])c(N)c1F ZINC000596360092 469249718 /nfs/dbraw/zinc/24/97/18/469249718.db2.gz HGAZYKVNCDOJBV-NSHDSACASA-N 1 1 327.404 2.000 10 5 EEBEMO O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619574234 469641778 /nfs/dbraw/zinc/64/17/78/469641778.db2.gz JOEHJGLBTVGXPT-GXTWGEPZSA-N 1 1 346.362 2.334 10 5 EEBEMO CC(C)C[C@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000189590694 528541154 /nfs/dbraw/zinc/54/11/54/528541154.db2.gz OOJXXHDGIRGOKV-CYBMUJFWSA-N 1 1 341.383 2.401 10 5 EEBEMO COCC[N@H+]1CCC[C@H](NC(=O)/C(C)=C\c2ccc([N+](=O)[O-])cc2)C1 ZINC000755264226 577822649 /nfs/dbraw/zinc/82/26/49/577822649.db2.gz 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ZINC000590583387 468278315 /nfs/dbraw/zinc/27/83/15/468278315.db2.gz WJWSJKHQKSWPJO-DZGCQCFKSA-N 1 1 349.341 2.708 10 5 EEBEMO C[N@H+]1CC[C@H](Nc2ccc(N)c([N+](=O)[O-])n2)[C@H]1c1ccc(F)c(F)c1 ZINC000590583387 468278321 /nfs/dbraw/zinc/27/83/21/468278321.db2.gz WJWSJKHQKSWPJO-DZGCQCFKSA-N 1 1 349.341 2.708 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000113270631 462584471 /nfs/dbraw/zinc/58/44/71/462584471.db2.gz LBASZBSIVVCKTC-IUODEOHRSA-N 1 1 343.387 2.313 10 5 EEBEMO O=C(C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000128384931 462634387 /nfs/dbraw/zinc/63/43/87/462634387.db2.gz JVFWABLVNMMRKG-DYVFJYSZSA-N 1 1 333.388 2.160 10 5 EEBEMO O=C(C[N@H+]1CC[C@@]2(O)CCCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000128384931 462634393 /nfs/dbraw/zinc/63/43/93/462634393.db2.gz JVFWABLVNMMRKG-DYVFJYSZSA-N 1 1 333.388 2.160 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCN(c3ccccc3)CC2)c1 ZINC000136804364 463259337 /nfs/dbraw/zinc/25/93/37/463259337.db2.gz RBMPZIGMLHVFCQ-GOSISDBHSA-N 1 1 327.384 2.450 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C ZINC000123361605 463335518 /nfs/dbraw/zinc/33/55/18/463335518.db2.gz BUCSMBBKBNYHIZ-CHWSQXEVSA-N 1 1 334.420 2.216 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCC[C@@H]1C1(O)CC1 ZINC000590969256 468387024 /nfs/dbraw/zinc/38/70/24/468387024.db2.gz BMGNMJIXTHRRLI-CQSZACIVSA-N 1 1 333.388 2.221 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCC[C@@H]1C1(O)CC1 ZINC000590969256 468387026 /nfs/dbraw/zinc/38/70/26/468387026.db2.gz BMGNMJIXTHRRLI-CQSZACIVSA-N 1 1 333.388 2.221 10 5 EEBEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1Cc1cc([N+](=O)[O-])ccc1OC ZINC000284346632 464158130 /nfs/dbraw/zinc/15/81/30/464158130.db2.gz CNKKGBWOIPCOQI-AWEZNQCLSA-N 1 1 335.404 2.484 10 5 EEBEMO O=C(CCN1CC[N@H+]2CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000246121931 464545936 /nfs/dbraw/zinc/54/59/36/464545936.db2.gz AYIXMZCCWTYELX-AWEZNQCLSA-N 1 1 332.404 2.094 10 5 EEBEMO O=C(CC[N@@H+]1CCN2CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000246121931 464545943 /nfs/dbraw/zinc/54/59/43/464545943.db2.gz AYIXMZCCWTYELX-AWEZNQCLSA-N 1 1 332.404 2.094 10 5 EEBEMO O=C(CC[N@H+]1CCN2CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000246121931 464545947 /nfs/dbraw/zinc/54/59/47/464545947.db2.gz AYIXMZCCWTYELX-AWEZNQCLSA-N 1 1 332.404 2.094 10 5 EEBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCCN(c3ccccn3)CC2)c1 ZINC000183874305 464921689 /nfs/dbraw/zinc/92/16/89/464921689.db2.gz ACECJLLUTVLVRC-KRWDZBQOSA-N 1 1 342.399 2.236 10 5 EEBEMO CCN(C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N)[C@H]1CC[N@@H+](C)C1 ZINC000597092092 468440568 /nfs/dbraw/zinc/44/05/68/468440568.db2.gz JSOJRPLSBPPAQI-JTQLQIEISA-N 1 1 341.799 2.388 10 5 EEBEMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+][C@H]2CCc3[nH]cnc3C2)n1 ZINC000353626491 466021315 /nfs/dbraw/zinc/02/13/15/466021315.db2.gz ILFVYZUKIPZEPI-NJZAAPMLSA-N 1 1 330.392 2.145 10 5 EEBEMO C[C@H](c1cccnc1)[NH+]1CCN(c2cc(CO)ccc2[N+](=O)[O-])CC1 ZINC000302041555 466086746 /nfs/dbraw/zinc/08/67/46/466086746.db2.gz NUNQQJVRCKNMEI-CQSZACIVSA-N 1 1 342.399 2.365 10 5 EEBEMO CCOc1ccc(NC(=O)C[N@H+](CC)[C@@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000361596562 466131431 /nfs/dbraw/zinc/13/14/31/466131431.db2.gz TXNQUMGNUWXEQA-GFCCVEGCSA-N 1 1 337.376 2.043 10 5 EEBEMO CCOc1ccc(NC(=O)C[N@@H+](CC)[C@@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000361596562 466131438 /nfs/dbraw/zinc/13/14/38/466131438.db2.gz TXNQUMGNUWXEQA-GFCCVEGCSA-N 1 1 337.376 2.043 10 5 EEBEMO C[C@@H]1C[N@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCCC2)O1 ZINC000594057670 468474294 /nfs/dbraw/zinc/47/42/94/468474294.db2.gz KUHZHGMPJGMGKK-CQSZACIVSA-N 1 1 335.404 2.180 10 5 EEBEMO C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CC2(CCCCC2)O1 ZINC000594057670 468474296 /nfs/dbraw/zinc/47/42/96/468474296.db2.gz KUHZHGMPJGMGKK-CQSZACIVSA-N 1 1 335.404 2.180 10 5 EEBEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2cc([N+](=O)[O-])n[nH]2)cc1 ZINC000353997064 466310144 /nfs/dbraw/zinc/31/01/44/466310144.db2.gz HYFCJLYKEUPLEB-SNVBAGLBSA-N 1 1 340.343 2.303 10 5 EEBEMO CC(C)(C[NH+]1CCCC1)NCCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000411873742 466922797 /nfs/dbraw/zinc/92/27/97/466922797.db2.gz NDHDAPXTRUKVDA-UHFFFAOYSA-N 1 1 334.420 2.387 10 5 EEBEMO COc1cc(C[N@@H+](C)CCN2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697565 467420657 /nfs/dbraw/zinc/42/06/57/467420657.db2.gz QDHHQLMQNRUADD-UHFFFAOYSA-N 1 1 337.420 2.146 10 5 EEBEMO COc1cc(CN(C)CC[N@@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697565 467420664 /nfs/dbraw/zinc/42/06/64/467420664.db2.gz QDHHQLMQNRUADD-UHFFFAOYSA-N 1 1 337.420 2.146 10 5 EEBEMO COc1cc(CN(C)CC[N@H+]2CCOC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000434697565 467420668 /nfs/dbraw/zinc/42/06/68/467420668.db2.gz QDHHQLMQNRUADD-UHFFFAOYSA-N 1 1 337.420 2.146 10 5 EEBEMO C[C@@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408384488 467549654 /nfs/dbraw/zinc/54/96/54/467549654.db2.gz HNVHXPVUUUOPFP-SECBINFHSA-N 1 1 342.193 2.133 10 5 EEBEMO C[C@@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408384488 467549657 /nfs/dbraw/zinc/54/96/57/467549657.db2.gz HNVHXPVUUUOPFP-SECBINFHSA-N 1 1 342.193 2.133 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c1 ZINC000589498432 468156401 /nfs/dbraw/zinc/15/64/01/468156401.db2.gz PQKDJNQKEGJLSQ-OAHLLOKOSA-N 1 1 333.388 2.050 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000597574902 468604607 /nfs/dbraw/zinc/60/46/07/468604607.db2.gz IRZJTILVYLKTHH-GJZGRUSLSA-N 1 1 335.379 2.470 10 5 EEBEMO C[C@H](CNc1nccc2cc([N+](=O)[O-])ccc21)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594590810 468628943 /nfs/dbraw/zinc/62/89/43/468628943.db2.gz CIHLBSCIMASGAJ-MCIONIFRSA-N 1 1 344.415 3.053 10 5 EEBEMO CCN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@@H]1CC[N@@H+](C)C1 ZINC000597946963 468721320 /nfs/dbraw/zinc/72/13/20/468721320.db2.gz UAEYRDMMDWYMGZ-OAHLLOKOSA-N 1 1 330.388 2.102 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@]2(CO)CC[C@@H](C)C2)c1 ZINC000593025777 468843762 /nfs/dbraw/zinc/84/37/62/468843762.db2.gz XXDFJIMXXRXFRH-SJKOYZFVSA-N 1 1 336.388 2.364 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)NCCc1cccc([N+](=O)[O-])c1 ZINC000593383321 468958920 /nfs/dbraw/zinc/95/89/20/468958920.db2.gz FEWMTPVKSZUONV-UHFFFAOYSA-N 1 1 336.436 2.414 10 5 EEBEMO COC(=O)[C@@H]1CC[N@H+](Cc2onc(C)c2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000595728393 468973652 /nfs/dbraw/zinc/97/36/52/468973652.db2.gz NCWXVSOQULPHFE-YNEHKIRRSA-N 1 1 337.376 2.445 10 5 EEBEMO COC(=O)[C@@H]1CC[N@@H+](Cc2onc(C)c2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000595728393 468973658 /nfs/dbraw/zinc/97/36/58/468973658.db2.gz NCWXVSOQULPHFE-YNEHKIRRSA-N 1 1 337.376 2.445 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595746886 468984804 /nfs/dbraw/zinc/98/48/04/468984804.db2.gz ZFHJENPMEBKONC-NGOBNIPXSA-N 1 1 335.404 2.179 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@@H](C)[C@H](O)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595746886 468984808 /nfs/dbraw/zinc/98/48/08/468984808.db2.gz ZFHJENPMEBKONC-NGOBNIPXSA-N 1 1 335.404 2.179 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CCC[C@@](O)(C4CC4)C3)n2)cc1 ZINC000595749012 468986018 /nfs/dbraw/zinc/98/60/18/468986018.db2.gz CDGOLSCFIIACGX-KRWDZBQOSA-N 1 1 344.371 2.382 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)n2)cc1 ZINC000595749012 468986022 /nfs/dbraw/zinc/98/60/22/468986022.db2.gz CDGOLSCFIIACGX-KRWDZBQOSA-N 1 1 344.371 2.382 10 5 EEBEMO C[C@]12COC[C@H]1C[N@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760925 468993392 /nfs/dbraw/zinc/99/33/92/468993392.db2.gz VFXCVBULQDQYHP-WBMJQRKESA-N 1 1 330.344 2.113 10 5 EEBEMO C[C@]12COC[C@H]1C[N@@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760925 468993397 /nfs/dbraw/zinc/99/33/97/468993397.db2.gz VFXCVBULQDQYHP-WBMJQRKESA-N 1 1 330.344 2.113 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@@H]3C[C@H](O)C34CCC4)n2)cc1 ZINC000595779340 469004416 /nfs/dbraw/zinc/00/44/16/469004416.db2.gz CSVMGHFMOFNCPQ-OLZOCXBDSA-N 1 1 330.344 2.038 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)[C@H](C(C)(C)C)C1 ZINC000603142808 469280054 /nfs/dbraw/zinc/28/00/54/469280054.db2.gz OTEIKKQSKGKBQZ-HNNXBMFYSA-N 1 1 335.404 2.406 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C(=O)N1CC[N@@H+](C)[C@H](C(C)(C)C)C1 ZINC000603142808 469280057 /nfs/dbraw/zinc/28/00/57/469280057.db2.gz OTEIKKQSKGKBQZ-HNNXBMFYSA-N 1 1 335.404 2.406 10 5 EEBEMO COc1ccc([C@H]2CC[N@@H+](CCn3ccc([N+](=O)[O-])n3)C2)cc1F ZINC000599681134 469336244 /nfs/dbraw/zinc/33/62/44/469336244.db2.gz WHQQRYKITHSDHB-ZDUSSCGKSA-N 1 1 334.351 2.429 10 5 EEBEMO C[N@@H+](CCOC(=O)c1ccc([N+](=O)[O-])cn1)Cc1ccc(F)cc1 ZINC000769116649 577570224 /nfs/dbraw/zinc/57/02/24/577570224.db2.gz UJNSKCJADXONDR-UHFFFAOYSA-N 1 1 333.319 2.418 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000747822992 577950633 /nfs/dbraw/zinc/95/06/33/577950633.db2.gz GJNILTQZPDVDRA-ZIAGYGMSSA-N 1 1 345.403 2.354 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000747822986 577950646 /nfs/dbraw/zinc/95/06/46/577950646.db2.gz GJNILTQZPDVDRA-KBPBESRZSA-N 1 1 345.403 2.354 10 5 EEBEMO CCOCC(=O)N1CC2(C1)CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001485659865 1191880761 /nfs/dbraw/zinc/88/07/61/1191880761.db2.gz XGSJPSXJKQKMGH-UHFFFAOYSA-N 1 1 347.415 2.056 10 5 EEBEMO C[N@@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001692011218 1177654073 /nfs/dbraw/zinc/65/40/73/1177654073.db2.gz KBRXCFSLWAMTIS-IAGOWNOFSA-N 1 1 337.464 2.402 10 5 EEBEMO C[N@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001692011218 1177654078 /nfs/dbraw/zinc/65/40/78/1177654078.db2.gz KBRXCFSLWAMTIS-IAGOWNOFSA-N 1 1 337.464 2.402 10 5 EEBEMO C[N@@H+](CCCC1CCC1)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001692011218 1177654083 /nfs/dbraw/zinc/65/40/83/1177654083.db2.gz KBRXCFSLWAMTIS-IAGOWNOFSA-N 1 1 337.464 2.402 10 5 EEBEMO CC[NH+]1CCN(CCCN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872021338 1198027966 /nfs/dbraw/zinc/02/79/66/1198027966.db2.gz BRXOZVLOZVTSFO-CQSZACIVSA-N 1 1 338.427 2.412 10 5 EEBEMO CC1(C)[C@H]2[C@H](CCC[N@@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1O ZINC000872255262 1198113961 /nfs/dbraw/zinc/11/39/61/1198113961.db2.gz TYEDDJCSZQGMNK-UAGQMJEPSA-N 1 1 348.399 2.443 10 5 EEBEMO CC1(C)[C@H]2[C@H](CCC[N@H+]2Cc2cc([N+](=O)[O-])cc3c2OCOC3)[C@@H]1O ZINC000872255262 1198113965 /nfs/dbraw/zinc/11/39/65/1198113965.db2.gz TYEDDJCSZQGMNK-UAGQMJEPSA-N 1 1 348.399 2.443 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(c3cn[nH]c3)CC2)c1 ZINC000811456693 1200071487 /nfs/dbraw/zinc/07/14/87/1200071487.db2.gz BDTGHCMUTPRZGB-UHFFFAOYSA-N 1 1 344.371 2.484 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)C[C@H](O)c1ccccc1)C2 ZINC000878302988 1200386797 /nfs/dbraw/zinc/38/67/97/1200386797.db2.gz 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COC[C@@](C)(CCO)[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC000929821967 1206505649 /nfs/dbraw/zinc/50/56/49/1206505649.db2.gz DEGITRJFCUCCBV-CYBMUJFWSA-N 1 1 347.209 2.234 10 5 EEBEMO COc1c(C)[nH]cc(C[N@@H+](C)CCOc2ccc([N+](=O)[O-])cc2)c1=O ZINC000931322617 1206624909 /nfs/dbraw/zinc/62/49/09/1206624909.db2.gz BXFJEWVBJQPFKJ-UHFFFAOYSA-N 1 1 347.371 2.111 10 5 EEBEMO CC1(C)Cc2n[nH]cc2C[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000854055009 1292600401 /nfs/dbraw/zinc/60/04/01/1292600401.db2.gz FVOOSIGSTKDNPE-MRXNPFEDSA-N 1 1 330.388 2.436 10 5 EEBEMO C[C@@]1(F)C[NH2+]CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000843485547 1315921761 /nfs/dbraw/zinc/92/17/61/1315921761.db2.gz DBGJWMKNSFNNTL-CQSZACIVSA-N 1 1 347.749 2.090 10 5 EEBEMO CCOCCC(=O)N1CCC([N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001283297431 1325994500 /nfs/dbraw/zinc/99/45/00/1325994500.db2.gz ZNLSWQXWEHQNJO-UHFFFAOYSA-N 1 1 349.431 2.444 10 5 EEBEMO CCc1[nH]nc(C(=O)N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C(C)C)c1[N+](=O)[O-] 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O=[N+]([O-])c1cc2c(cc1C[N@H+]1CC[C@@H]([C@@H]3CCCO3)C1)OCCO2 ZINC000895842857 684740715 /nfs/dbraw/zinc/74/07/15/684740715.db2.gz GDXPPLYFXCMIKD-DOMZBBRYSA-N 1 1 334.372 2.367 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1cc(F)c[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001691033348 1176864985 /nfs/dbraw/zinc/86/49/85/1176864985.db2.gz KWPRNXFEFJKENC-UHFFFAOYSA-N 1 1 334.351 2.314 10 5 EEBEMO Cc1ccc(CC(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001267230532 1178552536 /nfs/dbraw/zinc/55/25/36/1178552536.db2.gz QZSQVQDGYXNQIU-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO Cc1ccc(CC(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001267230532 1178552542 /nfs/dbraw/zinc/55/25/42/1178552542.db2.gz QZSQVQDGYXNQIU-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO O=C(COC1CCCC1)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001268546468 1183225027 /nfs/dbraw/zinc/22/50/27/1183225027.db2.gz GHOULYCFOMHIMI-UHFFFAOYSA-N 1 1 347.415 2.102 10 5 EEBEMO CN(CCC[N@@H+](C)CC1CCC2(CC2)CC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001484742175 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469894468 /nfs/dbraw/zinc/89/44/68/469894468.db2.gz VFJYFYOZTDZPOJ-SNVBAGLBSA-N 1 1 339.417 2.149 10 5 EEBEMO C[N@@H+](CCNS(=O)(=O)c1csc([N+](=O)[O-])c1)C1CCCCC1 ZINC000119661050 683572240 /nfs/dbraw/zinc/57/22/40/683572240.db2.gz DKNUFVAGKFSQFM-UHFFFAOYSA-N 1 1 347.462 2.199 10 5 EEBEMO CCc1[nH]nc(C(=O)N2[C@@H](CC[NH+](C)C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000914443347 683784496 /nfs/dbraw/zinc/78/44/96/683784496.db2.gz MMODMGJGJKLZTC-NWDGAFQWSA-N 1 1 337.424 2.215 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)[C@@H]2C1 ZINC000897825870 691793909 /nfs/dbraw/zinc/79/39/09/691793909.db2.gz QLXNTWYTPWHWKE-SWLSCSKDSA-N 1 1 340.383 2.106 10 5 EEBEMO O=C(CCc1ccco1)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001268510792 1183135376 /nfs/dbraw/zinc/13/53/76/1183135376.db2.gz NESQGERLSHDTTM-UHFFFAOYSA-N 1 1 343.383 2.369 10 5 EEBEMO CCc1cccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c1 ZINC001482218752 1184270756 /nfs/dbraw/zinc/27/07/56/1184270756.db2.gz VAUFRTALQWGLLP-IAGOWNOFSA-N 1 1 345.443 2.433 10 5 EEBEMO C[C@]1(F)C[NH2+]CCN(C(=O)NCc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000841859079 1188048925 /nfs/dbraw/zinc/04/89/25/1188048925.db2.gz XOLVMHRGJNJUSA-AWEZNQCLSA-N 1 1 344.774 2.091 10 5 EEBEMO CN(CC(C)(C)C[NH2+]CC1CC(C)(C)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001485250734 1191703841 /nfs/dbraw/zinc/70/38/41/1191703841.db2.gz QCSOPTZNSYKFIR-ZIAGYGMSSA-N 1 1 325.453 2.162 10 5 EEBEMO C[C@H](CNc1cc(F)c([N+](=O)[O-])cc1CO)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000865916583 1198424183 /nfs/dbraw/zinc/42/41/83/1198424183.db2.gz PNJBTHDSIVTHLU-UTUOFQBUSA-N 1 1 341.383 2.136 10 5 EEBEMO C[C@H](CNc1cc(F)c([N+](=O)[O-])cc1CO)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000865916583 1198424187 /nfs/dbraw/zinc/42/41/87/1198424187.db2.gz PNJBTHDSIVTHLU-UTUOFQBUSA-N 1 1 341.383 2.136 10 5 EEBEMO C[C@@H](COC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N+](=O)[O-] ZINC000813106653 1201115914 /nfs/dbraw/zinc/11/59/14/1201115914.db2.gz FPEFRFBIASRWKA-MELADBBJSA-N 1 1 336.388 2.118 10 5 EEBEMO C[C@@H](COC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N+](=O)[O-] ZINC000813106653 1201115921 /nfs/dbraw/zinc/11/59/21/1201115921.db2.gz FPEFRFBIASRWKA-MELADBBJSA-N 1 1 336.388 2.118 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000794951715 1201598600 /nfs/dbraw/zinc/59/86/00/1201598600.db2.gz CUXZILNEQQTJRK-FZMZJTMJSA-N 1 1 340.221 2.493 10 5 EEBEMO O=C(NC1(C[NH2+]CCc2ccccc2)CCCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001276199689 1205829571 /nfs/dbraw/zinc/82/95/71/1205829571.db2.gz DULGBRKDDOXCBJ-IAGOWNOFSA-N 1 1 345.443 2.303 10 5 EEBEMO Cc1cc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000928102006 1206343866 /nfs/dbraw/zinc/34/38/66/1206343866.db2.gz KXZXRINYDPBPQN-UKRRQHHQSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928448784 1206385953 /nfs/dbraw/zinc/38/59/53/1206385953.db2.gz OQBNEEVCBRMRDQ-JQWIXIFHSA-N 1 1 341.795 2.226 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](CO)CC2)o1 ZINC001194734241 1283256180 /nfs/dbraw/zinc/25/61/80/1283256180.db2.gz QIQYMEMDEYNFHO-LBPRGKRZSA-N 1 1 332.360 2.239 10 5 EEBEMO COCC[N@@H+](CCF)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000852482714 1292123595 /nfs/dbraw/zinc/12/35/95/1292123595.db2.gz LNSVXSNRBFPTRP-UHFFFAOYSA-N 1 1 327.356 2.150 10 5 EEBEMO O=C1COc2cc([N+](=O)[O-])c(NC[C@H]3CC[N@H+]3C3CCCC3)cc2N1 ZINC000858780607 1294222095 /nfs/dbraw/zinc/22/20/95/1294222095.db2.gz RCXPGKDMXXTMCG-GFCCVEGCSA-N 1 1 346.387 2.355 10 5 EEBEMO O=C1OC[C@H]2C[N@H+](Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C[C@@H]12 ZINC000862545245 1295875073 /nfs/dbraw/zinc/87/50/73/1295875073.db2.gz LWNFNKLHKGEDEX-BXUZGUMPSA-N 1 1 328.324 2.460 10 5 EEBEMO CCC1(C(=O)N[C@@H]2[C@H]3C[N@@H+](Cc4cccc([N+](=O)[O-])c4)C[C@H]32)CC1 ZINC001265721241 1323352357 /nfs/dbraw/zinc/35/23/57/1323352357.db2.gz XHQQCDRPJRGYKK-ZSHCYNCHSA-N 1 1 329.400 2.331 10 5 EEBEMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1ccc([N+](=O)[O-])cc1N ZINC001291679066 1328314712 /nfs/dbraw/zinc/31/47/12/1328314712.db2.gz WCPLXKVBUWFSKW-UHFFFAOYSA-N 1 1 338.327 2.318 10 5 EEBEMO Cc1c[nH]cc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001316865590 1331778190 /nfs/dbraw/zinc/77/81/90/1331778190.db2.gz NMCRWYDLQWSZHJ-UHFFFAOYSA-N 1 1 330.388 2.483 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1cncnc1)Cc1cccc([N+](=O)[O-])c1 ZINC001317541857 1332290810 /nfs/dbraw/zinc/29/08/10/1332290810.db2.gz GCEBMURVDOBTDU-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO O=C(Cc1ccoc1)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001321026589 1333000398 /nfs/dbraw/zinc/00/03/98/1333000398.db2.gz FFSSWCWREWJKKF-UPHRSURJSA-N 1 1 335.385 2.254 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001616328105 1352327977 /nfs/dbraw/zinc/32/79/77/1352327977.db2.gz JAGJUNRVIDZZOL-JYXJIEJFSA-N 1 1 331.416 2.162 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001616328105 1352327980 /nfs/dbraw/zinc/32/79/80/1352327980.db2.gz JAGJUNRVIDZZOL-JYXJIEJFSA-N 1 1 331.416 2.162 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001616328105 1352327981 /nfs/dbraw/zinc/32/79/81/1352327981.db2.gz JAGJUNRVIDZZOL-JYXJIEJFSA-N 1 1 331.416 2.162 10 5 EEBEMO CC[C@]1(O)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560059991 1342506504 /nfs/dbraw/zinc/50/65/04/1342506504.db2.gz CDRSPVJBNCYHCQ-INIZCTEOSA-N 1 1 332.360 2.382 10 5 EEBEMO CC[C@]1(O)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560059991 1342506508 /nfs/dbraw/zinc/50/65/08/1342506508.db2.gz CDRSPVJBNCYHCQ-INIZCTEOSA-N 1 1 332.360 2.382 10 5 EEBEMO Cc1noc(C[C@@H]2CCC[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001620623307 1344576001 /nfs/dbraw/zinc/57/60/01/1344576001.db2.gz RSQXCQPKGUCJNR-XJKSGUPXSA-N 1 1 346.387 2.274 10 5 EEBEMO CC[N@H+]1C[C@H](C)N(C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C[C@@H]1C ZINC001598113792 1349935515 /nfs/dbraw/zinc/93/55/15/1349935515.db2.gz XFAWMFNLKOBBSO-UWVGGRQHSA-N 1 1 340.811 2.385 10 5 EEBEMO C[N@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001651304719 1354048271 /nfs/dbraw/zinc/04/82/71/1354048271.db2.gz NTBKHXQEHLJGLS-ZIAGYGMSSA-N 1 1 337.807 2.486 10 5 EEBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])c(N)n1 ZINC001651332520 1354049355 /nfs/dbraw/zinc/04/93/55/1354049355.db2.gz ZQCKAAMCPILMNY-JSGCOSHPSA-N 1 1 342.403 2.290 10 5 EEBEMO CCCn1nccc1NC(=O)C[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC001660030855 1354391697 /nfs/dbraw/zinc/39/16/97/1354391697.db2.gz JGTUWDLGOUBPJF-LBPRGKRZSA-N 1 1 331.376 2.491 10 5 EEBEMO CC[N@@H+](CCNC(=O)CC1CCOCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001663367603 1354954013 /nfs/dbraw/zinc/95/40/13/1354954013.db2.gz IONABTWDSJCBJQ-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO C[C@@H](NC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001685153573 1358311587 /nfs/dbraw/zinc/31/15/87/1358311587.db2.gz SVRKICMSXYPWAK-MRRJBJDNSA-N 1 1 332.404 2.249 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2nccn2CC(F)(F)F)c1 ZINC000819012168 785382147 /nfs/dbraw/zinc/38/21/47/785382147.db2.gz CHDRQTVWJMODFK-GFCCVEGCSA-N 1 1 344.293 2.177 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CC[C@]4(C3)CCCOC4)n2)c1 ZINC000789540447 808052526 /nfs/dbraw/zinc/05/25/26/808052526.db2.gz JABSODVNXHHBBT-KRWDZBQOSA-N 1 1 343.387 2.313 10 5 EEBEMO COCC(C)(C)C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001568489655 1124546519 /nfs/dbraw/zinc/54/65/19/1124546519.db2.gz MHPHAUWFCRVYLV-UHFFFAOYSA-N 1 1 337.420 2.158 10 5 EEBEMO COCC(C)(C)C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001568489655 1124546524 /nfs/dbraw/zinc/54/65/24/1124546524.db2.gz MHPHAUWFCRVYLV-UHFFFAOYSA-N 1 1 337.420 2.158 10 5 EEBEMO COc1ccc(NC(=O)[C@@H](C)[N@H+](C)C[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000076299373 201179306 /nfs/dbraw/zinc/17/93/06/201179306.db2.gz SEESOZDEWHCZSY-YPMHNXCESA-N 1 1 337.376 2.041 10 5 EEBEMO COc1ccc(NC(=O)[C@@H](C)[N@@H+](C)C[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC000076299373 201179308 /nfs/dbraw/zinc/17/93/08/201179308.db2.gz SEESOZDEWHCZSY-YPMHNXCESA-N 1 1 337.376 2.041 10 5 EEBEMO C[C@@]12C[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C[C@@H]1[C@@H]1C=C[C@H]2C1 ZINC000451366083 243092892 /nfs/dbraw/zinc/09/28/92/243092892.db2.gz XSPKZMZFLSNYPV-KERGGTOXSA-N 1 1 344.411 2.479 10 5 EEBEMO O=C(c1cc(N2CC[N@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-])N1CCCC1 ZINC000171939033 296182928 /nfs/dbraw/zinc/18/29/28/296182928.db2.gz GOTYQZRROUXHCL-OAHLLOKOSA-N 1 1 344.415 2.115 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000245434854 205133014 /nfs/dbraw/zinc/13/30/14/205133014.db2.gz CNFMTSWDUJEBNZ-KBPBESRZSA-N 1 1 334.420 2.256 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC1(CO)CC1 ZINC000186823044 255942918 /nfs/dbraw/zinc/94/29/18/255942918.db2.gz COZDZFCJACRWDK-SNVBAGLBSA-N 1 1 341.795 2.280 10 5 EEBEMO 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ZINC000338873925 466447469 /nfs/dbraw/zinc/44/74/69/466447469.db2.gz XZMZLZWMDYJPBA-NWDGAFQWSA-N 1 1 328.372 2.433 10 5 EEBEMO CCOc1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CNC(=O)C2)ccc1[N+](=O)[O-] ZINC000372804202 466595183 /nfs/dbraw/zinc/59/51/83/466595183.db2.gz FEWIRSGPFVZHSI-HUUCEWRRSA-N 1 1 347.415 2.484 10 5 EEBEMO COc1cc(NC[C@@H]2C[N@H+]3CCC[C@H]3CO2)c([N+](=O)[O-])cc1F ZINC000373675893 466885285 /nfs/dbraw/zinc/88/52/85/466885285.db2.gz UAWAKOWKTHVYPK-WDEREUQCSA-N 1 1 325.340 2.018 10 5 EEBEMO O=C(CC[N@H+]1CCO[C@H](C2CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000411857990 466918729 /nfs/dbraw/zinc/91/87/29/466918729.db2.gz XIKHKIAKPSHYRC-INIZCTEOSA-N 1 1 333.388 2.424 10 5 EEBEMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCC[C@H]([C@H]2CCC[NH2+]2)C1 ZINC000371017606 467072929 /nfs/dbraw/zinc/07/29/29/467072929.db2.gz KGQNCHLMXCEKKD-SMDDNHRTSA-N 1 1 343.387 2.075 10 5 EEBEMO COC(=O)c1cc(C)nc(N(C)[C@H]2CC[N@H+](C(C)C)C2)c1[N+](=O)[O-] ZINC000450958783 467216416 /nfs/dbraw/zinc/21/64/16/467216416.db2.gz WXWYSHULTVZUQJ-LBPRGKRZSA-N 1 1 336.392 2.004 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC000408153698 467519466 /nfs/dbraw/zinc/51/94/66/467519466.db2.gz LHNLBKJOSDVFLX-DGCLKSJQSA-N 1 1 328.372 2.385 10 5 EEBEMO CCOC(=O)[C@H]1C[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC12COC2 ZINC000449359179 467633112 /nfs/dbraw/zinc/63/31/12/467633112.db2.gz GKSUXWSXOZBPSS-KEDPEKRHSA-N 1 1 346.383 2.120 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C[C@H]2CO)cn1 ZINC000450345940 467831397 /nfs/dbraw/zinc/83/13/97/467831397.db2.gz GPLJVSNDLOCBRO-RDJZCZTQSA-N 1 1 342.399 2.285 10 5 EEBEMO CO[C@](C)(CO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594508038 468611756 /nfs/dbraw/zinc/61/17/56/468611756.db2.gz AACNZCQCMBQIFQ-HNNXBMFYSA-N 1 1 337.401 2.205 10 5 EEBEMO COc1ccc(CC(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000597858175 468695402 /nfs/dbraw/zinc/69/54/02/468695402.db2.gz LJTMGTWWHSVXGH-ZDUSSCGKSA-N 1 1 335.404 2.135 10 5 EEBEMO O=C1NCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000594964181 468731800 /nfs/dbraw/zinc/73/18/00/468731800.db2.gz PIRHIMFTFAKHJX-ZDUSSCGKSA-N 1 1 335.747 2.486 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](C)C[C@@H]2[C@H](C)O)c1 ZINC000593024693 468843649 /nfs/dbraw/zinc/84/36/49/468843649.db2.gz KLCKQZHHUDNDGE-MQIPJXDCSA-N 1 1 336.388 2.363 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](CC2CCC2)[C@H](C)CO)c1 ZINC000593029243 468844133 /nfs/dbraw/zinc/84/41/33/468844133.db2.gz OTUWZUPHAQYANU-GFCCVEGCSA-N 1 1 336.388 2.364 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593114613 468875979 /nfs/dbraw/zinc/87/59/79/468875979.db2.gz DQDKOAFXYNJUOX-JSGCOSHPSA-N 1 1 328.315 2.066 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@H]3COC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000595834981 469034109 /nfs/dbraw/zinc/03/41/09/469034109.db2.gz UBCHMLYQNDYVPY-UONOGXRCSA-N 1 1 333.388 2.200 10 5 EEBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000595851468 469045637 /nfs/dbraw/zinc/04/56/37/469045637.db2.gz UAZPGTWPCUJKAJ-AWEZNQCLSA-N 1 1 335.404 2.210 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@@H]1C[C@H]([NH3+])CCO1 ZINC000593731217 469112562 /nfs/dbraw/zinc/11/25/62/469112562.db2.gz UQEGUABIWUXKBT-KYJSFNMBSA-N 1 1 349.431 2.464 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000588887048 469175280 /nfs/dbraw/zinc/17/52/80/469175280.db2.gz LCKQRXMYSPDFRD-CYBMUJFWSA-N 1 1 345.403 2.012 10 5 EEBEMO CCOc1cccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1[N+](=O)[O-] ZINC000596539352 469296502 /nfs/dbraw/zinc/29/65/02/469296502.db2.gz OZPCLTPYPZVHFR-AWEZNQCLSA-N 1 1 335.404 2.029 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3C[C@@H]4CCC[C@]4(CO)C3)n2)c1 ZINC000599635493 469318111 /nfs/dbraw/zinc/31/81/11/469318111.db2.gz LEOAXOXXAFPLAC-SUMWQHHRSA-N 1 1 344.371 2.239 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3C[C@@H]4CCC[C@]4(CO)C3)n2)c1 ZINC000599635493 469318113 /nfs/dbraw/zinc/31/81/13/469318113.db2.gz LEOAXOXXAFPLAC-SUMWQHHRSA-N 1 1 344.371 2.239 10 5 EEBEMO COC(=O)CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000609634460 469952472 /nfs/dbraw/zinc/95/24/72/469952472.db2.gz JFCASANSXNTROX-GFCCVEGCSA-N 1 1 328.390 2.200 10 5 EEBEMO COC(=O)CC[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@H]1CCCO1 ZINC000609634460 469952473 /nfs/dbraw/zinc/95/24/73/469952473.db2.gz JFCASANSXNTROX-GFCCVEGCSA-N 1 1 328.390 2.200 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000174255420 533890657 /nfs/dbraw/zinc/89/06/57/533890657.db2.gz YHFXIGPFELSZAC-CZUORRHYSA-N 1 1 334.420 2.261 10 5 EEBEMO Cc1nn(CN(C)[C@@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292175 577681276 /nfs/dbraw/zinc/68/12/76/577681276.db2.gz PHAQVLHDAXZZMY-OAHLLOKOSA-N 1 1 329.404 2.379 10 5 EEBEMO C/C(=C/C(=O)NCc1c[nH+]c(N(C)C)n1C)c1ccc([N+](=O)[O-])cc1 ZINC000752352223 577769435 /nfs/dbraw/zinc/76/94/35/577769435.db2.gz XQQBTMZZPYEAKY-XFXZXTDPSA-N 1 1 343.387 2.114 10 5 EEBEMO O=C1c2ccc([N+](=O)[O-])cc2C(=O)N1C[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000176201832 677808512 /nfs/dbraw/zinc/80/85/12/677808512.db2.gz VGJHFFGTMITOMY-VXGBXAGGSA-N 1 1 329.356 2.270 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(c3ncc([N+](=O)[O-])cc3Br)C[C@]2(C)C1 ZINC000896914699 685833425 /nfs/dbraw/zinc/83/34/25/685833425.db2.gz PGNJDRLTBGBPNT-RNCFNFMXSA-N 1 1 341.209 2.140 10 5 EEBEMO COc1ccc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001266352139 1176376328 /nfs/dbraw/zinc/37/63/28/1176376328.db2.gz OHZIJDCGNNTERZ-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO COc1ccc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC001266352139 1176376336 /nfs/dbraw/zinc/37/63/36/1176376336.db2.gz OHZIJDCGNNTERZ-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO CC1([NH2+]CCc2ccccc2F)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001484915677 1191568544 /nfs/dbraw/zinc/56/85/44/1191568544.db2.gz CFJPCMPIYDQPFH-GDBMZVCRSA-N 1 1 349.406 2.004 10 5 EEBEMO C[C@@H]([NH2+]CC1(CS(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872047150 1198034394 /nfs/dbraw/zinc/03/43/94/1198034394.db2.gz BSEQDEZQHIUVBT-SNVBAGLBSA-N 1 1 330.381 2.209 10 5 EEBEMO C[C@H](NC[C@@H]1CCCC[N@@H+]1CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872075099 1198040412 /nfs/dbraw/zinc/04/04/12/1198040412.db2.gz OAJNPYCPCGGOJD-STQMWFEESA-N 1 1 325.384 2.231 10 5 EEBEMO C[C@H](NC[C@@H]1CCCC[N@H+]1CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872075099 1198040420 /nfs/dbraw/zinc/04/04/20/1198040420.db2.gz OAJNPYCPCGGOJD-STQMWFEESA-N 1 1 325.384 2.231 10 5 EEBEMO O=C(C[C@H]1CCCO1)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171799 1201140402 /nfs/dbraw/zinc/14/04/02/1201140402.db2.gz BFTBHGJFCNLGCW-CVEARBPZSA-N 1 1 334.372 2.281 10 5 EEBEMO O=C(C[C@H]1CCCO1)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171799 1201140407 /nfs/dbraw/zinc/14/04/07/1201140407.db2.gz BFTBHGJFCNLGCW-CVEARBPZSA-N 1 1 334.372 2.281 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](CCOc1ccccc1[N+](=O)[O-])CC2 ZINC000880180299 1201414123 /nfs/dbraw/zinc/41/41/23/1201414123.db2.gz KJALATDFFXSRCJ-WBVHZDCISA-N 1 1 334.372 2.391 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(Cc3ccc(Br)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000794951720 1201599295 /nfs/dbraw/zinc/59/92/95/1201599295.db2.gz CUXZILNEQQTJRK-RISCZKNCSA-N 1 1 340.221 2.493 10 5 EEBEMO Cc1c(CNC(=O)N2CC[C@@H]3[C@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000868535405 1201829867 /nfs/dbraw/zinc/82/98/67/1201829867.db2.gz RVEWXHJCVFDXEV-GDBMZVCRSA-N 1 1 332.404 2.139 10 5 EEBEMO C[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000930769834 1206581512 /nfs/dbraw/zinc/58/15/12/1206581512.db2.gz QBFRXQDYVQJEJU-SECBINFHSA-N 1 1 332.282 2.439 10 5 EEBEMO Cc1cccc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-] ZINC000096995674 1213930475 /nfs/dbraw/zinc/93/04/75/1213930475.db2.gz HDLSGWWPLBYPAG-CQSZACIVSA-N 1 1 336.388 2.417 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)CC[C@H]2CO)cc1F ZINC000859523318 1294469331 /nfs/dbraw/zinc/46/93/31/1294469331.db2.gz OHBJNCXOCGCYTL-AWEZNQCLSA-N 1 1 338.379 2.487 10 5 EEBEMO C[C@@H]1CC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)O1 ZINC001118595027 1308894598 /nfs/dbraw/zinc/89/45/98/1308894598.db2.gz ISNVSDJXSQZHKQ-OLZOCXBDSA-N 1 1 331.376 2.310 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C[C@H](C)O1 ZINC001118595027 1308894605 /nfs/dbraw/zinc/89/46/05/1308894605.db2.gz ISNVSDJXSQZHKQ-OLZOCXBDSA-N 1 1 331.376 2.310 10 5 EEBEMO C[C@]1(O)CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848487888 1338708283 /nfs/dbraw/zinc/70/82/83/1338708283.db2.gz ZVSAEYMTEKMICQ-AEFFLSMTSA-N 1 1 347.415 2.105 10 5 EEBEMO CC[N@H+](CCNC(=O)Cc1ccoc1)Cc1ccccc1[N+](=O)[O-] ZINC001663372322 1354954184 /nfs/dbraw/zinc/95/41/84/1354954184.db2.gz BWRRGIAJGQQEII-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1ccoc1)Cc1ccccc1[N+](=O)[O-] ZINC001663372322 1354954187 /nfs/dbraw/zinc/95/41/87/1354954187.db2.gz BWRRGIAJGQQEII-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO Nc1c(C(=O)N[C@@H]2CC[N@H+](C3CC3)C2)cc2ccccc2c1[N+](=O)[O-] ZINC001542337485 1342328434 /nfs/dbraw/zinc/32/84/34/1342328434.db2.gz DUDLHXJYVRIQRW-GFCCVEGCSA-N 1 1 340.383 2.297 10 5 EEBEMO C[N@H+]1C[C@H](NC(=O)c2ccc([N+](=O)[O-])c3cccnc23)C(C)(C)C1 ZINC001597315010 1349922077 /nfs/dbraw/zinc/92/20/77/1349922077.db2.gz WRHCTEPQBZFBIR-AWEZNQCLSA-N 1 1 328.372 2.213 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)N[C@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001629064707 1352548594 /nfs/dbraw/zinc/54/85/94/1352548594.db2.gz HRCYFCWOTJBVKK-ZDUSSCGKSA-N 1 1 332.404 2.171 10 5 EEBEMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@H]1CC[N@H+]1C1CCOCC1 ZINC001643230661 1352743915 /nfs/dbraw/zinc/74/39/15/1352743915.db2.gz ZWKPWPIJKFAPHU-GFCCVEGCSA-N 1 1 336.348 2.168 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CC[C@H](c3nccs3)C2)c([N+](=O)[O-])c1 ZINC001648168699 1353419739 /nfs/dbraw/zinc/41/97/39/1353419739.db2.gz MASJEVGFIROEDD-LBPRGKRZSA-N 1 1 332.385 2.140 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)c1nccnc1C ZINC001655517671 1354175841 /nfs/dbraw/zinc/17/58/41/1354175841.db2.gz BKBMFTDVRLTFSG-LBPRGKRZSA-N 1 1 329.360 2.291 10 5 EEBEMO COC(=O)CC[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)C ZINC001167377598 758188902 /nfs/dbraw/zinc/18/89/02/758188902.db2.gz VNXOCJPKTNYQQM-UHFFFAOYSA-N 1 1 348.359 2.418 10 5 EEBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000906792635 784163669 /nfs/dbraw/zinc/16/36/69/784163669.db2.gz ODMLHNKWPALWPD-ONGXEEELSA-N 1 1 340.811 2.385 10 5 EEBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)NCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC001136669250 787557706 /nfs/dbraw/zinc/55/77/06/787557706.db2.gz WKICNRTUZOUSLV-CQSZACIVSA-N 1 1 335.404 2.210 10 5 EEBEMO C[C@@H]1C[C@H](NC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)CC[N@H+]1C ZINC001148546884 792521077 /nfs/dbraw/zinc/52/10/77/792521077.db2.gz BOTXNEKSIMCSNI-HTQZYQBOSA-N 1 1 344.774 2.182 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])cn1)N1C[C@@H]2C[C@H]1C[N@@H+]2Cc1ccccc1 ZINC000913685540 794099743 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DPPIFHHJUWCMMM-STQMWFEESA-N 1 1 328.376 2.336 10 5 EEBEMO Cc1cnc([C@H](C)[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000428376076 467226369 /nfs/dbraw/zinc/22/63/69/467226369.db2.gz DPPIFHHJUWCMMM-STQMWFEESA-N 1 1 328.376 2.336 10 5 EEBEMO COc1cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000456984782 467725923 /nfs/dbraw/zinc/72/59/23/467725923.db2.gz IEVQDEPGWLXPEF-OAHLLOKOSA-N 1 1 341.367 2.390 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccnc2ccc([N+](=O)[O-])cc21 ZINC000601175872 468771733 /nfs/dbraw/zinc/77/17/33/468771733.db2.gz RCBQNSPCFURTSG-QWHCGFSZSA-N 1 1 330.388 2.034 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@]2(CO)CC[C@H](C)C2)c1 ZINC000593025779 468844764 /nfs/dbraw/zinc/84/47/64/468844764.db2.gz XXDFJIMXXRXFRH-YVEFUNNKSA-N 1 1 336.388 2.364 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000598465129 468874439 /nfs/dbraw/zinc/87/44/39/468874439.db2.gz DKJFLUMBHAKBJL-UHFFFAOYSA-N 1 1 325.413 2.292 10 5 EEBEMO C[C@@H]1C[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1O ZINC000595752931 468990351 /nfs/dbraw/zinc/99/03/51/468990351.db2.gz ZNVPGYCBZPRTNK-GHMZBOCLSA-N 1 1 332.360 2.094 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000595873990 469057768 /nfs/dbraw/zinc/05/77/68/469057768.db2.gz QHKPNXKENLKQEE-UHFFFAOYSA-N 1 1 348.447 2.194 10 5 EEBEMO CCCc1[nH]nc(C(=O)N2CCC[C@@H](C3CC[NH2+]CC3)C2)c1[N+](=O)[O-] ZINC000595932871 469089162 /nfs/dbraw/zinc/08/91/62/469089162.db2.gz CZRHUUZVHBTTKO-CYBMUJFWSA-N 1 1 349.435 2.122 10 5 EEBEMO C[N@@H+]1CCN(Cc2ccccc2)[C@H](CNc2ncccc2[N+](=O)[O-])C1 ZINC000596551648 469298853 /nfs/dbraw/zinc/29/88/53/469298853.db2.gz LTLDTUCDXAPIHL-MRXNPFEDSA-N 1 1 341.415 2.218 10 5 EEBEMO C[N@H+]1CCN(Cc2ccccc2)[C@H](CNc2ncccc2[N+](=O)[O-])C1 ZINC000596551648 469298858 /nfs/dbraw/zinc/29/88/58/469298858.db2.gz LTLDTUCDXAPIHL-MRXNPFEDSA-N 1 1 341.415 2.218 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC34CCOCC4)n2)cc1 ZINC000618318301 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C[NH+](C)Cc1ccc(C(=O)NCCNc2ccccc2[N+](=O)[O-])o1 ZINC001290275279 1328169337 /nfs/dbraw/zinc/16/93/37/1328169337.db2.gz QJDWEFDVCIFZSO-UHFFFAOYSA-N 1 1 332.360 2.091 10 5 EEBEMO Cc1nc(C)c(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)[nH]1 ZINC001316851404 1331934331 /nfs/dbraw/zinc/93/43/31/1331934331.db2.gz WKLFSNGMTUFUMW-UHFFFAOYSA-N 1 1 345.403 2.187 10 5 EEBEMO CCc1ccccc1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001319351363 1332689534 /nfs/dbraw/zinc/68/95/34/1332689534.db2.gz IMKYCKSQNDGRRO-IAGOWNOFSA-N 1 1 345.443 2.433 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)Cc3c[nH]c4ccc([N+](=O)[O-])cc34)[C@H]2C1 ZINC001349693709 1337639527 /nfs/dbraw/zinc/63/95/27/1337639527.db2.gz LWKXFYPRZYHGAV-KCTSRDHCSA-N 1 1 342.399 2.075 10 5 EEBEMO C[N@@H+](CC1CCOCC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848483527 1338706342 /nfs/dbraw/zinc/70/63/42/1338706342.db2.gz JCMQXEMGIXVQRF-KRWDZBQOSA-N 1 1 347.415 2.227 10 5 EEBEMO 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328.372 2.154 10 5 EEBEMO CC[N@H+]1C[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(C)c2)C(C)(C)C1 ZINC001639265906 1352696241 /nfs/dbraw/zinc/69/62/41/1352696241.db2.gz DCQMAOLLVPZAFI-OAHLLOKOSA-N 1 1 335.404 2.129 10 5 EEBEMO Cc1cccc(NC(=O)C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001648017145 1353413797 /nfs/dbraw/zinc/41/37/97/1353413797.db2.gz JOVXVPDCXOUZLM-SFHVURJKSA-N 1 1 343.383 2.339 10 5 EEBEMO C[C@H]1C[N@@H+](CCc2ccc([N+](=O)[O-])cc2)CCN1c1cnccn1 ZINC001655145461 1354166497 /nfs/dbraw/zinc/16/64/97/1354166497.db2.gz XOEURRFOGYSEDL-AWEZNQCLSA-N 1 1 327.388 2.138 10 5 EEBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CC(F)(F)C1 ZINC001668767943 1356000861 /nfs/dbraw/zinc/00/08/61/1356000861.db2.gz OUFJKSCQXIAUKS-OWOJBTEDSA-N 1 1 345.371 2.464 10 5 EEBEMO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1nnc2n1CCCCC2 ZINC000818950064 785339986 /nfs/dbraw/zinc/33/99/86/785339986.db2.gz PATNORWBEDJDGX-SWLSCSKDSA-N 1 1 345.403 2.297 10 5 EEBEMO 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334.420 2.027 10 5 EEBEMO COc1cc(C[NH+]2CCC(Oc3cnccn3)CC2)ccc1[N+](=O)[O-] ZINC000488769256 468103687 /nfs/dbraw/zinc/10/36/87/468103687.db2.gz RLEBAHDJBQHWCU-UHFFFAOYSA-N 1 1 344.371 2.437 10 5 EEBEMO CCc1ccc(C(=O)N2CCOC[C@H]2[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590399914 468247008 /nfs/dbraw/zinc/24/70/08/468247008.db2.gz FDHRCRLSCCODFQ-WBVHZDCISA-N 1 1 347.415 2.092 10 5 EEBEMO CC[C@H]1C[N@@H+](C)CCCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000597603259 468613789 /nfs/dbraw/zinc/61/37/89/468613789.db2.gz AVSJQGQKVGWPJC-NSHDSACASA-N 1 1 341.358 2.358 10 5 EEBEMO C[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@H]1C(=O)OC(C)(C)C ZINC000570276764 468616271 /nfs/dbraw/zinc/61/62/71/468616271.db2.gz QWAKFUPAOGCSGY-QWHCGFSZSA-N 1 1 338.408 2.091 10 5 EEBEMO CC(C)(C)Oc1cc(N2CC[N@H+]3C[C@H](O)C[C@H]3C2)ccc1[N+](=O)[O-] ZINC000594603075 468632707 /nfs/dbraw/zinc/63/27/07/468632707.db2.gz HZHRFXXGCRESER-UONOGXRCSA-N 1 1 335.404 2.027 10 5 EEBEMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cc1 ZINC000594976305 468736005 /nfs/dbraw/zinc/73/60/05/468736005.db2.gz ZFBPBPCJKKVSST-IBGZPJMESA-N 1 1 341.411 2.451 10 5 EEBEMO CC(C)[N@H+]1CCCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC1 ZINC000601110961 468744909 /nfs/dbraw/zinc/74/49/09/468744909.db2.gz MIBOMEBLXLEYCY-UHFFFAOYSA-N 1 1 335.330 2.268 10 5 EEBEMO O=[N+]([O-])c1cc(F)cnc1N[C@@H]1C[C@@H]([NH+]2CCOCC2)C12CCC2 ZINC000601196609 468778502 /nfs/dbraw/zinc/77/85/02/468778502.db2.gz PKXIKTPCEBAQKW-ZIAGYGMSSA-N 1 1 336.367 2.184 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C2CCCCC2)C1 ZINC000598220888 468796640 /nfs/dbraw/zinc/79/66/40/468796640.db2.gz QVYOTJKENIORHQ-CYBMUJFWSA-N 1 1 332.404 2.435 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[NH+]2C[C@H](C)C(O)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000595746885 468984819 /nfs/dbraw/zinc/98/48/19/468984819.db2.gz ZFHJENPMEBKONC-GVXVVHGQSA-N 1 1 335.404 2.179 10 5 EEBEMO O=C(CC[N@@H+]1CCC[C@@](O)(C2CC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595750325 468987138 /nfs/dbraw/zinc/98/71/38/468987138.db2.gz LSJLJIMVPSEKDA-KRWDZBQOSA-N 1 1 333.388 2.160 10 5 EEBEMO Nc1cc(N2CCC[N@H+](C3CCCC3)CC2)cc(CO)c1[N+](=O)[O-] ZINC000587982534 469099304 /nfs/dbraw/zinc/09/93/04/469099304.db2.gz FLHBCGQBUULBNF-UHFFFAOYSA-N 1 1 334.420 2.124 10 5 EEBEMO CNC(=O)c1ccc(NC[C@H]2CC[N@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599166570 469146041 /nfs/dbraw/zinc/14/60/41/469146041.db2.gz YAVZHILSFRWGFP-CQSZACIVSA-N 1 1 332.404 2.383 10 5 EEBEMO CN(C)c1nc(NCCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc[nH+]1 ZINC000588864540 469173882 /nfs/dbraw/zinc/17/38/82/469173882.db2.gz NQTOKNFJYIMQPV-UHFFFAOYSA-N 1 1 326.360 2.587 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@H](O)CC3(O)CCC3)C2)cc1 ZINC000599433921 469254590 /nfs/dbraw/zinc/25/45/90/469254590.db2.gz MYUAKYAOTYQALL-DOTOQJQBSA-N 1 1 334.416 2.440 10 5 EEBEMO COc1ccc(C[NH+]2CCC(C)(N3CCOCC3)CC2)cc1[N+](=O)[O-] ZINC000599618100 469311749 /nfs/dbraw/zinc/31/17/49/469311749.db2.gz PORZQQRXNMAKAD-UHFFFAOYSA-N 1 1 349.431 2.290 10 5 EEBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)NCc1ccccc1[N+](=O)[O-] ZINC000175715758 534777347 /nfs/dbraw/zinc/77/73/47/534777347.db2.gz OTHPWPHUPFRIEO-HNNXBMFYSA-N 1 1 343.387 2.474 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CNC(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 ZINC000752016531 577764614 /nfs/dbraw/zinc/76/46/14/577764614.db2.gz YVIUDOQIJGDCHI-AINHQSCGSA-N 1 1 347.415 2.225 10 5 EEBEMO C/C(=C\C(=O)NCc1c[nH+]c(N(C)C)n1C)c1ccc([N+](=O)[O-])cc1 ZINC000752352222 577769453 /nfs/dbraw/zinc/76/94/53/577769453.db2.gz XQQBTMZZPYEAKY-FMIVXFBMSA-N 1 1 343.387 2.114 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c2ncc([N+](=O)[O-])cc12 ZINC000756888200 577852516 /nfs/dbraw/zinc/85/25/16/577852516.db2.gz OCRZXTSHMVEACI-WFASDCNBSA-N 1 1 331.376 2.106 10 5 EEBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1 ZINC000898169231 691889971 /nfs/dbraw/zinc/88/99/71/691889971.db2.gz GMKMFYYTDDTENH-VGAQJYNHSA-N 1 1 329.400 2.408 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000925322412 692043131 /nfs/dbraw/zinc/04/31/31/692043131.db2.gz XKWISOGMVUHIFR-PSASIEDQSA-N 1 1 344.318 2.410 10 5 EEBEMO C[N@H+](CCNC(=O)CCc1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001266255684 1176035905 /nfs/dbraw/zinc/03/59/05/1176035905.db2.gz ZMLAPVDULHUESP-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1ccco1)Cc1cccc([N+](=O)[O-])c1 ZINC001266255684 1176035911 /nfs/dbraw/zinc/03/59/11/1176035911.db2.gz ZMLAPVDULHUESP-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c(C)n1C ZINC001690994865 1176434972 /nfs/dbraw/zinc/43/49/72/1176434972.db2.gz VMMKNHZHLCJXQG-UHFFFAOYSA-N 1 1 344.415 2.412 10 5 EEBEMO Cc1cc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c(C)n1C ZINC001690994865 1176434977 /nfs/dbraw/zinc/43/49/77/1176434977.db2.gz VMMKNHZHLCJXQG-UHFFFAOYSA-N 1 1 344.415 2.412 10 5 EEBEMO CCC[N@H+](CCNC(=O)c1n[nH]cc1C)Cc1ccccc1[N+](=O)[O-] ZINC001266560717 1176846905 /nfs/dbraw/zinc/84/69/05/1176846905.db2.gz UKEZXPCDMNGMKY-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1n[nH]cc1C)Cc1ccccc1[N+](=O)[O-] ZINC001266560717 1176846913 /nfs/dbraw/zinc/84/69/13/1176846913.db2.gz UKEZXPCDMNGMKY-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO C[N@H+](CCNC(=O)c1cc(C2CC2)n[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001267219857 1178526617 /nfs/dbraw/zinc/52/66/17/1178526617.db2.gz ZZAKBDVFCIRVRE-UHFFFAOYSA-N 1 1 343.387 2.057 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc(C2CC2)n[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001267219857 1178526624 /nfs/dbraw/zinc/52/66/24/1178526624.db2.gz ZZAKBDVFCIRVRE-UHFFFAOYSA-N 1 1 343.387 2.057 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1cnc(C)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480978990 1179414807 /nfs/dbraw/zinc/41/48/07/1179414807.db2.gz RZTFPYRJPVNBOB-UHFFFAOYSA-N 1 1 346.387 2.072 10 5 EEBEMO Cc1n[nH]cc1C(=O)N(C)CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001484751955 1191507853 /nfs/dbraw/zinc/50/78/53/1191507853.db2.gz JJHIQBQPQRELBV-UHFFFAOYSA-N 1 1 345.403 2.220 10 5 EEBEMO C[C@@H]([NH2+]C[C@H]1CCCCS1(=O)=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872059089 1198036733 /nfs/dbraw/zinc/03/67/33/1198036733.db2.gz BEACRVXIJXSSDY-GHMZBOCLSA-N 1 1 330.381 2.352 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)C[C@@H](O)c1ccccc1)C2 ZINC000878302989 1200386976 /nfs/dbraw/zinc/38/69/76/1200386976.db2.gz CZXFXNJFPUXNQI-QFBILLFUSA-N 1 1 342.395 2.438 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)C[C@@H](O)c1ccccc1)C2 ZINC000878302989 1200386983 /nfs/dbraw/zinc/38/69/83/1200386983.db2.gz CZXFXNJFPUXNQI-QFBILLFUSA-N 1 1 342.395 2.438 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CC[C@H](C4CC4)O3)CC2)cn1 ZINC000885938175 1202457185 /nfs/dbraw/zinc/45/71/85/1202457185.db2.gz UTIOERIBGFYWES-HZPDHXFCSA-N 1 1 332.404 2.069 10 5 EEBEMO C[N@H+]1CC[C@@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000925405177 1206108007 /nfs/dbraw/zinc/10/80/07/1206108007.db2.gz VJQBASMSZOKWHG-SECBINFHSA-N 1 1 330.291 2.022 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928433556 1206383020 /nfs/dbraw/zinc/38/30/20/1206383020.db2.gz MPNMUTNPGSRDML-GZMMTYOYSA-N 1 1 331.294 2.436 10 5 EEBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000803859834 1242104842 /nfs/dbraw/zinc/10/48/42/1242104842.db2.gz XHHRHBXLGNGKFN-AWEZNQCLSA-N 1 1 349.387 2.001 10 5 EEBEMO COC(=O)[C@]12C[N@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C[C@H]1COCC2 ZINC000483074303 1253824360 /nfs/dbraw/zinc/82/43/60/1253824360.db2.gz JZQFZLQOSFVUSG-GDZNZVCISA-N 1 1 334.372 2.167 10 5 EEBEMO C[C@@H]1[C@@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001195045670 1283414679 /nfs/dbraw/zinc/41/46/79/1283414679.db2.gz LRHBISGCZFZYNK-VXGBXAGGSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@@H]1[C@@H](CO)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001195045670 1283414688 /nfs/dbraw/zinc/41/46/88/1283414688.db2.gz LRHBISGCZFZYNK-VXGBXAGGSA-N 1 1 332.360 2.238 10 5 EEBEMO CCOC(=O)[C@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001198280917 1285065279 /nfs/dbraw/zinc/06/52/79/1285065279.db2.gz YHQCZLPAPDOVGS-ZDUSSCGKSA-N 1 1 349.387 2.117 10 5 EEBEMO Cc1ccc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001123345027 1310531075 /nfs/dbraw/zinc/53/10/75/1310531075.db2.gz DTMFLZFBWXHGDE-HNNXBMFYSA-N 1 1 334.372 2.313 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@@H]32)c1 ZINC001124025430 1310808133 /nfs/dbraw/zinc/80/81/33/1310808133.db2.gz MWFZVHHLMKKPRZ-SOUVJXGZSA-N 1 1 347.415 2.129 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2cccc([N+](=O)[O-])c2Br)C1 ZINC000839604649 1315219339 /nfs/dbraw/zinc/21/93/39/1315219339.db2.gz FPJKESVTLKQYOA-GWCFXTLKSA-N 1 1 340.221 2.493 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cnsn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001265101084 1322920104 /nfs/dbraw/zinc/92/01/04/1322920104.db2.gz APPRHKUCGQDPQQ-UHFFFAOYSA-N 1 1 349.416 2.088 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1ccon1)Cc1ccc([N+](=O)[O-])cc1 ZINC001265101647 1322920165 /nfs/dbraw/zinc/92/01/65/1322920165.db2.gz SXNABOUMBNCTKE-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO CC(C)[N@@H+](C)CCCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001290781522 1328270296 /nfs/dbraw/zinc/27/02/96/1328270296.db2.gz COMDCDKINYWWNA-UHFFFAOYSA-N 1 1 346.790 2.430 10 5 EEBEMO CCn1ccnc1C(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001316821168 1331913317 /nfs/dbraw/zinc/91/33/17/1331913317.db2.gz MPEFRMKFHZZKTR-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO Cc1cc(C)nc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001317453861 1332249471 /nfs/dbraw/zinc/24/94/71/1332249471.db2.gz SYPCWHVRTSMTBV-UHFFFAOYSA-N 1 1 342.399 2.468 10 5 EEBEMO Cc1cc(C)nc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001317453861 1332249475 /nfs/dbraw/zinc/24/94/75/1332249475.db2.gz SYPCWHVRTSMTBV-UHFFFAOYSA-N 1 1 342.399 2.468 10 5 EEBEMO Cc1cc(C(=O)N2CC[N@H+](C)[C@@H](C(C)(C)C)C2)c(N)c([N+](=O)[O-])c1 ZINC001300097912 1338050264 /nfs/dbraw/zinc/05/02/64/1338050264.db2.gz RYVUGGCTDDGVLE-CQSZACIVSA-N 1 1 334.420 2.288 10 5 EEBEMO Cn1cc([N+](=O)[O-])c(N2CCC(c3[nH+]cc4n3CCCC4)CC2)n1 ZINC001612311149 1352307131 /nfs/dbraw/zinc/30/71/31/1352307131.db2.gz VTNMTDDJBPDVKE-UHFFFAOYSA-N 1 1 330.392 2.245 10 5 EEBEMO C[NH+](C)Cc1ccc(C(=O)N2CCc3ccc([N+](=O)[O-])cc3C2)o1 ZINC001635435505 1352645897 /nfs/dbraw/zinc/64/58/97/1352645897.db2.gz LVVGOMPRPKHWMN-UHFFFAOYSA-N 1 1 329.356 2.448 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(C(=O)Cc3ccc(Cl)c([N+](=O)[O-])c3)C[C@@H]2C1 ZINC001640577957 1352711528 /nfs/dbraw/zinc/71/15/28/1352711528.db2.gz BBFNQKBLBPLPHD-OLZOCXBDSA-N 1 1 337.807 2.201 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001654030144 1354138183 /nfs/dbraw/zinc/13/81/83/1354138183.db2.gz GHRQWRDKYKQHBX-CYBMUJFWSA-N 1 1 325.796 2.343 10 5 EEBEMO O=C(CC[NH2+][C@@H](c1ncccn1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC001654859562 1354160210 /nfs/dbraw/zinc/16/02/10/1354160210.db2.gz FTCDQZKGNLDOOD-MRXNPFEDSA-N 1 1 341.371 2.454 10 5 EEBEMO 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ZINC001667659159 1355775048 /nfs/dbraw/zinc/77/50/48/1355775048.db2.gz ANMIQOPKLYAYML-UHFFFAOYSA-N 1 1 330.388 2.435 10 5 EEBEMO CNc1ccc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)cc1[N+](=O)[O-] ZINC000913292612 788769970 /nfs/dbraw/zinc/76/99/70/788769970.db2.gz BFEVEZOJYVJZFK-CALCHBBNSA-N 1 1 332.404 2.050 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001147111878 791709423 /nfs/dbraw/zinc/70/94/23/791709423.db2.gz RYBWHGBWHZCSGI-JTQLQIEISA-N 1 1 340.811 2.433 10 5 EEBEMO NC(=O)[C@@H](C1CC1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC1 ZINC001175503761 798136798 /nfs/dbraw/zinc/13/67/98/798136798.db2.gz RFKQKDOSJUJAIK-MRXNPFEDSA-N 1 1 344.371 2.212 10 5 EEBEMO NC(=O)[C@@H](C1CC1)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC1 ZINC001175503761 798136800 /nfs/dbraw/zinc/13/68/00/798136800.db2.gz RFKQKDOSJUJAIK-MRXNPFEDSA-N 1 1 344.371 2.212 10 5 EEBEMO C[C@@]12CSC[C@@H]1C[N@H+]([C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)C2 ZINC001176803432 798577749 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CCN(CC)C(=O)[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352417128 162128977 /nfs/dbraw/zinc/12/89/77/162128977.db2.gz NHHDXVYHHZSJNC-HNNXBMFYSA-N 1 1 335.404 2.436 10 5 EEBEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000352417128 162128980 /nfs/dbraw/zinc/12/89/80/162128980.db2.gz NHHDXVYHHZSJNC-HNNXBMFYSA-N 1 1 335.404 2.436 10 5 EEBEMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000364325983 165097640 /nfs/dbraw/zinc/09/76/40/165097640.db2.gz SPXSZWPNDFWDQA-KBPBESRZSA-N 1 1 340.351 2.276 10 5 EEBEMO CCOC(=O)C[C@@H]1C[C@H](OC)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000364325983 165097647 /nfs/dbraw/zinc/09/76/47/165097647.db2.gz SPXSZWPNDFWDQA-KBPBESRZSA-N 1 1 340.351 2.276 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CCC[N@H+](CCO)CC2)cc1C(F)(F)F ZINC000171506917 227115552 /nfs/dbraw/zinc/11/55/52/227115552.db2.gz NOKCPFPRINOAMO-UHFFFAOYSA-N 1 1 333.310 2.118 10 5 EEBEMO CC1(C)C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@]2(CCOC2)O1 ZINC000280331543 269352127 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333.388 2.221 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCCC[C@@H]1C1(O)CC1 ZINC000576952568 320219353 /nfs/dbraw/zinc/21/93/53/320219353.db2.gz SLOKVYBEAJYQCQ-OAHLLOKOSA-N 1 1 333.388 2.221 10 5 EEBEMO O=C1C[C@@H]([C@@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751157 465338538 /nfs/dbraw/zinc/33/85/38/465338538.db2.gz GSRQRWMXQPOZMF-BMIGLBTASA-N 1 1 339.342 2.364 10 5 EEBEMO O=C1C[C@@H]([C@@H]2CCCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751157 465338542 /nfs/dbraw/zinc/33/85/42/465338542.db2.gz GSRQRWMXQPOZMF-BMIGLBTASA-N 1 1 339.342 2.364 10 5 EEBEMO Cc1ccccc1[C@]1(F)CC[N@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000337429135 465364030 /nfs/dbraw/zinc/36/40/30/465364030.db2.gz AMFGSFPCVBGPLH-WBVHZDCISA-N 1 1 348.378 2.031 10 5 EEBEMO Cc1ccccc1[C@]1(F)CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000337429135 465364036 /nfs/dbraw/zinc/36/40/36/465364036.db2.gz AMFGSFPCVBGPLH-WBVHZDCISA-N 1 1 348.378 2.031 10 5 EEBEMO O=[N+]([O-])c1cnn(C[C@H](O)C[N@@H+]2CC=C(c3ccccc3F)CC2)c1 ZINC000127688650 462574978 /nfs/dbraw/zinc/57/49/78/462574978.db2.gz FZBYWQVZCIKOKS-OAHLLOKOSA-N 1 1 346.362 2.081 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000117280251 462793931 /nfs/dbraw/zinc/79/39/31/462793931.db2.gz MSTSYSMYJFEDTI-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@H]1C ZINC000117280251 462793936 /nfs/dbraw/zinc/79/39/36/462793936.db2.gz MSTSYSMYJFEDTI-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CC[C@@H]1CN(CCOc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000105836976 463476875 /nfs/dbraw/zinc/47/68/75/463476875.db2.gz LYENHZZZNAPDCG-OAHLLOKOSA-N 1 1 337.420 2.016 10 5 EEBEMO Cc1cnn([C@H]2CCC[N@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000105900801 463494466 /nfs/dbraw/zinc/49/44/66/463494466.db2.gz XEKALHQZBWPOAM-HNNXBMFYSA-N 1 1 343.387 2.036 10 5 EEBEMO Cc1cnn([C@H]2CCC[N@@H+](Cc3ccc(C(N)=O)cc3[N+](=O)[O-])C2)c1 ZINC000105900801 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O=C(COc1cccc([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600229896 468502476 /nfs/dbraw/zinc/50/24/76/468502476.db2.gz WWXCAJHCNVYBQP-INIZCTEOSA-N 1 1 347.415 2.497 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C2 ZINC000373913134 466965215 /nfs/dbraw/zinc/96/52/15/466965215.db2.gz XJQRPBSHHORPAY-LRDDRELGSA-N 1 1 349.343 2.278 10 5 EEBEMO O=[N+]([O-])c1cnc2ccccc2c1N1CC[NH+]([C@@H]2CCOC2)CC1 ZINC000589864418 468190641 /nfs/dbraw/zinc/19/06/41/468190641.db2.gz NTWSUCDRPZBDDP-CYBMUJFWSA-N 1 1 328.372 2.054 10 5 EEBEMO C[C@](CO)([NH2+]Cc1ccnn1CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000601148478 468761744 /nfs/dbraw/zinc/76/17/44/468761744.db2.gz CHFXAHRJVRIXCN-QGZVFWFLSA-N 1 1 330.388 2.199 10 5 EEBEMO CCC[N@H+](C)CC(C)(C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000595381064 468832340 /nfs/dbraw/zinc/83/23/40/468832340.db2.gz IAFYNMCHGINOTC-UHFFFAOYSA-N 1 1 347.412 2.133 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1c(F)cccc1[N+](=O)[O-] ZINC000595381064 468832342 /nfs/dbraw/zinc/83/23/42/468832342.db2.gz IAFYNMCHGINOTC-UHFFFAOYSA-N 1 1 347.412 2.133 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)[C@@]2(CO)CC[C@@H](C)C2)c1 ZINC000593025773 468843618 /nfs/dbraw/zinc/84/36/18/468843618.db2.gz XXDFJIMXXRXFRH-PXAZEXFGSA-N 1 1 336.388 2.364 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000595468725 468864733 /nfs/dbraw/zinc/86/47/33/468864733.db2.gz KXZHLAIFCJWSKF-HNNXBMFYSA-N 1 1 334.420 2.309 10 5 EEBEMO C[C@@H]1CC[N@@H+](CCn2cc([N+](=O)[O-])cn2)C[C@@H]1C(=O)OC(C)(C)C ZINC000584716633 468920366 /nfs/dbraw/zinc/92/03/66/468920366.db2.gz HLVXJZLZVDCGMO-OCCSQVGLSA-N 1 1 338.408 2.091 10 5 EEBEMO C[C@@H]1CN(c2ccnc3cc([N+](=O)[O-])ccc32)[C@@H](C)C[N@H+]1CCO ZINC000593480021 468998410 /nfs/dbraw/zinc/99/84/10/468998410.db2.gz SZDBXOMCKTXMCH-OLZOCXBDSA-N 1 1 330.388 2.034 10 5 EEBEMO CC(C)NC(=O)[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000595848157 469041613 /nfs/dbraw/zinc/04/16/13/469041613.db2.gz AUWDSNCIBUYESU-AWEZNQCLSA-N 1 1 335.404 2.210 10 5 EEBEMO O=[N+]([O-])c1cccc2c1ccnc2NC1CC([NH+]2CCOCC2)C1 ZINC000599092475 469116357 /nfs/dbraw/zinc/11/63/57/469116357.db2.gz ILNNRRCZVDGBHE-UHFFFAOYSA-N 1 1 328.372 2.418 10 5 EEBEMO CC[C@@H]([NH2+]Cc1cnc(C(=O)OC)cn1)c1cccc([N+](=O)[O-])c1 ZINC000599355158 469224257 /nfs/dbraw/zinc/22/42/57/469224257.db2.gz VIEJAEXRLIIEOH-CQSZACIVSA-N 1 1 330.344 2.412 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596266610 469227326 /nfs/dbraw/zinc/22/73/26/469227326.db2.gz VBCTVKNPVZRSMI-SNVBAGLBSA-N 1 1 333.310 2.116 10 5 EEBEMO O=[N+]([O-])c1cnc(N2CCC([N@H+]3CCCOCC3)CC2)c(Cl)c1 ZINC000596268943 469227551 /nfs/dbraw/zinc/22/75/51/469227551.db2.gz OBOGVWXIDYCRNG-UHFFFAOYSA-N 1 1 340.811 2.334 10 5 EEBEMO COC(=O)c1ccc(C[N@H+](C)CCOc2ccccc2[N+](=O)[O-])nc1 ZINC000599443532 469258758 /nfs/dbraw/zinc/25/87/58/469258758.db2.gz QJUBNONAVOHZLW-UHFFFAOYSA-N 1 1 345.355 2.287 10 5 EEBEMO COC(=O)c1ccc(C[N@@H+](C)CCOc2ccccc2[N+](=O)[O-])nc1 ZINC000599443532 469258761 /nfs/dbraw/zinc/25/87/61/469258761.db2.gz QJUBNONAVOHZLW-UHFFFAOYSA-N 1 1 345.355 2.287 10 5 EEBEMO CC1([NH+]2CCOCC2)CCN(CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000599618628 469311956 /nfs/dbraw/zinc/31/19/56/469311956.db2.gz QGZVGZDUVGNJBZ-UHFFFAOYSA-N 1 1 349.431 2.160 10 5 EEBEMO CN(C(=O)c1cc([N+](=O)[O-])cn1C)[C@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000531634893 485538908 /nfs/dbraw/zinc/53/89/08/485538908.db2.gz JLSLWCNXDDPZNB-HNNXBMFYSA-N 1 1 342.399 2.280 10 5 EEBEMO COCC[N@H+]1CCCN(C(=O)/C=C(\C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000751503027 577754410 /nfs/dbraw/zinc/75/44/10/577754410.db2.gz WKOPZKABZRUNDI-CCEZHUSRSA-N 1 1 347.415 2.179 10 5 EEBEMO COCCC(C)(C)C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001267695374 1180195004 /nfs/dbraw/zinc/19/50/04/1180195004.db2.gz UGFWGSOJTUQPKN-UHFFFAOYSA-N 1 1 349.431 2.206 10 5 EEBEMO O=C(NCC1([NH2+]Cc2cccc(C(F)F)c2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001670781410 1181703428 /nfs/dbraw/zinc/70/34/28/1181703428.db2.gz JHAZGIUGBHSJAT-CHWSQXEVSA-N 1 1 339.342 2.028 10 5 EEBEMO O=C(NCC1([NH2+]Cc2ccc(CF)cc2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001482218595 1184269672 /nfs/dbraw/zinc/26/96/72/1184269672.db2.gz RSNMCABOVQZMMV-HZPDHXFCSA-N 1 1 349.406 2.340 10 5 EEBEMO O=C(O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1[C@@H]2CCCO[C@H]12 ZINC000813174359 1201142933 /nfs/dbraw/zinc/14/29/33/1201142933.db2.gz YSLGRPWXRCXARZ-NXOAAHMSSA-N 1 1 346.383 2.137 10 5 EEBEMO O=C(O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)[C@@H]1[C@@H]2CCCO[C@H]12 ZINC000813174359 1201142937 /nfs/dbraw/zinc/14/29/37/1201142937.db2.gz YSLGRPWXRCXARZ-NXOAAHMSSA-N 1 1 346.383 2.137 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(c3ncc([N+](=O)[O-])cc3Br)CC[C@@H]21 ZINC000866207887 1201465518 /nfs/dbraw/zinc/46/55/18/1201465518.db2.gz YKLPCBFQUMGLPU-CABZTGNLSA-N 1 1 341.209 2.283 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC000136935354 1202471252 /nfs/dbraw/zinc/47/12/52/1202471252.db2.gz PSDBRLJPHIVMSL-GFCCVEGCSA-N 1 1 341.795 2.089 10 5 EEBEMO Cn1ccnc1[C@@H](NC[C@@H]1CC[C@H]([NH3+])C1)c1cccc([N+](=O)[O-])c1 ZINC000925879502 1206163648 /nfs/dbraw/zinc/16/36/48/1206163648.db2.gz GCUXUNAEXHSMFA-INWMFGNUSA-N 1 1 329.404 2.135 10 5 EEBEMO Cc1c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000928102418 1206344619 /nfs/dbraw/zinc/34/46/19/1206344619.db2.gz MJKLSNIDIDSPGF-DZGCQCFKSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000928102418 1206344621 /nfs/dbraw/zinc/34/46/21/1206344621.db2.gz MJKLSNIDIDSPGF-DZGCQCFKSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)CCOc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928448786 1206386027 /nfs/dbraw/zinc/38/60/27/1206386027.db2.gz OQBNEEVCBRMRDQ-ZYHUDNBSSA-N 1 1 341.795 2.226 10 5 EEBEMO O=C(NCC[NH2+]C(c1ccccc1)c1ccccc1)[C@@H]1CC1[N+](=O)[O-] ZINC000900836211 1234886528 /nfs/dbraw/zinc/88/65/28/1234886528.db2.gz PIEGXBALTFOEKL-IAGOWNOFSA-N 1 1 339.395 2.147 10 5 EEBEMO C[C@@H]1C[C@H](CO)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000860085378 1294797770 /nfs/dbraw/zinc/79/77/70/1294797770.db2.gz DQYWEIJAQGNWNL-GHMZBOCLSA-N 1 1 341.795 2.280 10 5 EEBEMO C[C@@H]1C[C@H](CO)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000860085378 1294797777 /nfs/dbraw/zinc/79/77/77/1294797777.db2.gz DQYWEIJAQGNWNL-GHMZBOCLSA-N 1 1 341.795 2.280 10 5 EEBEMO O=C([C@@H]1CC[C@H]2CCCC[N@H+]21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001262155601 1322249629 /nfs/dbraw/zinc/24/96/29/1322249629.db2.gz PVIHJYFPFGDNGT-WBVHZDCISA-N 1 1 329.400 2.496 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CCc1ccc2ccccc2c1 ZINC001492250269 1331112630 /nfs/dbraw/zinc/11/26/30/1331112630.db2.gz SAJKOXHVTKKIAF-QZTJIDSGSA-N 1 1 341.411 2.096 10 5 EEBEMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCc1ccc2ccccc2c1 ZINC001492250269 1331112635 /nfs/dbraw/zinc/11/26/35/1331112635.db2.gz SAJKOXHVTKKIAF-QZTJIDSGSA-N 1 1 341.411 2.096 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])CCc1ccc2ccccc2c1 ZINC001492250269 1331112640 /nfs/dbraw/zinc/11/26/40/1331112640.db2.gz SAJKOXHVTKKIAF-QZTJIDSGSA-N 1 1 341.411 2.096 10 5 EEBEMO C[N@H+](CCNC(=O)c1coc(C2CC2)n1)Cc1cccc([N+](=O)[O-])c1 ZINC001492448181 1331261185 /nfs/dbraw/zinc/26/11/85/1331261185.db2.gz QOSQOWFFNAGJQA-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO C[N@@H+](CCNC(=O)c1coc(C2CC2)n1)Cc1cccc([N+](=O)[O-])c1 ZINC001492448181 1331261190 /nfs/dbraw/zinc/26/11/90/1331261190.db2.gz QOSQOWFFNAGJQA-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO CCc1cc(C(=O)NCC[N@H+](CC)Cc2cccc([N+](=O)[O-])c2)no1 ZINC001317491301 1332263767 /nfs/dbraw/zinc/26/37/67/1332263767.db2.gz TZJNWNJORGNKGT-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001344683169 1337410170 /nfs/dbraw/zinc/41/01/70/1337410170.db2.gz CCRFNOCNOLJKNF-CYZMBNFOSA-N 1 1 334.376 2.065 10 5 EEBEMO CCC1(O)CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC001615669338 1352324699 /nfs/dbraw/zinc/32/46/99/1352324699.db2.gz UEGYIYWRKOSOBD-UHFFFAOYSA-N 1 1 332.360 2.382 10 5 EEBEMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC001617134456 1352336898 /nfs/dbraw/zinc/33/68/98/1352336898.db2.gz WONUZZUDZPYPRQ-GFCCVEGCSA-N 1 1 344.375 2.051 10 5 EEBEMO CC(=O)Nc1c[nH]nc1[C@@H]1CCC[N@@H+](Cc2cccnc2[N+](=O)[O-])C1 ZINC001617134456 1352336902 /nfs/dbraw/zinc/33/69/02/1352336902.db2.gz WONUZZUDZPYPRQ-GFCCVEGCSA-N 1 1 344.375 2.051 10 5 EEBEMO COc1ccc(CNC(=O)[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC001542174360 1342327992 /nfs/dbraw/zinc/32/79/92/1342327992.db2.gz HOMZEKXJYBRUKW-AWEZNQCLSA-N 1 1 335.404 2.340 10 5 EEBEMO Cc1nc(C(=O)N(C)CCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c[nH]1 ZINC001570192324 1343030069 /nfs/dbraw/zinc/03/00/69/1343030069.db2.gz CUZYNMPPFWHHQR-UHFFFAOYSA-N 1 1 345.403 2.220 10 5 EEBEMO Cc1ncc(C(=O)N(C)CCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]1 ZINC001570192324 1343030072 /nfs/dbraw/zinc/03/00/72/1343030072.db2.gz CUZYNMPPFWHHQR-UHFFFAOYSA-N 1 1 345.403 2.220 10 5 EEBEMO Cc1ncc(C(=O)N(C)CCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]1 ZINC001570192324 1343030074 /nfs/dbraw/zinc/03/00/74/1343030074.db2.gz CUZYNMPPFWHHQR-UHFFFAOYSA-N 1 1 345.403 2.220 10 5 EEBEMO C[N@H+]1C[C@@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC001635643552 1352649903 /nfs/dbraw/zinc/64/99/03/1352649903.db2.gz CSZNANVPVQGYQJ-OAHLLOKOSA-N 1 1 334.420 2.243 10 5 EEBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC001648297144 1353423005 /nfs/dbraw/zinc/42/30/05/1353423005.db2.gz QDFYCHKLBRACQG-NSHDSACASA-N 1 1 343.786 2.482 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@H](CO)C2CC2)o1 ZINC001654057469 1354139878 /nfs/dbraw/zinc/13/98/78/1354139878.db2.gz HNEWNZQNMFTMRM-LLVKDONJSA-N 1 1 338.751 2.159 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001654653401 1354154679 /nfs/dbraw/zinc/15/46/79/1354154679.db2.gz NFLOXKFELQSSKP-GFCCVEGCSA-N 1 1 335.379 2.362 10 5 EEBEMO CCc1cc(C(=O)NCC[N@@H+](CC)Cc2ccccc2[N+](=O)[O-])no1 ZINC001663443273 1354962388 /nfs/dbraw/zinc/96/23/88/1354962388.db2.gz QFQSIQKSYAVEOP-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO CCc1cc(C(=O)NCC[N@H+](CC)Cc2ccccc2[N+](=O)[O-])no1 ZINC001663443273 1354962391 /nfs/dbraw/zinc/96/23/91/1354962391.db2.gz QFQSIQKSYAVEOP-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)Cc1ccc[nH]1 ZINC001673491698 1356695857 /nfs/dbraw/zinc/69/58/57/1356695857.db2.gz PHLKQGNIQKQSMN-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO Cn1cc([C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000821288049 786690725 /nfs/dbraw/zinc/69/07/25/786690725.db2.gz NFCUDJIAVKUQPL-INIZCTEOSA-N 1 1 348.378 2.461 10 5 EEBEMO CCc1ccc(C[NH+]2CCN(Cn3cc([N+](=O)[O-])cn3)CC2)s1 ZINC000153436601 795523105 /nfs/dbraw/zinc/52/31/05/795523105.db2.gz USMRWWVHLUQPOG-UHFFFAOYSA-N 1 1 335.433 2.191 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC001171937896 796820049 /nfs/dbraw/zinc/82/00/49/796820049.db2.gz ZERSDDOJXUJPLU-RFQIPJPRSA-N 1 1 333.388 2.015 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176515489 798479620 /nfs/dbraw/zinc/47/96/20/798479620.db2.gz JQSGEHQUKBVJKF-QWHCGFSZSA-N 1 1 341.371 2.201 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@H](c2cnccn2)C1 ZINC001176515489 798479622 /nfs/dbraw/zinc/47/96/22/798479622.db2.gz JQSGEHQUKBVJKF-QWHCGFSZSA-N 1 1 341.371 2.201 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC001176629234 798509055 /nfs/dbraw/zinc/50/90/55/798509055.db2.gz JBBDOAGLKRYJGL-IYOUNJFTSA-N 1 1 346.431 2.114 10 5 EEBEMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000791255991 809138071 /nfs/dbraw/zinc/13/80/71/809138071.db2.gz BJSCSVRAFXKBDG-HTEAGGNKSA-N 1 1 333.363 2.253 10 5 EEBEMO CC(C)[C@H]1C[N@@H+](Cc2ccccc2)CCN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001533468357 1123179957 /nfs/dbraw/zinc/17/99/57/1123179957.db2.gz JGBUJRXVWRLJAJ-BRWVUGGUSA-N 1 1 331.416 2.021 10 5 EEBEMO Cc1ccc(NCCCNC(=O)c2cc([N+](=O)[O-])cnc2C)[nH+]c1 ZINC000127781993 292330617 /nfs/dbraw/zinc/33/06/17/292330617.db2.gz JYQFUZAJCIYPKK-UHFFFAOYSA-N 1 1 329.360 2.234 10 5 EEBEMO C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@@H+]1CCC[C@@H](C)C1 ZINC000249756895 160384744 /nfs/dbraw/zinc/38/47/44/160384744.db2.gz DRNNQXWATFGXSJ-GHMZBOCLSA-N 1 1 347.462 2.055 10 5 EEBEMO C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@H+]1CCC[C@@H](C)C1 ZINC000249756895 160384746 /nfs/dbraw/zinc/38/47/46/160384746.db2.gz DRNNQXWATFGXSJ-GHMZBOCLSA-N 1 1 347.462 2.055 10 5 EEBEMO C[C@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000342432374 161065117 /nfs/dbraw/zinc/06/51/17/161065117.db2.gz FQVQNMYCRIBNAA-ZUZCIYMTSA-N 1 1 341.358 2.214 10 5 EEBEMO CN(C)C(=O)C1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 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IDQTVPFWZDYESC-PBHICJAKSA-N 1 1 336.388 2.098 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC001150119504 1316166067 /nfs/dbraw/zinc/16/60/67/1316166067.db2.gz DVVHMQQUXLMVET-WCQYABFASA-N 1 1 333.388 2.206 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@@H+](CC)CC1(C)C ZINC001156835623 1318235660 /nfs/dbraw/zinc/23/56/60/1318235660.db2.gz ABRBEFJCSUVOQE-AWEZNQCLSA-N 1 1 335.404 2.454 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(C)sc1C ZINC001265113207 1322926125 /nfs/dbraw/zinc/92/61/25/1322926125.db2.gz FALHFPIOOKZNBJ-HUUCEWRRSA-N 1 1 339.461 2.358 10 5 EEBEMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(C)sc1C ZINC001265113207 1322926128 /nfs/dbraw/zinc/92/61/28/1322926128.db2.gz FALHFPIOOKZNBJ-HUUCEWRRSA-N 1 1 339.461 2.358 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(C)sc1C ZINC001265113207 1322926132 /nfs/dbraw/zinc/92/61/32/1322926132.db2.gz FALHFPIOOKZNBJ-HUUCEWRRSA-N 1 1 339.461 2.358 10 5 EEBEMO Cc1nc(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)c(C)o1 ZINC001265942810 1323505905 /nfs/dbraw/zinc/50/59/05/1323505905.db2.gz UHVOSFRUKVVFII-UHFFFAOYSA-N 1 1 346.387 2.452 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(F)cc1 ZINC001319487797 1332710153 /nfs/dbraw/zinc/71/01/53/1332710153.db2.gz SGLCKXXAFBTISR-IUODEOHRSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(F)cc1 ZINC001319487797 1332710155 /nfs/dbraw/zinc/71/01/55/1332710155.db2.gz SGLCKXXAFBTISR-IUODEOHRSA-N 1 1 332.335 2.237 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cnn(C)c2C)c1 ZINC001326387974 1334081842 /nfs/dbraw/zinc/08/18/42/1334081842.db2.gz NKACAMNODBUQHF-JTQLQIEISA-N 1 1 332.360 2.274 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1 ZINC001349775579 1337647119 /nfs/dbraw/zinc/64/71/19/1337647119.db2.gz DALRGJZMTUGVEM-CYZMBNFOSA-N 1 1 328.372 2.146 10 5 EEBEMO Cc1cccc(CCC[NH2+][C@H]2C[C@H](CNC(=O)[C@@H]3CC3[N+](=O)[O-])C2)c1 ZINC001565863957 1342570733 /nfs/dbraw/zinc/57/07/33/1342570733.db2.gz CIABGQDOELUDDR-BRSBDYLESA-N 1 1 345.443 2.077 10 5 EEBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC001608184678 1351643040 /nfs/dbraw/zinc/64/30/40/1351643040.db2.gz UUGRSXXAISTNFJ-AWEZNQCLSA-N 1 1 330.388 2.171 10 5 EEBEMO CC[C@@H](NC(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21)c1cccc([N+](=O)[O-])c1 ZINC001679150676 1357629329 /nfs/dbraw/zinc/62/93/29/1357629329.db2.gz GSIPIXCXNZSMCQ-NUEKZKHPSA-N 1 1 332.404 2.391 10 5 EEBEMO Cc1ccc(C[N@@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)cc1[N+](=O)[O-] ZINC001648526531 1353433150 /nfs/dbraw/zinc/43/31/50/1353433150.db2.gz WCIHIYZWRMNELK-HDICACEKSA-N 1 1 334.416 2.250 10 5 EEBEMO CCc1[nH+]ccn1CCNC(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001651660326 1354059749 /nfs/dbraw/zinc/05/97/49/1354059749.db2.gz JPFLRBORYZGMAI-UHFFFAOYSA-N 1 1 341.371 2.194 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1nccnc1C ZINC001660046805 1354391980 /nfs/dbraw/zinc/39/19/80/1354391980.db2.gz YXNZZDXEVVOSBI-GFCCVEGCSA-N 1 1 329.360 2.291 10 5 EEBEMO CCC[N@@H+](CC)CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000925337258 775158925 /nfs/dbraw/zinc/15/89/25/775158925.db2.gz WCKFPEFIXCXCQO-QGZVFWFLSA-N 1 1 348.403 2.094 10 5 EEBEMO C[N@@H+]1C[C@H](O)C[C@@]1(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000908076408 785065482 /nfs/dbraw/zinc/06/54/82/785065482.db2.gz NMVUJVVDONNBFL-PXAZEXFGSA-N 1 1 335.404 2.286 10 5 EEBEMO C[N@H+]1C[C@H](O)C[C@@]1(C)C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000908076408 785065487 /nfs/dbraw/zinc/06/54/87/785065487.db2.gz NMVUJVVDONNBFL-PXAZEXFGSA-N 1 1 335.404 2.286 10 5 EEBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCN2CCO[C@H]1C2 ZINC000824501107 788208615 /nfs/dbraw/zinc/20/86/15/788208615.db2.gz DBFGJOHCMSGMRK-GJZGRUSLSA-N 1 1 325.796 2.153 10 5 EEBEMO COc1cccc(C(=O)N2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-] ZINC000913278146 788755404 /nfs/dbraw/zinc/75/54/04/788755404.db2.gz BKBTULGCMUNZOT-CALCHBBNSA-N 1 1 333.388 2.017 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[NH+](CCCCCO)CC1 ZINC000913695299 794141454 /nfs/dbraw/zinc/14/14/54/794141454.db2.gz ZPUSUSXIWFVCFU-UHFFFAOYSA-N 1 1 349.431 2.132 10 5 EEBEMO CC[N@H+]1CC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000712331861 803194147 /nfs/dbraw/zinc/19/41/47/803194147.db2.gz ATUOCLMCIMNKLA-VIFPVBQESA-N 1 1 342.193 2.181 10 5 EEBEMO C[C@@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC001170072414 807093309 /nfs/dbraw/zinc/09/33/09/807093309.db2.gz MFKMPHYSCFMGDY-ZDUSSCGKSA-N 1 1 328.372 2.442 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[N@@H+]3C[C@@H](F)C[C@H]3C2)cc1OC(F)F ZINC001458663125 1109928355 /nfs/dbraw/zinc/92/83/55/1109928355.db2.gz NYAAZWJOAFYBHH-ONGXEEELSA-N 1 1 331.294 2.429 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[N@H+]3C[C@@H](F)C[C@H]3C2)cc1OC(F)F ZINC001458663125 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XSPKZMZFLSNYPV-KZYWPTACSA-N 1 1 344.411 2.479 10 5 EEBEMO COCC[N@@H+]1[C@H](C)CN(c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000131891117 285064723 /nfs/dbraw/zinc/06/47/23/285064723.db2.gz ZUQLKUPBWIVMKE-TXEJJXNPSA-N 1 1 341.383 2.288 10 5 EEBEMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[N@@H+]2CCOC[C@H]2C1 ZINC000374905905 285085229 /nfs/dbraw/zinc/08/52/29/285085229.db2.gz ASBJYYHHMMIMBQ-LLVKDONJSA-N 1 1 331.294 2.134 10 5 EEBEMO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[N@H+]2CCOC[C@H]2C1 ZINC000374905905 285085233 /nfs/dbraw/zinc/08/52/33/285085233.db2.gz ASBJYYHHMMIMBQ-LLVKDONJSA-N 1 1 331.294 2.134 10 5 EEBEMO COCC[N@H+]1CCCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000271250251 256225090 /nfs/dbraw/zinc/22/50/90/256225090.db2.gz KGTDKPOXAMVIKL-UHFFFAOYSA-N 1 1 349.431 2.314 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(Br)cc([N+](=O)[O-])c1 ZINC000119050507 221232183 /nfs/dbraw/zinc/23/21/83/221232183.db2.gz KFGCKZSJYUQPCD-NSHDSACASA-N 1 1 342.193 2.181 10 5 EEBEMO C[C@@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000273030829 256258760 /nfs/dbraw/zinc/25/87/60/256258760.db2.gz UYJRRWULNOZOOR-VXGBXAGGSA-N 1 1 347.419 2.154 10 5 EEBEMO Cn1cc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000173313176 152158937 /nfs/dbraw/zinc/15/89/37/152158937.db2.gz RAGMKLYQAPNZHK-MRXNPFEDSA-N 1 1 343.387 2.494 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000110086002 159356865 /nfs/dbraw/zinc/35/68/65/159356865.db2.gz KEYRSFCUBXHKGW-CYBMUJFWSA-N 1 1 336.392 2.136 10 5 EEBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]ncc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000119310718 159376555 /nfs/dbraw/zinc/37/65/55/159376555.db2.gz VFDRWSLZKRNIRW-IINYFYTJSA-N 1 1 349.416 2.192 10 5 EEBEMO C[N@@H+]1CCC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000119310718 159376558 /nfs/dbraw/zinc/37/65/58/159376558.db2.gz VFDRWSLZKRNIRW-IINYFYTJSA-N 1 1 349.416 2.192 10 5 EEBEMO C[N@H+]1CCC[C@@H](CNC(=O)c2n[nH]cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000119310718 159376562 /nfs/dbraw/zinc/37/65/62/159376562.db2.gz VFDRWSLZKRNIRW-IINYFYTJSA-N 1 1 349.416 2.192 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]2C1 ZINC000246469942 160280955 /nfs/dbraw/zinc/28/09/55/160280955.db2.gz JKGOZPUPBPVLCP-PVAVHDDUSA-N 1 1 336.388 2.242 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)[C@H]2C1 ZINC000246469942 160280957 /nfs/dbraw/zinc/28/09/57/160280957.db2.gz JKGOZPUPBPVLCP-PVAVHDDUSA-N 1 1 336.388 2.242 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000246916328 160301096 /nfs/dbraw/zinc/30/10/96/160301096.db2.gz ISBLTMBQNZZLBJ-KBPBESRZSA-N 1 1 332.404 2.092 10 5 EEBEMO CCNC(=O)C[C@H]1CCCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000342052865 161035561 /nfs/dbraw/zinc/03/55/61/161035561.db2.gz VWSUHUYNQWJUCX-GFCCVEGCSA-N 1 1 345.403 2.352 10 5 EEBEMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000342052865 161035562 /nfs/dbraw/zinc/03/55/62/161035562.db2.gz VWSUHUYNQWJUCX-GFCCVEGCSA-N 1 1 345.403 2.352 10 5 EEBEMO C[C@H]([NH2+]CC(=O)NCC(=O)c1cccs1)c1ccccc1[N+](=O)[O-] ZINC000342297346 161054353 /nfs/dbraw/zinc/05/43/53/161054353.db2.gz TUDALJKCANDTSD-NSHDSACASA-N 1 1 347.396 2.306 10 5 EEBEMO Cc1[nH+]ccn1CCNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359043972 164045089 /nfs/dbraw/zinc/04/50/89/164045089.db2.gz RWPHWPLYJIJRIW-UHFFFAOYSA-N 1 1 340.286 2.131 10 5 EEBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000369378763 166248446 /nfs/dbraw/zinc/24/84/46/166248446.db2.gz UVZZLKPRLPXDIV-ABUXHAGHSA-N 1 1 333.388 2.015 10 5 EEBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O ZINC000369378763 166248447 /nfs/dbraw/zinc/24/84/47/166248447.db2.gz UVZZLKPRLPXDIV-ABUXHAGHSA-N 1 1 333.388 2.015 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123163288 222227546 /nfs/dbraw/zinc/22/75/46/222227546.db2.gz SPZZYOWRJROEQC-ZYHUDNBSSA-N 1 1 336.348 2.058 10 5 EEBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2N(C)C)CC[N@H+]1C ZINC000123362345 222264063 /nfs/dbraw/zinc/26/40/63/222264063.db2.gz BUCSMBBKBNYHIZ-STQMWFEESA-N 1 1 334.420 2.216 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@H](c2nc(=O)[nH][nH]2)C1 ZINC000289585971 275130069 /nfs/dbraw/zinc/13/00/69/275130069.db2.gz ZGSBWUSTWGUSKD-RYUDHWBXSA-N 1 1 331.376 2.255 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc(OC)ccc1[N+](=O)[O-] ZINC000246619050 281198295 /nfs/dbraw/zinc/19/82/95/281198295.db2.gz SQCAYJUGXOQSLR-STQMWFEESA-N 1 1 333.388 2.302 10 5 EEBEMO COc1ccc(OCCN(C)[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000441380301 315183522 /nfs/dbraw/zinc/18/35/22/315183522.db2.gz FREJESIIDPDOSP-AWEZNQCLSA-N 1 1 335.404 2.151 10 5 EEBEMO COc1ccc(OCC[N@H+](C)[C@H]2CCN(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000441380301 315183524 /nfs/dbraw/zinc/18/35/24/315183524.db2.gz FREJESIIDPDOSP-AWEZNQCLSA-N 1 1 335.404 2.151 10 5 EEBEMO COc1ccc(OCC[N@@H+](C)[C@H]2CCN(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000441380301 315183526 /nfs/dbraw/zinc/18/35/26/315183526.db2.gz FREJESIIDPDOSP-AWEZNQCLSA-N 1 1 335.404 2.151 10 5 EEBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000131414288 462809075 /nfs/dbraw/zinc/80/90/75/462809075.db2.gz AXIGEHUKZAZTMD-SUMWQHHRSA-N 1 1 346.431 2.070 10 5 EEBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000131414288 462809078 /nfs/dbraw/zinc/80/90/78/462809078.db2.gz AXIGEHUKZAZTMD-SUMWQHHRSA-N 1 1 346.431 2.070 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000069529150 463269246 /nfs/dbraw/zinc/26/92/46/463269246.db2.gz MZVLKCNDQJBSJJ-GFCCVEGCSA-N 1 1 341.795 2.089 10 5 EEBEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000284977436 464413922 /nfs/dbraw/zinc/41/39/22/464413922.db2.gz XWERRNBWBGCBJU-HOCLYGCPSA-N 1 1 335.404 2.009 10 5 EEBEMO C[N@@H+](CCO)C1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000264926855 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347.415 2.276 10 5 EEBEMO C[C@@H]1CC(C)(C)C[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000412047158 466980817 /nfs/dbraw/zinc/98/08/17/466980817.db2.gz SAUSTQCHPIPQOL-SNVBAGLBSA-N 1 1 335.360 2.382 10 5 EEBEMO C[C@@H]1CC(C)(C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000412047158 466980818 /nfs/dbraw/zinc/98/08/18/466980818.db2.gz SAUSTQCHPIPQOL-SNVBAGLBSA-N 1 1 335.360 2.382 10 5 EEBEMO C[C@H]1CC(C)(C)C[N@@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000412047157 466981169 /nfs/dbraw/zinc/98/11/69/466981169.db2.gz SAUSTQCHPIPQOL-JTQLQIEISA-N 1 1 335.360 2.382 10 5 EEBEMO C[C@H]1CC(C)(C)C[N@H+]1CC(=O)Nc1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000412047157 466981175 /nfs/dbraw/zinc/98/11/75/466981175.db2.gz SAUSTQCHPIPQOL-JTQLQIEISA-N 1 1 335.360 2.382 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000450955064 467214896 /nfs/dbraw/zinc/21/48/96/467214896.db2.gz PBSPOKAFLAXAJX-LBPRGKRZSA-N 1 1 348.428 2.221 10 5 EEBEMO O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000408021563 467496595 /nfs/dbraw/zinc/49/65/95/467496595.db2.gz IORXXWGBWGUZPS-CYBMUJFWSA-N 1 1 328.372 2.386 10 5 EEBEMO CCOc1cc(C[N@@H+]2CCSC[C@@H]2CCO)ccc1[N+](=O)[O-] ZINC000492786596 467751361 /nfs/dbraw/zinc/75/13/61/467751361.db2.gz BAKGLLKTVMJVLO-ZDUSSCGKSA-N 1 1 326.418 2.293 10 5 EEBEMO CCOc1cc(C[N@H+]2CCSC[C@@H]2CCO)ccc1[N+](=O)[O-] ZINC000492786596 467751366 /nfs/dbraw/zinc/75/13/66/467751366.db2.gz BAKGLLKTVMJVLO-ZDUSSCGKSA-N 1 1 326.418 2.293 10 5 EEBEMO COc1cc(NC[C@@H]2CCC[N@H+]2CCCO)c([N+](=O)[O-])cc1F ZINC000450593932 467876379 /nfs/dbraw/zinc/87/63/79/467876379.db2.gz JPXKXWWALIZEPS-NSHDSACASA-N 1 1 327.356 2.001 10 5 EEBEMO CC[N@@H+](C)Cc1cccc(CNC(=O)c2ccc([N+](=O)[O-])cn2)c1 ZINC000532408039 468117397 /nfs/dbraw/zinc/11/73/97/468117397.db2.gz UUEGVQJNWGTQBL-UHFFFAOYSA-N 1 1 328.372 2.372 10 5 EEBEMO COc1ccc(C[N@@H+]2CC[C@@H](Nc3ncccn3)C2)cc1[N+](=O)[O-] ZINC000567906072 468235902 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C[C@H](C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000597584035 468607927 /nfs/dbraw/zinc/60/79/27/468607927.db2.gz XBAHWELHMDGWNJ-APHBMKBZSA-N 1 1 335.379 2.343 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H](O)[C@@H]2CCc2ccccc2)c1 ZINC000592166861 468644952 /nfs/dbraw/zinc/64/49/52/468644952.db2.gz JZVNQFNNMKOEMK-ZWKOTPCHSA-N 1 1 344.415 2.249 10 5 EEBEMO O=C(NCC[NH+]1CCSCC1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601157904 468764640 /nfs/dbraw/zinc/76/46/40/468764640.db2.gz ILXULKYIKQMFPY-UHFFFAOYSA-N 1 1 349.456 2.182 10 5 EEBEMO COc1cc(CSC[C@H]2C[N@H+](C)CCO2)c([N+](=O)[O-])cc1F ZINC000571325546 468772385 /nfs/dbraw/zinc/77/23/85/468772385.db2.gz SUXSTVXNUSLHTO-LLVKDONJSA-N 1 1 330.381 2.306 10 5 EEBEMO COc1cc(CSC[C@H]2C[N@@H+](C)CCO2)c([N+](=O)[O-])cc1F ZINC000571325546 468772390 /nfs/dbraw/zinc/77/23/90/468772390.db2.gz SUXSTVXNUSLHTO-LLVKDONJSA-N 1 1 330.381 2.306 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000598465089 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ZINC001265155123 1322953244 /nfs/dbraw/zinc/95/32/44/1322953244.db2.gz OTIRCVWTLAHTRC-UHFFFAOYSA-N 1 1 343.387 2.102 10 5 EEBEMO Cc1cc(NC(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)cc(C)[nH+]1 ZINC001320951171 1332985401 /nfs/dbraw/zinc/98/54/01/1332985401.db2.gz JXWCDFVOWQIGCE-UHFFFAOYSA-N 1 1 342.355 2.324 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cnn(C)c2C)c1 ZINC001326387975 1334081700 /nfs/dbraw/zinc/08/17/00/1334081700.db2.gz NKACAMNODBUQHF-SNVBAGLBSA-N 1 1 332.360 2.274 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)c(F)c1 ZINC001620641578 1352361305 /nfs/dbraw/zinc/36/13/05/1352361305.db2.gz RFKMJJHTXQAOKX-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)c(F)c1 ZINC001620641578 1352361307 /nfs/dbraw/zinc/36/13/07/1352361307.db2.gz RFKMJJHTXQAOKX-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO C[C@@H](CNC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1ccccc1[N+](=O)[O-] ZINC001685531371 1358334428 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O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@H](c3nnc[nH]3)C2)c1 ZINC000425348936 241134412 /nfs/dbraw/zinc/13/44/12/241134412.db2.gz CWBBIWUMMLSVFV-VIFPVBQESA-N 1 1 339.302 2.304 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000371829607 285221325 /nfs/dbraw/zinc/22/13/25/285221325.db2.gz UURBTBJPOQCELD-INIZCTEOSA-N 1 1 335.404 2.038 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCO[C@H](C2CCCCC2)C1 ZINC000371829607 285221332 /nfs/dbraw/zinc/22/13/32/285221332.db2.gz UURBTBJPOQCELD-INIZCTEOSA-N 1 1 335.404 2.038 10 5 EEBEMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@H]2C1 ZINC000195070815 160206329 /nfs/dbraw/zinc/20/63/29/160206329.db2.gz PUDKPJIDVLXFEZ-AWEZNQCLSA-N 1 1 332.404 2.094 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC[C@@H](CNc3ccccn3)C2)c1 ZINC000246306935 160273222 /nfs/dbraw/zinc/27/32/22/160273222.db2.gz QIJBHLGBRZQLNE-WMLDXEAASA-N 1 1 342.399 2.457 10 5 EEBEMO O=C(CCN1CC[N@H+]2CCCC[C@H]2C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000248372205 160342449 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COc1ccc(CN2CCC([N@H+]3CCO[C@@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000079489381 217232542 /nfs/dbraw/zinc/23/25/42/217232542.db2.gz NWHGMTKWTPEGMM-AWEZNQCLSA-N 1 1 349.431 2.289 10 5 EEBEMO C[C@@H](c1ccccc1F)[NH+]1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000095405867 218341275 /nfs/dbraw/zinc/34/12/75/218341275.db2.gz WHSITFINWUYDSH-AWEZNQCLSA-N 1 1 347.394 2.309 10 5 EEBEMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c(F)c1 ZINC000451310676 285093207 /nfs/dbraw/zinc/09/32/07/285093207.db2.gz YFGKOBTZQJKXAU-KANYHAFZSA-N 1 1 342.342 2.235 10 5 EEBEMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](O)C[C@@H]2[C@H]2CCCOC2)c(F)c1 ZINC000451310676 285093208 /nfs/dbraw/zinc/09/32/08/285093208.db2.gz YFGKOBTZQJKXAU-KANYHAFZSA-N 1 1 342.342 2.235 10 5 EEBEMO C[C@@H](O)C[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000153801514 224160114 /nfs/dbraw/zinc/16/01/14/224160114.db2.gz LVPIWQNQJWGPLG-VXGBXAGGSA-N 1 1 327.812 2.135 10 5 EEBEMO C[C@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)[C@@H]1CCC[N@H+](C2CCC2)C1 ZINC000273030825 256258945 /nfs/dbraw/zinc/25/89/45/256258945.db2.gz UYJRRWULNOZOOR-NWDGAFQWSA-N 1 1 347.419 2.154 10 5 EEBEMO Cn1cc([C@@H]2CC[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000116316943 152048262 /nfs/dbraw/zinc/04/82/62/152048262.db2.gz LOQOSRZAFUEGBE-CYBMUJFWSA-N 1 1 343.387 2.146 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000248820847 160362544 /nfs/dbraw/zinc/36/25/44/160362544.db2.gz JFSWWYNBJYQEHU-XEZPLFJOSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000248820847 160362545 /nfs/dbraw/zinc/36/25/45/160362545.db2.gz JFSWWYNBJYQEHU-XEZPLFJOSA-N 1 1 334.372 2.247 10 5 EEBEMO C[C@H](c1cccc(F)c1)[NH+]1CCN(CCn2cc([N+](=O)[O-])cn2)CC1 ZINC000091689233 159206831 /nfs/dbraw/zinc/20/68/31/159206831.db2.gz HOLNBFMACIWNLC-CQSZACIVSA-N 1 1 347.394 2.309 10 5 EEBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@]2(C1)CCCOC2 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Cn1cc([C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000590603077 468284407 /nfs/dbraw/zinc/28/44/07/468284407.db2.gz OFZXCFUXMPWYPT-MRXNPFEDSA-N 1 1 330.388 2.322 10 5 EEBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000097049455 463311991 /nfs/dbraw/zinc/31/19/91/463311991.db2.gz VSXCELOFDHRKEN-UWVGGRQHSA-N 1 1 343.330 2.361 10 5 EEBEMO CC(C)[N@@H+]1Cc2cccc(NC(=O)c3c([N+](=O)[O-])cnn3C)c2C1 ZINC000097108177 463327134 /nfs/dbraw/zinc/32/71/34/463327134.db2.gz FWGAMXLJSQTYGN-UHFFFAOYSA-N 1 1 329.360 2.305 10 5 EEBEMO CC(C)[N@H+]1Cc2cccc(NC(=O)c3c([N+](=O)[O-])cnn3C)c2C1 ZINC000097108177 463327140 /nfs/dbraw/zinc/32/71/40/463327140.db2.gz FWGAMXLJSQTYGN-UHFFFAOYSA-N 1 1 329.360 2.305 10 5 EEBEMO CCn1cnnc1[C@H]1CCC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000161263579 463414800 /nfs/dbraw/zinc/41/48/00/463414800.db2.gz LOMWULBXJMNRGP-AWEZNQCLSA-N 1 1 345.403 2.465 10 5 EEBEMO COc1ccc(CN(C)C(=O)[C@H]2C[C@@H]3CCCC[N@H+]3C2)cc1[N+](=O)[O-] ZINC000081651752 463477639 /nfs/dbraw/zinc/47/76/39/463477639.db2.gz MDOGBMTURNYCAE-GJZGRUSLSA-N 1 1 347.415 2.436 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000222332934 464129447 /nfs/dbraw/zinc/12/94/47/464129447.db2.gz MCKKHZISIGPUOQ-JQWIXIFHSA-N 1 1 347.462 2.007 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000173922026 464331971 /nfs/dbraw/zinc/33/19/71/464331971.db2.gz BBLNZOSFHKYUSK-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CC[C@@H](N2CCOCC2)C1 ZINC000173922026 464331978 /nfs/dbraw/zinc/33/19/78/464331978.db2.gz BBLNZOSFHKYUSK-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2c(N)cccc2[N+](=O)[O-])C1 ZINC000180759064 464387383 /nfs/dbraw/zinc/38/73/83/464387383.db2.gz RDMOZPCILANWHQ-LBPRGKRZSA-N 1 1 343.387 2.413 10 5 EEBEMO C[C@H]1C[C@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000272220846 464523881 /nfs/dbraw/zinc/52/38/81/464523881.db2.gz KNJGYRTWIMKSLS-GXSJLCMTSA-N 1 1 349.416 2.154 10 5 EEBEMO C[C@@H]1CC[C@@](CO)([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000281998712 464662781 /nfs/dbraw/zinc/66/27/81/464662781.db2.gz IQWDQJJUPZOIPG-CXAGYDPISA-N 1 1 335.404 2.406 10 5 EEBEMO CC(C)[NH+]1CCN(CCCN2CCc3c(cccc3[N+](=O)[O-])C2)CC1 ZINC000554550757 468419471 /nfs/dbraw/zinc/41/94/71/468419471.db2.gz NYOAWSZLJZMPKW-UHFFFAOYSA-N 1 1 346.475 2.369 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCCC[C@H]1c1cn[nH]c1 ZINC000248467831 464756587 /nfs/dbraw/zinc/75/65/87/464756587.db2.gz SYXOXBNYQWWBGY-GJZGRUSLSA-N 1 1 346.387 2.285 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000177032198 464911338 /nfs/dbraw/zinc/91/13/38/464911338.db2.gz PQTZFKOYGIVQDR-LBPRGKRZSA-N 1 1 339.367 2.055 10 5 EEBEMO Cn1c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000340375532 466039539 /nfs/dbraw/zinc/03/95/39/466039539.db2.gz RNHRRXCATXPRNY-XJKSGUPXSA-N 1 1 328.372 2.109 10 5 EEBEMO O=[N+]([O-])c1cnc2ccc(N3CC[NH+](Cc4cccs4)CC3)nn21 ZINC000301935298 466064013 /nfs/dbraw/zinc/06/40/13/466064013.db2.gz QVKNFXBKTTXEEL-UHFFFAOYSA-N 1 1 344.400 2.021 10 5 EEBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCN(c2nccnn2)CC1 ZINC000600185250 468488384 /nfs/dbraw/zinc/48/83/84/468488384.db2.gz SHJGHIUTAGZUPS-KAMYIIQDSA-N 1 1 340.387 2.005 10 5 EEBEMO C[N@H+]1CCC[C@@H](CCNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000458199944 467788159 /nfs/dbraw/zinc/78/81/59/467788159.db2.gz FLQAPEMNGNGPBF-NSHDSACASA-N 1 1 341.358 2.264 10 5 EEBEMO CCC(=O)c1ccc(NC[C@H]2CCCC[N@H+]2CCO)c([N+](=O)[O-])c1 ZINC000450610774 467879327 /nfs/dbraw/zinc/87/93/27/467879327.db2.gz HGCKXHFDKZJVRK-CQSZACIVSA-N 1 1 335.404 2.446 10 5 EEBEMO CC(C)C[N@H+]1CCO[C@@H](CNc2c3ccccc3ncc2[N+](=O)[O-])C1 ZINC000487945307 468061838 /nfs/dbraw/zinc/06/18/38/468061838.db2.gz UXZJRXFCNORTOQ-AWEZNQCLSA-N 1 1 344.415 2.334 10 5 EEBEMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2ccccc2C1 ZINC000531626746 468066348 /nfs/dbraw/zinc/06/63/48/468066348.db2.gz GASANQGNNLRQNE-CYBMUJFWSA-N 1 1 340.383 2.166 10 5 EEBEMO O=C(c1c[nH]c2cccc([N+](=O)[O-])c12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597576003 468605619 /nfs/dbraw/zinc/60/56/19/468605619.db2.gz BMDYKXBKSOOQJH-OCCSQVGLSA-N 1 1 346.362 2.334 10 5 EEBEMO C[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594592605 468630183 /nfs/dbraw/zinc/63/01/83/468630183.db2.gz SVSVQMHJGVTBLX-MCIONIFRSA-N 1 1 344.415 3.053 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H](O)[C@H]2CCc2ccccc2)c1 ZINC000592166857 468645084 /nfs/dbraw/zinc/64/50/84/468645084.db2.gz JZVNQFNNMKOEMK-MSOLQXFVSA-N 1 1 344.415 2.249 10 5 EEBEMO Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000594793895 468688208 /nfs/dbraw/zinc/68/82/08/468688208.db2.gz VYLJGORXSRFUEC-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1ccc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000594793895 468688212 /nfs/dbraw/zinc/68/82/12/468688212.db2.gz VYLJGORXSRFUEC-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)CCNc1ccccc1[N+](=O)[O-] ZINC000597859261 468696461 /nfs/dbraw/zinc/69/64/61/468696461.db2.gz SLAPKBCPDMTYDQ-CYBMUJFWSA-N 1 1 334.420 2.386 10 5 EEBEMO O=[N+]([O-])c1cccc(CNCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c1 ZINC000594973042 468734765 /nfs/dbraw/zinc/73/47/65/468734765.db2.gz BYDNQUGJOIMVOD-IBGZPJMESA-N 1 1 341.411 2.451 10 5 EEBEMO O=[N+]([O-])c1cccc(CNCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)c1 ZINC000594973042 468734770 /nfs/dbraw/zinc/73/47/70/468734770.db2.gz BYDNQUGJOIMVOD-IBGZPJMESA-N 1 1 341.411 2.451 10 5 EEBEMO CC[N@@H+](C)C[C@@H]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601126092 468752475 /nfs/dbraw/zinc/75/24/75/468752475.db2.gz YKQYKEYKPRMYON-VIFPVBQESA-N 1 1 335.330 2.125 10 5 EEBEMO O=[N+]([O-])c1cc(F)cnc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000601194239 468777854 /nfs/dbraw/zinc/77/78/54/468777854.db2.gz VYRWYVPLFSOTHH-HNNXBMFYSA-N 1 1 346.362 2.308 10 5 EEBEMO O=[N+]([O-])c1cccc(N2CC[NH+](CCO[C@@H]3CC3(F)F)CC2)c1 ZINC000595290480 468801253 /nfs/dbraw/zinc/80/12/53/468801253.db2.gz KGSHHULUSMFVTB-CQSZACIVSA-N 1 1 327.331 2.141 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])cc1F)N1CC[NH2+]C[C@H]1c1cccnc1 ZINC000598917048 469048183 /nfs/dbraw/zinc/04/81/83/469048183.db2.gz RUXSPQWIQXWKOI-HNNXBMFYSA-N 1 1 345.334 2.307 10 5 EEBEMO COc1cc(C[NH+]2CCC(C3(O)CC3)CC2)c([N+](=O)[O-])cc1OC ZINC000593647619 469077945 /nfs/dbraw/zinc/07/79/45/469077945.db2.gz DHPOBQHRWVXEJM-UHFFFAOYSA-N 1 1 336.388 2.349 10 5 EEBEMO COc1ccc(OCC[N@@H+]2CCO[C@H](C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000601978195 469124838 /nfs/dbraw/zinc/12/48/38/469124838.db2.gz VQLMEWNLRTVJBM-AWEZNQCLSA-N 1 1 346.330 2.338 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCO[C@H](C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000601978195 469124844 /nfs/dbraw/zinc/12/48/44/469124844.db2.gz VQLMEWNLRTVJBM-AWEZNQCLSA-N 1 1 346.330 2.338 10 5 EEBEMO CC1([NH+]2CCOCC2)CCN(CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599618559 469312236 /nfs/dbraw/zinc/31/22/36/469312236.db2.gz PUZTUWMCSRDIEF-UHFFFAOYSA-N 1 1 349.431 2.160 10 5 EEBEMO COC(=O)CC[N@@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000609634461 469952042 /nfs/dbraw/zinc/95/20/42/469952042.db2.gz JFCASANSXNTROX-LBPRGKRZSA-N 1 1 328.390 2.200 10 5 EEBEMO COC(=O)CC[N@H+](Cc1csc([N+](=O)[O-])c1)C[C@@H]1CCCO1 ZINC000609634461 469952044 /nfs/dbraw/zinc/95/20/44/469952044.db2.gz JFCASANSXNTROX-LBPRGKRZSA-N 1 1 328.390 2.200 10 5 EEBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158414550 529088493 /nfs/dbraw/zinc/08/84/93/529088493.db2.gz FMGGOWXEOAAILJ-CJNGLKHVSA-N 1 1 334.420 2.165 10 5 EEBEMO CC[C@H]1CN(c2ccc([N+](=O)[O-])cc2COC)CC[N@H+]1C[C@@H](C)O ZINC000175099373 529301698 /nfs/dbraw/zinc/30/16/98/529301698.db2.gz PCXROMWRXLVZOD-HIFRSBDPSA-N 1 1 337.420 2.023 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2ncn(C[N@H+]3CCC[C@H]4COCC[C@@H]43)n2)cc1 ZINC000756887984 577852407 /nfs/dbraw/zinc/85/24/07/577852407.db2.gz NCGOQRBJNCEHKL-HOCLYGCPSA-N 1 1 343.387 2.312 10 5 EEBEMO COc1cccc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001267227350 1178545696 /nfs/dbraw/zinc/54/56/96/1178545696.db2.gz MOFVVLBAKDKMAW-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO COc1cccc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC001267227350 1178545703 /nfs/dbraw/zinc/54/57/03/1178545703.db2.gz MOFVVLBAKDKMAW-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO Cc1cc(C[N@@H+](CCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001493370778 1181388521 /nfs/dbraw/zinc/38/85/21/1181388521.db2.gz OIFMYWUBPIXHAY-HUUCEWRRSA-N 1 1 337.445 2.111 10 5 EEBEMO Cc1cc(C[N@H+](CCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001493370778 1181388526 /nfs/dbraw/zinc/38/85/26/1181388526.db2.gz OIFMYWUBPIXHAY-HUUCEWRRSA-N 1 1 337.445 2.111 10 5 EEBEMO Cc1cc(C[N@@H+](CCNC(=O)[C@@H]2CC2[N+](=O)[O-])C2CC2)c(C)s1 ZINC001493370778 1181388532 /nfs/dbraw/zinc/38/85/32/1181388532.db2.gz OIFMYWUBPIXHAY-HUUCEWRRSA-N 1 1 337.445 2.111 10 5 EEBEMO Cc1sc(C(=O)N2CC[NH2+][C@@H](c3ccc(O)cc3)C2)cc1[N+](=O)[O-] ZINC000870080875 1200448617 /nfs/dbraw/zinc/44/86/17/1200448617.db2.gz OZXPXJQLOGZSDB-CYBMUJFWSA-N 1 1 347.396 2.457 10 5 EEBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850044 1200957048 /nfs/dbraw/zinc/95/70/48/1200957048.db2.gz SYJAXQMGTDANKY-KSSFIOAISA-N 1 1 345.399 2.201 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c1 ZINC000928096005 1206341609 /nfs/dbraw/zinc/34/16/09/1206341609.db2.gz QKHYGXTVAMIAJK-ZFWWWQNUSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c1 ZINC000928096005 1206341610 /nfs/dbraw/zinc/34/16/10/1206341610.db2.gz QKHYGXTVAMIAJK-ZFWWWQNUSA-N 1 1 335.429 2.213 10 5 EEBEMO O=C(N[C@H]1CCC[N@@H+]2CCSC[C@@H]12)c1cc(F)cc([N+](=O)[O-])c1 ZINC000928096914 1206342247 /nfs/dbraw/zinc/34/22/47/1206342247.db2.gz SXQMXOZKPHPQIG-KBPBESRZSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cc(F)cc([N+](=O)[O-])c1 ZINC000928096914 1206342248 /nfs/dbraw/zinc/34/22/48/1206342248.db2.gz SXQMXOZKPHPQIG-KBPBESRZSA-N 1 1 339.392 2.044 10 5 EEBEMO Cc1c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000928102434 1206344707 /nfs/dbraw/zinc/34/47/07/1206344707.db2.gz MJKLSNIDIDSPGF-ZFWWWQNUSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000928102434 1206344708 /nfs/dbraw/zinc/34/47/08/1206344708.db2.gz MJKLSNIDIDSPGF-ZFWWWQNUSA-N 1 1 335.429 2.213 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(Cc3c(Br)cccc3[N+](=O)[O-])[C@H]2C1 ZINC000930544283 1206566116 /nfs/dbraw/zinc/56/61/16/1206566116.db2.gz MLNSGZSMULKPBG-YGRLFVJLSA-N 1 1 340.221 2.493 10 5 EEBEMO CC(C)(COC(=O)c1cnn(-c2cc[nH+]cc2)c1C(F)F)[N+](=O)[O-] ZINC000851128243 1277484441 /nfs/dbraw/zinc/48/44/41/1277484441.db2.gz OCAQBHDHDXEGRV-UHFFFAOYSA-N 1 1 340.286 2.417 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)OC[C@H]2CC[N@@H+]2Cc2ccccc2)n1 ZINC000851469011 1277618969 /nfs/dbraw/zinc/61/89/69/1277618969.db2.gz QNSWSAVBVHQRBQ-CQSZACIVSA-N 1 1 344.371 2.243 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)OC[C@H]2CC[N@H+]2Cc2ccccc2)n1 ZINC000851469011 1277618978 /nfs/dbraw/zinc/61/89/78/1277618978.db2.gz QNSWSAVBVHQRBQ-CQSZACIVSA-N 1 1 344.371 2.243 10 5 EEBEMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC001192747681 1282139431 /nfs/dbraw/zinc/13/94/31/1282139431.db2.gz WSKNTHDDFLUJHV-LBPRGKRZSA-N 1 1 328.376 2.365 10 5 EEBEMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC001192747681 1282139439 /nfs/dbraw/zinc/13/94/39/1282139439.db2.gz WSKNTHDDFLUJHV-LBPRGKRZSA-N 1 1 328.376 2.365 10 5 EEBEMO Nc1ccc(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000853794191 1292456082 /nfs/dbraw/zinc/45/60/82/1292456082.db2.gz FSMSUBMGWBYGAW-MRXNPFEDSA-N 1 1 342.399 2.356 10 5 EEBEMO CCCC[N@@H+](C)CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863503128 1296311813 /nfs/dbraw/zinc/31/18/13/1296311813.db2.gz BZPSCEBBXYXOQN-KRWDZBQOSA-N 1 1 348.403 2.094 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@H]23)c1 ZINC001124025427 1310808231 /nfs/dbraw/zinc/80/82/31/1310808231.db2.gz MWFZVHHLMKKPRZ-QLFBSQMISA-N 1 1 347.415 2.129 10 5 EEBEMO O=C(NCC1([NH2+]Cc2cccc(Cl)c2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480486 1324247788 /nfs/dbraw/zinc/24/77/88/1324247788.db2.gz PTYGRTZKKADOJD-ZIAGYGMSSA-N 1 1 337.807 2.134 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)Cc1cnoc1 ZINC001280849287 1324571659 /nfs/dbraw/zinc/57/16/59/1324571659.db2.gz BMFWZLHKZPPXEG-UHFFFAOYSA-N 1 1 346.387 2.106 10 5 EEBEMO C[N@H+](CCNC(=O)CCc1ccncc1)Cc1ccccc1[N+](=O)[O-] ZINC001492316804 1331153162 /nfs/dbraw/zinc/15/31/62/1331153162.db2.gz RJVLIDPOTBKUKC-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1ccncc1)Cc1ccccc1[N+](=O)[O-] ZINC001492316804 1331153164 /nfs/dbraw/zinc/15/31/64/1331153164.db2.gz RJVLIDPOTBKUKC-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)n1 ZINC001303540244 1331358246 /nfs/dbraw/zinc/35/82/46/1331358246.db2.gz NMCMFTXCYWKQNE-CYBMUJFWSA-N 1 1 332.404 2.387 10 5 EEBEMO CC[N@H+](CCNC(=O)c1nc(C)oc1C)Cc1ccccc1[N+](=O)[O-] ZINC001317487697 1331677254 /nfs/dbraw/zinc/67/72/54/1331677254.db2.gz COUKGOOTGHYVHR-UHFFFAOYSA-N 1 1 346.387 2.452 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1nc(C)oc1C)Cc1ccccc1[N+](=O)[O-] ZINC001317487697 1331677255 /nfs/dbraw/zinc/67/72/55/1331677255.db2.gz COUKGOOTGHYVHR-UHFFFAOYSA-N 1 1 346.387 2.452 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cnsn1)Cc1ccccc1[N+](=O)[O-] ZINC001316886022 1331952119 /nfs/dbraw/zinc/95/21/19/1331952119.db2.gz QQECFWMVGKKPRR-UHFFFAOYSA-N 1 1 349.416 2.088 10 5 EEBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1cccnc1 ZINC001323370455 1333451221 /nfs/dbraw/zinc/45/12/21/1333451221.db2.gz JRHDAWZQHLNDCK-UHFFFAOYSA-N 1 1 332.385 2.104 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(C(=O)CCOc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001300085945 1338036002 /nfs/dbraw/zinc/03/60/02/1338036002.db2.gz LWCDVCGRLSWHTJ-OKILXGFUSA-N 1 1 335.404 2.305 10 5 EEBEMO COc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccnn2C)c([N+](=O)[O-])c1 ZINC001620516467 1352359910 /nfs/dbraw/zinc/35/99/10/1352359910.db2.gz OYGBADPDPJUZHU-WDEREUQCSA-N 1 1 347.375 2.015 10 5 EEBEMO CC[C@@]1(O)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560059992 1342506258 /nfs/dbraw/zinc/50/62/58/1342506258.db2.gz CDRSPVJBNCYHCQ-MRXNPFEDSA-N 1 1 332.360 2.382 10 5 EEBEMO CC[C@@]1(O)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001560059992 1342506261 /nfs/dbraw/zinc/50/62/61/1342506261.db2.gz CDRSPVJBNCYHCQ-MRXNPFEDSA-N 1 1 332.360 2.382 10 5 EEBEMO CN(CCNCc1ccccc1[N+](=O)[O-])C(=O)C(C)(C)[NH+]1CCCC1 ZINC001567542514 1342782998 /nfs/dbraw/zinc/78/29/98/1342782998.db2.gz ZWVTZEUJSGPQOJ-UHFFFAOYSA-N 1 1 348.447 2.017 10 5 EEBEMO O=C(CC[N@H+]1CC[C@@H](c2cnccn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC001620617848 1344554684 /nfs/dbraw/zinc/55/46/84/1344554684.db2.gz QWZGBZDFRAQHKX-CYBMUJFWSA-N 1 1 341.371 2.203 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC([N@@H+](C)Cc3ccccc3)C2)n1 ZINC001635208091 1352641803 /nfs/dbraw/zinc/64/18/03/1352641803.db2.gz KVACRMWMXNZHRJ-UHFFFAOYSA-N 1 1 340.383 2.255 10 5 EEBEMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001643886119 1352755190 /nfs/dbraw/zinc/75/51/90/1352755190.db2.gz QCZSSIAERIOWGX-BZNIZROVSA-N 1 1 332.360 2.095 10 5 EEBEMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@]1(C)CO ZINC001643886119 1352755192 /nfs/dbraw/zinc/75/51/92/1352755192.db2.gz QCZSSIAERIOWGX-BZNIZROVSA-N 1 1 332.360 2.095 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1C[C@H]2[C@H](C[C@@H]2c2ccccc2)C1 ZINC001655315240 1354170384 /nfs/dbraw/zinc/17/03/84/1354170384.db2.gz YCWNLAJQYZHDLW-NXHRZFHOSA-N 1 1 339.395 2.492 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])CC2 ZINC001655527181 1354176588 /nfs/dbraw/zinc/17/65/88/1354176588.db2.gz ATSQKRGEOUIRRJ-ZBFHGGJFSA-N 1 1 349.343 2.421 10 5 EEBEMO COc1ccc(OCC[N@@H+]2Cc3c[nH]nc3C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001655590254 1354179409 /nfs/dbraw/zinc/17/94/09/1354179409.db2.gz XPHXGWBAAYDKSQ-GFCCVEGCSA-N 1 1 346.387 2.400 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CCCC[C@]23CCCOC3)c([N+](=O)[O-])c1 ZINC001656575005 1354249350 /nfs/dbraw/zinc/24/93/50/1354249350.db2.gz YXBZJUHGLMASNP-QGZVFWFLSA-N 1 1 333.388 2.229 10 5 EEBEMO CCCSCC(=O)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001665258361 1355283105 /nfs/dbraw/zinc/28/31/05/1355283105.db2.gz QQDTVMUDWODDPW-UHFFFAOYSA-N 1 1 337.445 2.286 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)Cc1cncs1 ZINC001667585469 1355765037 /nfs/dbraw/zinc/76/50/37/1355765037.db2.gz TYAWJONJUJXGBM-UHFFFAOYSA-N 1 1 348.428 2.184 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)Cc1cncs1 ZINC001667585469 1355765043 /nfs/dbraw/zinc/76/50/43/1355765043.db2.gz TYAWJONJUJXGBM-UHFFFAOYSA-N 1 1 348.428 2.184 10 5 EEBEMO COCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(C(C)=O)CC1 ZINC001699689388 1405443384 /nfs/dbraw/zinc/44/33/84/1405443384.db2.gz QQUXMFRMLKBMKO-UHFFFAOYSA-N 1 1 335.404 2.054 10 5 EEBEMO O=C(NCC[NH+]1CC=CC1)c1ccnc(-c2ccccc2)c1[N+](=O)[O-] ZINC001136909573 788262132 /nfs/dbraw/zinc/26/21/32/788262132.db2.gz VOJJMQWPBGFQGU-UHFFFAOYSA-N 1 1 338.367 2.258 10 5 EEBEMO C[N@H+]1CCC[C@@](O)(CC(=O)N2CCCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000912653495 788283777 /nfs/dbraw/zinc/28/37/77/788283777.db2.gz RNEAWCGVDCKBGK-GOSISDBHSA-N 1 1 347.415 2.111 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@H]1C[N@H+]2CCC[C@H]2CO1 ZINC000845476627 789823788 /nfs/dbraw/zinc/82/37/88/789823788.db2.gz VTYJBKGWKIUFOB-UONOGXRCSA-N 1 1 328.372 2.418 10 5 EEBEMO C[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C[C@]12CCC[C@H]1OCC2 ZINC001176989992 798683379 /nfs/dbraw/zinc/68/33/79/798683379.db2.gz BUAXUNQZAVEEGP-NVXWUHKLSA-N 1 1 333.388 2.085 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NCCn1cc[nH+]c1CC ZINC001177513923 798997432 /nfs/dbraw/zinc/99/74/32/798997432.db2.gz ITBDBQLNVARQGU-UHFFFAOYSA-N 1 1 332.360 2.182 10 5 EEBEMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)[C@H](C)O1 ZINC000446068343 242153643 /nfs/dbraw/zinc/15/36/43/242153643.db2.gz HQOXLLGHRUZPLX-AGIUHOORSA-N 1 1 349.387 2.391 10 5 EEBEMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)[C@H](C)O1 ZINC000446068343 242153648 /nfs/dbraw/zinc/15/36/48/242153648.db2.gz HQOXLLGHRUZPLX-AGIUHOORSA-N 1 1 349.387 2.391 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451908257 243307760 /nfs/dbraw/zinc/30/77/60/243307760.db2.gz WCTPCQSQJCFHKT-KRWDZBQOSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451908257 243307767 /nfs/dbraw/zinc/30/77/67/243307767.db2.gz WCTPCQSQJCFHKT-KRWDZBQOSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451910684 243310969 /nfs/dbraw/zinc/31/09/69/243310969.db2.gz YPHFUKMEDOFMME-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451910684 243310972 /nfs/dbraw/zinc/31/09/72/243310972.db2.gz YPHFUKMEDOFMME-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO CCOc1ccc(NC(=O)C[NH2+][C@@H](C)c2cn[nH]c2)c([N+](=O)[O-])c1 ZINC000494703080 247007248 /nfs/dbraw/zinc/00/72/48/247007248.db2.gz LVPMWYYPLWXZCR-JTQLQIEISA-N 1 1 333.348 2.006 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C ZINC000091983465 218097893 /nfs/dbraw/zinc/09/78/93/218097893.db2.gz NIDPFCSSFCSQJX-DGCLKSJQSA-N 1 1 334.376 2.304 10 5 EEBEMO Nc1ccc([N+](=O)[O-])c(NC[C@H]2C[C@H](O)C[N@H+]2Cc2ccccc2)c1 ZINC000193489725 160182569 /nfs/dbraw/zinc/18/25/69/160182569.db2.gz AVOAOJMXQUAEEM-CVEARBPZSA-N 1 1 342.399 2.224 10 5 EEBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000246992585 160304469 /nfs/dbraw/zinc/30/44/69/160304469.db2.gz GONHBZZZCJMPLO-DZGCQCFKSA-N 1 1 349.435 2.035 10 5 EEBEMO CCOc1ccc(C(=O)N[C@@H]2C[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000342459029 161067020 /nfs/dbraw/zinc/06/70/20/161067020.db2.gz BWQAXYYTJQQBSN-BXUZGUMPSA-N 1 1 333.388 2.206 10 5 EEBEMO COC(=O)c1cc(C(C)(C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)no1 ZINC000352004834 162024018 /nfs/dbraw/zinc/02/40/18/162024018.db2.gz DPRASKGTOKVGLI-UHFFFAOYSA-N 1 1 349.343 2.273 10 5 EEBEMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000352022430 162032906 /nfs/dbraw/zinc/03/29/06/162032906.db2.gz OSLSGNJMIZXLAG-YGRLFVJLSA-N 1 1 335.385 2.307 10 5 EEBEMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359035084 164042619 /nfs/dbraw/zinc/04/26/19/164042619.db2.gz ASLZDSBFOQSRIQ-JTQLQIEISA-N 1 1 341.314 2.163 10 5 EEBEMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000360705181 164366603 /nfs/dbraw/zinc/36/66/03/164366603.db2.gz VMQXSXOXOXKLMN-UONOGXRCSA-N 1 1 340.351 2.276 10 5 EEBEMO CCOC(=O)C[C@@H]1C[C@@H](OC)C[N@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC000360705181 164366604 /nfs/dbraw/zinc/36/66/04/164366604.db2.gz VMQXSXOXOXKLMN-UONOGXRCSA-N 1 1 340.351 2.276 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1CCn1cc([N+](=O)[O-])cn1 ZINC000370007187 166375421 /nfs/dbraw/zinc/37/54/21/166375421.db2.gz FNBJTBCONAOHTF-MRXNPFEDSA-N 1 1 343.431 2.388 10 5 EEBEMO Cc1[nH+]ccn1-c1ccc(NC(=O)c2cc([O-])ccc2[N+](=O)[O-])cn1 ZINC000375648340 167174250 /nfs/dbraw/zinc/17/42/50/167174250.db2.gz VWFNLJRKGWSTKX-UHFFFAOYSA-N 1 1 339.311 2.442 10 5 EEBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCCN(c3ccccc3F)CC2)n1 ZINC000375803070 167200407 /nfs/dbraw/zinc/20/04/07/167200407.db2.gz AQSCIUILXNDKCF-UHFFFAOYSA-N 1 1 333.367 2.143 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc([N+](=O)[O-])cc1Br ZINC000122486901 222098195 /nfs/dbraw/zinc/09/81/95/222098195.db2.gz PUUMPWYUWFMCRH-JTQLQIEISA-N 1 1 342.193 2.181 10 5 EEBEMO Cc1cc(OCC(=O)NCC[N@@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000280613036 269378916 /nfs/dbraw/zinc/37/89/16/269378916.db2.gz SEVQWAFZNMZTDJ-CQSZACIVSA-N 1 1 335.404 2.273 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3cc4cccnc4o3)CC2)cn1 ZINC000581052369 324174142 /nfs/dbraw/zinc/17/41/42/324174142.db2.gz QKMNLHNKIWPJFD-UHFFFAOYSA-N 1 1 339.355 2.453 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1CC ZINC000116770868 462772164 /nfs/dbraw/zinc/77/21/64/462772164.db2.gz DXBOBARDBKEOFY-OAHLLOKOSA-N 1 1 335.404 2.168 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2)C[C@H]1CC ZINC000116770868 462772170 /nfs/dbraw/zinc/77/21/70/462772170.db2.gz DXBOBARDBKEOFY-OAHLLOKOSA-N 1 1 335.404 2.168 10 5 EEBEMO C[C@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[NH+]1CCC(C)CC1 ZINC000130926352 462783684 /nfs/dbraw/zinc/78/36/84/462783684.db2.gz KWPKNRWEWHOYBX-LLVKDONJSA-N 1 1 347.462 2.055 10 5 EEBEMO O=[N+]([O-])c1cnccc1NCc1cccc(C[NH+]2CCOCC2)c1 ZINC000066809598 462932123 /nfs/dbraw/zinc/93/21/23/462932123.db2.gz MJLQTQKPYCQPFW-UHFFFAOYSA-N 1 1 328.372 2.434 10 5 EEBEMO COCC[N@H+]1CCN(CCCOc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000105834094 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2.400 10 5 EEBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2o1)N1CC[NH2+]C[C@H]1C(F)F ZINC000377562190 284625473 /nfs/dbraw/zinc/62/54/73/284625473.db2.gz JPSBROKSJLXSGI-JTQLQIEISA-N 1 1 325.271 2.020 10 5 EEBEMO COCC[N@H+]1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000153803834 532967578 /nfs/dbraw/zinc/96/75/78/532967578.db2.gz DJSZMKQUPLTVAU-LBPRGKRZSA-N 1 1 327.812 2.401 10 5 EEBEMO CC[C@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000119051941 221232373 /nfs/dbraw/zinc/23/23/73/221232373.db2.gz NESJKFCUGPISTP-INIZCTEOSA-N 1 1 349.431 2.097 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000245476431 160238448 /nfs/dbraw/zinc/23/84/48/160238448.db2.gz SUHCLCIVRBHGFD-CJNGLKHVSA-N 1 1 334.420 2.338 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](C(=O)NCC3CC3)C2)ccc1[N+](=O)[O-] ZINC000351971802 162008184 /nfs/dbraw/zinc/00/81/84/162008184.db2.gz WVXKXRIQDVQHNT-OAHLLOKOSA-N 1 1 347.415 2.342 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@]2(CC[NH+](C)C2)C1 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COCCN(C)C(=O)[C@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000070037948 463370577 /nfs/dbraw/zinc/37/05/77/463370577.db2.gz QSHIWRXKHNRZRM-INIZCTEOSA-N 1 1 349.431 2.220 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@@H](Cn2cncn2)C1 ZINC000105882723 463487236 /nfs/dbraw/zinc/48/72/36/463487236.db2.gz YRQGLYJDRYEOSP-CYBMUJFWSA-N 1 1 331.376 2.107 10 5 EEBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2csc([N+](=O)[O-])c2)CC1 ZINC000178539240 463917015 /nfs/dbraw/zinc/91/70/15/463917015.db2.gz JJFAAFQGERXDGW-UHFFFAOYSA-N 1 1 334.401 2.485 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172804069 464145734 /nfs/dbraw/zinc/14/57/34/464145734.db2.gz UASQARLIBRQNEL-MRXNPFEDSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCN2CCCC[C@@H]2C1 ZINC000172804069 464145741 /nfs/dbraw/zinc/14/57/41/464145741.db2.gz UASQARLIBRQNEL-MRXNPFEDSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCN2CCCC[C@@H]2C1 ZINC000172804069 464145747 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Cc1ccc([C@@H](C)NC(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-] ZINC000417848756 466954436 /nfs/dbraw/zinc/95/44/36/466954436.db2.gz KTHSUYNGFFLFOK-MLGOLLRUSA-N 1 1 338.383 2.307 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1c1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000450955063 467214812 /nfs/dbraw/zinc/21/48/12/467214812.db2.gz PBSPOKAFLAXAJX-GFCCVEGCSA-N 1 1 348.428 2.221 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@@]2(CC[NH2+]C2)C1 ZINC000420359534 467377080 /nfs/dbraw/zinc/37/70/80/467377080.db2.gz FUNGXCUWCUUAPN-SFHVURJKSA-N 1 1 346.431 2.307 10 5 EEBEMO O=C(NC[C@@H](c1ccco1)[NH+]1CCCC1)c1ccc([N+](=O)[O-])cn1 ZINC000532397766 468116949 /nfs/dbraw/zinc/11/69/49/468116949.db2.gz NWMCGMNCIDKOQZ-AWEZNQCLSA-N 1 1 330.344 2.150 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H](c3cc[nH]n3)C2)c1 ZINC000589496192 468157186 /nfs/dbraw/zinc/15/71/86/468157186.db2.gz ZDPXOJJEDXXZTE-ZDUSSCGKSA-N 1 1 344.371 2.484 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]([C@@H]3CCOC3)C2)c1 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O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N[C@@H]1CCC[N@@H+](CCF)C1 ZINC000898496059 693340671 /nfs/dbraw/zinc/34/06/71/693340671.db2.gz QMXWLDNTTRBSLE-CYBMUJFWSA-N 1 1 348.378 2.169 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1cc(C)on1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691012038 1176491041 /nfs/dbraw/zinc/49/10/41/1176491041.db2.gz QBYVAKYPYJJPMF-UHFFFAOYSA-N 1 1 346.387 2.072 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(C)cc(C)c1 ZINC001691181353 1177682254 /nfs/dbraw/zinc/68/22/54/1177682254.db2.gz UHFSZYBNCWOGNR-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(C)cc(C)c1 ZINC001691181353 1177682261 /nfs/dbraw/zinc/68/22/61/1177682261.db2.gz UHFSZYBNCWOGNR-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(C)cc(C)c1 ZINC001691181353 1177682270 /nfs/dbraw/zinc/68/22/70/1177682270.db2.gz UHFSZYBNCWOGNR-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001267241308 1178591341 /nfs/dbraw/zinc/59/13/41/1178591341.db2.gz RKWCESKQPZWYRZ-BXUZGUMPSA-N 1 1 343.786 2.082 10 5 EEBEMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001267241308 1178591348 /nfs/dbraw/zinc/59/13/48/1178591348.db2.gz RKWCESKQPZWYRZ-BXUZGUMPSA-N 1 1 343.786 2.082 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(F)c(Cl)c1 ZINC001267241308 1178591354 /nfs/dbraw/zinc/59/13/54/1178591354.db2.gz RKWCESKQPZWYRZ-BXUZGUMPSA-N 1 1 343.786 2.082 10 5 EEBEMO C[C@H]([NH2+]CC1(CS(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872047149 1198034215 /nfs/dbraw/zinc/03/42/15/1198034215.db2.gz BSEQDEZQHIUVBT-JTQLQIEISA-N 1 1 330.381 2.209 10 5 EEBEMO C[C@H]([NH2+]C[C@@H]1CC[C@H](C(=O)N(C)C)O1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052630 1198035409 /nfs/dbraw/zinc/03/54/09/1198035409.db2.gz DUPIYDRYBLSDPJ-COPLHBTASA-N 1 1 339.367 2.020 10 5 EEBEMO Cc1ccc(CNC[C@@H](O)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000872231350 1198100668 /nfs/dbraw/zinc/10/06/68/1198100668.db2.gz IMCFHTSWAGOCEK-GOSISDBHSA-N 1 1 343.427 2.486 10 5 EEBEMO Cc1ccc(C[NH2+]C[C@@H](O)CN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000872231350 1198100670 /nfs/dbraw/zinc/10/06/70/1198100670.db2.gz IMCFHTSWAGOCEK-GOSISDBHSA-N 1 1 343.427 2.486 10 5 EEBEMO C[C@@H](COC(=O)c1cnn(-c2cc[nH+]cc2)c1C(F)F)[N+](=O)[O-] ZINC000813105944 1201098416 /nfs/dbraw/zinc/09/84/16/1201098416.db2.gz VVRMIUMSBLTBRU-QMMMGPOBSA-N 1 1 326.259 2.027 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000928456069 1206387569 /nfs/dbraw/zinc/38/75/69/1206387569.db2.gz LIUOKNYHJJUMSG-TZMCWYRMSA-N 1 1 332.404 2.017 10 5 EEBEMO CCC[N@@H+]1Cc2cccc(NC(=O)Cn3c(C)ncc3[N+](=O)[O-])c2C1 ZINC000931727611 1207451028 /nfs/dbraw/zinc/45/10/28/1207451028.db2.gz VKCUHOHVULLZNT-UHFFFAOYSA-N 1 1 343.387 2.464 10 5 EEBEMO CCC[N@H+]1Cc2cccc(NC(=O)Cn3c(C)ncc3[N+](=O)[O-])c2C1 ZINC000931727611 1207451032 /nfs/dbraw/zinc/45/10/32/1207451032.db2.gz VKCUHOHVULLZNT-UHFFFAOYSA-N 1 1 343.387 2.464 10 5 EEBEMO Cn1nccc1C1=CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000796143246 1215342490 /nfs/dbraw/zinc/34/24/90/1215342490.db2.gz OAEFCHUUCBFCMF-QGZVFWFLSA-N 1 1 328.372 2.151 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000853748948 1292444482 /nfs/dbraw/zinc/44/44/82/1292444482.db2.gz UMKZOTPQLAOPHF-SNVBAGLBSA-N 1 1 334.376 2.210 10 5 EEBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC000854058298 1292601258 /nfs/dbraw/zinc/60/12/58/1292601258.db2.gz IYFAHEHWQAXROM-QGZVFWFLSA-N 1 1 344.415 2.446 10 5 EEBEMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000861347888 1295351966 /nfs/dbraw/zinc/35/19/66/1295351966.db2.gz BAHFUTKTJGIHRI-RDJZCZTQSA-N 1 1 336.388 2.180 10 5 EEBEMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001262265230 1322266086 /nfs/dbraw/zinc/26/60/86/1322266086.db2.gz NOEUNXOWNSIBMJ-GJZGRUSLSA-N 1 1 335.379 2.410 10 5 EEBEMO CN(CC(C)(C)C[NH2+]Cc1ccccc1F)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001282294972 1325680495 /nfs/dbraw/zinc/68/04/95/1325680495.db2.gz JSDQSFLBCPCQJL-UKRRQHHQSA-N 1 1 337.395 2.065 10 5 EEBEMO C[S@](=O)c1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335507328 1336386284 /nfs/dbraw/zinc/38/62/84/1336386284.db2.gz QFDTWSMJWAQQCI-XDHUDOTRSA-N 1 1 348.424 2.330 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)[C@H]2C1 ZINC001349693343 1337639550 /nfs/dbraw/zinc/63/95/50/1337639550.db2.gz KNMQXWXPPGUISO-CWRNSKLLSA-N 1 1 342.399 2.006 10 5 EEBEMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001558997894 1342494865 /nfs/dbraw/zinc/49/48/65/1342494865.db2.gz BGKRRNJQJLGCFB-DQYPLSBCSA-N 1 1 329.400 2.393 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001558997894 1342494866 /nfs/dbraw/zinc/49/48/66/1342494866.db2.gz BGKRRNJQJLGCFB-DQYPLSBCSA-N 1 1 329.400 2.393 10 5 EEBEMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001624782504 1352430548 /nfs/dbraw/zinc/43/05/48/1352430548.db2.gz GZRYQAJRAPATAW-JTQLQIEISA-N 1 1 343.815 2.213 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC001640616114 1352712753 /nfs/dbraw/zinc/71/27/53/1352712753.db2.gz YLJFXOXNTOFPAI-CQSZACIVSA-N 1 1 332.404 2.314 10 5 EEBEMO C[C@H](O)[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718141 1352724230 /nfs/dbraw/zinc/72/42/30/1352724230.db2.gz NINWCXYFRXKHRB-AAEUAGOBSA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@H](O)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718141 1352724233 /nfs/dbraw/zinc/72/42/33/1352724233.db2.gz NINWCXYFRXKHRB-AAEUAGOBSA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@@H](CO)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001642862069 1352738696 /nfs/dbraw/zinc/73/86/96/1352738696.db2.gz QLKUEIFGIFIMFW-QMMMGPOBSA-N 1 1 326.740 2.111 10 5 EEBEMO C[C@@H](CO)[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001642862069 1352738702 /nfs/dbraw/zinc/73/87/02/1352738702.db2.gz QLKUEIFGIFIMFW-QMMMGPOBSA-N 1 1 326.740 2.111 10 5 EEBEMO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(N2CCNC2=O)cc1 ZINC001654824656 1354158793 /nfs/dbraw/zinc/15/87/93/1354158793.db2.gz GCGKJLDRBUIHQX-GFCCVEGCSA-N 1 1 341.371 2.370 10 5 EEBEMO Cn1c(=O)c([N+](=O)[O-])c(N[C@@H]2CCc3[nH+]c[nH]c3C2)c2ccccc21 ZINC001655537463 1354176544 /nfs/dbraw/zinc/17/65/44/1354176544.db2.gz UKIHVUXWTOKZIL-SNVBAGLBSA-N 1 1 339.355 2.139 10 5 EEBEMO Cn1c(=O)c([N+](=O)[O-])c(N[C@@H]2CCc3[nH]c[nH+]c3C2)c2ccccc21 ZINC001655537463 1354176546 /nfs/dbraw/zinc/17/65/46/1354176546.db2.gz UKIHVUXWTOKZIL-SNVBAGLBSA-N 1 1 339.355 2.139 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001660485020 1354472428 /nfs/dbraw/zinc/47/24/28/1354472428.db2.gz YCYSTWIQDZMRJL-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001660485020 1354472431 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2.083 10 5 EEBEMO C[N@@H+]1C[C@H]2CN(C(=O)CCc3ccc([N+](=O)[O-])cc3Cl)C[C@H]2C1 ZINC000907806125 784859428 /nfs/dbraw/zinc/85/94/28/784859428.db2.gz XUKGYHSASDBDCH-BETUJISGSA-N 1 1 337.807 2.201 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000913275730 788751645 /nfs/dbraw/zinc/75/16/45/788751645.db2.gz VVQOSODTDZDLJU-OGWHTMIXSA-N 1 1 343.427 2.499 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000174282141 792055374 /nfs/dbraw/zinc/05/53/74/792055374.db2.gz MJJUTRGXJMPUSX-CQSZACIVSA-N 1 1 336.388 2.417 10 5 EEBEMO CCc1[nH+]ccn1CCNC(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC001177514016 798997527 /nfs/dbraw/zinc/99/75/27/798997527.db2.gz MWYBPMBAICYTGP-UHFFFAOYSA-N 1 1 339.355 2.332 10 5 EEBEMO CCn1ccc(C(=O)NCCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001566498248 1125666510 /nfs/dbraw/zinc/66/65/10/1125666510.db2.gz YQCIWDCJOGJTPV-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO CCC[N@H+](CCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-] ZINC001493280028 1107840898 /nfs/dbraw/zinc/84/08/98/1107840898.db2.gz IQRCEFWXFPAMQP-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-] ZINC001493280028 1107840920 /nfs/dbraw/zinc/84/09/20/1107840920.db2.gz IQRCEFWXFPAMQP-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001493290479 1107866433 /nfs/dbraw/zinc/86/64/33/1107866433.db2.gz IHQALDQNLNEPOY-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001493290479 1107866448 /nfs/dbraw/zinc/86/64/48/1107866448.db2.gz IHQALDQNLNEPOY-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001493290479 1107866467 /nfs/dbraw/zinc/86/64/67/1107866467.db2.gz IHQALDQNLNEPOY-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2CC[C@@H](c3nnc[nH]3)C2)c1 ZINC000425348934 241133618 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1 1 347.415 2.469 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000246572299 160284599 /nfs/dbraw/zinc/28/45/99/160284599.db2.gz BUWCWWDODNPELW-KSSFIOAISA-N 1 1 347.415 2.469 10 5 EEBEMO C[N@@H+](CCc1nnnn1-c1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000338387839 160751929 /nfs/dbraw/zinc/75/19/29/160751929.db2.gz VCMONKXHADMLTA-UHFFFAOYSA-N 1 1 338.371 2.245 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000122699410 222140530 /nfs/dbraw/zinc/14/05/30/222140530.db2.gz DJMHLGQOPBUXAC-NXEZZACHSA-N 1 1 327.331 2.428 10 5 EEBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[NH+](Cc4ccncc4)CC3)nc2c1 ZINC000277873030 269192877 /nfs/dbraw/zinc/19/28/77/269192877.db2.gz PDAXCQNOLDQTBW-UHFFFAOYSA-N 1 1 338.371 2.188 10 5 EEBEMO COCCO[C@@H]1C[C@@H](CO)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000278382082 269228270 /nfs/dbraw/zinc/22/82/70/269228270.db2.gz UKAYVEVAULUSRU-CKEIUWERSA-N 1 1 338.404 2.002 10 5 EEBEMO CC(C)c1n[nH]c(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC000269466518 274113727 /nfs/dbraw/zinc/11/37/27/274113727.db2.gz IEGVANXHDJSZOJ-YOGCLGLASA-N 1 1 335.408 2.186 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)NCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000289486032 275120483 /nfs/dbraw/zinc/12/04/83/275120483.db2.gz CGVNSHQNMVIHRO-QGZVFWFLSA-N 1 1 337.395 2.466 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000290860033 275246955 /nfs/dbraw/zinc/24/69/55/275246955.db2.gz OXVRTSMKWCFHAQ-KRWDZBQOSA-N 1 1 337.395 2.466 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366598052 280118517 /nfs/dbraw/zinc/11/85/17/280118517.db2.gz NFEJREREMOWTCY-XJKSGUPXSA-N 1 1 340.383 2.383 10 5 EEBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@@H](n2cc(CO)nn2)C1 ZINC000293105134 293127050 /nfs/dbraw/zinc/12/70/50/293127050.db2.gz YCIDBTTWNIRROE-MLGOLLRUSA-N 1 1 331.376 2.077 10 5 EEBEMO O=C(NC[C@@H]1CCCC[N@H+]1Cc1ccccc1)c1cc([N+](=O)[O-])n[nH]1 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341.799 2.388 10 5 EEBEMO CCn1nc2c(cc1=O)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000371324991 465714364 /nfs/dbraw/zinc/71/43/64/465714364.db2.gz BINFPHJJFQFBLA-FNORWQNLSA-N 1 1 340.383 2.243 10 5 EEBEMO O=[N+]([O-])c1cnc2ccc(N3CC[C@@H]4[C@H](CCC[N@H+]4C4CC4)C3)nn21 ZINC000301947217 466065869 /nfs/dbraw/zinc/06/58/69/466065869.db2.gz HOARCSRNTKKOQW-TZMCWYRMSA-N 1 1 342.403 2.091 10 5 EEBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CCN(c2cnccn2)CC1 ZINC000372274898 466266469 /nfs/dbraw/zinc/26/64/69/466266469.db2.gz SSUFTRJGBWUGPU-UHFFFAOYSA-N 1 1 327.388 2.486 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])cn1)N1CC[C@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC000372762408 466578407 /nfs/dbraw/zinc/57/84/07/466578407.db2.gz PHWXKYAGYAWDSV-WBMJQRKESA-N 1 1 330.388 2.079 10 5 EEBEMO CN(C(=O)C[NH2+]C(C)(C)CN1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000452092834 467319800 /nfs/dbraw/zinc/31/98/00/467319800.db2.gz FFSOAQICTNWEDD-UHFFFAOYSA-N 1 1 334.420 2.022 10 5 EEBEMO 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O=C(N[C@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)[C@@H]1CC1[N+](=O)[O-] ZINC001337670454 1336725078 /nfs/dbraw/zinc/72/50/78/1336725078.db2.gz WUYMEUDGDPQZDP-DISONHOPSA-N 1 1 343.427 2.069 10 5 EEBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1ccon1 ZINC001570192428 1343030121 /nfs/dbraw/zinc/03/01/21/1343030121.db2.gz HFTBEOSOTWDVPP-UHFFFAOYSA-N 1 1 338.389 2.238 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1ccon1 ZINC001570192428 1343030126 /nfs/dbraw/zinc/03/01/26/1343030126.db2.gz HFTBEOSOTWDVPP-UHFFFAOYSA-N 1 1 338.389 2.238 10 5 EEBEMO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC[C@@H]1CC[N@H+]1C1CCOCC1 ZINC001643230662 1352743770 /nfs/dbraw/zinc/74/37/70/1352743770.db2.gz ZWKPWPIJKFAPHU-LBPRGKRZSA-N 1 1 336.348 2.168 10 5 EEBEMO NC(=O)[C@@H]1CCC[N@H+]1CCCNc1ccc([N+](=O)[O-])cc1C(F)F ZINC001655685404 1354181434 /nfs/dbraw/zinc/18/14/34/1354181434.db2.gz VAHLISCGIPZDMW-ZDUSSCGKSA-N 1 1 342.346 2.284 10 5 EEBEMO Cc1cc(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)ccn1 ZINC001669097248 1356093456 /nfs/dbraw/zinc/09/34/56/1356093456.db2.gz PZXMXXWUEPJPPM-NSCUHMNNSA-N 1 1 346.412 2.436 10 5 EEBEMO Cc1cc(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)cc([N+](=O)[O-])c1 ZINC000920901054 770904181 /nfs/dbraw/zinc/90/41/81/770904181.db2.gz ZDGUHEBYEBUOKN-MRXNPFEDSA-N 1 1 336.388 2.417 10 5 EEBEMO CCC[N@@H+](CC)CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000925337252 775128893 /nfs/dbraw/zinc/12/88/93/775128893.db2.gz WCKFPEFIXCXCQO-KRWDZBQOSA-N 1 1 348.403 2.094 10 5 EEBEMO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000818950093 785339630 /nfs/dbraw/zinc/33/96/30/785339630.db2.gz PLIQQBHKAWISAQ-DOMZBBRYSA-N 1 1 345.403 2.297 10 5 EEBEMO C[C@@H]1[C@H](C)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C(=O)N1C ZINC001171559998 796639057 /nfs/dbraw/zinc/63/90/57/796639057.db2.gz CDKLCZJYOIPOQD-RDBSUJKOSA-N 1 1 335.404 2.303 10 5 EEBEMO C[C@@H]1[C@H](C)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C(=O)N1C ZINC001171559998 796639060 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2.023 10 5 EEBEMO Cc1nc(C[C@@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)no1 ZINC000246223853 160268750 /nfs/dbraw/zinc/26/87/50/160268750.db2.gz DTZOUGQDDLRQOC-XJKSGUPXSA-N 1 1 346.387 2.274 10 5 EEBEMO CN(C(=O)C[N@H+]1CCCCC[C@H]1CCO)c1ccc([N+](=O)[O-])cc1 ZINC000342047912 161035026 /nfs/dbraw/zinc/03/50/26/161035026.db2.gz MLHYRYFHKPVBGX-HNNXBMFYSA-N 1 1 335.404 2.185 10 5 EEBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H]1CCS(=O)(=O)C1 ZINC000347353742 161445689 /nfs/dbraw/zinc/44/56/89/161445689.db2.gz GZYMHFBAIMGDIC-JEMSNHSXSA-N 1 1 338.429 2.365 10 5 EEBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@H]1CCS(=O)(=O)C1 ZINC000347353742 161445690 /nfs/dbraw/zinc/44/56/90/161445690.db2.gz GZYMHFBAIMGDIC-JEMSNHSXSA-N 1 1 338.429 2.365 10 5 EEBEMO O=[N+]([O-])c1cn(C[C@H](O)C[N@H+]2CCc3ccccc3C2)nc1C1CC1 ZINC000352439524 162135980 /nfs/dbraw/zinc/13/59/80/162135980.db2.gz WSVWXYCAZHJMOP-MRXNPFEDSA-N 1 1 342.399 2.088 10 5 EEBEMO 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1 1 336.436 2.179 10 5 EEBEMO C[C@H]1C[N@H+](C)[C@@H](C)CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359572605 465463084 /nfs/dbraw/zinc/46/30/84/465463084.db2.gz QFAKPDWXQISUSC-UWVGGRQHSA-N 1 1 343.330 2.361 10 5 EEBEMO C[C@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359572605 465463089 /nfs/dbraw/zinc/46/30/89/465463089.db2.gz QFAKPDWXQISUSC-UWVGGRQHSA-N 1 1 343.330 2.361 10 5 EEBEMO CN1CCN([C@@H]2CCCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000174901094 464466578 /nfs/dbraw/zinc/46/65/78/464466578.db2.gz FTNMRQGPOPAGKA-QGZVFWFLSA-N 1 1 332.448 2.197 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2C[C@@H](c3ccsc3)[C@H](CO)C2)c1 ZINC000249564528 464892039 /nfs/dbraw/zinc/89/20/39/464892039.db2.gz MRVKQHTYIZKBOE-BHYGNILZSA-N 1 1 348.424 2.398 10 5 EEBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223329 465497914 /nfs/dbraw/zinc/49/79/14/465497914.db2.gz FEDCQAHKLHWXFD-LDYMZIIASA-N 1 1 331.294 2.466 10 5 EEBEMO C[C@@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223329 465497920 /nfs/dbraw/zinc/49/79/20/465497920.db2.gz FEDCQAHKLHWXFD-LDYMZIIASA-N 1 1 331.294 2.466 10 5 EEBEMO CC[N@H+]1CCN(C(=O)Nc2cc(Cl)cc([N+](=O)[O-])c2N)C[C@@H]1C ZINC000597102290 468443810 /nfs/dbraw/zinc/44/38/10/468443810.db2.gz WPJYDGAZVQLGGC-VIFPVBQESA-N 1 1 341.799 2.388 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)cccc1[N+](=O)[O-] ZINC000360971637 465674200 /nfs/dbraw/zinc/67/42/00/465674200.db2.gz CTNLJFCAPFKITG-UUVAVEHKSA-N 1 1 347.415 2.325 10 5 EEBEMO O=C(C[N@@H+]1CCC[C@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000357066291 465738512 /nfs/dbraw/zinc/73/85/12/465738512.db2.gz HNAJPQRABWXTTN-KRWDZBQOSA-N 1 1 333.388 2.426 10 5 EEBEMO O=C(C[N@H+]1CCC[C@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000357066291 465738521 /nfs/dbraw/zinc/73/85/21/465738521.db2.gz HNAJPQRABWXTTN-KRWDZBQOSA-N 1 1 333.388 2.426 10 5 EEBEMO Cc1ccncc1C[N@@H+](C)C[C@@H](O)COc1ccccc1[N+](=O)[O-] ZINC000361425931 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COc1cc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@H]2C)cc([N+](=O)[O-])c1C ZINC000249950912 160386744 /nfs/dbraw/zinc/38/67/44/160386744.db2.gz HMPWVHBBZQLXDV-BXUZGUMPSA-N 1 1 333.388 2.221 10 5 EEBEMO Cc1cnn([C@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000246372462 160275906 /nfs/dbraw/zinc/27/59/06/160275906.db2.gz YSKWBKAVJUSNQE-DLBZAZTESA-N 1 1 330.388 2.470 10 5 EEBEMO C[C@H]1C[N@@H+](Cc2ccccn2)CC[C@H]1NC(=O)c1ccc([N+](=O)[O-])o1 ZINC000247299250 160319410 /nfs/dbraw/zinc/31/94/10/160319410.db2.gz UVAINDCFHXYUJY-GXTWGEPZSA-N 1 1 344.371 2.223 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247449859 160325208 /nfs/dbraw/zinc/32/52/08/160325208.db2.gz QDKHGHUAVMVAPE-UONOGXRCSA-N 1 1 335.404 2.162 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000248062455 160337005 /nfs/dbraw/zinc/33/70/05/160337005.db2.gz PGBCSQMABWMOPX-NVXWUHKLSA-N 1 1 340.383 2.352 10 5 EEBEMO O=C(Cc1c(F)cc([N+](=O)[O-])cc1F)N[C@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC000343870797 161176202 /nfs/dbraw/zinc/17/62/02/161176202.db2.gz DNCVCJSDCFCTEA-WDEREUQCSA-N 1 1 339.342 2.159 10 5 EEBEMO COc1cc(C[N@@H+](CCC(N)=O)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000352526316 162173043 /nfs/dbraw/zinc/17/30/43/162173043.db2.gz MMTLNBZAHDQDRX-UHFFFAOYSA-N 1 1 343.383 2.481 10 5 EEBEMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1[nH]ncc1[N+](=O)[O-] ZINC000122971278 222193503 /nfs/dbraw/zinc/19/35/03/222193503.db2.gz WDDCCAMVCMAYDL-CQSZACIVSA-N 1 1 343.387 2.102 10 5 EEBEMO O=C(NC[C@H]1CCCC[N@@H+]1Cc1ccccc1)c1n[nH]cc1[N+](=O)[O-] ZINC000122971278 222193507 /nfs/dbraw/zinc/19/35/07/222193507.db2.gz WDDCCAMVCMAYDL-CQSZACIVSA-N 1 1 343.387 2.102 10 5 EEBEMO O=C(NC[C@H]1CCCC[N@H+]1Cc1ccccc1)c1n[nH]cc1[N+](=O)[O-] ZINC000122971278 222193508 /nfs/dbraw/zinc/19/35/08/222193508.db2.gz WDDCCAMVCMAYDL-CQSZACIVSA-N 1 1 343.387 2.102 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)n1 ZINC000191773253 274052082 /nfs/dbraw/zinc/05/20/82/274052082.db2.gz MGQJWGKJWLQFCM-CYBMUJFWSA-N 1 1 337.424 2.053 10 5 EEBEMO C[C@H]([C@H](C)Nc1c2ccccc2ncc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000488081643 274543142 /nfs/dbraw/zinc/54/31/42/274543142.db2.gz NMUFQUWJIXGVKI-QWHCGFSZSA-N 1 1 330.388 2.086 10 5 EEBEMO O=[N+]([O-])c1cnc(N2CC[N@@H+]3CCC[C@@H]3C2)c(Br)c1 ZINC000177543837 275040983 /nfs/dbraw/zinc/04/09/83/275040983.db2.gz BYEHPZIWOIGMSA-SECBINFHSA-N 1 1 327.182 2.037 10 5 EEBEMO O=[N+]([O-])c1cnc(N2CC[N@H+]3CCC[C@@H]3C2)c(Br)c1 ZINC000177543837 275040985 /nfs/dbraw/zinc/04/09/85/275040985.db2.gz BYEHPZIWOIGMSA-SECBINFHSA-N 1 1 327.182 2.037 10 5 EEBEMO CC(C)[C@@H](O)C[N@H+]1CCCN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000292936459 293082838 /nfs/dbraw/zinc/08/28/38/293082838.db2.gz NBMFWTFZXJBMOA-INIZCTEOSA-N 1 1 347.419 2.000 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000525033117 317037463 /nfs/dbraw/zinc/03/74/63/317037463.db2.gz BBFHXMRPYXIBIP-UKRRQHHQSA-N 1 1 349.431 2.335 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@@H](c3cnn(C)c3)C2)c([N+](=O)[O-])cc1OC ZINC000128443775 462640307 /nfs/dbraw/zinc/64/03/07/462640307.db2.gz LWEMYBGJTOTFJH-GFCCVEGCSA-N 1 1 346.387 2.335 10 5 EEBEMO Cc1[nH+]ccn1-c1ccc([C@@H](C)NC(=O)c2[nH]ncc2[N+](=O)[O-])cc1 ZINC000133998301 462993255 /nfs/dbraw/zinc/99/32/55/462993255.db2.gz IBGUOONDBONNLE-SNVBAGLBSA-N 1 1 340.343 2.303 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@H]1c1cccc(F)c1 ZINC000261997956 463921888 /nfs/dbraw/zinc/92/18/88/463921888.db2.gz PPXCEJCERVIBLX-INIZCTEOSA-N 1 1 344.346 2.224 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](Cc3cnn4ccccc34)C2)nc1 ZINC000179819304 464193556 /nfs/dbraw/zinc/19/35/56/464193556.db2.gz ITRLEAUJSSYCRH-AWEZNQCLSA-N 1 1 338.371 2.324 10 5 EEBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](S(=O)(=O)N(C)C)C1 ZINC000285515388 464593627 /nfs/dbraw/zinc/59/36/27/464593627.db2.gz GGQODDIXABKTCJ-CHWSQXEVSA-N 1 1 341.433 2.012 10 5 EEBEMO 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332.356 2.306 10 5 EEBEMO C[C@@H]1C[C@H](C)C[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000531884141 468082936 /nfs/dbraw/zinc/08/29/36/468082936.db2.gz QRDLSTISVWYRLD-BETUJISGSA-N 1 1 334.420 2.476 10 5 EEBEMO CCc1ccc(C(=O)N2CCOC[C@@H]2[C@H]2CCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000590399910 468247278 /nfs/dbraw/zinc/24/72/78/468247278.db2.gz FDHRCRLSCCODFQ-NVXWUHKLSA-N 1 1 347.415 2.092 10 5 EEBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[C@@H]2C[N@@H+](C)C[C@H]21 ZINC000590443728 468258422 /nfs/dbraw/zinc/25/84/22/468258422.db2.gz GMIXLPDOCFSOMC-BFYDXBDKSA-N 1 1 331.416 2.326 10 5 EEBEMO C[C@H](C(=O)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1)c1cccc([N+](=O)[O-])c1 ZINC000597584037 468607783 /nfs/dbraw/zinc/60/77/83/468607783.db2.gz XBAHWELHMDGWNJ-MAZHCROVSA-N 1 1 335.379 2.343 10 5 EEBEMO CC1(C)CCC[C@@H]1[C@@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)C1 ZINC000592154346 468640990 /nfs/dbraw/zinc/64/09/90/468640990.db2.gz QDCBOIHFJBZXRL-VNQPRFMTSA-N 1 1 336.436 2.300 10 5 EEBEMO 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O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@H]3COCC[C@H]32)nc1-c1ccncc1 ZINC000756885013 577852324 /nfs/dbraw/zinc/85/23/24/577852324.db2.gz JSASTGBWMAPGPL-HUUCEWRRSA-N 1 1 343.387 2.312 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001648854976 1176736928 /nfs/dbraw/zinc/73/69/28/1176736928.db2.gz MVLYJNZTEPGULV-CYBMUJFWSA-N 1 1 332.404 2.092 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1ncccn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001481149451 1179924497 /nfs/dbraw/zinc/92/44/97/1179924497.db2.gz GVOOOEINPBZFIU-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccn1 ZINC001268507419 1183107241 /nfs/dbraw/zinc/10/72/41/1183107241.db2.gz ZMJMPNSGZJUCOG-ARJAWSKDSA-N 1 1 332.385 2.127 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CCn1cccc1 ZINC001482638770 1187465134 /nfs/dbraw/zinc/46/51/34/1187465134.db2.gz WVKNUHUSYJMELN-UHFFFAOYSA-N 1 1 344.415 2.377 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CCn1cccc1 ZINC001482638770 1187465136 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MLOBIKNKORMFJK-CQSZACIVSA-N 1 1 344.371 2.068 10 5 EEBEMO Cc1cc([N+](=O)[O-])c(F)c(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)c1F ZINC000827280643 1239193927 /nfs/dbraw/zinc/19/39/27/1239193927.db2.gz GNPBKQKVHJMQRK-NSHDSACASA-N 1 1 339.342 2.490 10 5 EEBEMO C[C@@H]1[C@H](CO)CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001195045667 1283414847 /nfs/dbraw/zinc/41/48/47/1283414847.db2.gz LRHBISGCZFZYNK-NEPJUHHUSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@@H]1[C@H](CO)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001195045667 1283414862 /nfs/dbraw/zinc/41/48/62/1283414862.db2.gz LRHBISGCZFZYNK-NEPJUHHUSA-N 1 1 332.360 2.238 10 5 EEBEMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000861345155 1295349941 /nfs/dbraw/zinc/34/99/41/1295349941.db2.gz ZLSBKKPSGAASKX-YVEFUNNKSA-N 1 1 347.371 2.342 10 5 EEBEMO CO[C@@H]1C[N@@H+](C)[C@@](C)(COC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000861347886 1295352758 /nfs/dbraw/zinc/35/27/58/1295352758.db2.gz BAHFUTKTJGIHRI-DOTOQJQBSA-N 1 1 336.388 2.180 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001293251696 1328646589 /nfs/dbraw/zinc/64/65/89/1328646589.db2.gz DNWBKMRCKPQVMN-ZDUSSCGKSA-N 1 1 333.388 2.208 10 5 EEBEMO CCC[N@H+]1CCC[C@H](C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001154336159 1317080920 /nfs/dbraw/zinc/08/09/20/1317080920.db2.gz ZAZLTDQCNIZFHX-AWEZNQCLSA-N 1 1 347.415 2.306 10 5 EEBEMO C[NH+](C)C1(C)CCC(NC(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CC1 ZINC001288013707 1327597141 /nfs/dbraw/zinc/59/71/41/1327597141.db2.gz QZBJTXIKNIPGBR-UHFFFAOYSA-N 1 1 345.403 2.464 10 5 EEBEMO COc1ccc(C[C@@H](C)[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC001319791070 1332769293 /nfs/dbraw/zinc/76/92/93/1332769293.db2.gz ICUYRRUCZUYIAA-CQSZACIVSA-N 1 1 345.399 2.328 10 5 EEBEMO CCc1ncc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001567322314 1342740314 /nfs/dbraw/zinc/74/03/14/1342740314.db2.gz ZZCPKZFIGCMCFZ-UHFFFAOYSA-N 1 1 348.428 2.476 10 5 EEBEMO CCc1ncc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)s1 ZINC001567322314 1342740315 /nfs/dbraw/zinc/74/03/15/1342740315.db2.gz ZZCPKZFIGCMCFZ-UHFFFAOYSA-N 1 1 348.428 2.476 10 5 EEBEMO Cc1c(C[N@@H+]2CCN(c3cnccn3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC001655925553 1354190072 /nfs/dbraw/zinc/19/00/72/1354190072.db2.gz KQLISICJXSWDIO-ZDUSSCGKSA-N 1 1 327.388 2.404 10 5 EEBEMO Cc1c(C[N@H+]2CCN(c3cnccn3)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC001655925553 1354190075 /nfs/dbraw/zinc/19/00/75/1354190075.db2.gz KQLISICJXSWDIO-ZDUSSCGKSA-N 1 1 327.388 2.404 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2ncncc2C1 ZINC001659925071 1354389733 /nfs/dbraw/zinc/38/97/33/1354389733.db2.gz FJYADZIHPSCOCW-UHFFFAOYSA-N 1 1 341.371 2.080 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ccc(F)nc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001663363162 1354953232 /nfs/dbraw/zinc/95/32/32/1354953232.db2.gz AJJGAZTZAQWSIU-UHFFFAOYSA-N 1 1 346.362 2.381 10 5 EEBEMO CN(CCC[NH2+]Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001699506095 1405367789 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348.384 2.041 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790565870 808804183 /nfs/dbraw/zinc/80/41/83/808804183.db2.gz VIWODRJDBWETIC-JTQLQIEISA-N 1 1 329.759 2.140 10 5 EEBEMO CNc1nccc(C(=O)Nc2cc(C)c3[nH+]ccn3c2)c1[N+](=O)[O-] ZINC001450357520 1094602905 /nfs/dbraw/zinc/60/29/05/1094602905.db2.gz VJZIQIDUTFWFTF-UHFFFAOYSA-N 1 1 326.316 2.240 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1cnc(C)[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001493282088 1107843253 /nfs/dbraw/zinc/84/32/53/1107843253.db2.gz VVBUPEJKWZHJQF-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CC[C@@H]1CN(c2nn(C)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001458306114 1109856926 /nfs/dbraw/zinc/85/69/26/1109856926.db2.gz KIROJECODWQTHT-OAHLLOKOSA-N 1 1 329.404 2.429 10 5 EEBEMO Cc1[nH]c(CNC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)c(C)[nH+]1 ZINC001471980152 1110537350 /nfs/dbraw/zinc/53/73/50/1110537350.db2.gz DJVYOWIOFSBWDE-UHFFFAOYSA-N 1 1 340.286 2.466 10 5 EEBEMO Cc1ccc(C[N@@H+]2CCN(c3cnccn3)[C@H](C)C2)cc1[N+](=O)[O-] 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XJGMIOBLKRWCEM-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1cccnc1)Cc1cccc([N+](=O)[O-])c1 ZINC001480886851 1177041098 /nfs/dbraw/zinc/04/10/98/1177041098.db2.gz XJGMIOBLKRWCEM-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO CCC[N@@H+](CCNC(=O)C1CCOCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001691174486 1177673582 /nfs/dbraw/zinc/67/35/82/1177673582.db2.gz VYGKPOFMTBGHAS-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO CN(CC[NH2+]Cc1cc(Cl)cc(Cl)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001691314792 1177893646 /nfs/dbraw/zinc/89/36/46/1177893646.db2.gz HEQXQALKGWOJBQ-CHWSQXEVSA-N 1 1 346.214 2.207 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001481350178 1181093460 /nfs/dbraw/zinc/09/34/60/1181093460.db2.gz FLBXSGUHMBYCRJ-HZPDHXFCSA-N 1 1 337.464 2.449 10 5 EEBEMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001481350178 1181093465 /nfs/dbraw/zinc/09/34/65/1181093465.db2.gz FLBXSGUHMBYCRJ-HZPDHXFCSA-N 1 1 337.464 2.449 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CC2(CCC2)C1 ZINC001481350178 1181093471 /nfs/dbraw/zinc/09/34/71/1181093471.db2.gz FLBXSGUHMBYCRJ-HZPDHXFCSA-N 1 1 337.464 2.449 10 5 EEBEMO Cc1ccn(C)c1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001483003366 1187982326 /nfs/dbraw/zinc/98/23/26/1187982326.db2.gz OJVWDBYJPDOQHR-ARJAWSKDSA-N 1 1 348.428 2.379 10 5 EEBEMO Cc1nn(C[N@H+]2C[C@@H]3COC[C@]3(c3ccccc3)C2)c(C)c1[N+](=O)[O-] ZINC000905675975 1189860355 /nfs/dbraw/zinc/86/03/55/1189860355.db2.gz NORKXKHNOUWZCR-AEFFLSMTSA-N 1 1 342.399 2.266 10 5 EEBEMO CC(C)[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H]1CCOC1 ZINC000812291861 1200623631 /nfs/dbraw/zinc/62/36/31/1200623631.db2.gz HBPGRPONEBPDDM-CQSZACIVSA-N 1 1 331.376 2.310 10 5 EEBEMO CC(C)[N@@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H]1CCOC1 ZINC000812291861 1200623635 /nfs/dbraw/zinc/62/36/35/1200623635.db2.gz HBPGRPONEBPDDM-CQSZACIVSA-N 1 1 331.376 2.310 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(c3ccc(C(=O)NC4CC4)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000866208894 1201465476 /nfs/dbraw/zinc/46/54/76/1201465476.db2.gz WTBRUAAPYLOXMK-ZFWWWQNUSA-N 1 1 344.415 2.017 10 5 EEBEMO Cc1cccc(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928095034 1206341069 /nfs/dbraw/zinc/34/10/69/1206341069.db2.gz JCXBHZVKSBBTRP-UONOGXRCSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1cccc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1[N+](=O)[O-] ZINC000928095034 1206341070 /nfs/dbraw/zinc/34/10/70/1206341070.db2.gz JCXBHZVKSBBTRP-UONOGXRCSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000928437151 1206383463 /nfs/dbraw/zinc/38/34/63/1206383463.db2.gz HAAYUPPVTTYTEM-KCJUWKMLSA-N 1 1 331.294 2.436 10 5 EEBEMO CC(C)(C)OC(=O)N1CCC[C@H]1[C@H]1CCC[N@@H+](CC[N+](=O)[O-])C1 ZINC000929429441 1206473895 /nfs/dbraw/zinc/47/38/95/1206473895.db2.gz JPCPGBTVAZZLFA-KBPBESRZSA-N 1 1 327.425 2.375 10 5 EEBEMO O=C(NCC1CC1)[C@H]1CCC[N@@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000047978890 1208433060 /nfs/dbraw/zinc/43/30/60/1208433060.db2.gz WQBSTJAYDLCSMF-ZDUSSCGKSA-N 1 1 335.379 2.472 10 5 EEBEMO O=C(NCC1CC1)[C@H]1CCC[N@H+](Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000047978890 1208433063 /nfs/dbraw/zinc/43/30/63/1208433063.db2.gz WQBSTJAYDLCSMF-ZDUSSCGKSA-N 1 1 335.379 2.472 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000902903700 1238998731 /nfs/dbraw/zinc/99/87/31/1238998731.db2.gz CGDQRCSAEQDMLR-KBPBESRZSA-N 1 1 336.417 2.296 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccns1 ZINC000860054325 1294778843 /nfs/dbraw/zinc/77/88/43/1294778843.db2.gz JREKJFHHQYMTIO-SECBINFHSA-N 1 1 336.373 2.349 10 5 EEBEMO Cc1cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c(N)c([N+](=O)[O-])c1 ZINC000863034006 1296089682 /nfs/dbraw/zinc/08/96/82/1296089682.db2.gz FZSCBMWQTFIYNA-CYBMUJFWSA-N 1 1 332.404 2.232 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3OCCC[C@H]3C2)c1 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WSAQMRFCJCPYRA-UHFFFAOYSA-N 1 1 330.388 2.402 10 5 EEBEMO O=C(c1cc([N+](=O)[O-])ccc1F)N1CC[NH2+][C@H](c2ccc(O)cc2)C1 ZINC001301801338 1331311457 /nfs/dbraw/zinc/31/14/57/1331311457.db2.gz DTEIYFCIZRAIGO-INIZCTEOSA-N 1 1 345.330 2.226 10 5 EEBEMO Cc1ccc(CCC[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)cc1 ZINC001326821219 1334164595 /nfs/dbraw/zinc/16/45/95/1334164595.db2.gz AMUAKGVTWUKTPI-IAGOWNOFSA-N 1 1 345.443 2.221 10 5 EEBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)c2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC001472449548 1338438403 /nfs/dbraw/zinc/43/84/03/1338438403.db2.gz WYDQWURSRTWICA-LBPRGKRZSA-N 1 1 328.372 2.309 10 5 EEBEMO CO[C@@H]1C[N@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC[C@@H]1C ZINC000848484714 1338706761 /nfs/dbraw/zinc/70/67/61/1338706761.db2.gz DAKYQJCLEOFCMM-IAOVAPTHSA-N 1 1 347.415 2.225 10 5 EEBEMO CO[C@@H]1C[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC[C@@H]1C ZINC000848484714 1338706764 /nfs/dbraw/zinc/70/67/64/1338706764.db2.gz DAKYQJCLEOFCMM-IAOVAPTHSA-N 1 1 347.415 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C[N@H+]1C[C@@H]2CN(Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C[C@]2(C)C1 ZINC000933735367 676840811 /nfs/dbraw/zinc/84/08/11/676840811.db2.gz WKGPYKPMRFADFI-PXAZEXFGSA-N 1 1 343.387 2.028 10 5 EEBEMO Cn1nccc1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162175535 679422217 /nfs/dbraw/zinc/42/22/17/679422217.db2.gz SSLLSGIUAKNHMP-UHFFFAOYSA-N 1 1 325.166 2.381 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](CCc3cccc(F)c3)CC2)cn1 ZINC000929171623 692195886 /nfs/dbraw/zinc/19/58/86/692195886.db2.gz MYGQYGWBJZHRKR-UHFFFAOYSA-N 1 1 330.363 2.494 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC[N@H+]1C ZINC000925329073 692721954 /nfs/dbraw/zinc/72/19/54/692721954.db2.gz KNKLNQRILHFCFA-WBMJQRKESA-N 1 1 332.404 2.361 10 5 EEBEMO CCCC(=O)NCCC[NH+]1CCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC001266256891 1176036536 /nfs/dbraw/zinc/03/65/36/1176036536.db2.gz MUHSIVGTZINGRX-UHFFFAOYSA-N 1 1 348.447 2.019 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ccncc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691005890 1176481359 /nfs/dbraw/zinc/48/13/59/1176481359.db2.gz FBNNPZZQKQQNBY-UHFFFAOYSA-N 1 1 328.372 2.242 10 5 EEBEMO Cc1cccc(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)n1 ZINC001670746696 1178289125 /nfs/dbraw/zinc/28/91/25/1178289125.db2.gz SOPXACFPLWDVGG-UHFFFAOYSA-N 1 1 346.412 2.412 10 5 EEBEMO O=C(NCC1([NH2+]Cc2cccc(F)c2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001270743251 1185359858 /nfs/dbraw/zinc/35/98/58/1185359858.db2.gz KSIKWNYIXBQGAP-HUUCEWRRSA-N 1 1 335.379 2.010 10 5 EEBEMO C[N@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000874827788 1199022349 /nfs/dbraw/zinc/02/23/49/1199022349.db2.gz UDCHRVBDJIGCEV-YVSFHVDLSA-N 1 1 329.400 2.393 10 5 EEBEMO CC[N@@H+](CCN1C(=O)N[C@@](C)(c2cccc([N+](=O)[O-])c2)C1=O)C(C)C ZINC000925295123 1206092236 /nfs/dbraw/zinc/09/22/36/1206092236.db2.gz JFLJCXHGNUUJBT-KRWDZBQOSA-N 1 1 348.403 2.092 10 5 EEBEMO Cc1c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000928102425 1206344453 /nfs/dbraw/zinc/34/44/53/1206344453.db2.gz MJKLSNIDIDSPGF-HIFRSBDPSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)cccc1[N+](=O)[O-] ZINC000928102425 1206344454 /nfs/dbraw/zinc/34/44/54/1206344454.db2.gz MJKLSNIDIDSPGF-HIFRSBDPSA-N 1 1 335.429 2.213 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1c(Cl)cccc1[N+](=O)[O-])C1CC1 ZINC000930648209 1206572922 /nfs/dbraw/zinc/57/29/22/1206572922.db2.gz HQQIALQSDTYWDX-UHFFFAOYSA-N 1 1 325.796 2.391 10 5 EEBEMO C[C@H](O)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399969 1281973793 /nfs/dbraw/zinc/97/37/93/1281973793.db2.gz FBHYPWQFULXXAL-NWDGAFQWSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@H](O)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399969 1281973796 /nfs/dbraw/zinc/97/37/96/1281973796.db2.gz FBHYPWQFULXXAL-NWDGAFQWSA-N 1 1 332.360 2.238 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CCCC[C@H]2[C@@H]2CCCO2)c([N+](=O)[O-])c1 ZINC001198685334 1285297049 /nfs/dbraw/zinc/29/70/49/1285297049.db2.gz IYTKUGGGMADADO-HOCLYGCPSA-N 1 1 333.388 2.227 10 5 EEBEMO CC1(C)Cc2n[nH]cc2C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000854056175 1292602247 /nfs/dbraw/zinc/60/22/47/1292602247.db2.gz ZYYMFYWJPCMKGD-MRXNPFEDSA-N 1 1 330.388 2.436 10 5 EEBEMO CCC(=O)c1ccc(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000842045820 1315654012 /nfs/dbraw/zinc/65/40/12/1315654012.db2.gz KADYQSPWAUWNFI-QWHCGFSZSA-N 1 1 335.404 2.079 10 5 EEBEMO CCC(=O)c1ccc(N2C[C@H](C)[N@@H+](CCO)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000842045820 1315654014 /nfs/dbraw/zinc/65/40/14/1315654014.db2.gz KADYQSPWAUWNFI-QWHCGFSZSA-N 1 1 335.404 2.079 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)NC[C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001251305964 1317446439 /nfs/dbraw/zinc/44/64/39/1317446439.db2.gz ZKZKVELVVUONEJ-ZIAGYGMSSA-N 1 1 334.420 2.434 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C3CCC3)C[C@@H](C)C2)n1 ZINC001159070156 1319593005 /nfs/dbraw/zinc/59/30/05/1319593005.db2.gz GOGQKXKZDWJDJM-GFCCVEGCSA-N 1 1 332.404 2.245 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1csnn1)Cc1cccc([N+](=O)[O-])c1 ZINC001266069096 1323623301 /nfs/dbraw/zinc/62/33/01/1323623301.db2.gz UGIMDBFNEBFISB-UHFFFAOYSA-N 1 1 349.416 2.088 10 5 EEBEMO C[C@@H]1CN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H](C)[N@@H+]1C ZINC001298676611 1330110944 /nfs/dbraw/zinc/11/09/44/1330110944.db2.gz IGHURCPWGSHJED-PHIMTYICSA-N 1 1 325.796 2.342 10 5 EEBEMO O=C1NCC[C@@H]1[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001350434773 1337711482 /nfs/dbraw/zinc/71/14/82/1337711482.db2.gz ZDQWWICYHAWBIS-LBPRGKRZSA-N 1 1 335.747 2.486 10 5 EEBEMO CC[C@H]1C[N@@H+](C)CCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001556745598 1342433684 /nfs/dbraw/zinc/43/36/84/1342433684.db2.gz YSLAWEDIJVAULS-LBPRGKRZSA-N 1 1 325.796 2.343 10 5 EEBEMO Cc1c(C(=O)N2CC[C@@H]3[C@@H]2CCC[N@@H+]3C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001594215504 1349874913 /nfs/dbraw/zinc/87/49/13/1349874913.db2.gz WNGOYYOFYKXYTE-KGLIPLIRSA-N 1 1 348.359 2.120 10 5 EEBEMO C[C@H](O)[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718143 1352724071 /nfs/dbraw/zinc/72/40/71/1352724071.db2.gz NINWCXYFRXKHRB-WCQYABFASA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@H](O)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718143 1352724073 /nfs/dbraw/zinc/72/40/73/1352724073.db2.gz NINWCXYFRXKHRB-WCQYABFASA-N 1 1 332.360 2.380 10 5 EEBEMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001651304717 1354048291 /nfs/dbraw/zinc/04/82/91/1354048291.db2.gz NTBKHXQEHLJGLS-KGLIPLIRSA-N 1 1 337.807 2.486 10 5 EEBEMO CC[C@H](C)[C@H](C)[N@@H+](C)CCNS(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC001654845228 1354159317 /nfs/dbraw/zinc/15/93/17/1354159317.db2.gz YDTVCLRVRYWYJQ-STQMWFEESA-N 1 1 343.449 2.240 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CCCC[C@@]23CCCOC3)c([N+](=O)[O-])c1 ZINC001656575004 1354249602 /nfs/dbraw/zinc/24/96/02/1354249602.db2.gz YXBZJUHGLMASNP-KRWDZBQOSA-N 1 1 333.388 2.229 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C1=CCOCC1 ZINC001673429284 1356690139 /nfs/dbraw/zinc/69/01/39/1356690139.db2.gz ABZCWIMKGKPUKM-UHFFFAOYSA-N 1 1 347.415 2.222 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000918393415 769075484 /nfs/dbraw/zinc/07/54/84/769075484.db2.gz FLPDBAVHMPHYBZ-CQSZACIVSA-N 1 1 346.431 2.409 10 5 EEBEMO C[C@H]1[C@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000919803445 770298733 /nfs/dbraw/zinc/29/87/33/770298733.db2.gz SXENHAUZGXPCDN-XJKSGUPXSA-N 1 1 334.420 2.309 10 5 EEBEMO CC(C)(C)OC1CC([NH+]2CCN(c3ncccc3[N+](=O)[O-])CC2)C1 ZINC000459513328 788094864 /nfs/dbraw/zinc/09/48/64/788094864.db2.gz RODZLAUQBLMKOO-UHFFFAOYSA-N 1 1 334.420 2.458 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H]2CCCC[N@H+]2CCO)c1 ZINC000824583103 788246133 /nfs/dbraw/zinc/24/61/33/788246133.db2.gz HZNGULXJQWOCKS-AWEZNQCLSA-N 1 1 327.812 2.185 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)c(CNC[C@@H]2CCCC[N@@H+]2CCO)c1 ZINC000824583103 788246139 /nfs/dbraw/zinc/24/61/39/788246139.db2.gz HZNGULXJQWOCKS-AWEZNQCLSA-N 1 1 327.812 2.185 10 5 EEBEMO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000913539071 788977561 /nfs/dbraw/zinc/97/75/61/788977561.db2.gz CAQTZSODUCEKNV-OKILXGFUSA-N 1 1 330.388 2.088 10 5 EEBEMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000913539071 788977563 /nfs/dbraw/zinc/97/75/63/788977563.db2.gz CAQTZSODUCEKNV-OKILXGFUSA-N 1 1 330.388 2.088 10 5 EEBEMO CCc1[nH+]ccn1CCNC(=O)CCC(=O)c1cccc([N+](=O)[O-])c1 ZINC001177514771 798997367 /nfs/dbraw/zinc/99/73/67/798997367.db2.gz UEPAVGLMOZTRGU-UHFFFAOYSA-N 1 1 344.371 2.133 10 5 EEBEMO CC[N@H+]1CC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Br ZINC000712331857 803194357 /nfs/dbraw/zinc/19/43/57/803194357.db2.gz ATUOCLMCIMNKLA-SECBINFHSA-N 1 1 342.193 2.181 10 5 EEBEMO Cc1nn(C[N@H+]2CC[C@@]3(C2)CCCOC3)c2ncc([N+](=O)[O-])cc12 ZINC000789543710 808053866 /nfs/dbraw/zinc/05/38/66/808053866.db2.gz XCFGQJSJKDHYBB-MRXNPFEDSA-N 1 1 331.376 2.108 10 5 EEBEMO Cc1ccc(CNC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001438573693 1091061415 /nfs/dbraw/zinc/06/14/15/1091061415.db2.gz GBTCPVUPVZHGCT-UHFFFAOYSA-N 1 1 337.339 2.414 10 5 EEBEMO CN(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cncc(F)c1 ZINC001496685672 1101285016 /nfs/dbraw/zinc/28/50/16/1101285016.db2.gz BHYISILSZOMCDH-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO CN(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cncc(F)c1 ZINC001496685672 1101285021 /nfs/dbraw/zinc/28/50/21/1101285021.db2.gz BHYISILSZOMCDH-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO CC[N@H+](CCNC(=O)c1nccs1)Cc1ccccc1[N+](=O)[O-] ZINC001493034951 1107357831 /nfs/dbraw/zinc/35/78/31/1107357831.db2.gz NYOGOBATUVWYQX-UHFFFAOYSA-N 1 1 334.401 2.303 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1nccs1)Cc1ccccc1[N+](=O)[O-] ZINC001493034951 1107357842 /nfs/dbraw/zinc/35/78/42/1107357842.db2.gz NYOGOBATUVWYQX-UHFFFAOYSA-N 1 1 334.401 2.303 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC(C)(C)[C@H]3COC[C@H]32)c1 ZINC001460226828 1110259786 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1197789559 /nfs/dbraw/zinc/78/95/59/1197789559.db2.gz QQCRYLLMXBURGC-QHCPKHFHSA-N 1 1 336.417 2.369 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(n3cccn3)CC2)c1 ZINC000811457786 1200071225 /nfs/dbraw/zinc/07/12/25/1200071225.db2.gz GVPAJPMRDDVBGO-UHFFFAOYSA-N 1 1 344.371 2.415 10 5 EEBEMO CCC[N@@H+](CC)C[C@@H](C)Nc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2 ZINC000811866590 1200366128 /nfs/dbraw/zinc/36/61/28/1200366128.db2.gz HNXTZPKRGIYLHZ-LLVKDONJSA-N 1 1 336.392 2.458 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C[C@@H]2C1 ZINC000812333856 1200667495 /nfs/dbraw/zinc/66/74/95/1200667495.db2.gz KDFCRDKVPCKVOC-NEPJUHHUSA-N 1 1 328.372 2.100 10 5 EEBEMO CCOc1cc(C[N@H+]2[C@H](C)CC[C@H](C(N)=O)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000930909588 1206591805 /nfs/dbraw/zinc/59/18/05/1206591805.db2.gz GQZDUUGNIGSZAF-DYEKYZERSA-N 1 1 335.404 2.468 10 5 EEBEMO C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2c[nH]nc21 ZINC000931451381 1207384472 /nfs/dbraw/zinc/38/44/72/1207384472.db2.gz 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Cc1ccc(CC(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)o1 ZINC001492228822 1331101575 /nfs/dbraw/zinc/10/15/75/1331101575.db2.gz SZUOFALNSXKHIR-UHFFFAOYSA-N 1 1 331.372 2.287 10 5 EEBEMO Cc1ccc(CC(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)o1 ZINC001492228822 1331101577 /nfs/dbraw/zinc/10/15/77/1331101577.db2.gz SZUOFALNSXKHIR-UHFFFAOYSA-N 1 1 331.372 2.287 10 5 EEBEMO COc1ccc(C[C@H](C)[N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)cc1 ZINC001319791065 1332769046 /nfs/dbraw/zinc/76/90/46/1332769046.db2.gz ICUYRRUCZUYIAA-AWEZNQCLSA-N 1 1 345.399 2.328 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(C(=O)COc2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1C ZINC001300086797 1338037182 /nfs/dbraw/zinc/03/71/82/1338037182.db2.gz KUQYUHUJAYUSNN-OKILXGFUSA-N 1 1 335.404 2.223 10 5 EEBEMO Cc1ccc(NC(=O)c2cnn(-c3cc[nH+]cc3)c2)c(N)c1[N+](=O)[O-] ZINC001646260250 1352824365 /nfs/dbraw/zinc/82/43/65/1352824365.db2.gz YHUWTDSVMUMWDA-UHFFFAOYSA-N 1 1 338.327 2.318 10 5 EEBEMO NC(=O)C[NH+]1CCC(Nc2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC001655766525 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333.344 2.354 10 5 EEBEMO Cc1ncoc1C(=O)NCCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001479763792 1098926523 /nfs/dbraw/zinc/92/65/23/1098926523.db2.gz NNFZKZLICRRSLD-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO Cc1nc(C(C)C)ccc1C[N@@H+](C)CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001479770219 1098940925 /nfs/dbraw/zinc/94/09/25/1098940925.db2.gz KUAIMNABJSYOOW-NVXWUHKLSA-N 1 1 348.447 2.117 10 5 EEBEMO Cc1nc(C(C)C)ccc1C[N@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001479770219 1098940929 /nfs/dbraw/zinc/94/09/29/1098940929.db2.gz KUAIMNABJSYOOW-NVXWUHKLSA-N 1 1 348.447 2.117 10 5 EEBEMO Cc1nc(C(C)C)ccc1C[N@@H+](C)CCCNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001479770219 1098940934 /nfs/dbraw/zinc/94/09/34/1098940934.db2.gz KUAIMNABJSYOOW-NVXWUHKLSA-N 1 1 348.447 2.117 10 5 EEBEMO CCOC(=O)[C@@H]1CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC001473845035 1110582418 /nfs/dbraw/zinc/58/24/18/1110582418.db2.gz QAITWQANRCWVJQ-CHWSQXEVSA-N 1 1 349.387 2.115 10 5 EEBEMO CCOC(=O)[C@@H]1CC[N@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC001473845035 1110582419 /nfs/dbraw/zinc/58/24/19/1110582419.db2.gz QAITWQANRCWVJQ-CHWSQXEVSA-N 1 1 349.387 2.115 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@@H]2CC[N@@H+](CC3CCCC3)C2)n1 ZINC001531560966 1122453216 /nfs/dbraw/zinc/45/32/16/1122453216.db2.gz MFWRTUSWUAJCNW-CQSZACIVSA-N 1 1 332.404 2.293 10 5 EEBEMO CN(C)c1ccc(COC(=O)c2cc(C[NH+](C)C)on2)cc1[N+](=O)[O-] ZINC001536908647 1123860420 /nfs/dbraw/zinc/86/04/20/1123860420.db2.gz UJFRCGITHPCFJN-UHFFFAOYSA-N 1 1 348.359 2.067 10 5 EEBEMO C[C@@H]1C[C@H](C)C[N@H+](CCCNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001540940483 1124097176 /nfs/dbraw/zinc/09/71/76/1124097176.db2.gz RENRZCXDULVNSK-AOOOYVTPSA-N 1 1 343.815 2.069 10 5 EEBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)C1(C(F)F)CC1 ZINC001568850193 1124868837 /nfs/dbraw/zinc/86/88/37/1124868837.db2.gz HOAZQHYNRIHYGV-OWOJBTEDSA-N 1 1 345.371 2.464 10 5 EEBEMO C[C@H]1C[C@H]([NH+]2CCOCC2)CN1c1c2ccccc2ncc1[N+](=O)[O-] 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O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C[C@H](O)CCc1ccccc1)CC2 ZINC000347787175 465226982 /nfs/dbraw/zinc/22/69/82/465226982.db2.gz HLLMSFPIGOKUHY-QGZVFWFLSA-N 1 1 327.384 2.342 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@]3(CCOC3)C2)c1 ZINC000590662323 468298051 /nfs/dbraw/zinc/29/80/51/468298051.db2.gz KKKYKIGCKOMYSZ-KRWDZBQOSA-N 1 1 334.372 2.384 10 5 EEBEMO CCn1nc2c(cc1=O)C[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000078616921 463134231 /nfs/dbraw/zinc/13/42/31/463134231.db2.gz GKJBLZLMYCBPJO-GFCCVEGCSA-N 1 1 328.372 2.291 10 5 EEBEMO CCn1nc2c(cc1=O)C[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000078616921 463134237 /nfs/dbraw/zinc/13/42/37/463134237.db2.gz GKJBLZLMYCBPJO-GFCCVEGCSA-N 1 1 328.372 2.291 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123005901 463308541 /nfs/dbraw/zinc/30/85/41/463308541.db2.gz BLXZPBLWLPQATP-KGLIPLIRSA-N 1 1 335.404 2.305 10 5 EEBEMO Cc1sc(S(=O)(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)cc1[N+](=O)[O-] 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333.388 2.035 10 5 EEBEMO CCO[C@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000599430991 469253348 /nfs/dbraw/zinc/25/33/48/469253348.db2.gz JVIGMQDIABXDEV-QGZVFWFLSA-N 1 1 347.415 2.168 10 5 EEBEMO Cc1sc(C(=O)N2CC[C@@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000619253088 469559576 /nfs/dbraw/zinc/55/95/76/469559576.db2.gz RQCBKVPHBQYXMH-GHMZBOCLSA-N 1 1 327.381 2.223 10 5 EEBEMO CC(C)(C)OC(=O)[C@@](C)(O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000776521668 577461391 /nfs/dbraw/zinc/46/13/91/577461391.db2.gz XPGBHQMXSLWPQG-HNNXBMFYSA-N 1 1 344.795 2.431 10 5 EEBEMO COC(=O)[C@H]1CCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765007258 577492732 /nfs/dbraw/zinc/49/27/32/577492732.db2.gz WVAFKDPQZHGGFD-LBPRGKRZSA-N 1 1 332.360 2.095 10 5 EEBEMO COC(=O)[C@H]1CCC[N@@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765007258 577492733 /nfs/dbraw/zinc/49/27/33/577492733.db2.gz WVAFKDPQZHGGFD-LBPRGKRZSA-N 1 1 332.360 2.095 10 5 EEBEMO 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2.206 10 5 EEBEMO Cc1ncoc1C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001269393585 1184234469 /nfs/dbraw/zinc/23/44/69/1184234469.db2.gz HWNMIDBPVHBFDX-UHFFFAOYSA-N 1 1 336.373 2.005 10 5 EEBEMO Cc1cc(CC(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)no1 ZINC001271984760 1186757843 /nfs/dbraw/zinc/75/78/43/1186757843.db2.gz VKDGHAJXLFJDRB-UHFFFAOYSA-N 1 1 346.387 2.024 10 5 EEBEMO Cc1cc(CC(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)no1 ZINC001271984760 1186757847 /nfs/dbraw/zinc/75/78/47/1186757847.db2.gz VKDGHAJXLFJDRB-UHFFFAOYSA-N 1 1 346.387 2.024 10 5 EEBEMO C[C@@H]([NH2+][C@H](C)C1(S(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070867 1198041192 /nfs/dbraw/zinc/04/11/92/1198041192.db2.gz ILDZWUHJAVLQPN-NXEZZACHSA-N 1 1 330.381 2.350 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCN(C)c2ncccc2C1 ZINC000872320039 1198145813 /nfs/dbraw/zinc/14/58/13/1198145813.db2.gz XRRKEBRJKQXJRA-UHFFFAOYSA-N 1 1 328.372 2.450 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCN(C)c2ncccc2C1 ZINC000872320039 1198145820 /nfs/dbraw/zinc/14/58/20/1198145820.db2.gz XRRKEBRJKQXJRA-UHFFFAOYSA-N 1 1 328.372 2.450 10 5 EEBEMO C[C@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCN1c1cc[nH+]cc1 ZINC000881635032 1201730907 /nfs/dbraw/zinc/73/09/07/1201730907.db2.gz KAKUKMOOHMIHDK-LBPRGKRZSA-N 1 1 342.355 2.046 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931286035 1206621985 /nfs/dbraw/zinc/62/19/85/1206621985.db2.gz VULUNRJCFDMGJZ-UHFFFAOYSA-N 1 1 337.395 2.421 10 5 EEBEMO CC(C)C1(O)CC[NH+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC001198676351 1285289729 /nfs/dbraw/zinc/28/97/29/1285289729.db2.gz NAJFCNPNLIMDKC-ZDUSSCGKSA-N 1 1 335.404 2.405 10 5 EEBEMO O=C(NCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)C(F)F ZINC001490360685 1291300241 /nfs/dbraw/zinc/30/02/41/1291300241.db2.gz DTVWIPSQPDUVNZ-UHFFFAOYSA-N 1 1 327.331 2.331 10 5 EEBEMO C[N@@H+](Cc1ccc2nc(NC(=O)[C@@H]3CC3[N+](=O)[O-])sc2c1)C1CC1 ZINC000855470393 1293221842 /nfs/dbraw/zinc/22/18/42/1293221842.db2.gz GHCLIHVDZQJKBX-DGCLKSJQSA-N 1 1 346.412 2.494 10 5 EEBEMO CCOC(=O)c1cc([N+](=O)[O-])c(N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cc1C ZINC001164261087 1321334035 /nfs/dbraw/zinc/33/40/35/1321334035.db2.gz MKLKQAAADMNQMV-ACJLOTCBSA-N 1 1 347.415 2.468 10 5 EEBEMO COc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC001316855994 1331482960 /nfs/dbraw/zinc/48/29/60/1331482960.db2.gz DVDUVLMVBRDWPQ-UHFFFAOYSA-N 1 1 347.371 2.448 10 5 EEBEMO CN(CC[NH2+]Cc1ccc(C(C)(C)C)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001317585687 1332309150 /nfs/dbraw/zinc/30/91/50/1332309150.db2.gz SUFQZFBYGZPSES-HZPDHXFCSA-N 1 1 333.432 2.197 10 5 EEBEMO CN(CC(C)(C)C[NH2+]CC1CC2(CCC2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001329293951 1334621816 /nfs/dbraw/zinc/62/18/16/1334621816.db2.gz ZHFKCYPCEDOFBB-HUUCEWRRSA-N 1 1 337.464 2.306 10 5 EEBEMO CC/C(C)=C\C(=O)N1CCC([N@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001331016463 1334947085 /nfs/dbraw/zinc/94/70/85/1334947085.db2.gz OMQILLAQQVSQRU-RAXLEYEMSA-N 1 1 349.435 2.107 10 5 EEBEMO CC/C(C)=C\C(=O)N1CCC([N@@H+](C)Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001331016463 1334947088 /nfs/dbraw/zinc/94/70/88/1334947088.db2.gz OMQILLAQQVSQRU-RAXLEYEMSA-N 1 1 349.435 2.107 10 5 EEBEMO C[NH+](C)Cc1cc(C(=O)Nc2ccc([N+](=O)[O-])c3ncccc23)no1 ZINC001435848313 1342001689 /nfs/dbraw/zinc/00/16/89/1342001689.db2.gz SIEYSMPHRRRWLZ-UHFFFAOYSA-N 1 1 341.327 2.445 10 5 EEBEMO CC(C)N(CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cn[nH]c1 ZINC001571610749 1343251746 /nfs/dbraw/zinc/25/17/46/1343251746.db2.gz ZVOYFGNOQZZJER-UHFFFAOYSA-N 1 1 345.403 2.301 10 5 EEBEMO CC(C)N(CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cn[nH]c1 ZINC001571610749 1343251748 /nfs/dbraw/zinc/25/17/48/1343251748.db2.gz ZVOYFGNOQZZJER-UHFFFAOYSA-N 1 1 345.403 2.301 10 5 EEBEMO CC[C@@H](NC(=O)N1CC[C@@H]2C[N@@H+](C)C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC001679150673 1357629620 /nfs/dbraw/zinc/62/96/20/1357629620.db2.gz GSIPIXCXNZSMCQ-BMFZPTHFSA-N 1 1 332.404 2.391 10 5 EEBEMO C[NH+](C)CC[C@H](NC(=O)c1cc(O)cc([N+](=O)[O-])c1)c1cccnc1 ZINC001652289903 1354085871 /nfs/dbraw/zinc/08/58/71/1354085871.db2.gz OARJZAUARXHWKL-INIZCTEOSA-N 1 1 344.371 2.118 10 5 EEBEMO Cn1cc([C@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)nn1 ZINC001656473553 1354241989 /nfs/dbraw/zinc/24/19/89/1354241989.db2.gz DWOXWPSHXOZAJY-NSHDSACASA-N 1 1 342.359 2.244 10 5 EEBEMO Cn1cc([C@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)nn1 ZINC001656473553 1354241992 /nfs/dbraw/zinc/24/19/92/1354241992.db2.gz DWOXWPSHXOZAJY-NSHDSACASA-N 1 1 342.359 2.244 10 5 EEBEMO Cn1cnnc1CC1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC001660241856 1354424474 /nfs/dbraw/zinc/42/44/74/1354424474.db2.gz NNEJLMJDRUIVLS-UHFFFAOYSA-N 1 1 333.367 2.317 10 5 EEBEMO CCc1noc(C)c1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663331967 1354949723 /nfs/dbraw/zinc/94/97/23/1354949723.db2.gz SMLDKXMIDCDGDH-UHFFFAOYSA-N 1 1 346.387 2.315 10 5 EEBEMO CCc1noc(C)c1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663331967 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QHKIOOWMTMCQRH-SJCJKPOMSA-N 1 1 344.415 2.266 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)Cc1ccon1 ZINC001502168085 1113624751 /nfs/dbraw/zinc/62/47/51/1113624751.db2.gz ISBVULLYIHBHDA-UHFFFAOYSA-N 1 1 346.387 2.106 10 5 EEBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000451262635 243055174 /nfs/dbraw/zinc/05/51/74/243055174.db2.gz XUSLTKWLXGPOGV-GXTWGEPZSA-N 1 1 332.360 2.238 10 5 EEBEMO COC(=O)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000073502095 203267777 /nfs/dbraw/zinc/26/77/77/203267777.db2.gz QZPXTIDTLGBYJI-HNNXBMFYSA-N 1 1 349.387 2.259 10 5 EEBEMO COC(=O)[C@@H]1CCCC[N@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000073502095 203267780 /nfs/dbraw/zinc/26/77/80/203267780.db2.gz QZPXTIDTLGBYJI-HNNXBMFYSA-N 1 1 349.387 2.259 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@](O)(CO)C3)o2)cc1 ZINC000459717914 245221363 /nfs/dbraw/zinc/22/13/63/245221363.db2.gz MOZMYDITIKKXDN-KRWDZBQOSA-N 1 1 332.356 2.174 10 5 EEBEMO O=C(C[N@@H+]1CC[C@]2(O)CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000247972931 205325422 /nfs/dbraw/zinc/32/54/22/205325422.db2.gz JVFWABLVNMMRKG-SUMWQHHRSA-N 1 1 333.388 2.160 10 5 EEBEMO O=C(C[N@H+]1CC[C@]2(O)CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000247972931 205325425 /nfs/dbraw/zinc/32/54/25/205325425.db2.gz JVFWABLVNMMRKG-SUMWQHHRSA-N 1 1 333.388 2.160 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177714268 207381792 /nfs/dbraw/zinc/38/17/92/207381792.db2.gz FZOCDFCGBBRDTF-UONOGXRCSA-N 1 1 334.420 2.338 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000245415842 160233140 /nfs/dbraw/zinc/23/31/40/160233140.db2.gz DPGPSIVDSQWJBO-PBHICJAKSA-N 1 1 346.431 2.116 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247449470 160325215 /nfs/dbraw/zinc/32/52/15/160325215.db2.gz QBTDIEUSMRMITE-JSGCOSHPSA-N 1 1 335.404 2.406 10 5 EEBEMO Cc1cc(C)cc([C@@H]2CC[N@@H+](C[C@@H](O)Cn3cc([N+](=O)[O-])cn3)C2)c1 ZINC000248441040 160346368 /nfs/dbraw/zinc/34/63/68/160346368.db2.gz DLOHQXLUIZFUEJ-CRAIPNDOSA-N 1 1 344.415 2.259 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000342438700 161065625 /nfs/dbraw/zinc/06/56/25/161065625.db2.gz PFSHCQDDIBGLSG-MNOVXSKESA-N 1 1 341.358 2.357 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C ZINC000277666590 269169355 /nfs/dbraw/zinc/16/93/55/269169355.db2.gz XAICXRAUHWHOKT-YHWZYXNKSA-N 1 1 333.388 2.349 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N1CC[N@@H+](C2CCOCC2)C[C@H]1C ZINC000278326696 274346970 /nfs/dbraw/zinc/34/69/70/274346970.db2.gz ASSBUABJBUEUFX-CQSZACIVSA-N 1 1 347.415 2.229 10 5 EEBEMO O=C(CC[N@@H+]1CC[C@H](O)CC12CCC2)Nc1ccccc1[N+](=O)[O-] ZINC000420993246 314017372 /nfs/dbraw/zinc/01/73/72/314017372.db2.gz LTVNGCKYKWSMRH-ZDUSSCGKSA-N 1 1 333.388 2.303 10 5 EEBEMO CO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000510159856 316387164 /nfs/dbraw/zinc/38/71/64/316387164.db2.gz NRISYTIBPZIHDN-PHIMTYICSA-N 1 1 327.768 2.296 10 5 EEBEMO CO[C@H]1C[C@@H]([N@@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000510159856 316387169 /nfs/dbraw/zinc/38/71/69/316387169.db2.gz NRISYTIBPZIHDN-PHIMTYICSA-N 1 1 327.768 2.296 10 5 EEBEMO CCO[C@H]1C[C@@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCC2 ZINC000090554588 462797734 /nfs/dbraw/zinc/79/77/34/462797734.db2.gz SMEUUTOAMLOLON-CVEARBPZSA-N 1 1 349.431 2.426 10 5 EEBEMO CCO[C@@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCC2 ZINC000090554585 462797829 /nfs/dbraw/zinc/79/78/29/462797829.db2.gz SMEUUTOAMLOLON-JKSUJKDBSA-N 1 1 349.431 2.426 10 5 EEBEMO CCn1cnnc1[C@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000161342476 463422645 /nfs/dbraw/zinc/42/26/45/463422645.db2.gz XMGJGZIAADUJSL-AWEZNQCLSA-N 1 1 345.403 2.465 10 5 EEBEMO COC(=O)[C@@]1(C)CCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000186400542 463992840 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CC1=CC[N@@H+](CCNC(=O)NCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000358192185 466527472 /nfs/dbraw/zinc/52/74/72/466527472.db2.gz PFWSXZSAPFHBKW-UHFFFAOYSA-N 1 1 332.404 2.089 10 5 EEBEMO COC(=O)C=Cc1ccc(N[C@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1 ZINC000370863832 467029935 /nfs/dbraw/zinc/02/99/35/467029935.db2.gz VSSDBYKJRFUHBP-QBODLPLBSA-N 1 1 342.355 2.474 10 5 EEBEMO COC(=O)C=Cc1ccc(N[C@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1 ZINC000370863832 467029937 /nfs/dbraw/zinc/02/99/37/467029937.db2.gz VSSDBYKJRFUHBP-QBODLPLBSA-N 1 1 342.355 2.474 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H]1CCc2nc[nH]c2C1 ZINC000377765933 467135792 /nfs/dbraw/zinc/13/57/92/467135792.db2.gz VOOJCNZQRGKQSC-VIFPVBQESA-N 1 1 331.332 2.006 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CCc2nc[nH]c2C1 ZINC000377765929 467136058 /nfs/dbraw/zinc/13/60/58/467136058.db2.gz VOOJCNZQRGKQSC-SECBINFHSA-N 1 1 331.332 2.006 10 5 EEBEMO CC[NH+]1CCN(CC(C)(C)Nc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000450924109 467207631 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2.429 10 5 EEBEMO C[C@H]1CCC[N@@H+](CCNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601104943 468742478 /nfs/dbraw/zinc/74/24/78/468742478.db2.gz NQZBHTCBHWUPPO-VIFPVBQESA-N 1 1 335.330 2.491 10 5 EEBEMO C[C@H]1C[C@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C ZINC000601119689 468749211 /nfs/dbraw/zinc/74/92/11/468749211.db2.gz VPGXXZXOMFFWQJ-DTWKUNHWSA-N 1 1 335.330 2.266 10 5 EEBEMO COC[C@H](CC[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)OC ZINC000595060291 468750089 /nfs/dbraw/zinc/75/00/89/468750089.db2.gz MGSAYTOISAEBKV-JKSUJKDBSA-N 1 1 348.403 2.059 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[C@H]2C[N@@H+](C)CC[C@H]21 ZINC000601131425 468755376 /nfs/dbraw/zinc/75/53/76/468755376.db2.gz KBPPLOSGJVVXCN-VHSXEESVSA-N 1 1 347.341 2.268 10 5 EEBEMO Cc1noc(C[NH+]2CCC(C(=O)N[C@@H](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000595298014 468803802 /nfs/dbraw/zinc/80/38/02/468803802.db2.gz MXIUCNZOHQTCNW-NSHDSACASA-N 1 1 338.408 2.264 10 5 EEBEMO CC[N@H+]1C[C@@H](C)N(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@H]1C ZINC000593021162 468842016 /nfs/dbraw/zinc/84/20/16/468842016.db2.gz SJJFWJIXFXNSIZ-CHWSQXEVSA-N 1 1 335.404 2.296 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CC[C@]2(CC2(F)F)C1 ZINC000593119127 468878140 /nfs/dbraw/zinc/87/81/40/468878140.db2.gz UTEQTHDDBHSTKE-FZMZJTMJSA-N 1 1 328.315 2.066 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595749722 468986041 /nfs/dbraw/zinc/98/60/41/468986041.db2.gz GTUOEKDWFILUSI-YVEFUNNKSA-N 1 1 333.388 2.159 10 5 EEBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595752712 468988661 /nfs/dbraw/zinc/98/86/61/468988661.db2.gz VNEYMLBJVOKWLG-YVEFUNNKSA-N 1 1 333.388 2.159 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H]2COC[C@]2(C)C1 ZINC000595756447 468991492 /nfs/dbraw/zinc/99/14/92/468991492.db2.gz GDUDLGIWTMWRQO-DYVFJYSZSA-N 1 1 333.388 2.200 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2C[C@H]3COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595761718 468994212 /nfs/dbraw/zinc/99/42/12/468994212.db2.gz ZGNSSNWLIOHEEA-DCGLDWPTSA-N 1 1 333.388 2.199 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[NH2+][C@H]3C[C@H](O)C34CCC4)n2)cc1 ZINC000595779342 469004197 /nfs/dbraw/zinc/00/41/97/469004197.db2.gz CSVMGHFMOFNCPQ-STQMWFEESA-N 1 1 330.344 2.038 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[NH2+][C@@H]3C[C@H](O)C34CCC4)n2)c1 ZINC000595778917 469004832 /nfs/dbraw/zinc/00/48/32/469004832.db2.gz VURSDWSWQSTYNR-OLZOCXBDSA-N 1 1 330.344 2.038 10 5 EEBEMO COc1cc(C[N@@H+]2CCC3(COC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595835518 469032940 /nfs/dbraw/zinc/03/29/40/469032940.db2.gz RNWDHJCWGFIXSE-UHFFFAOYSA-N 1 1 344.314 2.427 10 5 EEBEMO COc1cc(C[N@H+]2CCC3(COC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000595835518 469032949 /nfs/dbraw/zinc/03/29/49/469032949.db2.gz RNWDHJCWGFIXSE-UHFFFAOYSA-N 1 1 344.314 2.427 10 5 EEBEMO CC(C)NC(=O)[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000595851353 469046059 /nfs/dbraw/zinc/04/60/59/469046059.db2.gz RNDOKIWCGPBVEE-GFCCVEGCSA-N 1 1 346.387 2.473 10 5 EEBEMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000595851353 469046061 /nfs/dbraw/zinc/04/60/61/469046061.db2.gz RNDOKIWCGPBVEE-GFCCVEGCSA-N 1 1 346.387 2.473 10 5 EEBEMO COC(=O)[C@H]1C[C@@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595853341 469047601 /nfs/dbraw/zinc/04/76/01/469047601.db2.gz TUYAGDIRBOVSSC-BJHJDKERSA-N 1 1 346.343 2.028 10 5 EEBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595853341 469047610 /nfs/dbraw/zinc/04/76/10/469047610.db2.gz TUYAGDIRBOVSSC-BJHJDKERSA-N 1 1 346.343 2.028 10 5 EEBEMO [NH3+][C@@H]1CCO[C@H]([C@@H]2CCCC[N@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000593728656 469111205 /nfs/dbraw/zinc/11/12/05/469111205.db2.gz BIIAQXCNUAOSIV-COXVUDFISA-N 1 1 335.404 2.161 10 5 EEBEMO O=[N+]([O-])c1c(NC2CC([NH+]3CCOCC3)C2)ccc2cnccc21 ZINC000599091475 469116238 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2.218 10 5 EEBEMO CC(C)C[C@@H](CO)[N@@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000189590676 528336994 /nfs/dbraw/zinc/33/69/94/528336994.db2.gz OOJXXHDGIRGOKV-ZDUSSCGKSA-N 1 1 341.383 2.401 10 5 EEBEMO C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000930909875 684656064 /nfs/dbraw/zinc/65/60/64/684656064.db2.gz HELFJSZQGNEUFL-KKZNHRDASA-N 1 1 327.331 2.347 10 5 EEBEMO C[C@@H]1CC[C@H](C(N)=O)[C@@H](C)[N@H+]1Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000930909875 684656065 /nfs/dbraw/zinc/65/60/65/684656065.db2.gz HELFJSZQGNEUFL-KKZNHRDASA-N 1 1 327.331 2.347 10 5 EEBEMO CCc1cc(C(=O)NCC[N@H+](CC)Cc2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC001691008659 1176485319 /nfs/dbraw/zinc/48/53/19/1176485319.db2.gz ZUANIWSAVJSJJR-UHFFFAOYSA-N 1 1 345.403 2.132 10 5 EEBEMO CCc1c(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)ccn1C ZINC001480913500 1178108976 /nfs/dbraw/zinc/10/89/76/1178108976.db2.gz OWFOCQYGQPGQDH-UHFFFAOYSA-N 1 1 344.415 2.358 10 5 EEBEMO CCc1c(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccn1C ZINC001480913500 1178108980 /nfs/dbraw/zinc/10/89/80/1178108980.db2.gz OWFOCQYGQPGQDH-UHFFFAOYSA-N 1 1 344.415 2.358 10 5 EEBEMO CCc1cccnc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267205283 1178492578 /nfs/dbraw/zinc/49/25/78/1178492578.db2.gz YHKUVWKYTICWGR-UHFFFAOYSA-N 1 1 342.399 2.414 10 5 EEBEMO CCc1cccnc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001267205283 1178492587 /nfs/dbraw/zinc/49/25/87/1178492587.db2.gz YHKUVWKYTICWGR-UHFFFAOYSA-N 1 1 342.399 2.414 10 5 EEBEMO O=C(CCC(F)(F)F)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001267679280 1180148752 /nfs/dbraw/zinc/14/87/52/1180148752.db2.gz YSRSGSZOHHCTIL-UHFFFAOYSA-N 1 1 345.321 2.485 10 5 EEBEMO O=C(CC(F)(F)F)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001481614643 1181884903 /nfs/dbraw/zinc/88/49/03/1181884903.db2.gz SHSKWBBMDKHXEB-UHFFFAOYSA-N 1 1 331.294 2.095 10 5 EEBEMO C[C@H](N[C@H]1CC[N@@H+](CC(C)(C)O)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872092314 1198045053 /nfs/dbraw/zinc/04/50/53/1198045053.db2.gz OCUWHHDEVCZSAQ-RYUDHWBXSA-N 1 1 325.384 2.230 10 5 EEBEMO C[C@H]([NH2+][C@H]1CCN(CC(C)(C)O)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872092314 1198045058 /nfs/dbraw/zinc/04/50/58/1198045058.db2.gz OCUWHHDEVCZSAQ-RYUDHWBXSA-N 1 1 325.384 2.230 10 5 EEBEMO Cc1ccc(CNC[C@H](O)C[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000872231351 1198100690 /nfs/dbraw/zinc/10/06/90/1198100690.db2.gz IMCFHTSWAGOCEK-SFHVURJKSA-N 1 1 343.427 2.486 10 5 EEBEMO Cc1ccc(C[NH2+]C[C@H](O)CN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000872231351 1198100694 /nfs/dbraw/zinc/10/06/94/1198100694.db2.gz IMCFHTSWAGOCEK-SFHVURJKSA-N 1 1 343.427 2.486 10 5 EEBEMO CN(CC[NH+]1CC2(C1)CCOCC2)c1c(Cl)cncc1[N+](=O)[O-] ZINC000866256658 1201477379 /nfs/dbraw/zinc/47/73/79/1201477379.db2.gz BSNSMEMYSZMHPF-UHFFFAOYSA-N 1 1 340.811 2.192 10 5 EEBEMO Cc1ccc(CNC(=O)NCC[C@@H]2CCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000868697432 1201861850 /nfs/dbraw/zinc/86/18/50/1201861850.db2.gz BHTWVPHMRZCVQW-AWEZNQCLSA-N 1 1 334.420 2.434 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c1 ZINC000928095999 1206341402 /nfs/dbraw/zinc/34/14/02/1206341402.db2.gz QKHYGXTVAMIAJK-DZGCQCFKSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)c1 ZINC000928095999 1206341405 /nfs/dbraw/zinc/34/14/05/1206341405.db2.gz QKHYGXTVAMIAJK-DZGCQCFKSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928434567 1206382962 /nfs/dbraw/zinc/38/29/62/1206382962.db2.gz JCHVBALVUYSMMQ-WFASDCNBSA-N 1 1 340.383 2.479 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC[N@H+]1C ZINC000928450360 1206386105 /nfs/dbraw/zinc/38/61/05/1206386105.db2.gz IANPJWABISQSLE-IUODEOHRSA-N 1 1 332.404 2.017 10 5 EEBEMO C[C@@H]([NH2+]CC(=O)N1C[C@H](C)OC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000930236526 1206543375 /nfs/dbraw/zinc/54/33/75/1206543375.db2.gz XOTUTVHVRUXJCO-QWHCGFSZSA-N 1 1 335.404 2.271 10 5 EEBEMO C[N@H+]1CC[C@@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000930544568 1206566148 /nfs/dbraw/zinc/56/61/48/1206566148.db2.gz HGKNBKVZVKZIJY-SECBINFHSA-N 1 1 343.181 2.183 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(Cc3c(Br)cccc3[N+](=O)[O-])[C@@H]2C1 ZINC000930544281 1206566107 /nfs/dbraw/zinc/56/61/07/1206566107.db2.gz MLNSGZSMULKPBG-IINYFYTJSA-N 1 1 340.221 2.493 10 5 EEBEMO CCOC(=O)[C@@H]1[C@@H]2CC[N@@H+](CCOc3cccc([N+](=O)[O-])c3)C[C@@H]21 ZINC000932064063 1207529054 /nfs/dbraw/zinc/52/90/54/1207529054.db2.gz WCOLLDGHOWAWOR-OWCLPIDISA-N 1 1 334.372 2.105 10 5 EEBEMO COC(=O)C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C ZINC000932106490 1207537632 /nfs/dbraw/zinc/53/76/32/1207537632.db2.gz AXEKXISORUVJTF-GHMZBOCLSA-N 1 1 333.344 2.367 10 5 EEBEMO COC(=O)C[C@@H]1C[N@@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@H]1C ZINC000932106490 1207537634 /nfs/dbraw/zinc/53/76/34/1207537634.db2.gz AXEKXISORUVJTF-GHMZBOCLSA-N 1 1 333.344 2.367 10 5 EEBEMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)O[C@H]1CC[N@H+](CCF)C1 ZINC000802234385 1237149018 /nfs/dbraw/zinc/14/90/18/1237149018.db2.gz CXAHBMKOQDTWOC-HNNXBMFYSA-N 1 1 339.367 2.374 10 5 EEBEMO O=C(CCCNc1ccc([N+](=O)[O-])cc1)O[C@H]1CC[N@@H+](CCF)C1 ZINC000802234385 1237149021 /nfs/dbraw/zinc/14/90/21/1237149021.db2.gz CXAHBMKOQDTWOC-HNNXBMFYSA-N 1 1 339.367 2.374 10 5 EEBEMO O=C(Nc1cccc([N+](=O)[O-])c1)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000902906302 1239019230 /nfs/dbraw/zinc/01/92/30/1239019230.db2.gz SSBYSWQUIAQIJC-KGLIPLIRSA-N 1 1 336.417 2.296 10 5 EEBEMO Nc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@@H](O)C3)cc2)c1 ZINC000853793867 1292455718 /nfs/dbraw/zinc/45/57/18/1292455718.db2.gz BDVZPGFCLOYEOB-MRXNPFEDSA-N 1 1 342.399 2.356 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(NC2CC([NH+]3CCOCC3)C2)c1 ZINC000858599878 1294164435 /nfs/dbraw/zinc/16/44/35/1294164435.db2.gz MXINCNNXVMDDPB-UHFFFAOYSA-N 1 1 325.340 2.018 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(N2CCC([NH+]3CCOCC3)CC2)c1 ZINC000858633159 1294174921 /nfs/dbraw/zinc/17/49/21/1294174921.db2.gz WCXLFLSFDHGPAY-UHFFFAOYSA-N 1 1 339.367 2.044 10 5 EEBEMO CO[C@H]1C[N@@H+](C)[C@](C)(COC(=O)c2c[nH]c3cc([N+](=O)[O-])ccc23)C1 ZINC000861345152 1295349824 /nfs/dbraw/zinc/34/98/24/1295349824.db2.gz ZLSBKKPSGAASKX-PXAZEXFGSA-N 1 1 347.371 2.342 10 5 EEBEMO Cc1cnccc1C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001277049682 1301025519 /nfs/dbraw/zinc/02/55/19/1301025519.db2.gz REIHPBKYXMALMM-UHFFFAOYSA-N 1 1 346.412 2.412 10 5 EEBEMO O=C([C@@H]1CC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001138247435 1314582316 /nfs/dbraw/zinc/58/23/16/1314582316.db2.gz NHLNTWABRPKELZ-KRWDZBQOSA-N 1 1 345.399 2.201 10 5 EEBEMO C[N@@H+](CCCNC(=O)Cc1cccnc1)Cc1ccccc1[N+](=O)[O-] ZINC001264975830 1322826764 /nfs/dbraw/zinc/82/67/64/1322826764.db2.gz GFZANRBRIRXPRL-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1c(C)ccn1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317475238 1331608539 /nfs/dbraw/zinc/60/85/39/1331608539.db2.gz UGZXBWNTOLIKFW-UHFFFAOYSA-N 1 1 344.415 2.494 10 5 EEBEMO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Br)[C@H]1C[C@@H](C(N)=O)C1 ZINC001328978256 1334560683 /nfs/dbraw/zinc/56/06/83/1334560683.db2.gz WZTKDAXXWATJKD-JGZJWPJOSA-N 1 1 342.193 2.053 10 5 EEBEMO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1Br)[C@H]1C[C@@H](C(N)=O)C1 ZINC001328978256 1334560686 /nfs/dbraw/zinc/56/06/86/1334560686.db2.gz WZTKDAXXWATJKD-JGZJWPJOSA-N 1 1 342.193 2.053 10 5 EEBEMO O=C(NCC[N@@H+](Cc1cccc(Cl)c1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001567441154 1342761402 /nfs/dbraw/zinc/76/14/02/1342761402.db2.gz UHFAFZOZNNNKKO-HUUCEWRRSA-N 1 1 337.807 2.086 10 5 EEBEMO O=C(NCC[N@H+](Cc1cccc(Cl)c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001567441154 1342761403 /nfs/dbraw/zinc/76/14/03/1342761403.db2.gz UHFAFZOZNNNKKO-HUUCEWRRSA-N 1 1 337.807 2.086 10 5 EEBEMO O=C(NCC[N@@H+](Cc1cccc(Cl)c1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001567441154 1342761405 /nfs/dbraw/zinc/76/14/05/1342761405.db2.gz UHFAFZOZNNNKKO-HUUCEWRRSA-N 1 1 337.807 2.086 10 5 EEBEMO Nc1c(Cl)cc(C(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC001597027317 1349917231 /nfs/dbraw/zinc/91/72/31/1349917231.db2.gz YDTHZASATPXZGA-SECBINFHSA-N 1 1 338.795 2.045 10 5 EEBEMO CN(C[C@@H]1CCCC[N@H+]1Cc1ccccc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001625317205 1352446125 /nfs/dbraw/zinc/44/61/25/1352446125.db2.gz QCAFATYBWIJLBO-GVDBMIGSSA-N 1 1 331.416 2.165 10 5 EEBEMO CN(C[C@@H]1CCCC[N@@H+]1Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001625317205 1352446127 /nfs/dbraw/zinc/44/61/27/1352446127.db2.gz QCAFATYBWIJLBO-GVDBMIGSSA-N 1 1 331.416 2.165 10 5 EEBEMO CN(C[C@@H]1CCCC[N@H+]1Cc1ccccc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001625317205 1352446128 /nfs/dbraw/zinc/44/61/28/1352446128.db2.gz QCAFATYBWIJLBO-GVDBMIGSSA-N 1 1 331.416 2.165 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-] ZINC001643274300 1352745033 /nfs/dbraw/zinc/74/50/33/1352745033.db2.gz BJMICBSGNJCUJX-GFCCVEGCSA-N 1 1 345.359 2.369 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001656372853 1354226206 /nfs/dbraw/zinc/22/62/06/1354226206.db2.gz JCKGRYYMZTXVNY-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1C[C@@]2(CO)CCCC[C@@]2(CO)C1 ZINC001656372853 1354226207 /nfs/dbraw/zinc/22/62/07/1354226207.db2.gz JCKGRYYMZTXVNY-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO C[C@@H]1CC[C@@](CO)([NH2+]Cc2cn(C)nc2[N+](=O)[O-])c2ccccc21 ZINC001656510625 1354243805 /nfs/dbraw/zinc/24/38/05/1354243805.db2.gz DVLJRSGFONADFZ-PXAZEXFGSA-N 1 1 330.388 2.203 10 5 EEBEMO C[C@]1([NH2+]Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CCOc2ccccc21 ZINC001660309207 1354436584 /nfs/dbraw/zinc/43/65/84/1354436584.db2.gz AVOBAQVVRXASDR-SFHVURJKSA-N 1 1 341.367 2.481 10 5 EEBEMO Cc1nocc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001667619650 1355770432 /nfs/dbraw/zinc/77/04/32/1355770432.db2.gz VPAQMNPKCJVEEH-UHFFFAOYSA-N 1 1 332.360 2.095 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000823979949 788006293 /nfs/dbraw/zinc/00/62/93/788006293.db2.gz FFYVOAXHYYVQEB-SMDDNHRTSA-N 1 1 335.408 2.371 10 5 EEBEMO COC(=O)c1cc(NC(=O)[C@@H]2CC[C@H]3CCCC[N@H+]32)cc([N+](=O)[O-])c1 ZINC001136960407 788354369 /nfs/dbraw/zinc/35/43/69/788354369.db2.gz ULNZJXTWVNDFQK-HIFRSBDPSA-N 1 1 347.371 2.337 10 5 EEBEMO C[N@@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000913532013 788972940 /nfs/dbraw/zinc/97/29/40/788972940.db2.gz GYGJPVCZMFYWKL-OKILXGFUSA-N 1 1 337.807 2.486 10 5 EEBEMO Cc1ccc(NC[C@]2(O)CC[N@H+](C)C2)c([N+](=O)[O-])c1Br ZINC000804614719 810977960 /nfs/dbraw/zinc/97/79/60/810977960.db2.gz BPSCLWPPYUZULD-CYBMUJFWSA-N 1 1 344.209 2.144 10 5 EEBEMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)C1(CF)CCC1 ZINC001494597481 1104184903 /nfs/dbraw/zinc/18/49/03/1104184903.db2.gz PCFSHFCVUUQECR-UHFFFAOYSA-N 1 1 335.379 2.283 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CC[C@@H](Cc3nccs3)C2)c([N+](=O)[O-])c1 ZINC001460927664 1110328457 /nfs/dbraw/zinc/32/84/57/1110328457.db2.gz CRUACMCERLTPDH-NSHDSACASA-N 1 1 346.412 2.215 10 5 EEBEMO C[N@H+]1C[C@H](NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C(C)(C)C1 ZINC001472029717 1110539382 /nfs/dbraw/zinc/53/93/82/1110539382.db2.gz VAANTTKSNYRLTN-HNNXBMFYSA-N 1 1 331.416 2.473 10 5 EEBEMO CC[C@]1(CO)CCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001473399013 1110574970 /nfs/dbraw/zinc/57/49/70/1110574970.db2.gz IVIZZXKJHFFJLO-MRXNPFEDSA-N 1 1 332.360 2.382 10 5 EEBEMO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1CO ZINC001473668952 1110578205 /nfs/dbraw/zinc/57/82/05/1110578205.db2.gz VYWXNWONEYITRP-NEPJUHHUSA-N 1 1 332.360 2.095 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1CO ZINC001473668952 1110578208 /nfs/dbraw/zinc/57/82/08/1110578208.db2.gz VYWXNWONEYITRP-NEPJUHHUSA-N 1 1 332.360 2.095 10 5 EEBEMO O=C([C@@H]1CC1[N+](=O)[O-])N(CC[NH2+]C/C=C\Cl)Cc1ccccc1 ZINC001501193527 1113236451 /nfs/dbraw/zinc/23/64/51/1113236451.db2.gz GTNBIHHLHOYDLX-DGPIVGRDSA-N 1 1 337.807 2.023 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CN1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000109751166 204291368 /nfs/dbraw/zinc/29/13/68/204291368.db2.gz JNYMQUIYBKWURL-LJQANCHMSA-N 1 1 346.475 2.239 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000129130211 205180067 /nfs/dbraw/zinc/18/00/67/205180067.db2.gz KIFGFWCCGKRQEM-CYBMUJFWSA-N 1 1 340.383 2.453 10 5 EEBEMO CCOC(=O)c1ccnc(N[C@H]2C[N@H+](C(C)C)C[C@@H]2C)c1[N+](=O)[O-] ZINC000129723415 205208986 /nfs/dbraw/zinc/20/89/86/205208986.db2.gz WWXIZAOWHDUULI-AAEUAGOBSA-N 1 1 336.392 2.307 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000174255447 207004177 /nfs/dbraw/zinc/00/41/77/207004177.db2.gz YHFXIGPFELSZAC-CJNGLKHVSA-N 1 1 334.420 2.261 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)COc1cccc([N+](=O)[O-])c1 ZINC000175009559 207082666 /nfs/dbraw/zinc/08/26/66/207082666.db2.gz WSPWIFPSJFGSOV-DZGCQCFKSA-N 1 1 333.388 2.059 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000117282122 292236925 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C[C@@H]1CN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C ZINC000906815728 784154967 /nfs/dbraw/zinc/15/49/67/784154967.db2.gz OVNSCLZOJSSXIW-LLVKDONJSA-N 1 1 325.796 2.343 10 5 EEBEMO C[C@@H]1CN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000906815728 784154969 /nfs/dbraw/zinc/15/49/69/784154969.db2.gz OVNSCLZOJSSXIW-LLVKDONJSA-N 1 1 325.796 2.343 10 5 EEBEMO C[C@@H]1CC[C@H](C)[N@@H+]1[C@H]1CCCN(C(=O)c2cnc(N)c([N+](=O)[O-])c2)C1 ZINC001136493130 786861795 /nfs/dbraw/zinc/86/17/95/786861795.db2.gz SJCMPHYUBMFPRP-SCRDCRAPSA-N 1 1 347.419 2.049 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000845476628 789823612 /nfs/dbraw/zinc/82/36/12/789823612.db2.gz VTYJBKGWKIUFOB-ZIAGYGMSSA-N 1 1 328.372 2.418 10 5 EEBEMO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H](O)C(F)(F)F)c1 ZINC000788975223 807801725 /nfs/dbraw/zinc/80/17/25/807801725.db2.gz HMGFZRSLVVYKCI-VIFPVBQESA-N 1 1 330.209 2.209 10 5 EEBEMO C[N@H+]1CCN(C(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC001566422192 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JMERKFXQCAKORG-OAHLLOKOSA-N 1 1 349.431 2.097 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000119030262 292240217 /nfs/dbraw/zinc/24/02/17/292240217.db2.gz JMERKFXQCAKORG-OAHLLOKOSA-N 1 1 349.431 2.097 10 5 EEBEMO CC[N@H+]1CCC[C@@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000130607777 292376395 /nfs/dbraw/zinc/37/63/95/292376395.db2.gz LNGLYGFRIANPLO-CYBMUJFWSA-N 1 1 330.388 2.219 10 5 EEBEMO C[N@@H+](CCNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000068901639 159023853 /nfs/dbraw/zinc/02/38/53/159023853.db2.gz IGISCHNGPHWQSB-UHFFFAOYSA-N 1 1 345.403 2.465 10 5 EEBEMO C[N@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000068901639 159023854 /nfs/dbraw/zinc/02/38/54/159023854.db2.gz IGISCHNGPHWQSB-UHFFFAOYSA-N 1 1 345.403 2.465 10 5 EEBEMO C[N@@H+](CCNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000068901639 159023856 /nfs/dbraw/zinc/02/38/56/159023856.db2.gz IGISCHNGPHWQSB-UHFFFAOYSA-N 1 1 345.403 2.465 10 5 EEBEMO C[C@@H]([C@H]1Cc2ccccc2O1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090559618 159197899 /nfs/dbraw/zinc/19/78/99/159197899.db2.gz SUSDKPUWSFWSHI-SUMWQHHRSA-N 1 1 343.383 2.081 10 5 EEBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CCNc2ccccc2[N+](=O)[O-])C1 ZINC000247013027 160305753 /nfs/dbraw/zinc/30/57/53/160305753.db2.gz HFGFKNAEIGUQNX-UKRRQHHQSA-N 1 1 334.420 2.242 10 5 EEBEMO CC(C)[N@H+]1C[C@H](C)[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])C1 ZINC000247390743 160323508 /nfs/dbraw/zinc/32/35/08/160323508.db2.gz QKQFMPVWAAWUKJ-DZGCQCFKSA-N 1 1 334.420 2.465 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@H](c3nnc(C)[nH]3)C2)ccc1[N+](=O)[O-] ZINC000352554561 162184590 /nfs/dbraw/zinc/18/45/90/162184590.db2.gz GWAYUGMFRZBBHG-ZDUSSCGKSA-N 1 1 331.376 2.410 10 5 EEBEMO O=C(N[C@@H]1CC[N@H+](C2CC2)C1)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359035086 164042610 /nfs/dbraw/zinc/04/26/10/164042610.db2.gz ASLZDSBFOQSRIQ-SNVBAGLBSA-N 1 1 341.314 2.163 10 5 EEBEMO 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O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)n2)c1 ZINC000595749693 468986334 /nfs/dbraw/zinc/98/63/34/468986334.db2.gz GEPFKCWVMZYYGU-KRWDZBQOSA-N 1 1 344.371 2.382 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)NC(C)C)C1 ZINC000595851865 469046313 /nfs/dbraw/zinc/04/63/13/469046313.db2.gz UTBWEERNWKVJGT-AWEZNQCLSA-N 1 1 335.404 2.340 10 5 EEBEMO Cc1sc(S(=O)(=O)NCCC[N@H+](C)CC(C)C)cc1[N+](=O)[O-] ZINC000593615328 469059380 /nfs/dbraw/zinc/05/93/80/469059380.db2.gz AGEWFWLWYJEKHW-UHFFFAOYSA-N 1 1 349.478 2.221 10 5 EEBEMO O=C(CN1CCC[C@H](C2CC[NH2+]CC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000595901238 469071850 /nfs/dbraw/zinc/07/18/50/469071850.db2.gz SSEGDHCNQDDFGA-HNNXBMFYSA-N 1 1 346.431 2.245 10 5 EEBEMO C[C@@H]1C[N@H+](CCNc2c3ccccc3ncc2[N+](=O)[O-])[C@H](C)CO1 ZINC000596429476 469263690 /nfs/dbraw/zinc/26/36/90/469263690.db2.gz JOYAXFNKXOWIRB-CHWSQXEVSA-N 1 1 330.388 2.086 10 5 EEBEMO C[C@@H]1C[N@@H+](CCNc2c3ccccc3ncc2[N+](=O)[O-])[C@H](C)CO1 ZINC000596429476 469263692 /nfs/dbraw/zinc/26/36/92/469263692.db2.gz JOYAXFNKXOWIRB-CHWSQXEVSA-N 1 1 330.388 2.086 10 5 EEBEMO O=[N+]([O-])c1c2cccnc2ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000596537141 469296878 /nfs/dbraw/zinc/29/68/78/469296878.db2.gz BHGXVAXPDZOZEW-CQSZACIVSA-N 1 1 342.399 2.178 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CCC([N@H+]3CC[C@H](O)C3)CC2)c2ccncc21 ZINC000596540890 469297086 /nfs/dbraw/zinc/29/70/86/469297086.db2.gz VRZUMSZIFJDZAY-AWEZNQCLSA-N 1 1 342.399 2.178 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)cccc1[N+](=O)[O-] ZINC000599640819 469320082 /nfs/dbraw/zinc/32/00/82/469320082.db2.gz XXRUFRRRCMHDBG-KBXCAEBGSA-N 1 1 347.415 2.326 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC12CCOCC2 ZINC000618318139 469960200 /nfs/dbraw/zinc/96/02/00/469960200.db2.gz DMAVDJXUBPBOFA-UHFFFAOYSA-N 1 1 333.388 2.487 10 5 EEBEMO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C[C@H](O)C(F)(F)F ZINC000236514217 681722452 /nfs/dbraw/zinc/72/24/52/681722452.db2.gz DHIPHQZMRHWRPI-VIFPVBQESA-N 1 1 343.099 2.370 10 5 EEBEMO Cc1cc(N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000842047993 1188244813 /nfs/dbraw/zinc/24/48/13/1188244813.db2.gz YGTUHRVYPFKSQL-RYUDHWBXSA-N 1 1 327.812 2.448 10 5 EEBEMO Cc1cc(N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000842047993 1188244818 /nfs/dbraw/zinc/24/48/18/1188244818.db2.gz YGTUHRVYPFKSQL-RYUDHWBXSA-N 1 1 327.812 2.448 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000866205079 1201464204 /nfs/dbraw/zinc/46/42/04/1201464204.db2.gz JVENLLBLMJJTJD-KOLCDFICSA-N 1 1 341.209 2.283 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@H]21 ZINC000866207442 1201464835 /nfs/dbraw/zinc/46/48/35/1201464835.db2.gz IXTPQSWJIRODOU-GXSJLCMTSA-N 1 1 341.209 2.283 10 5 EEBEMO C[N@H+]1CCC[C@@H]1C(=O)NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000881864146 1201778050 /nfs/dbraw/zinc/77/80/50/1201778050.db2.gz LTUZMLUHBPYJRI-LLVKDONJSA-N 1 1 342.193 2.068 10 5 EEBEMO Cc1ccc(CNC(=O)NC[C@@H]2CCCC[N@H+](C)C2)cc1[N+](=O)[O-] ZINC000868806810 1201883800 /nfs/dbraw/zinc/88/38/00/1201883800.db2.gz ZLTJLNQYZSBEDM-HNNXBMFYSA-N 1 1 334.420 2.434 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)[C@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1 ZINC000887938898 1204513619 /nfs/dbraw/zinc/51/36/19/1204513619.db2.gz FJPPYOGZVBIMJW-KBEGMRNHSA-N 1 1 329.400 2.108 10 5 EEBEMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](C)[C@H]1C ZINC000928443977 1206384613 /nfs/dbraw/zinc/38/46/13/1206384613.db2.gz HQCNOVICHXEDJF-JBLDHEPKSA-N 1 1 341.795 2.224 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000928453409 1206386850 /nfs/dbraw/zinc/38/68/50/1206386850.db2.gz KLDMIHINCXLTCS-HIFRSBDPSA-N 1 1 346.431 2.020 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCc2cc(O)ccc2C1 ZINC001198828573 1285361304 /nfs/dbraw/zinc/36/13/04/1285361304.db2.gz LPGHYGATDCJLHE-INIZCTEOSA-N 1 1 344.367 2.098 10 5 EEBEMO Cc1nccc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)n1 ZINC001490284233 1291116415 /nfs/dbraw/zinc/11/64/15/1291116415.db2.gz NJGJXIKAFUDBKW-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO Cc1nccc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)n1 ZINC001490284233 1291116421 /nfs/dbraw/zinc/11/64/21/1291116421.db2.gz NJGJXIKAFUDBKW-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO CCc1noc(C[C@]2(O)CCC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000856592627 1293576096 /nfs/dbraw/zinc/57/60/96/1293576096.db2.gz LOXIQYKZNSXSLI-QGZVFWFLSA-N 1 1 346.387 2.110 10 5 EEBEMO CCc1noc(C[C@]2(O)CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)n1 ZINC000856592627 1293576103 /nfs/dbraw/zinc/57/61/03/1293576103.db2.gz LOXIQYKZNSXSLI-QGZVFWFLSA-N 1 1 346.387 2.110 10 5 EEBEMO C[C@@H]1C[C@H](CO)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000860088226 1294799865 /nfs/dbraw/zinc/79/98/65/1294799865.db2.gz PIYVKYJIBCQZQW-VXGBXAGGSA-N 1 1 339.367 2.155 10 5 EEBEMO CCC[N@@H+](CC)CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N ZINC001294275146 1328954723 /nfs/dbraw/zinc/95/47/23/1328954723.db2.gz WARXJEMOHXNEJV-UHFFFAOYSA-N 1 1 346.790 2.431 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cocn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001316888466 1331954266 /nfs/dbraw/zinc/95/42/66/1331954266.db2.gz WBGUWDFLYRBRBB-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO CC[N@H+](CCCNC(=O)c1cnco1)Cc1csc([N+](=O)[O-])c1 ZINC001316898883 1331964531 /nfs/dbraw/zinc/96/45/31/1331964531.db2.gz XTYRLALPQRDFCX-UHFFFAOYSA-N 1 1 338.389 2.286 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cnco1)Cc1csc([N+](=O)[O-])c1 ZINC001316898883 1331964533 /nfs/dbraw/zinc/96/45/33/1331964533.db2.gz XTYRLALPQRDFCX-UHFFFAOYSA-N 1 1 338.389 2.286 10 5 EEBEMO Cc1cccc(Cl)c1C[NH2+]C1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001323440277 1333464545 /nfs/dbraw/zinc/46/45/45/1333464545.db2.gz AJNFZURYTGFCJJ-BXUZGUMPSA-N 1 1 337.807 2.052 10 5 EEBEMO COc1ccc(NC(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)cc1[N+](=O)[O-] ZINC001346468074 1337484972 /nfs/dbraw/zinc/48/49/72/1337484972.db2.gz NXTVFBYURXYYEN-CYZMBNFOSA-N 1 1 334.376 2.065 10 5 EEBEMO COc1ccc(C[N@H+]2CCC[C@H](c3cn(C)nn3)C2)cc1[N+](=O)[O-] ZINC001620661942 1352361408 /nfs/dbraw/zinc/36/14/08/1352361408.db2.gz SILDRFVEYGICJX-ZDUSSCGKSA-N 1 1 331.376 2.112 10 5 EEBEMO Cn1nccc1C[C@@H]1CCC[N@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC001560238086 1342508986 /nfs/dbraw/zinc/50/89/86/1342508986.db2.gz XELAXZDCUCIZAZ-DOTOQJQBSA-N 1 1 330.388 2.069 10 5 EEBEMO Cc1ccc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001567271233 1342729778 /nfs/dbraw/zinc/72/97/78/1342729778.db2.gz SLTJQNZFFJMSSM-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO Cc1ccc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001567271233 1342729781 /nfs/dbraw/zinc/72/97/81/1342729781.db2.gz SLTJQNZFFJMSSM-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO C[N@H+]1C[C@H](NC(=O)CCCNc2ccc([N+](=O)[O-])cc2)C(C)(C)C1 ZINC001635643550 1352649747 /nfs/dbraw/zinc/64/97/47/1352649747.db2.gz CSZNANVPVQGYQJ-HNNXBMFYSA-N 1 1 334.420 2.243 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@]3(CO)CCCC[C@@]3(CO)C2)cc1F ZINC001656373588 1354226019 /nfs/dbraw/zinc/22/60/19/1354226019.db2.gz ZVBJJZKSTSMAPY-CALCHBBNSA-N 1 1 338.379 2.081 10 5 EEBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc(C(N)=O)cs1 ZINC001662896718 1354874116 /nfs/dbraw/zinc/87/41/16/1354874116.db2.gz NGBSDVXWDCDWQR-BJMVGYQFSA-N 1 1 332.385 2.343 10 5 EEBEMO NC(=O)c1ccc(C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c([N+](=O)[O-])c1 ZINC000844437466 789123891 /nfs/dbraw/zinc/12/38/91/789123891.db2.gz KLAVVLOAERDREJ-CQSZACIVSA-N 1 1 325.315 2.315 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CC[C@@H](CO)C2)o1 ZINC001459539274 1110213372 /nfs/dbraw/zinc/21/33/72/1110213372.db2.gz LDSNZBGDTTWBLR-SECBINFHSA-N 1 1 338.751 2.112 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@H](CO)C2)o1 ZINC001459539274 1110213375 /nfs/dbraw/zinc/21/33/75/1110213375.db2.gz LDSNZBGDTTWBLR-SECBINFHSA-N 1 1 338.751 2.112 10 5 EEBEMO O=C(NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1O ZINC001568818783 1124836073 /nfs/dbraw/zinc/83/60/73/1124836073.db2.gz YTZDIBKKKBJFAW-ONEGZZNKSA-N 1 1 347.396 2.438 10 5 EEBEMO CCc1ccc(C(=O)N2CC[N@H+](CCOC)[C@H](CC)C2)cc1[N+](=O)[O-] ZINC000174248492 529598380 /nfs/dbraw/zinc/59/83/80/529598380.db2.gz NFWVYWLPYXLARX-MRXNPFEDSA-N 1 1 349.431 2.340 10 5 EEBEMO CCc1ccc(C(=O)N2CC[N@@H+](CCOC)[C@H](CC)C2)cc1[N+](=O)[O-] ZINC000174248492 529598382 /nfs/dbraw/zinc/59/83/82/529598382.db2.gz NFWVYWLPYXLARX-MRXNPFEDSA-N 1 1 349.431 2.340 10 5 EEBEMO CCOC(=O)COCC[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451546768 243152595 /nfs/dbraw/zinc/15/25/95/243152595.db2.gz JTCJBVZIJVLANK-OAHLLOKOSA-N 1 1 336.388 2.354 10 5 EEBEMO NC(=O)C[C@@H]1CCCC[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892927 292213769 /nfs/dbraw/zinc/21/37/69/292213769.db2.gz PLQVFKSWZDQITA-HNNXBMFYSA-N 1 1 344.371 2.480 10 5 EEBEMO Cn1cc([C@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000173320106 152158172 /nfs/dbraw/zinc/15/81/72/152158172.db2.gz HUNJYVXLGVFKSF-OAHLLOKOSA-N 1 1 343.387 2.494 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@@H](O)CC3CCCC3)C2)nc1 ZINC000249120174 160374340 /nfs/dbraw/zinc/37/43/40/160374340.db2.gz SOJRVJJEUKDSET-HOCLYGCPSA-N 1 1 334.420 2.417 10 5 EEBEMO CCOc1ccc(C(=O)N2CC[N@@H+]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000195096554 160205875 /nfs/dbraw/zinc/20/58/75/160205875.db2.gz FSINJQWSAWYBCT-AWEZNQCLSA-N 1 1 333.388 2.304 10 5 EEBEMO CCOc1ccc(C(=O)N2CC[N@H+]3CCCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000195096554 160205877 /nfs/dbraw/zinc/20/58/77/160205877.db2.gz FSINJQWSAWYBCT-AWEZNQCLSA-N 1 1 333.388 2.304 10 5 EEBEMO Cc1nc(C[C@H]2CCC[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)no1 ZINC000246223849 160268866 /nfs/dbraw/zinc/26/88/66/160268866.db2.gz DTZOUGQDDLRQOC-CZUORRHYSA-N 1 1 346.387 2.274 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000247004128 160305361 /nfs/dbraw/zinc/30/53/61/160305361.db2.gz QIRJNKAHLCOIQG-KGLIPLIRSA-N 1 1 333.388 2.059 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000122605180 222122516 /nfs/dbraw/zinc/12/25/16/222122516.db2.gz FGVMAULNVUTWFM-DOMZBBRYSA-N 1 1 335.404 2.406 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)CCNc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123866959 222345050 /nfs/dbraw/zinc/34/50/50/222345050.db2.gz WZBFSRWDPFOIMM-KGLIPLIRSA-N 1 1 334.420 2.338 10 5 EEBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Nc1ccncc1[N+](=O)[O-] ZINC000183584245 274861895 /nfs/dbraw/zinc/86/18/95/274861895.db2.gz YCAUPPGFLOEWAI-LBPRGKRZSA-N 1 1 330.348 2.191 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc(N)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000180108767 277137142 /nfs/dbraw/zinc/13/71/42/277137142.db2.gz PGBCSQMABWMOPX-WBVHZDCISA-N 1 1 340.383 2.352 10 5 EEBEMO O=C(Cn1c[nH+]c2c1CCCC2)Nc1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000540886992 318081001 /nfs/dbraw/zinc/08/10/01/318081001.db2.gz DPOWFGIXLBLDBV-UHFFFAOYSA-N 1 1 340.343 2.185 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC000576747414 320200528 /nfs/dbraw/zinc/20/05/28/320200528.db2.gz AFQAONDXQPYWJK-CQSZACIVSA-N 1 1 334.420 2.391 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000154955323 462828242 /nfs/dbraw/zinc/82/82/42/462828242.db2.gz ACLRCYWZDPAQOW-QWHCGFSZSA-N 1 1 340.383 2.452 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(OCCCO)CC1 ZINC000155037589 462838521 /nfs/dbraw/zinc/83/85/21/462838521.db2.gz DCHVMBAMMBNWAP-UHFFFAOYSA-N 1 1 338.404 2.357 10 5 EEBEMO CC(C)[N@@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCOCC1 ZINC000077322779 462968895 /nfs/dbraw/zinc/96/88/95/462968895.db2.gz CPTMTTYPKOFUAN-UHFFFAOYSA-N 1 1 347.415 2.373 10 5 EEBEMO CC[N@@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000135242212 463133072 /nfs/dbraw/zinc/13/30/72/463133072.db2.gz KZMKYKUJXUIOPD-LLVKDONJSA-N 1 1 344.209 2.490 10 5 EEBEMO CC[N@H+]1CCO[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000135242212 463133075 /nfs/dbraw/zinc/13/30/75/463133075.db2.gz KZMKYKUJXUIOPD-LLVKDONJSA-N 1 1 344.209 2.490 10 5 EEBEMO Cc1cn2c(C[N@H+](C)CCn3ccc([N+](=O)[O-])n3)c(C)nc2s1 ZINC000097086159 463320227 /nfs/dbraw/zinc/32/02/27/463320227.db2.gz RRHVPXAKZDOTFB-UHFFFAOYSA-N 1 1 334.405 2.249 10 5 EEBEMO Cc1cn2c(C[N@@H+](C)CCn3ccc([N+](=O)[O-])n3)c(C)nc2s1 ZINC000097086159 463320231 /nfs/dbraw/zinc/32/02/31/463320231.db2.gz RRHVPXAKZDOTFB-UHFFFAOYSA-N 1 1 334.405 2.249 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276994432 463834545 /nfs/dbraw/zinc/83/45/45/463834545.db2.gz VGFSTTVQAFVOJF-NSHDSACASA-N 1 1 342.355 2.081 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276994432 463834551 /nfs/dbraw/zinc/83/45/51/463834551.db2.gz VGFSTTVQAFVOJF-NSHDSACASA-N 1 1 342.355 2.081 10 5 EEBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1CCC[N@H+](C2CC2)CC1 ZINC000172347847 464060691 /nfs/dbraw/zinc/06/06/91/464060691.db2.gz LKGIREVPFJVFHL-CYBMUJFWSA-N 1 1 332.404 2.092 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)c(Cl)c1 ZINC000182192879 464594485 /nfs/dbraw/zinc/59/44/85/464594485.db2.gz LPWVMDFHSBCRJK-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](N3CCOCC3)C2)c(Cl)c1 ZINC000182192879 464594492 /nfs/dbraw/zinc/59/44/92/464594492.db2.gz LPWVMDFHSBCRJK-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000191204406 464796764 /nfs/dbraw/zinc/79/67/64/464796764.db2.gz JFSWWYNBJYQEHU-IOASZLSFSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)[C@@H]1[C@@H]2CCC[C@@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000191204406 464796767 /nfs/dbraw/zinc/79/67/67/464796767.db2.gz JFSWWYNBJYQEHU-IOASZLSFSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)c1cc(C)nc(N(C)C2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c1[N+](=O)[O-] ZINC000286196024 464835854 /nfs/dbraw/zinc/83/58/54/464835854.db2.gz ASEBYMWUNXCJBV-FUNVUKJBSA-N 1 1 348.403 2.146 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000348223854 465497878 /nfs/dbraw/zinc/49/78/78/465497878.db2.gz YETNHCDXTOIEGM-HNNXBMFYSA-N 1 1 332.404 2.010 10 5 EEBEMO CC[N@@H+](C)Cc1cccc(CNc2ncc([N+](=O)[O-])cc2C(N)=O)c1 ZINC000299194996 465643155 /nfs/dbraw/zinc/64/31/55/465643155.db2.gz MKCOFKACZSMILE-UHFFFAOYSA-N 1 1 343.387 2.153 10 5 EEBEMO CC(C)[N@@H+](C)CCCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000362513953 465795365 /nfs/dbraw/zinc/79/53/65/465795365.db2.gz XBXLMDKZTGBKNM-UHFFFAOYSA-N 1 1 329.347 2.262 10 5 EEBEMO CN(C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@H]1CC[N@H+](C2CC2)C1 ZINC000340147275 465813707 /nfs/dbraw/zinc/81/37/07/465813707.db2.gz JXDGQRKWBOGESS-HNNXBMFYSA-N 1 1 342.399 2.314 10 5 EEBEMO C[N@H+]1CCO[C@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C[C@H]21 ZINC000301684600 466008469 /nfs/dbraw/zinc/00/84/69/466008469.db2.gz WLYKPYDNDZNFJT-OLZOCXBDSA-N 1 1 331.294 2.133 10 5 EEBEMO C[N@@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000354520145 466626185 /nfs/dbraw/zinc/62/61/85/466626185.db2.gz HELNBGDMDDWDDF-FZMZJTMJSA-N 1 1 349.778 2.147 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@@H]1c1ccc(Cl)cc1 ZINC000354520145 466626188 /nfs/dbraw/zinc/62/61/88/466626188.db2.gz HELNBGDMDDWDDF-FZMZJTMJSA-N 1 1 349.778 2.147 10 5 EEBEMO Cc1cnc([C@@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000428376073 467226548 /nfs/dbraw/zinc/22/65/48/467226548.db2.gz DPPIFHHJUWCMMM-CHWSQXEVSA-N 1 1 328.376 2.336 10 5 EEBEMO Cc1cnc([C@@H](C)[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000428376073 467226550 /nfs/dbraw/zinc/22/65/50/467226550.db2.gz DPPIFHHJUWCMMM-CHWSQXEVSA-N 1 1 328.376 2.336 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000518187782 468108233 /nfs/dbraw/zinc/10/82/33/468108233.db2.gz IIKLCPSEMNGTCD-GOSISDBHSA-N 1 1 346.431 2.307 10 5 EEBEMO O=[N+]([O-])c1ccn(CC[N@@H+](Cc2ccccc2)[C@@H](CO)C2CCC2)n1 ZINC000592139447 468633918 /nfs/dbraw/zinc/63/39/18/468633918.db2.gz DOGYGQNYMXXFFM-KRWDZBQOSA-N 1 1 344.415 2.455 10 5 EEBEMO CC[NH+]1CCN(C[C@H](C)CNc2c(OC)cccc2[N+](=O)[O-])CC1 ZINC000583470733 468701335 /nfs/dbraw/zinc/70/13/35/468701335.db2.gz AGEFZEHGHVLHKR-CQSZACIVSA-N 1 1 336.436 2.289 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[NH+](C2CCC2)CC1 ZINC000601117240 468748281 /nfs/dbraw/zinc/74/82/81/468748281.db2.gz ZQUYEBITNHVVDI-UHFFFAOYSA-N 1 1 333.314 2.022 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[C@H]2C[N@@H+](C)CC[C@@H]21 ZINC000601131424 468755140 /nfs/dbraw/zinc/75/51/40/468755140.db2.gz KBPPLOSGJVVXCN-UWVGGRQHSA-N 1 1 347.341 2.268 10 5 EEBEMO Cn1c(C(=O)NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000592879641 468813417 /nfs/dbraw/zinc/81/34/17/468813417.db2.gz AJOKMMHOCLDQTI-CABCVRRESA-N 1 1 342.399 2.009 10 5 EEBEMO C[N@H+]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cn2)[C@H](c2ccccc2)C1 ZINC000592879765 468813832 /nfs/dbraw/zinc/81/38/32/468813832.db2.gz CLSZOKOCQSNZFN-ZBFHGGJFSA-N 1 1 340.383 2.065 10 5 EEBEMO CCC[N@H+]1CC[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000598341578 468836689 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347.415 2.469 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595753617 468989649 /nfs/dbraw/zinc/98/96/49/468989649.db2.gz ZPHWZANHQHNDAY-YVEFUNNKSA-N 1 1 333.388 2.159 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595753617 468989655 /nfs/dbraw/zinc/98/96/55/468989655.db2.gz ZPHWZANHQHNDAY-YVEFUNNKSA-N 1 1 333.388 2.159 10 5 EEBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000595848200 469041798 /nfs/dbraw/zinc/04/17/98/469041798.db2.gz FJFVMHSIXQURRH-BETUJISGSA-N 1 1 349.387 2.115 10 5 EEBEMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+]1Cc1ccccc1 ZINC000562713448 469047138 /nfs/dbraw/zinc/04/71/38/469047138.db2.gz QBRTXFCRECCCHF-CQSZACIVSA-N 1 1 340.383 2.336 10 5 EEBEMO C[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000562713448 469047146 /nfs/dbraw/zinc/04/71/46/469047146.db2.gz QBRTXFCRECCCHF-CQSZACIVSA-N 1 1 340.383 2.336 10 5 EEBEMO 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469299331 /nfs/dbraw/zinc/29/93/31/469299331.db2.gz SNTCZAXEGMPFAV-QGZVFWFLSA-N 1 1 341.415 2.218 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)[C@@H]2C1 ZINC000646916624 470774860 /nfs/dbraw/zinc/77/48/60/470774860.db2.gz MFGJUANBCPQNLL-SCLBCKFNSA-N 1 1 347.418 2.457 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000174533481 529097562 /nfs/dbraw/zinc/09/75/62/529097562.db2.gz UAYFRDPUKBCUNY-JTQLQIEISA-N 1 1 327.331 2.429 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000928448815 683197125 /nfs/dbraw/zinc/19/71/25/683197125.db2.gz OTHRJRAXXRDTFE-UFBFGSQYSA-N 1 1 342.193 2.180 10 5 EEBEMO C[N@H+](CCNC(=O)c1cnoc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001266344107 1176348410 /nfs/dbraw/zinc/34/84/10/1176348410.db2.gz DXPOFLXQFHTSGH-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cnoc1C1CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001266344107 1176348427 /nfs/dbraw/zinc/34/84/27/1176348427.db2.gz DXPOFLXQFHTSGH-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1nc(C)oc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001691045054 1177017292 /nfs/dbraw/zinc/01/72/92/1177017292.db2.gz QRSGUBQTKVTXQB-UHFFFAOYSA-N 1 1 346.387 2.452 10 5 EEBEMO CN(CC[NH2+]CCc1ccc2ccccc2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001481229472 1180359889 /nfs/dbraw/zinc/35/98/89/1180359889.db2.gz QIFUEWGUGZGVHC-QZTJIDSGSA-N 1 1 341.411 2.096 10 5 EEBEMO CO[C@H](C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000813170067 1201139914 /nfs/dbraw/zinc/13/99/14/1201139914.db2.gz FHTZYEFNVFTHBL-HOTGVXAUSA-N 1 1 336.388 2.383 10 5 EEBEMO CO[C@H](C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1)C(C)C ZINC000813170067 1201139920 /nfs/dbraw/zinc/13/99/20/1201139920.db2.gz FHTZYEFNVFTHBL-HOTGVXAUSA-N 1 1 336.388 2.383 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000868210290 1201765320 /nfs/dbraw/zinc/76/53/20/1201765320.db2.gz KBDVYCHTAYPLBF-CABCVRRESA-N 1 1 332.404 2.329 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H]3CC[C@@H](C4CC4)O3)CC2)cn1 ZINC000885938174 1202457338 /nfs/dbraw/zinc/45/73/38/1202457338.db2.gz UTIOERIBGFYWES-HOTGVXAUSA-N 1 1 332.404 2.069 10 5 EEBEMO C[C@H]1CCCC[N@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000777798566 1206487618 /nfs/dbraw/zinc/48/76/18/1206487618.db2.gz CHHZXIMDHUTQLE-JTQLQIEISA-N 1 1 349.416 2.204 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000078651000 1210379994 /nfs/dbraw/zinc/37/99/94/1210379994.db2.gz QGUTXBRDSVVQQX-LBPRGKRZSA-N 1 1 341.795 2.089 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)OCc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000803859835 1242104524 /nfs/dbraw/zinc/10/45/24/1242104524.db2.gz XHHRHBXLGNGKFN-CQSZACIVSA-N 1 1 349.387 2.001 10 5 EEBEMO O=C(N[C@H]1C[C@@H]([NH2+]C/C=C/c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001491017203 1258574316 /nfs/dbraw/zinc/57/43/16/1258574316.db2.gz DVHHHLHSHVYJLW-SDDRIOSUSA-N 1 1 349.818 2.255 10 5 EEBEMO CC(C)(O)[C@H]1CC[N@@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC001197494089 1284660710 /nfs/dbraw/zinc/66/07/10/1284660710.db2.gz BZTVSZUIACGIKO-LBPRGKRZSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@H]([NH2+]CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)c1ccns1 ZINC000860055406 1294780801 /nfs/dbraw/zinc/78/08/01/1294780801.db2.gz XXLLOUWZMITNCZ-JTQLQIEISA-N 1 1 332.385 2.291 10 5 EEBEMO O=C1OC[C@H]2C[N@H+](Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]12 ZINC000862545383 1295874869 /nfs/dbraw/zinc/87/48/69/1295874869.db2.gz RGPAIJKHUOSOED-IUODEOHRSA-N 1 1 328.324 2.460 10 5 EEBEMO COc1ccc(NC(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@H]32)c([N+](=O)[O-])c1 ZINC001123425452 1310563785 /nfs/dbraw/zinc/56/37/85/1310563785.db2.gz KSEOFQGEDFMIGV-CYZMBNFOSA-N 1 1 334.376 2.065 10 5 EEBEMO CC[C@@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610599 1315219842 /nfs/dbraw/zinc/21/98/42/1315219842.db2.gz OYGIRJKRZGAGGR-GXFFZTMASA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610599 1315219847 /nfs/dbraw/zinc/21/98/47/1315219847.db2.gz OYGIRJKRZGAGGR-GXFFZTMASA-N 1 1 341.795 2.280 10 5 EEBEMO Cc1cc(NC(=O)[C@@H]2CC(c3ccccc3[N+](=O)[O-])=NO2)cc(C)[nH+]1 ZINC001254428639 1318072239 /nfs/dbraw/zinc/07/22/39/1318072239.db2.gz JEKCIZZIUCVZNK-INIZCTEOSA-N 1 1 340.339 2.160 10 5 EEBEMO Cc1c[nH+]cn1CC(=O)Nc1cc(C)nc2ccc([N+](=O)[O-])cc21 ZINC001435847551 1342001673 /nfs/dbraw/zinc/00/16/73/1342001673.db2.gz DCGSYIFWXSSCAZ-UHFFFAOYSA-N 1 1 325.328 2.017 10 5 EEBEMO Nc1c(C(=O)N[C@H]2CC[N@H+](C3CC3)C2)cc2ccccc2c1[N+](=O)[O-] ZINC001542337486 1342328333 /nfs/dbraw/zinc/32/83/33/1342328333.db2.gz DUDLHXJYVRIQRW-LBPRGKRZSA-N 1 1 340.383 2.297 10 5 EEBEMO CCC[N@H+]1CCC[C@H]1CNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001627002976 1352480440 /nfs/dbraw/zinc/48/04/40/1352480440.db2.gz SSXBXKZBWBOHJY-NSHDSACASA-N 1 1 340.811 2.435 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CC[N@@H+](CC2CCCC2)C1 ZINC001629064706 1352548229 /nfs/dbraw/zinc/54/82/29/1352548229.db2.gz HRCYFCWOTJBVKK-CYBMUJFWSA-N 1 1 332.404 2.171 10 5 EEBEMO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC4(CC3)C[C@H](O)CCO4)nc2c1 ZINC001655677681 1354181736 /nfs/dbraw/zinc/18/17/36/1354181736.db2.gz RZNRNMQGWGQICR-CYBMUJFWSA-N 1 1 347.371 2.242 10 5 EEBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)n1C ZINC001663332093 1354949670 /nfs/dbraw/zinc/94/96/70/1354949670.db2.gz YCZCOSCQNCLSHN-UHFFFAOYSA-N 1 1 344.415 2.412 10 5 EEBEMO Cc1cc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])c(C)n1C ZINC001663332093 1354949673 /nfs/dbraw/zinc/94/96/73/1354949673.db2.gz YCZCOSCQNCLSHN-UHFFFAOYSA-N 1 1 344.415 2.412 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)C1 ZINC000918393414 769075156 /nfs/dbraw/zinc/07/51/56/769075156.db2.gz FLPDBAVHMPHYBZ-AWEZNQCLSA-N 1 1 346.431 2.409 10 5 EEBEMO CCC[N@H+]1CCC[C@H](C(=O)N[C@@](C)(CO)c2cccc([N+](=O)[O-])c2)C1 ZINC000913659259 794039673 /nfs/dbraw/zinc/03/96/73/794039673.db2.gz GPSJNHSXLIWXEO-KSSFIOAISA-N 1 1 349.431 2.041 10 5 EEBEMO C[N@@H+](CCCNC(=O)C(=O)C(C)(C)C)Cc1cccc([N+](=O)[O-])c1 ZINC001479762133 1098923843 /nfs/dbraw/zinc/92/38/43/1098923843.db2.gz IVNIJVXWQCOVDC-UHFFFAOYSA-N 1 1 335.404 2.148 10 5 EEBEMO CCC1(C(=O)NC/C=C/C[NH2+]Cc2c([N+](=O)[O-])ncn2C)CCCC1 ZINC001497713374 1102951750 /nfs/dbraw/zinc/95/17/50/1102951750.db2.gz OJWZBLVLTNNSIG-VOTSOKGWSA-N 1 1 349.435 2.061 10 5 EEBEMO C[C@H](NC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC001479306523 1110678710 /nfs/dbraw/zinc/67/87/10/1110678710.db2.gz SVRKICMSXYPWAK-QEORTHHSSA-N 1 1 332.404 2.249 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)C1CCOCC1 ZINC001502152479 1113618376 /nfs/dbraw/zinc/61/83/76/1113618376.db2.gz ILJOGGMKBXAJIE-UHFFFAOYSA-N 1 1 349.431 2.302 10 5 EEBEMO COc1cc(C(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])cc1F ZINC001521763429 1119274771 /nfs/dbraw/zinc/27/47/71/1119274771.db2.gz ZNWDCAUMHCMQKU-FGWVZKOKSA-N 1 1 337.351 2.098 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000451896997 243297367 /nfs/dbraw/zinc/29/73/67/243297367.db2.gz VNZHHFQRTXDNJZ-MFKMUULPSA-N 1 1 334.294 2.349 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000451896997 243297372 /nfs/dbraw/zinc/29/73/72/243297372.db2.gz VNZHHFQRTXDNJZ-MFKMUULPSA-N 1 1 334.294 2.349 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000266222711 248185336 /nfs/dbraw/zinc/18/53/36/248185336.db2.gz IBIJZUFLAWIVQL-OCCSQVGLSA-N 1 1 334.420 2.121 10 5 EEBEMO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H](O)CN1CCCCC1)C1CC1 ZINC000151253517 285161345 /nfs/dbraw/zinc/16/13/45/285161345.db2.gz BPNGSVAMSSJAIE-ZWKOTPCHSA-N 1 1 347.459 2.352 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000113269557 220507120 /nfs/dbraw/zinc/50/71/20/220507120.db2.gz NVNXHVOZHUHUJR-GOEBONIOSA-N 1 1 346.431 2.400 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)c(F)c1 ZINC000270785156 256171878 /nfs/dbraw/zinc/17/18/78/256171878.db2.gz PYJUEYCBPFRDKD-CHWSQXEVSA-N 1 1 337.330 2.464 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)c(F)c1 ZINC000270785156 256171879 /nfs/dbraw/zinc/17/18/79/256171879.db2.gz PYJUEYCBPFRDKD-CHWSQXEVSA-N 1 1 337.330 2.464 10 5 EEBEMO C[C@H](Nc1ncc([N+](=O)[O-])cc1C(N)=O)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000273030827 256259081 /nfs/dbraw/zinc/25/90/81/256259081.db2.gz UYJRRWULNOZOOR-RYUDHWBXSA-N 1 1 347.419 2.154 10 5 EEBEMO C[C@@H]([C@@H]1Cc2ccccc2O1)[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090559616 159197975 /nfs/dbraw/zinc/19/79/75/159197975.db2.gz SUSDKPUWSFWSHI-GUYCJALGSA-N 1 1 343.383 2.081 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000246420174 160277968 /nfs/dbraw/zinc/27/79/68/160277968.db2.gz IGINUDVEFBGIRH-IKGGRYGDSA-N 1 1 336.388 2.242 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC000246420174 160277970 /nfs/dbraw/zinc/27/79/70/160277970.db2.gz IGINUDVEFBGIRH-IKGGRYGDSA-N 1 1 336.388 2.242 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000342004366 161031478 /nfs/dbraw/zinc/03/14/78/161031478.db2.gz YEJBWJNPZKDRBY-SUMWQHHRSA-N 1 1 333.388 2.424 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](CO)c1ccsc1 ZINC000352022971 162032992 /nfs/dbraw/zinc/03/29/92/162032992.db2.gz SNAFDJKYXREUEU-CQSZACIVSA-N 1 1 335.385 2.226 10 5 EEBEMO O=C(c1cc(O)cc([N+](=O)[O-])c1)N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000272541197 268989559 /nfs/dbraw/zinc/98/95/59/268989559.db2.gz NZAMIWJFVUYREQ-AWEZNQCLSA-N 1 1 333.388 2.391 10 5 EEBEMO COCCO[C@@H]1C[C@H](CO)C[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000278382114 269228306 /nfs/dbraw/zinc/22/83/06/269228306.db2.gz UKAYVEVAULUSRU-JKIFEVAISA-N 1 1 338.404 2.002 10 5 EEBEMO COc1ccc(NC(=O)C[N@H+](C(C)C)[C@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000291652310 275326741 /nfs/dbraw/zinc/32/67/41/275326741.db2.gz FIPHSWAGILRSNV-LBPRGKRZSA-N 1 1 337.376 2.041 10 5 EEBEMO COc1ccc(NC(=O)C[N@@H+](C(C)C)[C@H]2CCOC2)c([N+](=O)[O-])c1 ZINC000291652310 275326743 /nfs/dbraw/zinc/32/67/43/275326743.db2.gz FIPHSWAGILRSNV-LBPRGKRZSA-N 1 1 337.376 2.041 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@@H](C(=O)N3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000347453833 465030630 /nfs/dbraw/zinc/03/06/30/465030630.db2.gz MPJQWXDINNRADH-CQSZACIVSA-N 1 1 333.388 2.048 10 5 EEBEMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC[N@H+]1C ZINC000358698691 465271747 /nfs/dbraw/zinc/27/17/47/465271747.db2.gz MBDLZUDOKBKFNR-JQWIXIFHSA-N 1 1 341.795 2.226 10 5 EEBEMO CCOCC[N@@H+]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000125508456 463552069 /nfs/dbraw/zinc/55/20/69/463552069.db2.gz PXZHPVLCNFBIHW-LBPRGKRZSA-N 1 1 341.383 2.290 10 5 EEBEMO CCOCC[N@H+]1CCN(c2cc(OC)c(F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000125508456 463552073 /nfs/dbraw/zinc/55/20/73/463552073.db2.gz PXZHPVLCNFBIHW-LBPRGKRZSA-N 1 1 341.383 2.290 10 5 EEBEMO COc1ccc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)cc1[N+](=O)[O-] ZINC000109818965 463650796 /nfs/dbraw/zinc/65/07/96/463650796.db2.gz QLEZEJJDBKLBHS-INIZCTEOSA-N 1 1 349.431 2.290 10 5 EEBEMO CC[C@H]1CN(c2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000110560535 463659665 /nfs/dbraw/zinc/65/96/65/463659665.db2.gz XCKFZYVINOASLR-LBPRGKRZSA-N 1 1 338.364 2.050 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@H](C)C1 ZINC000194450621 463865181 /nfs/dbraw/zinc/86/51/81/463865181.db2.gz XDLMZROEAQHNOQ-TZMCWYRMSA-N 1 1 335.404 2.406 10 5 EEBEMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CCC[N@H+](C2CC2)CC1 ZINC000172114112 463991310 /nfs/dbraw/zinc/99/13/10/463991310.db2.gz NKEGZEVCGZQPQR-UHFFFAOYSA-N 1 1 337.807 2.487 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CC2)CC1 ZINC000172347186 464059878 /nfs/dbraw/zinc/05/98/78/464059878.db2.gz XGXABIYXZZFDKD-ZDUSSCGKSA-N 1 1 332.404 2.092 10 5 EEBEMO Cn1cc(C[N@@H+](C)CC2(CO)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000188958613 464403765 /nfs/dbraw/zinc/40/37/65/464403765.db2.gz VUMQORGECVINGX-UHFFFAOYSA-N 1 1 330.388 2.200 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000175007358 464479539 /nfs/dbraw/zinc/47/95/39/464479539.db2.gz RQXNUSHSVLUMER-GXTWGEPZSA-N 1 1 333.388 2.302 10 5 EEBEMO O=[N+]([O-])c1ccn(CC[N@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)n1 ZINC000176228826 464725793 /nfs/dbraw/zinc/72/57/93/464725793.db2.gz GZGBKFFZNJJXQX-ZDUSSCGKSA-N 1 1 330.344 2.357 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCCCNc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000298744224 465490569 /nfs/dbraw/zinc/49/05/69/465490569.db2.gz YBYRCUWACHUYII-GFCCVEGCSA-N 1 1 335.408 2.155 10 5 EEBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(c2ncc([N+](=O)[O-])s2)C1 ZINC000192541766 464944714 /nfs/dbraw/zinc/94/47/14/464944714.db2.gz SMDRJAVOPXIQLN-ZDUSSCGKSA-N 1 1 333.417 2.405 10 5 EEBEMO COCC[N@H+]1CCCN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC000569098766 468438148 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347.371 2.319 10 5 EEBEMO Cc1ncccc1OC[C@H]1CCC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000419400568 467195419 /nfs/dbraw/zinc/19/54/19/467195419.db2.gz MQONSXYTPCFNDK-CQSZACIVSA-N 1 1 331.376 2.038 10 5 EEBEMO C[C@H]1C[NH2+]CC[C@@H]1NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414948087 467456776 /nfs/dbraw/zinc/45/67/76/467456776.db2.gz XLNZMCGWSCGGRW-LRDDRELGSA-N 1 1 329.404 2.083 10 5 EEBEMO COC(=O)Cc1ccc(NCC[N@@H+]2CC=C(C)CC2)c([N+](=O)[O-])c1 ZINC000450434961 467850033 /nfs/dbraw/zinc/85/00/33/467850033.db2.gz CPECPSNYSRBXQA-UHFFFAOYSA-N 1 1 333.388 2.374 10 5 EEBEMO C[C@H]1CN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)CC[N@H+]1CCO ZINC000490047367 468189534 /nfs/dbraw/zinc/18/95/34/468189534.db2.gz SLSWNULGGPXASN-ZDUSSCGKSA-N 1 1 337.420 2.275 10 5 EEBEMO CN(CC(=O)NC[C@H]1CC[N@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000600473947 468568506 /nfs/dbraw/zinc/56/85/06/468568506.db2.gz VECBRXZMHJNYIT-OAHLLOKOSA-N 1 1 346.431 2.164 10 5 EEBEMO C[C@@H]1C[N@H+](CCCCNc2ncc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000601127485 468752750 /nfs/dbraw/zinc/75/27/50/468752750.db2.gz HMOYNKDENTZXDQ-TXEJJXNPSA-N 1 1 326.372 2.430 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])s1)N1CC[NH+](C[C@@H]2C[C@H]3C[C@H]3C2)CC1 ZINC000595297284 468804441 /nfs/dbraw/zinc/80/44/41/468804441.db2.gz LGLLLOQUNJTUGF-CLLJXQQHSA-N 1 1 335.429 2.460 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc2c(cc1[N+](=O)[O-])OCO2 ZINC000593208989 468904762 /nfs/dbraw/zinc/90/47/62/468904762.db2.gz DDEBXMFMLOWASF-UHFFFAOYSA-N 1 1 337.376 2.031 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000593356841 468949569 /nfs/dbraw/zinc/94/95/69/468949569.db2.gz UKGSUNVBZBDSBJ-UHFFFAOYSA-N 1 1 336.436 2.414 10 5 EEBEMO C[C@@]12COC[C@]1(C)C[N@@H+]([C@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)C2 ZINC000595687860 468956356 /nfs/dbraw/zinc/95/63/56/468956356.db2.gz DMDSGYYUVUSIIB-RYQLBKOJSA-N 1 1 345.399 2.059 10 5 EEBEMO O=[N+]([O-])c1ccc(CC[N@@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1 ZINC000602729556 469038383 /nfs/dbraw/zinc/03/83/83/469038383.db2.gz VWQXQJRLCJXRSH-QZTJIDSGSA-N 1 1 328.368 2.261 10 5 EEBEMO COc1cc(N2CC[NH+](C[C@@H]3CCCO3)CC2)c([N+](=O)[O-])cc1F ZINC000610714031 469046922 /nfs/dbraw/zinc/04/69/22/469046922.db2.gz DXMJCZJZQGMUCY-LBPRGKRZSA-N 1 1 339.367 2.044 10 5 EEBEMO C[C@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599082374 469110253 /nfs/dbraw/zinc/11/02/53/469110253.db2.gz QBKBPZJIKNOSEV-DZGCQCFKSA-N 1 1 342.399 2.442 10 5 EEBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@H]3COCC[C@H]31)OCCO2 ZINC000611285347 469220448 /nfs/dbraw/zinc/22/04/48/469220448.db2.gz GKDUTKPHNQSUES-GXTWGEPZSA-N 1 1 334.372 2.367 10 5 EEBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1c2ccccc2ncc1[N+](=O)[O-] ZINC000596362905 469251516 /nfs/dbraw/zinc/25/15/16/469251516.db2.gz PUKYTOZDOXQYJO-AWEZNQCLSA-N 1 1 345.447 2.249 10 5 EEBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1c2ccccc2ncc1[N+](=O)[O-] ZINC000596362905 469251520 /nfs/dbraw/zinc/25/15/20/469251520.db2.gz PUKYTOZDOXQYJO-AWEZNQCLSA-N 1 1 345.447 2.249 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+](C3CCN(C)CC3)C2)n1 ZINC000611616379 469293197 /nfs/dbraw/zinc/29/31/97/469293197.db2.gz JKAGUVUXSVHHJB-AWEZNQCLSA-N 1 1 333.436 2.187 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@H+](C3CCN(C)CC3)C2)n1 ZINC000611616379 469293201 /nfs/dbraw/zinc/29/32/01/469293201.db2.gz JKAGUVUXSVHHJB-AWEZNQCLSA-N 1 1 333.436 2.187 10 5 EEBEMO COC(=O)[C@@](C)(NCC[C@@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000599647210 469322650 /nfs/dbraw/zinc/32/26/50/469322650.db2.gz AFUDINDOOQMZES-YOEHRIQHSA-N 1 1 335.404 2.057 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@@H](OC(F)F)C1 ZINC000612121951 469399867 /nfs/dbraw/zinc/39/98/67/469399867.db2.gz YIBUAXZZNBIBBU-VXGBXAGGSA-N 1 1 346.330 2.038 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CC[C@H]4COC[C@H]4C3)o2)cc1 ZINC000595829859 485609834 /nfs/dbraw/zinc/60/98/34/485609834.db2.gz IWKDBHDWVVBUMK-QWHCGFSZSA-N 1 1 330.344 2.113 10 5 EEBEMO CC[C@H]1[C@@H](CO)CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000451253858 536181532 /nfs/dbraw/zinc/18/15/32/536181532.db2.gz KEWDSWOUIKNAHN-CJNGLKHVSA-N 1 1 335.404 2.325 10 5 EEBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591527 577463643 /nfs/dbraw/zinc/46/36/43/577463643.db2.gz IUOPSDFXFQUQGF-HIFRSBDPSA-N 1 1 336.388 2.292 10 5 EEBEMO CC(C)C[N@H+]1CCO[C@@H](COC(=O)c2cc(F)cc([N+](=O)[O-])c2)C1 ZINC000741118414 578113082 /nfs/dbraw/zinc/11/30/82/578113082.db2.gz QLQIOHQKAJKJAD-OAHLLOKOSA-N 1 1 340.351 2.248 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000928433656 683113479 /nfs/dbraw/zinc/11/34/79/683113479.db2.gz AWPYVXULJNUTBD-SCZZXKLOSA-N 1 1 329.303 2.019 10 5 EEBEMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CC[C@@H]2CCCC[N@@H+]12 ZINC000899988141 693954977 /nfs/dbraw/zinc/95/49/77/693954977.db2.gz YSDLEULSXMHERT-XJKSGUPXSA-N 1 1 332.404 2.140 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc4ccccc4c([N+](=O)[O-])c3N)[C@H]2C1 ZINC000897825868 691793798 /nfs/dbraw/zinc/79/37/98/691793798.db2.gz QLXNTWYTPWHWKE-DOMZBBRYSA-N 1 1 340.383 2.106 10 5 EEBEMO CCO[C@@H](CN[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])C[NH+](C)C ZINC000926958587 693043838 /nfs/dbraw/zinc/04/38/38/693043838.db2.gz GWCNJMGHSJVANJ-DOMZBBRYSA-N 1 1 327.400 2.221 10 5 EEBEMO Cc1ccc(CC[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)cc1 ZINC001269545597 1184370370 /nfs/dbraw/zinc/37/03/70/1184370370.db2.gz WIVKYULUZMQGKU-IAGOWNOFSA-N 1 1 345.443 2.221 10 5 EEBEMO CCN(CC[NH2+]Cc1cccc(F)c1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001273374563 1198391859 /nfs/dbraw/zinc/39/18/59/1198391859.db2.gz JZSJNNKVVFYQGH-DGCLKSJQSA-N 1 1 343.786 2.082 10 5 EEBEMO C[NH+]1CCC2(CCN(C(=O)c3cc(O)cc([N+](=O)[O-])c3)CC2)CC1 ZINC000870508039 1200714920 /nfs/dbraw/zinc/71/49/20/1200714920.db2.gz PDTCQDOZMRVYRB-UHFFFAOYSA-N 1 1 333.388 2.248 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[N@@H+](C)C(C)(C)CC1 ZINC000866110059 1201435129 /nfs/dbraw/zinc/43/51/29/1201435129.db2.gz QDRJTPDNUDEZRF-UHFFFAOYSA-N 1 1 335.330 2.268 10 5 EEBEMO COC(=O)c1cc(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)cc(C)c1[N+](=O)[O-] ZINC000866204812 1201463924 /nfs/dbraw/zinc/46/39/24/1201463924.db2.gz GHKHUFCKSIUHPX-SWLSCSKDSA-N 1 1 333.388 2.220 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928434565 1206382982 /nfs/dbraw/zinc/38/29/82/1206382982.db2.gz JCHVBALVUYSMMQ-IUODEOHRSA-N 1 1 340.383 2.479 10 5 EEBEMO O=C(CCC(F)F)N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21 ZINC001491320622 1258949717 /nfs/dbraw/zinc/94/97/17/1258949717.db2.gz IVBYNVOLYPPEKB-VIKVFOODSA-N 1 1 339.342 2.187 10 5 EEBEMO Cc1nc2c(c(=O)[nH]1)C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001196638009 1284173700 /nfs/dbraw/zinc/17/37/00/1284173700.db2.gz FAVODZDOKKHRGU-UHFFFAOYSA-N 1 1 330.344 2.184 10 5 EEBEMO Cc1nc2c(c(=O)[nH]1)C[N@@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC001196638009 1284173708 /nfs/dbraw/zinc/17/37/08/1284173708.db2.gz FAVODZDOKKHRGU-UHFFFAOYSA-N 1 1 330.344 2.184 10 5 EEBEMO C[C@@H]([NH2+]CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1)c1ccns1 ZINC000860057920 1294782424 /nfs/dbraw/zinc/78/24/24/1294782424.db2.gz CFDWKCCOJKXSGL-SNVBAGLBSA-N 1 1 341.414 2.176 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)n1 ZINC001142264594 1315540746 /nfs/dbraw/zinc/54/07/46/1315540746.db2.gz UUSOTPNFYIVUAS-INIZCTEOSA-N 1 1 326.356 2.085 10 5 EEBEMO O=C(NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)C1(C(F)F)CC1 ZINC001318123405 1332475135 /nfs/dbraw/zinc/47/51/35/1332475135.db2.gz XTSYDNSINMSCIV-UHFFFAOYSA-N 1 1 339.342 2.188 10 5 EEBEMO CCc1nc(C)c(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)o1 ZINC001492484135 1332569764 /nfs/dbraw/zinc/56/97/64/1332569764.db2.gz NGALXYAGXBZSQR-UHFFFAOYSA-N 1 1 346.387 2.315 10 5 EEBEMO CCc1nc(C)c(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)o1 ZINC001492484135 1332569766 /nfs/dbraw/zinc/56/97/66/1332569766.db2.gz NGALXYAGXBZSQR-UHFFFAOYSA-N 1 1 346.387 2.315 10 5 EEBEMO C[C@@H]1C[C@@H]2CC[C@H](C(=O)NCCNc3ccc([N+](=O)[O-])cc3)C[N@H+]2C1 ZINC001347261783 1337500844 /nfs/dbraw/zinc/50/08/44/1337500844.db2.gz IYOAMTDCDFYAIM-KEYYUXOJSA-N 1 1 346.431 2.243 10 5 EEBEMO C[N@@H+]1C[C@H]2CN(C(=O)c3cc([N+](=O)[O-])cc4ccccc43)C[C@H]2C1 ZINC001351530569 1337823342 /nfs/dbraw/zinc/82/33/42/1337823342.db2.gz CMTGMTQOHFKGAY-OKILXGFUSA-N 1 1 325.368 2.382 10 5 EEBEMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC001611460352 1352301071 /nfs/dbraw/zinc/30/10/71/1352301071.db2.gz JLWUYXXOCBHAPV-LLVKDONJSA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC001611460352 1352301073 /nfs/dbraw/zinc/30/10/73/1352301073.db2.gz JLWUYXXOCBHAPV-LLVKDONJSA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@@H]1[C@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001616328104 1352327745 /nfs/dbraw/zinc/32/77/45/1352327745.db2.gz JAGJUNRVIDZZOL-AZGDMVHKSA-N 1 1 331.416 2.162 10 5 EEBEMO C[C@@H]1[C@H](C)[N@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001616328104 1352327748 /nfs/dbraw/zinc/32/77/48/1352327748.db2.gz JAGJUNRVIDZZOL-AZGDMVHKSA-N 1 1 331.416 2.162 10 5 EEBEMO C[C@@H]1[C@H](C)[N@@H+](Cc2ccccc2)[C@@H](C)CN1C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001616328104 1352327750 /nfs/dbraw/zinc/32/77/50/1352327750.db2.gz JAGJUNRVIDZZOL-AZGDMVHKSA-N 1 1 331.416 2.162 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cnco1 ZINC001570204290 1343032057 /nfs/dbraw/zinc/03/20/57/1343032057.db2.gz LTFSVLGHRSVZTI-UHFFFAOYSA-N 1 1 332.360 2.177 10 5 EEBEMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@H+](C)[C@H](C)C1 ZINC001627866655 1352511935 /nfs/dbraw/zinc/51/19/35/1352511935.db2.gz JPHFWRDJMTYQFA-MNOVXSKESA-N 1 1 341.795 2.178 10 5 EEBEMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N1CC[N@@H+](C)[C@H](C)C1 ZINC001627866655 1352511938 /nfs/dbraw/zinc/51/19/38/1352511938.db2.gz JPHFWRDJMTYQFA-MNOVXSKESA-N 1 1 341.795 2.178 10 5 EEBEMO O=C1N[C@H](C2CC[NH+](Cc3nc4cc([N+](=O)[O-])ccc4o3)CC2)CO1 ZINC001656328960 1354223762 /nfs/dbraw/zinc/22/37/62/1354223762.db2.gz SJHPYEMKVWSVSU-ZDUSSCGKSA-N 1 1 346.343 2.056 10 5 EEBEMO CCC1(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CCOCC1 ZINC001663304539 1354946659 /nfs/dbraw/zinc/94/66/59/1354946659.db2.gz KWSLEEDMAXNRAI-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C(=O)C(C)(C)C ZINC001673425273 1355032223 /nfs/dbraw/zinc/03/22/23/1355032223.db2.gz FKTHAFBPFGCFDS-UHFFFAOYSA-N 1 1 349.431 2.490 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)CC1(O)CCC1 ZINC001673434039 1356690376 /nfs/dbraw/zinc/69/03/76/1356690376.db2.gz CAYZTULSWAHIQA-UHFFFAOYSA-N 1 1 349.431 2.180 10 5 EEBEMO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001699689477 1405443176 /nfs/dbraw/zinc/44/31/76/1405443176.db2.gz UNXNMQZRWMWQCW-IAGOWNOFSA-N 1 1 335.448 2.321 10 5 EEBEMO CC(C)=CC[N@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001699689477 1405443179 /nfs/dbraw/zinc/44/31/79/1405443179.db2.gz UNXNMQZRWMWQCW-IAGOWNOFSA-N 1 1 335.448 2.321 10 5 EEBEMO CC(C)=CC[N@@H+](CC1CC1)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001699689477 1405443185 /nfs/dbraw/zinc/44/31/85/1405443185.db2.gz UNXNMQZRWMWQCW-IAGOWNOFSA-N 1 1 335.448 2.321 10 5 EEBEMO O=C1C[C@@]2(CC[N@@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=S)C2)CN1 ZINC000788382319 807507923 /nfs/dbraw/zinc/50/79/23/807507923.db2.gz KNDVTISXDUMURH-HNNXBMFYSA-N 1 1 348.384 2.041 10 5 EEBEMO O=C1C[C@@]2(CC[N@H+](Cn3c4cc([N+](=O)[O-])ccc4oc3=S)C2)CN1 ZINC000788382319 807507927 /nfs/dbraw/zinc/50/79/27/807507927.db2.gz KNDVTISXDUMURH-HNNXBMFYSA-N 1 1 348.384 2.041 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)N1CCC[N@H+](C2CCCC2)CC1 ZINC001565946390 1125470846 /nfs/dbraw/zinc/47/08/46/1125470846.db2.gz RRZVLFMLTSFRAL-UHFFFAOYSA-N 1 1 332.404 2.268 10 5 EEBEMO Cc1ccccc1C[N@@H+]1CCCN(c2nn(C)cc2[N+](=O)[O-])CC1 ZINC001458098826 1109832188 /nfs/dbraw/zinc/83/21/88/1109832188.db2.gz VEOIDMZHOKVOMD-UHFFFAOYSA-N 1 1 329.404 2.349 10 5 EEBEMO 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325.369 2.445 10 5 EEBEMO O=[N+]([O-])c1cc2c(ncnc2N[C@H]2CCC[N@@H+](CCF)C2)s1 ZINC000865928430 1198426744 /nfs/dbraw/zinc/42/67/44/1198426744.db2.gz XUEOANOKQVWVCQ-VIFPVBQESA-N 1 1 325.369 2.445 10 5 EEBEMO O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCC[N@H+](CCF)C3)cc2N1 ZINC000865928029 1198427054 /nfs/dbraw/zinc/42/70/54/1198427054.db2.gz OGJVGJZIHDQFOE-LBPRGKRZSA-N 1 1 336.367 2.325 10 5 EEBEMO O=C1CCc2cc([N+](=O)[O-])c(N[C@H]3CCC[N@@H+](CCF)C3)cc2N1 ZINC000865928029 1198427059 /nfs/dbraw/zinc/42/70/59/1198427059.db2.gz OGJVGJZIHDQFOE-LBPRGKRZSA-N 1 1 336.367 2.325 10 5 EEBEMO CC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000812878504 1200963967 /nfs/dbraw/zinc/96/39/67/1200963967.db2.gz BNZNQGFGEHBCAZ-LLVKDONJSA-N 1 1 327.768 2.298 10 5 EEBEMO CC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000812878504 1200963970 /nfs/dbraw/zinc/96/39/70/1200963970.db2.gz BNZNQGFGEHBCAZ-LLVKDONJSA-N 1 1 327.768 2.298 10 5 EEBEMO C[C@H](COC(=O)c1ccc(C[N@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N+](=O)[O-] ZINC000813106651 1201116373 /nfs/dbraw/zinc/11/63/73/1201116373.db2.gz FPEFRFBIASRWKA-MCIONIFRSA-N 1 1 336.388 2.118 10 5 EEBEMO C[C@H](COC(=O)c1ccc(C[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cc1)[N+](=O)[O-] ZINC000813106651 1201116377 /nfs/dbraw/zinc/11/63/77/1201116377.db2.gz FPEFRFBIASRWKA-MCIONIFRSA-N 1 1 336.388 2.118 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(c3c(Br)cncc3[N+](=O)[O-])CC[C@H]21 ZINC000866207447 1201464829 /nfs/dbraw/zinc/46/48/29/1201464829.db2.gz IXTPQSWJIRODOU-MWLCHTKSSA-N 1 1 341.209 2.283 10 5 EEBEMO C[C@@H]1CC[C@H](CO)[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000880438486 1201488847 /nfs/dbraw/zinc/48/88/47/1201488847.db2.gz JXHCWGAPAWVXQX-MWLCHTKSSA-N 1 1 327.768 2.032 10 5 EEBEMO C[C@@H]1CC[C@H](CO)[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000880438486 1201488848 /nfs/dbraw/zinc/48/88/48/1201488848.db2.gz JXHCWGAPAWVXQX-MWLCHTKSSA-N 1 1 327.768 2.032 10 5 EEBEMO O=[N+]([O-])c1ccc(CN2CCC([N@H+]3CCCOCC3)CC2)c(F)c1 ZINC000931288489 1206622285 /nfs/dbraw/zinc/62/22/85/1206622285.db2.gz LHEXRXLOYMPWNB-UHFFFAOYSA-N 1 1 337.395 2.421 10 5 EEBEMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000802142115 1236988153 /nfs/dbraw/zinc/98/81/53/1236988153.db2.gz WRGPIQGACUUPBX-CJNGLKHVSA-N 1 1 336.388 2.351 10 5 EEBEMO O=[N+]([O-])c1ccc(CN2C[C@H]3CC[C@@H](C2)N3C2CC[NH2+]CC2)c(F)c1 ZINC000903508602 1240728481 /nfs/dbraw/zinc/72/84/81/1240728481.db2.gz NPKOAOLQRKLFDQ-CALCHBBNSA-N 1 1 348.422 2.135 10 5 EEBEMO CCN(C(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000855360833 1293188980 /nfs/dbraw/zinc/18/89/80/1293188980.db2.gz PCBYVIXERDZBAK-LLVKDONJSA-N 1 1 343.786 2.482 10 5 EEBEMO CCN(C(=O)COc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000855490723 1293230189 /nfs/dbraw/zinc/23/01/89/1293230189.db2.gz KMFVAVCRDLHCSH-LBPRGKRZSA-N 1 1 339.367 2.055 10 5 EEBEMO CCN(C(=O)COc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CC[N@@H+](CC)C1 ZINC000855490722 1293230933 /nfs/dbraw/zinc/23/09/33/1293230933.db2.gz KMFVAVCRDLHCSH-GFCCVEGCSA-N 1 1 339.367 2.055 10 5 EEBEMO CC[C@H]1[C@H](CO)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610596 1315219769 /nfs/dbraw/zinc/21/97/69/1315219769.db2.gz OYGIRJKRZGAGGR-GWCFXTLKSA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@H]1[C@H](CO)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610596 1315219776 /nfs/dbraw/zinc/21/97/76/1315219776.db2.gz OYGIRJKRZGAGGR-GWCFXTLKSA-N 1 1 341.795 2.280 10 5 EEBEMO CCc1[nH+]ccn1CCNC(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001303469445 1331355527 /nfs/dbraw/zinc/35/55/27/1331355527.db2.gz GJWWSDVOJAJBDK-UHFFFAOYSA-N 1 1 327.344 2.265 10 5 EEBEMO CC[N@@H+](CCCNC(=O)C1CCOCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001316883707 1331950445 /nfs/dbraw/zinc/95/04/45/1331950445.db2.gz INTGESXANVCRJW-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO Cc1cnccc1CC(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001317445840 1332245135 /nfs/dbraw/zinc/24/51/35/1332245135.db2.gz LMXIRLOKKKPHFR-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO Cc1cnccc1CC(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001317445840 1332245136 /nfs/dbraw/zinc/24/51/36/1332245136.db2.gz LMXIRLOKKKPHFR-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO C[N@H+](CCNC(=O)c1ccc(Cl)[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001317458877 1332251434 /nfs/dbraw/zinc/25/14/34/1332251434.db2.gz FIGZBDLNKZAPML-UHFFFAOYSA-N 1 1 336.779 2.438 10 5 EEBEMO C[N@@H+](CCNC(=O)c1ccc(Cl)[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001317458877 1332251436 /nfs/dbraw/zinc/25/14/36/1332251436.db2.gz FIGZBDLNKZAPML-UHFFFAOYSA-N 1 1 336.779 2.438 10 5 EEBEMO O=C(CCCF)N1C[C@@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@@H]2C1 ZINC001325751344 1333953175 /nfs/dbraw/zinc/95/31/75/1333953175.db2.gz ICDPPFFBIFYSOA-GASCZTMLSA-N 1 1 335.379 2.235 10 5 EEBEMO C[N@H+](C[C@@H]1CCCCO1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474623 1338704904 /nfs/dbraw/zinc/70/49/04/1338704904.db2.gz FIGDGMUALOTQLK-DLBZAZTESA-N 1 1 347.415 2.369 10 5 EEBEMO C[N@@H+](C[C@@H]1CCCCO1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474623 1338704909 /nfs/dbraw/zinc/70/49/09/1338704909.db2.gz FIGDGMUALOTQLK-DLBZAZTESA-N 1 1 347.415 2.369 10 5 EEBEMO COC(=O)[C@@H]1CC[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)[C@H](C)C1 ZINC001620605218 1352361023 /nfs/dbraw/zinc/36/10/23/1352361023.db2.gz CNXJZDMZSDNUHB-CHWSQXEVSA-N 1 1 349.387 2.197 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2CCC[C@H](CCO)C2)o1 ZINC001653319415 1354120814 /nfs/dbraw/zinc/12/08/14/1354120814.db2.gz HQGKMQAJZKUSMD-GFCCVEGCSA-N 1 1 332.360 2.239 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](CCO)C2)o1 ZINC001653319415 1354120815 /nfs/dbraw/zinc/12/08/15/1354120815.db2.gz HQGKMQAJZKUSMD-GFCCVEGCSA-N 1 1 332.360 2.239 10 5 EEBEMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001654649178 1354154626 /nfs/dbraw/zinc/15/46/26/1354154626.db2.gz FVVUXQYWSMUOBT-NSHDSACASA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001654649178 1354154629 /nfs/dbraw/zinc/15/46/29/1354154629.db2.gz FVVUXQYWSMUOBT-NSHDSACASA-N 1 1 328.372 2.385 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(F)nc1 ZINC001667546230 1355757968 /nfs/dbraw/zinc/75/79/68/1355757968.db2.gz VIAJKMIIBYNLGQ-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(F)nc1 ZINC001667546230 1355757971 /nfs/dbraw/zinc/75/79/71/1355757971.db2.gz VIAJKMIIBYNLGQ-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO Cc1cccc(Cl)c1C[NH2+]C/C=C\CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001668822006 1356012772 /nfs/dbraw/zinc/01/27/72/1356012772.db2.gz UTFUWFDEJBEUEU-QADGWQRPSA-N 1 1 337.807 2.076 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC001135672580 784224465 /nfs/dbraw/zinc/22/44/65/784224465.db2.gz BRNDXOPBSKPYCX-INIZCTEOSA-N 1 1 334.420 2.243 10 5 EEBEMO CC(C)(C)[N@@H+]1CC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911474191 787467724 /nfs/dbraw/zinc/46/77/24/787467724.db2.gz WDEAZOQUHYYQDE-GFCCVEGCSA-N 1 1 327.331 2.362 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911474191 787467730 /nfs/dbraw/zinc/46/77/30/787467730.db2.gz WDEAZOQUHYYQDE-GFCCVEGCSA-N 1 1 327.331 2.362 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H](NC(=O)c2cc(Cl)c(N)c([N+](=O)[O-])c2)C1 ZINC001147111879 791708200 /nfs/dbraw/zinc/70/82/00/791708200.db2.gz RYBWHGBWHZCSGI-SNVBAGLBSA-N 1 1 340.811 2.433 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C ZINC000921839161 796901571 /nfs/dbraw/zinc/90/15/71/796901571.db2.gz XVKFMHYODWLPHK-GWCFXTLKSA-N 1 1 340.811 2.183 10 5 EEBEMO Cc1ccc(NC(=O)C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1 ZINC001175323789 798076170 /nfs/dbraw/zinc/07/61/70/798076170.db2.gz PHNIMMOZVBNIMZ-SFHVURJKSA-N 1 1 343.383 2.339 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C ZINC000828133619 800609095 /nfs/dbraw/zinc/60/90/95/800609095.db2.gz BGQRDYZFLVMPAD-HUUCEWRRSA-N 1 1 347.415 2.132 10 5 EEBEMO C[C@@H]1Cc2n[nH]cc2C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001460781108 1110323781 /nfs/dbraw/zinc/32/37/81/1110323781.db2.gz WWAAOSHBLHBLFV-GFCCVEGCSA-N 1 1 343.387 2.341 10 5 EEBEMO CC[N@H+]1CCC[C@H](NC(=O)Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001472023058 1110538549 /nfs/dbraw/zinc/53/85/49/1110538549.db2.gz WIQMNJQILDTOOD-LBPRGKRZSA-N 1 1 325.796 2.391 10 5 EEBEMO CNC(=O)c1ccc(NCCn2cc[nH+]c2C(C)C)c([N+](=O)[O-])c1 ZINC001472880922 1110565000 /nfs/dbraw/zinc/56/50/00/1110565000.db2.gz FROMFYLTJCPLFO-UHFFFAOYSA-N 1 1 331.376 2.386 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC001473599720 1110577454 /nfs/dbraw/zinc/57/74/54/1110577454.db2.gz QIMLKTQFQSFRPC-BETUJISGSA-N 1 1 335.404 2.296 10 5 EEBEMO C[N@@H+](CCCC(C)(C)C)C1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001506957491 1115005269 /nfs/dbraw/zinc/00/52/69/1115005269.db2.gz PXOFHXKFOFOEES-HUUCEWRRSA-N 1 1 325.453 2.401 10 5 EEBEMO C[N@H+](CCCC(C)(C)C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001506957491 1115005271 /nfs/dbraw/zinc/00/52/71/1115005271.db2.gz PXOFHXKFOFOEES-HUUCEWRRSA-N 1 1 325.453 2.401 10 5 EEBEMO C[N@@H+](CCCC(C)(C)C)C1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001506957491 1115005272 /nfs/dbraw/zinc/00/52/72/1115005272.db2.gz PXOFHXKFOFOEES-HUUCEWRRSA-N 1 1 325.453 2.401 10 5 EEBEMO CC(C)(CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[NH+]1CCCCC1 ZINC000066000200 215003081 /nfs/dbraw/zinc/00/30/81/215003081.db2.gz MDAYCKUEZNBEHN-UHFFFAOYSA-N 1 1 347.462 2.199 10 5 EEBEMO CCOC(=O)[C@H]1C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC12COC2 ZINC000451131897 243009814 /nfs/dbraw/zinc/00/98/14/243009814.db2.gz HSPXDFVUVLBQFR-CZUORRHYSA-N 1 1 348.399 2.476 10 5 EEBEMO CC[C@@H]1CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000245773450 243153705 /nfs/dbraw/zinc/15/37/05/243153705.db2.gz SGCAHHUXTSJHHZ-FJVHFBRSSA-N 1 1 333.432 2.385 10 5 EEBEMO COc1ccc(CN2CCC([N@H+]3CCO[C@H](C)C3)CC2)cc1[N+](=O)[O-] ZINC000079489377 217232814 /nfs/dbraw/zinc/23/28/14/217232814.db2.gz NWHGMTKWTPEGMM-CQSZACIVSA-N 1 1 349.431 2.289 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000052950834 292136704 /nfs/dbraw/zinc/13/67/04/292136704.db2.gz UQLWZDWKRXWLOE-HNNXBMFYSA-N 1 1 344.371 2.458 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076492473 159087304 /nfs/dbraw/zinc/08/73/04/159087304.db2.gz QDKHGHUAVMVAPE-ZIAGYGMSSA-N 1 1 335.404 2.162 10 5 EEBEMO CCOc1ccc(NC(=O)C[N@@H+](C[C@H](C)O)C(C)C)c([N+](=O)[O-])c1 ZINC000107044109 159326617 /nfs/dbraw/zinc/32/66/17/159326617.db2.gz HIHHGNLCYZYCCK-LBPRGKRZSA-N 1 1 339.392 2.023 10 5 EEBEMO CCOCC[N@H+]1CCN(c2c([N+](=O)[O-])c(C)nn2CC)C[C@H]1CC ZINC000192568504 160172013 /nfs/dbraw/zinc/17/20/13/160172013.db2.gz OMVHRBHXSGELIB-CQSZACIVSA-N 1 1 339.440 2.057 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247284718 160318634 /nfs/dbraw/zinc/31/86/34/160318634.db2.gz GBZWDMHODIRRQP-BBRMVZONSA-N 1 1 335.404 2.162 10 5 EEBEMO CC(C)[C@H]1C[N@@H+](C)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000342280455 161053316 /nfs/dbraw/zinc/05/33/16/161053316.db2.gz MOUSDWDCWNDREO-OAHLLOKOSA-N 1 1 341.358 2.214 10 5 EEBEMO COc1cc(C[NH+]2CCC(NC(=O)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000351977683 162011013 /nfs/dbraw/zinc/01/10/13/162011013.db2.gz JGRLSBABXWDWGE-UHFFFAOYSA-N 1 1 335.404 2.340 10 5 EEBEMO CC[NH+]1CCN(C[C@@H](C)CNc2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000359079012 164052558 /nfs/dbraw/zinc/05/25/58/164052558.db2.gz AJYDIPAWYMCRJD-ZDUSSCGKSA-N 1 1 335.452 2.292 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000375345938 167116997 /nfs/dbraw/zinc/11/69/97/167116997.db2.gz WIINPBXEEGYRDE-MRXNPFEDSA-N 1 1 333.388 2.343 10 5 EEBEMO C[N@H+]1CC[C@]2(CCN(Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000292058947 275369589 /nfs/dbraw/zinc/36/95/89/275369589.db2.gz CIHZDQMCRTVWDJ-KRWDZBQOSA-N 1 1 343.387 2.172 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCOCC3)C2)n1 ZINC000336912506 280398669 /nfs/dbraw/zinc/39/86/69/280398669.db2.gz KFBMOGGJNRKWFR-OAHLLOKOSA-N 1 1 334.420 2.155 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)Cc2ccccc2[N+](=O)[O-])C[C@H]1CC ZINC000116768218 462773382 /nfs/dbraw/zinc/77/33/82/462773382.db2.gz XABYTEDEHTUXCH-MRXNPFEDSA-N 1 1 349.431 2.097 10 5 EEBEMO C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@@H+]1CCC[C@@H](C)C1 ZINC000066333455 462875709 /nfs/dbraw/zinc/87/57/09/462875709.db2.gz DRNNQXWATFGXSJ-MNOVXSKESA-N 1 1 347.462 2.055 10 5 EEBEMO C[C@@H](CNS(=O)(=O)c1ccc([N+](=O)[O-])s1)[N@H+]1CCC[C@@H](C)C1 ZINC000066333455 462875718 /nfs/dbraw/zinc/87/57/18/462875718.db2.gz DRNNQXWATFGXSJ-MNOVXSKESA-N 1 1 347.462 2.055 10 5 EEBEMO CCOC(=O)c1ccnc(NCC[N@H+]2CCCC[C@@H]2C)c1[N+](=O)[O-] ZINC000077928860 463072513 /nfs/dbraw/zinc/07/25/13/463072513.db2.gz MKMDLWMBEFFQQO-LBPRGKRZSA-N 1 1 336.392 2.453 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+]1CCCC[C@@H]1C ZINC000058561866 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ZINC000928093140 1206340779 /nfs/dbraw/zinc/34/07/79/1206340779.db2.gz LGAQXKLBWHFLCA-UONOGXRCSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@H]1C[C@@H]([NH2+]C/C=C\c2ccc(Cl)cc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001491017205 1258573474 /nfs/dbraw/zinc/57/34/74/1258573474.db2.gz DVHHHLHSHVYJLW-YCBWMULKSA-N 1 1 349.818 2.255 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(N[C@@H](C)C[N@H+](C)CCCN(C)C)c1 ZINC000853774897 1292447497 /nfs/dbraw/zinc/44/74/97/1292447497.db2.gz YRHOOOQMVBGXGN-LBPRGKRZSA-N 1 1 342.415 2.426 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c1 ZINC000853774897 1292447501 /nfs/dbraw/zinc/44/75/01/1292447501.db2.gz YRHOOOQMVBGXGN-LBPRGKRZSA-N 1 1 342.415 2.426 10 5 EEBEMO Cc1cccc(CCC[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)c1 ZINC001280480535 1324247515 /nfs/dbraw/zinc/24/75/15/1324247515.db2.gz RKTQWXAMWBQNRA-IAGOWNOFSA-N 1 1 345.443 2.221 10 5 EEBEMO Cc1cc(NC(=O)NCCOc2ccc([N+](=O)[O-])cc2)cc(C)[nH+]1 ZINC001322915429 1333352486 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/nfs/dbraw/zinc/49/78/49/1342497849.db2.gz FKHYFKCUOHZQDH-WDEREUQCSA-N 1 1 345.359 2.368 10 5 EEBEMO C[C@H]1C[C@@H](Nc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])CC[N@H+]1C ZINC001559122382 1342498177 /nfs/dbraw/zinc/49/81/77/1342498177.db2.gz FKHYFKCUOHZQDH-QWRGUYRKSA-N 1 1 345.359 2.368 10 5 EEBEMO O=C(NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1)C1(C2CC2)CC1 ZINC001567833131 1342848207 /nfs/dbraw/zinc/84/82/07/1342848207.db2.gz GRUOWWOXMXCYRS-UHFFFAOYSA-N 1 1 329.400 2.333 10 5 EEBEMO O=C(N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001624156935 1352415262 /nfs/dbraw/zinc/41/52/62/1352415262.db2.gz STYKDGQMLKDXSR-BRWVUGGUSA-N 1 1 331.416 2.213 10 5 EEBEMO O=C(N[C@@H]1CCCCC[N@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001624156935 1352415272 /nfs/dbraw/zinc/41/52/72/1352415272.db2.gz STYKDGQMLKDXSR-BRWVUGGUSA-N 1 1 331.416 2.213 10 5 EEBEMO O=C(N[C@@H]1CCCCC[N@@H+](Cc2ccccc2)C1)[C@@H]1CC1[N+](=O)[O-] ZINC001624156935 1352415275 /nfs/dbraw/zinc/41/52/75/1352415275.db2.gz STYKDGQMLKDXSR-BRWVUGGUSA-N 1 1 331.416 2.213 10 5 EEBEMO C[N@H+]1CCC[C@@H]1CNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N ZINC001633132519 1352606389 /nfs/dbraw/zinc/60/63/89/1352606389.db2.gz NNKANAWUFUNIRD-GFCCVEGCSA-N 1 1 328.372 2.154 10 5 EEBEMO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccc(N2CCNC2=O)cc1 ZINC001654824657 1354158694 /nfs/dbraw/zinc/15/86/94/1354158694.db2.gz GCGKJLDRBUIHQX-LBPRGKRZSA-N 1 1 341.371 2.370 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)CCc1ccc([N+](=O)[O-])cc1Cl ZINC000906675815 784072141 /nfs/dbraw/zinc/07/21/41/784072141.db2.gz GKSXCTVHXSRXAE-ZDUSSCGKSA-N 1 1 325.796 2.391 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(Cl)c(F)c([N+](=O)[O-])c3)[C@H]2C1 ZINC000908346860 785339444 /nfs/dbraw/zinc/33/94/44/785339444.db2.gz ILXBLGVRRPXUAE-PELKAZGASA-N 1 1 327.743 2.163 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3c[nH]c4cc([N+](=O)[O-])ccc34)C[C@@]2(C)C1 ZINC000913293392 788770805 /nfs/dbraw/zinc/77/08/05/788770805.db2.gz NROAGRZGMWMYMC-HDICACEKSA-N 1 1 342.399 2.490 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CC[C@@H](CCCO)C2)o1 ZINC001171118344 789013425 /nfs/dbraw/zinc/01/34/25/789013425.db2.gz JYAGLBNTYURVPG-GFCCVEGCSA-N 1 1 332.360 2.239 10 5 EEBEMO C[C@@H]1C(=O)N(C)[C@H](C)[C@H](C)[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001171559994 796639419 /nfs/dbraw/zinc/63/94/19/796639419.db2.gz CDKLCZJYOIPOQD-HZSPNIEDSA-N 1 1 335.404 2.303 10 5 EEBEMO C[C@@H]1C(=O)N(C)[C@H](C)[C@H](C)[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC001171559994 796639422 /nfs/dbraw/zinc/63/94/22/796639422.db2.gz CDKLCZJYOIPOQD-HZSPNIEDSA-N 1 1 335.404 2.303 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C(=O)N1C ZINC001171559995 796639567 /nfs/dbraw/zinc/63/95/67/796639567.db2.gz CDKLCZJYOIPOQD-MCIONIFRSA-N 1 1 335.404 2.303 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H](C)C(=O)N1C ZINC001171559995 796639572 /nfs/dbraw/zinc/63/95/72/796639572.db2.gz CDKLCZJYOIPOQD-MCIONIFRSA-N 1 1 335.404 2.303 10 5 EEBEMO Cc1conc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001566506623 1125675537 /nfs/dbraw/zinc/67/55/37/1125675537.db2.gz RKLDQKIOVBRPOK-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001545988761 1101290253 /nfs/dbraw/zinc/29/02/53/1101290253.db2.gz SDXDPNQAOMTXQR-ZDUSSCGKSA-N 1 1 334.420 2.275 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001493850597 1108734643 /nfs/dbraw/zinc/73/46/43/1108734643.db2.gz CNBUXIMQWSBVAW-UHFFFAOYSA-N 1 1 345.403 2.348 10 5 EEBEMO Cc1cc(NC(=O)NC[C@@H]2CC[N@H+]2C2CCOCC2)cc([N+](=O)[O-])c1 ZINC001517922029 1119047132 /nfs/dbraw/zinc/04/71/32/1119047132.db2.gz IYFOMXKPJCTCPV-HNNXBMFYSA-N 1 1 348.403 2.278 10 5 EEBEMO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000451919739 243316956 /nfs/dbraw/zinc/31/69/56/243316956.db2.gz ZYVLJSYFDVMIOH-GWCFXTLKSA-N 1 1 334.294 2.219 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@](O)(CO)C3)o2)c1 ZINC000459665006 245201197 /nfs/dbraw/zinc/20/11/97/245201197.db2.gz BMYUGOVBUAOMBD-QGZVFWFLSA-N 1 1 332.356 2.174 10 5 EEBEMO [NH3+][C@H]1CCCCCN1S(=O)(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000080988755 217347118 /nfs/dbraw/zinc/34/71/18/217347118.db2.gz ZQMQMXPYACRUET-GFCCVEGCSA-N 1 1 333.797 2.098 10 5 EEBEMO C/C(=C\c1ccc([N+](=O)[O-])cc1)C(=O)NCc1c[nH+]c(N(C)C)n1C ZINC000273516900 256303396 /nfs/dbraw/zinc/30/33/96/256303396.db2.gz PIBLJTPVMAVUHS-FMIVXFBMSA-N 1 1 343.387 2.114 10 5 EEBEMO CN(CC[N@@H+](C)C1CC1)C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000354082583 153096257 /nfs/dbraw/zinc/09/62/57/153096257.db2.gz NLNLAURZBZVDMG-UHFFFAOYSA-N 1 1 343.330 2.362 10 5 EEBEMO Cc1cccc(C(=O)N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000193562672 160183254 /nfs/dbraw/zinc/18/32/54/160183254.db2.gz OZJPJBQTHSFIFO-CQSZACIVSA-N 1 1 347.415 2.229 10 5 EEBEMO CC[N@@H+]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000341794865 161013974 /nfs/dbraw/zinc/01/39/74/161013974.db2.gz DLSGUPZQIJYZKX-SNVBAGLBSA-N 1 1 343.330 2.362 10 5 EEBEMO CC[N@H+]1CCN(C(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000341794865 161013975 /nfs/dbraw/zinc/01/39/75/161013975.db2.gz DLSGUPZQIJYZKX-SNVBAGLBSA-N 1 1 343.330 2.362 10 5 EEBEMO CC[N@H+]1C[C@@H](C)N(C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C[C@H]1C ZINC000343673206 161157434 /nfs/dbraw/zinc/15/74/34/161157434.db2.gz QJAQBOSIJIHNBM-GHMZBOCLSA-N 1 1 341.358 2.357 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](CO)c1ccsc1 ZINC000352022992 162033106 /nfs/dbraw/zinc/03/31/06/162033106.db2.gz SSJRRJPZTQBUIG-AWEZNQCLSA-N 1 1 335.385 2.226 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](CCO)CC1CC1 ZINC000352491509 162155598 /nfs/dbraw/zinc/15/55/98/162155598.db2.gz QPWMYKVZDLUKBT-SNVBAGLBSA-N 1 1 341.795 2.280 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3COCC[C@H]32)c2c(c1)COCO2 ZINC000355101012 163080455 /nfs/dbraw/zinc/08/04/55/163080455.db2.gz BTOCVXMOYBXVJS-MLGOLLRUSA-N 1 1 334.372 2.462 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@H](C)C1 ZINC000279566495 269288955 /nfs/dbraw/zinc/28/89/55/269288955.db2.gz ZBGGXBJFJGDVKD-QMTHXVAHSA-N 1 1 338.383 2.118 10 5 EEBEMO COc1cc(N2CC[N@@H+](CC(C)(C)O)[C@H](C)C2)c([N+](=O)[O-])cc1F ZINC000275488930 274251775 /nfs/dbraw/zinc/25/17/75/274251775.db2.gz KIEHZRJXVLUPCY-LLVKDONJSA-N 1 1 341.383 2.024 10 5 EEBEMO CC(=O)c1ccc(NC[C@@H](c2cnn(C)c2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000301254234 294838611 /nfs/dbraw/zinc/83/86/11/294838611.db2.gz AWCJBEMUQMXQOD-INIZCTEOSA-N 1 1 331.376 2.246 10 5 EEBEMO Cn1cc[nH+]c1C[C@@H]1CCCN(c2cc(CO)ccc2[N+](=O)[O-])C1 ZINC000302053950 294925565 /nfs/dbraw/zinc/92/55/65/294925565.db2.gz PYJDTSNPFJZQQS-ZDUSSCGKSA-N 1 1 330.388 2.280 10 5 EEBEMO C[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H]1CC[C@H](O)CC1 ZINC000439305810 315072915 /nfs/dbraw/zinc/07/29/15/315072915.db2.gz WFJHPRUDTTXTMB-MQMHXKEQSA-N 1 1 349.387 2.128 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000525107150 317039289 /nfs/dbraw/zinc/03/92/89/317039289.db2.gz NKQQFOLJERGNLW-IUODEOHRSA-N 1 1 334.420 2.439 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@@H+]1CC=C(C)CC1 ZINC000358447220 465128032 /nfs/dbraw/zinc/12/80/32/465128032.db2.gz ZKSPJCQCGFOLAN-UHFFFAOYSA-N 1 1 334.376 2.377 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN(C)[C@H]2CC[N@H+](C(C)C)C2)c1 ZINC000590663870 468299385 /nfs/dbraw/zinc/29/93/85/468299385.db2.gz ZUCDFYBVJOTKES-HNNXBMFYSA-N 1 1 335.404 2.296 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(CN3CCC[N@H+](C4CC4)CC3)n2)c1 ZINC000061041220 462574959 /nfs/dbraw/zinc/57/49/59/462574959.db2.gz HFQUHBAGTKGFGS-UHFFFAOYSA-N 1 1 343.387 2.315 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000117275974 462791805 /nfs/dbraw/zinc/79/18/05/462791805.db2.gz RSUJZIHHIWNVPY-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@H]1C ZINC000117275974 462791809 /nfs/dbraw/zinc/79/18/09/462791809.db2.gz RSUJZIHHIWNVPY-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)CC[N@@H+](C)C1CCN(C)CC1 ZINC000124866760 463473942 /nfs/dbraw/zinc/47/39/42/463473942.db2.gz LQFNLAPJJKRPCD-UHFFFAOYSA-N 1 1 348.447 2.001 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)CCN(C)C1CC[NH+](C)CC1 ZINC000124866760 463473943 /nfs/dbraw/zinc/47/39/43/463473943.db2.gz LQFNLAPJJKRPCD-UHFFFAOYSA-N 1 1 348.447 2.001 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[NH2+]C[C@@H]1c1cccc(F)c1 ZINC000261997957 463921427 /nfs/dbraw/zinc/92/14/27/463921427.db2.gz PPXCEJCERVIBLX-MRXNPFEDSA-N 1 1 344.346 2.224 10 5 EEBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c(OC(F)F)c3)C[C@H]21 ZINC000285079469 464447269 /nfs/dbraw/zinc/44/72/69/464447269.db2.gz PPTBQBZBLZVTOM-CHWSQXEVSA-N 1 1 343.330 2.106 10 5 EEBEMO CN(C(=O)C[N@@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272276530 464547271 /nfs/dbraw/zinc/54/72/71/464547271.db2.gz CKLHQXZMSKFIKK-HOTGVXAUSA-N 1 1 349.431 2.287 10 5 EEBEMO CN(C(=O)C[N@H+]1CC[C@H](C(C)(C)C)[C@@H](O)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272276530 464547279 /nfs/dbraw/zinc/54/72/79/464547279.db2.gz CKLHQXZMSKFIKK-HOTGVXAUSA-N 1 1 349.431 2.287 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000247464624 464682722 /nfs/dbraw/zinc/68/27/22/464682722.db2.gz RDCYGDZTAQELHU-AAEUAGOBSA-N 1 1 328.372 2.385 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000248886033 464816536 /nfs/dbraw/zinc/81/65/36/464816536.db2.gz XUJMTCVATXJTDC-RCBQFDQVSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@H]2C[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000248886033 464816540 /nfs/dbraw/zinc/81/65/40/464816540.db2.gz XUJMTCVATXJTDC-RCBQFDQVSA-N 1 1 334.372 2.247 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1C[N@H+](C(C)C)C[C@@H]1C ZINC000249280004 464859085 /nfs/dbraw/zinc/85/90/85/464859085.db2.gz NCFNGRXITJRBCP-SMDDNHRTSA-N 1 1 336.392 2.454 10 5 EEBEMO O=[N+]([O-])c1cnc(NC[C@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)s1 ZINC000192514780 464940841 /nfs/dbraw/zinc/94/08/41/464940841.db2.gz FTIBDLUIVBILNA-OLZOCXBDSA-N 1 1 334.401 2.099 10 5 EEBEMO Cc1cc(N2CCC([N@@H+](C)CCO)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000302018059 466080635 /nfs/dbraw/zinc/08/06/35/466080635.db2.gz CXOFKDVSMCPIOG-UHFFFAOYSA-N 1 1 327.812 2.450 10 5 EEBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1C(F)F ZINC000367392617 466309669 /nfs/dbraw/zinc/30/96/69/466309669.db2.gz SAPOFMTXQDSAPA-SKDRFNHKSA-N 1 1 345.371 2.141 10 5 EEBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@H]2CCC[N@@H+](C)C2)CC1 ZINC000363419519 466392704 /nfs/dbraw/zinc/39/27/04/466392704.db2.gz VXNHTYDRCAJZQB-QAPCUYQASA-N 1 1 332.448 2.368 10 5 EEBEMO O=C(CC[N@H+]1CCO[C@H](C2CCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411843594 466915364 /nfs/dbraw/zinc/91/53/64/466915364.db2.gz ILHJVUHDXIYOQD-INIZCTEOSA-N 1 1 333.388 2.424 10 5 EEBEMO CC(C)(C[NH+]1CCCC1)NCCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411885442 466925501 /nfs/dbraw/zinc/92/55/01/466925501.db2.gz XTDXGSGUARDPQT-UHFFFAOYSA-N 1 1 334.420 2.387 10 5 EEBEMO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C[N@H+]1CCO ZINC000418117907 467049452 /nfs/dbraw/zinc/04/94/52/467049452.db2.gz SECKYRMOPKJHBE-NEPJUHHUSA-N 1 1 327.812 2.135 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000419009378 467161634 /nfs/dbraw/zinc/16/16/34/467161634.db2.gz VXPFMMUKZQTKEU-STQMWFEESA-N 1 1 330.388 2.034 10 5 EEBEMO COC[C@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000452109956 467325331 /nfs/dbraw/zinc/32/53/31/467325331.db2.gz XRJUCCWSZGZWGB-GJZGRUSLSA-N 1 1 338.404 2.083 10 5 EEBEMO COC(=O)c1cc(N[C@H]2CCn3cc[nH+]c3C2)cc(C)c1[N+](=O)[O-] ZINC000489925495 468177698 /nfs/dbraw/zinc/17/76/98/468177698.db2.gz HEQFDRWGXLLSLY-NSHDSACASA-N 1 1 330.344 2.313 10 5 EEBEMO COc1ccc(CC(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000597858174 468695598 /nfs/dbraw/zinc/69/55/98/468695598.db2.gz LJTMGTWWHSVXGH-CYBMUJFWSA-N 1 1 335.404 2.135 10 5 EEBEMO C[C@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CS1(=O)=O ZINC000594975188 468736401 /nfs/dbraw/zinc/73/64/01/468736401.db2.gz MISIIFZAUWHLDR-GXSJLCMTSA-N 1 1 332.809 2.304 10 5 EEBEMO COC[C@@H](CC[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)OC ZINC000595059005 468750070 /nfs/dbraw/zinc/75/00/70/468750070.db2.gz FECQSSVRXGDMCF-HZPDHXFCSA-N 1 1 348.403 2.059 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2[C@H](CCC[N@H+]2C)C1 ZINC000601131293 468754779 /nfs/dbraw/zinc/75/47/79/468754779.db2.gz VXDRIQQNOMGFOZ-ZJUUUORDSA-N 1 1 347.341 2.268 10 5 EEBEMO Cc1cc(S(=O)(=O)NC[C@H]2CC[N@@H+]2C(C)(C)C)c([N+](=O)[O-])s1 ZINC000601461436 468884085 /nfs/dbraw/zinc/88/40/85/468884085.db2.gz DPTWULYIIOHCLL-SNVBAGLBSA-N 1 1 347.462 2.116 10 5 EEBEMO Cc1cc(S(=O)(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])s1 ZINC000601461436 468884090 /nfs/dbraw/zinc/88/40/90/468884090.db2.gz DPTWULYIIOHCLL-SNVBAGLBSA-N 1 1 347.462 2.116 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CC[C@H]4COC[C@@H]4C3)n2)c1 ZINC000595835821 469033850 /nfs/dbraw/zinc/03/38/50/469033850.db2.gz VSMVUKQRUPZESH-STQMWFEESA-N 1 1 330.344 2.113 10 5 EEBEMO COC[C@@H]1C[C@@H](O)C[N@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593670777 469087538 /nfs/dbraw/zinc/08/75/38/469087538.db2.gz IMTMHSDTJXCBCF-LSDHHAIUSA-N 1 1 332.356 2.436 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1CN1CCCC[C@@H]1[C@@H]1C[C@@H]([NH3+])CCO1 ZINC000593731219 469112363 /nfs/dbraw/zinc/11/23/63/469112363.db2.gz UQEGUABIWUXKBT-LESCRADOSA-N 1 1 349.431 2.464 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCO[C@@H]1c1nc(C)no1 ZINC000599091841 469116397 /nfs/dbraw/zinc/11/63/97/469116397.db2.gz GNSRVXJZLDMLMQ-PKPZWWHKSA-N 1 1 348.359 2.476 10 5 EEBEMO CCO[C@@H](C[NH+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1)C1CC1 ZINC000599430990 469252630 /nfs/dbraw/zinc/25/26/30/469252630.db2.gz JVIGMQDIABXDEV-KRWDZBQOSA-N 1 1 347.415 2.168 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(CN3CC[NH+](CCCF)CC3)o2)cc1 ZINC000599666784 469332542 /nfs/dbraw/zinc/33/25/42/469332542.db2.gz CHGCJNVMFYBSEH-UHFFFAOYSA-N 1 1 349.366 2.122 10 5 EEBEMO CCN(C(=O)NCCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000596417738 485611631 /nfs/dbraw/zinc/61/16/31/485611631.db2.gz JUJPDJKMNHJYKP-HNNXBMFYSA-N 1 1 334.420 2.263 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)COc1ccccc1[N+](=O)[O-] ZINC000175010992 529303715 /nfs/dbraw/zinc/30/37/15/529303715.db2.gz QIRJNKAHLCOIQG-UONOGXRCSA-N 1 1 333.388 2.059 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H]([C@H](O)C(F)(F)F)C2)c1 ZINC000769900662 577586765 /nfs/dbraw/zinc/58/67/65/577586765.db2.gz QMTIRAVVDJBAAP-BNOWGMLFSA-N 1 1 348.321 2.263 10 5 EEBEMO C/C(=C/C(=O)NCC[N@@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000751871863 577761295 /nfs/dbraw/zinc/76/12/95/577761295.db2.gz UFMDAEPEWRVZGL-OWBHPGMISA-N 1 1 347.415 2.225 10 5 EEBEMO C/C(=C/C(=O)NCC[N@H+]1CCOC(C)(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000751871863 577761296 /nfs/dbraw/zinc/76/12/96/577761296.db2.gz UFMDAEPEWRVZGL-OWBHPGMISA-N 1 1 347.415 2.225 10 5 EEBEMO Cc1cc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ns1 ZINC001480858312 1176031098 /nfs/dbraw/zinc/03/10/98/1176031098.db2.gz LWGQKJZUCQPKJU-UHFFFAOYSA-N 1 1 334.401 2.222 10 5 EEBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)ns1 ZINC001480858312 1176031104 /nfs/dbraw/zinc/03/11/04/1176031104.db2.gz LWGQKJZUCQPKJU-UHFFFAOYSA-N 1 1 334.401 2.222 10 5 EEBEMO C[N@@H+](CCNC(=O)c1coc(C2CC2)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC001266335394 1176321014 /nfs/dbraw/zinc/32/10/14/1176321014.db2.gz USMJARGADMDWLM-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1c(C)ccn1C)Cc1cccc([N+](=O)[O-])c1 ZINC001480971284 1179401090 /nfs/dbraw/zinc/40/10/90/1179401090.db2.gz HGLPIAOOJNECJO-UHFFFAOYSA-N 1 1 344.415 2.494 10 5 EEBEMO CCC/C=C\CC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001268044106 1181495471 /nfs/dbraw/zinc/49/54/71/1181495471.db2.gz XGZJJQAPKDOLCA-KSLSASGISA-N 1 1 335.448 2.322 10 5 EEBEMO CN(CCC[NH2+]Cc1cccc(F)c1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001268790392 1183706796 /nfs/dbraw/zinc/70/67/96/1183706796.db2.gz DMSVJKMVCDEJEH-DGCLKSJQSA-N 1 1 343.786 2.082 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(F)cn1 ZINC001271998574 1186799180 /nfs/dbraw/zinc/79/91/80/1186799180.db2.gz UNWLXPWNVSACRA-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccc(F)cn1 ZINC001271998574 1186799185 /nfs/dbraw/zinc/79/91/85/1186799185.db2.gz UNWLXPWNVSACRA-UHFFFAOYSA-N 1 1 346.362 2.333 10 5 EEBEMO O=C(/C=C\c1ccc[nH]1)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001483729666 1190833728 /nfs/dbraw/zinc/83/37/28/1190833728.db2.gz ZPBYJEJHAXUAPG-ARJAWSKDSA-N 1 1 346.412 2.436 10 5 EEBEMO C[C@@H]([NH2+]CC(C)(C)N1CCN(C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020290 1198026946 /nfs/dbraw/zinc/02/69/46/1198026946.db2.gz FJQMEKUXIVYBSW-CYBMUJFWSA-N 1 1 338.427 2.411 10 5 EEBEMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](CO)c1ccnn1C ZINC000872087285 1198042891 /nfs/dbraw/zinc/04/28/91/1198042891.db2.gz HYNAUDRNPJTXBT-GXFFZTMASA-N 1 1 336.417 2.434 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Cc2cccc(F)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000866050299 1201414749 /nfs/dbraw/zinc/41/47/49/1201414749.db2.gz YNGIRLUNRQWXJW-SWLSCSKDSA-N 1 1 337.395 2.465 10 5 EEBEMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CNCCC2(F)F)n1 ZINC000925775429 1206153255 /nfs/dbraw/zinc/15/32/55/1206153255.db2.gz GNNLLBZDNVUUSO-YNEHKIRRSA-N 1 1 343.378 2.109 10 5 EEBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641725 1206572481 /nfs/dbraw/zinc/57/24/81/1206572481.db2.gz YGBJXKCQDVRHRO-ZBFHGGJFSA-N 1 1 338.429 2.351 10 5 EEBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@@H+](C[C@@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641725 1206572482 /nfs/dbraw/zinc/57/24/82/1206572482.db2.gz YGBJXKCQDVRHRO-ZBFHGGJFSA-N 1 1 338.429 2.351 10 5 EEBEMO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2c[nH]nc21 ZINC000931451495 1207384158 /nfs/dbraw/zinc/38/41/58/1207384158.db2.gz BVHAPCSXAWFMLP-SNVBAGLBSA-N 1 1 330.344 2.304 10 5 EEBEMO C[C@@H]1C[N@@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)Cc2c[nH]nc21 ZINC000931451495 1207384161 /nfs/dbraw/zinc/38/41/61/1207384161.db2.gz BVHAPCSXAWFMLP-SNVBAGLBSA-N 1 1 330.344 2.304 10 5 EEBEMO C[C@@H]1[C@@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000903301990 1240208848 /nfs/dbraw/zinc/20/88/48/1240208848.db2.gz VRKNKMNXZIYPQH-KCXAZCMYSA-N 1 1 329.404 2.100 10 5 EEBEMO C[C@@H](O)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399971 1281973193 /nfs/dbraw/zinc/97/31/93/1281973193.db2.gz FBHYPWQFULXXAL-VXGBXAGGSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@@H](O)[C@@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399971 1281973196 /nfs/dbraw/zinc/97/31/96/1281973196.db2.gz FBHYPWQFULXXAL-VXGBXAGGSA-N 1 1 332.360 2.238 10 5 EEBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000854058516 1292602720 /nfs/dbraw/zinc/60/27/20/1292602720.db2.gz OXZYGCGWCUMBLI-KRWDZBQOSA-N 1 1 344.415 2.446 10 5 EEBEMO CN1CC[NH+](Cc2cccc(CNc3ccc([N+](=O)[O-])nc3)c2)CC1 ZINC001117746890 1306160038 /nfs/dbraw/zinc/16/00/38/1306160038.db2.gz FUAROTXBQXZQGE-UHFFFAOYSA-N 1 1 341.415 2.349 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@@]3(CCOC3)C2)nc1-c1ccncc1 ZINC000840141389 1315306787 /nfs/dbraw/zinc/30/67/87/1315306787.db2.gz OLCNRFRWFUKCQA-QGZVFWFLSA-N 1 1 343.387 2.313 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@@]3(CCOC3)C2)nc1-c1ccncc1 ZINC000840141389 1315306792 /nfs/dbraw/zinc/30/67/92/1315306792.db2.gz OLCNRFRWFUKCQA-QGZVFWFLSA-N 1 1 343.387 2.313 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[N@H+](C2CC2)C[C@H]1C ZINC001150119503 1316165968 /nfs/dbraw/zinc/16/59/68/1316165968.db2.gz DVVHMQQUXLMVET-DGCLKSJQSA-N 1 1 333.388 2.206 10 5 EEBEMO CCC[N@H+]1CCC[C@@H](C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001154336160 1317081461 /nfs/dbraw/zinc/08/14/61/1317081461.db2.gz ZAZLTDQCNIZFHX-CQSZACIVSA-N 1 1 347.415 2.306 10 5 EEBEMO CNc1ccc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)cc1[N+](=O)[O-] ZINC001263620690 1322495925 /nfs/dbraw/zinc/49/59/25/1322495925.db2.gz ZVVZPCAXWGXWRI-AWEZNQCLSA-N 1 1 349.387 2.047 10 5 EEBEMO C[N@H+](CCNC(=O)/C=C\c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001317445451 1332244080 /nfs/dbraw/zinc/24/40/80/1332244080.db2.gz WEALRJGWFOMEHO-HJWRWDBZSA-N 1 1 328.372 2.184 10 5 EEBEMO C[N@@H+](CCNC(=O)/C=C\c1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001317445451 1332244082 /nfs/dbraw/zinc/24/40/82/1332244082.db2.gz WEALRJGWFOMEHO-HJWRWDBZSA-N 1 1 328.372 2.184 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)c3c[nH]c4cccc([N+](=O)[O-])c34)[C@@H]2C1 ZINC001349775813 1337646869 /nfs/dbraw/zinc/64/68/69/1337646869.db2.gz DALRGJZMTUGVEM-UHTWSYAYSA-N 1 1 328.372 2.146 10 5 EEBEMO CSc1ccc(C(=O)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cc1[N+](=O)[O-] ZINC001627017269 1352480521 /nfs/dbraw/zinc/48/05/21/1352480521.db2.gz PPIPITMCNZCEAY-WBMJQRKESA-N 1 1 335.429 2.340 10 5 EEBEMO CCOC(=O)c1ccnc(NCCn2cc[nH+]c2CC)c1[N+](=O)[O-] ZINC001643182605 1352741881 /nfs/dbraw/zinc/74/18/81/1352741881.db2.gz FYOKXJKMCHCZMY-UHFFFAOYSA-N 1 1 333.348 2.038 10 5 EEBEMO Cc1cccc(NC(=O)C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c1 ZINC001648017144 1353413660 /nfs/dbraw/zinc/41/36/60/1353413660.db2.gz JOVXVPDCXOUZLM-GOSISDBHSA-N 1 1 343.383 2.339 10 5 EEBEMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001651085680 1354039275 /nfs/dbraw/zinc/03/92/75/1354039275.db2.gz OVDFTVNMRXVOEP-GFCCVEGCSA-N 1 1 342.399 2.314 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001651085680 1354039280 /nfs/dbraw/zinc/03/92/80/1354039280.db2.gz OVDFTVNMRXVOEP-GFCCVEGCSA-N 1 1 342.399 2.314 10 5 EEBEMO CC[N@@H+](CCC(=O)NC)[C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001655780506 1354184301 /nfs/dbraw/zinc/18/43/01/1354184301.db2.gz DEIZRDZVMBNVKP-LLVKDONJSA-N 1 1 347.375 2.164 10 5 EEBEMO COc1ccc(C(=O)NCCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC001660341259 1354443925 /nfs/dbraw/zinc/44/39/25/1354443925.db2.gz JFKGTLVCGXPOSO-UHFFFAOYSA-N 1 1 347.371 2.448 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000921419983 773348653 /nfs/dbraw/zinc/34/86/53/773348653.db2.gz QNRMHCJZAWMAGA-RNCFNFMXSA-N 1 1 326.784 2.140 10 5 EEBEMO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1nnc2n1CCCCC2 ZINC000818950098 785339590 /nfs/dbraw/zinc/33/95/90/785339590.db2.gz PLIQQBHKAWISAQ-WFASDCNBSA-N 1 1 345.403 2.297 10 5 EEBEMO CCN(C(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](CC)C1 ZINC000912397631 788159524 /nfs/dbraw/zinc/15/95/24/788159524.db2.gz CJMQCOWHFSKBJV-NSHDSACASA-N 1 1 340.811 2.387 10 5 EEBEMO Cc1cc(C(=O)NC(C)(C)CC[NH+]2CCOCC2)cc([N+](=O)[O-])c1 ZINC000912953633 788519061 /nfs/dbraw/zinc/51/90/61/788519061.db2.gz IOWQKMOFSBDFKY-UHFFFAOYSA-N 1 1 335.404 2.134 10 5 EEBEMO C[C@@H](C[NH+]1CCOCC1)N(C)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000788566652 807586355 /nfs/dbraw/zinc/58/63/55/807586355.db2.gz YIAIQGPIZFJAFX-ZDUSSCGKSA-N 1 1 330.388 2.300 10 5 EEBEMO O=C(NCCC[N@@H+](CC1CC2(CCC2)C1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001566587644 1125774819 /nfs/dbraw/zinc/77/48/19/1125774819.db2.gz NCQQGDJERICLJI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO O=C(NCCC[N@H+](CC1CC2(CCC2)C1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001566587644 1125774830 /nfs/dbraw/zinc/77/48/30/1125774830.db2.gz NCQQGDJERICLJI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO O=C(NCCC[N@@H+](CC1CC2(CCC2)C1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001566587644 1125774837 /nfs/dbraw/zinc/77/48/37/1125774837.db2.gz NCQQGDJERICLJI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO C[NH+](C)Cc1ccc(C(=O)N2CC(Oc3ccc([N+](=O)[O-])cc3)C2)o1 ZINC001466903156 1110446260 /nfs/dbraw/zinc/44/62/60/1110446260.db2.gz LHEPZRGETRFOPK-UHFFFAOYSA-N 1 1 345.355 2.153 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+]2C[C@H]3CCC[C@@H](C2)C3O)o1 ZINC001473167467 1110572444 /nfs/dbraw/zinc/57/24/44/1110572444.db2.gz GYQMTLSZLNKECL-HBBFGDNQSA-N 1 1 344.371 2.238 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)o1 ZINC001473167467 1110572446 /nfs/dbraw/zinc/57/24/46/1110572446.db2.gz GYQMTLSZLNKECL-HBBFGDNQSA-N 1 1 344.371 2.238 10 5 EEBEMO C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1CO ZINC001473668953 1110578404 /nfs/dbraw/zinc/57/84/04/1110578404.db2.gz VYWXNWONEYITRP-NWDGAFQWSA-N 1 1 332.360 2.095 10 5 EEBEMO C[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1CO ZINC001473668953 1110578405 /nfs/dbraw/zinc/57/84/05/1110578405.db2.gz VYWXNWONEYITRP-NWDGAFQWSA-N 1 1 332.360 2.095 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C/CNC(=O)CC1CCCCC1 ZINC001568811626 1124828387 /nfs/dbraw/zinc/82/83/87/1124828387.db2.gz GPCACABBIYNZLE-AATRIKPKSA-N 1 1 349.435 2.061 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C\CNC(=O)C1CCCCCC1 ZINC001568825378 1124844274 /nfs/dbraw/zinc/84/42/74/1124844274.db2.gz JKEPRRZZPJBBGW-SREVYHEPSA-N 1 1 349.435 2.061 10 5 EEBEMO CC(C)[C@@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000438500864 242025807 /nfs/dbraw/zinc/02/58/07/242025807.db2.gz KJROGPMMGXWGAG-LLVKDONJSA-N 1 1 335.360 2.240 10 5 EEBEMO CC(C)[C@@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000438500864 242025814 /nfs/dbraw/zinc/02/58/14/242025814.db2.gz KJROGPMMGXWGAG-LLVKDONJSA-N 1 1 335.360 2.240 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])cn1 ZINC000173320091 152157703 /nfs/dbraw/zinc/15/77/03/152157703.db2.gz HUNJYVXLGVFKSF-HNNXBMFYSA-N 1 1 343.387 2.494 10 5 EEBEMO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000184765490 160016994 /nfs/dbraw/zinc/01/69/94/160016994.db2.gz FNIRSCJSEWVHKC-NVXWUHKLSA-N 1 1 331.416 2.470 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000247081146 160309732 /nfs/dbraw/zinc/30/97/32/160309732.db2.gz ZJHLIHASBSSJPQ-KBPBESRZSA-N 1 1 333.388 2.302 10 5 EEBEMO CN1CC[NH+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)CC1 ZINC000344425246 161226498 /nfs/dbraw/zinc/22/64/98/161226498.db2.gz VNWVTVFXUXPOLL-UHFFFAOYSA-N 1 1 341.415 2.349 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C2CC2)C1 ZINC000375345936 167117146 /nfs/dbraw/zinc/11/71/46/167117146.db2.gz WIINPBXEEGYRDE-INIZCTEOSA-N 1 1 333.388 2.343 10 5 EEBEMO Cc1ccc(C[NH2+]Cc2cccc(N3CCOCC3)n2)cc1[N+](=O)[O-] ZINC000274773106 269051561 /nfs/dbraw/zinc/05/15/61/269051561.db2.gz JAFPLCONBMYKGV-UHFFFAOYSA-N 1 1 342.399 2.425 10 5 EEBEMO C[C@@H]1CN(c2ccc3ncccc3c2[N+](=O)[O-])C[C@@H]1[NH+]1CCOCC1 ZINC000176704333 274364842 /nfs/dbraw/zinc/36/48/42/274364842.db2.gz ZBEODBWPFLXQAC-DYVFJYSZSA-N 1 1 342.399 2.300 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[N@@H+]3CCOC[C@H]3C2)cc1C(F)(F)F ZINC000371801511 275036680 /nfs/dbraw/zinc/03/66/80/275036680.db2.gz GYRMHLWLGWLEJI-LLVKDONJSA-N 1 1 331.294 2.134 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[N@H+]3CCOC[C@H]3C2)cc1C(F)(F)F ZINC000371801511 275036681 /nfs/dbraw/zinc/03/66/81/275036681.db2.gz GYRMHLWLGWLEJI-LLVKDONJSA-N 1 1 331.294 2.134 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1 ZINC000289585966 275130027 /nfs/dbraw/zinc/13/00/27/275130027.db2.gz ZGSBWUSTWGUSKD-NWDGAFQWSA-N 1 1 331.376 2.255 10 5 EEBEMO CNC(=O)c1ccc(N2CCC([N@H+]3CCC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000154946504 277016971 /nfs/dbraw/zinc/01/69/71/277016971.db2.gz HAJFDIDVTYEVBG-CYBMUJFWSA-N 1 1 346.431 2.408 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000181268186 277168648 /nfs/dbraw/zinc/16/86/48/277168648.db2.gz BMSRZBMLZNJSDG-YOEHRIQHSA-N 1 1 340.383 2.352 10 5 EEBEMO C[C@H]1C[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000334033397 312231273 /nfs/dbraw/zinc/23/12/73/312231273.db2.gz YCWFMGGKMJIUSX-GXSJLCMTSA-N 1 1 343.330 2.409 10 5 EEBEMO CNC(=O)[C@H]1CC[N@@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000420959855 314009848 /nfs/dbraw/zinc/00/98/48/314009848.db2.gz FRFJSWPGVXEZKF-VIFPVBQESA-N 1 1 331.294 2.182 10 5 EEBEMO O=C1C[C@H]([C@@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751158 465338026 /nfs/dbraw/zinc/33/80/26/465338026.db2.gz GSRQRWMXQPOZMF-BONVTDFDSA-N 1 1 339.342 2.364 10 5 EEBEMO O=C1C[C@H]([C@@H]2CCCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751158 465338032 /nfs/dbraw/zinc/33/80/32/465338032.db2.gz GSRQRWMXQPOZMF-BONVTDFDSA-N 1 1 339.342 2.364 10 5 EEBEMO C[C@@H]1CCOCC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000129981371 462734145 /nfs/dbraw/zinc/73/41/45/462734145.db2.gz PSKZCSIANBQAKD-LLVKDONJSA-N 1 1 325.340 2.173 10 5 EEBEMO Cn1cccc1[C@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090551471 462797778 /nfs/dbraw/zinc/79/77/78/462797778.db2.gz ICQZHWRXZPGWKR-MRXNPFEDSA-N 1 1 330.388 2.322 10 5 EEBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000155770405 462941560 /nfs/dbraw/zinc/94/15/60/462941560.db2.gz WBXLGXOQJTVDKY-ZIAGYGMSSA-N 1 1 346.431 2.360 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@@H]1c1ccccc1 ZINC000536262791 468346756 /nfs/dbraw/zinc/34/67/56/468346756.db2.gz JEPJPWWOQNQTQA-GOEBONIOSA-N 1 1 328.372 2.109 10 5 EEBEMO C[C@H]1C[C@H](N(C)C(=O)c2cc(F)c([N+](=O)[O-])cc2F)CC[N@H+]1C ZINC000160422107 463337212 /nfs/dbraw/zinc/33/72/12/463337212.db2.gz HLNMNABBMQUREG-VHSXEESVSA-N 1 1 327.331 2.428 10 5 EEBEMO C[C@@H](CC[NH+]1CCN(C)CC1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC000185873465 463895932 /nfs/dbraw/zinc/89/59/32/463895932.db2.gz XVHZEUWPBPKXPE-ZDUSSCGKSA-N 1 1 340.855 2.364 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000294807449 464611687 /nfs/dbraw/zinc/61/16/87/464611687.db2.gz PJOVRDVVVVTSHP-JTQLQIEISA-N 1 1 331.294 2.438 10 5 EEBEMO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@H+]1CCO ZINC000190249011 464612611 /nfs/dbraw/zinc/61/26/11/464612611.db2.gz WYVOJLPZJLIYOI-AWEZNQCLSA-N 1 1 345.399 2.353 10 5 EEBEMO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1CCO ZINC000190249011 464612621 /nfs/dbraw/zinc/61/26/21/464612621.db2.gz WYVOJLPZJLIYOI-AWEZNQCLSA-N 1 1 345.399 2.353 10 5 EEBEMO C[C@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCN1CCO ZINC000190249011 464612626 /nfs/dbraw/zinc/61/26/26/464612626.db2.gz WYVOJLPZJLIYOI-AWEZNQCLSA-N 1 1 345.399 2.353 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[N@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000282241155 464748732 /nfs/dbraw/zinc/74/87/32/464748732.db2.gz ZZUYMSKHTSPYOB-AWEZNQCLSA-N 1 1 344.419 2.204 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cccc(OC)c2[N+](=O)[O-])[C@@H](C)C1 ZINC000248894171 464818267 /nfs/dbraw/zinc/81/82/67/464818267.db2.gz XDLMZROEAQHNOQ-JSGCOSHPSA-N 1 1 335.404 2.406 10 5 EEBEMO C[C@@H]1C[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1N1CCOCC1 ZINC000177258632 464971413 /nfs/dbraw/zinc/97/14/13/464971413.db2.gz UVGHWQXINCZFIT-WBMJQRKESA-N 1 1 339.823 2.401 10 5 EEBEMO C[C@@H]1C[N@@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1N1CCOCC1 ZINC000177258632 464971421 /nfs/dbraw/zinc/97/14/21/464971421.db2.gz UVGHWQXINCZFIT-WBMJQRKESA-N 1 1 339.823 2.401 10 5 EEBEMO CC[C@@H]1C[N@@H+](CC(C)(C)O)[C@@H](CC)CN1c1ccc([N+](=O)[O-])cn1 ZINC000252539887 464983088 /nfs/dbraw/zinc/98/30/88/464983088.db2.gz OQAMNCASRFQGEC-UONOGXRCSA-N 1 1 336.436 2.440 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N(C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000361769848 466271962 /nfs/dbraw/zinc/27/19/62/466271962.db2.gz KQPGSOOWRIQIHP-CYBMUJFWSA-N 1 1 333.388 2.302 10 5 EEBEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000372284355 466277630 /nfs/dbraw/zinc/27/76/30/466277630.db2.gz ZBZMVYXIFLVXOZ-CVEARBPZSA-N 1 1 336.388 2.180 10 5 EEBEMO Cn1cc([N+](=O)[O-])c(C(=O)NC[C@@H]2CCC[N@H+]2CC2CCCCC2)n1 ZINC000357911360 466312334 /nfs/dbraw/zinc/31/23/34/466312334.db2.gz NVYZJYPVAGFXNY-AWEZNQCLSA-N 1 1 349.435 2.103 10 5 EEBEMO COc1ccc(C[NH+]2CCC(Oc3cnccn3)CC2)cc1[N+](=O)[O-] ZINC000365839198 466958354 /nfs/dbraw/zinc/95/83/54/466958354.db2.gz QUGFTTPWFIOULH-UHFFFAOYSA-N 1 1 344.371 2.437 10 5 EEBEMO C[C@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccc([N+](=O)[O-])cc1 ZINC000454962408 467626516 /nfs/dbraw/zinc/62/65/16/467626516.db2.gz ACUGSABTUBPFMV-CMPLNLGQSA-N 1 1 329.360 2.236 10 5 EEBEMO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2CCO)c2ccncc21 ZINC000450616304 467880160 /nfs/dbraw/zinc/88/01/60/467880160.db2.gz PGDDDOHOHYLJIY-CYBMUJFWSA-N 1 1 330.388 2.402 10 5 EEBEMO CC(C)(C)OC(=O)C[C@@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000532378954 468115407 /nfs/dbraw/zinc/11/54/07/468115407.db2.gz RWAXHQXVXRLTIP-ZDUSSCGKSA-N 1 1 338.408 2.235 10 5 EEBEMO CNc1ccc(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582889210 468610787 /nfs/dbraw/zinc/61/07/87/468610787.db2.gz CEPQWVQJNXHBAE-INIZCTEOSA-N 1 1 340.383 2.423 10 5 EEBEMO C[C@H]1CC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C[C@@H]1C(=O)OC(C)(C)C ZINC000570276765 468616289 /nfs/dbraw/zinc/61/62/89/468616289.db2.gz QWAKFUPAOGCSGY-STQMWFEESA-N 1 1 338.408 2.091 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C1(S(C)(=O)=O)CC1 ZINC000595048864 468749242 /nfs/dbraw/zinc/74/92/42/468749242.db2.gz LCIWIYCPBCQKIT-QWRGUYRKSA-N 1 1 342.417 2.220 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@@H+](C)C[C@H]2C(C)C)c1 ZINC000593031342 468845716 /nfs/dbraw/zinc/84/57/16/468845716.db2.gz DEKGVLIYNWNIQT-INIZCTEOSA-N 1 1 335.404 2.153 10 5 EEBEMO C[C@@]1(C2CC2)C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CCO1 ZINC000595624559 468927817 /nfs/dbraw/zinc/92/78/17/468927817.db2.gz COSIYBFMVSCTJF-KRWDZBQOSA-N 1 1 333.388 2.424 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595690155 468956252 /nfs/dbraw/zinc/95/62/52/468956252.db2.gz WATYPUWEPMEJGX-JLZZUVOBSA-N 1 1 333.388 2.280 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595690155 468956257 /nfs/dbraw/zinc/95/62/57/468956257.db2.gz WATYPUWEPMEJGX-JLZZUVOBSA-N 1 1 333.388 2.280 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2COC[C@]2(C)C1 ZINC000595756449 468992715 /nfs/dbraw/zinc/99/27/15/468992715.db2.gz GDUDLGIWTMWRQO-GUYCJALGSA-N 1 1 333.388 2.200 10 5 EEBEMO COC[C@@](C)(CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610518958 468993981 /nfs/dbraw/zinc/99/39/81/468993981.db2.gz AQBJMUMQOOYLCD-OAHLLOKOSA-N 1 1 337.401 2.205 10 5 EEBEMO CCOc1cc(CN2CCC([N@H+]3CC[C@H](O)C3)CC2)ccc1[N+](=O)[O-] ZINC000595864704 469051983 /nfs/dbraw/zinc/05/19/83/469051983.db2.gz WCNSCIVJXXCKFX-INIZCTEOSA-N 1 1 349.431 2.025 10 5 EEBEMO O=C(C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccccc1[N+](=O)[O-] ZINC000595909824 469076905 /nfs/dbraw/zinc/07/69/05/469076905.db2.gz OALLIUIAAYCTMT-HDICACEKSA-N 1 1 345.399 2.426 10 5 EEBEMO O=C(C[N@@H+]1C[C@]23COC[C@@]2(C1)CCCC3)Nc1ccccc1[N+](=O)[O-] ZINC000595909824 469076910 /nfs/dbraw/zinc/07/69/10/469076910.db2.gz OALLIUIAAYCTMT-HDICACEKSA-N 1 1 345.399 2.426 10 5 EEBEMO COc1ccc([N+](=O)[O-])c(Cc2noc(Cn3c[nH+]cc3C)n2)c1 ZINC000599153537 469139646 /nfs/dbraw/zinc/13/96/46/469139646.db2.gz FBGZBVXEAJEJER-UHFFFAOYSA-N 1 1 329.316 2.130 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000611513272 469269352 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327.812 2.135 10 5 EEBEMO C[C@H](NC[C@H]1CCCC[N@@H+]1CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872075098 1198040803 /nfs/dbraw/zinc/04/08/03/1198040803.db2.gz OAJNPYCPCGGOJD-QWHCGFSZSA-N 1 1 325.384 2.231 10 5 EEBEMO C[C@H](NC[C@H]1CCCC[N@H+]1CCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872075098 1198040812 /nfs/dbraw/zinc/04/08/12/1198040812.db2.gz OAJNPYCPCGGOJD-QWHCGFSZSA-N 1 1 325.384 2.231 10 5 EEBEMO CC1(C)[C@H](O)CC[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000812867215 1200974598 /nfs/dbraw/zinc/97/45/98/1200974598.db2.gz HXWDWEXKLJAWMO-GFCCVEGCSA-N 1 1 327.768 2.032 10 5 EEBEMO CC1(C)[C@H](O)CC[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000812867215 1200974609 /nfs/dbraw/zinc/97/46/09/1200974609.db2.gz HXWDWEXKLJAWMO-GFCCVEGCSA-N 1 1 327.768 2.032 10 5 EEBEMO C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CCC1(C)C ZINC000871153284 1201073201 /nfs/dbraw/zinc/07/32/01/1201073201.db2.gz JXDIDXNXILLZMY-UHFFFAOYSA-N 1 1 339.367 2.055 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3N3CCOC3=O)CC[C@@H]21 ZINC000866205442 1201464658 /nfs/dbraw/zinc/46/46/58/1201464658.db2.gz LYNFTQZVCJKNJA-OCCSQVGLSA-N 1 1 346.387 2.082 10 5 EEBEMO Cc1ccc(CNC(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000869055124 1201930087 /nfs/dbraw/zinc/93/00/87/1201930087.db2.gz QZIALMCOJMKIBW-LSDHHAIUSA-N 1 1 332.404 2.139 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000869052736 1201930274 /nfs/dbraw/zinc/93/02/74/1201930274.db2.gz DGSSIPAKEXBPHJ-HUUCEWRRSA-N 1 1 332.404 2.329 10 5 EEBEMO C[C@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1C ZINC000928443978 1206384880 /nfs/dbraw/zinc/38/48/80/1206384880.db2.gz HQCNOVICHXEDJF-JFGNBEQYSA-N 1 1 341.795 2.224 10 5 EEBEMO O=[N+]([O-])c1ccc2nc(N3CCC([N@H+]4CC[C@@H](O)C4)CC3)sc2c1 ZINC000853965087 1292559839 /nfs/dbraw/zinc/55/98/39/1292559839.db2.gz DPOUNGFAKVVKPC-CYBMUJFWSA-N 1 1 348.428 2.240 10 5 EEBEMO 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Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[N@H+]2CCCC[C@H]2C1 ZINC000283510105 463910452 /nfs/dbraw/zinc/91/04/52/463910452.db2.gz MVVYEJWPNXGZLI-HNNXBMFYSA-N 1 1 342.403 2.065 10 5 EEBEMO Cn1c(-c2cccc([N+](=O)[O-])c2)nnc1N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000283510107 463910902 /nfs/dbraw/zinc/91/09/02/463910902.db2.gz MVVYEJWPNXGZLI-OAHLLOKOSA-N 1 1 342.403 2.065 10 5 EEBEMO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC[N@H+](C2CC2)CC1 ZINC000172347189 464059919 /nfs/dbraw/zinc/05/99/19/464059919.db2.gz XGXABIYXZZFDKD-CYBMUJFWSA-N 1 1 332.404 2.092 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@@H](O)CC(F)(F)F)CC2)cc1 ZINC000188604821 464321842 /nfs/dbraw/zinc/32/18/42/464321842.db2.gz YBKALKFEDXZHEW-ZDUSSCGKSA-N 1 1 333.310 2.030 10 5 EEBEMO C[C@@H]([NH2+][C@@H](C)C(=O)NC(=O)NC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000271625836 464347130 /nfs/dbraw/zinc/34/71/30/464347130.db2.gz NZDIQDZREXOQFI-MNOVXSKESA-N 1 1 336.392 2.258 10 5 EEBEMO C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@@H+]1CCO ZINC000188793400 464370825 /nfs/dbraw/zinc/37/08/25/464370825.db2.gz FORDSMKXALFMQO-ZDUSSCGKSA-N 1 1 349.431 2.031 10 5 EEBEMO C[C@H]1CN(C(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@H+]1CCO ZINC000188793400 464370829 /nfs/dbraw/zinc/37/08/29/464370829.db2.gz FORDSMKXALFMQO-ZDUSSCGKSA-N 1 1 349.431 2.031 10 5 EEBEMO C[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccccc1 ZINC000242047896 464456601 /nfs/dbraw/zinc/45/66/01/464456601.db2.gz VQYMHDXOOQUUNH-CXAGYDPISA-N 1 1 338.371 2.495 10 5 EEBEMO O=[N+]([O-])c1cnc(N2CC[N@@H+]3CCC[C@H]3C2)c(Br)c1 ZINC000246337002 464572856 /nfs/dbraw/zinc/57/28/56/464572856.db2.gz BYEHPZIWOIGMSA-VIFPVBQESA-N 1 1 327.182 2.037 10 5 EEBEMO O=[N+]([O-])c1cnc(N2CC[N@H+]3CCC[C@H]3C2)c(Br)c1 ZINC000246337002 464572864 /nfs/dbraw/zinc/57/28/64/464572864.db2.gz BYEHPZIWOIGMSA-VIFPVBQESA-N 1 1 327.182 2.037 10 5 EEBEMO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H]1CCN2CCO[C@H]1C2 ZINC000295125056 464713577 /nfs/dbraw/zinc/71/35/77/464713577.db2.gz 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COC(=O)[C@]1(OC)CC[N@@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000600191239 468490410 /nfs/dbraw/zinc/49/04/10/468490410.db2.gz KOHVQXSSYGSHSN-VEMDQMBVSA-N 1 1 334.372 2.262 10 5 EEBEMO O=C(NC1CC([NH+]2CCCCC2)C1)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000370196169 466794233 /nfs/dbraw/zinc/79/42/33/466794233.db2.gz XRIGWHQMYFZTQS-UHFFFAOYSA-N 1 1 343.387 2.218 10 5 EEBEMO COc1cc(C[N@H+](C[C@@H]2CCC(=O)N2)C(C)C)c([N+](=O)[O-])cc1F ZINC000412066120 466991078 /nfs/dbraw/zinc/99/10/78/466991078.db2.gz DSKFRAONBLRTHG-LBPRGKRZSA-N 1 1 339.367 2.232 10 5 EEBEMO COc1cc(C[N@@H+](C[C@@H]2CCC(=O)N2)C(C)C)c([N+](=O)[O-])cc1F ZINC000412066120 466991079 /nfs/dbraw/zinc/99/10/79/466991079.db2.gz DSKFRAONBLRTHG-LBPRGKRZSA-N 1 1 339.367 2.232 10 5 EEBEMO Nc1nccc([C@H]2CCC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000429700161 467360019 /nfs/dbraw/zinc/36/00/19/467360019.db2.gz HNBZVZHTGCZQIM-NSHDSACASA-N 1 1 331.351 2.486 10 5 EEBEMO Nc1nccc([C@H]2CCC[N@@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)n1 ZINC000429700161 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BKNMDODPXOHICV-GHMZBOCLSA-N 1 1 326.372 2.429 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])s1 ZINC000601306642 468819090 /nfs/dbraw/zinc/81/90/90/468819090.db2.gz NPRRPBZGPMMYBL-JTQLQIEISA-N 1 1 347.462 2.117 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])s1 ZINC000601306642 468819094 /nfs/dbraw/zinc/81/90/94/468819094.db2.gz NPRRPBZGPMMYBL-JTQLQIEISA-N 1 1 347.462 2.117 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC3(CCC[N@H+]3C)CC2)c1 ZINC000593021335 468841980 /nfs/dbraw/zinc/84/19/80/468841980.db2.gz VVLFZMWKFJGWOG-UHFFFAOYSA-N 1 1 347.415 2.442 10 5 EEBEMO C[C@@H]1C[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)CCc2ccccc21 ZINC000593092019 468867769 /nfs/dbraw/zinc/86/77/69/468867769.db2.gz RFJUHOLEEIXDBP-CQSZACIVSA-N 1 1 327.384 2.418 10 5 EEBEMO Cc1cc(S(=O)(=O)N(C)[C@H]2CC[N@H+](C(C)C)C2)c([N+](=O)[O-])s1 ZINC000601433648 468871712 /nfs/dbraw/zinc/87/17/12/468871712.db2.gz GSJAYJNBEBWGOK-NSHDSACASA-N 1 1 347.462 2.068 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000598465596 468874794 /nfs/dbraw/zinc/87/47/94/468874794.db2.gz GMMBRIUWMSAIOD-UHFFFAOYSA-N 1 1 336.436 2.268 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@]3(CC3(F)F)C2)c1 ZINC000593114614 468875864 /nfs/dbraw/zinc/87/58/64/468875864.db2.gz DQDKOAFXYNJUOX-OCCSQVGLSA-N 1 1 328.315 2.066 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@@H](Cn2ccnn2)C1 ZINC000595608290 468920983 /nfs/dbraw/zinc/92/09/83/468920983.db2.gz NFCSYRGKTQZPMJ-CYBMUJFWSA-N 1 1 331.376 2.107 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H]2COC[C@@]2(C)C1 ZINC000595756451 468992090 /nfs/dbraw/zinc/99/20/90/468992090.db2.gz GDUDLGIWTMWRQO-SUMWQHHRSA-N 1 1 333.388 2.200 10 5 EEBEMO Cn1nccc1[C@H](CO)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000599053642 469101919 /nfs/dbraw/zinc/10/19/19/469101919.db2.gz FSDWSGPNFNWILU-HOTGVXAUSA-N 1 1 330.388 2.419 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1 ZINC000602923312 469166882 /nfs/dbraw/zinc/16/68/82/469166882.db2.gz GSTVSLSICKGIOC-SJLPKXTDSA-N 1 1 344.367 2.228 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1C[C@@H](O)[C@H](Oc2ccccc2)C1 ZINC000602923312 469166885 /nfs/dbraw/zinc/16/68/85/469166885.db2.gz GSTVSLSICKGIOC-SJLPKXTDSA-N 1 1 344.367 2.228 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2C2(O)CC2)c2c(c1)COCO2 ZINC000573806675 469210137 /nfs/dbraw/zinc/21/01/37/469210137.db2.gz DETIXOQQDMCYQN-HNNXBMFYSA-N 1 1 334.372 2.341 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000611513273 469269579 /nfs/dbraw/zinc/26/95/79/469269579.db2.gz COZVHCSQCHHOQZ-ZDUSSCGKSA-N 1 1 340.811 2.184 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N(C)[C@@H]2CC[N@H+](C3CCN(C)CC3)C2)n1 ZINC000611616529 469293379 /nfs/dbraw/zinc/29/33/79/469293379.db2.gz WGHFMADCBUFYLM-MRXNPFEDSA-N 1 1 347.463 2.211 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N(C)[C@@H]2CCN(C3CC[NH+](C)CC3)C2)n1 ZINC000611616529 469293382 /nfs/dbraw/zinc/29/33/82/469293382.db2.gz WGHFMADCBUFYLM-MRXNPFEDSA-N 1 1 347.463 2.211 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21 ZINC000599680548 469336081 /nfs/dbraw/zinc/33/60/81/469336081.db2.gz GDFWPJFGKYJKPR-XGWLTEMNSA-N 1 1 333.388 2.077 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(NC(C)(C)CCN2CC[NH+](C)CC2)n1 ZINC000613704975 469770058 /nfs/dbraw/zinc/77/00/58/469770058.db2.gz APWAMWAYXOTAJU-UHFFFAOYSA-N 1 1 335.452 2.435 10 5 EEBEMO C[C@H]1CC[C@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000187909883 533771052 /nfs/dbraw/zinc/77/10/52/533771052.db2.gz QOFGSXMMVXXDEG-SJCJKPOMSA-N 1 1 336.388 2.444 10 5 EEBEMO CN(C(=O)C[N@@H+]1CCC[C@@]2(CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000451910012 535986762 /nfs/dbraw/zinc/98/67/62/535986762.db2.gz XXZMHLUQQVOEDI-QGZVFWFLSA-N 1 1 333.388 2.060 10 5 EEBEMO CN(C(=O)C[N@H+]1CCC[C@@]2(CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000451910012 535986769 /nfs/dbraw/zinc/98/67/69/535986769.db2.gz XXZMHLUQQVOEDI-QGZVFWFLSA-N 1 1 333.388 2.060 10 5 EEBEMO CC(C)(C)OC(=O)[C@](C)(O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000776521669 577461385 /nfs/dbraw/zinc/46/13/85/577461385.db2.gz XPGBHQMXSLWPQG-OAHLLOKOSA-N 1 1 344.795 2.431 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1cccnn1)Cc1cccc([N+](=O)[O-])c1 ZINC001266575493 1176873000 /nfs/dbraw/zinc/87/30/00/1176873000.db2.gz QMCONFIJAVCZTE-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO CCn1cccc1C(=O)NCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267229796 1178549417 /nfs/dbraw/zinc/54/94/17/1178549417.db2.gz DEKIGBYJIGGFGB-UHFFFAOYSA-N 1 1 330.388 2.278 10 5 EEBEMO CCn1cccc1C(=O)NCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001267229796 1178549422 /nfs/dbraw/zinc/54/94/22/1178549422.db2.gz DEKIGBYJIGGFGB-UHFFFAOYSA-N 1 1 330.388 2.278 10 5 EEBEMO Cc1n[nH]cc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001267330688 1178768162 /nfs/dbraw/zinc/76/81/62/1178768162.db2.gz JNWLSAAABCDDQT-UHFFFAOYSA-N 1 1 343.387 2.021 10 5 EEBEMO Cc1ccn(C)c1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001268235097 1182052537 /nfs/dbraw/zinc/05/25/37/1182052537.db2.gz YUGIPSKVNBPAEE-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO Cc1ccn(C)c1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001268235097 1182052544 /nfs/dbraw/zinc/05/25/44/1182052544.db2.gz YUGIPSKVNBPAEE-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO O=C(NC1(C[NH2+]Cc2ccc(CF)cc2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001481896479 1182906899 /nfs/dbraw/zinc/90/68/99/1182906899.db2.gz RMLPFOBWQWYJNG-HZPDHXFCSA-N 1 1 349.406 2.340 10 5 EEBEMO Cn1cc(C(F)F)c(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)n1 ZINC000872234618 1198103451 /nfs/dbraw/zinc/10/34/51/1198103451.db2.gz VNEVPCXQVZAHMF-ZDUSSCGKSA-N 1 1 326.303 2.089 10 5 EEBEMO C[N@H+]1CCN(c2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CCC1(C)C ZINC000866115175 1201437402 /nfs/dbraw/zinc/43/74/02/1201437402.db2.gz WXHIGSYWPFNZMU-UHFFFAOYSA-N 1 1 331.376 2.164 10 5 EEBEMO COc1ccc2c(c1)CCN2C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867950628 1201712801 /nfs/dbraw/zinc/71/28/01/1201712801.db2.gz XLVKAOMLVFVFNP-SFHVURJKSA-N 1 1 341.367 2.367 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000928448917 1206385687 /nfs/dbraw/zinc/38/56/87/1206385687.db2.gz DRYRDJVPGDBPRB-CZUORRHYSA-N 1 1 346.431 2.408 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH2+][C@H]2C[C@@H](O)C23CCC3)o1 ZINC001196124224 1283922100 /nfs/dbraw/zinc/92/21/00/1283922100.db2.gz LOIFRVJCZMKTOR-QWHCGFSZSA-N 1 1 330.344 2.038 10 5 EEBEMO Cc1ccncc1N1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000799188844 1305180835 /nfs/dbraw/zinc/18/08/35/1305180835.db2.gz VHIVSMVXDDAFHT-SFHVURJKSA-N 1 1 342.399 2.154 10 5 EEBEMO O=C([C@H]1CC[C@H]2CCCC[N@H+]21)N1CCc2ccc([N+](=O)[O-])cc2C1 ZINC001262155599 1322249701 /nfs/dbraw/zinc/24/97/01/1322249701.db2.gz PVIHJYFPFGDNGT-NVXWUHKLSA-N 1 1 329.400 2.496 10 5 EEBEMO C[N@@H+](CCCNC(=O)Cc1ccc[nH]1)Cc1ccccc1[N+](=O)[O-] ZINC001265976433 1323536161 /nfs/dbraw/zinc/53/61/61/1323536161.db2.gz RLUFJKLFQIXOLX-UHFFFAOYSA-N 1 1 330.388 2.104 10 5 EEBEMO CCC[NH2+]CC1(c2ccccc2)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001281588288 1325327672 /nfs/dbraw/zinc/32/76/72/1325327672.db2.gz XOLZANWTEPMTQC-IAGOWNOFSA-N 1 1 345.443 2.212 10 5 EEBEMO Cc1c(C(=O)NC[C@@H]2CCCC[N@@H+]2C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001627288788 1352490128 /nfs/dbraw/zinc/49/01/28/1352490128.db2.gz CFALYRPJXLINON-NSHDSACASA-N 1 1 336.348 2.026 10 5 EEBEMO COCC[N@@H+](C)CCCNc1cc(C)c([N+](=O)[O-])cc1C(=O)OC ZINC001639268740 1352696221 /nfs/dbraw/zinc/69/62/21/1352696221.db2.gz RGRNZWQLHPZQTH-UHFFFAOYSA-N 1 1 339.392 2.070 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@H+]2CCC[C@H]2CO)o1 ZINC001653329480 1354120887 /nfs/dbraw/zinc/12/08/87/1354120887.db2.gz KCDPSRHGUQRFJA-JTQLQIEISA-N 1 1 338.751 2.255 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@H]2CO)o1 ZINC001653329480 1354120890 /nfs/dbraw/zinc/12/08/90/1354120890.db2.gz KCDPSRHGUQRFJA-JTQLQIEISA-N 1 1 338.751 2.255 10 5 EEBEMO COC(=O)c1cc(NC(=O)[C@@H]2CC[C@@H]3CCCC[N@H+]32)cc([N+](=O)[O-])c1 ZINC001136960409 788353754 /nfs/dbraw/zinc/35/37/54/788353754.db2.gz ULNZJXTWVNDFQK-ZFWWWQNUSA-N 1 1 347.371 2.337 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)/C=C\c3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000913295309 788772452 /nfs/dbraw/zinc/77/24/52/788772452.db2.gz RYPXJXKKFLIYJZ-VTUQDJEPSA-N 1 1 329.400 2.408 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])ccc1N(C)C ZINC000844656871 789282218 /nfs/dbraw/zinc/28/22/18/789282218.db2.gz XUGYNDWFMMCUSS-UHFFFAOYSA-N 1 1 336.436 2.369 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1C[C@H]([NH+]2CCOCC2)C1(C)C ZINC000828133617 800608715 /nfs/dbraw/zinc/60/87/15/800608715.db2.gz BGQRDYZFLVMPAD-CABCVRRESA-N 1 1 347.415 2.132 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@@H](O)c2ncc[nH]2)CC1 ZINC000787995346 807327539 /nfs/dbraw/zinc/32/75/39/807327539.db2.gz JAMLSMRRORMVNZ-OAHLLOKOSA-N 1 1 334.351 2.403 10 5 EEBEMO CCNC(=O)C[C@H]1CCCC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000789521334 808040632 /nfs/dbraw/zinc/04/06/32/808040632.db2.gz 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Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)c(F)c1 ZINC000270785164 256171368 /nfs/dbraw/zinc/17/13/68/256171368.db2.gz PYJUEYCBPFRDKD-STQMWFEESA-N 1 1 337.330 2.464 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)c(F)c1 ZINC000270785164 256171369 /nfs/dbraw/zinc/17/13/69/256171369.db2.gz PYJUEYCBPFRDKD-STQMWFEESA-N 1 1 337.330 2.464 10 5 EEBEMO COCCNC(=O)[C@H]1CC[C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000273378264 256291363 /nfs/dbraw/zinc/29/13/63/256291363.db2.gz BRKZFGOATNHTAC-ZBFHGGJFSA-N 1 1 349.431 2.266 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@H]([NH3+])C(C)(C)C1 ZINC000261713625 160410531 /nfs/dbraw/zinc/41/05/31/160410531.db2.gz MUEGJWMUXQZXOL-OAHLLOKOSA-N 1 1 334.420 2.291 10 5 EEBEMO C[C@@H]1C[N@@H+](CCCOc2ccc([N+](=O)[O-])cc2)C[C@H]1N1CCOCC1 ZINC000246508895 160282115 /nfs/dbraw/zinc/28/21/15/160282115.db2.gz QJMBBUIDVIOATM-CRAIPNDOSA-N 1 1 349.431 2.016 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CC[C@]2(C1)CCCOC2 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C[N@H+](CCOc1cccc(F)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053186500 214169172 /nfs/dbraw/zinc/16/91/72/214169172.db2.gz LSJXQFVCEXLWMJ-UHFFFAOYSA-N 1 1 347.346 2.344 10 5 EEBEMO C[N@@H+](CCOc1cccc(F)c1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000053186500 214169175 /nfs/dbraw/zinc/16/91/75/214169175.db2.gz LSJXQFVCEXLWMJ-UHFFFAOYSA-N 1 1 347.346 2.344 10 5 EEBEMO C[N@@H+](CCSc1ncc([N+](=O)[O-])cc1C(N)=O)Cc1ccccc1 ZINC000193745370 240292990 /nfs/dbraw/zinc/29/29/90/240292990.db2.gz FBVGIDYRRZAMHQ-UHFFFAOYSA-N 1 1 346.412 2.313 10 5 EEBEMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)[C@@H](C)O1 ZINC000446068344 242153134 /nfs/dbraw/zinc/15/31/34/242153134.db2.gz HQOXLLGHRUZPLX-FRRDWIJNSA-N 1 1 349.387 2.391 10 5 EEBEMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@@H](C)[C@@H](C)O1 ZINC000446068344 242153137 /nfs/dbraw/zinc/15/31/37/242153137.db2.gz HQOXLLGHRUZPLX-FRRDWIJNSA-N 1 1 349.387 2.391 10 5 EEBEMO CCOC(=O)[C@@H]1C[N@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC12COC2 ZINC000451131896 243010422 /nfs/dbraw/zinc/01/04/22/243010422.db2.gz HSPXDFVUVLBQFR-CJNGLKHVSA-N 1 1 348.399 2.476 10 5 EEBEMO CNc1ccc(C[N@H+]2CCC[C@H](CN3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000093017506 218186282 /nfs/dbraw/zinc/18/62/82/218186282.db2.gz LTAWJAXSCXVOGL-MRXNPFEDSA-N 1 1 348.447 2.181 10 5 EEBEMO CNc1ccc(CN2CCC[C@H](C[NH+]3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000093017506 218186284 /nfs/dbraw/zinc/18/62/84/218186284.db2.gz LTAWJAXSCXVOGL-MRXNPFEDSA-N 1 1 348.447 2.181 10 5 EEBEMO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2CCc3[nH]cnc3C2)n1 ZINC000353626490 285168197 /nfs/dbraw/zinc/16/81/97/285168197.db2.gz ILFVYZUKIPZEPI-CORIIIEPSA-N 1 1 330.392 2.145 10 5 EEBEMO Cc1nc(CN2CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3C)CC2)no1 ZINC000105867020 159310104 /nfs/dbraw/zinc/31/01/04/159310104.db2.gz RLRUCJMGZYYPKR-UHFFFAOYSA-N 1 1 345.403 2.303 10 5 EEBEMO CCOCC[N@H+]1CCN(Cc2ccc(OC)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000106110958 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CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC(=O)N([C@@H]2C[C@@H]2C)C1 ZINC000363264157 466317010 /nfs/dbraw/zinc/31/70/10/466317010.db2.gz JGSQYPIRIIHWNT-NJZAAPMLSA-N 1 1 333.388 2.092 10 5 EEBEMO CN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](C2CC2)C1 ZINC000347016371 466322627 /nfs/dbraw/zinc/32/26/27/466322627.db2.gz WBWXJQNGTPWKGS-CQSZACIVSA-N 1 1 333.388 2.059 10 5 EEBEMO CN(C)C(=O)N(C)[C@H]1CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000597224930 468486726 /nfs/dbraw/zinc/48/67/26/468486726.db2.gz VIKULZAOICRUII-VFADXPBXSA-N 1 1 332.404 2.296 10 5 EEBEMO CN(C)C(=O)N(C)[C@H]1CC[N@@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000597224930 468486728 /nfs/dbraw/zinc/48/67/28/468486728.db2.gz VIKULZAOICRUII-VFADXPBXSA-N 1 1 332.404 2.296 10 5 EEBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H]1CCS(=O)(=O)C1 ZINC000347353745 466586889 /nfs/dbraw/zinc/58/68/89/466586889.db2.gz GZYMHFBAIMGDIC-XETPBLJFSA-N 1 1 338.429 2.365 10 5 EEBEMO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)C[C@H]1CCS(=O)(=O)C1 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ZINC001473602459 1110577368 /nfs/dbraw/zinc/57/73/68/1110577368.db2.gz RFYYDQQLOZBTTE-GFCCVEGCSA-N 1 1 330.344 2.094 10 5 EEBEMO CC1(CNC(=O)[C@@H]2CC2[N+](=O)[O-])CC[NH+](Cc2ccccc2F)CC1 ZINC001500424408 1112821191 /nfs/dbraw/zinc/82/11/91/1112821191.db2.gz DGPHJOKOPBANSQ-GDBMZVCRSA-N 1 1 349.406 2.209 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)[C@@H]2C1 ZINC001520867978 1119199324 /nfs/dbraw/zinc/19/93/24/1119199324.db2.gz OPGXNSPOKBOWSP-NORZTCDRSA-N 1 1 349.406 2.468 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000451896996 243298183 /nfs/dbraw/zinc/29/81/83/243298183.db2.gz VNZHHFQRTXDNJZ-GXFFZTMASA-N 1 1 334.294 2.349 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000451896996 243298188 /nfs/dbraw/zinc/29/81/88/243298188.db2.gz VNZHHFQRTXDNJZ-GXFFZTMASA-N 1 1 334.294 2.349 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000245661658 160246824 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Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1CCC[C@@H](c2nc(=O)[nH][nH]2)C1 ZINC000289585974 275130055 /nfs/dbraw/zinc/13/00/55/275130055.db2.gz ZGSBWUSTWGUSKD-VXGBXAGGSA-N 1 1 331.376 2.255 10 5 EEBEMO Cn1cccc1[C@@H]1CCCC[N@H+]1CCn1cc([N+](=O)[O-])ccc1=O ZINC000090551470 294385210 /nfs/dbraw/zinc/38/52/10/294385210.db2.gz ICQZHWRXZPGWKR-INIZCTEOSA-N 1 1 330.388 2.322 10 5 EEBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)c1ccc(N2CCCC2)c([N+](=O)[O-])c1 ZINC000155770284 300222411 /nfs/dbraw/zinc/22/24/11/300222411.db2.gz WBXLGXOQJTVDKY-KBPBESRZSA-N 1 1 346.431 2.360 10 5 EEBEMO CC(C)[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H](O)CO ZINC000421402200 314097505 /nfs/dbraw/zinc/09/75/05/314097505.db2.gz DGJLAMXOWWUZOX-OAHLLOKOSA-N 1 1 334.372 2.418 10 5 EEBEMO COc1cc(C[NH2+][C@]2(CO)CCOc3ccccc32)ccc1[N+](=O)[O-] ZINC000440465974 315133125 /nfs/dbraw/zinc/13/31/25/315133125.db2.gz SMRGLHMVOUZEHL-SFHVURJKSA-N 1 1 344.367 2.363 10 5 EEBEMO COc1ccccc1[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 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342.193 2.181 10 5 EEBEMO O=[N+]([O-])c1ccccc1CN1CC[NH+](C[C@H](O)c2ccccc2)CC1 ZINC000106097586 463506246 /nfs/dbraw/zinc/50/62/46/463506246.db2.gz IATDSXFRPDYHNO-IBGZPJMESA-N 1 1 341.411 2.446 10 5 EEBEMO Cn1c(-c2ccc([N+](=O)[O-])cc2)nnc1N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000283072755 463753956 /nfs/dbraw/zinc/75/39/56/463753956.db2.gz GYMYMBAYMLSERO-OAHLLOKOSA-N 1 1 342.403 2.065 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000177699986 463770157 /nfs/dbraw/zinc/77/01/57/463770157.db2.gz SUHCLCIVRBHGFD-XJKSGUPXSA-N 1 1 334.420 2.338 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000174393004 464402557 /nfs/dbraw/zinc/40/25/57/464402557.db2.gz WDXMVFHEFMCTDG-GDBMZVCRSA-N 1 1 332.404 2.363 10 5 EEBEMO CO[C@H]1C[C@H](c2nc(C)no2)[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000189329068 464478416 /nfs/dbraw/zinc/47/84/16/464478416.db2.gz QOZZJQAWUUSXKI-LSDHHAIUSA-N 1 1 332.360 2.291 10 5 EEBEMO CO[C@H]1C[C@H](c2nc(C)no2)[N@@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000189329068 464478420 /nfs/dbraw/zinc/47/84/20/464478420.db2.gz QOZZJQAWUUSXKI-LSDHHAIUSA-N 1 1 332.360 2.291 10 5 EEBEMO COc1cc(C[N@H+](C)CCCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000281904619 464628953 /nfs/dbraw/zinc/62/89/53/464628953.db2.gz QUZXJVHGRWDCJB-UHFFFAOYSA-N 1 1 334.319 2.062 10 5 EEBEMO COc1cc(C[N@@H+](C)CCCO)c([N+](=O)[O-])cc1OCC(F)F ZINC000281904619 464628958 /nfs/dbraw/zinc/62/89/58/464628958.db2.gz QUZXJVHGRWDCJB-UHFFFAOYSA-N 1 1 334.319 2.062 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000266746622 464808045 /nfs/dbraw/zinc/80/80/45/464808045.db2.gz GCQLBDLZONTYTQ-HIFRSBDPSA-N 1 1 334.420 2.261 10 5 EEBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1CC[NH2+]C[C@H]1C(F)F ZINC000367392615 466309719 /nfs/dbraw/zinc/30/97/19/466309719.db2.gz SAPOFMTXQDSAPA-CABZTGNLSA-N 1 1 345.371 2.141 10 5 EEBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000372482151 466411593 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QDCBOIHFJBZXRL-CWRNSKLLSA-N 1 1 336.436 2.300 10 5 EEBEMO CCN(C(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[C@H]1CC[N@@H+](C)C1 ZINC000597946278 468721212 /nfs/dbraw/zinc/72/12/12/468721212.db2.gz NDFDVBMWBWKELF-NSHDSACASA-N 1 1 343.330 2.362 10 5 EEBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[C@@H](C)n2ncnc21 ZINC000595069155 468752348 /nfs/dbraw/zinc/75/23/48/468752348.db2.gz NEZDPGYBTGQCSC-JTNHKYCSSA-N 1 1 344.375 2.199 10 5 EEBEMO C[C@@H]1CN(c2ccnc3ccc([N+](=O)[O-])cc32)[C@@H](C)C[N@H+]1CCO ZINC000601175870 468771722 /nfs/dbraw/zinc/77/17/22/468771722.db2.gz RCBQNSPCFURTSG-OLZOCXBDSA-N 1 1 330.388 2.034 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C)C2CCC(CO)CC2)c1 ZINC000593021934 468842172 /nfs/dbraw/zinc/84/21/72/468842172.db2.gz BANRPGMDGOWWEM-UHFFFAOYSA-N 1 1 336.388 2.364 10 5 EEBEMO COc1ccc(CC(=O)NCCC[N@@H+](C)CC(C)C)cc1[N+](=O)[O-] ZINC000593204195 468904093 /nfs/dbraw/zinc/90/40/93/468904093.db2.gz MEHHTNSWKVWIMB-UHFFFAOYSA-N 1 1 337.420 2.240 10 5 EEBEMO C[N@@H+]1C[C@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C[C@H]2C1 ZINC000601542261 468912652 /nfs/dbraw/zinc/91/26/52/468912652.db2.gz ZZASXWQDVSJXCC-OKILXGFUSA-N 1 1 329.400 2.037 10 5 EEBEMO C[N@@H+](CCCO)C1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593461091 468989619 /nfs/dbraw/zinc/98/96/19/468989619.db2.gz HJNJKCKSKFUDQM-UHFFFAOYSA-N 1 1 344.415 2.426 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2C[C@@H]3COC[C@]3(C)C2)cccc1[N+](=O)[O-] ZINC000595761471 468994275 /nfs/dbraw/zinc/99/42/75/468994275.db2.gz WYQPWWHEEXWBTF-DYVFJYSZSA-N 1 1 333.388 2.200 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH+]2CC3(C2)CC(F)(F)C3)c1 ZINC000611180528 469185326 /nfs/dbraw/zinc/18/53/26/469185326.db2.gz JPWBXJZKMXKUMX-GFCCVEGCSA-N 1 1 328.315 2.066 10 5 EEBEMO COC(=O)c1c(Cl)c(N2C[C@@H]3C[N@H+](C)C[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000596214256 469205924 /nfs/dbraw/zinc/20/59/24/469205924.db2.gz QYDJDZLZCPCSQF-AOOOYVTPSA-N 1 1 339.779 2.033 10 5 EEBEMO COc1cc(NCC[NH+]2CCC(O)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596258623 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SXENHAUZGXPCDN-CZUORRHYSA-N 1 1 334.420 2.309 10 5 EEBEMO Cc1cc(NC(=O)c2ccc([N+](=O)[O-])c(-n3ccnc3)c2)cc(C)[nH+]1 ZINC001127822671 788043261 /nfs/dbraw/zinc/04/32/61/788043261.db2.gz INCRPKKBYXTGMQ-UHFFFAOYSA-N 1 1 337.339 2.467 10 5 EEBEMO CCC[N@H+]1CCC[C@H](C(=O)N[C@](C)(CO)c2cccc([N+](=O)[O-])c2)C1 ZINC000913659190 794039889 /nfs/dbraw/zinc/03/98/89/794039889.db2.gz GPSJNHSXLIWXEO-KBXCAEBGSA-N 1 1 349.431 2.041 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[NH+](CCCCCO)CC2)c1C ZINC000913688211 794108166 /nfs/dbraw/zinc/10/81/66/794108166.db2.gz OWTMUPVWEFSPPP-UHFFFAOYSA-N 1 1 349.431 2.132 10 5 EEBEMO CC(C)(O)[C@@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001175883087 798261481 /nfs/dbraw/zinc/26/14/81/798261481.db2.gz PGRIUVVRWLCQNB-LLVKDONJSA-N 1 1 332.360 2.238 10 5 EEBEMO COC(=O)C[C@@H]1C[N@@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC001176209394 798379485 /nfs/dbraw/zinc/37/94/85/798379485.db2.gz CRTFXQPGRBGLFS-CHWSQXEVSA-N 1 1 349.387 2.054 10 5 EEBEMO 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ZINC000246041934 464535796 /nfs/dbraw/zinc/53/57/96/464535796.db2.gz BHVUMHVEISASPB-QWHCGFSZSA-N 1 1 341.433 2.006 10 5 EEBEMO COc1cc(C(=O)N2CCC[C@@H]2Cn2cc[nH+]c2C)ccc1[N+](=O)[O-] ZINC000177164792 464947633 /nfs/dbraw/zinc/94/76/33/464947633.db2.gz YUTCWVDHZSIKED-CQSZACIVSA-N 1 1 344.371 2.413 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)CN1CCCCC1)CCC2 ZINC000192721836 464983783 /nfs/dbraw/zinc/98/37/83/464983783.db2.gz MYUPTMFFZGEHMB-AEFFLSMTSA-N 1 1 333.432 2.409 10 5 EEBEMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000362289159 465632496 /nfs/dbraw/zinc/63/24/96/465632496.db2.gz NNGBGFKTMJCFBF-SNVBAGLBSA-N 1 1 341.209 2.425 10 5 EEBEMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000362289159 465632503 /nfs/dbraw/zinc/63/25/03/465632503.db2.gz NNGBGFKTMJCFBF-SNVBAGLBSA-N 1 1 341.209 2.425 10 5 EEBEMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[NH+](CCCF)CC1 ZINC000600072622 468448583 /nfs/dbraw/zinc/44/85/83/468448583.db2.gz 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COC1(CC(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CCC1 ZINC001267193446 1178469117 /nfs/dbraw/zinc/46/91/17/1178469117.db2.gz QDTZAMUTOOJDAR-UHFFFAOYSA-N 1 1 335.404 2.102 10 5 EEBEMO C[N@H+](CCNC(=O)COc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001267227349 1178545490 /nfs/dbraw/zinc/54/54/90/1178545490.db2.gz MOBWMZCETBMBGR-UHFFFAOYSA-N 1 1 343.383 2.222 10 5 EEBEMO C[N@@H+](CCNC(=O)COc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC001267227349 1178545492 /nfs/dbraw/zinc/54/54/92/1178545492.db2.gz MOBWMZCETBMBGR-UHFFFAOYSA-N 1 1 343.383 2.222 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C\CNC(=O)CC1(C)CCCC1 ZINC001268535463 1183194443 /nfs/dbraw/zinc/19/44/43/1183194443.db2.gz GYVHAAGMHZRYOG-WAYWQWQTSA-N 1 1 349.435 2.061 10 5 EEBEMO COCC(=O)NC[C@H]1C[C@H]2CC[C@@H](C1)[N@@H+]2Cc1ccc([N+](=O)[O-])cc1 ZINC001271721197 1186394092 /nfs/dbraw/zinc/39/40/92/1186394092.db2.gz KUEQTNYLVRENJL-ACHSLPGTSA-N 1 1 347.415 2.100 10 5 EEBEMO CCc1ocnc1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482585927 1186999344 /nfs/dbraw/zinc/99/93/44/1186999344.db2.gz GJRIYJHFQHQMST-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO CCc1ocnc1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482585927 1186999347 /nfs/dbraw/zinc/99/93/47/1186999347.db2.gz GJRIYJHFQHQMST-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO CCN(CC[NH2+]Cc1cc2ccccc2o1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001482924433 1187844534 /nfs/dbraw/zinc/84/45/34/1187844534.db2.gz GYFGMYQFHBOIMH-HUUCEWRRSA-N 1 1 331.372 2.036 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(c3ncc(Br)cc3[N+](=O)[O-])CC[C@H]21 ZINC000866205078 1201464164 /nfs/dbraw/zinc/46/41/64/1201464164.db2.gz JVENLLBLMJJTJD-GXSJLCMTSA-N 1 1 341.209 2.283 10 5 EEBEMO CCOC(=O)Cc1ccc(N2CC[C@H]3[C@@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000866208408 1201465753 /nfs/dbraw/zinc/46/57/53/1201465753.db2.gz IYSBFYFCCCPMEE-GJZGRUSLSA-N 1 1 347.415 2.231 10 5 EEBEMO Cc1cc(S(=O)(=O)N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])s1 ZINC000867680195 1201656999 /nfs/dbraw/zinc/65/69/99/1201656999.db2.gz BWGSTBMLRQAVEI-UHFFFAOYSA-N 1 1 347.462 2.070 10 5 EEBEMO Cc1cc(S(=O)(=O)N2CC[N@H+](C)C(C)(C)CC2)c([N+](=O)[O-])s1 ZINC000867680195 1201657007 /nfs/dbraw/zinc/65/70/07/1201657007.db2.gz BWGSTBMLRQAVEI-UHFFFAOYSA-N 1 1 347.462 2.070 10 5 EEBEMO C[C@H](NC(=O)N1CC[C@@H]2[C@H](CC[N@H+]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000868121028 1201747733 /nfs/dbraw/zinc/74/77/33/1201747733.db2.gz CXMNERFBXQPQDX-JGGQBBKZSA-N 1 1 332.404 2.391 10 5 EEBEMO Cc1c(CNC(=O)N2CC[C@@H]3[C@@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000868535406 1201829760 /nfs/dbraw/zinc/82/97/60/1201829760.db2.gz RVEWXHJCVFDXEV-GOEBONIOSA-N 1 1 332.404 2.139 10 5 EEBEMO CC[N@H+]1CC[C@@H]1CNC(=O)Cc1cc(F)c(Cl)cc1[N+](=O)[O-] ZINC000882492583 1201882045 /nfs/dbraw/zinc/88/20/45/1201882045.db2.gz QZSMASXTGRHPLE-SNVBAGLBSA-N 1 1 329.759 2.140 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H]3CC[C@@H](C4CC4)O3)CC2)cn1 ZINC000885938173 1202457324 /nfs/dbraw/zinc/45/73/24/1202457324.db2.gz UTIOERIBGFYWES-CVEARBPZSA-N 1 1 332.404 2.069 10 5 EEBEMO 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C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1nccc2cc([N+](=O)[O-])ccc21 ZINC000419008245 239397323 /nfs/dbraw/zinc/39/73/23/239397323.db2.gz VJODXKSTSVYDIZ-STQMWFEESA-N 1 1 330.388 2.034 10 5 EEBEMO COc1ccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000080717564 217327056 /nfs/dbraw/zinc/32/70/56/217327056.db2.gz XMKAUAKODYHAIV-AGUYFDCRSA-N 1 1 333.388 2.349 10 5 EEBEMO C[C@H]1C[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1 ZINC000154172774 224213701 /nfs/dbraw/zinc/21/37/01/224213701.db2.gz FOYDUQJRZWPWRI-LRDDRELGSA-N 1 1 339.823 2.401 10 5 EEBEMO C[C@H]1C[N@@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1N1CCOCC1 ZINC000154172774 224213703 /nfs/dbraw/zinc/21/37/03/224213703.db2.gz FOYDUQJRZWPWRI-LRDDRELGSA-N 1 1 339.823 2.401 10 5 EEBEMO C[C@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1[NH+]1CCOCC1 ZINC000154172774 224213704 /nfs/dbraw/zinc/21/37/04/224213704.db2.gz FOYDUQJRZWPWRI-LRDDRELGSA-N 1 1 339.823 2.401 10 5 EEBEMO Cc1ccc(O)c(C[N@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)n1 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CC[N@H+]1CC[C@@H](CNC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000107887745 463585510 /nfs/dbraw/zinc/58/55/10/463585510.db2.gz NFCVIAOZCBYAER-AWEZNQCLSA-N 1 1 346.431 2.267 10 5 EEBEMO COC(=O)c1cc(N2CCC[N@H+](C3CC3)CC2)cc(C)c1[N+](=O)[O-] ZINC000177822117 463800199 /nfs/dbraw/zinc/80/01/99/463800199.db2.gz YYKLHTHRRQZJBS-UHFFFAOYSA-N 1 1 333.388 2.364 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276994430 463834426 /nfs/dbraw/zinc/83/44/26/463834426.db2.gz VGFSTTVQAFVOJF-LLVKDONJSA-N 1 1 342.355 2.081 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCc2cc[nH]c(=O)c2C1 ZINC000276994430 463834429 /nfs/dbraw/zinc/83/44/29/463834429.db2.gz VGFSTTVQAFVOJF-LLVKDONJSA-N 1 1 342.355 2.081 10 5 EEBEMO CCc1n[nH]c(C(=O)N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000179220798 464085163 /nfs/dbraw/zinc/08/51/63/464085163.db2.gz QQCRHTFNYCIKBX-UKRRQHHQSA-N 1 1 343.387 2.056 10 5 EEBEMO CCC[N@@H+](C)C[C@@H]1CCN(S(=O)(=O)c2ccc([N+](=O)[O-])s2)C1 ZINC000173948470 464337384 /nfs/dbraw/zinc/33/73/84/464337384.db2.gz BCORZXCMEVMFIS-NSHDSACASA-N 1 1 347.462 2.009 10 5 EEBEMO CN1CCN([C@H]2CCCC[N@@H+](Cc3ccccc3[N+](=O)[O-])C2)CC1 ZINC000174901110 464466093 /nfs/dbraw/zinc/46/60/93/464466093.db2.gz FTNMRQGPOPAGKA-KRWDZBQOSA-N 1 1 332.448 2.197 10 5 EEBEMO CO[C@H]1C[N@@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC[C@@H]1C ZINC000189342945 464480658 /nfs/dbraw/zinc/48/06/58/464480658.db2.gz AZEVHRXOUPXKEJ-NHYWBVRUSA-N 1 1 339.367 2.419 10 5 EEBEMO Cc1cc(C)cc([C@@H]2CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)c1 ZINC000183479133 464869607 /nfs/dbraw/zinc/86/96/07/464869607.db2.gz DLOHQXLUIZFUEJ-QAPCUYQASA-N 1 1 344.415 2.259 10 5 EEBEMO CN(C)C(=O)C1CC[NH+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000176987754 464899245 /nfs/dbraw/zinc/89/92/45/464899245.db2.gz RSVNRNMENFINOJ-UHFFFAOYSA-N 1 1 332.360 2.036 10 5 EEBEMO CC(C)(C)C1=CC[N@@H+](CCNC(=O)c2cc([N+](=O)[O-])c[nH]c2=O)CC1 ZINC000356422924 465372244 /nfs/dbraw/zinc/37/22/44/465372244.db2.gz RFSYVHYONRNGIK-UHFFFAOYSA-N 1 1 348.403 2.103 10 5 EEBEMO Cc1[nH+]cn(-c2ccc(NC(=O)c3nn(C)cc3[N+](=O)[O-])cc2)c1C ZINC000360937923 465647528 /nfs/dbraw/zinc/64/75/28/465647528.db2.gz PBWKIMSIFPGRNM-UHFFFAOYSA-N 1 1 340.343 2.383 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCN(C2CC2)CC1 ZINC000299328039 465699421 /nfs/dbraw/zinc/69/94/21/465699421.db2.gz KLMAWTFBGSSXOU-UHFFFAOYSA-N 1 1 332.404 2.012 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000362448997 465748917 /nfs/dbraw/zinc/74/89/17/465748917.db2.gz NSROXMNXFIPFNQ-XJKSGUPXSA-N 1 1 333.388 2.343 10 5 EEBEMO COC(=O)COc1ccc(C[N@H+]2CCCSCC2)cc1[N+](=O)[O-] ZINC000349065476 465947410 /nfs/dbraw/zinc/94/74/10/465947410.db2.gz ZXCBOXNJLLQXKU-UHFFFAOYSA-N 1 1 340.401 2.086 10 5 EEBEMO CC1=CC[N@@H+](CCNc2cc3nc[nH]c(=O)c3cc2[N+](=O)[O-])CC1 ZINC000302147665 466106324 /nfs/dbraw/zinc/10/63/24/466106324.db2.gz KCVANEHZXUEREX-UHFFFAOYSA-N 1 1 329.360 2.308 10 5 EEBEMO C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098564 468484374 /nfs/dbraw/zinc/48/43/74/468484374.db2.gz JAANQGCUYDKZJV-KFWWJZLASA-N 1 1 349.431 2.141 10 5 EEBEMO C[C@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098564 468484378 /nfs/dbraw/zinc/48/43/78/468484378.db2.gz JAANQGCUYDKZJV-KFWWJZLASA-N 1 1 349.431 2.141 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CCO[C@@H](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000363776155 466610493 /nfs/dbraw/zinc/61/04/93/466610493.db2.gz FZUUVGHWQKQPDB-MRXNPFEDSA-N 1 1 333.388 2.343 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC1CCN(c2[nH+]ccn2C)CC1 ZINC000373027720 466668593 /nfs/dbraw/zinc/66/85/93/466668593.db2.gz PLVSQMKDSIBCHW-UHFFFAOYSA-N 1 1 343.387 2.036 10 5 EEBEMO Cc1sc(C(=O)N2CC[NH2+]C[C@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423958083 466928720 /nfs/dbraw/zinc/92/87/20/466928720.db2.gz BKGSXDNFIFNAOV-ZDUSSCGKSA-N 1 1 332.385 2.146 10 5 EEBEMO C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC[N@@H+]1CCO ZINC000450448942 467852015 /nfs/dbraw/zinc/85/20/15/467852015.db2.gz CXGQKRZYLPCNQT-GFCCVEGCSA-N 1 1 348.428 2.221 10 5 EEBEMO C[C@@H]1CN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC[N@H+]1CCO ZINC000450448942 467852019 /nfs/dbraw/zinc/85/20/19/467852019.db2.gz CXGQKRZYLPCNQT-GFCCVEGCSA-N 1 1 348.428 2.221 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c1 ZINC000589501689 468158397 /nfs/dbraw/zinc/15/83/97/468158397.db2.gz WFJMEBMBMRHNAU-HIFRSBDPSA-N 1 1 334.372 2.382 10 5 EEBEMO O=C(CNc1ccccc1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600471290 468567090 /nfs/dbraw/zinc/56/70/90/468567090.db2.gz KGOWSCNQLMOJQZ-AWEZNQCLSA-N 1 1 332.404 2.140 10 5 EEBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)[C@@H]1CCc2[nH]cnc2C1 ZINC000597625365 468619664 /nfs/dbraw/zinc/61/96/64/468619664.db2.gz AOSBZESGUYRNOV-CYBMUJFWSA-N 1 1 328.372 2.124 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H](O)[C@H]2CCc2ccccc2)c1 ZINC000592166858 468644581 /nfs/dbraw/zinc/64/45/81/468644581.db2.gz JZVNQFNNMKOEMK-QZTJIDSGSA-N 1 1 344.415 2.249 10 5 EEBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000592184751 468647933 /nfs/dbraw/zinc/64/79/33/468647933.db2.gz OZGCTLYTYLADOD-ZDUSSCGKSA-N 1 1 331.294 2.095 10 5 EEBEMO Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000594793894 468687904 /nfs/dbraw/zinc/68/79/04/468687904.db2.gz VYLJGORXSRFUEC-GFCCVEGCSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1ccc(S(=O)(=O)NC[C@H]2CC[N@H+]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000594793894 468687907 /nfs/dbraw/zinc/68/79/07/468687907.db2.gz VYLJGORXSRFUEC-GFCCVEGCSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CC[N@@H+]1C(C)(C)C ZINC000594793080 468688582 /nfs/dbraw/zinc/68/85/82/468688582.db2.gz UNAHFDQLFYEASI-ZDUSSCGKSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000594793080 468688584 /nfs/dbraw/zinc/68/85/84/468688584.db2.gz UNAHFDQLFYEASI-ZDUSSCGKSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1[nH+]ccn1CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601023453 468721585 /nfs/dbraw/zinc/72/15/85/468721585.db2.gz AJOQQXKKTCNZIA-UHFFFAOYSA-N 1 1 328.372 2.338 10 5 EEBEMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000594974544 468736219 /nfs/dbraw/zinc/73/62/19/468736219.db2.gz LPEIJUXNOFXEAP-SFHVURJKSA-N 1 1 341.411 2.451 10 5 EEBEMO O=[N+]([O-])c1ccccc1CNCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000594974544 468736225 /nfs/dbraw/zinc/73/62/25/468736225.db2.gz LPEIJUXNOFXEAP-SFHVURJKSA-N 1 1 341.411 2.451 10 5 EEBEMO CCN(C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](CC)C1 ZINC000598040510 468746509 /nfs/dbraw/zinc/74/65/09/468746509.db2.gz GWQDFHLXVXXSEK-GFCCVEGCSA-N 1 1 331.376 2.027 10 5 EEBEMO CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@H+](CC)C1 ZINC000598040510 468746511 /nfs/dbraw/zinc/74/65/11/468746511.db2.gz GWQDFHLXVXXSEK-GFCCVEGCSA-N 1 1 331.376 2.027 10 5 EEBEMO CCN(C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](CC)C1 ZINC000598040510 468746514 /nfs/dbraw/zinc/74/65/14/468746514.db2.gz GWQDFHLXVXXSEK-GFCCVEGCSA-N 1 1 331.376 2.027 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCCC[C@@H]2C2(O)CC2)c([N+](=O)[O-])c1 ZINC000571405311 468784211 /nfs/dbraw/zinc/78/42/11/468784211.db2.gz KEMKWJNXKDDVNV-MRXNPFEDSA-N 1 1 336.388 2.362 10 5 EEBEMO CC[N@H+]1C[C@H](C)N(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000593021165 468842536 /nfs/dbraw/zinc/84/25/36/468842536.db2.gz SJJFWJIXFXNSIZ-STQMWFEESA-N 1 1 335.404 2.296 10 5 EEBEMO CC[C@@H]1C[N@@H+](CC)CCN1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000593030164 468845679 /nfs/dbraw/zinc/84/56/79/468845679.db2.gz LTYBNCCEPNUEJA-OAHLLOKOSA-N 1 1 335.404 2.298 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@H+]2CCCC2(C)C)c([N+](=O)[O-])s1 ZINC000601434815 468871435 /nfs/dbraw/zinc/87/14/35/468871435.db2.gz WBNPTHWZXUJQHF-UHFFFAOYSA-N 1 1 347.462 2.117 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC[C@]3(CC[N@@H+](C)C3)C2)c1 ZINC000595504052 468879105 /nfs/dbraw/zinc/87/91/05/468879105.db2.gz DLCSCLKJFDBBPM-GOSISDBHSA-N 1 1 347.415 2.299 10 5 EEBEMO COC(=O)c1ccnc(NC[C@@H]2CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000598635622 468940869 /nfs/dbraw/zinc/94/08/69/468940869.db2.gz XPTCCDULWXDTOD-NSHDSACASA-N 1 1 336.392 2.309 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[NH+]2C[C@@H](C)C(O)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000595746888 468985110 /nfs/dbraw/zinc/98/51/10/468985110.db2.gz ZFHJENPMEBKONC-WZRBSPASSA-N 1 1 335.404 2.179 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCC[C@H](CCF)C1 ZINC000595755018 468990885 /nfs/dbraw/zinc/99/08/85/468990885.db2.gz DZEBXTIFKOVLCB-ZIAGYGMSSA-N 1 1 326.368 2.406 10 5 EEBEMO Cc1cn2c([nH+]1)C[C@@H](c1nc(-c3ccc(N)c([N+](=O)[O-])c3)no1)CC2 ZINC000599113002 469124199 /nfs/dbraw/zinc/12/41/99/469124199.db2.gz VQJZKAREFJGSDJ-NSHDSACASA-N 1 1 340.343 2.462 10 5 EEBEMO COc1cc(NCCC[NH+]2CCOCC2)c(Cl)cc1[N+](=O)[O-] ZINC000596050946 469128801 /nfs/dbraw/zinc/12/88/01/469128801.db2.gz HPSPEYHYRCVCIY-UHFFFAOYSA-N 1 1 329.784 2.391 10 5 EEBEMO Cc1cn2c([nH+]1)C[C@H](c1nc(Cc3ccc([N+](=O)[O-])cn3)no1)CC2 ZINC000599144080 469135383 /nfs/dbraw/zinc/13/53/83/469135383.db2.gz IFWFMFQXDNBXKF-LLVKDONJSA-N 1 1 340.343 2.199 10 5 EEBEMO C[N@@H+]1CCN(Cc2ccccc2)[C@@H](CNc2ncccc2[N+](=O)[O-])C1 ZINC000596551647 469298519 /nfs/dbraw/zinc/29/85/19/469298519.db2.gz LTLDTUCDXAPIHL-INIZCTEOSA-N 1 1 341.415 2.218 10 5 EEBEMO C[N@H+]1CCN(Cc2ccccc2)[C@@H](CNc2ncccc2[N+](=O)[O-])C1 ZINC000596551647 469298524 /nfs/dbraw/zinc/29/85/24/469298524.db2.gz LTLDTUCDXAPIHL-INIZCTEOSA-N 1 1 341.415 2.218 10 5 EEBEMO O=c1ccc([C@@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC000599640872 469320168 /nfs/dbraw/zinc/32/01/68/469320168.db2.gz IDQJBRDCUMBCMY-HNNXBMFYSA-N 1 1 330.344 2.306 10 5 EEBEMO CC[C@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451254584 536181982 /nfs/dbraw/zinc/18/19/82/536181982.db2.gz LSBIOXOMDHWIPO-MFKMUULPSA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451254584 536181987 /nfs/dbraw/zinc/18/19/87/536181987.db2.gz LSBIOXOMDHWIPO-MFKMUULPSA-N 1 1 341.795 2.280 10 5 EEBEMO COC(=O)/C=C\c1ccc(NCCc2c[nH+]cn2C)c([N+](=O)[O-])c1 ZINC000753526742 577789235 /nfs/dbraw/zinc/78/92/35/577789235.db2.gz CMAOQGIOXFKFFC-XQRVVYSFSA-N 1 1 330.344 2.169 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc(Cl)c1[N+](=O)[O-] ZINC000176251202 677803690 /nfs/dbraw/zinc/80/36/90/677803690.db2.gz VHYISBLKXKTRCQ-LLVKDONJSA-N 1 1 341.795 2.089 10 5 EEBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178865947 681282278 /nfs/dbraw/zinc/28/22/78/681282278.db2.gz GMWZKKGEDUMXBT-ZFWWWQNUSA-N 1 1 336.388 2.292 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1n[nH]cc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001266560403 1176846052 /nfs/dbraw/zinc/84/60/52/1176846052.db2.gz LKKOLEGUWGSIPA-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO Cc1ccc2ccccc2c1C[NH2+]CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001691315040 1177893217 /nfs/dbraw/zinc/89/32/17/1177893217.db2.gz QKDUHLJHXFLZTA-SJLPKXTDSA-N 1 1 341.411 2.361 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)COC(C)(C)C ZINC001482591399 1187157838 /nfs/dbraw/zinc/15/78/38/1187157838.db2.gz IXJNJXYTKBUQIR-UHFFFAOYSA-N 1 1 337.420 2.300 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)COC(C)(C)C ZINC001482591399 1187157841 /nfs/dbraw/zinc/15/78/41/1187157841.db2.gz IXJNJXYTKBUQIR-UHFFFAOYSA-N 1 1 337.420 2.300 10 5 EEBEMO CC(C)CCC[NH+]1CCC2(CCN(C(=O)[C@@H]3CC3[N+](=O)[O-])C2)CC1 ZINC001671050281 1193554149 /nfs/dbraw/zinc/55/41/49/1193554149.db2.gz PJRMPELGRFFXAA-HZPDHXFCSA-N 1 1 337.464 2.402 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872281987 1198128262 /nfs/dbraw/zinc/12/82/62/1198128262.db2.gz YQERPHAPSRRGJG-MRXNPFEDSA-N 1 1 335.404 2.180 10 5 EEBEMO COc1cc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)cc([N+](=O)[O-])c1C ZINC000871157177 1201077188 /nfs/dbraw/zinc/07/71/88/1201077188.db2.gz VPAUZJGJYFJXDP-UHFFFAOYSA-N 1 1 335.404 2.468 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000880182917 1201414493 /nfs/dbraw/zinc/41/44/93/1201414493.db2.gz FCNDCFWUQAONCR-UXLLHSPISA-N 1 1 334.372 2.046 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000868282849 1201782869 /nfs/dbraw/zinc/78/28/69/1201782869.db2.gz JBKLUEYAMMYPMQ-HNNXBMFYSA-N 1 1 332.404 2.187 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@@H]3c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1 ZINC000887938897 1204513814 /nfs/dbraw/zinc/51/38/14/1204513814.db2.gz FJPPYOGZVBIMJW-IIVZCXTMSA-N 1 1 329.400 2.108 10 5 EEBEMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000928100694 1206343757 /nfs/dbraw/zinc/34/37/57/1206343757.db2.gz JGCJEZGFCQXYIX-YPMHNXCESA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000928100694 1206343758 /nfs/dbraw/zinc/34/37/58/1206343758.db2.gz JGCJEZGFCQXYIX-YPMHNXCESA-N 1 1 339.392 2.044 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCCC2)CC[N@H+]1C ZINC000928448919 1206385964 /nfs/dbraw/zinc/38/59/64/1206385964.db2.gz DRYRDJVPGDBPRB-XJKSGUPXSA-N 1 1 346.431 2.408 10 5 EEBEMO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@H](C(F)F)CC1=O ZINC000795453410 1212784680 /nfs/dbraw/zinc/78/46/80/1212784680.db2.gz PBJBLQKNJUQYLE-GFCCVEGCSA-N 1 1 327.331 2.140 10 5 EEBEMO C[N@@H+](CCc1cccc([N+](=O)[O-])c1)CN1C[C@H](C(F)F)CC1=O ZINC000795453410 1212784684 /nfs/dbraw/zinc/78/46/84/1212784684.db2.gz PBJBLQKNJUQYLE-GFCCVEGCSA-N 1 1 327.331 2.140 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000902903703 1238998080 /nfs/dbraw/zinc/99/80/80/1238998080.db2.gz CGDQRCSAEQDMLR-ZIAGYGMSSA-N 1 1 336.417 2.296 10 5 EEBEMO O=C(CCCC[NH+]1CCOCC1)OCc1csc([N+](=O)[O-])c1 ZINC000803513478 1240586721 /nfs/dbraw/zinc/58/67/21/1240586721.db2.gz QKJYARSWAMDXIV-UHFFFAOYSA-N 1 1 328.390 2.202 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@H]1C ZINC001150119505 1316165487 /nfs/dbraw/zinc/16/54/87/1316165487.db2.gz DVVHMQQUXLMVET-YPMHNXCESA-N 1 1 333.388 2.206 10 5 EEBEMO Cc1cc(C(=O)OC[C@@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC001263620398 1322496056 /nfs/dbraw/zinc/49/60/56/1322496056.db2.gz SYVPHFRFVWGPLU-HNNXBMFYSA-N 1 1 334.372 2.313 10 5 EEBEMO CC(C)c1cccc(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])n1 ZINC001280815235 1324538575 /nfs/dbraw/zinc/53/85/75/1324538575.db2.gz YWIDKKHERFWBAY-NVXWUHKLSA-N 1 1 348.447 2.151 10 5 EEBEMO CC(C)c1cccc(C[N@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])n1 ZINC001280815235 1324538583 /nfs/dbraw/zinc/53/85/83/1324538583.db2.gz YWIDKKHERFWBAY-NVXWUHKLSA-N 1 1 348.447 2.151 10 5 EEBEMO CC(C)c1cccc(C[N@@H+](C)CCCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])n1 ZINC001280815235 1324538588 /nfs/dbraw/zinc/53/85/88/1324538588.db2.gz YWIDKKHERFWBAY-NVXWUHKLSA-N 1 1 348.447 2.151 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001492249110 1331112897 /nfs/dbraw/zinc/11/28/97/1331112897.db2.gz AXKZBXXFAGBIMP-IAGOWNOFSA-N 1 1 327.384 2.053 10 5 EEBEMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001492249110 1331112901 /nfs/dbraw/zinc/11/29/01/1331112901.db2.gz AXKZBXXFAGBIMP-IAGOWNOFSA-N 1 1 327.384 2.053 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc2ccccc21 ZINC001492249110 1331112904 /nfs/dbraw/zinc/11/29/04/1331112904.db2.gz AXKZBXXFAGBIMP-IAGOWNOFSA-N 1 1 327.384 2.053 10 5 EEBEMO CN(Cc1ccccc1[N+](=O)[O-])C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC001351834530 1337855379 /nfs/dbraw/zinc/85/53/79/1337855379.db2.gz BHKZPUHGMOSHFH-NWANDNLSSA-N 1 1 332.404 2.076 10 5 EEBEMO C[C@@]1(O)CCC[N@@H+](CN2CC[C@H](c3ccc([N+](=O)[O-])cc3)C2=O)CC1 ZINC000848487890 1338707935 /nfs/dbraw/zinc/70/79/35/1338707935.db2.gz ZVSAEYMTEKMICQ-SJLPKXTDSA-N 1 1 347.415 2.105 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+](C)Cc2ccn(C)n2)cccc1[N+](=O)[O-] ZINC001620662397 1352361424 /nfs/dbraw/zinc/36/14/24/1352361424.db2.gz CNJJQBSRYQVKIA-UHFFFAOYSA-N 1 1 331.376 2.097 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+](C)Cc2ccn(C)n2)cccc1[N+](=O)[O-] ZINC001620662397 1352361431 /nfs/dbraw/zinc/36/14/31/1352361431.db2.gz CNJJQBSRYQVKIA-UHFFFAOYSA-N 1 1 331.376 2.097 10 5 EEBEMO COc1ccc(OCC[N@@H+]2CC[C@H](c3noc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001560140317 1342508423 /nfs/dbraw/zinc/50/84/23/1342508423.db2.gz RJNYBBYSNPVCAU-LBPRGKRZSA-N 1 1 348.359 2.163 10 5 EEBEMO COc1ccc(OCC[N@H+]2CC[C@H](c3noc(C)n3)C2)c([N+](=O)[O-])c1 ZINC001560140317 1342508426 /nfs/dbraw/zinc/50/84/26/1342508426.db2.gz RJNYBBYSNPVCAU-LBPRGKRZSA-N 1 1 348.359 2.163 10 5 EEBEMO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@H+]1CC[C@H]2COC(=O)N[C@@H]2C1 ZINC001621424836 1352367817 /nfs/dbraw/zinc/36/78/17/1352367817.db2.gz GPJPJZKUIDLZSP-FQDRTLPPSA-N 1 1 331.372 2.428 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N[C@H](C)C[N@@H+]2C[C@H](C)C[C@H](C)C2)n1 ZINC001625506658 1352450465 /nfs/dbraw/zinc/45/04/65/1352450465.db2.gz IXXSLZFDHIJITJ-MBNYWOFBSA-N 1 1 334.420 2.394 10 5 EEBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2C[C@H](CCO)[C@H](CO)C2)c1 ZINC001655116413 1354165675 /nfs/dbraw/zinc/16/56/75/1354165675.db2.gz HNHZICWOSHVVGQ-JQWIXIFHSA-N 1 1 348.321 2.036 10 5 EEBEMO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2C[C@H](CCO)[C@H](CO)C2)c1 ZINC001655116413 1354165677 /nfs/dbraw/zinc/16/56/77/1354165677.db2.gz HNHZICWOSHVVGQ-JQWIXIFHSA-N 1 1 348.321 2.036 10 5 EEBEMO Cn1cnnc1CC1CC[NH+](Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC001655642709 1354180421 /nfs/dbraw/zinc/18/04/21/1354180421.db2.gz USEYEUGZQSFFRC-UHFFFAOYSA-N 1 1 333.367 2.317 10 5 EEBEMO Cc1nc(C(=O)NCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)co1 ZINC001663719303 1355022447 /nfs/dbraw/zinc/02/24/47/1355022447.db2.gz VMGGDTIQBLAJES-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO Cc1nc(C(=O)NCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)co1 ZINC001663719303 1355022450 /nfs/dbraw/zinc/02/24/50/1355022450.db2.gz VMGGDTIQBLAJES-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO Cc1c(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000073185330 784027999 /nfs/dbraw/zinc/02/79/99/784027999.db2.gz QFKRTACIASNBOU-AWEZNQCLSA-N 1 1 336.388 2.417 10 5 EEBEMO C[C@@H](NCCC[NH2+]Cc1cccnc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000817939190 785086705 /nfs/dbraw/zinc/08/67/05/785086705.db2.gz AEYUUKAWDNIYSY-CYBMUJFWSA-N 1 1 329.404 2.403 10 5 EEBEMO CC[C@@H]1[C@@H](C(=O)NCc2cc([N+](=O)[O-])c(F)cc2F)CC[N@H+]1C ZINC000911472009 787465755 /nfs/dbraw/zinc/46/57/55/787465755.db2.gz BTDSHUZFUCPVFR-GXFFZTMASA-N 1 1 327.331 2.220 10 5 EEBEMO C[C@@H]1C[N@@H+](C)[C@H](C)[C@@H](C)N1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000844646599 789290301 /nfs/dbraw/zinc/29/03/01/789290301.db2.gz VKRHSFAFUNHBOO-IJLUTSLNSA-N 1 1 339.367 2.052 10 5 EEBEMO O=C(NCc1c[nH+]c2n1CCC2)[C@H]1C[C@H]1c1cccc([N+](=O)[O-])c1 ZINC001177745200 799097281 /nfs/dbraw/zinc/09/72/81/799097281.db2.gz MKGSEVFNPIUMJB-GJZGRUSLSA-N 1 1 326.356 2.157 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCC(C)(C)CC1 ZINC001566453559 1125613091 /nfs/dbraw/zinc/61/30/91/1125613091.db2.gz PAJRKWHPBGKDJA-HUUCEWRRSA-N 1 1 325.453 2.306 10 5 EEBEMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(C)(C)CC1 ZINC001566453559 1125613096 /nfs/dbraw/zinc/61/30/96/1125613096.db2.gz PAJRKWHPBGKDJA-HUUCEWRRSA-N 1 1 325.453 2.306 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCC(C)(C)CC1 ZINC001566453559 1125613099 /nfs/dbraw/zinc/61/30/99/1125613099.db2.gz PAJRKWHPBGKDJA-HUUCEWRRSA-N 1 1 325.453 2.306 10 5 EEBEMO Cc1c(C(=O)NCCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)ccn1C ZINC001566488094 1125649376 /nfs/dbraw/zinc/64/93/76/1125649376.db2.gz HFGWLCILRSTKKN-UHFFFAOYSA-N 1 1 344.415 2.494 10 5 EEBEMO C[C@H]1CCCC[N@H+]1CCCCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001441526228 1095230566 /nfs/dbraw/zinc/23/05/66/1095230566.db2.gz WVGPOMKXEKYNMW-JTQLQIEISA-N 1 1 343.815 2.356 10 5 EEBEMO COC1(CC(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)CCC1 ZINC001496692194 1101291047 /nfs/dbraw/zinc/29/10/47/1101291047.db2.gz GZKGPQIBLLEPQV-UHFFFAOYSA-N 1 1 349.431 2.444 10 5 EEBEMO COC1(CC(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)CCC1 ZINC001496692194 1101291050 /nfs/dbraw/zinc/29/10/50/1101291050.db2.gz GZKGPQIBLLEPQV-UHFFFAOYSA-N 1 1 349.431 2.444 10 5 EEBEMO CCOc1cc(C[NH+]2CCC(c3nnc(N)o3)CC2)ccc1[N+](=O)[O-] ZINC001460339687 1110263036 /nfs/dbraw/zinc/26/30/36/1110263036.db2.gz XUCTWKRVJCODCQ-UHFFFAOYSA-N 1 1 347.375 2.338 10 5 EEBEMO CCN(CC[NH2+]Cc1ccc(C(C)C)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001568741502 1124754867 /nfs/dbraw/zinc/75/48/67/1124754867.db2.gz AIIFGVFORBSVSM-IAGOWNOFSA-N 1 1 333.432 2.413 10 5 EEBEMO O=[N+]([O-])c1cc(F)c(C[N@@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c(F)c1 ZINC000451310677 243072939 /nfs/dbraw/zinc/07/29/39/243072939.db2.gz YFGKOBTZQJKXAU-NSODJVPESA-N 1 1 342.342 2.235 10 5 EEBEMO O=[N+]([O-])c1cc(F)c(C[N@H+]2C[C@H](O)C[C@@H]2[C@@H]2CCCOC2)c(F)c1 ZINC000451310677 243072946 /nfs/dbraw/zinc/07/29/46/243072946.db2.gz YFGKOBTZQJKXAU-NSODJVPESA-N 1 1 342.342 2.235 10 5 EEBEMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000117632655 221079290 /nfs/dbraw/zinc/07/92/90/221079290.db2.gz KYQIYXLNZPKIJE-CQSZACIVSA-N 1 1 337.807 2.487 10 5 EEBEMO CC[N@H+]1CC[C@H](CNC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000117762290 221087925 /nfs/dbraw/zinc/08/79/25/221087925.db2.gz XVLIUKJJLNQODP-LLVKDONJSA-N 1 1 325.796 2.249 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cs1 ZINC000109821351 159353775 /nfs/dbraw/zinc/35/37/75/159353775.db2.gz TUMFYAGMLAJWIF-CQSZACIVSA-N 1 1 325.434 2.343 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)cs1 ZINC000109821351 159353777 /nfs/dbraw/zinc/35/37/77/159353777.db2.gz TUMFYAGMLAJWIF-CQSZACIVSA-N 1 1 325.434 2.343 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000119563063 159379842 /nfs/dbraw/zinc/37/98/42/159379842.db2.gz BNPCJZVZWUDOET-CYBMUJFWSA-N 1 1 345.403 2.321 10 5 EEBEMO CC(C)C[N@@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000119563063 159379843 /nfs/dbraw/zinc/37/98/43/159379843.db2.gz BNPCJZVZWUDOET-CYBMUJFWSA-N 1 1 345.403 2.321 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@@H]1CNC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000119563063 159379845 /nfs/dbraw/zinc/37/98/45/159379845.db2.gz BNPCJZVZWUDOET-CYBMUJFWSA-N 1 1 345.403 2.321 10 5 EEBEMO C[N@H+]1C[C@H]2CN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]2C1 ZINC000193608270 160183501 /nfs/dbraw/zinc/18/35/01/160183501.db2.gz SOFRGXMEDIWVTK-GASCZTMLSA-N 1 1 342.399 2.286 10 5 EEBEMO C[N@@H+]1C[C@H]2CN(CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C[C@H]2C1 ZINC000193608270 160183502 /nfs/dbraw/zinc/18/35/02/160183502.db2.gz SOFRGXMEDIWVTK-GASCZTMLSA-N 1 1 342.399 2.286 10 5 EEBEMO CN1C[C@@H]2C[N@@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]2C1 ZINC000193608270 160183504 /nfs/dbraw/zinc/18/35/04/160183504.db2.gz SOFRGXMEDIWVTK-GASCZTMLSA-N 1 1 342.399 2.286 10 5 EEBEMO CN1C[C@@H]2C[N@H+](CCc3ncc(-c4cccc([N+](=O)[O-])c4)o3)C[C@@H]2C1 ZINC000193608270 160183505 /nfs/dbraw/zinc/18/35/05/160183505.db2.gz SOFRGXMEDIWVTK-GASCZTMLSA-N 1 1 342.399 2.286 10 5 EEBEMO C[N@H+]1CC[C@@H]2[C@@H](CCCN2C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000246245824 160269937 /nfs/dbraw/zinc/26/99/37/160269937.db2.gz JJTXGZNCAIYPSP-IINYFYTJSA-N 1 1 339.342 2.429 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341988977 161029627 /nfs/dbraw/zinc/02/96/27/161029627.db2.gz IYCYMRYLSJNVMU-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341988977 161029628 /nfs/dbraw/zinc/02/96/28/161029628.db2.gz IYCYMRYLSJNVMU-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C2CCC2)C[C@@H](C)C1 ZINC000344765526 161244264 /nfs/dbraw/zinc/24/42/64/161244264.db2.gz CKXXAELRZNJNGB-GFCCVEGCSA-N 1 1 332.404 2.245 10 5 EEBEMO CN(CC[C@@H]1CCCC[N@H+]1C)S(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000360877487 164395507 /nfs/dbraw/zinc/39/55/07/164395507.db2.gz PVTZIBJZSASGKK-NSHDSACASA-N 1 1 347.462 2.151 10 5 EEBEMO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(S(N)(=O)=O)c1 ZINC000361086897 164425566 /nfs/dbraw/zinc/42/55/66/164425566.db2.gz PQLPOYHCNGPWSF-SECBINFHSA-N 1 1 341.414 2.155 10 5 EEBEMO Cc1cc(N2CCN(c3ccc(N)[nH+]c3)CC2)c(F)cc1[N+](=O)[O-] ZINC000292617354 275455279 /nfs/dbraw/zinc/45/52/79/275455279.db2.gz NGGOLHBQVCUXGQ-UHFFFAOYSA-N 1 1 331.351 2.346 10 5 EEBEMO CN(C(=O)C[N@H+]1CCC[C@H]([C@@H]2CCOC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000441273926 315177630 /nfs/dbraw/zinc/17/76/30/315177630.db2.gz DXTUUGORQYGYEA-LSDHHAIUSA-N 1 1 347.415 2.306 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@H](Cc3cnn(C)c3)C2)ccc1[N+](=O)[O-] ZINC000539808573 318063745 /nfs/dbraw/zinc/06/37/45/318063745.db2.gz FFFWNFGRPILHRS-CQSZACIVSA-N 1 1 330.388 2.402 10 5 EEBEMO O=[N+]([O-])c1ccc2[nH]c(N3CCCC[C@H]3C[NH+]3CCOCC3)nc2c1 ZINC000590689794 468308032 /nfs/dbraw/zinc/30/80/32/468308032.db2.gz GNIZMDBNHNVJHF-AWEZNQCLSA-N 1 1 345.403 2.162 10 5 EEBEMO CC[C@H](CO)[NH+]1CCN(c2cc(C)c([N+](=O)[O-])cc2Cl)CC1 ZINC000080652447 463343142 /nfs/dbraw/zinc/34/31/42/463343142.db2.gz YKWWBBQFIBAHIN-GFCCVEGCSA-N 1 1 327.812 2.450 10 5 EEBEMO C[C@@H]1CC[N@@H+](C[C@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H]1c1cccc(F)c1 ZINC000266945245 464881531 /nfs/dbraw/zinc/88/15/31/464881531.db2.gz RELPHBHUSZRXDM-DQYPLSBCSA-N 1 1 348.378 2.374 10 5 EEBEMO COC(=O)[C@H](CC(C)C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000351877509 465412441 /nfs/dbraw/zinc/41/24/41/465412441.db2.gz QIBARZVJCAUZFI-JSGCOSHPSA-N 1 1 336.392 2.064 10 5 EEBEMO COC(=O)[C@H](CC(C)C)[N@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000351877509 465412445 /nfs/dbraw/zinc/41/24/45/465412445.db2.gz QIBARZVJCAUZFI-JSGCOSHPSA-N 1 1 336.392 2.064 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CCN(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000348180971 465474823 /nfs/dbraw/zinc/47/48/23/465474823.db2.gz NLYQIDKHGAKLTH-HNNXBMFYSA-N 1 1 346.431 2.400 10 5 EEBEMO Cc1c(NC(=O)CCN(C)[C@H]2CC[N@@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000348180971 465474827 /nfs/dbraw/zinc/47/48/27/465474827.db2.gz NLYQIDKHGAKLTH-HNNXBMFYSA-N 1 1 346.431 2.400 10 5 EEBEMO Cc1c(NC(=O)CCN(C)[C@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000348180971 465474832 /nfs/dbraw/zinc/47/48/32/465474832.db2.gz NLYQIDKHGAKLTH-HNNXBMFYSA-N 1 1 346.431 2.400 10 5 EEBEMO CN(Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000348197614 465484446 /nfs/dbraw/zinc/48/44/46/465484446.db2.gz LLJKRSZCJIJGFI-OAHLLOKOSA-N 1 1 343.387 2.313 10 5 EEBEMO O=C(C[N@@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000357066292 465738386 /nfs/dbraw/zinc/73/83/86/465738386.db2.gz HNAJPQRABWXTTN-QGZVFWFLSA-N 1 1 333.388 2.426 10 5 EEBEMO O=C(C[N@H+]1CCC[C@@]2(CCCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000357066292 465738397 /nfs/dbraw/zinc/73/83/97/465738397.db2.gz HNAJPQRABWXTTN-QGZVFWFLSA-N 1 1 333.388 2.426 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@@H]1CCS(=O)(=O)C1 ZINC000330731176 465780956 /nfs/dbraw/zinc/78/09/56/465780956.db2.gz QDUSRLIWWNNXAR-OLZOCXBDSA-N 1 1 326.418 2.331 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+](C)C[C@@H]1CCS(=O)(=O)C1 ZINC000330731176 465780962 /nfs/dbraw/zinc/78/09/62/465780962.db2.gz QDUSRLIWWNNXAR-OLZOCXBDSA-N 1 1 326.418 2.331 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CC[N@@H+](C3CCOCC3)C[C@@H]2C)n1 ZINC000362685376 465937872 /nfs/dbraw/zinc/93/78/72/465937872.db2.gz RZCLARIVQXYHOZ-AWEZNQCLSA-N 1 1 334.420 2.296 10 5 EEBEMO CNC(=O)c1cc([N+](=O)[O-])ccc1N1CC[C@H]2CC[C@@H](C1)[N@H+]2C(C)C ZINC000301412461 465960959 /nfs/dbraw/zinc/96/09/59/465960959.db2.gz BZKYSWKOGGTDSQ-HIFRSBDPSA-N 1 1 346.431 2.406 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000340301218 465970225 /nfs/dbraw/zinc/97/02/25/465970225.db2.gz JUWJPRVCIARNJK-UKRRQHHQSA-N 1 1 334.420 2.261 10 5 EEBEMO COc1cc(N2CCC[C@@H]2C[N@H+]2CCC[C@@H]2CO)ccc1[N+](=O)[O-] ZINC000301726153 466018017 /nfs/dbraw/zinc/01/80/17/466018017.db2.gz PZOIBYVICMKAEO-HUUCEWRRSA-N 1 1 335.404 2.029 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000371829610 466022026 /nfs/dbraw/zinc/02/20/26/466022026.db2.gz UURBTBJPOQCELD-MRXNPFEDSA-N 1 1 335.404 2.038 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1CCO[C@@H](C2CCCCC2)C1 ZINC000371829610 466022031 /nfs/dbraw/zinc/02/20/31/466022031.db2.gz UURBTBJPOQCELD-MRXNPFEDSA-N 1 1 335.404 2.038 10 5 EEBEMO C[C@@H](C(=O)NC[C@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594099228 468483664 /nfs/dbraw/zinc/48/36/64/468483664.db2.gz ORBDCHXRFKNLEG-BYNSBNAKSA-N 1 1 349.431 2.312 10 5 EEBEMO C[C@@H](C(=O)NC[C@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000594099228 468483669 /nfs/dbraw/zinc/48/36/69/468483669.db2.gz ORBDCHXRFKNLEG-BYNSBNAKSA-N 1 1 349.431 2.312 10 5 EEBEMO CC1=CC[N@@H+](CCNC(=O)CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000358062975 466424112 /nfs/dbraw/zinc/42/41/12/466424112.db2.gz IMACKQZAWIDZDU-UHFFFAOYSA-N 1 1 333.388 2.132 10 5 EEBEMO CC1=CC[N@@H+](CCNC(=O)NCCc2cccc([N+](=O)[O-])c2)CC1 ZINC000358193469 466529300 /nfs/dbraw/zinc/52/93/00/466529300.db2.gz RJBGUSHDFOITIL-UHFFFAOYSA-N 1 1 332.404 2.089 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C)[C@H]1C[C@@H](OC)C1 ZINC000411720114 466885935 /nfs/dbraw/zinc/88/59/35/466885935.db2.gz PEIHYCQDTFFCEO-BETUJISGSA-N 1 1 337.376 2.041 10 5 EEBEMO COC(=O)[C@@H]1CSCC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000412064031 466991186 /nfs/dbraw/zinc/99/11/86/466991186.db2.gz CTSHFVGPNLWFEZ-NSHDSACASA-N 1 1 328.365 2.072 10 5 EEBEMO COC(=O)[C@@H]1CSCC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000412064031 466991191 /nfs/dbraw/zinc/99/11/91/466991191.db2.gz CTSHFVGPNLWFEZ-NSHDSACASA-N 1 1 328.365 2.072 10 5 EEBEMO COC[C@H]1CCC[N@@H+](CC(=O)N2CCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000452108943 467325955 /nfs/dbraw/zinc/32/59/55/467325955.db2.gz VNYZCMQDCCONHS-AWEZNQCLSA-N 1 1 347.415 2.232 10 5 EEBEMO C[C@@H]1CN(c2c3ccccc3ncc2[N+](=O)[O-])C[C@H](C)[N@@H+]1CCO ZINC000450788326 467907657 /nfs/dbraw/zinc/90/76/57/467907657.db2.gz DFRCNSXSSAUXAW-BETUJISGSA-N 1 1 330.388 2.034 10 5 EEBEMO C[NH+]1CCN(CCCCNc2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000516902716 468053784 /nfs/dbraw/zinc/05/37/84/468053784.db2.gz JCPLLUNPFJZRMH-UHFFFAOYSA-N 1 1 343.431 2.004 10 5 EEBEMO O=[N+]([O-])c1cnc2ccccc2c1N1CC[NH+](C[C@H]2CCCO2)CC1 ZINC000589859196 468191203 /nfs/dbraw/zinc/19/12/03/468191203.db2.gz IMUPXUOGXZJJIM-CQSZACIVSA-N 1 1 342.399 2.444 10 5 EEBEMO CN(c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@@H+]2C ZINC000569757193 468538652 /nfs/dbraw/zinc/53/86/52/468538652.db2.gz VSIJTEIPBFRUTQ-FOSCPWQOSA-N 1 1 343.387 2.305 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H](NC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000597920357 468711855 /nfs/dbraw/zinc/71/18/55/468711855.db2.gz ANWYMAFDMXBGDR-JTQLQIEISA-N 1 1 341.358 2.405 10 5 EEBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2C)C1 ZINC000592529451 468721519 /nfs/dbraw/zinc/72/15/19/468721519.db2.gz ZXOPWLKEQGADBO-CQSZACIVSA-N 1 1 345.321 2.404 10 5 EEBEMO CC[N@H+]1CCC[C@@H](CNc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601107848 468743910 /nfs/dbraw/zinc/74/39/10/468743910.db2.gz BHEZFMOKWOCSQW-VIFPVBQESA-N 1 1 335.330 2.491 10 5 EEBEMO C[C@H]1C[C@@H](Nc2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[N@H+]1C1CC1 ZINC000601127652 468752650 /nfs/dbraw/zinc/75/26/50/468752650.db2.gz MLQAHIHCABZGAU-JGVFFNPUSA-N 1 1 333.314 2.384 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@H]2[C@@H](CCC[N@H+]2C)C1 ZINC000601131291 468755183 /nfs/dbraw/zinc/75/51/83/468755183.db2.gz VXDRIQQNOMGFOZ-UWVGGRQHSA-N 1 1 347.341 2.268 10 5 EEBEMO Cn1cc[nH+]c1[C@@H]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601134665 468756371 /nfs/dbraw/zinc/75/63/71/468756371.db2.gz GJFLCURSAKBXBE-MRVPVSSYSA-N 1 1 344.297 2.075 10 5 EEBEMO C[C@@](CO)([NH2+]Cc1ccnn1CC1CC1)c1cccc([N+](=O)[O-])c1 ZINC000601148476 468761658 /nfs/dbraw/zinc/76/16/58/468761658.db2.gz CHFXAHRJVRIXCN-KRWDZBQOSA-N 1 1 330.388 2.199 10 5 EEBEMO Cn1ccnc1[C@H](NCCC1(C[NH3+])CC1)c1ccc([N+](=O)[O-])cc1 ZINC000593320868 468938251 /nfs/dbraw/zinc/93/82/51/468938251.db2.gz UYFIXDQGAFMDAG-OAHLLOKOSA-N 1 1 329.404 2.136 10 5 EEBEMO Cc1c(NC(=O)CC[NH+]2C[C@@H](C)C(=O)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000595711733 468964288 /nfs/dbraw/zinc/96/42/88/468964288.db2.gz CLUMXVUCOOYUSO-VXGBXAGGSA-N 1 1 333.388 2.389 10 5 EEBEMO C[C@]12COC[C@H]1C[N@@H+](Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595756166 468992149 /nfs/dbraw/zinc/99/21/49/468992149.db2.gz FFIZUMHBDWMOHA-WBMJQRKESA-N 1 1 330.344 2.113 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)c2cc(Br)cc([N+](=O)[O-])c2)C1 ZINC000610903977 469109018 /nfs/dbraw/zinc/10/90/18/469109018.db2.gz DDYNMRQCOKVNPA-LLVKDONJSA-N 1 1 342.193 2.181 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000599138387 469133604 /nfs/dbraw/zinc/13/36/04/469133604.db2.gz AXFHBOLSWGBWTH-CQSZACIVSA-N 1 1 328.372 2.685 10 5 EEBEMO CC[N@@H+]1CCO[C@@H](CNc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596115592 469161579 /nfs/dbraw/zinc/16/15/79/469161579.db2.gz CPTUNBHXWLOKQD-JTQLQIEISA-N 1 1 344.209 2.490 10 5 EEBEMO CC[N@H+]1CCO[C@@H](CNc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000596115592 469161584 /nfs/dbraw/zinc/16/15/84/469161584.db2.gz CPTUNBHXWLOKQD-JTQLQIEISA-N 1 1 344.209 2.490 10 5 EEBEMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC[C@H]([NH+]2CCOCC2)C1 ZINC000596247970 469221103 /nfs/dbraw/zinc/22/11/03/469221103.db2.gz USBLVEJDLMSXQX-AWEZNQCLSA-N 1 1 342.399 2.444 10 5 EEBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000596362000 469250531 /nfs/dbraw/zinc/25/05/31/469250531.db2.gz XQSCDEWAYOVFKC-ZDUSSCGKSA-N 1 1 346.435 2.222 10 5 EEBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000596362000 469250534 /nfs/dbraw/zinc/25/05/34/469250534.db2.gz XQSCDEWAYOVFKC-ZDUSSCGKSA-N 1 1 346.435 2.222 10 5 EEBEMO Cc1nc(CC(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC001690994411 1176434886 /nfs/dbraw/zinc/43/48/86/1176434886.db2.gz DYHUSOPTROXMEN-UHFFFAOYSA-N 1 1 348.428 2.150 10 5 EEBEMO Cc1nc(CC(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC001690994411 1176434889 /nfs/dbraw/zinc/43/48/89/1176434889.db2.gz DYHUSOPTROXMEN-UHFFFAOYSA-N 1 1 348.428 2.150 10 5 EEBEMO CCCSCC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001266899140 1177753048 /nfs/dbraw/zinc/75/30/48/1177753048.db2.gz ZSPLCIGDCBKAIK-HALDLXJZSA-N 1 1 349.456 2.284 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])CC1CCCCC1 ZINC001481350953 1181095027 /nfs/dbraw/zinc/09/50/27/1181095027.db2.gz SXKFQITXDYANRU-HZPDHXFCSA-N 1 1 325.453 2.449 10 5 EEBEMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCC1 ZINC001481350953 1181095034 /nfs/dbraw/zinc/09/50/34/1181095034.db2.gz SXKFQITXDYANRU-HZPDHXFCSA-N 1 1 325.453 2.449 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])CC1CCCCC1 ZINC001481350953 1181095039 /nfs/dbraw/zinc/09/50/39/1181095039.db2.gz SXKFQITXDYANRU-HZPDHXFCSA-N 1 1 325.453 2.449 10 5 EEBEMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC(CC[NH2+]Cc2cccc(F)c2)CC1 ZINC001269859414 1184675948 /nfs/dbraw/zinc/67/59/48/1184675948.db2.gz SSANWKZMFQBQCM-IAGOWNOFSA-N 1 1 349.406 2.209 10 5 EEBEMO CC[NH+]1CCN([C@@H](C)CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872022594 1198028701 /nfs/dbraw/zinc/02/87/01/1198028701.db2.gz KAEMSIMRPUPHCX-UONOGXRCSA-N 1 1 338.427 2.411 10 5 EEBEMO C[C@@H](CNc1cc(F)c([N+](=O)[O-])cc1CO)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000865916582 1198424200 /nfs/dbraw/zinc/42/42/00/1198424200.db2.gz PNJBTHDSIVTHLU-SDDRHHMPSA-N 1 1 341.383 2.136 10 5 EEBEMO C[C@@H](CNc1cc(F)c([N+](=O)[O-])cc1CO)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000865916582 1198424204 /nfs/dbraw/zinc/42/42/04/1198424204.db2.gz PNJBTHDSIVTHLU-SDDRHHMPSA-N 1 1 341.383 2.136 10 5 EEBEMO C[C@H](C[C@@H]1CCCC[N@H+]1C)OC(=O)C(C)(C)n1cc([N+](=O)[O-])cn1 ZINC000870789743 1200881955 /nfs/dbraw/zinc/88/19/55/1200881955.db2.gz JJOMUBADQYLVGN-OLZOCXBDSA-N 1 1 338.408 2.333 10 5 EEBEMO Cc1cc(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@@H]23)ccc1[N+](=O)[O-] ZINC000928102005 1206344087 /nfs/dbraw/zinc/34/40/87/1206344087.db2.gz KXZXRINYDPBPQN-HIFRSBDPSA-N 1 1 335.429 2.213 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641723 1206572520 /nfs/dbraw/zinc/57/25/20/1206572520.db2.gz YGBJXKCQDVRHRO-HOCLYGCPSA-N 1 1 338.429 2.351 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641723 1206572521 /nfs/dbraw/zinc/57/25/21/1206572521.db2.gz YGBJXKCQDVRHRO-HOCLYGCPSA-N 1 1 338.429 2.351 10 5 EEBEMO COc1cc(C[N@H+]2[C@H](C)CC[C@@H](C(N)=O)[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000930911198 1206591879 /nfs/dbraw/zinc/59/18/79/1206591879.db2.gz LVXZOBXLTMGSAR-JFGNBEQYSA-N 1 1 339.367 2.217 10 5 EEBEMO C[C@H](O)[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399970 1281973869 /nfs/dbraw/zinc/97/38/69/1281973869.db2.gz FBHYPWQFULXXAL-RYUDHWBXSA-N 1 1 332.360 2.238 10 5 EEBEMO C[C@H](O)[C@H]1CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192399970 1281973875 /nfs/dbraw/zinc/97/38/75/1281973875.db2.gz FBHYPWQFULXXAL-RYUDHWBXSA-N 1 1 332.360 2.238 10 5 EEBEMO C[N@@H+](CC1=CCCOC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853562359 1292415774 /nfs/dbraw/zinc/41/57/74/1292415774.db2.gz MGAMFSSUBWSRMQ-KRWDZBQOSA-N 1 1 345.399 2.147 10 5 EEBEMO C[N@H+](CC1=CCCOC1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000853562359 1292415781 /nfs/dbraw/zinc/41/57/81/1292415781.db2.gz MGAMFSSUBWSRMQ-KRWDZBQOSA-N 1 1 345.399 2.147 10 5 EEBEMO CCc1ccc(C(=O)OC[C@@]2(C)C[C@H](OC)C[N@H+]2C)cc1[N+](=O)[O-] ZINC000861347241 1295350621 /nfs/dbraw/zinc/35/06/21/1295350621.db2.gz OASHCPAJQMAWDF-WMLDXEAASA-N 1 1 336.388 2.423 10 5 EEBEMO CO[C@H]1C[N@@H+](C)[C@@](C)(COC(=O)CCc2cccc([N+](=O)[O-])c2)C1 ZINC000861347887 1295351371 /nfs/dbraw/zinc/35/13/71/1295351371.db2.gz BAHFUTKTJGIHRI-NVXWUHKLSA-N 1 1 336.388 2.180 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cnc(C)[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001266028167 1323578497 /nfs/dbraw/zinc/57/84/97/1323578497.db2.gz KJVRMNDCHTZEPL-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1c[nH]nc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317542761 1332291038 /nfs/dbraw/zinc/29/10/38/1332291038.db2.gz JXDOIHCERORDFW-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO C[C@H]1CCC[N@@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001630229235 1352566182 /nfs/dbraw/zinc/56/61/82/1352566182.db2.gz XLOKGGMWOMXSAW-ZDUSSCGKSA-N 1 1 334.420 2.419 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@H]1CCC[N@H+](C(C)C)C1 ZINC001631425084 1352583267 /nfs/dbraw/zinc/58/32/67/1352583267.db2.gz XYCHXKILSAZUBR-ZDUSSCGKSA-N 1 1 335.404 2.340 10 5 EEBEMO Cc1[nH]nc(C(=O)N2CCC[C@H]2CC[NH+]2CCC(C)CC2)c1[N+](=O)[O-] ZINC001632159891 1352594173 /nfs/dbraw/zinc/59/41/73/1352594173.db2.gz JEVGLXNIFSDKHQ-AWEZNQCLSA-N 1 1 349.435 2.353 10 5 EEBEMO CN(c1nn(C)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001639590572 1352699624 /nfs/dbraw/zinc/69/96/24/1352699624.db2.gz RMOBPFOHNKBPDQ-HNNXBMFYSA-N 1 1 329.404 2.429 10 5 EEBEMO CN(C)CC[N@@H+](C)CCCN(C)c1ncc([N+](=O)[O-])c2ccccc21 ZINC001651121147 1354040373 /nfs/dbraw/zinc/04/03/73/1354040373.db2.gz WYDKUSLLBCVFTI-UHFFFAOYSA-N 1 1 345.447 2.463 10 5 EEBEMO CN(CCCN(C)c1ncc([N+](=O)[O-])c2ccccc21)CC[NH+](C)C ZINC001651121147 1354040377 /nfs/dbraw/zinc/04/03/77/1354040377.db2.gz WYDKUSLLBCVFTI-UHFFFAOYSA-N 1 1 345.447 2.463 10 5 EEBEMO C[C@@H]1CN(C(=O)COc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C1CCCC1 ZINC001651769195 1354064583 /nfs/dbraw/zinc/06/45/83/1354064583.db2.gz FKHFFVBLGCPROM-CQSZACIVSA-N 1 1 347.415 2.449 10 5 EEBEMO O=C(CC[N@H+]1CC[C@H](c2ncccn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001654914899 1354161412 /nfs/dbraw/zinc/16/14/12/1354161412.db2.gz DBTBWWQGWHEQQB-ZDUSSCGKSA-N 1 1 341.371 2.203 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)nn1 ZINC001656473544 1354241797 /nfs/dbraw/zinc/24/17/97/1354241797.db2.gz DWOXWPSHXOZAJY-LLVKDONJSA-N 1 1 342.359 2.244 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C2)nn1 ZINC001656473544 1354241798 /nfs/dbraw/zinc/24/17/98/1354241798.db2.gz 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CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000823979948 788005746 /nfs/dbraw/zinc/00/57/46/788005746.db2.gz FFYVOAXHYYVQEB-RISCZKNCSA-N 1 1 335.408 2.371 10 5 EEBEMO Cc1ccccc1[C@@H](CO)[N@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001176176035 798364656 /nfs/dbraw/zinc/36/46/56/798364656.db2.gz OJANMHKFCHXLSL-QGZVFWFLSA-N 1 1 343.383 2.168 10 5 EEBEMO Cc1ccccc1[C@@H](CO)[N@@H+](C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001176176035 798364660 /nfs/dbraw/zinc/36/46/60/798364660.db2.gz OJANMHKFCHXLSL-QGZVFWFLSA-N 1 1 343.383 2.168 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1C[NH+]1CCC([C@H](O)c2ncc[nH]2)CC1 ZINC000787995343 807327620 /nfs/dbraw/zinc/32/76/20/807327620.db2.gz JAMLSMRRORMVNZ-HNNXBMFYSA-N 1 1 334.351 2.403 10 5 EEBEMO Cc1nccnc1[C@H](C)[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001460732635 1110322149 /nfs/dbraw/zinc/32/21/49/1110322149.db2.gz DVYHQQYMVGOSGY-NWDGAFQWSA-N 1 1 329.360 2.371 10 5 EEBEMO Cc1ccc(NC(=O)c2cc([C@@H]3CCC[N@H+]3C)[nH]n2)c(N)c1[N+](=O)[O-] ZINC001472227792 1110548241 /nfs/dbraw/zinc/54/82/41/1110548241.db2.gz ZTPNMKYLUVYGOY-ZDUSSCGKSA-N 1 1 344.375 2.228 10 5 EEBEMO Cc1ccc(NC(=O)c2cc([C@@H]3CCC[N@@H+]3C)[nH]n2)c(N)c1[N+](=O)[O-] ZINC001472227792 1110548243 /nfs/dbraw/zinc/54/82/43/1110548243.db2.gz ZTPNMKYLUVYGOY-ZDUSSCGKSA-N 1 1 344.375 2.228 10 5 EEBEMO Cc1cc(N2CC[N@@H+](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001472849562 1110564312 /nfs/dbraw/zinc/56/43/12/1110564312.db2.gz GZQSWHTXHBJUGQ-SNVBAGLBSA-N 1 1 333.310 2.035 10 5 EEBEMO Cc1cc(N2CC[N@H+](C)[C@@H](CO)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001472849562 1110564314 /nfs/dbraw/zinc/56/43/14/1110564314.db2.gz GZQSWHTXHBJUGQ-SNVBAGLBSA-N 1 1 333.310 2.035 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nn1 ZINC001473877864 1110583281 /nfs/dbraw/zinc/58/32/81/1110583281.db2.gz YFIBCVXXYZYGQY-LLVKDONJSA-N 1 1 346.347 2.011 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)nn1 ZINC001473877864 1110583282 /nfs/dbraw/zinc/58/32/82/1110583282.db2.gz YFIBCVXXYZYGQY-LLVKDONJSA-N 1 1 346.347 2.011 10 5 EEBEMO C[N@H+](CCCNC(=O)c1ccsn1)Cc1csc([N+](=O)[O-])c1 ZINC001566465598 1124240764 /nfs/dbraw/zinc/24/07/64/1124240764.db2.gz XIYZNJILGRFOBC-UHFFFAOYSA-N 1 1 340.430 2.365 10 5 EEBEMO C[N@@H+](CCCNC(=O)c1ccsn1)Cc1csc([N+](=O)[O-])c1 ZINC001566465598 1124240772 /nfs/dbraw/zinc/24/07/72/1124240772.db2.gz XIYZNJILGRFOBC-UHFFFAOYSA-N 1 1 340.430 2.365 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000181884038 530063805 /nfs/dbraw/zinc/06/38/05/530063805.db2.gz KPSWUJUPOIXQSZ-JTQLQIEISA-N 1 1 329.303 2.020 10 5 EEBEMO C[C@@H]1CC(O)C[C@@H](C)[NH+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000191267621 239002005 /nfs/dbraw/zinc/00/20/05/239002005.db2.gz BTIYPTGXWKJTNV-GHMZBOCLSA-N 1 1 332.360 2.379 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000451896998 243296581 /nfs/dbraw/zinc/29/65/81/243296581.db2.gz VNZHHFQRTXDNJZ-ZWNOBZJWSA-N 1 1 334.294 2.349 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000451896998 243296586 /nfs/dbraw/zinc/29/65/86/243296586.db2.gz VNZHHFQRTXDNJZ-ZWNOBZJWSA-N 1 1 334.294 2.349 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@H]2CCC[N@@H+]2C[C@H]1C ZINC000246779191 243316375 /nfs/dbraw/zinc/31/63/75/243316375.db2.gz BDXGPMUBGQHVGJ-GDBMZVCRSA-N 1 1 346.431 2.400 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCC1 ZINC000264923996 247050155 /nfs/dbraw/zinc/05/01/55/247050155.db2.gz QLEJECLNTJMWEN-AWEZNQCLSA-N 1 1 332.404 2.019 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H]3COCC[C@@H]32)c2c(c1)COCO2 ZINC000355101013 285086412 /nfs/dbraw/zinc/08/64/12/285086412.db2.gz BTOCVXMOYBXVJS-WBMJQRKESA-N 1 1 334.372 2.462 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1CCC[N@H+](C2CC2)CC1 ZINC000172542436 152092382 /nfs/dbraw/zinc/09/23/82/152092382.db2.gz SUHGJDHYWRZZKY-UHFFFAOYSA-N 1 1 332.404 2.012 10 5 EEBEMO C[C@H]1C[N@H+](C2CCN(Cc3cc(F)ccc3[N+](=O)[O-])CC2)CCO1 ZINC000193429893 160180946 /nfs/dbraw/zinc/18/09/46/160180946.db2.gz VMJQLIOMMCGGMM-ZDUSSCGKSA-N 1 1 337.395 2.419 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000245468328 160237505 /nfs/dbraw/zinc/23/75/05/160237505.db2.gz KOYSAFBCYYQKTM-CZUORRHYSA-N 1 1 334.420 2.338 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000246873903 160299088 /nfs/dbraw/zinc/29/90/88/160299088.db2.gz FGOKRXFGNQTOAW-STQMWFEESA-N 1 1 348.359 2.202 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)COc2cccc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000247352210 160321930 /nfs/dbraw/zinc/32/19/30/160321930.db2.gz JUESKHAKIZVPQK-BBRMVZONSA-N 1 1 335.404 2.162 10 5 EEBEMO C[C@@H](C[NH+]1CCOCC1)C(=O)N(Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000341904285 161023115 /nfs/dbraw/zinc/02/31/15/161023115.db2.gz YUZFZHQRSYJZOI-AWEZNQCLSA-N 1 1 347.415 2.054 10 5 EEBEMO CO[C@H]1C[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC[C@H]1C ZINC000342740212 161087119 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SJPCSEIDKUVXKD-KGLIPLIRSA-N 1 1 334.420 2.256 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)NCc2cccc(C[N@@H+](C)CC)c2)n1 ZINC000191783281 274052373 /nfs/dbraw/zinc/05/23/73/274052373.db2.gz XQAQFURTWAQHOE-UHFFFAOYSA-N 1 1 345.403 2.193 10 5 EEBEMO COC(=O)Cc1ccc(N2CCC(c3[nH]cc[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000295629273 293773622 /nfs/dbraw/zinc/77/36/22/293773622.db2.gz XFSIUBSZHFKSMO-UHFFFAOYSA-N 1 1 344.371 2.417 10 5 EEBEMO O=C(C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000441278812 315178209 /nfs/dbraw/zinc/17/82/09/315178209.db2.gz QMSPIWKHZATQFG-KGLIPLIRSA-N 1 1 333.388 2.282 10 5 EEBEMO O=C(C[N@H+]1CCC[C@@H]([C@H]2CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000441278812 315178211 /nfs/dbraw/zinc/17/82/11/315178211.db2.gz QMSPIWKHZATQFG-KGLIPLIRSA-N 1 1 333.388 2.282 10 5 EEBEMO C[C@H](NC(=O)c1ccc([N+](=O)[O-])cn1)[C@H]1CCC[N@H+](C2CCC2)C1 ZINC000540969399 318088916 /nfs/dbraw/zinc/08/89/16/318088916.db2.gz CBMFDMGWYQSRHW-STQMWFEESA-N 1 1 332.404 2.373 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1CC ZINC000116768241 462773400 /nfs/dbraw/zinc/77/34/00/462773400.db2.gz BBXSUBFGQNKZFI-INIZCTEOSA-N 1 1 349.431 2.476 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc(C)c([N+](=O)[O-])c2)C[C@@H]1CC ZINC000116768241 462773403 /nfs/dbraw/zinc/77/34/03/462773403.db2.gz BBXSUBFGQNKZFI-INIZCTEOSA-N 1 1 349.431 2.476 10 5 EEBEMO CC(C)[N@@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CCOCC1 ZINC000077356864 462973009 /nfs/dbraw/zinc/97/30/09/462973009.db2.gz HVSADKGAZIFLEP-UHFFFAOYSA-N 1 1 347.415 2.373 10 5 EEBEMO Cc1cn2c(C[N@H+](C)CCn3cc([N+](=O)[O-])cn3)c(C)nc2s1 ZINC000096009834 463140077 /nfs/dbraw/zinc/14/00/77/463140077.db2.gz SAQWFMUQVXODTN-UHFFFAOYSA-N 1 1 334.405 2.249 10 5 EEBEMO Cc1cn2c(C[N@@H+](C)CCn3cc([N+](=O)[O-])cn3)c(C)nc2s1 ZINC000096009834 463140082 /nfs/dbraw/zinc/14/00/82/463140082.db2.gz SAQWFMUQVXODTN-UHFFFAOYSA-N 1 1 334.405 2.249 10 5 EEBEMO CCOC(=O)c1ccnc(N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-] ZINC000172765309 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1352824348 /nfs/dbraw/zinc/82/43/48/1352824348.db2.gz VNOULQKMUKZXEB-NSHDSACASA-N 1 1 329.360 2.191 10 5 EEBEMO C[C@H](CNc1c2cc([N+](=O)[O-])ccc2ncc1[N+](=O)[O-])[N@@H+](C)C1CC1 ZINC001655091697 1354164601 /nfs/dbraw/zinc/16/46/01/1354164601.db2.gz GWKXGXUSHZLNAB-SNVBAGLBSA-N 1 1 345.359 2.368 10 5 EEBEMO Cn1cc([C@H]2CCC[N@@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)nn1 ZINC001655855279 1354187762 /nfs/dbraw/zinc/18/77/62/1354187762.db2.gz DUVUUGOPQIMKGV-AWEZNQCLSA-N 1 1 345.403 2.372 10 5 EEBEMO COc1cccc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001663321544 1354948087 /nfs/dbraw/zinc/94/80/87/1354948087.db2.gz WCEYVAIFDYGJFK-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO COc1cccc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001663321544 1354948090 /nfs/dbraw/zinc/94/80/90/1354948090.db2.gz WCEYVAIFDYGJFK-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO Cc1cnccc1C(=O)NC/C=C/C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001668810947 1356011599 /nfs/dbraw/zinc/01/15/99/1356011599.db2.gz WJUBFEWEKRPBHH-NSCUHMNNSA-N 1 1 346.412 2.436 10 5 EEBEMO O=C(NC/C=C\C[NH2+]Cc1cccc(C(F)F)c1)[C@@H]1CC1[N+](=O)[O-] ZINC001668822024 1356014153 /nfs/dbraw/zinc/01/41/53/1356014153.db2.gz VFGYSADPMGSSEF-KOMGFDSOSA-N 1 1 339.342 2.051 10 5 EEBEMO C[C@@H]1CCC[N@H+](C(C)(C)CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001136398779 786539029 /nfs/dbraw/zinc/53/90/29/786539029.db2.gz VUMOZCINSGOOFX-SECBINFHSA-N 1 1 343.815 2.212 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)C[C@@]2(C)C1 ZINC000913288439 788764094 /nfs/dbraw/zinc/76/40/94/788764094.db2.gz ORQSFTDPHQRADO-HDICACEKSA-N 1 1 342.399 2.490 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])C1 ZINC001144808406 790166069 /nfs/dbraw/zinc/16/60/69/790166069.db2.gz UXLZUOKZTVBPHU-AWEZNQCLSA-N 1 1 340.383 2.481 10 5 EEBEMO O=[N+]([O-])c1ccc(OC2CC[NH+](CN3CCOC3=S)CC2)cc1 ZINC000173435282 791856007 /nfs/dbraw/zinc/85/60/07/791856007.db2.gz GJYQQJJITHRCDT-UHFFFAOYSA-N 1 1 337.401 2.013 10 5 EEBEMO C[N@H+]1C[C@H](NC(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)C(C)(C)C1 ZINC001178707849 799598482 /nfs/dbraw/zinc/59/84/82/799598482.db2.gz ANSVGCRSSWMEEW-HNNXBMFYSA-N 1 1 330.388 2.006 10 5 EEBEMO CC[C@H]1CN(c2nn(C)cc2[N+](=O)[O-])CC[N@H+]1Cc1ccccc1 ZINC001458306112 1109856739 /nfs/dbraw/zinc/85/67/39/1109856739.db2.gz KIROJECODWQTHT-HNNXBMFYSA-N 1 1 329.404 2.429 10 5 EEBEMO NC(=O)c1cc([N+](=O)[O-])cnc1NC[C@@H]1CC[N@H+]1C1CCCCCC1 ZINC001458545379 1109890394 /nfs/dbraw/zinc/89/03/94/1109890394.db2.gz KOPZOCYKFQQXCJ-ZDUSSCGKSA-N 1 1 347.419 2.298 10 5 EEBEMO C[N@H+](CCn1cnnc1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001473766163 1110580097 /nfs/dbraw/zinc/58/00/97/1110580097.db2.gz UIJQWSRCTKEPCK-UHFFFAOYSA-N 1 1 340.181 2.081 10 5 EEBEMO C[N@@H+](CCn1cnnc1)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001473766163 1110580098 /nfs/dbraw/zinc/58/00/98/1110580098.db2.gz UIJQWSRCTKEPCK-UHFFFAOYSA-N 1 1 340.181 2.081 10 5 EEBEMO COCCC(=O)N1CCC([N@@H+](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC001506948768 1114997188 /nfs/dbraw/zinc/99/71/88/1114997188.db2.gz FRCSDESWPGWBLI-UHFFFAOYSA-N 1 1 335.404 2.054 10 5 EEBEMO CC[C@H](CO)[NH+]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000190222507 529385981 /nfs/dbraw/zinc/38/59/81/529385981.db2.gz MSZLJTKUEKIGSI-OAHLLOKOSA-N 1 1 349.431 2.247 10 5 EEBEMO Cn1cc(CN2CC[N@H+]3CCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000179545515 233150891 /nfs/dbraw/zinc/15/08/91/233150891.db2.gz COIRBRNPFNWWKU-QGZVFWFLSA-N 1 1 341.415 2.275 10 5 EEBEMO Cn1c2ccccc2c(N2CC[N@H+]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1=O ZINC000685940434 539988825 /nfs/dbraw/zinc/98/88/25/539988825.db2.gz LMYXPWOAMJGXJR-CYBMUJFWSA-N 1 1 342.399 2.121 10 5 EEBEMO CNC(=O)c1ccc(N2CCC(n3c[nH+]cc3C)CC2)c([N+](=O)[O-])c1 ZINC000376741030 283475009 /nfs/dbraw/zinc/47/50/09/283475009.db2.gz CAHFWZVORBQFJW-UHFFFAOYSA-N 1 1 343.387 2.301 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCCNc1ccc([N+](=O)[O-])cc1 ZINC000247322025 243410023 /nfs/dbraw/zinc/41/00/23/243410023.db2.gz OQWVQYCQHWSUER-PBHICJAKSA-N 1 1 346.431 2.482 10 5 EEBEMO C[N@@H+]1CCC[C@H]1CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000110282981 220027680 /nfs/dbraw/zinc/02/76/80/220027680.db2.gz SYPNPZJUSSBPIK-VIFPVBQESA-N 1 1 349.359 2.097 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC000110282981 220027683 /nfs/dbraw/zinc/02/76/83/220027683.db2.gz SYPNPZJUSSBPIK-VIFPVBQESA-N 1 1 349.359 2.097 10 5 EEBEMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@@H+](Cc2ccco2)C2CCCC2)c1 ZINC000266561581 248360672 /nfs/dbraw/zinc/36/06/72/248360672.db2.gz XYRJDFVNFKKZSO-HNNXBMFYSA-N 1 1 334.376 2.190 10 5 EEBEMO C[C@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892901 292213761 /nfs/dbraw/zinc/21/37/61/292213761.db2.gz DWDCQBBENLENDZ-WCQYABFASA-N 1 1 344.371 2.336 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc(F)cc([N+](=O)[O-])c1N)C1CCCCC1 ZINC000068899705 159023743 /nfs/dbraw/zinc/02/37/43/159023743.db2.gz JTEMWGRYCNECTA-UHFFFAOYSA-N 1 1 338.383 2.310 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000195319815 160210473 /nfs/dbraw/zinc/21/04/73/160210473.db2.gz QHPFQBHZIDOTGR-CYBMUJFWSA-N 1 1 348.359 2.122 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+]3CCCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000195319815 160210475 /nfs/dbraw/zinc/21/04/75/160210475.db2.gz QHPFQBHZIDOTGR-CYBMUJFWSA-N 1 1 348.359 2.122 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2CCC[N@H+]2C[C@@H]1C ZINC000246440527 160279313 /nfs/dbraw/zinc/27/93/13/160279313.db2.gz NIDPFCSSFCSQJX-AAEUAGOBSA-N 1 1 334.376 2.304 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]2C1 ZINC000246686924 160289779 /nfs/dbraw/zinc/28/97/79/160289779.db2.gz MTPYDQVUXMNGCD-KMFMINBZSA-N 1 1 336.388 2.242 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCOc3ccccc3[N+](=O)[O-])[C@H]2C1 ZINC000246686924 160289781 /nfs/dbraw/zinc/28/97/81/160289781.db2.gz MTPYDQVUXMNGCD-KMFMINBZSA-N 1 1 336.388 2.242 10 5 EEBEMO CCOC(=O)[C@H](C)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000343641903 161153802 /nfs/dbraw/zinc/15/38/02/161153802.db2.gz UOXFRUUGPFOHGB-LBPRGKRZSA-N 1 1 337.376 2.115 10 5 EEBEMO CCOC(=O)[C@H](C)[N@@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000343641903 161153803 /nfs/dbraw/zinc/15/38/03/161153803.db2.gz UOXFRUUGPFOHGB-LBPRGKRZSA-N 1 1 337.376 2.115 10 5 EEBEMO CCc1ccc([C@@H]2CN(C(=O)c3ccc([N+](=O)[O-])cn3)CC[NH2+]2)cc1 ZINC000374352617 167023628 /nfs/dbraw/zinc/02/36/28/167023628.db2.gz RWEXSMWZCXZBRZ-KRWDZBQOSA-N 1 1 340.383 2.339 10 5 EEBEMO O=C(CC[N@H+]1CC[C@@]2(C1)CCCOC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000375304105 167108413 /nfs/dbraw/zinc/10/84/13/167108413.db2.gz RDESDRNYBQNPNM-QGZVFWFLSA-N 1 1 333.388 2.426 10 5 EEBEMO COCC[N@@H+]1CCN(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000182714248 274028038 /nfs/dbraw/zinc/02/80/38/274028038.db2.gz RGEZKKZTNXGKIT-ZQHYZAEZSA-N 1 1 347.415 2.177 10 5 EEBEMO COCC[N@H+]1CCN(C(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C[C@@H]1C 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CBMFDMGWYQSRHW-QWHCGFSZSA-N 1 1 332.404 2.373 10 5 EEBEMO CC(C)[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000182184604 323367789 /nfs/dbraw/zinc/36/77/89/323367789.db2.gz QFGIMTQWGQDZRI-OAHLLOKOSA-N 1 1 338.404 2.224 10 5 EEBEMO Cc1c(C(=O)N2CCC[N@H+](C3CC3)CC2)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000061647199 462594391 /nfs/dbraw/zinc/59/43/91/462594391.db2.gz YONPZCLOMKBIMD-UHFFFAOYSA-N 1 1 348.359 2.122 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116316560 462754005 /nfs/dbraw/zinc/75/40/05/462754005.db2.gz GWBXTIFXNYYBKT-ZDUSSCGKSA-N 1 1 343.387 2.065 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116316560 462754008 /nfs/dbraw/zinc/75/40/08/462754008.db2.gz GWBXTIFXNYYBKT-ZDUSSCGKSA-N 1 1 343.387 2.065 10 5 EEBEMO Cc1ccc(C[C@@H](C)[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000075752376 462756613 /nfs/dbraw/zinc/75/66/13/462756613.db2.gz GOIFKNGBXDILDU-PBHICJAKSA-N 1 1 332.404 2.024 10 5 EEBEMO 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349.366 2.251 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](c3cn(C)nn3)C2)c([N+](=O)[O-])cc1F ZINC001620662219 1352361373 /nfs/dbraw/zinc/36/13/73/1352361373.db2.gz ZRLBNEYPYIYAPO-LLVKDONJSA-N 1 1 349.366 2.251 10 5 EEBEMO C[N@@H+](CCNC(=O)c1ccc([N+](=O)[O-])cc1N)Cc1ccccc1 ZINC001625586570 1352452704 /nfs/dbraw/zinc/45/27/04/1352452704.db2.gz MCCJLJCTLOVGAX-UHFFFAOYSA-N 1 1 328.372 2.039 10 5 EEBEMO Cc1ccc(NC(=O)c2cc(C[NH+]3CCCC3)on2)c(N)c1[N+](=O)[O-] ZINC001636729166 1352668491 /nfs/dbraw/zinc/66/84/91/1352668491.db2.gz PAFRTALGJXWSDO-UHFFFAOYSA-N 1 1 345.359 2.322 10 5 EEBEMO CC(C)[N@H+]1CCC[C@@H](NC(=O)COc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC001638146257 1352685302 /nfs/dbraw/zinc/68/53/02/1352685302.db2.gz SHEUHOCWIRXMCX-GFCCVEGCSA-N 1 1 339.367 2.102 10 5 EEBEMO Cc1cccn2cc(Cn3cnc4sc([N+](=O)[O-])cc4c3=O)[nH+]c12 ZINC001651971049 1354071836 /nfs/dbraw/zinc/07/18/36/1354071836.db2.gz BJKLGYCXJJVSET-UHFFFAOYSA-N 1 1 341.352 2.371 10 5 EEBEMO CC1(C)C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001653325455 1354120511 /nfs/dbraw/zinc/12/05/11/1354120511.db2.gz NCRJXOSPNMPVKN-CYBMUJFWSA-N 1 1 332.360 2.238 10 5 EEBEMO CC1(C)C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC[C@H]1O ZINC001653325455 1354120515 /nfs/dbraw/zinc/12/05/15/1354120515.db2.gz NCRJXOSPNMPVKN-CYBMUJFWSA-N 1 1 332.360 2.238 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccn(C)c1 ZINC001667552290 1355759448 /nfs/dbraw/zinc/75/94/48/1355759448.db2.gz KKBLKRAOFWPBLR-UHFFFAOYSA-N 1 1 330.388 2.137 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccn(C)c1 ZINC001667552290 1355759453 /nfs/dbraw/zinc/75/94/53/1355759453.db2.gz KKBLKRAOFWPBLR-UHFFFAOYSA-N 1 1 330.388 2.137 10 5 EEBEMO O=C(NCC1([NH2+]CC2CCC(F)(F)CC2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001673164219 1356651300 /nfs/dbraw/zinc/65/13/00/1356651300.db2.gz NEWKJUKJVMYROD-CHWSQXEVSA-N 1 1 345.390 2.106 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000919803443 770298632 /nfs/dbraw/zinc/29/86/32/770298632.db2.gz SXENHAUZGXPCDN-CJNGLKHVSA-N 1 1 334.420 2.309 10 5 EEBEMO Cc1[nH+]ccn1-c1ncccc1NC(=O)c1cc([N+](=O)[O-])cc(C)n1 ZINC001136293322 785746174 /nfs/dbraw/zinc/74/61/74/785746174.db2.gz MYCIIWUMBKFYCL-UHFFFAOYSA-N 1 1 338.327 2.440 10 5 EEBEMO O=C(NCc1cc([N+](=O)[O-])c(F)cc1F)[C@H]1CCC[N@H+]1C1CC1 ZINC000911474642 787467696 /nfs/dbraw/zinc/46/76/96/787467696.db2.gz NHRFAZXDHPZNIF-CYBMUJFWSA-N 1 1 325.315 2.116 10 5 EEBEMO Cc1sc(C(=O)NC(C)(C)CC[NH+]2CCOCC2)cc1[N+](=O)[O-] ZINC000912954199 788520431 /nfs/dbraw/zinc/52/04/31/788520431.db2.gz IOZZQQYTWKILIN-UHFFFAOYSA-N 1 1 341.433 2.195 10 5 EEBEMO C[C@@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21 ZINC001175210557 798033267 /nfs/dbraw/zinc/03/32/67/798033267.db2.gz BVHNPVWUMLDHPX-LLVKDONJSA-N 1 1 329.360 2.266 10 5 EEBEMO Cc1c(NC(=O)[C@@H](C)N2C[C@H]3C[N@@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC001176629236 798509187 /nfs/dbraw/zinc/50/91/87/798509187.db2.gz JBBDOAGLKRYJGL-LBTNJELSSA-N 1 1 346.431 2.114 10 5 EEBEMO Cn1cc([N+](=O)[O-])c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)n1 ZINC001458442209 1109874001 /nfs/dbraw/zinc/87/40/01/1109874001.db2.gz AWHSHXDDDISEGQ-CABCVRRESA-N 1 1 327.388 2.039 10 5 EEBEMO CCc1[nH+]ccn1[C@H]1CCCN(C(=O)c2cc([N+](=O)[O-])ccc2N)C1 ZINC000184382241 529761398 /nfs/dbraw/zinc/76/13/98/529761398.db2.gz ZGNQHJHSZDABEA-ZDUSSCGKSA-N 1 1 343.387 2.413 10 5 EEBEMO C[NH+](C)C[C@H](NS(=O)(=O)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000030499267 202196156 /nfs/dbraw/zinc/19/61/56/202196156.db2.gz GTGFXMRGDGELRV-AWEZNQCLSA-N 1 1 349.412 2.176 10 5 EEBEMO Cn1cc(C[N@H+]2CCCN(Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105869281 204172493 /nfs/dbraw/zinc/17/24/93/204172493.db2.gz SKHYMHCHEGEKMT-UHFFFAOYSA-N 1 1 329.404 2.036 10 5 EEBEMO Cn1cc(CN2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105869281 204172500 /nfs/dbraw/zinc/17/25/00/204172500.db2.gz SKHYMHCHEGEKMT-UHFFFAOYSA-N 1 1 329.404 2.036 10 5 EEBEMO Cn1cc(CN2CCC[N@@H+](Cc3ccccc3[N+](=O)[O-])CC2)cn1 ZINC000105869281 204172503 /nfs/dbraw/zinc/17/25/03/204172503.db2.gz SKHYMHCHEGEKMT-UHFFFAOYSA-N 1 1 329.404 2.036 10 5 EEBEMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000249021448 206327737 /nfs/dbraw/zinc/32/77/37/206327737.db2.gz KERWREORYKFFSC-GNXNZQSNSA-N 1 1 332.360 2.379 10 5 EEBEMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000249021448 206327741 /nfs/dbraw/zinc/32/77/41/206327741.db2.gz KERWREORYKFFSC-GNXNZQSNSA-N 1 1 332.360 2.379 10 5 EEBEMO CC(C)c1ccc(C[N@@H+](C)C[C@H](O)Cn2cc([N+](=O)[O-])cn2)cc1 ZINC000266430544 248297746 /nfs/dbraw/zinc/29/77/46/248297746.db2.gz KQPWPYYMFKQCLY-KRWDZBQOSA-N 1 1 332.404 2.408 10 5 EEBEMO CC(C)(C)NC(=O)C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000174247934 207001915 /nfs/dbraw/zinc/00/19/15/207001915.db2.gz UAWURMMCUYQYDF-UHFFFAOYSA-N 1 1 335.404 2.353 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC000177011242 207284756 /nfs/dbraw/zinc/28/47/56/207284756.db2.gz MLEUYCFKDQCWIE-LBPRGKRZSA-N 1 1 331.376 2.027 10 5 EEBEMO CC[N@@H+]1CCC[C@H]1CN(C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000177011242 207284758 /nfs/dbraw/zinc/28/47/58/207284758.db2.gz MLEUYCFKDQCWIE-LBPRGKRZSA-N 1 1 331.376 2.027 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)c1[nH]nc2ccc([N+](=O)[O-])cc21 ZINC000177011242 207284759 /nfs/dbraw/zinc/28/47/59/207284759.db2.gz MLEUYCFKDQCWIE-LBPRGKRZSA-N 1 1 331.376 2.027 10 5 EEBEMO C[C@@H]1CC[C@@H](C(N)=O)C[N@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892900 292213821 /nfs/dbraw/zinc/21/38/21/292213821.db2.gz DWDCQBBENLENDZ-DGCLKSJQSA-N 1 1 344.371 2.336 10 5 EEBEMO CC[N@H+]1CCC[C@H](NC(=O)Cc2c[nH]c3ccc([N+](=O)[O-])cc23)C1 ZINC000130607548 292376467 /nfs/dbraw/zinc/37/64/67/292376467.db2.gz LNGLYGFRIANPLO-ZDUSSCGKSA-N 1 1 330.388 2.219 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000375345964 167117022 /nfs/dbraw/zinc/11/70/22/167117022.db2.gz WNJMIKMWLOSLAP-MRXNPFEDSA-N 1 1 349.387 2.043 10 5 EEBEMO O=[N+]([O-])c1cnc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c(Br)c1 ZINC000339038328 275041369 /nfs/dbraw/zinc/04/13/69/275041369.db2.gz MNPHNJPJMDJSKW-SSDOTTSWSA-N 1 1 338.165 2.445 10 5 EEBEMO O=[N+]([O-])c1cnc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c(Br)c1 ZINC000339038328 275041371 /nfs/dbraw/zinc/04/13/71/275041371.db2.gz MNPHNJPJMDJSKW-SSDOTTSWSA-N 1 1 338.165 2.445 10 5 EEBEMO CNC(=O)c1ccc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C(C)C)c([N+](=O)[O-])c1 ZINC000266741149 277017707 /nfs/dbraw/zinc/01/77/07/277017707.db2.gz QGKPRYGCRKPVCO-CABCVRRESA-N 1 1 346.431 2.406 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc(NC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000525107151 317039001 /nfs/dbraw/zinc/03/90/01/317039001.db2.gz NKQQFOLJERGNLW-SWLSCSKDSA-N 1 1 334.420 2.439 10 5 EEBEMO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@@H]2C(N)=O)CC1 ZINC000131414498 462808991 /nfs/dbraw/zinc/80/89/91/462808991.db2.gz AXIGEHUKZAZTMD-CXAGYDPISA-N 1 1 346.431 2.070 10 5 EEBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(N2CCC[C@@H]2C(N)=O)CC1 ZINC000131414498 462808995 /nfs/dbraw/zinc/80/89/95/462808995.db2.gz AXIGEHUKZAZTMD-CXAGYDPISA-N 1 1 346.431 2.070 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(Cc3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000591849691 468529873 /nfs/dbraw/zinc/52/98/73/468529873.db2.gz JFTJVFRMQKDWCC-BXUZGUMPSA-N 1 1 340.221 2.493 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCCc1ccccc1[N+](=O)[O-] ZINC000080598409 463334586 /nfs/dbraw/zinc/33/45/86/463334586.db2.gz OOCGQRJZVXCZKI-CQSZACIVSA-N 1 1 334.420 2.311 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000173271713 464225902 /nfs/dbraw/zinc/22/59/02/464225902.db2.gz JMPMEYMAXIWMQR-CHWSQXEVSA-N 1 1 341.433 2.006 10 5 EEBEMO C[C@H]([NH2+]CC(=O)NC(=O)NC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000271689516 464360925 /nfs/dbraw/zinc/36/09/25/464360925.db2.gz FAQDQQSWFIEDOT-LBPRGKRZSA-N 1 1 348.403 2.404 10 5 EEBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](S(=O)(=O)N(C)C)C1 ZINC000285515391 464592825 /nfs/dbraw/zinc/59/28/25/464592825.db2.gz GGQODDIXABKTCJ-OLZOCXBDSA-N 1 1 341.433 2.012 10 5 EEBEMO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1CCC[C@H](S(=O)(=O)N(C)C)C1 ZINC000285515391 464592827 /nfs/dbraw/zinc/59/28/27/464592827.db2.gz GGQODDIXABKTCJ-OLZOCXBDSA-N 1 1 341.433 2.012 10 5 EEBEMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223325 465499013 /nfs/dbraw/zinc/49/90/13/465499013.db2.gz FEDCQAHKLHWXFD-KCJUWKMLSA-N 1 1 331.294 2.466 10 5 EEBEMO C[C@@H]1[C@@H](C(F)(F)F)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223325 465499014 /nfs/dbraw/zinc/49/90/14/465499014.db2.gz FEDCQAHKLHWXFD-KCJUWKMLSA-N 1 1 331.294 2.466 10 5 EEBEMO Cc1nc(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)ccc1[N+](=O)[O-] ZINC000301852858 466046581 /nfs/dbraw/zinc/04/65/81/466046581.db2.gz QAHINTWSGDJKES-XYPWUTKMSA-N 1 1 345.447 2.045 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@@]3(C2)CCCOC3)c2c(c1)COCO2 ZINC000367065780 466105837 /nfs/dbraw/zinc/10/58/37/466105837.db2.gz GXRNMQOEPIMIHG-QGZVFWFLSA-N 1 1 334.372 2.464 10 5 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O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3cnccn3)C2)c([N+](=O)[O-])c1 ZINC001654911978 1354161287 /nfs/dbraw/zinc/16/12/87/1354161287.db2.gz HJCLPVVONBVTMZ-NSHDSACASA-N 1 1 329.316 2.283 10 5 EEBEMO O=C(CC[N@H+]1CC[C@H](c2cnccn2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC001660351937 1354446374 /nfs/dbraw/zinc/44/63/74/1354446374.db2.gz JANPBDUAXDEWBZ-ZDUSSCGKSA-N 1 1 341.371 2.203 10 5 EEBEMO O=C(NCC1([NH2+]Cc2ccc(C3CCC3)cc2)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001699650845 1405430538 /nfs/dbraw/zinc/43/05/38/1405430538.db2.gz GRBQGCJRGDSVST-IAGOWNOFSA-N 1 1 343.427 2.358 10 5 EEBEMO C[C@H]1[C@H](NC(=O)NCc2cc([N+](=O)[O-])ccc2Cl)CC[N@H+]1C ZINC000921419984 773349157 /nfs/dbraw/zinc/34/91/57/773349157.db2.gz QNRMHCJZAWMAGA-TVQRCGJNSA-N 1 1 326.784 2.140 10 5 EEBEMO C/C(=C/C(=O)N1C[C@@H]2C[N@@H+](C)CC[C@@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000911828353 787746473 /nfs/dbraw/zinc/74/64/73/787746473.db2.gz BITWGGMKUWRXQP-VGAQJYNHSA-N 1 1 329.400 2.408 10 5 EEBEMO 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Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC([N@@H+](C)Cc2ccccc2)C1 ZINC000352865592 162319919 /nfs/dbraw/zinc/31/99/19/162319919.db2.gz CDMBZSQKVPVZSW-UHFFFAOYSA-N 1 1 340.383 2.255 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)CN(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000123879866 222346185 /nfs/dbraw/zinc/34/61/85/222346185.db2.gz GPNNOMWWQHWKSH-ZIAGYGMSSA-N 1 1 334.420 2.256 10 5 EEBEMO O=[N+]([O-])c1cccc(C[NH2+]Cc2cccc(N3CCOCC3)n2)c1 ZINC000274775777 269051525 /nfs/dbraw/zinc/05/15/25/269051525.db2.gz JORVWUAFUMMFOX-UHFFFAOYSA-N 1 1 328.372 2.116 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@](F)(C(=O)NCCc2ccccc2[N+](=O)[O-])C1 ZINC000290860042 275246967 /nfs/dbraw/zinc/24/69/67/275246967.db2.gz OXVRTSMKWCFHAQ-QGZVFWFLSA-N 1 1 337.395 2.466 10 5 EEBEMO CNC(=O)[C@H]1CC[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000421395458 314096386 /nfs/dbraw/zinc/09/63/86/314096386.db2.gz YKZSHBYNVMDUKL-LBPRGKRZSA-N 1 1 329.356 2.423 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000113224232 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CC[N@H+]1CCC[C@@H](CNC(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000362662752 465921770 /nfs/dbraw/zinc/92/17/70/465921770.db2.gz IVAIBBLQMXHCFT-NSHDSACASA-N 1 1 341.358 2.264 10 5 EEBEMO Cc1nn(C)c(N2CCC(Nc3cccc(C)[nH+]3)CC2)c1[N+](=O)[O-] ZINC000301251119 465929358 /nfs/dbraw/zinc/92/93/58/465929358.db2.gz CAYVRTKOQMPMQT-UHFFFAOYSA-N 1 1 330.392 2.421 10 5 EEBEMO Cc1ccncc1C[N@@H+](C)C[C@H](O)COc1cccc([N+](=O)[O-])c1 ZINC000361437714 465996047 /nfs/dbraw/zinc/99/60/47/465996047.db2.gz OOYLBNZNLGDCJR-INIZCTEOSA-N 1 1 331.372 2.170 10 5 EEBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN([C@H]2CCC[N@@H+](C)C2)CC1 ZINC000363419523 466392916 /nfs/dbraw/zinc/39/29/16/466392916.db2.gz VXNHTYDRCAJZQB-YJBOKZPZSA-N 1 1 332.448 2.368 10 5 EEBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc([N+](=O)[O-])cnc2C)CC1 ZINC000373476163 466816075 /nfs/dbraw/zinc/81/60/75/466816075.db2.gz POJAGLOQULPZED-UHFFFAOYSA-N 1 1 329.360 2.280 10 5 EEBEMO Cc1sc(C(=O)N2CC[NH2+]C[C@@H]2c2ccncc2)cc1[N+](=O)[O-] ZINC000423958081 466928992 /nfs/dbraw/zinc/92/89/92/466928992.db2.gz BKGSXDNFIFNAOV-CYBMUJFWSA-N 1 1 332.385 2.146 10 5 EEBEMO O=C(CNc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000456995743 467727670 /nfs/dbraw/zinc/72/76/70/467727670.db2.gz PNAXCDFYHYGTGC-INIZCTEOSA-N 1 1 340.383 2.180 10 5 EEBEMO CC(C)[C@@H](CNc1c2ccccc2ncc1[N+](=O)[O-])[NH+]1CCOCC1 ZINC000487907180 468059459 /nfs/dbraw/zinc/05/94/59/468059459.db2.gz IAIFMEKFJAWKLX-MRXNPFEDSA-N 1 1 344.415 2.334 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@H](CO)[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000488717751 468098516 /nfs/dbraw/zinc/09/85/16/468098516.db2.gz LGNQJWDURRDTIF-VHSXEESVSA-N 1 1 346.330 2.408 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+](C[C@@H]2CCOC2)C2CC2)c1 ZINC000589494950 468156315 /nfs/dbraw/zinc/15/63/15/468156315.db2.gz BYBIIMQSYAOKQM-LBPRGKRZSA-N 1 1 334.372 2.382 10 5 EEBEMO C[C@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CS1(=O)=O ZINC000594975191 468735753 /nfs/dbraw/zinc/73/57/53/468735753.db2.gz MISIIFZAUWHLDR-ONGXEEELSA-N 1 1 332.809 2.304 10 5 EEBEMO Cn1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C(F)F)n1 ZINC000601148631 468761078 /nfs/dbraw/zinc/76/10/78/468761078.db2.gz FXQWHUNGHJLTLP-OAHLLOKOSA-N 1 1 340.330 2.263 10 5 EEBEMO Cc1cccc(N2CC[NH+](CCc3cnccn3)CC2)c1[N+](=O)[O-] ZINC000601253633 468799780 /nfs/dbraw/zinc/79/97/80/468799780.db2.gz UXLPTKWGRNCGRZ-UHFFFAOYSA-N 1 1 327.388 2.058 10 5 EEBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1CC[C@H](Cn2ccnn2)C1 ZINC000595605792 468919408 /nfs/dbraw/zinc/91/94/08/468919408.db2.gz GICYWGCJOCTUHP-AWEZNQCLSA-N 1 1 345.403 2.496 10 5 EEBEMO CC(C)(C)OC(=O)[C@]12COC[C@H]1C[N@@H+](Cc1ccccc1[N+](=O)[O-])C2 ZINC000595718689 468966608 /nfs/dbraw/zinc/96/66/08/468966608.db2.gz VBGIWPHESXNGMS-RDTXWAMCSA-N 1 1 348.399 2.385 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[N@H+]2CC[C@H]3COC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000595826979 469030580 /nfs/dbraw/zinc/03/05/80/469030580.db2.gz BPAFWOJFOVGOGV-IHRRRGAJSA-N 1 1 333.388 2.199 10 5 EEBEMO O=[N+]([O-])c1ccc(OCCC[N@@H+]2C[C@@H](CO)[C@H](C(F)(F)F)C2)cc1 ZINC000602987627 469209197 /nfs/dbraw/zinc/20/91/97/469209197.db2.gz MMKYAOMBIGEIAB-SMDDNHRTSA-N 1 1 348.321 2.466 10 5 EEBEMO Nc1cc(NCC[N@H+]2CCc3ccccc3C2)cc(CO)c1[N+](=O)[O-] ZINC000611525197 469272389 /nfs/dbraw/zinc/27/23/89/469272389.db2.gz KMAJZDOTYWHFDA-UHFFFAOYSA-N 1 1 342.399 2.140 10 5 EEBEMO O=[N+]([O-])c1ccc2c(ccnc2N2CCC([N@H+]3CC[C@H](O)C3)CC2)c1 ZINC000596539273 469296262 /nfs/dbraw/zinc/29/62/62/469296262.db2.gz NVCPJDLDLKDFIA-INIZCTEOSA-N 1 1 342.399 2.178 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3C[C@@H]4CCC[C@]4(CO)C3)o2)cc1 ZINC000599637237 469318420 /nfs/dbraw/zinc/31/84/20/469318420.db2.gz UAACWMJIDRXNEC-SUMWQHHRSA-N 1 1 344.371 2.239 10 5 EEBEMO C[N@H+]1CCCN(C(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)CC1 ZINC000599833616 469386769 /nfs/dbraw/zinc/38/67/69/469386769.db2.gz VNDZFNSJUMTZOK-UHFFFAOYSA-N 1 1 329.360 2.312 10 5 EEBEMO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000182260151 490692282 /nfs/dbraw/zinc/69/22/82/490692282.db2.gz KHUQVZHQSIXGGJ-SNVBAGLBSA-N 1 1 343.339 2.273 10 5 EEBEMO CCOCC[NH+]1CCN(C(=O)/C=C(/C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000752243074 577767833 /nfs/dbraw/zinc/76/78/33/577767833.db2.gz GAUSVRXSDIPEPS-PFONDFGASA-N 1 1 347.415 2.179 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@H]([C@@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000747822990 577950686 /nfs/dbraw/zinc/95/06/86/577950686.db2.gz GJNILTQZPDVDRA-UONOGXRCSA-N 1 1 345.403 2.354 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000928433654 683113572 /nfs/dbraw/zinc/11/35/72/683113572.db2.gz AWPYVXULJNUTBD-PSASIEDQSA-N 1 1 329.303 2.019 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000928441719 683164398 /nfs/dbraw/zinc/16/43/98/683164398.db2.gz TUELDBIFFDYBLX-LDYMZIIASA-N 1 1 329.303 2.019 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)Nc2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000925322422 692043759 /nfs/dbraw/zinc/04/37/59/692043759.db2.gz XKWISOGMVUHIFR-WPRPVWTQSA-N 1 1 344.318 2.410 10 5 EEBEMO O=C(/C=C/c1ccco1)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001268495330 1183003521 /nfs/dbraw/zinc/00/35/21/1183003521.db2.gz MLWRXTFPWHOXTA-BQYQJAHWSA-N 1 1 341.367 2.449 10 5 EEBEMO Cc1c(C(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccn1C ZINC001482625938 1187450921 /nfs/dbraw/zinc/45/09/21/1187450921.db2.gz LFRBHUWPTMNALF-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO Cc1cc(N2C[C@@H](C)[N@@H+](CCO)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000842047988 1188245221 /nfs/dbraw/zinc/24/52/21/1188245221.db2.gz YGTUHRVYPFKSQL-NEPJUHHUSA-N 1 1 327.812 2.448 10 5 EEBEMO Cc1cc(N2C[C@@H](C)[N@H+](CCO)C[C@@H]2C)c(Cl)cc1[N+](=O)[O-] ZINC000842047988 1188245226 /nfs/dbraw/zinc/24/52/26/1188245226.db2.gz YGTUHRVYPFKSQL-NEPJUHHUSA-N 1 1 327.812 2.448 10 5 EEBEMO C[C@@H](NC[C@H]1CCC[N@H+]1CCCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872076081 1198040723 /nfs/dbraw/zinc/04/07/23/1198040723.db2.gz XCSCLGHTPPNETH-CHWSQXEVSA-N 1 1 325.384 2.231 10 5 EEBEMO C[C@@H]([NH2+]C[C@H]1CCCN1CCCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872076081 1198040734 /nfs/dbraw/zinc/04/07/34/1198040734.db2.gz XCSCLGHTPPNETH-CHWSQXEVSA-N 1 1 325.384 2.231 10 5 EEBEMO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CO)c1ccnn1C ZINC000872087284 1198043740 /nfs/dbraw/zinc/04/37/40/1198043740.db2.gz HYNAUDRNPJTXBT-GWCFXTLKSA-N 1 1 336.417 2.434 10 5 EEBEMO C[C@@H](c1cccc(NCc2cn(C)nc2[N+](=O)[O-])c1)[NH+]1CCOCC1 ZINC000876859679 1199797951 /nfs/dbraw/zinc/79/79/51/1199797951.db2.gz XDDSMXOQJNZCKR-ZDUSSCGKSA-N 1 1 345.403 2.334 10 5 EEBEMO CC(=O)c1c(NCCN2CC[N@H+](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000882313029 1201848873 /nfs/dbraw/zinc/84/88/73/1201848873.db2.gz PUHYWYKZMGAKCS-UHFFFAOYSA-N 1 1 334.420 2.235 10 5 EEBEMO C[C@H](C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cccc([N+](=O)[O-])c1 ZINC000928083966 1206337216 /nfs/dbraw/zinc/33/72/16/1206337216.db2.gz BVCMFJYTZXYKMN-VBNZEHGJSA-N 1 1 349.456 2.394 10 5 EEBEMO COc1cc(C[N@H+]2[C@H](C)CC[C@H](C(N)=O)[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000930911199 1206591900 /nfs/dbraw/zinc/59/19/00/1206591900.db2.gz LVXZOBXLTMGSAR-SCVCMEIPSA-N 1 1 339.367 2.217 10 5 EEBEMO COc1cncc(N2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000931208692 1206616014 /nfs/dbraw/zinc/61/60/14/1206616014.db2.gz MSODNEBPGDEPBZ-UHFFFAOYSA-N 1 1 328.372 2.321 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000902903701 1239000229 /nfs/dbraw/zinc/00/02/29/1239000229.db2.gz CGDQRCSAEQDMLR-KGLIPLIRSA-N 1 1 336.417 2.296 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1)C(=O)c1cocn1 ZINC001273496014 1278593420 /nfs/dbraw/zinc/59/34/20/1278593420.db2.gz QOYGBKQFJMHUMJ-UHFFFAOYSA-N 1 1 332.360 2.177 10 5 EEBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1ccnnc1 ZINC001273566366 1279956454 /nfs/dbraw/zinc/95/64/54/1279956454.db2.gz RJWDHDXCXSUUEZ-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1ccnnc1 ZINC001273566366 1279956458 /nfs/dbraw/zinc/95/64/58/1279956458.db2.gz RJWDHDXCXSUUEZ-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CC[C@H](c2ccccn2)C1 ZINC000799158588 1305170185 /nfs/dbraw/zinc/17/01/85/1305170185.db2.gz OFCKSASJVFKNCU-LBPRGKRZSA-N 1 1 340.339 2.345 10 5 EEBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CC[C@H](c2ccccn2)C1 ZINC000799158588 1305170189 /nfs/dbraw/zinc/17/01/89/1305170189.db2.gz OFCKSASJVFKNCU-LBPRGKRZSA-N 1 1 340.339 2.345 10 5 EEBEMO Cc1ncc(CC(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)o1 ZINC001316831043 1331920571 /nfs/dbraw/zinc/92/05/71/1331920571.db2.gz XCLLHPBWSQZONT-UHFFFAOYSA-N 1 1 346.387 2.072 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1ccon1)Cc1ccccc1[N+](=O)[O-] ZINC001316886003 1331952080 /nfs/dbraw/zinc/95/20/80/1331952080.db2.gz QBBWWCRKZVUDJA-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO O=C(NCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)C(F)F ZINC001316908979 1331974798 /nfs/dbraw/zinc/97/47/98/1331974798.db2.gz JGJFLVPQRFXGAM-UHFFFAOYSA-N 1 1 327.331 2.331 10 5 EEBEMO Cc1nocc1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001317556860 1332296683 /nfs/dbraw/zinc/29/66/83/1332296683.db2.gz QHXWMSFDFONCMD-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO CNC(=O)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC001321345221 1333079661 /nfs/dbraw/zinc/07/96/61/1333079661.db2.gz UVUSHNRSVMHAGF-LBPRGKRZSA-N 1 1 344.209 2.218 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(CNC(=O)C2CCCCCC2)CC1 ZINC001323407234 1333457694 /nfs/dbraw/zinc/45/76/94/1333457694.db2.gz VPNMHBACCGJTJB-UHFFFAOYSA-N 1 1 349.435 2.037 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@@H](CNC(=O)c2[nH]nc([N+](=O)[O-])c2Cl)C1 ZINC001632289981 1352595580 /nfs/dbraw/zinc/59/55/80/1352595580.db2.gz FKKHEGYAMXDKLJ-JTQLQIEISA-N 1 1 343.815 2.069 10 5 EEBEMO Nc1[nH+]ccc2c1CN(c1nc3c(cc1[N+](=O)[O-])CCCC3)CC2 ZINC001640525131 1352711160 /nfs/dbraw/zinc/71/11/60/1352711160.db2.gz IJTXIMZPUIBZMQ-UHFFFAOYSA-N 1 1 325.372 2.409 10 5 EEBEMO C[C@]1(CO)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001642363089 1352729625 /nfs/dbraw/zinc/72/96/25/1352729625.db2.gz LCUGPKRYFUGARS-INIZCTEOSA-N 1 1 332.360 2.239 10 5 EEBEMO C[C@]1(CO)CCC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001642363089 1352729629 /nfs/dbraw/zinc/72/96/29/1352729629.db2.gz LCUGPKRYFUGARS-INIZCTEOSA-N 1 1 332.360 2.239 10 5 EEBEMO Cc1noc(C[N@H+]2C[C@H]3COC[C@@]3(c3ccccc3)C2)c1[N+](=O)[O-] ZINC001660107358 1354397804 /nfs/dbraw/zinc/39/78/04/1354397804.db2.gz VGEVGXQDPQMPDD-WMLDXEAASA-N 1 1 329.356 2.291 10 5 EEBEMO Cc1cc(F)cc(C(=O)N2C[C@]3(C)C[N@H+](C)C[C@]3(C)C2)c1[N+](=O)[O-] ZINC000913282383 788759942 /nfs/dbraw/zinc/75/99/42/788759942.db2.gz GMLBSIASIMUCEJ-CALCHBBNSA-N 1 1 335.379 2.456 10 5 EEBEMO Cn1nc2c(c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)COCC2 ZINC000921835257 796821714 /nfs/dbraw/zinc/82/17/14/796821714.db2.gz RIURGFLOZFIVFU-UHFFFAOYSA-N 1 1 336.779 2.344 10 5 EEBEMO COC(=O)C12CCC(CC1)[N@@H+]2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001175323112 798076034 /nfs/dbraw/zinc/07/60/34/798076034.db2.gz HZPZSBRTHLNWLL-UHFFFAOYSA-N 1 1 347.371 2.093 10 5 EEBEMO COC(=O)C12CCC(CC1)[N@H+]2CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001175323112 798076039 /nfs/dbraw/zinc/07/60/39/798076039.db2.gz HZPZSBRTHLNWLL-UHFFFAOYSA-N 1 1 347.371 2.093 10 5 EEBEMO C[C@H]1COC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001176364857 798441373 /nfs/dbraw/zinc/44/13/73/798441373.db2.gz IBMCDEGGNTUXDQ-GZMMTYOYSA-N 1 1 338.751 2.423 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1sccc1Cl ZINC001566453018 1125611638 /nfs/dbraw/zinc/61/16/38/1125611638.db2.gz CGRPQDWKYCITPA-MWLCHTKSSA-N 1 1 331.825 2.005 10 5 EEBEMO C[N@@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001446186454 1092261345 /nfs/dbraw/zinc/26/13/45/1092261345.db2.gz FABIEZSYGKILEA-ZFWWWQNUSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001446186454 1092261357 /nfs/dbraw/zinc/26/13/57/1092261357.db2.gz FABIEZSYGKILEA-ZFWWWQNUSA-N 1 1 332.335 2.237 10 5 EEBEMO CCOC(=O)[C@@H](C)[C@H](C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001459903381 1110250067 /nfs/dbraw/zinc/25/00/67/1110250067.db2.gz SZWKPIFAGMZRJF-QWRGUYRKSA-N 1 1 348.359 2.322 10 5 EEBEMO O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC001466636333 1110440101 /nfs/dbraw/zinc/44/01/01/1110440101.db2.gz RDEZHPCNGIJKOU-YGRLFVJLSA-N 1 1 329.360 2.427 10 5 EEBEMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2ccc([N+](=O)[O-])cc2N)C1 ZINC001467938090 1110466451 /nfs/dbraw/zinc/46/64/51/1110466451.db2.gz LRZJNMGGXPRNMQ-UHFFFAOYSA-N 1 1 340.383 2.133 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CC1(CO)CC1 ZINC000186774644 236015063 /nfs/dbraw/zinc/01/50/63/236015063.db2.gz JLNRWJVLLNEXAE-NSHDSACASA-N 1 1 332.360 2.410 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+](C)CC1(CO)CC1 ZINC000186774644 236015066 /nfs/dbraw/zinc/01/50/66/236015066.db2.gz JLNRWJVLLNEXAE-NSHDSACASA-N 1 1 332.360 2.410 10 5 EEBEMO CCC[C@@H]1CN(c2nc3cc([N+](=O)[O-])ccc3[nH]2)CC[N@H+]1CCOC ZINC000447677135 242303543 /nfs/dbraw/zinc/30/35/43/242303543.db2.gz HIHJUTGYXQVSEY-CQSZACIVSA-N 1 1 347.419 2.408 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000247193410 243391275 /nfs/dbraw/zinc/39/12/75/243391275.db2.gz LJEDVBKSDQQXNW-KGLIPLIRSA-N 1 1 333.388 2.059 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000071888311 203138042 /nfs/dbraw/zinc/13/80/42/203138042.db2.gz FMGZZJAURDZSEU-GFCCVEGCSA-N 1 1 341.795 2.089 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3[C@@H]4CC[C@H]3CC(O)C4)n2)c1 ZINC000111317055 204348689 /nfs/dbraw/zinc/34/86/89/204348689.db2.gz MIJYIPZBOZIQRH-ONXXMXGDSA-N 1 1 330.344 2.133 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3[C@@H]4CC[C@H]3CC(O)C4)n2)c1 ZINC000111317055 204348694 /nfs/dbraw/zinc/34/86/94/204348694.db2.gz MIJYIPZBOZIQRH-ONXXMXGDSA-N 1 1 330.344 2.133 10 5 EEBEMO Cc1c(NC(=O)N2C[C@@H](C)[C@@H]([NH+]3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000177700327 207380376 /nfs/dbraw/zinc/38/03/76/207380376.db2.gz IWVRJRWHZRYRPN-WBMJQRKESA-N 1 1 348.403 2.088 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000119030169 292240355 /nfs/dbraw/zinc/24/03/55/292240355.db2.gz JMERKFXQCAKORG-HNNXBMFYSA-N 1 1 349.431 2.097 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)CCc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000119030169 292240356 /nfs/dbraw/zinc/24/03/56/292240356.db2.gz JMERKFXQCAKORG-HNNXBMFYSA-N 1 1 349.431 2.097 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](C[C@@H](O)CC3CCCC3)C2)nc1 ZINC000249120177 160374148 /nfs/dbraw/zinc/37/41/48/160374148.db2.gz SOJRVJJEUKDSET-ZBFHGGJFSA-N 1 1 334.420 2.417 10 5 EEBEMO Cn1cc(C[N@H+](C)Cc2cnccn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092590799 159223129 /nfs/dbraw/zinc/22/31/29/159223129.db2.gz YMVATMXFKDCHAJ-UHFFFAOYSA-N 1 1 338.371 2.417 10 5 EEBEMO Cn1cc(C[N@@H+](C)Cc2cnccn2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092590799 159223132 /nfs/dbraw/zinc/22/31/32/159223132.db2.gz YMVATMXFKDCHAJ-UHFFFAOYSA-N 1 1 338.371 2.417 10 5 EEBEMO COc1cc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c([N+](=O)[O-])cc1OC ZINC000093479764 159236732 /nfs/dbraw/zinc/23/67/32/159236732.db2.gz ODGWMIIEEOXTLH-GTKHYJCHSA-N 1 1 336.388 2.205 10 5 EEBEMO CCOc1ccc(NC(=O)C[N@@H+](C[C@@H](C)O)C(C)C)c([N+](=O)[O-])c1 ZINC000107044107 159326770 /nfs/dbraw/zinc/32/67/70/159326770.db2.gz HIHHGNLCYZYCCK-GFCCVEGCSA-N 1 1 339.392 2.023 10 5 EEBEMO CCOC(=O)c1cc([N+](=O)[O-])cc(F)c1N1CC[N@H+]2CCC[C@H]2C1 ZINC000247064715 160307620 /nfs/dbraw/zinc/30/76/20/160307620.db2.gz RSKLXVIRJMJPDX-NSHDSACASA-N 1 1 337.351 2.195 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000342003979 161031375 /nfs/dbraw/zinc/03/13/75/161031375.db2.gz YDAOLPZQEOIXRT-SUMWQHHRSA-N 1 1 333.388 2.424 10 5 EEBEMO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000342003979 161031376 /nfs/dbraw/zinc/03/13/76/161031376.db2.gz YDAOLPZQEOIXRT-SUMWQHHRSA-N 1 1 333.388 2.424 10 5 EEBEMO O=C(C[N@@H+]1CCCCC[C@H]1CCO)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000342055315 161036024 /nfs/dbraw/zinc/03/60/24/161036024.db2.gz AXBALLWLXIEPGQ-HNNXBMFYSA-N 1 1 347.415 2.111 10 5 EEBEMO O=C1[C@@H]([NH2+][C@@H](CO)c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000352034159 162039313 /nfs/dbraw/zinc/03/93/13/162039313.db2.gz YTHXZEYCKXANDA-GJZGRUSLSA-N 1 1 347.396 2.085 10 5 EEBEMO CCOC(=O)c1ccnc(NCC[N@@H+]2CC=C(C)CC2)c1[N+](=O)[O-] ZINC000358309907 163884812 /nfs/dbraw/zinc/88/48/12/163884812.db2.gz KFAZFGAXGSDZIV-UHFFFAOYSA-N 1 1 334.376 2.230 10 5 EEBEMO Cc1sc(C(=O)NC2CCN(c3[nH+]ccn3C)CC2)cc1[N+](=O)[O-] ZINC000372976086 166821103 /nfs/dbraw/zinc/82/11/03/166821103.db2.gz FVVQDCYTQXOGPF-UHFFFAOYSA-N 1 1 349.416 2.097 10 5 EEBEMO C[C@@H](C[N@@H+](C)Cc1ccccc1)NC(=O)c1c(N)cccc1[N+](=O)[O-] ZINC000181317480 274213181 /nfs/dbraw/zinc/21/31/81/274213181.db2.gz GSYNTTVODYXZSW-ZDUSSCGKSA-N 1 1 342.399 2.427 10 5 EEBEMO COc1cccc(N2CCC([N@H+]3CCO[C@@H](C)C3)CC2)c1[N+](=O)[O-] ZINC000185196142 278015727 /nfs/dbraw/zinc/01/57/27/278015727.db2.gz BQSUTZUZNFRLPH-ZDUSSCGKSA-N 1 1 335.404 2.293 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CCC[C@]2(CC[NH2+]C2)C1 ZINC000420359533 281017486 /nfs/dbraw/zinc/01/74/86/281017486.db2.gz FUNGXCUWCUUAPN-GOSISDBHSA-N 1 1 346.431 2.307 10 5 EEBEMO Cn1cc([C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2(CO)CCC2)cn1 ZINC000590603074 468285397 /nfs/dbraw/zinc/28/53/97/468285397.db2.gz OFZXCFUXMPWYPT-INIZCTEOSA-N 1 1 330.388 2.322 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[N@H+](C3CC3)C[C@@H](C)C2)c1 ZINC000590654457 468296508 /nfs/dbraw/zinc/29/65/08/468296508.db2.gz BXYJKLHPMLDVDR-ZDUSSCGKSA-N 1 1 347.415 2.298 10 5 EEBEMO CC[C@@H]1CN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000117307617 462798261 /nfs/dbraw/zinc/79/82/61/462798261.db2.gz RQUVLCMVXNTBCG-YXMGTMDOSA-N 1 1 347.415 2.177 10 5 EEBEMO CC(C)NC(=O)C[N@@H+](C)C1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000095986698 463129173 /nfs/dbraw/zinc/12/91/73/463129173.db2.gz YRHCBGWEJXSYME-UHFFFAOYSA-N 1 1 340.449 2.082 10 5 EEBEMO Cc1cnc(CC[N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000157754573 463166081 /nfs/dbraw/zinc/16/60/81/463166081.db2.gz PWLAYOPGHIYGCX-UHFFFAOYSA-N 1 1 348.428 2.497 10 5 EEBEMO Cc1cnc(CC[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000157754573 463166083 /nfs/dbraw/zinc/16/60/83/463166083.db2.gz PWLAYOPGHIYGCX-UHFFFAOYSA-N 1 1 348.428 2.497 10 5 EEBEMO COCCCNC(=O)C1CC[NH+](Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056511858 463406996 /nfs/dbraw/zinc/40/69/96/463406996.db2.gz XYCBJAPGQXOPLV-UHFFFAOYSA-N 1 1 341.433 2.021 10 5 EEBEMO O=C(C[N@@H+]1CCC[C@H]1CCCO)N1CCCc2cc([N+](=O)[O-])ccc21 ZINC000072636089 463527944 /nfs/dbraw/zinc/52/79/44/463527944.db2.gz OCANEVADONFBCI-HNNXBMFYSA-N 1 1 347.415 2.111 10 5 EEBEMO Cc1cc(C(=O)N2CC[NH2+]C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000261911404 463897490 /nfs/dbraw/zinc/89/74/90/463897490.db2.gz HQUYZYMJVSXTTA-INIZCTEOSA-N 1 1 326.356 2.085 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000172017543 463970228 /nfs/dbraw/zinc/97/02/28/463970228.db2.gz DBCNPBOGWUQPSV-ZDUSSCGKSA-N 1 1 341.433 2.056 10 5 EEBEMO O=[N+]([O-])c1cnc(NC[C@@H]2C[C@H](O)C[N@@H+]2Cc2ccccc2)s1 ZINC000249219102 464852821 /nfs/dbraw/zinc/85/28/21/464852821.db2.gz FTIBDLUIVBILNA-STQMWFEESA-N 1 1 334.401 2.099 10 5 EEBEMO C[C@](O)(C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000298188559 465327694 /nfs/dbraw/zinc/32/76/94/465327694.db2.gz WNTPKSVEHRUOLZ-SFHVURJKSA-N 1 1 342.399 2.020 10 5 EEBEMO Cc1cccc(C(=O)N2CCC([N@H+]3CCCOCC3)CC2)c1[N+](=O)[O-] ZINC000600007420 468435543 /nfs/dbraw/zinc/43/55/43/468435543.db2.gz QDTZJFXGLCDZIV-UHFFFAOYSA-N 1 1 347.415 2.230 10 5 EEBEMO Cn1ccnc1[C@H](NC[C@@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000353498953 465935164 /nfs/dbraw/zinc/93/51/64/465935164.db2.gz SFWXOHVHJUUGHX-JKSUJKDBSA-N 1 1 329.404 2.102 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)c1cc2nc[nH]c(=O)c2cc1[N+](=O)[O-] ZINC000301482035 465970025 /nfs/dbraw/zinc/97/00/25/465970025.db2.gz SSHXMSUWWORMRV-NSHDSACASA-N 1 1 331.376 2.164 10 5 EEBEMO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1ccc(Cl)cc1 ZINC000301886304 466055596 /nfs/dbraw/zinc/05/55/96/466055596.db2.gz PTLBBZUKNVCMGT-WCQYABFASA-N 1 1 348.794 2.478 10 5 EEBEMO C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])c(N)n2)[C@H]1c1ccc(Cl)cc1 ZINC000301886304 466055612 /nfs/dbraw/zinc/05/56/12/466055612.db2.gz PTLBBZUKNVCMGT-WCQYABFASA-N 1 1 348.794 2.478 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccccc1 ZINC000372268600 466260697 /nfs/dbraw/zinc/26/06/97/466260697.db2.gz ZVUBGOPQPXVQBS-GOEBONIOSA-N 1 1 326.356 2.165 10 5 EEBEMO O=C(CC[N@@H+]1C[C@H]2CCC[C@@H](C1)C2O)Nc1ccc([N+](=O)[O-])cc1 ZINC000363176238 466263454 /nfs/dbraw/zinc/26/34/54/466263454.db2.gz GZKQMAFCCBACGH-MPYYAJLASA-N 1 1 333.388 2.016 10 5 EEBEMO C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098565 468484301 /nfs/dbraw/zinc/48/43/01/468484301.db2.gz JAANQGCUYDKZJV-SOUVJXGZSA-N 1 1 349.431 2.141 10 5 EEBEMO C[C@@H](CNC(=O)CCc1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594098565 468484305 /nfs/dbraw/zinc/48/43/05/468484305.db2.gz JAANQGCUYDKZJV-SOUVJXGZSA-N 1 1 349.431 2.141 10 5 EEBEMO CCNc1ccc(C(=O)N(C)[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000347016725 466324356 /nfs/dbraw/zinc/32/43/56/466324356.db2.gz SXEUZYXBZJMPEQ-AWEZNQCLSA-N 1 1 332.404 2.335 10 5 EEBEMO Cc1cc(N2CC[N@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338708012 466325998 /nfs/dbraw/zinc/32/59/98/466325998.db2.gz OAMOJQQQSAFYOD-LLVKDONJSA-N 1 1 347.337 2.425 10 5 EEBEMO Cc1cc(N2CC[N@@H+](CCO)[C@H](C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000338708012 466326005 /nfs/dbraw/zinc/32/60/05/466326005.db2.gz OAMOJQQQSAFYOD-LLVKDONJSA-N 1 1 347.337 2.425 10 5 EEBEMO O=[N+]([O-])c1ccc(O)cc1CN1CCN(c2cccc(O)c2)CC1 ZINC000338903192 466471664 /nfs/dbraw/zinc/47/16/64/466471664.db2.gz JDFWWZMXJYVYBO-UHFFFAOYSA-N 1 1 329.356 2.328 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(NC2CCN(c3[nH+]ccn3C)CC2)n1 ZINC000428266278 467217330 /nfs/dbraw/zinc/21/73/30/467217330.db2.gz JZFRGSOULYZONW-UHFFFAOYSA-N 1 1 330.392 2.421 10 5 EEBEMO C[C@H]1C[N@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408384490 467549850 /nfs/dbraw/zinc/54/98/50/467549850.db2.gz HNVHXPVUUUOPFP-VIFPVBQESA-N 1 1 342.193 2.133 10 5 EEBEMO C[C@H]1C[N@@H+](C)CCN1C(=O)c1ccc(Br)cc1[N+](=O)[O-] ZINC000408384490 467549853 /nfs/dbraw/zinc/54/98/53/467549853.db2.gz HNVHXPVUUUOPFP-VIFPVBQESA-N 1 1 342.193 2.133 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2csc(N3CC[N@@H+]4CCOC[C@H]4C3)n2)cc1 ZINC000448960491 467608313 /nfs/dbraw/zinc/60/83/13/467608313.db2.gz FQINKAHEVHIRFR-CQSZACIVSA-N 1 1 346.412 2.239 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2csc(N3CC[N@H+]4CCOC[C@H]4C3)n2)cc1 ZINC000448960491 467608315 /nfs/dbraw/zinc/60/83/15/467608315.db2.gz FQINKAHEVHIRFR-CQSZACIVSA-N 1 1 346.412 2.239 10 5 EEBEMO CCOc1cc(C[N@@H+]2CCSC[C@H]2CCO)ccc1[N+](=O)[O-] ZINC000492786595 467751039 /nfs/dbraw/zinc/75/10/39/467751039.db2.gz BAKGLLKTVMJVLO-CYBMUJFWSA-N 1 1 326.418 2.293 10 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VXKQFQXKLORVKQ-ZANVPECISA-N 1 1 334.294 2.349 10 5 EEBEMO CC(C)[N@@H+]1C[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000155716730 206030242 /nfs/dbraw/zinc/03/02/42/206030242.db2.gz RSPLKIGAJZJYTO-KBPBESRZSA-N 1 1 335.404 2.209 10 5 EEBEMO COc1ccc([N+](=O)[O-])c(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)c1 ZINC000160421771 206295859 /nfs/dbraw/zinc/29/58/59/206295859.db2.gz NSETWJDRBIRQSJ-CYBMUJFWSA-N 1 1 335.404 2.454 10 5 EEBEMO COc1cc(C(=O)NC[C@H]2CCC[N@H+]2CC(C)C)ccc1[N+](=O)[O-] ZINC000160379682 206294931 /nfs/dbraw/zinc/29/49/31/206294931.db2.gz LZCHFQBFMCQRJY-CQSZACIVSA-N 1 1 335.404 2.454 10 5 EEBEMO COc1cc(N2CCN(C[C@H]3CCCC[N@H+]3C)CC2)ccc1[N+](=O)[O-] ZINC000266160451 248139145 /nfs/dbraw/zinc/13/91/45/248139145.db2.gz WMJNPTQJKOBAFU-MRXNPFEDSA-N 1 1 348.447 2.210 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)c2ccc(C(=O)NC)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000266222706 248184882 /nfs/dbraw/zinc/18/48/82/248184882.db2.gz IBIJZUFLAWIVQL-JSGCOSHPSA-N 1 1 334.420 2.121 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC[C@H](Cn2cncn2)C1 ZINC000175235300 207107634 /nfs/dbraw/zinc/10/76/34/207107634.db2.gz UXKUFYPOTVEJJX-AWEZNQCLSA-N 1 1 345.403 2.497 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000177712153 207382242 /nfs/dbraw/zinc/38/22/42/207382242.db2.gz LYDGNGSOPZXRPA-OAHLLOKOSA-N 1 1 334.420 2.258 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@H]1CCCO1 ZINC000076300039 159083393 /nfs/dbraw/zinc/08/33/93/159083393.db2.gz NXCFHIDVYUCMFF-CYBMUJFWSA-N 1 1 337.376 2.043 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[N@H+]2CCC[C@H]2C1 ZINC000246217697 160268038 /nfs/dbraw/zinc/26/80/38/160268038.db2.gz AXPIRIHPEOIGGI-HNNXBMFYSA-N 1 1 332.404 2.012 10 5 EEBEMO Cc1c(NC(=O)[C@@H](C)N2CC[N@H+]3CCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000246784138 160294412 /nfs/dbraw/zinc/29/44/12/160294412.db2.gz ZKNXSNUBVSHAOY-KGLIPLIRSA-N 1 1 332.404 2.010 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])cc2)[C@@H](C)C1 ZINC000247284730 160318570 /nfs/dbraw/zinc/31/85/70/160318570.db2.gz GBZWDMHODIRRQP-XJKSGUPXSA-N 1 1 335.404 2.162 10 5 EEBEMO C[C@@H]([NH2+][C@@H](CO)c1ccsc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000352032679 162037801 /nfs/dbraw/zinc/03/78/01/162037801.db2.gz NKLQKQCBWVWQTM-MFKMUULPSA-N 1 1 335.385 2.307 10 5 EEBEMO CCc1n[nH]c(C(=O)NCC[N@@H+]2CC=C(C(C)(C)C)CC2)c1[N+](=O)[O-] ZINC000354917119 163014362 /nfs/dbraw/zinc/01/43/62/163014362.db2.gz TXLKZFKXDZSJLR-UHFFFAOYSA-N 1 1 349.435 2.288 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359035129 164042362 /nfs/dbraw/zinc/04/23/62/164042362.db2.gz AALWTEDDSNLRAE-NSHDSACASA-N 1 1 343.330 2.410 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN1C[C@H]2CCC[N@@H+]2C[C@@H]1C ZINC000113268325 462583250 /nfs/dbraw/zinc/58/32/50/462583250.db2.gz YWLXWTAGVHUTMA-DZGCQCFKSA-N 1 1 332.404 2.010 10 5 EEBEMO CC[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000117306976 462798930 /nfs/dbraw/zinc/79/89/30/462798930.db2.gz NKJMKBOYKBNHFS-AWEZNQCLSA-N 1 1 335.404 2.086 10 5 EEBEMO CC[C@H]1CN(C(=O)c2cccc(C)c2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000117306976 462798931 /nfs/dbraw/zinc/79/89/31/462798931.db2.gz NKJMKBOYKBNHFS-AWEZNQCLSA-N 1 1 335.404 2.086 10 5 EEBEMO CC[N@H+]1CC[C@H]2OCCN(C/C=C\c3ccccc3[N+](=O)[O-])[C@H]2C1 ZINC000552346658 468324923 /nfs/dbraw/zinc/32/49/23/468324923.db2.gz ZCBBFCNGJWCOIG-QGNVGDHZSA-N 1 1 331.416 2.403 10 5 EEBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000122021890 463231702 /nfs/dbraw/zinc/23/17/02/463231702.db2.gz SWASHRGGDPGUAZ-UHFFFAOYSA-N 1 1 328.372 2.423 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123163766 463320618 /nfs/dbraw/zinc/32/06/18/463320618.db2.gz SPZZYOWRJROEQC-PWSUYJOCSA-N 1 1 336.348 2.058 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[N@H+]3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000172804034 464146520 /nfs/dbraw/zinc/14/65/20/464146520.db2.gz OFWYSFUBGSJOBP-OAHLLOKOSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2CCN3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000172804034 464146523 /nfs/dbraw/zinc/14/65/23/464146523.db2.gz OFWYSFUBGSJOBP-OAHLLOKOSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CCN3CCCC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000172804034 464146525 /nfs/dbraw/zinc/14/65/25/464146525.db2.gz OFWYSFUBGSJOBP-OAHLLOKOSA-N 1 1 346.431 2.402 10 5 EEBEMO C[N@H+]1CC[C@@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@@H]1c1ccccc1 ZINC000225600100 464175160 /nfs/dbraw/zinc/17/51/60/464175160.db2.gz VQYMHDXOOQUUNH-DYVFJYSZSA-N 1 1 338.371 2.495 10 5 EEBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cc([N+](=O)[O-])ccc2N)CC1 ZINC000188479575 464291439 /nfs/dbraw/zinc/29/14/39/464291439.db2.gz ZWFWWGGVVAOZQY-UHFFFAOYSA-N 1 1 343.387 2.005 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](C[C@H](O)CC(F)(F)F)CC2)cc1 ZINC000188604804 464322103 /nfs/dbraw/zinc/32/21/03/464322103.db2.gz YBKALKFEDXZHEW-CYBMUJFWSA-N 1 1 333.310 2.030 10 5 EEBEMO CN(C[C@@H]1CCC[N@@H+](C)[C@H]1c1ccnn1C)c1ccc([N+](=O)[O-])cn1 ZINC000285093087 464451752 /nfs/dbraw/zinc/45/17/52/464451752.db2.gz YQUKUEAVFGONFE-SUMWQHHRSA-N 1 1 344.419 2.243 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)c1cc([N+](=O)[O-])ccc1OC ZINC000175007340 464478873 /nfs/dbraw/zinc/47/88/73/464478873.db2.gz RQXNUSHSVLUMER-TZMCWYRMSA-N 1 1 333.388 2.302 10 5 EEBEMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000362289158 465632558 /nfs/dbraw/zinc/63/25/58/465632558.db2.gz NNGBGFKTMJCFBF-JTQLQIEISA-N 1 1 341.209 2.425 10 5 EEBEMO CN(c1ncc([N+](=O)[O-])cc1Br)[C@H]1CC[N@H+](C2CC2)C1 ZINC000362289158 465632563 /nfs/dbraw/zinc/63/25/63/465632563.db2.gz NNGBGFKTMJCFBF-JTQLQIEISA-N 1 1 341.209 2.425 10 5 EEBEMO C[C@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC000597102412 468443398 /nfs/dbraw/zinc/44/33/98/468443398.db2.gz XKUUIUFVCGGPKT-IUCAKERBSA-N 1 1 341.799 2.387 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600227450 468501065 /nfs/dbraw/zinc/50/10/65/468501065.db2.gz CLVNCFIFJITTTM-AWEZNQCLSA-N 1 1 332.404 2.435 10 5 EEBEMO O=C(NC[C@@H]1CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cn1 ZINC000375693824 466864185 /nfs/dbraw/zinc/86/41/85/466864185.db2.gz UIFDQKTWWCUDBR-HNNXBMFYSA-N 1 1 340.383 2.242 10 5 EEBEMO C[N@@H+](Cc1ccccc1)[C@@H]1CCN(C(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000370587120 466932190 /nfs/dbraw/zinc/93/21/90/466932190.db2.gz HCIAFJQOZYGYPE-MRXNPFEDSA-N 1 1 340.383 2.336 10 5 EEBEMO C[C@@H]1C[NH2+]CC[C@H]1NCc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414948088 467456226 /nfs/dbraw/zinc/45/62/26/467456226.db2.gz XLNZMCGWSCGGRW-MLGOLLRUSA-N 1 1 329.404 2.083 10 5 EEBEMO Cc1ccc(S(=O)(=O)N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000408239474 467534115 /nfs/dbraw/zinc/53/41/15/467534115.db2.gz ZCZSRCOOBCRFRT-CHWSQXEVSA-N 1 1 341.433 2.006 10 5 EEBEMO COc1ccc(C[N@@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000449668967 467683817 /nfs/dbraw/zinc/68/38/17/467683817.db2.gz HKSUSSKBWMUXAC-GWCFXTLKSA-N 1 1 334.294 2.349 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@H]([C@H](O)C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000449668967 467683821 /nfs/dbraw/zinc/68/38/21/467683821.db2.gz HKSUSSKBWMUXAC-GWCFXTLKSA-N 1 1 334.294 2.349 10 5 EEBEMO CCOc1ccc(C(=O)NCC[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000458196592 467787295 /nfs/dbraw/zinc/78/72/95/467787295.db2.gz RPFSIMOQUGUDPT-ZDUSSCGKSA-N 1 1 335.404 2.455 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@@H]2C[N@H+](Cc3ccccc3)CC[C@H]2CO)cn1 ZINC000450397925 467842924 /nfs/dbraw/zinc/84/29/24/467842924.db2.gz WQDLJPLIRQYHRG-DOTOQJQBSA-N 1 1 342.399 2.285 10 5 EEBEMO CCc1nc(C[NH2+]C[C@@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000591734709 468512440 /nfs/dbraw/zinc/51/24/40/468512440.db2.gz CTCGXISQSBIIPX-CYBMUJFWSA-N 1 1 337.401 2.143 10 5 EEBEMO CC(C)OC(=O)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000558607549 468692206 /nfs/dbraw/zinc/69/22/06/468692206.db2.gz DXXSNPJGHOQFTL-HNNXBMFYSA-N 1 1 349.387 2.339 10 5 EEBEMO CC(C)OC(=O)[C@@H]1CCC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000558607549 468692208 /nfs/dbraw/zinc/69/22/08/468692208.db2.gz DXXSNPJGHOQFTL-HNNXBMFYSA-N 1 1 349.387 2.339 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[NH+](CCCF)CC1 ZINC000592571164 468731743 /nfs/dbraw/zinc/73/17/43/468731743.db2.gz TUVDNDLVZQIOIZ-UHFFFAOYSA-N 1 1 346.362 2.260 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC[C@@H](C)S(=O)(=O)C1 ZINC000594974392 468736022 /nfs/dbraw/zinc/73/60/22/468736022.db2.gz JLUZFBRFHUWEHE-DGCLKSJQSA-N 1 1 342.417 2.049 10 5 EEBEMO CC[C@@H]1C[N@@H+](CC)CCN1c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601171217 468769954 /nfs/dbraw/zinc/76/99/54/468769954.db2.gz ILWBULGQGHJBQH-SECBINFHSA-N 1 1 335.330 2.268 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CC[NH+](CCc2cnccn2)CC1 ZINC000601253460 468798981 /nfs/dbraw/zinc/79/89/81/468798981.db2.gz OVIPKRDAYVIXEU-UHFFFAOYSA-N 1 1 347.806 2.403 10 5 EEBEMO CCC[N@H+]1CCC[C@H]1CNS(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC000601414758 468864570 /nfs/dbraw/zinc/86/45/70/468864570.db2.gz HFFIHYRUJNTSIN-NSHDSACASA-N 1 1 347.462 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/nfs/dbraw/zinc/10/79/74/469107974.db2.gz KLDKNPZLDMQEIS-UHFFFAOYSA-N 1 1 347.419 2.345 10 5 EEBEMO COc1ccc(C[N@@H+]2CC[C@@H]2CNc2c([N+](=O)[O-])ncn2C)cc1 ZINC000599139308 469133167 /nfs/dbraw/zinc/13/31/67/469133167.db2.gz JOBUIMLNHGZYHP-CYBMUJFWSA-N 1 1 331.376 2.023 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2c([N+](=O)[O-])ncn2C)cc1 ZINC000599139308 469133175 /nfs/dbraw/zinc/13/31/75/469133175.db2.gz JOBUIMLNHGZYHP-CYBMUJFWSA-N 1 1 331.376 2.023 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000599138385 469133702 /nfs/dbraw/zinc/13/37/02/469133702.db2.gz AXFHBOLSWGBWTH-AWEZNQCLSA-N 1 1 328.372 2.685 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000604199390 469463062 /nfs/dbraw/zinc/46/30/62/469463062.db2.gz QRYIRVNZWAFQEA-CQSZACIVSA-N 1 1 332.404 2.019 10 5 EEBEMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@@H+](C)Cc1ccccc1 ZINC000532392628 485543958 /nfs/dbraw/zinc/54/39/58/485543958.db2.gz RJKPSSANFXKGBR-CYBMUJFWSA-N 1 1 328.372 2.240 10 5 EEBEMO CC(C)c1ccc(C(=O)N2C[C@H](C)[N@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000416313296 528066855 /nfs/dbraw/zinc/06/68/55/528066855.db2.gz RJCSDPQNSFVFSL-KBPBESRZSA-N 1 1 349.431 2.245 10 5 EEBEMO CC(C)c1ccc(C(=O)N2C[C@H](C)[N@@H+](CCO)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000416313296 528066858 /nfs/dbraw/zinc/06/68/58/528066858.db2.gz RJCSDPQNSFVFSL-KBPBESRZSA-N 1 1 349.431 2.245 10 5 EEBEMO C[N@H+]1C[C@@H]2CCCN(C(=O)c3c[nH]c4ccc([N+](=O)[O-])cc34)[C@@H]2C1 ZINC000425058829 536488459 /nfs/dbraw/zinc/48/84/59/536488459.db2.gz PSRZKHNOZQIPCC-MEDUHNTESA-N 1 1 328.372 2.242 10 5 EEBEMO COC(=O)C=Cc1ccc(N[C@@H]2CCc3[nH+]c[nH]c3C2)c([N+](=O)[O-])c1 ZINC000772947331 577307175 /nfs/dbraw/zinc/30/71/75/577307175.db2.gz VSSDBYKJRFUHBP-AUXFESMGSA-N 1 1 342.355 2.474 10 5 EEBEMO COC(=O)C=Cc1ccc(N[C@@H]2CCc3[nH]c[nH+]c3C2)c([N+](=O)[O-])c1 ZINC000772947331 577307177 /nfs/dbraw/zinc/30/71/77/577307177.db2.gz VSSDBYKJRFUHBP-AUXFESMGSA-N 1 1 342.355 2.474 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H](O)CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000776578678 577463030 /nfs/dbraw/zinc/46/30/30/577463030.db2.gz IDTQSINMWDXDEJ-GOSISDBHSA-N 1 1 333.432 2.436 10 5 EEBEMO CC[C@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000776598111 577463967 /nfs/dbraw/zinc/46/39/67/577463967.db2.gz RIYKHAWPAJLTCS-DZGCQCFKSA-N 1 1 343.374 2.290 10 5 EEBEMO CC[C@H]1C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000776598111 577463968 /nfs/dbraw/zinc/46/39/68/577463968.db2.gz RIYKHAWPAJLTCS-DZGCQCFKSA-N 1 1 343.374 2.290 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC[N@H+]1C ZINC000925329395 692753477 /nfs/dbraw/zinc/75/34/77/692753477.db2.gz ANVVCLHXQXEKQH-IUODEOHRSA-N 1 1 332.404 2.361 10 5 EEBEMO CCN(C(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)[C@@H]1CC[N@@H+](C)C1 ZINC000898586640 693386246 /nfs/dbraw/zinc/38/62/46/693386246.db2.gz HSKMDCKVMMRURN-CYBMUJFWSA-N 1 1 342.399 2.496 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001266560209 1176844799 /nfs/dbraw/zinc/84/47/99/1176844799.db2.gz DLZZUHCOMSOJDF-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001266560209 1176844808 /nfs/dbraw/zinc/84/48/08/1176844808.db2.gz DLZZUHCOMSOJDF-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001266560209 1176844816 /nfs/dbraw/zinc/84/48/16/1176844816.db2.gz DLZZUHCOMSOJDF-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CCCC[N@H+]1CCCC[C@@H]1CNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl ZINC001626016132 1190904656 /nfs/dbraw/zinc/90/46/56/1190904656.db2.gz QNVLLOGQWLKOFD-SNVBAGLBSA-N 1 1 343.815 2.356 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(c3cc4c(cc3[N+](=O)[O-])CCC(=O)N4)CC[C@H]21 ZINC000866204623 1201464133 /nfs/dbraw/zinc/46/41/33/1201464133.db2.gz FEFKEGWONFIQBO-TZMCWYRMSA-N 1 1 330.388 2.010 10 5 EEBEMO COc1cccc2c1CN(C(=O)[C@@](C)([NH3+])c1cccc([N+](=O)[O-])c1)C2 ZINC000868030083 1201730115 /nfs/dbraw/zinc/73/01/15/1201730115.db2.gz GKVFBPDWIFCSHR-SFHVURJKSA-N 1 1 341.367 2.320 10 5 EEBEMO C[C@H](C(=O)N[C@H]1CCC[N@H+]2CCSC[C@@H]12)c1cccc([N+](=O)[O-])c1 ZINC000928083965 1206337023 /nfs/dbraw/zinc/33/70/23/1206337023.db2.gz BVCMFJYTZXYKMN-RCBQFDQVSA-N 1 1 349.456 2.394 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000928083975 1206337080 /nfs/dbraw/zinc/33/70/80/1206337080.db2.gz BYPDLEMDKKBMPX-GXTWGEPZSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928083975 1206337082 /nfs/dbraw/zinc/33/70/82/1206337082.db2.gz BYPDLEMDKKBMPX-GXTWGEPZSA-N 1 1 335.429 2.213 10 5 EEBEMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928093138 1206340363 /nfs/dbraw/zinc/34/03/63/1206340363.db2.gz LGAQXKLBWHFLCA-KGLIPLIRSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@@H]12)c1ccc([N+](=O)[O-])cc1F ZINC000928093138 1206340365 /nfs/dbraw/zinc/34/03/65/1206340365.db2.gz LGAQXKLBWHFLCA-KGLIPLIRSA-N 1 1 339.392 2.044 10 5 EEBEMO C[N@H+]1CCCN(C(=O)CCc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000929226013 1206457684 /nfs/dbraw/zinc/45/76/84/1206457684.db2.gz WHEZBUZTAQOADT-UHFFFAOYSA-N 1 1 325.796 2.345 10 5 EEBEMO CC(C)(C)OC(=O)N1CC[C@@H]([C@@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1 ZINC000930582892 1206568540 /nfs/dbraw/zinc/56/85/40/1206568540.db2.gz KUBWYHHHQZEPJM-KGLIPLIRSA-N 1 1 327.425 2.375 10 5 EEBEMO C[N@H+]1CCCC[C@H]1CCC(=O)OCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000803854805 1242087659 /nfs/dbraw/zinc/08/76/59/1242087659.db2.gz APTLEGOCZPEOAG-ZDUSSCGKSA-N 1 1 349.387 2.341 10 5 EEBEMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]2CCC[C@H]21 ZINC000859955307 1294724943 /nfs/dbraw/zinc/72/49/43/1294724943.db2.gz UGHSHEUIFWGOCI-HZMVEIRTSA-N 1 1 348.399 2.292 10 5 EEBEMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000861351331 1295360387 /nfs/dbraw/zinc/36/03/87/1295360387.db2.gz IDQTVPFWZDYESC-YOEHRIQHSA-N 1 1 336.388 2.098 10 5 EEBEMO CC[C@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610602 1315219541 /nfs/dbraw/zinc/21/95/41/1315219541.db2.gz OYGIRJKRZGAGGR-MFKMUULPSA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610602 1315219548 /nfs/dbraw/zinc/21/95/48/1315219548.db2.gz OYGIRJKRZGAGGR-MFKMUULPSA-N 1 1 341.795 2.280 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001253632611 1317900121 /nfs/dbraw/zinc/90/01/21/1317900121.db2.gz HPZWRIRASQKXPK-GDBMZVCRSA-N 1 1 346.362 2.248 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@@H]1CC[N@@H+](C)[C@@H]1c1ccc(F)cc1 ZINC001253632611 1317900122 /nfs/dbraw/zinc/90/01/22/1317900122.db2.gz HPZWRIRASQKXPK-GDBMZVCRSA-N 1 1 346.362 2.248 10 5 EEBEMO C[N@H+]1CCN(C(=O)COc2ccc([N+](=O)[O-])cc2)C[C@@H]1C(C)(C)C ZINC001163925218 1321248677 /nfs/dbraw/zinc/24/86/77/1321248677.db2.gz QPIGYZNTLNGVJM-OAHLLOKOSA-N 1 1 335.404 2.162 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ccn(C)c1C)Cc1cccc([N+](=O)[O-])c1 ZINC001317486320 1332262406 /nfs/dbraw/zinc/26/24/06/1332262406.db2.gz RJVYMLMGPCJKBN-UHFFFAOYSA-N 1 1 344.415 2.494 10 5 EEBEMO CCc1nc[nH]c1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001320077936 1332820050 /nfs/dbraw/zinc/82/00/50/1332820050.db2.gz DNQXDCQDLKULQV-UHFFFAOYSA-N 1 1 345.403 2.084 10 5 EEBEMO CCc1nc[nH]c1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001320077936 1332820053 /nfs/dbraw/zinc/82/00/53/1332820053.db2.gz DNQXDCQDLKULQV-UHFFFAOYSA-N 1 1 345.403 2.084 10 5 EEBEMO CC(C)CC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001326449253 1334096323 /nfs/dbraw/zinc/09/63/23/1334096323.db2.gz IJMXTYDVQWZXEJ-IAGOWNOFSA-N 1 1 333.432 2.446 10 5 EEBEMO CC(C)CC[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449253 1334096327 /nfs/dbraw/zinc/09/63/27/1334096327.db2.gz IJMXTYDVQWZXEJ-IAGOWNOFSA-N 1 1 333.432 2.446 10 5 EEBEMO CC(C)CC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449253 1334096329 /nfs/dbraw/zinc/09/63/29/1334096329.db2.gz IJMXTYDVQWZXEJ-IAGOWNOFSA-N 1 1 333.432 2.446 10 5 EEBEMO O=C(N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001337670453 1336725127 /nfs/dbraw/zinc/72/51/27/1336725127.db2.gz WUYMEUDGDPQZDP-CWQOZTLDSA-N 1 1 343.427 2.069 10 5 EEBEMO O=C(N[C@@H]1CC[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C1)[C@@H]1CC1[N+](=O)[O-] ZINC001337670453 1336725129 /nfs/dbraw/zinc/72/51/29/1336725129.db2.gz WUYMEUDGDPQZDP-CWQOZTLDSA-N 1 1 343.427 2.069 10 5 EEBEMO O=C(N[C@@H]1CC[C@@H]2C[N@@H+](Cc3ccccc3)C[C@@H]2C1)[C@@H]1CC1[N+](=O)[O-] ZINC001337670453 1336725131 /nfs/dbraw/zinc/72/51/31/1336725131.db2.gz WUYMEUDGDPQZDP-CWQOZTLDSA-N 1 1 343.427 2.069 10 5 EEBEMO COc1ccc(NC(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)cc1[N+](=O)[O-] ZINC001346468077 1337484913 /nfs/dbraw/zinc/48/49/13/1337484913.db2.gz NXTVFBYURXYYEN-WCFLWFBJSA-N 1 1 334.376 2.065 10 5 EEBEMO C[N@H+](C[C@H]1CCCCO1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474624 1338704979 /nfs/dbraw/zinc/70/49/79/1338704979.db2.gz FIGDGMUALOTQLK-IAGOWNOFSA-N 1 1 347.415 2.369 10 5 EEBEMO C[N@@H+](C[C@H]1CCCCO1)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474624 1338704980 /nfs/dbraw/zinc/70/49/80/1338704980.db2.gz FIGDGMUALOTQLK-IAGOWNOFSA-N 1 1 347.415 2.369 10 5 EEBEMO CC[N@H+](C[C@H](C)OC)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848491633 1338709221 /nfs/dbraw/zinc/70/92/21/1338709221.db2.gz XJBGCOJJCHDMKB-XJKSGUPXSA-N 1 1 335.404 2.225 10 5 EEBEMO CC[N@@H+](C[C@H](C)OC)CN1CC[C@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848491633 1338709226 /nfs/dbraw/zinc/70/92/26/1338709226.db2.gz XJBGCOJJCHDMKB-XJKSGUPXSA-N 1 1 335.404 2.225 10 5 EEBEMO Cc1cnccc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567279853 1342732043 /nfs/dbraw/zinc/73/20/43/1342732043.db2.gz LTOPRETWJURCOW-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO Cc1cnccc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001567279853 1342732044 /nfs/dbraw/zinc/73/20/44/1342732044.db2.gz LTOPRETWJURCOW-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO Cc1noc(C[C@@H]2CCC[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC001620623304 1344576152 /nfs/dbraw/zinc/57/61/52/1344576152.db2.gz RSQXCQPKGUCJNR-BBRMVZONSA-N 1 1 346.387 2.274 10 5 EEBEMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 ZINC001628237011 1352526880 /nfs/dbraw/zinc/52/68/80/1352526880.db2.gz ISDJGLHXGVKYJM-AAEUAGOBSA-N 1 1 341.770 2.045 10 5 EEBEMO O=C(Cc1ccc([N+](=O)[O-])cc1Cl)N1CC[N@H+]2C[C@@H](F)C[C@H]2C1 ZINC001628237011 1352526886 /nfs/dbraw/zinc/52/68/86/1352526886.db2.gz ISDJGLHXGVKYJM-AAEUAGOBSA-N 1 1 341.770 2.045 10 5 EEBEMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC001633310065 1352608818 /nfs/dbraw/zinc/60/88/18/1352608818.db2.gz KTXMPIKIWNECSP-ZDUSSCGKSA-N 1 1 337.807 2.391 10 5 EEBEMO CC[N@H+]1C[C@@H](NC(=O)CCC(=O)c2cccc([N+](=O)[O-])c2)C(C)(C)C1 ZINC001646585669 1352875928 /nfs/dbraw/zinc/87/59/28/1352875928.db2.gz BRALHLWXZHUTLZ-MRXNPFEDSA-N 1 1 347.415 2.404 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCCn2nccc21 ZINC001648139765 1353418150 /nfs/dbraw/zinc/41/81/50/1353418150.db2.gz PDNSTPPOCMVSDI-GFCCVEGCSA-N 1 1 329.360 2.163 10 5 EEBEMO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1C[C@H](N2CCCC2)C[C@@H]1C(C)C ZINC001655069338 1354164610 /nfs/dbraw/zinc/16/46/10/1354164610.db2.gz KYOQWOGYGXPDQW-HZPDHXFCSA-N 1 1 335.452 2.294 10 5 EEBEMO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1C[C@H](N2CCCC2)C[C@@H]1C(C)C ZINC001655069338 1354164612 /nfs/dbraw/zinc/16/46/12/1354164612.db2.gz KYOQWOGYGXPDQW-HZPDHXFCSA-N 1 1 335.452 2.294 10 5 EEBEMO O=[N+]([O-])c1ncccc1C[NH2+][C@H](c1ccncc1)C1(CO)CCC1 ZINC001655178691 1354166816 /nfs/dbraw/zinc/16/68/16/1354166816.db2.gz STEGWCNNYJOMDQ-OAHLLOKOSA-N 1 1 328.372 2.378 10 5 EEBEMO CN(C(=O)C[N@@H+](C)C[C@]12CCC[C@H]1OCC2)c1ccc([N+](=O)[O-])cc1 ZINC001656557823 1354247805 /nfs/dbraw/zinc/24/78/05/1354247805.db2.gz KFJPULKLANLUHF-SJLPKXTDSA-N 1 1 347.415 2.449 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1n[nH]cc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001660586449 1354494377 /nfs/dbraw/zinc/49/43/77/1354494377.db2.gz NSBMYIPVPLOWEE-UHFFFAOYSA-N 1 1 349.366 2.099 10 5 EEBEMO CCCn1nccc1NC(=O)C[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC001175890655 798264937 /nfs/dbraw/zinc/26/49/37/798264937.db2.gz JGTUWDLGOUBPJF-GFCCVEGCSA-N 1 1 331.376 2.491 10 5 EEBEMO CCc1[nH+]ccn1CCNC(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC001177514719 798997808 /nfs/dbraw/zinc/99/78/08/798997808.db2.gz ROZIAJGNYHAKEE-UHFFFAOYSA-N 1 1 338.314 2.262 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1c[nH]nc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001566559586 1125733553 /nfs/dbraw/zinc/73/35/53/1125733553.db2.gz LRKSQEVBRAZCTE-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CC(C)Cc1ccc(C[NH2+]CCN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001493546413 1108294249 /nfs/dbraw/zinc/29/42/49/1108294249.db2.gz VZVSWZPZNKZWTB-IAGOWNOFSA-N 1 1 333.432 2.098 10 5 EEBEMO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1CC[C@H](c2cc(=O)[nH]c(=O)[nH]2)C1 ZINC001473602455 1110577635 /nfs/dbraw/zinc/57/76/35/1110577635.db2.gz RCCQHRXOFJHNCL-QWRGUYRKSA-N 1 1 330.344 2.347 10 5 EEBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000451262637 243055773 /nfs/dbraw/zinc/05/57/73/243055773.db2.gz XUSLTKWLXGPOGV-JSGCOSHPSA-N 1 1 332.360 2.238 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1CC ZINC000116772185 152061675 /nfs/dbraw/zinc/06/16/75/152061675.db2.gz DCNJMPPRINZEAT-INIZCTEOSA-N 1 1 349.431 2.476 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@@H]1CC ZINC000116772185 152061679 /nfs/dbraw/zinc/06/16/79/152061679.db2.gz DCNJMPPRINZEAT-INIZCTEOSA-N 1 1 349.431 2.476 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@H](Cn3ccnn3)C2)ccc1[N+](=O)[O-] ZINC000352766875 162278806 /nfs/dbraw/zinc/27/88/06/162278806.db2.gz DLASDRDVFPYSCV-AWEZNQCLSA-N 1 1 331.376 2.107 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000369180004 166206231 /nfs/dbraw/zinc/20/62/31/166206231.db2.gz HOAKCQIQOHYIFB-INIZCTEOSA-N 1 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ZINC000117762293 462813165 /nfs/dbraw/zinc/81/31/65/462813165.db2.gz XVLIUKJJLNQODP-NSHDSACASA-N 1 1 325.796 2.249 10 5 EEBEMO CC[C@@H](CO)[NH+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000092927193 462992132 /nfs/dbraw/zinc/99/21/32/462992132.db2.gz QMKPSHWCQPUJMS-HNNXBMFYSA-N 1 1 349.431 2.049 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc([N+](=O)[O-])ccc2OC)[C@H](C)C1 ZINC000122633271 463281383 /nfs/dbraw/zinc/28/13/83/463281383.db2.gz OHFNWLPDXQUATK-DOMZBBRYSA-N 1 1 335.404 2.406 10 5 EEBEMO COCC[N@@H+](C)CCCNC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000185055569 463743125 /nfs/dbraw/zinc/74/31/25/463743125.db2.gz CTSZRFIKBMLEBO-BUHFOSPRSA-N 1 1 335.404 2.083 10 5 EEBEMO C[C@H]1C[C@H]([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CCN1C ZINC000283173496 463791956 /nfs/dbraw/zinc/79/19/56/463791956.db2.gz DSESRZRTLQSZDI-UONOGXRCSA-N 1 1 334.420 2.338 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)c2c(c1)COCO2 ZINC000172045526 463977139 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2.483 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cccc([N+](=O)[O-])c2OC)[C@@H](C)C1 ZINC000331057540 465914877 /nfs/dbraw/zinc/91/48/77/465914877.db2.gz LZKGPNGPAQZJDO-GXTWGEPZSA-N 1 1 335.404 2.406 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1n[nH]cc1[N+](=O)[O-] ZINC000362705777 465957709 /nfs/dbraw/zinc/95/77/09/465957709.db2.gz ZKSLJGNXOXVXBS-CYBMUJFWSA-N 1 1 343.387 2.055 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCO[C@@H](C2CC2)C1 ZINC000372255370 466251645 /nfs/dbraw/zinc/25/16/45/466251645.db2.gz QAZJEUUUBKJNQA-MRXNPFEDSA-N 1 1 349.387 2.043 10 5 EEBEMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594094787 468483410 /nfs/dbraw/zinc/48/34/10/468483410.db2.gz OJDSPLKOMUOODA-UPJWGTAASA-N 1 1 336.392 2.214 10 5 EEBEMO C[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594094787 468483415 /nfs/dbraw/zinc/48/34/15/468483415.db2.gz OJDSPLKOMUOODA-UPJWGTAASA-N 1 1 336.392 2.214 10 5 EEBEMO CN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@H]1CC[N@H+](C2CC2)C1 ZINC000347018721 466325788 /nfs/dbraw/zinc/32/57/88/466325788.db2.gz WMNJPFJDUQHZKI-INIZCTEOSA-N 1 1 342.399 2.245 10 5 EEBEMO COC(=O)[C@]1(OC)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000600191231 468490807 /nfs/dbraw/zinc/49/08/07/468490807.db2.gz KOHVQXSSYGSHSN-GQPJMJRUSA-N 1 1 334.372 2.262 10 5 EEBEMO CC[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000373804164 466924512 /nfs/dbraw/zinc/92/45/12/466924512.db2.gz GUHMYVVFDUMHLR-WMLDXEAASA-N 1 1 336.388 2.244 10 5 EEBEMO CC[C@H]1C[N@@H+](CCOc2ccccc2[N+](=O)[O-])C[C@@]2(CCOC2)O1 ZINC000373804164 466924516 /nfs/dbraw/zinc/92/45/16/466924516.db2.gz GUHMYVVFDUMHLR-WMLDXEAASA-N 1 1 336.388 2.244 10 5 EEBEMO CN(C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000412196725 467037080 /nfs/dbraw/zinc/03/70/80/467037080.db2.gz URFMNXKJPAVSIO-YESZJQIVSA-N 1 1 329.400 2.393 10 5 EEBEMO COC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2ccccc2[N+](=O)[O-])CC1 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AXCLKJLRFMUAND-WYTCUBLDSA-N 1 1 331.416 2.403 10 5 EEBEMO C[N@@H+](CCCCNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1CC1 ZINC000457167435 467770030 /nfs/dbraw/zinc/77/00/30/467770030.db2.gz MBBBBDBEAPLWBL-UHFFFAOYSA-N 1 1 341.358 2.406 10 5 EEBEMO CC(C)(C)OC(=O)C[C@H]1CCC[N@@H+](CCn2ccc([N+](=O)[O-])n2)C1 ZINC000532378953 468115396 /nfs/dbraw/zinc/11/53/96/468115396.db2.gz RWAXHQXVXRLTIP-CYBMUJFWSA-N 1 1 338.408 2.235 10 5 EEBEMO COc1cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)ccc1[N+](=O)[O-] ZINC000600474497 468568791 /nfs/dbraw/zinc/56/87/91/468568791.db2.gz XGUQTEQVENUZGH-CQSZACIVSA-N 1 1 333.388 2.350 10 5 EEBEMO COc1ccnc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1F ZINC000594733212 468667268 /nfs/dbraw/zinc/66/72/68/468667268.db2.gz RUMHIXGMUKSYAO-UHFFFAOYSA-N 1 1 348.334 2.256 10 5 EEBEMO CCCN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CC[N@@H+](C)C1 ZINC000592829702 468798589 /nfs/dbraw/zinc/79/85/89/468798589.db2.gz VTBLNCPINSMPTL-LLVKDONJSA-N 1 1 341.358 2.358 10 5 EEBEMO 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WTBRUAAPYLOXMK-DZGCQCFKSA-N 1 1 344.415 2.017 10 5 EEBEMO C[C@@H]1CN(C(=O)c2cc(O)cc([N+](=O)[O-])c2)CCN1c1cc[nH+]cc1 ZINC000881635031 1201730883 /nfs/dbraw/zinc/73/08/83/1201730883.db2.gz KAKUKMOOHMIHDK-GFCCVEGCSA-N 1 1 342.355 2.046 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCN([C@H]2CCC[N@H+](C)C2)CC1 ZINC000881985401 1201798179 /nfs/dbraw/zinc/79/81/79/1201798179.db2.gz MFHCKYPYEHMACQ-HNNXBMFYSA-N 1 1 346.431 2.014 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3F)C[C@]2(C)C1 ZINC000887928955 1204510224 /nfs/dbraw/zinc/51/02/24/1204510224.db2.gz BUMAWNPTNUUURZ-XIKOKIGWSA-N 1 1 349.406 2.422 10 5 EEBEMO CC(C)(C)OC(=O)N1CC[C@]2(C1)CCCC[N@@H+](CC[N+](=O)[O-])C2 ZINC000931754096 1207456725 /nfs/dbraw/zinc/45/67/25/1207456725.db2.gz VILXFNPAHYOOFV-MRXNPFEDSA-N 1 1 327.425 2.376 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC000933740235 1207830885 /nfs/dbraw/zinc/83/08/85/1207830885.db2.gz LUVVGPNDYOQMCB-KDOFPFPSSA-N 1 1 346.431 2.115 10 5 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ZINC000855166581 1293097112 /nfs/dbraw/zinc/09/71/12/1293097112.db2.gz MBYORWUNPAPGHK-NSHDSACASA-N 1 1 339.367 2.102 10 5 EEBEMO O=C([C@@H]1CC1[N+](=O)[O-])N1CCC2(C1)CC[NH+](CCCCCF)CC2 ZINC001277490649 1303651161 /nfs/dbraw/zinc/65/11/61/1303651161.db2.gz VFCVLRZGUQSFIY-HUUCEWRRSA-N 1 1 341.427 2.106 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC001149097483 1310505555 /nfs/dbraw/zinc/50/55/55/1310505555.db2.gz FGRGHOBYDXIANU-CYBMUJFWSA-N 1 1 332.404 2.029 10 5 EEBEMO Cc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001152053156 1316626320 /nfs/dbraw/zinc/62/63/20/1316626320.db2.gz NWLNDKDFIJWNJF-CYBMUJFWSA-N 1 1 335.408 2.153 10 5 EEBEMO Cc1cc(C(=O)OC[C@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC001263620399 1322495737 /nfs/dbraw/zinc/49/57/37/1322495737.db2.gz SYVPHFRFVWGPLU-OAHLLOKOSA-N 1 1 334.372 2.313 10 5 EEBEMO CCc1ocnc1C(=O)NCC[N@@H+](CC)Cc1ccccc1[N+](=O)[O-] ZINC001317477441 1331625909 /nfs/dbraw/zinc/62/59/09/1331625909.db2.gz 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Cc1cc(F)ccc1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001318631841 1332570671 /nfs/dbraw/zinc/57/06/71/1332570671.db2.gz GVZVYQRXAQYEMQ-HZPDHXFCSA-N 1 1 349.406 2.318 10 5 EEBEMO CCC1([NH2+]CCCCCF)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001327448492 1334294480 /nfs/dbraw/zinc/29/44/80/1334294480.db2.gz BUGNNYUPQNHHBT-ZIAGYGMSSA-N 1 1 329.416 2.152 10 5 EEBEMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@H]1CC[N@H+]2CCCC[C@H]12 ZINC001332868438 1335921830 /nfs/dbraw/zinc/92/18/30/1335921830.db2.gz XNGDKZNHQHDMBM-GOEBONIOSA-N 1 1 335.379 2.410 10 5 EEBEMO Cc1cc(NC(=O)N2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc(C)[nH+]1 ZINC001339343479 1336991068 /nfs/dbraw/zinc/99/10/68/1336991068.db2.gz IEKOVJWKDHAFMI-UHFFFAOYSA-N 1 1 344.375 2.094 10 5 EEBEMO Cc1cc(OCC(=O)N2CC[N@H+](C)[C@H](C(C)(C)C)C2)ccc1[N+](=O)[O-] ZINC001557279778 1342444879 /nfs/dbraw/zinc/44/48/79/1342444879.db2.gz FFQSJZPQVNWUBA-INIZCTEOSA-N 1 1 349.431 2.471 10 5 EEBEMO C[C@@H](O)[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718142 1352724322 /nfs/dbraw/zinc/72/43/22/1352724322.db2.gz NINWCXYFRXKHRB-DGCLKSJQSA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@@H](O)[C@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718142 1352724327 /nfs/dbraw/zinc/72/43/27/1352724327.db2.gz NINWCXYFRXKHRB-DGCLKSJQSA-N 1 1 332.360 2.380 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CNC(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001648347397 1353425950 /nfs/dbraw/zinc/42/59/50/1353425950.db2.gz QWXPRLWYKVGFKA-CQSZACIVSA-N 1 1 343.387 2.199 10 5 EEBEMO CC(C)N1CCC[C@@H]1C(=O)Nc1n[nH]c(-c2cccc([N+](=O)[O-])c2)n1 ZINC001648531194 1353432910 /nfs/dbraw/zinc/43/29/10/1353432910.db2.gz QENQCSSNABWBHV-CYBMUJFWSA-N 1 1 344.375 2.191 10 5 EEBEMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001651085681 1354039498 /nfs/dbraw/zinc/03/94/98/1354039498.db2.gz OVDFTVNMRXVOEP-LBPRGKRZSA-N 1 1 342.399 2.314 10 5 EEBEMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC001651085681 1354039500 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349.431 2.078 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCn2cc[nH+]c21 ZINC001175472544 798116219 /nfs/dbraw/zinc/11/62/19/798116219.db2.gz MXXCPQZJDQXUKQ-JTQLQIEISA-N 1 1 326.316 2.423 10 5 EEBEMO C[N@H+]1C[C@@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C1 ZINC001178709999 799599735 /nfs/dbraw/zinc/59/97/35/799599735.db2.gz UNLHKOREINFDSF-CYBMUJFWSA-N 1 1 325.796 2.247 10 5 EEBEMO CC[N@H+]1CC[C@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000712334251 803200140 /nfs/dbraw/zinc/20/01/40/803200140.db2.gz HZECBKWFMZTZJH-JTQLQIEISA-N 1 1 342.193 2.181 10 5 EEBEMO C[NH+](C)Cc1cc(C(=O)Nc2nccc3cc([N+](=O)[O-])ccc32)no1 ZINC001130758682 812007066 /nfs/dbraw/zinc/00/70/66/812007066.db2.gz JYUXZOVEOXHAMZ-UHFFFAOYSA-N 1 1 341.327 2.445 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCC2)n1 ZINC001461625354 1110346210 /nfs/dbraw/zinc/34/62/10/1110346210.db2.gz BKNAYCMODPXLOP-CQSZACIVSA-N 1 1 332.404 2.435 10 5 EEBEMO O=C(NC1(C2CC[NH+](CCCCCF)CC2)CC1)[C@@H]1CC1[N+](=O)[O-] 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O=C(N[C@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(F)ccc1[N+](=O)[O-] ZINC000928101051 1206343468 /nfs/dbraw/zinc/34/34/68/1206343468.db2.gz WFEFOPNLVKDALO-GXTWGEPZSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(F)ccc1[N+](=O)[O-] ZINC000928101051 1206343469 /nfs/dbraw/zinc/34/34/69/1206343469.db2.gz WFEFOPNLVKDALO-GXTWGEPZSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(/C=C\c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928104879 1206345030 /nfs/dbraw/zinc/34/50/30/1206345030.db2.gz XKNDATOBSCDZGY-BJYXUANLSA-N 1 1 347.440 2.304 10 5 EEBEMO CC(C)[N@@H+]1CCO[C@@H](C(N)=NO[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653255 1210714229 /nfs/dbraw/zinc/71/42/29/1210714229.db2.gz WBWILYCKHQHGHZ-SWLSCSKDSA-N 1 1 336.392 2.263 10 5 EEBEMO CC(C)[N@H+]1CCO[C@@H](C(N)=NO[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653255 1210714231 /nfs/dbraw/zinc/71/42/31/1210714231.db2.gz WBWILYCKHQHGHZ-SWLSCSKDSA-N 1 1 336.392 2.263 10 5 EEBEMO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)C[C@]1(O)CCC[N@@H+](C)C1 ZINC000900347911 1234248120 /nfs/dbraw/zinc/24/81/20/1234248120.db2.gz GYLMRPRBSSLAIB-GOSISDBHSA-N 1 1 349.431 2.179 10 5 EEBEMO O=C(N[C@@H]1[C@H]2C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C[C@H]21)C1(CF)CCC1 ZINC001491326381 1258954430 /nfs/dbraw/zinc/95/44/30/1258954430.db2.gz ODZUWUDIXQGIJL-ZSHCYNCHSA-N 1 1 347.390 2.281 10 5 EEBEMO C[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@H]1C[C@@H](C(N)=O)C1 ZINC000863322433 1296220432 /nfs/dbraw/zinc/22/04/32/1296220432.db2.gz VHWCHBPLSKPEET-WAAGHKOSSA-N 1 1 336.373 2.025 10 5 EEBEMO C[N@@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=S)[C@H]1C[C@@H](C(N)=O)C1 ZINC000863322433 1296220447 /nfs/dbraw/zinc/22/04/47/1296220447.db2.gz VHWCHBPLSKPEET-WAAGHKOSSA-N 1 1 336.373 2.025 10 5 EEBEMO Cn1ccc(C(=O)NCC2([NH2+]Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC001277037122 1300977440 /nfs/dbraw/zinc/97/74/40/1300977440.db2.gz STZPMUSBFSTLMW-UHFFFAOYSA-N 1 1 334.401 2.047 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1c[nH]nc1C)Cc1ccccc1[N+](=O)[O-] ZINC001265126140 1322934469 /nfs/dbraw/zinc/93/44/69/1322934469.db2.gz LMHABUMVAKAOSD-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ocnc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317475609 1331613097 /nfs/dbraw/zinc/61/30/97/1331613097.db2.gz NTSRLBPURDCHLW-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1nc(C)c[nH]1)Cc1cccc([N+](=O)[O-])c1 ZINC001317544131 1332291248 /nfs/dbraw/zinc/29/12/48/1332291248.db2.gz IZNVXFUETUMVLM-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO O=C(/C=C\c1ccc[nH]1)NCC1C[NH+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC001318117937 1332473958 /nfs/dbraw/zinc/47/39/58/1332473958.db2.gz NIRKBMULMRSRFT-SREVYHEPSA-N 1 1 340.383 2.184 10 5 EEBEMO CCOc1cc(NC(=O)N[C@@H]2CC[C@@H]3C[N@@H+](C)C[C@@H]23)ccc1[N+](=O)[O-] ZINC001345351153 1337439778 /nfs/dbraw/zinc/43/97/78/1337439778.db2.gz UCEQVKUOWYICPF-MRVWCRGKSA-N 1 1 348.403 2.455 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)Cn3ccc4cc([N+](=O)[O-])ccc43)[C@@H]2C1 ZINC001349693345 1337639664 /nfs/dbraw/zinc/63/96/64/1337639664.db2.gz KNMQXWXPPGUISO-NUEKZKHPSA-N 1 1 342.399 2.006 10 5 EEBEMO O=[N+]([O-])c1cc(C[NH+]2CCC(Cc3nn[nH]n3)CC2)ccc1Cl ZINC001620549323 1352360410 /nfs/dbraw/zinc/36/04/10/1352360410.db2.gz YNFZVTGPSLOLQC-UHFFFAOYSA-N 1 1 336.783 2.216 10 5 EEBEMO C[C@@H](O)[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718144 1352724151 /nfs/dbraw/zinc/72/41/51/1352724151.db2.gz NINWCXYFRXKHRB-YPMHNXCESA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@@H](O)[C@@H]1CCCC[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC001641718144 1352724154 /nfs/dbraw/zinc/72/41/54/1352724154.db2.gz NINWCXYFRXKHRB-YPMHNXCESA-N 1 1 332.360 2.380 10 5 EEBEMO C[C@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001641928774 1352727284 /nfs/dbraw/zinc/72/72/84/1352727284.db2.gz YSTQQFZOABZSTR-FPAYPSAMSA-N 1 1 343.427 2.022 10 5 EEBEMO COC(=O)C[C@@H]1C[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC001644540221 1352763328 /nfs/dbraw/zinc/76/33/28/1352763328.db2.gz ZZINHHKTZHKEEZ-JHJVBQTASA-N 1 1 349.387 2.053 10 5 EEBEMO COC(=O)C[C@@H]1C[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@H]1C ZINC001644540221 1352763331 /nfs/dbraw/zinc/76/33/31/1352763331.db2.gz ZZINHHKTZHKEEZ-JHJVBQTASA-N 1 1 349.387 2.053 10 5 EEBEMO CCc1[nH+]ccn1CCNc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1 ZINC001651416186 1354052515 /nfs/dbraw/zinc/05/25/15/1354052515.db2.gz XVVWTHHRADMVAL-UHFFFAOYSA-N 1 1 343.387 2.358 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc2c([nH]1)CCC2)Cc1ccc([N+](=O)[O-])cc1 ZINC001663312614 1354947166 /nfs/dbraw/zinc/94/71/66/1354947166.db2.gz CURFTTBCEPFGKG-UHFFFAOYSA-N 1 1 342.399 2.273 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001663381851 1354955292 /nfs/dbraw/zinc/95/52/92/1354955292.db2.gz SFIAJONZVWXVGD-HUUCEWRRSA-N 1 1 339.823 2.252 10 5 EEBEMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001663381851 1354955297 /nfs/dbraw/zinc/95/52/97/1354955297.db2.gz SFIAJONZVWXVGD-HUUCEWRRSA-N 1 1 339.823 2.252 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1C ZINC001663381851 1354955298 /nfs/dbraw/zinc/95/52/98/1354955298.db2.gz SFIAJONZVWXVGD-HUUCEWRRSA-N 1 1 339.823 2.252 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc(F)c(Cl)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001667566061 1355761659 /nfs/dbraw/zinc/76/16/59/1355761659.db2.gz MNBOBLYLHFAKMZ-BXUZGUMPSA-N 1 1 343.786 2.035 10 5 EEBEMO CN(CC(C)(C)C[NH2+]CC1CCCCC1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001674832454 1356901753 /nfs/dbraw/zinc/90/17/53/1356901753.db2.gz VAGNKPRBKGSMJD-HUUCEWRRSA-N 1 1 325.453 2.306 10 5 EEBEMO C[NH+]1C[C@]2(C)CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000823755515 798762274 /nfs/dbraw/zinc/76/22/74/798762274.db2.gz PWSFTVLXPKDDRE-QZTJIDSGSA-N 1 1 346.431 2.197 10 5 EEBEMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N1CC[C@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000791255992 809138002 /nfs/dbraw/zinc/13/80/02/809138002.db2.gz BJSCSVRAFXKBDG-KBKYZLAFSA-N 1 1 333.363 2.253 10 5 EEBEMO Nc1cc([N+](=O)[O-])ccc1C(=O)N1CC[C@@H]2[C@H](CCC[N@H+]2C2CC2)C1 ZINC001446377497 1100756771 /nfs/dbraw/zinc/75/67/71/1100756771.db2.gz QHKIOOWMTMCQRH-SJKOYZFVSA-N 1 1 344.415 2.266 10 5 EEBEMO CC(C)(C)c1ccc(C[NH2+]C/C=C\CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001497585754 1102702815 /nfs/dbraw/zinc/70/28/15/1102702815.db2.gz YBFYGIGTLIHUMV-OSNZYPHYSA-N 1 1 345.443 2.411 10 5 EEBEMO C[C@@H](O)C[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001459527251 1110209385 /nfs/dbraw/zinc/20/93/85/1110209385.db2.gz XDMWWFKOFQEEOH-MRVPVSSYSA-N 1 1 326.740 2.111 10 5 EEBEMO C[C@@H](O)C[N@@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001459527251 1110209386 /nfs/dbraw/zinc/20/93/86/1110209386.db2.gz XDMWWFKOFQEEOH-MRVPVSSYSA-N 1 1 326.740 2.111 10 5 EEBEMO CC(C)=CC(=O)NCC1(C)CC[NH+](Cc2c([N+](=O)[O-])ncn2C)CC1 ZINC001500411715 1112812578 /nfs/dbraw/zinc/81/25/78/1112812578.db2.gz XEJPCPPYXWSVKK-UHFFFAOYSA-N 1 1 349.435 2.013 10 5 EEBEMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001542464441 1124113714 /nfs/dbraw/zinc/11/37/14/1124113714.db2.gz DPEHHLFBNVJVEJ-CYBMUJFWSA-N 1 1 337.807 2.487 10 5 EEBEMO C[C@@H]1[C@@H](CO)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000425967438 241189490 /nfs/dbraw/zinc/18/94/90/241189490.db2.gz OHSMZBSOGWFCRG-TZMCWYRMSA-N 1 1 330.388 2.198 10 5 EEBEMO CC[C@H]1[C@H](CO)CC[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000451258910 243053348 /nfs/dbraw/zinc/05/33/48/243053348.db2.gz XAWUCTIPOXGXGX-JSGCOSHPSA-N 1 1 332.360 2.238 10 5 EEBEMO COc1cc(C[N@@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451888688 243295506 /nfs/dbraw/zinc/29/55/06/243295506.db2.gz LMBOBLAIRBLAGR-ZWNOBZJWSA-N 1 1 334.294 2.349 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@@H]([C@@H](O)C(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000451888688 243295514 /nfs/dbraw/zinc/29/55/14/243295514.db2.gz LMBOBLAIRBLAGR-ZWNOBZJWSA-N 1 1 334.294 2.349 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451908258 243308495 /nfs/dbraw/zinc/30/84/95/243308495.db2.gz WCTPCQSQJCFHKT-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451908258 243308501 /nfs/dbraw/zinc/30/85/01/243308501.db2.gz WCTPCQSQJCFHKT-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC000246982770 243345990 /nfs/dbraw/zinc/34/59/90/243345990.db2.gz DZJNXNLGSQQXCB-DOMZBBRYSA-N 1 1 344.415 2.478 10 5 EEBEMO [NH3+][C@H]1CCCCCN1S(=O)(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000080988624 217347345 /nfs/dbraw/zinc/34/73/45/217347345.db2.gz WNQZPPVWOJLEPE-GFCCVEGCSA-N 1 1 333.797 2.098 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(CN3CCC[N@H+](C4CC4)CC3)o2)cc1 ZINC000195338591 160211412 /nfs/dbraw/zinc/21/14/12/160211412.db2.gz HBHSHCZLXBHJPO-UHFFFAOYSA-N 1 1 343.387 2.315 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@@H](C)C1 ZINC000277357245 269150097 /nfs/dbraw/zinc/15/00/97/269150097.db2.gz CAAHFGHJFQHRPT-WFASDCNBSA-N 1 1 335.404 2.406 10 5 EEBEMO COCC[N@H+]1CCCN(c2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000278155813 269211646 /nfs/dbraw/zinc/21/16/46/269211646.db2.gz BRTVCKFYIZKJEN-UHFFFAOYSA-N 1 1 348.325 2.167 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])c(C)c2)[C@@H](C)C1 ZINC000281656689 269438311 /nfs/dbraw/zinc/43/83/11/269438311.db2.gz NEXLSJFBWOMCLJ-GOEBONIOSA-N 1 1 349.431 2.471 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CC[C@@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000338743985 274004318 /nfs/dbraw/zinc/00/43/18/274004318.db2.gz JWBANOIUYFKTGE-KRWDZBQOSA-N 1 1 333.388 2.304 10 5 EEBEMO CC[NH+]1CCN(C[C@H](C)CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000278422210 274353892 /nfs/dbraw/zinc/35/38/92/274353892.db2.gz IPXDFRBISQAQSU-CYBMUJFWSA-N 1 1 346.435 2.157 10 5 EEBEMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000248897139 274395684 /nfs/dbraw/zinc/39/56/84/274395684.db2.gz BTIYPTGXWKJTNV-GNXNZQSNSA-N 1 1 332.360 2.379 10 5 EEBEMO C[C@@H]1C[C@@H](O)C[C@H](C)[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000248897139 274395685 /nfs/dbraw/zinc/39/56/85/274395685.db2.gz BTIYPTGXWKJTNV-GNXNZQSNSA-N 1 1 332.360 2.379 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[C@@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135091 275382049 /nfs/dbraw/zinc/38/20/49/275382049.db2.gz LRKWGWCLFMRBQS-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[C@@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135091 275382051 /nfs/dbraw/zinc/38/20/51/275382051.db2.gz LRKWGWCLFMRBQS-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135091 275382054 /nfs/dbraw/zinc/38/20/54/275382054.db2.gz LRKWGWCLFMRBQS-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2CC[C@@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135091 275382056 /nfs/dbraw/zinc/38/20/56/275382056.db2.gz LRKWGWCLFMRBQS-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO CCO[C@H]1C[C@H]([N@@H+](C)CCn2cc([N+](=O)[O-])ccc2=O)C12CCCC2 ZINC000090554586 276364302 /nfs/dbraw/zinc/36/43/02/276364302.db2.gz SMEUUTOAMLOLON-HOTGVXAUSA-N 1 1 349.431 2.426 10 5 EEBEMO O=[N+]([O-])c1cccnc1N1CC[NH+](C[C@H](O)CC2CCCC2)CC1 ZINC000298015271 294397206 /nfs/dbraw/zinc/39/72/06/294397206.db2.gz CVSQUWTYXMQVFC-OAHLLOKOSA-N 1 1 334.420 2.053 10 5 EEBEMO Cc1ccc([C@H](C)NC(=O)N2CC[NH2+]C[C@@](C)(F)C2)cc1[N+](=O)[O-] ZINC000417848754 313617650 /nfs/dbraw/zinc/61/76/50/313617650.db2.gz KTHSUYNGFFLFOK-BLLLJJGKSA-N 1 1 338.383 2.307 10 5 EEBEMO CC(C)[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H](O)CO ZINC000421402199 314097113 /nfs/dbraw/zinc/09/71/13/314097113.db2.gz DGJLAMXOWWUZOX-HNNXBMFYSA-N 1 1 334.372 2.418 10 5 EEBEMO Cc1c(NC(=O)CCN2C[C@H]3CCC[N@@H+]3C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000113268995 462583633 /nfs/dbraw/zinc/58/36/33/462583633.db2.gz DCDOVKBVGMZCTH-DZGCQCFKSA-N 1 1 346.431 2.400 10 5 EEBEMO C[N@H+]1CCO[C@@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C[C@@H]21 ZINC000153139844 462619645 /nfs/dbraw/zinc/61/96/45/462619645.db2.gz WLYKPYDNDZNFJT-QWHCGFSZSA-N 1 1 331.294 2.133 10 5 EEBEMO C[C@@H]1C[NH+](C)C[C@@H](C)N1C(=O)c1cc([N+](=O)[O-])ccc1OC(F)F ZINC000097049456 463311461 /nfs/dbraw/zinc/31/14/61/463311461.db2.gz VSXCELOFDHRKEN-NXEZZACHSA-N 1 1 343.330 2.361 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[N@@H+]2C[C@H]3CCC[C@@H](C2)C3O)cccc1[N+](=O)[O-] ZINC000172043182 463975729 /nfs/dbraw/zinc/97/57/29/463975729.db2.gz VARNRVIWASNIHH-NRMMMPIQSA-N 1 1 347.415 2.323 10 5 EEBEMO COc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)cc([N+](=O)[O-])c1C ZINC000188041623 464185990 /nfs/dbraw/zinc/18/59/90/464185990.db2.gz ZEKOTXKTSXXAFB-RISCZKNCSA-N 1 1 335.404 2.467 10 5 EEBEMO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@@H](O)CC(F)(F)F)CC2)c1 ZINC000188737857 464356610 /nfs/dbraw/zinc/35/66/10/464356610.db2.gz ARHFWWBNGHKTQP-ZDUSSCGKSA-N 1 1 333.310 2.030 10 5 EEBEMO Cc1cc(S(=O)(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000246257729 464564279 /nfs/dbraw/zinc/56/42/79/464564279.db2.gz TXMOEMWMLXYFCX-QWHCGFSZSA-N 1 1 341.433 2.006 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC000294953875 464660995 /nfs/dbraw/zinc/66/09/95/464660995.db2.gz OEIHJODCLMMZAZ-JTQLQIEISA-N 1 1 331.294 2.438 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000247404904 464676361 /nfs/dbraw/zinc/67/63/61/464676361.db2.gz PRBYXZUVLLEAPA-BBRMVZONSA-N 1 1 332.404 2.015 10 5 EEBEMO CC(C)[N@@H+]1C[C@H](NC(=O)N(C)Cc2ccccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000176836086 464863063 /nfs/dbraw/zinc/86/30/63/464863063.db2.gz QKQFMPVWAAWUKJ-ZFWWWQNUSA-N 1 1 334.420 2.465 10 5 EEBEMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNc2ncc([N+](=O)[O-])cc2C(N)=O)C1 ZINC000298720595 465482735 /nfs/dbraw/zinc/48/27/35/465482735.db2.gz 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COC[C@@H]1CCC[N@@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000452076462 467314245 /nfs/dbraw/zinc/31/42/45/467314245.db2.gz BUZBYGJEEGVEHL-CQSZACIVSA-N 1 1 335.404 2.306 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2C[C@H]3CCC[C@@H](C2)N3)cccc1[N+](=O)[O-] ZINC000420346003 467371328 /nfs/dbraw/zinc/37/13/28/467371328.db2.gz CAGAGVOBQWUYCS-OKILXGFUSA-N 1 1 332.404 2.058 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H]3CCC[C@@H](C2)N3)cccc1[N+](=O)[O-] ZINC000420346003 467371330 /nfs/dbraw/zinc/37/13/30/467371330.db2.gz CAGAGVOBQWUYCS-OKILXGFUSA-N 1 1 332.404 2.058 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](C(=O)N2CCCC2)C1 ZINC000430244800 467410754 /nfs/dbraw/zinc/41/07/54/467410754.db2.gz YELDGNSWYFEKEB-HNNXBMFYSA-N 1 1 347.415 2.438 10 5 EEBEMO O=C(COc1ccc([N+](=O)[O-])cc1)N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000457004717 467728972 /nfs/dbraw/zinc/72/89/72/467728972.db2.gz YJAIWAVRKREIOQ-KRWDZBQOSA-N 1 1 341.367 2.147 10 5 EEBEMO CC[C@]1(CO)CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 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O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)CC1(CO)CCCC1)C2 ZINC000878303280 1200386160 /nfs/dbraw/zinc/38/61/60/1200386160.db2.gz MKCNRPULBZPGHL-OAHLLOKOSA-N 1 1 334.416 2.257 10 5 EEBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850046 1200957432 /nfs/dbraw/zinc/95/74/32/1200957432.db2.gz SYJAXQMGTDANKY-RDTXWAMCSA-N 1 1 345.399 2.201 10 5 EEBEMO CC(C)(O)C[N@@H+]1CC[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000866412418 1201510735 /nfs/dbraw/zinc/51/07/35/1201510735.db2.gz IVCPAOMIPRIAGY-WMLDXEAASA-N 1 1 333.432 2.407 10 5 EEBEMO CC(C)(O)C[N@H+]1CC[C@H](N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000866412418 1201510742 /nfs/dbraw/zinc/51/07/42/1201510742.db2.gz IVCPAOMIPRIAGY-WMLDXEAASA-N 1 1 333.432 2.407 10 5 EEBEMO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000928104882 1206345124 /nfs/dbraw/zinc/34/51/24/1206345124.db2.gz XKNDATOBSCDZGY-RTWZZBQXSA-N 1 1 347.440 2.304 10 5 EEBEMO 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ZINC001265824888 1323404515 /nfs/dbraw/zinc/40/45/15/1323404515.db2.gz JEWHBGIKPIWSRJ-UHFFFAOYSA-N 1 1 330.388 2.185 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CNC(=O)Nc1cc(Cl)cc([N+](=O)[O-])c1N ZINC001350616646 1337729123 /nfs/dbraw/zinc/72/91/23/1337729123.db2.gz QJGJZTIQJFFZPR-SNVBAGLBSA-N 1 1 341.799 2.436 10 5 EEBEMO COCC[N@@H+](CC(C)C)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848475826 1338704971 /nfs/dbraw/zinc/70/49/71/1338704971.db2.gz SJNDFVHNJKNMSP-KRWDZBQOSA-N 1 1 349.431 2.473 10 5 EEBEMO Cc1[nH]nc(C(=O)N2CCC[C@@H]2CC[NH+]2CCC(C)CC2)c1[N+](=O)[O-] ZINC001632159896 1352594111 /nfs/dbraw/zinc/59/41/11/1352594111.db2.gz JEVGLXNIFSDKHQ-CQSZACIVSA-N 1 1 349.435 2.353 10 5 EEBEMO Nc1nccc(C(=O)NC[C@H]2CC[N@H+]2C2CCCCCC2)c1[N+](=O)[O-] ZINC001635896319 1352654369 /nfs/dbraw/zinc/65/43/69/1352654369.db2.gz OPZBZXAPLQVTDQ-CYBMUJFWSA-N 1 1 347.419 2.099 10 5 EEBEMO O=C(CC[N@H+]1CC[C@H](F)C1)NCc1cc([N+](=O)[O-])ccc1Cl ZINC001636246761 1352661637 /nfs/dbraw/zinc/66/16/37/1352661637.db2.gz 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O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@H]1C[N@H+]2CCC[C@@H]2CO1 ZINC000845476626 789823512 /nfs/dbraw/zinc/82/35/12/789823512.db2.gz VTYJBKGWKIUFOB-KGLIPLIRSA-N 1 1 328.372 2.418 10 5 EEBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CCn2cc[nH+]c21 ZINC001175472545 798116284 /nfs/dbraw/zinc/11/62/84/798116284.db2.gz MXXCPQZJDQXUKQ-SNVBAGLBSA-N 1 1 326.316 2.423 10 5 EEBEMO C[C@@]12CSC[C@@H]1C[N@H+]([C@@H]1CCN(c3cccc([N+](=O)[O-])c3)C1=O)C2 ZINC001176803431 798577628 /nfs/dbraw/zinc/57/76/28/798577628.db2.gz GGOHYXRAUNEVRC-XGWLTEMNSA-N 1 1 347.440 2.385 10 5 EEBEMO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1 ZINC001536776261 1123807107 /nfs/dbraw/zinc/80/71/07/1123807107.db2.gz NVTPEPHIEIFBQI-XNJGSVPQSA-N 1 1 349.456 2.486 10 5 EEBEMO O=[N+]([O-])c1c(NC[C@H]2C[N@@H+](C3CC3)CCO2)ccc2ncccc21 ZINC000066745962 215075175 /nfs/dbraw/zinc/07/51/75/215075175.db2.gz CPPPTBKMPKRFGW-ZDUSSCGKSA-N 1 1 328.372 2.418 10 5 EEBEMO O=[N+]([O-])c1c(NC[C@H]2C[N@H+](C3CC3)CCO2)ccc2ncccc21 ZINC000066745962 215075179 /nfs/dbraw/zinc/07/51/79/215075179.db2.gz CPPPTBKMPKRFGW-ZDUSSCGKSA-N 1 1 328.372 2.418 10 5 EEBEMO Cc1ccc(Nc2[nH]cnc(=NN3CC[NH+](C)CC3)c2[N+](=O)[O-])cc1 ZINC000040623561 213358908 /nfs/dbraw/zinc/35/89/08/213358908.db2.gz CMRSIIIDTPKBET-UHFFFAOYSA-N 1 1 343.391 2.011 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000451895754 243297698 /nfs/dbraw/zinc/29/76/98/243297698.db2.gz FMBBSKJJCDVBKV-KRWDZBQOSA-N 1 1 349.387 2.044 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451895754 243297703 /nfs/dbraw/zinc/29/77/03/243297703.db2.gz FMBBSKJJCDVBKV-KRWDZBQOSA-N 1 1 349.387 2.044 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@@]2(CCOC2)C1 ZINC000451900869 243300272 /nfs/dbraw/zinc/30/02/72/243300272.db2.gz MIIWCZOLHKUNLO-SUMWQHHRSA-N 1 1 333.388 2.424 10 5 EEBEMO COC[C@@H]1CCC[N@@H+](C[C@@H](O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000452075014 243345481 /nfs/dbraw/zinc/34/54/81/243345481.db2.gz BOUMTDPCYADUNL-GDBMZVCRSA-N 1 1 338.404 2.083 10 5 EEBEMO CCNC(=O)C1C[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000459609821 245187081 /nfs/dbraw/zinc/18/70/81/245187081.db2.gz RGMXAADJOSMCPN-UHFFFAOYSA-N 1 1 329.356 2.423 10 5 EEBEMO O=C(C[N@H+]1[C@@H]2CC[C@H]1CC(O)C2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000111321923 220138673 /nfs/dbraw/zinc/13/86/73/220138673.db2.gz HYAFVYLCRNXNKN-FOSCPWQOSA-N 1 1 339.779 2.174 10 5 EEBEMO O=C(C[N@@H+]1[C@@H]2CC[C@H]1CC(O)C2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000111321923 220138676 /nfs/dbraw/zinc/13/86/76/220138676.db2.gz HYAFVYLCRNXNKN-FOSCPWQOSA-N 1 1 339.779 2.174 10 5 EEBEMO CC[C@@H]1CN(C(=O)CCc2cccc([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000119051838 221232344 /nfs/dbraw/zinc/23/23/44/221232344.db2.gz NESJKFCUGPISTP-MRXNPFEDSA-N 1 1 349.431 2.097 10 5 EEBEMO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000275877310 256384494 /nfs/dbraw/zinc/38/44/94/256384494.db2.gz PQICVJQMEMKKRA-HAQNSBGRSA-N 1 1 341.795 2.422 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](C[C@H](O)CC3CCCC3)C2)nc1 ZINC000190878367 152228658 /nfs/dbraw/zinc/22/86/58/152228658.db2.gz SOJRVJJEUKDSET-GOEBONIOSA-N 1 1 334.420 2.417 10 5 EEBEMO C[C@H](c1cccc(F)c1)[NH+]1CCN(CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000091981154 159211455 /nfs/dbraw/zinc/21/14/55/159211455.db2.gz JOTCNCNXFOFLIS-CQSZACIVSA-N 1 1 347.394 2.309 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc(OC)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000247265517 160317735 /nfs/dbraw/zinc/31/77/35/160317735.db2.gz FGVMAULNVUTWFM-SWLSCSKDSA-N 1 1 335.404 2.406 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCO[C@H](C2CC2)C1 ZINC000375345962 167116981 /nfs/dbraw/zinc/11/69/81/167116981.db2.gz WNJMIKMWLOSLAP-INIZCTEOSA-N 1 1 349.387 2.043 10 5 EEBEMO C[C@H]1C[C@@H](N(C)C(=O)COc2ccc([N+](=O)[O-])c(F)c2)CC[N@H+]1C ZINC000122984123 222194492 /nfs/dbraw/zinc/19/44/92/222194492.db2.gz YKSXARXKUJGAQL-RYUDHWBXSA-N 1 1 339.367 2.054 10 5 EEBEMO C[C@H]1C[C@H](N(C)C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000123163523 222227825 /nfs/dbraw/zinc/22/78/25/222227825.db2.gz SPZZYOWRJROEQC-CMPLNLGQSA-N 1 1 336.348 2.058 10 5 EEBEMO O=C1[C@@H]([N@H+]2CC[C@]3(C2)CCCOC3)CCN1c1cccc([N+](=O)[O-])c1 ZINC000341996954 275028263 /nfs/dbraw/zinc/02/82/63/275028263.db2.gz TXRPRLMNUKCDAE-WMZOPIPTSA-N 1 1 345.399 2.203 10 5 EEBEMO C[C@@H]1C[C@H]([NH+]2CCOCC2)CN1c1c2ccccc2ncc1[N+](=O)[O-] ZINC000291961294 278017080 /nfs/dbraw/zinc/01/70/80/278017080.db2.gz OFCVQNQRBXCQDD-KGLIPLIRSA-N 1 1 342.399 2.442 10 5 EEBEMO CC[N@H+]1CC[C@H]2OCCN(Cc3c(F)cc([N+](=O)[O-])cc3F)[C@H]2C1 ZINC000293315736 293179324 /nfs/dbraw/zinc/17/93/24/293179324.db2.gz QOTBZQPVQSHGOP-JKSUJKDBSA-N 1 1 341.358 2.168 10 5 EEBEMO COC(=O)[C@@H]([NH2+]CCCNc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)C ZINC000294979224 293596872 /nfs/dbraw/zinc/59/68/72/293596872.db2.gz OZWVSRORECQJHM-AWEZNQCLSA-N 1 1 349.391 2.060 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc(C(F)(F)F)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC000590767522 468333672 /nfs/dbraw/zinc/33/36/72/468333672.db2.gz OVGDAHQYADHSND-NOZJJQNGSA-N 1 1 343.305 2.390 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)Cc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000134727036 463076413 /nfs/dbraw/zinc/07/64/13/463076413.db2.gz PWFLPVINDPAUDQ-SWLSCSKDSA-N 1 1 342.399 2.314 10 5 EEBEMO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@@H](O)C(F)(F)F)CC2)cc1 ZINC000158291562 463224217 /nfs/dbraw/zinc/22/42/17/463224217.db2.gz HKHBCRJJSCYOHB-CYBMUJFWSA-N 1 1 334.294 2.361 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000071892882 463459317 /nfs/dbraw/zinc/45/93/17/463459317.db2.gz JOAGIBWBUDIPKI-OAHLLOKOSA-N 1 1 338.477 2.258 10 5 EEBEMO COc1ccc(CN(C)C(=O)[C@H]2C[C@H]3CCCC[N@H+]3C2)cc1[N+](=O)[O-] ZINC000081651755 463477067 /nfs/dbraw/zinc/47/70/67/463477067.db2.gz MDOGBMTURNYCAE-LSDHHAIUSA-N 1 1 347.415 2.436 10 5 EEBEMO CC[NH+](CC)CC1CCN(Cc2ccc(C(N)=O)cc2[N+](=O)[O-])CC1 ZINC000057847438 463523309 /nfs/dbraw/zinc/52/33/09/463523309.db2.gz SSYPNMNPBQTSHB-UHFFFAOYSA-N 1 1 348.447 2.248 10 5 EEBEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000262078080 463942191 /nfs/dbraw/zinc/94/21/91/463942191.db2.gz XJVKKRPNNNTHGT-INIZCTEOSA-N 1 1 341.367 2.390 10 5 EEBEMO CC[N@H+]1CC[C@H]2OCCN(c3nc4ccccc4cc3[N+](=O)[O-])[C@H]2C1 ZINC000292865934 464369427 /nfs/dbraw/zinc/36/94/27/464369427.db2.gz SQGCMTCBWODWQV-DLBZAZTESA-N 1 1 342.399 2.442 10 5 EEBEMO CCOC(=O)c1ccnc(N2C[C@@H]3CCC[N@H+]3C[C@H]2CC)c1[N+](=O)[O-] ZINC000246417885 464581977 /nfs/dbraw/zinc/58/19/77/464581977.db2.gz HQQBZDMNDWSYML-OLZOCXBDSA-N 1 1 348.403 2.230 10 5 EEBEMO C[C@H]1C[C@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C ZINC000265919127 464733400 /nfs/dbraw/zinc/73/34/00/464733400.db2.gz BRQBOXUXZWSWRU-DZGCQCFKSA-N 1 1 344.415 2.491 10 5 EEBEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000342432373 465320413 /nfs/dbraw/zinc/32/04/13/465320413.db2.gz FQVQNMYCRIBNAA-MEBBXXQBSA-N 1 1 341.358 2.214 10 5 EEBEMO CC[N@H+]1C[C@@H](C)N(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@@H]1C ZINC000342482198 465325069 /nfs/dbraw/zinc/32/50/69/465325069.db2.gz XZOQOEBVHCHLIP-NWDGAFQWSA-N 1 1 336.392 2.004 10 5 EEBEMO C[N@H+]1CCCC[C@H]1CCC(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC000356972760 465670303 /nfs/dbraw/zinc/67/03/03/465670303.db2.gz FUGOUNZYIJUIAN-AWEZNQCLSA-N 1 1 347.415 2.449 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCC[C@H]3COCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000362449179 465747926 /nfs/dbraw/zinc/74/79/26/465747926.db2.gz HDZPLZDMBAGZDZ-ZFWWWQNUSA-N 1 1 336.388 2.483 10 5 EEBEMO CCCC[N@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1C(N)=O ZINC000338398679 466091759 /nfs/dbraw/zinc/09/17/59/466091759.db2.gz OXQVBQZZZGJLLF-GFCCVEGCSA-N 1 1 335.408 2.155 10 5 EEBEMO C[C@H](NC(=O)N[C@@H]1CCc2nc[nH]c2C1)c1ccccc1[N+](=O)[O-] ZINC000357933164 466329467 /nfs/dbraw/zinc/32/94/67/466329467.db2.gz ISSJNEUDWBBUBR-WDEREUQCSA-N 1 1 329.360 2.236 10 5 EEBEMO COC(=O)[C@@]1(OC)CC[N@@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000600191232 468490364 /nfs/dbraw/zinc/49/03/64/468490364.db2.gz KOHVQXSSYGSHSN-HOFZKYPUSA-N 1 1 334.372 2.262 10 5 EEBEMO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CCN(C2CC2)C1 ZINC000411262244 466796574 /nfs/dbraw/zinc/79/65/74/466796574.db2.gz QZLDNWJMNVHRLV-INIZCTEOSA-N 1 1 332.404 2.092 10 5 EEBEMO CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000411262244 466796579 /nfs/dbraw/zinc/79/65/79/466796579.db2.gz QZLDNWJMNVHRLV-INIZCTEOSA-N 1 1 332.404 2.092 10 5 EEBEMO CN(CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000411262244 466796586 /nfs/dbraw/zinc/79/65/86/466796586.db2.gz QZLDNWJMNVHRLV-INIZCTEOSA-N 1 1 332.404 2.092 10 5 EEBEMO CC[N@@H+](C)C[C@H]1CCN(Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC000589503265 468157582 /nfs/dbraw/zinc/15/75/82/468157582.db2.gz NDWPCXYNTMUPDQ-CYBMUJFWSA-N 1 1 335.404 2.155 10 5 EEBEMO COCC[N@H+]1CCC[C@H](Nc2nc3c(cc2[N+](=O)[O-])CCCC3)C1 ZINC000591911520 468564958 /nfs/dbraw/zinc/56/49/58/468564958.db2.gz IMBYYGBSCXCKQA-AWEZNQCLSA-N 1 1 334.420 2.391 10 5 EEBEMO CNc1ccc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000582889211 468610571 /nfs/dbraw/zinc/61/05/71/468610571.db2.gz CEPQWVQJNXHBAE-MRXNPFEDSA-N 1 1 340.383 2.423 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)CC[N@H+]1C ZINC000601119687 468748957 /nfs/dbraw/zinc/74/89/57/468748957.db2.gz VPGXXZXOMFFWQJ-BDAKNGLRSA-N 1 1 335.330 2.266 10 5 EEBEMO CC[N@H+]1CCCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)[C@@H](C)C1 ZINC000601173654 468770865 /nfs/dbraw/zinc/77/08/65/468770865.db2.gz GEIACTWYVHTYTJ-VIFPVBQESA-N 1 1 335.330 2.268 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(C4(O)CC4)CC3)o2)cc1 ZINC000593051127 468852407 /nfs/dbraw/zinc/85/24/07/468852407.db2.gz KPHXAUYHGFXWQO-UHFFFAOYSA-N 1 1 344.371 2.382 10 5 EEBEMO O=C(C[N@@H+]1CC[C@@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000593115256 468875342 /nfs/dbraw/zinc/87/53/42/468875342.db2.gz BQAOJUDWGJYEPB-OAHLLOKOSA-N 1 1 337.326 2.215 10 5 EEBEMO O=C(C[N@H+]1CC[C@@]2(CC2(F)F)C1)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000593115256 468875345 /nfs/dbraw/zinc/87/53/45/468875345.db2.gz BQAOJUDWGJYEPB-OAHLLOKOSA-N 1 1 337.326 2.215 10 5 EEBEMO O=C1[C@H]([N@@H+]2CC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000593118305 468877599 /nfs/dbraw/zinc/87/75/99/468877599.db2.gz PYKLYOAFSSTNRO-HIFRSBDPSA-N 1 1 337.326 2.431 10 5 EEBEMO O=C1[C@H]([N@H+]2CC[C@]3(CC3(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000593118305 468877601 /nfs/dbraw/zinc/87/76/01/468877601.db2.gz PYKLYOAFSSTNRO-HIFRSBDPSA-N 1 1 337.326 2.431 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)[C@@H]2C1 ZINC000601596257 468931429 /nfs/dbraw/zinc/93/14/29/468931429.db2.gz VZFUWTRJITZGMV-XJKSGUPXSA-N 1 1 329.400 2.179 10 5 EEBEMO COc1ccc(CN2CCCC[C@@H]2[C@@H]2C[C@@H]([NH3+])CCO2)cc1[N+](=O)[O-] ZINC000593320432 468938052 /nfs/dbraw/zinc/93/80/52/468938052.db2.gz IWITZBQQEKVRRK-DAYGRLMNSA-N 1 1 349.431 2.464 10 5 EEBEMO C[C@H](O)C[N@H+]1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)[C@H](C)C1 ZINC000593468668 468993929 /nfs/dbraw/zinc/99/39/29/468993929.db2.gz DDVVAHOTVPYUBH-OLZOCXBDSA-N 1 1 330.388 2.034 10 5 EEBEMO COC(=O)[C@H]1C[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000595847736 469040532 /nfs/dbraw/zinc/04/05/32/469040532.db2.gz DXUFSGZMHNXKKC-XBXGTLAGSA-N 1 1 349.387 2.115 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000595864213 469052103 /nfs/dbraw/zinc/05/21/03/469052103.db2.gz RCHOESSWUJBTIG-YOEHRIQHSA-N 1 1 333.432 2.495 10 5 EEBEMO Nc1cc(N2CC[C@H]3[C@H](CCC[N@H+]3C3CC3)C2)cc(CO)c1[N+](=O)[O-] ZINC000588004069 469102400 /nfs/dbraw/zinc/10/24/00/469102400.db2.gz TZWSTYFHWUQGDA-PXAZEXFGSA-N 1 1 346.431 2.122 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000596537381 469296409 /nfs/dbraw/zinc/29/64/09/469296409.db2.gz FAJYBOUTRNAXRU-CYBMUJFWSA-N 1 1 325.796 2.284 10 5 EEBEMO C[NH+]1CCC(CNc2cccnc2[N+](=O)[O-])(N2CCCCC2)CC1 ZINC000610282716 470000159 /nfs/dbraw/zinc/00/01/59/470000159.db2.gz HVLURCZIQUHPBU-UHFFFAOYSA-N 1 1 333.436 2.352 10 5 EEBEMO C[C@@H]1CC[C@H](C)[N@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181934799 534222727 /nfs/dbraw/zinc/22/27/27/534222727.db2.gz SMOFNVQOJJHJHR-OLZOCXBDSA-N 1 1 326.418 2.489 10 5 EEBEMO C[C@@H]1CC[C@H](C)[N@@H+](CCS(=O)(=O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000181934799 534222731 /nfs/dbraw/zinc/22/27/31/534222731.db2.gz SMOFNVQOJJHJHR-OLZOCXBDSA-N 1 1 326.418 2.489 10 5 EEBEMO CCN1CC[NH+](CC(C)(C)NC(=O)c2ccc([N+](=O)[O-])cc2C)CC1 ZINC000456894707 535673199 /nfs/dbraw/zinc/67/31/99/535673199.db2.gz HZUXQAHKSQLWQG-UHFFFAOYSA-N 1 1 348.447 2.049 10 5 EEBEMO C/C(=C/C(=O)NC[C@@H](C)C[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752423330 577770785 /nfs/dbraw/zinc/77/07/85/577770785.db2.gz MUNCOHJEZSVOAR-ADVGAGMGSA-N 1 1 347.415 2.083 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(N2CCC([N@@H+](C)CCCO)CC2)c1 ZINC000747221259 577941023 /nfs/dbraw/zinc/94/10/23/577941023.db2.gz BQDZMRMFWKPTDQ-UHFFFAOYSA-N 1 1 341.383 2.026 10 5 EEBEMO C[N@H+](CCNC(=O)c1cc(Cl)no1)Cc1cccc([N+](=O)[O-])c1 ZINC001690989718 1176427962 /nfs/dbraw/zinc/42/79/62/1176427962.db2.gz IFSXTTDYGXCGAV-UHFFFAOYSA-N 1 1 338.751 2.098 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc(Cl)no1)Cc1cccc([N+](=O)[O-])c1 ZINC001690989718 1176427970 /nfs/dbraw/zinc/42/79/70/1176427970.db2.gz IFSXTTDYGXCGAV-UHFFFAOYSA-N 1 1 338.751 2.098 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1n[nH]cc1F)Cc1cccc([N+](=O)[O-])c1 ZINC001266571253 1176865493 /nfs/dbraw/zinc/86/54/93/1176865493.db2.gz MQPXOGPMYWEODJ-UHFFFAOYSA-N 1 1 349.366 2.099 10 5 EEBEMO C/C(=C/C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21)C1CC1 ZINC001266898963 1177752992 /nfs/dbraw/zinc/75/29/92/1177752992.db2.gz KICGURSBZZEVLT-VZDLTHNZSA-N 1 1 341.411 2.498 10 5 EEBEMO Cc1ccoc1CC(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001480910681 1178068853 /nfs/dbraw/zinc/06/88/53/1178068853.db2.gz IFQFYFGKIFVYHN-UHFFFAOYSA-N 1 1 331.372 2.287 10 5 EEBEMO CCc1ncoc1C(=O)NCC[N@H+](CC)Cc1ccc([N+](=O)[O-])cc1 ZINC001267251590 1178618783 /nfs/dbraw/zinc/61/87/83/1178618783.db2.gz LBPNIINESSSQPU-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO Cc1nc(C)c(C(=O)N(C)CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]1 ZINC001268251918 1182081173 /nfs/dbraw/zinc/08/11/73/1182081173.db2.gz RMWMRXGDNMCHLI-UHFFFAOYSA-N 1 1 345.403 2.139 10 5 EEBEMO Cc1nc(C)c(C(=O)N(C)CC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)[nH]1 ZINC001268251918 1182081176 /nfs/dbraw/zinc/08/11/76/1182081176.db2.gz RMWMRXGDNMCHLI-UHFFFAOYSA-N 1 1 345.403 2.139 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)c2c(F)c(C)cc([N+](=O)[O-])c2F)C1 ZINC001649116502 1193524872 /nfs/dbraw/zinc/52/48/72/1193524872.db2.gz YGWOSWQPMGZDQD-SNVBAGLBSA-N 1 1 327.331 2.348 10 5 EEBEMO CC1(C)[C@H]2[C@H](CCC[N@H+]2CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1O ZINC000872260809 1198116268 /nfs/dbraw/zinc/11/62/68/1198116268.db2.gz ZVZRBKRGKZJUMJ-VUCTXSBTSA-N 1 1 347.415 2.405 10 5 EEBEMO Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@@H](C)C[C@H]1CCCC[N@H+]1C ZINC000870786205 1200878071 /nfs/dbraw/zinc/87/80/71/1200878071.db2.gz ACJLYZFMJGGMNE-GXTWGEPZSA-N 1 1 338.408 2.296 10 5 EEBEMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@H]1CCOC1 ZINC000812878919 1200966128 /nfs/dbraw/zinc/96/61/28/1200966128.db2.gz KAKVSMALZBKJOV-LBPRGKRZSA-N 1 1 325.340 2.173 10 5 EEBEMO COC[C@@H](C)CC(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172482 1201142063 /nfs/dbraw/zinc/14/20/63/1201142063.db2.gz INSQBBIEFYAQGW-BBRMVZONSA-N 1 1 336.388 2.385 10 5 EEBEMO COC[C@@H](C)CC(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813172482 1201142065 /nfs/dbraw/zinc/14/20/65/1201142065.db2.gz INSQBBIEFYAQGW-BBRMVZONSA-N 1 1 336.388 2.385 10 5 EEBEMO CC(C)NC(=O)c1ccc(N2CC[C@@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000866205567 1201464711 /nfs/dbraw/zinc/46/47/11/1201464711.db2.gz FSJMQQVMWDOMNY-HUUCEWRRSA-N 1 1 346.431 2.263 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(c3ncc([N+](=O)[O-])cc3Br)CC[C@H]21 ZINC000866207888 1201465405 /nfs/dbraw/zinc/46/54/05/1201465405.db2.gz YKLPCBFQUMGLPU-JOYOIKCWSA-N 1 1 341.209 2.283 10 5 EEBEMO CC[N@H+]1CC[C@@H]1CNC(=O)[C@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000882485483 1201880358 /nfs/dbraw/zinc/88/03/58/1201880358.db2.gz SYJQKZJZMFQSHM-CMPLNLGQSA-N 1 1 341.795 2.226 10 5 EEBEMO O=C(CC[N@H+]1CC[C@H](OC(F)F)C1)Nc1cc([N+](=O)[O-])ccc1F ZINC000801988512 1236614150 /nfs/dbraw/zinc/61/41/50/1236614150.db2.gz FASSCUGUBRQDMF-JTQLQIEISA-N 1 1 347.293 2.376 10 5 EEBEMO Nc1ccc(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)c([N+](=O)[O-])c1 ZINC000853794190 1292455792 /nfs/dbraw/zinc/45/57/92/1292455792.db2.gz FSMSUBMGWBYGAW-INIZCTEOSA-N 1 1 342.399 2.356 10 5 EEBEMO O=[N+]([O-])c1ccc2nc(N3CCC([N@H+]4CC[C@H](O)C4)CC3)sc2c1 ZINC000853965089 1292560257 /nfs/dbraw/zinc/56/02/57/1292560257.db2.gz DPOUNGFAKVVKPC-ZDUSSCGKSA-N 1 1 348.428 2.240 10 5 EEBEMO C[C@@]12COC[C@@H]1C[N@@H+](Cn1cc(-c3ccc([N+](=O)[O-])cc3)cn1)C2 ZINC001118594292 1308894122 /nfs/dbraw/zinc/89/41/22/1308894122.db2.gz YAUFTVFSDFXCHX-DOTOQJQBSA-N 1 1 328.372 2.384 10 5 EEBEMO O=C([C@H]1CC[N@H+]1C1CCCC1)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001138247436 1314582437 /nfs/dbraw/zinc/58/24/37/1314582437.db2.gz NHLNTWABRPKELZ-QGZVFWFLSA-N 1 1 345.399 2.201 10 5 EEBEMO CC[C@@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610605 1315219664 /nfs/dbraw/zinc/21/96/64/1315219664.db2.gz OYGIRJKRZGAGGR-ZWNOBZJWSA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000839610605 1315219667 /nfs/dbraw/zinc/21/96/67/1315219667.db2.gz OYGIRJKRZGAGGR-ZWNOBZJWSA-N 1 1 341.795 2.280 10 5 EEBEMO C[C@@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001154879350 1317367244 /nfs/dbraw/zinc/36/72/44/1317367244.db2.gz CBPUWZDRPCEEPV-CQSZACIVSA-N 1 1 346.431 2.482 10 5 EEBEMO COc1ccc(C(=O)NCCNc2ccc(C)c[nH+]2)cc1[N+](=O)[O-] ZINC001156463977 1318024236 /nfs/dbraw/zinc/02/42/36/1318024236.db2.gz GEOAFOFPLBWJQU-UHFFFAOYSA-N 1 1 330.344 2.149 10 5 EEBEMO Cc1ccc(NCCNC(=O)COc2ccc([N+](=O)[O-])c(C)c2)[nH+]c1 ZINC001156470705 1318026907 /nfs/dbraw/zinc/02/69/07/1318026907.db2.gz TVXVZPATEFOXLK-UHFFFAOYSA-N 1 1 344.371 2.214 10 5 EEBEMO Cc1cccnc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001317444882 1332244233 /nfs/dbraw/zinc/24/42/33/1332244233.db2.gz UZZOORJQQVRQSV-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO Cc1cccnc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001317444882 1332244236 /nfs/dbraw/zinc/24/42/36/1332244236.db2.gz UZZOORJQQVRQSV-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO O=C(NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1nccs1 ZINC001317557613 1332297016 /nfs/dbraw/zinc/29/70/16/1332297016.db2.gz FEQRKGFQAGVNHS-UHFFFAOYSA-N 1 1 346.412 2.446 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cnsn1 ZINC001327186214 1334243128 /nfs/dbraw/zinc/24/31/28/1334243128.db2.gz ALJUOZLNZKQGNZ-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO O=[N+]([O-])c1cc2c(nc1NC[C@H]1C[N@H+]3CCC[C@@H]3CO1)CCCC2 ZINC001328119494 1334400455 /nfs/dbraw/zinc/40/04/55/1334400455.db2.gz MWGDMHNAAMMTAU-KGLIPLIRSA-N 1 1 332.404 2.144 10 5 EEBEMO CC[N@H+]1CCC[C@H](Nc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])C1 ZINC001472889119 1338660486 /nfs/dbraw/zinc/66/04/86/1338660486.db2.gz OSRKACUTQBLFIE-NSHDSACASA-N 1 1 345.359 2.369 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC001612899378 1352312298 /nfs/dbraw/zinc/31/22/98/1352312298.db2.gz NWPXRJLHNRIQMM-FZMZJTMJSA-N 1 1 338.389 2.495 10 5 EEBEMO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@H+]3CCSC[C@@H]23)c([N+](=O)[O-])c1 ZINC001612899378 1352312301 /nfs/dbraw/zinc/31/23/01/1352312301.db2.gz NWPXRJLHNRIQMM-FZMZJTMJSA-N 1 1 338.389 2.495 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1coc(C)n1)Cc1ccc([N+](=O)[O-])cc1 ZINC001663372770 1354954636 /nfs/dbraw/zinc/95/46/36/1354954636.db2.gz UZCWMPPWQGSIHE-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO O=[N+]([O-])c1ccc(OCC[N@@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1 ZINC001560062149 1342506707 /nfs/dbraw/zinc/50/67/07/1342506707.db2.gz DCNHGBKXXGKLDA-QZTJIDSGSA-N 1 1 344.367 2.098 10 5 EEBEMO CC(C)[N@H+]1CCC[C@@H](NC(=O)CN(C)c2ccccc2[N+](=O)[O-])C1 ZINC001567356147 1342743861 /nfs/dbraw/zinc/74/38/61/1342743861.db2.gz OCTWWXARYJAZRG-CQSZACIVSA-N 1 1 334.420 2.020 10 5 EEBEMO COC(=O)CC[C@H]1CCC[N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001648218220 1353421117 /nfs/dbraw/zinc/42/11/17/1353421117.db2.gz PBYXGDGHLZIAFA-CYBMUJFWSA-N 1 1 349.387 2.199 10 5 EEBEMO COC(=O)CC[C@H]1CCC[N@@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001648218220 1353421118 /nfs/dbraw/zinc/42/11/18/1353421118.db2.gz PBYXGDGHLZIAFA-CYBMUJFWSA-N 1 1 349.387 2.199 10 5 EEBEMO COc1cccc([C@@H](C)[NH+]2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)c1 ZINC001651506190 1354055657 /nfs/dbraw/zinc/05/56/57/1354055657.db2.gz RHDSEPOJXSUSBI-CYBMUJFWSA-N 1 1 345.403 2.220 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)CCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC001654027246 1354138371 /nfs/dbraw/zinc/13/83/71/1354138371.db2.gz NGRYDORPSFUUDG-MRXNPFEDSA-N 1 1 334.420 2.340 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+][C@@H](CO)C2CC2)o1 ZINC001654057486 1354139547 /nfs/dbraw/zinc/13/95/47/1354139547.db2.gz HNEWNZQNMFTMRM-NSHDSACASA-N 1 1 338.751 2.159 10 5 EEBEMO Cc1nccnc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001655515100 1354175812 /nfs/dbraw/zinc/17/58/12/1354175812.db2.gz OOXFMZUOPSEWBQ-NEPJUHHUSA-N 1 1 329.360 2.371 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C)c1nccnc1C ZINC001655517670 1354176098 /nfs/dbraw/zinc/17/60/98/1354176098.db2.gz BKBMFTDVRLTFSG-GFCCVEGCSA-N 1 1 329.360 2.291 10 5 EEBEMO CCCc1cc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001663309391 1354946379 /nfs/dbraw/zinc/94/63/79/1354946379.db2.gz TXSHYQKVYODYGJ-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO CCn1ccnc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001667556734 1355759642 /nfs/dbraw/zinc/75/96/42/1355759642.db2.gz JFILEMYLNSZCDH-UHFFFAOYSA-N 1 1 345.403 2.015 10 5 EEBEMO CCn1ccnc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001667556734 1355759646 /nfs/dbraw/zinc/75/96/46/1355759646.db2.gz JFILEMYLNSZCDH-UHFFFAOYSA-N 1 1 345.403 2.015 10 5 EEBEMO Cc1ccc(F)cc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001673434203 1356690037 /nfs/dbraw/zinc/69/00/37/1356690037.db2.gz ILYMBTNVFXREFU-HZPDHXFCSA-N 1 1 337.395 2.080 10 5 EEBEMO Cc1ccc(F)cc1C[N@@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001673434203 1356690040 /nfs/dbraw/zinc/69/00/40/1356690040.db2.gz ILYMBTNVFXREFU-HZPDHXFCSA-N 1 1 337.395 2.080 10 5 EEBEMO Cc1ccc(F)cc1C[N@H+](C)CCCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001673434203 1356690043 /nfs/dbraw/zinc/69/00/43/1356690043.db2.gz ILYMBTNVFXREFU-HZPDHXFCSA-N 1 1 337.395 2.080 10 5 EEBEMO C[C@H](Sc1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1 ZINC001129186448 784609688 /nfs/dbraw/zinc/60/96/88/784609688.db2.gz YESSFWOTJIKNHS-ZOWXZIJZSA-N 1 1 335.429 2.238 10 5 EEBEMO CC(C)Nc1ccc([N+](=O)[O-])cc1NC(=O)C1C[NH+]([C@@H]2CCOC2)C1 ZINC000909020190 785953687 /nfs/dbraw/zinc/95/36/87/785953687.db2.gz GLJQYGCLPXFUKG-CQSZACIVSA-N 1 1 348.403 2.074 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1C(=O)NCc1cc(F)c(Cl)c([N+](=O)[O-])c1 ZINC000913385278 788833418 /nfs/dbraw/zinc/83/34/18/788833418.db2.gz VVCCEKSBLZCZMX-LLVKDONJSA-N 1 1 329.759 2.488 10 5 EEBEMO Cc1[nH]c(Cn2cc([N+](=O)[O-])c(C)c(Br)c2=O)c(C)[nH+]1 ZINC000917467330 798240192 /nfs/dbraw/zinc/24/01/92/798240192.db2.gz DWDQRMWURFCPMB-UHFFFAOYSA-N 1 1 341.165 2.216 10 5 EEBEMO O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001177806532 799131816 /nfs/dbraw/zinc/13/18/16/799131816.db2.gz VVADBCZAYNRBSS-GFCCVEGCSA-N 1 1 347.350 2.308 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001446186443 1092261191 /nfs/dbraw/zinc/26/11/91/1092261191.db2.gz FABIEZSYGKILEA-HIFRSBDPSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])c[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001446186443 1092261201 /nfs/dbraw/zinc/26/12/01/1092261201.db2.gz FABIEZSYGKILEA-HIFRSBDPSA-N 1 1 332.335 2.237 10 5 EEBEMO Cc1c[nH]nc1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001493371518 1108006775 /nfs/dbraw/zinc/00/67/75/1108006775.db2.gz YWCZJHJHFKZEBR-UHFFFAOYSA-N 1 1 343.387 2.021 10 5 EEBEMO Cc1nccnc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC001460732644 1110321916 /nfs/dbraw/zinc/32/19/16/1110321916.db2.gz DVYHQQYMVGOSGY-VXGBXAGGSA-N 1 1 329.360 2.371 10 5 EEBEMO CC(C)[N@H+]1CCC[C@@H](C(=O)NCCNc2ccc([N+](=O)[O-])cc2)C1 ZINC001464098031 1110387492 /nfs/dbraw/zinc/38/74/92/1110387492.db2.gz DIECYWWQTRSQAJ-CQSZACIVSA-N 1 1 334.420 2.243 10 5 EEBEMO CC[N@H+]1CCN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC001471466331 1110522784 /nfs/dbraw/zinc/52/27/84/1110522784.db2.gz VDRYCOJWWAQAIU-UONOGXRCSA-N 1 1 334.420 2.434 10 5 EEBEMO CN(CCc1cccc([N+](=O)[O-])c1)C(=O)N[C@@H]1CC[C@H]2C[N@@H+](C)C[C@@H]21 ZINC001519930345 1119114927 /nfs/dbraw/zinc/11/49/27/1119114927.db2.gz IRSNGUCAZHEYGX-BHYGNILZSA-N 1 1 346.431 2.119 10 5 EEBEMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])Nc1c[nH+]ccc1-n1cccn1 ZINC001537565485 1124009711 /nfs/dbraw/zinc/00/97/11/1124009711.db2.gz AKNXJCXNIYENFQ-UHFFFAOYSA-N 1 1 341.302 2.496 10 5 EEBEMO O=C(CCNc1ccccc1[N+](=O)[O-])N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000195070655 160206021 /nfs/dbraw/zinc/20/60/21/160206021.db2.gz PUDKPJIDVLXFEZ-CQSZACIVSA-N 1 1 332.404 2.094 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[N@H+]3CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000246205696 160267547 /nfs/dbraw/zinc/26/75/47/160267547.db2.gz OFWYSFUBGSJOBP-HNNXBMFYSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2CCN3CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000246205696 160267548 /nfs/dbraw/zinc/26/75/48/160267548.db2.gz OFWYSFUBGSJOBP-HNNXBMFYSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CCN3CCCC[C@H]3C2)cccc1[N+](=O)[O-] ZINC000246205696 160267549 /nfs/dbraw/zinc/26/75/49/160267549.db2.gz OFWYSFUBGSJOBP-HNNXBMFYSA-N 1 1 346.431 2.402 10 5 EEBEMO CN(C(=O)C[N@@H+]1CC[C@@]2(O)CCCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000246933192 160301495 /nfs/dbraw/zinc/30/14/95/160301495.db2.gz NIUVZNAILQTIPK-KSSFIOAISA-N 1 1 347.415 2.185 10 5 EEBEMO CN(C(=O)C[N@H+]1CC[C@@]2(O)CCCC[C@H]2C1)c1ccc([N+](=O)[O-])cc1 ZINC000246933192 160301496 /nfs/dbraw/zinc/30/14/96/160301496.db2.gz NIUVZNAILQTIPK-KSSFIOAISA-N 1 1 347.415 2.185 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc(OC)c([N+](=O)[O-])c1 ZINC000247081157 160309691 /nfs/dbraw/zinc/30/96/91/160309691.db2.gz ZJHLIHASBSSJPQ-KGLIPLIRSA-N 1 1 333.388 2.302 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1 ZINC000247536925 160328245 /nfs/dbraw/zinc/32/82/45/160328245.db2.gz XSSMWXILGIMXHR-JSGCOSHPSA-N 1 1 335.404 2.406 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1 ZINC000359038365 164042730 /nfs/dbraw/zinc/04/27/30/164042730.db2.gz HFNIJEQOAITBPO-JTQLQIEISA-N 1 1 329.303 2.020 10 5 EEBEMO C[C@H]1C[C@@H](N(C)C(=O)CCOc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000123006024 222197837 /nfs/dbraw/zinc/19/78/37/222197837.db2.gz BLXZPBLWLPQATP-KBPBESRZSA-N 1 1 335.404 2.305 10 5 EEBEMO COCC[N@H+]1CC[C@@H](NC(=O)c2c(C)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000277876330 269193790 /nfs/dbraw/zinc/19/37/90/269193790.db2.gz CCEZZKLIWIZVDM-GFCCVEGCSA-N 1 1 341.795 2.007 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@]2(CC[NH+](C)C2)C1 ZINC000292218817 275395851 /nfs/dbraw/zinc/39/58/51/275395851.db2.gz UWHZYKLKPXWXGQ-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(CC[N@@H+](C)C2)C1 ZINC000292218817 275395853 /nfs/dbraw/zinc/39/58/53/275395853.db2.gz UWHZYKLKPXWXGQ-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(CC[N@H+](C)C2)C1 ZINC000292218817 275395856 /nfs/dbraw/zinc/39/58/56/275395856.db2.gz UWHZYKLKPXWXGQ-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000292218817 275395858 /nfs/dbraw/zinc/39/58/58/275395858.db2.gz UWHZYKLKPXWXGQ-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@]2(CCN(C)C2)C1 ZINC000292218817 275395859 /nfs/dbraw/zinc/39/58/59/275395859.db2.gz UWHZYKLKPXWXGQ-GOSISDBHSA-N 1 1 346.431 2.259 10 5 EEBEMO COC(=O)c1cc(C)nc(N2CC[C@]3(C2)CCC[N@@H+](C)C3)c1[N+](=O)[O-] ZINC000292885158 293068686 /nfs/dbraw/zinc/06/86/86/293068686.db2.gz VHGHKUXYHYFBPB-QGZVFWFLSA-N 1 1 348.403 2.007 10 5 EEBEMO C[C@H](C(=O)N1CCc2ncc([N+](=O)[O-])cc2C1)[N@@H+]1[C@H](C)CC[C@@H]1C ZINC000444285886 315288226 /nfs/dbraw/zinc/28/82/26/315288226.db2.gz HPYVHUPFHYUGES-FRRDWIJNSA-N 1 1 332.404 2.136 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNc1ncnc2ccc([N+](=O)[O-])cc21 ZINC000611710717 449390830 /nfs/dbraw/zinc/39/08/30/449390830.db2.gz NLQSEKINNPFYSF-CYBMUJFWSA-N 1 1 331.376 2.061 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1C[C@@H]2CCC[N@@H+]2C[C@@H]1C ZINC000113268988 462583147 /nfs/dbraw/zinc/58/31/47/462583147.db2.gz BDXGPMUBGQHVGJ-HOCLYGCPSA-N 1 1 346.431 2.400 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)NCC[N@@H+]1CC=C(C(C)(C)C)CC1 ZINC000552169166 468314475 /nfs/dbraw/zinc/31/44/75/468314475.db2.gz HHTOEDKFLCMBRV-UHFFFAOYSA-N 1 1 334.420 2.341 10 5 EEBEMO CCOC(=O)c1ccnc(NCC[N@H+]2CCCC[C@H]2C)c1[N+](=O)[O-] ZINC000077928862 463072792 /nfs/dbraw/zinc/07/27/92/463072792.db2.gz MKMDLWMBEFFQQO-GFCCVEGCSA-N 1 1 336.392 2.453 10 5 EEBEMO CN(C[C@@]1(O)CC[N@@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])nc1 ZINC000491270838 468338127 /nfs/dbraw/zinc/33/81/27/468338127.db2.gz KFQBEMYAWVLGHF-SFHVURJKSA-N 1 1 342.399 2.063 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1CC ZINC000172297012 464041385 /nfs/dbraw/zinc/04/13/85/464041385.db2.gz ADDYSHZJFPQVGU-ZDUSSCGKSA-N 1 1 341.433 2.229 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2csc([N+](=O)[O-])c2)C[C@@H]1CC ZINC000172297012 464041388 /nfs/dbraw/zinc/04/13/88/464041388.db2.gz ADDYSHZJFPQVGU-ZDUSSCGKSA-N 1 1 341.433 2.229 10 5 EEBEMO COc1ccc(OCC[N@@H+](C)[C@H]2CCN(C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525535 464276603 /nfs/dbraw/zinc/27/66/03/464276603.db2.gz UYBICOMAETYGAQ-KBPBESRZSA-N 1 1 337.420 2.397 10 5 EEBEMO COc1ccc(OCCN(C)[C@H]2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525535 464276607 /nfs/dbraw/zinc/27/66/07/464276607.db2.gz UYBICOMAETYGAQ-KBPBESRZSA-N 1 1 337.420 2.397 10 5 EEBEMO COc1ccc(OCCN(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525535 464276613 /nfs/dbraw/zinc/27/66/13/464276613.db2.gz UYBICOMAETYGAQ-KBPBESRZSA-N 1 1 337.420 2.397 10 5 EEBEMO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cnn4c3CCC4)CC2)c1 ZINC000596987871 468408299 /nfs/dbraw/zinc/40/82/99/468408299.db2.gz AXYVIPKCKMILHH-UHFFFAOYSA-N 1 1 327.388 2.060 10 5 EEBEMO COC(=O)c1ccc(C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])nc1 ZINC000285427354 464559830 /nfs/dbraw/zinc/55/98/30/464559830.db2.gz WEYLCTPLMDNTIG-UHFFFAOYSA-N 1 1 329.356 2.451 10 5 EEBEMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](C)CS(C)(=O)=O ZINC000176970979 464896172 /nfs/dbraw/zinc/89/61/72/464896172.db2.gz IOVXUIRAFBPRHM-CYBMUJFWSA-N 1 1 328.434 2.486 10 5 EEBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](C)CS(C)(=O)=O ZINC000176970979 464896176 /nfs/dbraw/zinc/89/61/76/464896176.db2.gz IOVXUIRAFBPRHM-CYBMUJFWSA-N 1 1 328.434 2.486 10 5 EEBEMO CCOCC[N@@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C ZINC000177054751 464918647 /nfs/dbraw/zinc/91/86/47/464918647.db2.gz SZCWAZFCJQLSJV-ZDUSSCGKSA-N 1 1 348.403 2.279 10 5 EEBEMO CCOCC[N@H+]1CCN(Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1C ZINC000177054751 464918655 /nfs/dbraw/zinc/91/86/55/464918655.db2.gz SZCWAZFCJQLSJV-ZDUSSCGKSA-N 1 1 348.403 2.279 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000177424018 465011152 /nfs/dbraw/zinc/01/11/52/465011152.db2.gz FOTCOEYPMVCWOW-INIZCTEOSA-N 1 1 334.420 2.263 10 5 EEBEMO Cc1c(CNC(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cccc1[N+](=O)[O-] ZINC000359540331 465442360 /nfs/dbraw/zinc/44/23/60/465442360.db2.gz HMCAESZWDZJZFN-OAHLLOKOSA-N 1 1 332.404 2.281 10 5 EEBEMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@H]3COCC[C@H]32)c([N+](=O)[O-])c1 ZINC000362445657 465745895 /nfs/dbraw/zinc/74/58/95/465745895.db2.gz DSONQGBDHPNJHT-SWLSCSKDSA-N 1 1 349.387 2.043 10 5 EEBEMO COc1ccc(NC(=O)C[N@H+]2CCC[C@H]3COCC[C@H]32)c([N+](=O)[O-])c1 ZINC000362445657 465745901 /nfs/dbraw/zinc/74/59/01/465745901.db2.gz DSONQGBDHPNJHT-SWLSCSKDSA-N 1 1 349.387 2.043 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366598050 465825547 /nfs/dbraw/zinc/82/55/47/465825547.db2.gz NFEJREREMOWTCY-CJNGLKHVSA-N 1 1 340.383 2.383 10 5 EEBEMO COC(=O)c1cc(N2CC[C@H](c3[nH+]ccn3C)C2)cc(C)c1[N+](=O)[O-] ZINC000366738617 465908533 /nfs/dbraw/zinc/90/85/33/465908533.db2.gz LVONDHLANLLIPH-LBPRGKRZSA-N 1 1 344.371 2.417 10 5 EEBEMO C[C@@H](CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[N@@H+](C)C1CC1 ZINC000362717520 465967687 /nfs/dbraw/zinc/96/76/87/465967687.db2.gz 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O=C(CC[N@@H+]1CC[C@@H](O)CC12CCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000420989288 467527009 /nfs/dbraw/zinc/52/70/09/467527009.db2.gz BXWSDKRKXTTZBB-OAHLLOKOSA-N 1 1 333.388 2.303 10 5 EEBEMO CN(C(=O)CCC(=O)c1cccc([N+](=O)[O-])c1)[C@H]1CC[N@H+](C2CC2)C1 ZINC000448961047 467608135 /nfs/dbraw/zinc/60/81/35/467608135.db2.gz LTRYSNJQJPGXLZ-INIZCTEOSA-N 1 1 345.399 2.253 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC(n3ccnc3)CC2)c1 ZINC000589497628 468156575 /nfs/dbraw/zinc/15/65/75/468156575.db2.gz XAUWZMXDKCLVAV-UHFFFAOYSA-N 1 1 344.371 2.415 10 5 EEBEMO C[C@H](C[NH+]1CCC(C)CC1)NS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000582796345 468598172 /nfs/dbraw/zinc/59/81/72/468598172.db2.gz DEOUEBOWULNKCR-LLVKDONJSA-N 1 1 347.462 2.055 10 5 EEBEMO [NH3+]CCCOCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000600773383 468653314 /nfs/dbraw/zinc/65/33/14/468653314.db2.gz HLCCQVVQZVEXHP-UHFFFAOYSA-N 1 1 336.417 2.173 10 5 EEBEMO Cc1ccc(CN2CCC(CO[C@H]3CC[NH2+]C3)CC2)cc1[N+](=O)[O-] ZINC000600774362 468654552 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333.388 2.199 10 5 EEBEMO C[C@H]1CN(c2ccc3cnccc3c2[N+](=O)[O-])CC[N@H+]1CC(C)(C)O ZINC000599072274 469106702 /nfs/dbraw/zinc/10/67/02/469106702.db2.gz IDWBQOKPIYEAEL-ZDUSSCGKSA-N 1 1 344.415 2.424 10 5 EEBEMO COC(=O)c1cnc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000599354875 469224125 /nfs/dbraw/zinc/22/41/25/469224125.db2.gz SGLNKXKGOJFGGO-NSHDSACASA-N 1 1 330.344 2.331 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCC([N@H+]3CCCOCC3)CC2)n1 ZINC000596268174 469226876 /nfs/dbraw/zinc/22/68/76/469226876.db2.gz HHUSEDAGXMUKGZ-UHFFFAOYSA-N 1 1 334.420 2.298 10 5 EEBEMO Cc1c(C(=O)N[C@H]2C[C@@H]([NH+]3CCOCC3)C2(C)C)cccc1[N+](=O)[O-] ZINC000603113093 469268748 /nfs/dbraw/zinc/26/87/48/469268748.db2.gz YPRZZCFCRGMTGY-JKSUJKDBSA-N 1 1 347.415 2.132 10 5 EEBEMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619253071 469559170 /nfs/dbraw/zinc/55/91/70/469559170.db2.gz QYNLBROABCBUBI-GDBMZVCRSA-N 1 1 346.362 2.334 10 5 EEBEMO 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/nfs/dbraw/zinc/48/36/81/468483681.db2.gz NPKODTAXEVCKKL-MCIONIFRSA-N 1 1 349.431 2.060 10 5 EEBEMO Cc1c(CC(=O)NC[C@@H](C)[N@@H+]2C[C@@H](C)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000594099199 468483684 /nfs/dbraw/zinc/48/36/84/468483684.db2.gz NPKODTAXEVCKKL-MCIONIFRSA-N 1 1 349.431 2.060 10 5 EEBEMO O=[N+]([O-])c1ccccc1/C=C/CN1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000597236498 468490690 /nfs/dbraw/zinc/49/06/90/468490690.db2.gz RAGASHOHKUHQEK-NJELEJDNSA-N 1 1 331.416 2.139 10 5 EEBEMO Cc1cn2c(n1)C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000363699686 466566614 /nfs/dbraw/zinc/56/66/14/466566614.db2.gz LHKXHIKXSIWAHM-UHFFFAOYSA-N 1 1 343.387 2.253 10 5 EEBEMO Cc1cn2c(n1)C[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)CC2 ZINC000363699686 466566618 /nfs/dbraw/zinc/56/66/18/466566618.db2.gz LHKXHIKXSIWAHM-UHFFFAOYSA-N 1 1 343.387 2.253 10 5 EEBEMO COc1cc(NC[C@@H]2C[N@H+]3CCC[C@@H]3CO2)c([N+](=O)[O-])cc1F ZINC000373675888 466885457 /nfs/dbraw/zinc/88/54/57/466885457.db2.gz UAWAKOWKTHVYPK-GHMZBOCLSA-N 1 1 325.340 2.018 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@@H]1[C@H]1CNC(=O)C1 ZINC000373759124 466912112 /nfs/dbraw/zinc/91/21/12/466912112.db2.gz HIMXYZYJSXMCTP-UKRRQHHQSA-N 1 1 333.388 2.094 10 5 EEBEMO CC(C)[C@H]1CC[N@H+]([C@H]2CC(=O)N(c3cccc([N+](=O)[O-])c3)C2=O)C1 ZINC000531265016 468040085 /nfs/dbraw/zinc/04/00/85/468040085.db2.gz QRCYYDMSDSVEAJ-WFASDCNBSA-N 1 1 331.372 2.205 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000590045950 468207414 /nfs/dbraw/zinc/20/74/14/468207414.db2.gz ZDCKLRSTMQPZBC-NOZJJQNGSA-N 1 1 343.305 2.390 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2F)C1 ZINC000590444370 468258345 /nfs/dbraw/zinc/25/83/45/468258345.db2.gz LBZZUUIRFMQIAJ-NHYWBVRUSA-N 1 1 335.379 2.174 10 5 EEBEMO Cc1nn(C)c(NC[C@@H]2C[N@@H+](C)C[C@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000591985035 468589879 /nfs/dbraw/zinc/58/98/79/468589879.db2.gz AQVOQTQGAUOLKY-CABCVRRESA-N 1 1 329.404 2.394 10 5 EEBEMO O=C1C[C@H]([N@@H+]2CCC[C@H](CCF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000594659652 468646288 /nfs/dbraw/zinc/64/62/88/468646288.db2.gz HABZBQKARQIPBK-DOMZBBRYSA-N 1 1 349.362 2.298 10 5 EEBEMO O=C1C[C@H]([N@H+]2CCC[C@H](CCF)C2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000594659652 468646291 /nfs/dbraw/zinc/64/62/91/468646291.db2.gz HABZBQKARQIPBK-DOMZBBRYSA-N 1 1 349.362 2.298 10 5 EEBEMO CCN(C(=O)COc1ccc([N+](=O)[O-])c(C)c1)[C@H]1CC[N@@H+](CC)C1 ZINC000598042278 468747247 /nfs/dbraw/zinc/74/72/47/468747247.db2.gz XAFWEMXGUDLAJT-AWEZNQCLSA-N 1 1 335.404 2.225 10 5 EEBEMO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1C[C@@H](C)n2ncnc21 ZINC000595063011 468751322 /nfs/dbraw/zinc/75/13/22/468751322.db2.gz BTWAWTPGPJIBEC-JTNHKYCSSA-N 1 1 344.375 2.199 10 5 EEBEMO C[C@@H]1C[N@@H+](C)CC[C@H]1N(C)c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601125805 468751918 /nfs/dbraw/zinc/75/19/18/468751918.db2.gz JXEOQGHPHZREGA-RKDXNWHRSA-N 1 1 335.330 2.124 10 5 EEBEMO CCCN(C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CC[N@@H+](C)C1 ZINC000592829703 468799213 /nfs/dbraw/zinc/79/92/13/468799213.db2.gz VTBLNCPINSMPTL-NSHDSACASA-N 1 1 341.358 2.358 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C[C@@H]21 ZINC000601618435 468938921 /nfs/dbraw/zinc/93/89/21/468938921.db2.gz YWTPCSLJDFRMPP-CJNGLKHVSA-N 1 1 329.400 2.179 10 5 EEBEMO C[C@@H](CNc1ccnc2cc([N+](=O)[O-])ccc21)N1CC[NH+](C)CC1 ZINC000593461464 468989752 /nfs/dbraw/zinc/98/97/52/468989752.db2.gz LVCBBMJVZDCWKW-ZDUSSCGKSA-N 1 1 329.404 2.191 10 5 EEBEMO C[C@@H]1CC[N@@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)O1 ZINC000595780327 469006587 /nfs/dbraw/zinc/00/65/87/469006587.db2.gz IHRZNFVHCDZCNW-WWGRRREGSA-N 1 1 333.388 2.199 10 5 EEBEMO C[C@@H]1CC[N@H+]([C@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)O1 ZINC000595780327 469006589 /nfs/dbraw/zinc/00/65/89/469006589.db2.gz IHRZNFVHCDZCNW-WWGRRREGSA-N 1 1 333.388 2.199 10 5 EEBEMO C[C@@H]1CC[N@@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)O1 ZINC000595780326 469006944 /nfs/dbraw/zinc/00/69/44/469006944.db2.gz IHRZNFVHCDZCNW-DVOMOZLQSA-N 1 1 333.388 2.199 10 5 EEBEMO C[C@@H]1CC[N@H+]([C@@H]2CCN(c3cccc([N+](=O)[O-])c3)C2=O)C[C@H](C)O1 ZINC000595780326 469006947 /nfs/dbraw/zinc/00/69/47/469006947.db2.gz IHRZNFVHCDZCNW-DVOMOZLQSA-N 1 1 333.388 2.199 10 5 EEBEMO O=C(NCc1cccc([N+](=O)[O-])c1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000598978197 469073578 /nfs/dbraw/zinc/07/35/78/469073578.db2.gz DDPMGTOGJRVQIN-MRXNPFEDSA-N 1 1 332.404 2.411 10 5 EEBEMO C[C@H](C[N@@H+]1C[C@H](C)C[C@H](C)C1)Nc1cc(N)c([N+](=O)[O-])c(CO)c1 ZINC000587454907 469089576 /nfs/dbraw/zinc/08/95/76/469089576.db2.gz KMMDKFRPIFRARC-FRRDWIJNSA-N 1 1 336.436 2.448 10 5 EEBEMO [NH3+][C@@H]1CN(Cc2cc(O)ccc2[N+](=O)[O-])C[C@H]1c1cccc(F)c1 ZINC000593726535 469111005 /nfs/dbraw/zinc/11/10/05/469111005.db2.gz NFIQKQWDZHCLDO-JKSUJKDBSA-N 1 1 331.347 2.366 10 5 EEBEMO COc1cc(NCCC[NH+]2CCN(C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596061084 469132954 /nfs/dbraw/zinc/13/29/54/469132954.db2.gz BRMLKVLEVHJMNC-UHFFFAOYSA-N 1 1 342.827 2.306 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000611513688 469269456 /nfs/dbraw/zinc/26/94/56/469269456.db2.gz UXRWBLQCIQBWHM-SECBINFHSA-N 1 1 329.303 2.020 10 5 EEBEMO O=c1ccc([C@@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000599641691 469319821 /nfs/dbraw/zinc/31/98/21/469319821.db2.gz OHBWCFPSXXJFNR-HNNXBMFYSA-N 1 1 330.344 2.306 10 5 EEBEMO CC(C)[N@H+]1CC[C@H](N(C)C(=O)Cc2c(F)cc([N+](=O)[O-])cc2F)C1 ZINC000457099123 485485424 /nfs/dbraw/zinc/48/54/24/485485424.db2.gz UUIWKGSYPOVHTF-NSHDSACASA-N 1 1 341.358 2.357 10 5 EEBEMO CC[C@@H]1[C@@H](CO)CC[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000451254126 535956014 /nfs/dbraw/zinc/95/60/14/535956014.db2.gz OIWOOCGJZITEAS-TZMCWYRMSA-N 1 1 332.360 2.238 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000754213153 577802485 /nfs/dbraw/zinc/80/24/85/577802485.db2.gz WVKVXCNYIOSLBE-UHFFFAOYSA-N 1 1 344.327 2.465 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C[N@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000754213153 577802486 /nfs/dbraw/zinc/80/24/86/577802486.db2.gz WVKVXCNYIOSLBE-UHFFFAOYSA-N 1 1 344.327 2.465 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928430668 683027288 /nfs/dbraw/zinc/02/72/88/683027288.db2.gz YYHCUERCHBYIAO-SCZZXKLOSA-N 1 1 342.193 2.180 10 5 EEBEMO C[N@@H+](CCNC(=O)C1C=CC=CC=C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480868908 1176209607 /nfs/dbraw/zinc/20/96/07/1176209607.db2.gz KARYAYHTOZSDOV-UHFFFAOYSA-N 1 1 327.384 2.441 10 5 EEBEMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)CCNc1ccccc1[N+](=O)[O-] ZINC001648854977 1176736025 /nfs/dbraw/zinc/73/60/25/1176736025.db2.gz MVLYJNZTEPGULV-ZDUSSCGKSA-N 1 1 332.404 2.092 10 5 EEBEMO O=C(NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001267326725 1178762622 /nfs/dbraw/zinc/76/26/22/1178762622.db2.gz ZYVHTXBPMMNOQI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO O=C(NCC[N@H+](CC1CCC2(CC2)CC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001267326725 1178762628 /nfs/dbraw/zinc/76/26/28/1178762628.db2.gz ZYVHTXBPMMNOQI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO O=C(NCC[N@@H+](CC1CCC2(CC2)CC1)C1CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001267326725 1178762634 /nfs/dbraw/zinc/76/26/34/1178762634.db2.gz ZYVHTXBPMMNOQI-HZPDHXFCSA-N 1 1 335.448 2.203 10 5 EEBEMO CCn1ccnc1C(=O)NCC[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC001480972704 1179403884 /nfs/dbraw/zinc/40/38/84/1179403884.db2.gz XMFAQJQGDYUTTM-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO O=C(CCc1ccoc1)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001481619269 1181896266 /nfs/dbraw/zinc/89/62/66/1181896266.db2.gz NEUFRJWOXASMCN-UHFFFAOYSA-N 1 1 343.383 2.369 10 5 EEBEMO CCc1cc(C(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC001482581172 1186980754 /nfs/dbraw/zinc/98/07/54/1186980754.db2.gz OXLYJVAZYKKWDJ-UHFFFAOYSA-N 1 1 345.403 2.084 10 5 EEBEMO COc1ccc2c(c1)CCN2C(=O)[C@](C)([NH3+])c1cccc([N+](=O)[O-])c1 ZINC000867950627 1201712849 /nfs/dbraw/zinc/71/28/49/1201712849.db2.gz XLVKAOMLVFVFNP-GOSISDBHSA-N 1 1 341.367 2.367 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)N(Cc2cccc([N+](=O)[O-])c2)C2CC2)CC[N@H+]1C ZINC000925329071 1206097953 /nfs/dbraw/zinc/09/79/53/1206097953.db2.gz KNKLNQRILHFCFA-LRDDRELGSA-N 1 1 332.404 2.361 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2Cc2c(Br)cccc2[N+](=O)[O-])C1 ZINC000930544279 1206566167 /nfs/dbraw/zinc/56/61/67/1206566167.db2.gz MLNSGZSMULKPBG-HZMBPMFUSA-N 1 1 340.221 2.493 10 5 EEBEMO CC(C)[N@H+]1CCO[C@H](COC(=O)[C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000802142114 1236988174 /nfs/dbraw/zinc/98/81/74/1236988174.db2.gz WRGPIQGACUUPBX-BBRMVZONSA-N 1 1 336.388 2.351 10 5 EEBEMO C[C@@H]1[C@H](N[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000903301989 1240209188 /nfs/dbraw/zinc/20/91/88/1240209188.db2.gz VRKNKMNXZIYPQH-DAXOMENPSA-N 1 1 329.404 2.100 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NS(=O)(=O)c1csc([N+](=O)[O-])c1 ZINC000851857480 1291891544 /nfs/dbraw/zinc/89/15/44/1291891544.db2.gz SKCWEVOGPSXBBV-UHFFFAOYSA-N 1 1 335.451 2.055 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@@H+]2CCC[C@H]3COCC[C@H]32)nc1-c1ccccn1 ZINC000853502017 1292404487 /nfs/dbraw/zinc/40/44/87/1292404487.db2.gz PIASBEFRDFDMNE-DZGCQCFKSA-N 1 1 343.387 2.312 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@H+]2CCC[C@H]3COCC[C@H]32)nc1-c1ccccn1 ZINC000853502017 1292404494 /nfs/dbraw/zinc/40/44/94/1292404494.db2.gz PIASBEFRDFDMNE-DZGCQCFKSA-N 1 1 343.387 2.312 10 5 EEBEMO O=C(NCC[NH+]1CCSCC1)c1c(Cl)cccc1[N+](=O)[O-] ZINC001293219298 1328637839 /nfs/dbraw/zinc/63/78/39/1328637839.db2.gz KTSKIJRWAHGJON-UHFFFAOYSA-N 1 1 329.809 2.027 10 5 EEBEMO Cc1nc(C(=O)NCCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)co1 ZINC001265831770 1323408861 /nfs/dbraw/zinc/40/88/61/1323408861.db2.gz RDSQPCZXXDVRDE-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001280813204 1324536809 /nfs/dbraw/zinc/53/68/09/1324536809.db2.gz DBNNTASLDOOFFV-NVXWUHKLSA-N 1 1 344.415 2.113 10 5 EEBEMO CN(CCC[N@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001280813204 1324536815 /nfs/dbraw/zinc/53/68/15/1324536815.db2.gz DBNNTASLDOOFFV-NVXWUHKLSA-N 1 1 344.415 2.113 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc2cc[nH]c2c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001280813204 1324536820 /nfs/dbraw/zinc/53/68/20/1324536820.db2.gz DBNNTASLDOOFFV-NVXWUHKLSA-N 1 1 344.415 2.113 10 5 EEBEMO CCc1[nH]nc(C(=O)N2C[C@H]([NH+]3CCCC3)C[C@@H]2C(C)C)c1[N+](=O)[O-] ZINC001305227226 1331414674 /nfs/dbraw/zinc/41/46/74/1331414674.db2.gz URTGMAGNSMFBEN-TZMCWYRMSA-N 1 1 349.435 2.215 10 5 EEBEMO Cc1cnoc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001317559045 1332297477 /nfs/dbraw/zinc/29/74/77/1332297477.db2.gz QQUWMEDNZKICHM-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO CCOC[C@@H]1CC[N@@H+](CN2CC[C@@H](c3ccc([N+](=O)[O-])cc3)C2=O)C1 ZINC000848479974 1338705878 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PWSBXUGSXFICSE-LLVKDONJSA-N 1 1 329.759 2.457 10 5 EEBEMO CC(C)c1[nH]nc(C(=O)N2CCC([NH2+]C3CCC3)CC2)c1[N+](=O)[O-] ZINC001648425540 1353428998 /nfs/dbraw/zinc/42/89/98/1353428998.db2.gz FKBUAJJRJRDJSR-UHFFFAOYSA-N 1 1 335.408 2.188 10 5 EEBEMO CC(C)(C)CCC[NH+]1CC2(C1)CCN(C(=O)[C@@H]1CC1[N+](=O)[O-])CC2 ZINC001666821201 1355596940 /nfs/dbraw/zinc/59/69/40/1355596940.db2.gz IUJUYICENWELLO-HUUCEWRRSA-N 1 1 337.464 2.402 10 5 EEBEMO Cc1cc[nH]c1C(=O)NCCC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001479768318 1098935562 /nfs/dbraw/zinc/93/55/62/1098935562.db2.gz SOLHHAUVKWCLKC-UHFFFAOYSA-N 1 1 330.388 2.483 10 5 EEBEMO CCn1cc(C(=O)N(C)CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC001496677534 1101276707 /nfs/dbraw/zinc/27/67/07/1101276707.db2.gz ZDFDUGPIRHJZQL-UHFFFAOYSA-N 1 1 345.403 2.015 10 5 EEBEMO CCn1cc(C(=O)N(C)CC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC001496677534 1101276711 /nfs/dbraw/zinc/27/67/11/1101276711.db2.gz ZDFDUGPIRHJZQL-UHFFFAOYSA-N 1 1 345.403 2.015 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1cscn1)Cc1cccc([N+](=O)[O-])c1 ZINC001493026891 1107332886 /nfs/dbraw/zinc/33/28/86/1107332886.db2.gz AMLKEWGZOCQHPI-UHFFFAOYSA-N 1 1 348.428 2.232 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC001493289906 1107863797 /nfs/dbraw/zinc/86/37/97/1107863797.db2.gz CATIAQSWTXGZAL-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CCC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC001493289906 1107863813 /nfs/dbraw/zinc/86/38/13/1107863813.db2.gz CATIAQSWTXGZAL-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC001493289906 1107863826 /nfs/dbraw/zinc/86/38/26/1107863826.db2.gz CATIAQSWTXGZAL-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO Cc1ccc(NC(=O)c2cc([C@H]3CCC[N@H+]3C)[nH]n2)c(N)c1[N+](=O)[O-] ZINC001472227791 1110548301 /nfs/dbraw/zinc/54/83/01/1110548301.db2.gz ZTPNMKYLUVYGOY-CYBMUJFWSA-N 1 1 344.375 2.228 10 5 EEBEMO Cc1ccc(NC(=O)c2cc([C@H]3CCC[N@@H+]3C)[nH]n2)c(N)c1[N+](=O)[O-] ZINC001472227791 1110548303 /nfs/dbraw/zinc/54/83/03/1110548303.db2.gz ZTPNMKYLUVYGOY-CYBMUJFWSA-N 1 1 344.375 2.228 10 5 EEBEMO C[C@H]1C[N@@H+](C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000066562260 215053898 /nfs/dbraw/zinc/05/38/98/215053898.db2.gz JOMXMGCIBHFIAL-HNNXBMFYSA-N 1 1 333.432 2.322 10 5 EEBEMO C[C@H]1C[N@H+](C2CCN(CCc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000066562260 215053899 /nfs/dbraw/zinc/05/38/99/215053899.db2.gz JOMXMGCIBHFIAL-HNNXBMFYSA-N 1 1 333.432 2.322 10 5 EEBEMO C[C@@H]1C[N@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)[C@@H](C)O1 ZINC000446068345 242153342 /nfs/dbraw/zinc/15/33/42/242153342.db2.gz HQOXLLGHRUZPLX-JHJVBQTASA-N 1 1 349.387 2.391 10 5 EEBEMO C[C@@H]1C[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)[C@H](C)[C@@H](C)O1 ZINC000446068345 242153346 /nfs/dbraw/zinc/15/33/46/242153346.db2.gz HQOXLLGHRUZPLX-JHJVBQTASA-N 1 1 349.387 2.391 10 5 EEBEMO COc1ccc(-c2ccc(C[N@@H+]3CCNC(=O)CC3)o2)c([N+](=O)[O-])c1 ZINC000093101714 159230004 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2.356 10 5 EEBEMO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])C(=O)N1CCOCC1 ZINC000872040425 1198033017 /nfs/dbraw/zinc/03/30/17/1198033017.db2.gz ADCVJLGOWFCHQZ-AAEUAGOBSA-N 1 1 339.367 2.022 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@H]2CC[N@H+]3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000868210291 1201765442 /nfs/dbraw/zinc/76/54/42/1201765442.db2.gz KBDVYCHTAYPLBF-GJZGRUSLSA-N 1 1 332.404 2.329 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H](C)C2=CC[N@@H+](C)CC2)cc1[N+](=O)[O-] ZINC000868488537 1201821222 /nfs/dbraw/zinc/82/12/22/1201821222.db2.gz DOZAOGOSLUABFR-ZDUSSCGKSA-N 1 1 332.404 2.353 10 5 EEBEMO CC[N@@H+](CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O)C(C)C ZINC000925295124 1206092045 /nfs/dbraw/zinc/09/20/45/1206092045.db2.gz JFLJCXHGNUUJBT-QGZVFWFLSA-N 1 1 348.403 2.092 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641722 1206572439 /nfs/dbraw/zinc/57/24/39/1206572439.db2.gz YGBJXKCQDVRHRO-GOEBONIOSA-N 1 1 338.429 2.351 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@@H+](C[C@H]3CCCS3(=O)=O)C2)cc1 ZINC000930641722 1206572440 /nfs/dbraw/zinc/57/24/40/1206572440.db2.gz YGBJXKCQDVRHRO-GOEBONIOSA-N 1 1 338.429 2.351 10 5 EEBEMO O=[N+]([O-])c1cc(CN2CCC([N@H+]3CC[C@@H](O)C3)CC2)ccc1Cl ZINC000852706843 1292172733 /nfs/dbraw/zinc/17/27/33/1292172733.db2.gz BKWXWSIXKKRAKC-CQSZACIVSA-N 1 1 339.823 2.279 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000859208297 1294349244 /nfs/dbraw/zinc/34/92/44/1294349244.db2.gz LRJZBGWUUSWAAR-LLVKDONJSA-N 1 1 341.795 2.089 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]3OCCC[C@@H]3C2)c1 ZINC001118290352 1306335521 /nfs/dbraw/zinc/33/55/21/1306335521.db2.gz KARLPQJRHCKOBA-CZUORRHYSA-N 1 1 334.372 2.382 10 5 EEBEMO CCc1ncc(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)[nH]1 ZINC001156538164 1318063326 /nfs/dbraw/zinc/06/33/26/1318063326.db2.gz NNZFJXHPQIKIDX-UHFFFAOYSA-N 1 1 331.376 2.389 10 5 EEBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001319487799 1332710189 /nfs/dbraw/zinc/71/01/89/1332710189.db2.gz SGLCKXXAFBTISR-WFASDCNBSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001319487799 1332710192 /nfs/dbraw/zinc/71/01/92/1332710192.db2.gz SGLCKXXAFBTISR-WFASDCNBSA-N 1 1 332.335 2.237 10 5 EEBEMO Cc1ccn(C)c1C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001323435403 1333463129 /nfs/dbraw/zinc/46/31/29/1333463129.db2.gz KAUQVBQJBRAHEP-UHFFFAOYSA-N 1 1 348.428 2.355 10 5 EEBEMO C[C@@H]1CC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC001328551968 1334478552 /nfs/dbraw/zinc/47/85/52/1334478552.db2.gz AJKLSILXHNNANM-OLZOCXBDSA-N 1 1 331.376 2.310 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC001328551968 1334478554 /nfs/dbraw/zinc/47/85/54/1334478554.db2.gz AJKLSILXHNNANM-OLZOCXBDSA-N 1 1 331.376 2.310 10 5 EEBEMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2[nH]ncc2[N+](=O)[O-])c1 ZINC001616634561 1352330463 /nfs/dbraw/zinc/33/04/63/1352330463.db2.gz WZJFHVGAGWWVDU-UHFFFAOYSA-N 1 1 331.376 2.088 10 5 EEBEMO CC(C)[N@H+](C)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1 ZINC001616634561 1352330464 /nfs/dbraw/zinc/33/04/64/1352330464.db2.gz WZJFHVGAGWWVDU-UHFFFAOYSA-N 1 1 331.376 2.088 10 5 EEBEMO CC(C)[N@@H+](C)Cc1cccc(CNC(=O)c2n[nH]cc2[N+](=O)[O-])c1 ZINC001616634561 1352330466 /nfs/dbraw/zinc/33/04/66/1352330466.db2.gz WZJFHVGAGWWVDU-UHFFFAOYSA-N 1 1 331.376 2.088 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ccc(F)cn1)Cc1cccc([N+](=O)[O-])c1 ZINC001663372575 1354954349 /nfs/dbraw/zinc/95/43/49/1354954349.db2.gz NHAOQZCZHSFAHD-UHFFFAOYSA-N 1 1 346.362 2.381 10 5 EEBEMO O=C(Cc1ccc[nH]1)NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001567454396 1342764015 /nfs/dbraw/zinc/76/40/15/1342764015.db2.gz RXOPCBUTDLVONO-UHFFFAOYSA-N 1 1 342.399 2.246 10 5 EEBEMO O=C(NCC1=CC[N@@H+](CCCCC(F)(F)F)CC1)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001571687221 1343271739 /nfs/dbraw/zinc/27/17/39/1343271739.db2.gz XLKPDDVCZGPGFD-CHWSQXEVSA-N 1 1 349.353 2.133 10 5 EEBEMO O=C(NCC1=CC[N@H+](CCCCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001571687221 1343271743 /nfs/dbraw/zinc/27/17/43/1343271743.db2.gz XLKPDDVCZGPGFD-CHWSQXEVSA-N 1 1 349.353 2.133 10 5 EEBEMO O=C(NCC1=CC[N@@H+](CCCCC(F)(F)F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001571687221 1343271747 /nfs/dbraw/zinc/27/17/47/1343271747.db2.gz XLKPDDVCZGPGFD-CHWSQXEVSA-N 1 1 349.353 2.133 10 5 EEBEMO C[N@@H+](CCCNC(=O)c1[nH]nc([N+](=O)[O-])c1Cl)C1CCCCC1 ZINC001587294575 1348859690 /nfs/dbraw/zinc/85/96/90/1348859690.db2.gz XNPYTNMPWHXYMR-UHFFFAOYSA-N 1 1 343.815 2.356 10 5 EEBEMO C[N@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001625287758 1352445315 /nfs/dbraw/zinc/44/53/15/1352445315.db2.gz GTDJAVRWZGRBHZ-LLVKDONJSA-N 1 1 328.372 2.012 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(C(=O)CCNc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001631498123 1352584603 /nfs/dbraw/zinc/58/46/03/1352584603.db2.gz JXPFIGLWPCZODB-OKILXGFUSA-N 1 1 334.420 2.338 10 5 EEBEMO Cc1cc(Cl)ccc1C[NH2+]C/C=C/CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001699255452 1405295810 /nfs/dbraw/zinc/29/58/10/1405295810.db2.gz NHSMCRSNKSPTGO-SWVJOTTGSA-N 1 1 337.807 2.076 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2)C1 ZINC000908346869 785339870 /nfs/dbraw/zinc/33/98/70/785339870.db2.gz ILXBLGVRRPXUAE-UFBFGSQYSA-N 1 1 327.743 2.163 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000913279722 788740034 /nfs/dbraw/zinc/74/00/34/788740034.db2.gz WKEILXSIAZCHBC-HDICACEKSA-N 1 1 347.415 2.407 10 5 EEBEMO C[N@H+]1C[C@H](NC(=O)Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)C1 ZINC001178710000 799599878 /nfs/dbraw/zinc/59/98/78/799599878.db2.gz UNLHKOREINFDSF-ZDUSSCGKSA-N 1 1 325.796 2.247 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)Cc1cccc(=O)[nH]1 ZINC001460829029 1110325625 /nfs/dbraw/zinc/32/56/25/1110325625.db2.gz NOLWWRMDTCHREQ-UHFFFAOYSA-N 1 1 344.371 2.464 10 5 EEBEMO O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 ZINC001468316692 1110472457 /nfs/dbraw/zinc/47/24/57/1110472457.db2.gz UJRDUDCXUHLMRD-JSGCOSHPSA-N 1 1 348.378 2.037 10 5 EEBEMO O=C(c1ccc(NC2CC2)c([N+](=O)[O-])c1)N1CC[N@H+]2C[C@@H](F)C[C@H]2C1 ZINC001468316692 1110472459 /nfs/dbraw/zinc/47/24/59/1110472459.db2.gz UJRDUDCXUHLMRD-JSGCOSHPSA-N 1 1 348.378 2.037 10 5 EEBEMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2ccnn2C)c([N+](=O)[O-])c1 ZINC001473731915 1110579604 /nfs/dbraw/zinc/57/96/04/1110579604.db2.gz JXEDEAMCUPAANB-LLVKDONJSA-N 1 1 347.375 2.016 10 5 EEBEMO O=C(NC[C@@]12CC[N@@H+](C1)CCC2)c1ccc(NC2CC2)c([N+](=O)[O-])c1 ZINC001528581019 1121073366 /nfs/dbraw/zinc/07/33/66/1121073366.db2.gz CDKDHUWOOTUWER-GOSISDBHSA-N 1 1 344.415 2.385 10 5 EEBEMO CNC(=O)c1ccc(NC[C@H]2CCC[N@H+]2CC(C)C)c([N+](=O)[O-])c1 ZINC000131472686 529942461 /nfs/dbraw/zinc/94/24/61/529942461.db2.gz CBARMSJPKNWDIE-CQSZACIVSA-N 1 1 334.420 2.487 10 5 EEBEMO O=C(c1ccc([N+](=O)[O-])c2cccnc12)N1CC[NH+](C2CC2)CC1 ZINC000128963623 223005916 /nfs/dbraw/zinc/00/59/16/223005916.db2.gz ILAUVHWLQZNYLZ-UHFFFAOYSA-N 1 1 326.356 2.063 10 5 EEBEMO C[N@H+]1CC[C@H](Nc2ccc3ncc([N+](=O)[O-])n3n2)[C@H]1c1ccccc1 ZINC000242047897 243009155 /nfs/dbraw/zinc/00/91/55/243009155.db2.gz VQYMHDXOOQUUNH-SUMWQHHRSA-N 1 1 338.371 2.495 10 5 EEBEMO C[C@H](C[N@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)CS(C)(=O)=O ZINC000451554168 243157030 /nfs/dbraw/zinc/15/70/30/243157030.db2.gz ZLHPWPJOHCFEFQ-UKRRQHHQSA-N 1 1 340.445 2.455 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21 ZINC000265025440 247143097 /nfs/dbraw/zinc/14/30/97/247143097.db2.gz YZOMCVMPVCDLEZ-CJNGLKHVSA-N 1 1 342.399 2.245 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC[N@@H+]2CCOC[C@H]2C1 ZINC000408106497 285088050 /nfs/dbraw/zinc/08/80/50/285088050.db2.gz LESXPSUFPCFZIU-SNVBAGLBSA-N 1 1 332.187 2.422 10 5 EEBEMO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC[N@H+]2CCOC[C@H]2C1 ZINC000408106497 285088053 /nfs/dbraw/zinc/08/80/53/285088053.db2.gz LESXPSUFPCFZIU-SNVBAGLBSA-N 1 1 332.187 2.422 10 5 EEBEMO Cc1nccn1C[C@H]1CCC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154412540 224250318 /nfs/dbraw/zinc/25/03/18/224250318.db2.gz SWKRWXFGQZKWMC-SJORKVTESA-N 1 1 330.388 2.298 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000117282124 292236878 /nfs/dbraw/zinc/23/68/78/292236878.db2.gz UBNGXNWFOIGFNE-RZIFZGNASA-N 1 1 347.415 2.177 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)/C=C/c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000117282124 292236879 /nfs/dbraw/zinc/23/68/79/292236879.db2.gz UBNGXNWFOIGFNE-RZIFZGNASA-N 1 1 347.415 2.177 10 5 EEBEMO Cn1cc([C@@H]2CCC[N@H+]2CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cn1 ZINC000173313159 152158726 /nfs/dbraw/zinc/15/87/26/152158726.db2.gz RAGMKLYQAPNZHK-INIZCTEOSA-N 1 1 343.387 2.494 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H]1CCCO1 ZINC000076300042 159083567 /nfs/dbraw/zinc/08/35/67/159083567.db2.gz PMAAGIJEEKMSJQ-ZDUSSCGKSA-N 1 1 337.376 2.043 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)COc2ccccc2[N+](=O)[O-])[C@H](C)C1 ZINC000076492469 159087586 /nfs/dbraw/zinc/08/75/86/159087586.db2.gz QDKHGHUAVMVAPE-KGLIPLIRSA-N 1 1 335.404 2.162 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CN1CCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000109753721 159352493 /nfs/dbraw/zinc/35/24/93/159352493.db2.gz CHLOBDPJIYXTEB-GOSISDBHSA-N 1 1 332.448 2.197 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1ccc([N+](=O)[O-])c2cccnc12 ZINC000245662900 160246841 /nfs/dbraw/zinc/24/68/41/160246841.db2.gz ACLRCYWZDPAQOW-STQMWFEESA-N 1 1 340.383 2.452 10 5 EEBEMO C[C@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000352031829 162038193 /nfs/dbraw/zinc/03/81/93/162038193.db2.gz HLQJWNCBVVMRJV-IINYFYTJSA-N 1 1 335.385 2.307 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2ccc([N+](=O)[O-])cc2OC)[C@H](C)C1 ZINC000277357223 269149803 /nfs/dbraw/zinc/14/98/03/269149803.db2.gz CAAHFGHJFQHRPT-DOMZBBRYSA-N 1 1 335.404 2.406 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2cc([N+](=O)[O-])c(F)cc2N)[C@@H](C)C1 ZINC000279566492 269288973 /nfs/dbraw/zinc/28/89/73/269288973.db2.gz ZBGGXBJFJGDVKD-IINYFYTJSA-N 1 1 338.383 2.118 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@](F)(C(=O)NCCc2cccc([N+](=O)[O-])c2)C1 ZINC000291368886 275298591 /nfs/dbraw/zinc/29/85/91/275298591.db2.gz UOFJUPXPBSTODD-KRWDZBQOSA-N 1 1 337.395 2.466 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000408025123 288311996 /nfs/dbraw/zinc/31/19/96/288311996.db2.gz OFRMECRMXGWHHR-NEPJUHHUSA-N 1 1 328.372 2.385 10 5 EEBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCc1cccc([N+](=O)[O-])c1 ZINC000176014347 311432509 /nfs/dbraw/zinc/43/25/09/311432509.db2.gz KWDRGEQOJDNRMW-MRXNPFEDSA-N 1 1 343.387 2.474 10 5 EEBEMO CN(C(=O)CSc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](C2CC2)C1 ZINC000347906069 465300703 /nfs/dbraw/zinc/30/07/03/465300703.db2.gz ZTVZTHYGENBIGK-ZDUSSCGKSA-N 1 1 335.429 2.382 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1CC ZINC000116769285 462772224 /nfs/dbraw/zinc/77/22/24/462772224.db2.gz PELKPNUQJPPFQF-HNNXBMFYSA-N 1 1 349.431 2.476 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2cc([N+](=O)[O-])ccc2C)C[C@@H]1CC ZINC000116769285 462772226 /nfs/dbraw/zinc/77/22/26/462772226.db2.gz PELKPNUQJPPFQF-HNNXBMFYSA-N 1 1 349.431 2.476 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000117279444 462790746 /nfs/dbraw/zinc/79/07/46/462790746.db2.gz STKNHQMGGMFZSY-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)C[C@H]1C ZINC000117279444 462790752 /nfs/dbraw/zinc/79/07/52/462790752.db2.gz STKNHQMGGMFZSY-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CC[C@H](CO)[NH+]1CCN(C(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000092927194 462992727 /nfs/dbraw/zinc/99/27/27/462992727.db2.gz QMKPSHWCQPUJMS-OAHLLOKOSA-N 1 1 349.431 2.049 10 5 EEBEMO Cc1c(C[N@H+]2CCCN(c3cccnn3)CC2)cccc1[N+](=O)[O-] ZINC000105799924 463467960 /nfs/dbraw/zinc/46/79/60/463467960.db2.gz RTUXWSFHQWPVJY-UHFFFAOYSA-N 1 1 327.388 2.406 10 5 EEBEMO CC[C@@H](NC(=O)CC[NH+]1CCN(CC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000177808144 463795835 /nfs/dbraw/zinc/79/58/35/463795835.db2.gz ZUPHLWKRKQNXIU-QGZVFWFLSA-N 1 1 348.447 2.190 10 5 EEBEMO CC(C)C[C@H](CO)[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185359391 463807954 /nfs/dbraw/zinc/80/79/54/463807954.db2.gz OUIKVABOLOMYER-CQSZACIVSA-N 1 1 334.376 2.484 10 5 EEBEMO CC(C)C[C@H](CO)[N@@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185359391 463807957 /nfs/dbraw/zinc/80/79/57/463807957.db2.gz OUIKVABOLOMYER-CQSZACIVSA-N 1 1 334.376 2.484 10 5 EEBEMO Cc1ccc([C@@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000173654116 464302071 /nfs/dbraw/zinc/30/20/71/464302071.db2.gz FVAZTOOEQDQVNV-GJZGRUSLSA-N 1 1 334.376 2.281 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)c1cc(OC)c(C)c([N+](=O)[O-])c1 ZINC000188705249 464348308 /nfs/dbraw/zinc/34/83/08/464348308.db2.gz FAQHEMWQVKKQED-CQSZACIVSA-N 1 1 335.404 2.468 10 5 EEBEMO 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/nfs/dbraw/zinc/84/28/05/464842805.db2.gz WOXIASQBVMSEEU-UHFFFAOYSA-N 1 1 340.855 2.364 10 5 EEBEMO CC[C@@H]1CN(Cc2nc3cc([N+](=O)[O-])ccc3o2)CC[N@H+]1CCOC ZINC000177054957 464918852 /nfs/dbraw/zinc/91/88/52/464918852.db2.gz GUWCCVODWFQBTL-CYBMUJFWSA-N 1 1 348.403 2.279 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NCC[N@H+](C)Cc1ccc(F)cc1 ZINC000177068509 464922245 /nfs/dbraw/zinc/92/22/45/464922245.db2.gz NLSCAYQDDNPNKY-UHFFFAOYSA-N 1 1 346.362 2.299 10 5 EEBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)c1cc([N+](=O)[O-])cnc1C ZINC000177193366 464954420 /nfs/dbraw/zinc/95/44/20/464954420.db2.gz MIVDNSJRBRDTRR-ZDUSSCGKSA-N 1 1 329.360 2.108 10 5 EEBEMO CNC(=O)CC[C@H]1CCCC[N@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000353167815 465689587 /nfs/dbraw/zinc/68/95/87/465689587.db2.gz BVSYDICTFNHHNI-CQSZACIVSA-N 1 1 335.404 2.484 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000362451455 465750424 /nfs/dbraw/zinc/75/04/24/465750424.db2.gz SQZJOTHMTMNCSG-WFASDCNBSA-N 1 1 349.387 2.043 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000362451455 465750431 /nfs/dbraw/zinc/75/04/31/465750431.db2.gz SQZJOTHMTMNCSG-WFASDCNBSA-N 1 1 349.387 2.043 10 5 EEBEMO CC(C)[N@@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)[C@@H]1CCOC1 ZINC000361402266 465963545 /nfs/dbraw/zinc/96/35/45/465963545.db2.gz HUGLLOVPWZGXCZ-CQSZACIVSA-N 1 1 349.387 2.392 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1CCC(=O)NCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000357345708 465968996 /nfs/dbraw/zinc/96/89/96/465968996.db2.gz KRCOQMDOVZRESN-GFCCVEGCSA-N 1 1 345.403 2.352 10 5 EEBEMO C[C@H]1CCC[N@H+]1C1CCN(c2ccc3ncc([N+](=O)[O-])n3n2)CC1 ZINC000301911644 466059824 /nfs/dbraw/zinc/05/98/24/466059824.db2.gz BTAIDFYPNUUDIR-LBPRGKRZSA-N 1 1 330.392 2.091 10 5 EEBEMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@@H]1CC[N@H+]1C1CCCCC1 ZINC000600228826 468501826 /nfs/dbraw/zinc/50/18/26/468501826.db2.gz GFQYODPKLIKUKN-ZDUSSCGKSA-N 1 1 332.404 2.314 10 5 EEBEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000364325986 466694098 /nfs/dbraw/zinc/69/40/98/466694098.db2.gz SPXSZWPNDFWDQA-KGLIPLIRSA-N 1 1 340.351 2.276 10 5 EEBEMO CCOC(=O)C[C@H]1C[C@H](OC)C[N@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000364325986 466694102 /nfs/dbraw/zinc/69/41/02/466694102.db2.gz SPXSZWPNDFWDQA-KGLIPLIRSA-N 1 1 340.351 2.276 10 5 EEBEMO CC[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC)[C@@H]1CCOC1 ZINC000411743355 466890539 /nfs/dbraw/zinc/89/05/39/466890539.db2.gz IKQIWAABGPSJLB-CYBMUJFWSA-N 1 1 337.376 2.043 10 5 EEBEMO C[C@@H]1CN(c2nccc3cc([N+](=O)[O-])ccc32)[C@@H](C)C[N@H+]1CCO ZINC000419008243 467161483 /nfs/dbraw/zinc/16/14/83/467161483.db2.gz VJODXKSTSVYDIZ-OLZOCXBDSA-N 1 1 330.388 2.034 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000450951821 467214094 /nfs/dbraw/zinc/21/40/94/467214094.db2.gz GPMFUAPCAWJXRT-SNVBAGLBSA-N 1 1 333.310 2.116 10 5 EEBEMO C[C@@H]1C[C@H](C)C[N@H+](CCCCNC(=O)c2ccc([N+](=O)[O-])cn2)C1 ZINC000531624145 468065779 /nfs/dbraw/zinc/06/57/79/468065779.db2.gz HEUZFLHDKPQFHH-OKILXGFUSA-N 1 1 334.420 2.478 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600468691 468566217 /nfs/dbraw/zinc/56/62/17/468566217.db2.gz GLTNCHBCJLEHFH-AWEZNQCLSA-N 1 1 333.388 2.350 10 5 EEBEMO CC1(CC(F)F)C[NH+](C[C@H](O)COc2ccccc2[N+](=O)[O-])C1 ZINC000592446553 468700346 /nfs/dbraw/zinc/70/03/46/468700346.db2.gz GOKVHCLJQAAGGE-NSHDSACASA-N 1 1 330.331 2.312 10 5 EEBEMO CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](C)C1 ZINC000597946298 468721113 /nfs/dbraw/zinc/72/11/13/468721113.db2.gz NSAQHUVGGZNEGA-CQSZACIVSA-N 1 1 335.404 2.225 10 5 EEBEMO C[C@@H]1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CS1(=O)=O ZINC000594975190 468736205 /nfs/dbraw/zinc/73/62/05/468736205.db2.gz MISIIFZAUWHLDR-MWLCHTKSSA-N 1 1 332.809 2.304 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)C[C@@H]1Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601128850 468754153 /nfs/dbraw/zinc/75/41/53/468754153.db2.gz DZXLSNAGONFMHJ-APPZFPTMSA-N 1 1 333.314 2.242 10 5 EEBEMO C[C@](CO)([NH2+]Cc1cccc2c1OCO2)c1cccc([N+](=O)[O-])c1 ZINC000601149536 468761353 /nfs/dbraw/zinc/76/13/53/468761353.db2.gz NTOBUFWFFOLVSR-QGZVFWFLSA-N 1 1 330.340 2.321 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CC[C@@]2(C1)CCC[N@@H+](C)C2 ZINC000601168741 468768651 /nfs/dbraw/zinc/76/86/51/468768651.db2.gz BEOYVWGAALYGTQ-ZDUSSCGKSA-N 1 1 347.341 2.269 10 5 EEBEMO Cc1cc(S(=O)(=O)N(C)[C@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])s1 ZINC000601355885 468837255 /nfs/dbraw/zinc/83/72/55/468837255.db2.gz AMVXBQVXKNJBIJ-KOLCDFICSA-N 1 1 347.462 2.068 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000599552023 469290803 /nfs/dbraw/zinc/29/08/03/469290803.db2.gz COJOKRDWQXGQNZ-BMFZPTHFSA-N 1 1 338.429 2.304 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC([N@H+]2CC[C@@H](O)C2)CC1 ZINC000596540900 469297522 /nfs/dbraw/zinc/29/75/22/469297522.db2.gz VVZOVVKYWYEQGR-OAHLLOKOSA-N 1 1 342.399 2.178 10 5 EEBEMO COc1ccc(OCC[N@H+]2C[C@@H]3CCC[C@]3(CO)C2)c([N+](=O)[O-])c1 ZINC000599639314 469318803 /nfs/dbraw/zinc/31/88/03/469318803.db2.gz BUUSMCAQIFZMTI-SUMWQHHRSA-N 1 1 336.388 2.077 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2CCO[C@@H](CCF)C2)cccc1[N+](=O)[O-] ZINC000599639985 469320096 /nfs/dbraw/zinc/32/00/96/469320096.db2.gz AZJXRGCBLQBNFM-ZDUSSCGKSA-N 1 1 339.367 2.292 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CCO[C@@H](CCF)C2)cccc1[N+](=O)[O-] ZINC000599639985 469320101 /nfs/dbraw/zinc/32/01/01/469320101.db2.gz AZJXRGCBLQBNFM-ZDUSSCGKSA-N 1 1 339.367 2.292 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)NCCCCc2ccc([N+](=O)[O-])cc2)C1 ZINC000610105213 469980882 /nfs/dbraw/zinc/98/08/82/469980882.db2.gz HYEKLWLXPPKWJS-OAHLLOKOSA-N 1 1 334.420 2.311 10 5 EEBEMO CC[N@@H+](CCc1nccs1)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000159255303 528607579 /nfs/dbraw/zinc/60/75/79/528607579.db2.gz FUTUDQHAGVFCKA-UHFFFAOYSA-N 1 1 334.401 2.215 10 5 EEBEMO Cc1nc(CC(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cs1 ZINC001690994509 1176435073 /nfs/dbraw/zinc/43/50/73/1176435073.db2.gz HBIVXHLQORCZSS-UHFFFAOYSA-N 1 1 348.428 2.150 10 5 EEBEMO CCN(CC[NH2+]Cc1cc(F)ccc1Cl)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001268450521 1182636024 /nfs/dbraw/zinc/63/60/24/1182636024.db2.gz WYTGZRJOJDIRIF-TZMCWYRMSA-N 1 1 343.786 2.082 10 5 EEBEMO CC(C)(C)CCC[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001481897130 1182907818 /nfs/dbraw/zinc/90/78/18/1182907818.db2.gz OXKVJPAOMZHVOY-ZIAGYGMSSA-N 1 1 325.453 2.497 10 5 EEBEMO C[C@H](CN[C@H](C)c1c(F)cccc1[N+](=O)[O-])C[NH+]1CCN(C)CC1 ZINC000872031405 1198030635 /nfs/dbraw/zinc/03/06/35/1198030635.db2.gz JMQGAZUXSXJUDP-ZIAGYGMSSA-N 1 1 338.427 2.268 10 5 EEBEMO C[C@@H]([NH2+]C[C@@H]1CCCCS1(=O)=O)c1c(F)cccc1[N+](=O)[O-] ZINC000872059090 1198036420 /nfs/dbraw/zinc/03/64/20/1198036420.db2.gz BEACRVXIJXSSDY-MNOVXSKESA-N 1 1 330.381 2.352 10 5 EEBEMO C[N@H+]1CCC[C@H]2[C@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000874827780 1199023142 /nfs/dbraw/zinc/02/31/42/1199023142.db2.gz UDCHRVBDJIGCEV-HZMVEIRTSA-N 1 1 329.400 2.393 10 5 EEBEMO C[N@H+]1CCN(c2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])CCC1(C)C ZINC000866114232 1201436438 /nfs/dbraw/zinc/43/64/38/1201436438.db2.gz IXRRFQNWQHAMLF-UHFFFAOYSA-N 1 1 346.431 2.408 10 5 EEBEMO CCOC(=O)c1cc(N2CC[C@@H]3[C@@H](CC[N@H+]3C)C2)ccc1[N+](=O)[O-] ZINC000866207535 1201464598 /nfs/dbraw/zinc/46/45/98/1201464598.db2.gz XEIXJYSVZSUXLP-SWLSCSKDSA-N 1 1 333.388 2.302 10 5 EEBEMO CCCCC(=O)NC1(CO)CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001274891981 1205201874 /nfs/dbraw/zinc/20/18/74/1205201874.db2.gz UEBYWDXCUZJVQE-UHFFFAOYSA-N 1 1 349.431 2.228 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@@H]12 ZINC000928100226 1206343388 /nfs/dbraw/zinc/34/33/88/1206343388.db2.gz UFRFSKINBBMTPA-CABCVRRESA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@@H]12 ZINC000928100226 1206343390 /nfs/dbraw/zinc/34/33/90/1206343390.db2.gz UFRFSKINBBMTPA-CABCVRRESA-N 1 1 335.429 2.213 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931290565 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EEBEMO C[C@H]1[C@H](C(F)(F)F)CC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223319 465498802 /nfs/dbraw/zinc/49/88/02/465498802.db2.gz FEDCQAHKLHWXFD-GZMMTYOYSA-N 1 1 331.294 2.466 10 5 EEBEMO C[C@H]1[C@H](C(F)(F)F)CC[N@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000348223319 465498807 /nfs/dbraw/zinc/49/88/07/465498807.db2.gz FEDCQAHKLHWXFD-GZMMTYOYSA-N 1 1 331.294 2.466 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000362448990 465748354 /nfs/dbraw/zinc/74/83/54/465748354.db2.gz NSROXMNXFIPFNQ-BBRMVZONSA-N 1 1 333.388 2.343 10 5 EEBEMO CC[C@H]1C[N@H+]2CCC[C@H]2CN1c1ccc([N+](=O)[O-])c(C(=O)OC)c1 ZINC000301969163 466069513 /nfs/dbraw/zinc/06/95/13/466069513.db2.gz ZXGFMWPULPLQCQ-JSGCOSHPSA-N 1 1 333.388 2.444 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](c3ccnc(N)n3)C2)ccc1[N+](=O)[O-] ZINC000338376947 466073687 /nfs/dbraw/zinc/07/36/87/466073687.db2.gz SGVLECWLANBKDW-CYBMUJFWSA-N 1 1 343.387 2.355 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(c2ncc(Br)cc2[N+](=O)[O-])C1 ZINC000302757265 466180268 /nfs/dbraw/zinc/18/02/68/466180268.db2.gz IYLUXWXYQMPICF-SNVBAGLBSA-N 1 1 329.198 2.283 10 5 EEBEMO COC(=O)c1cc(N2CCC[N@H+]3CCC[C@H]3C2)cc(C)c1[N+](=O)[O-] ZINC000362197653 466616522 /nfs/dbraw/zinc/61/65/22/466616522.db2.gz HQHBNWFUJQNAPZ-ZDUSSCGKSA-N 1 1 333.388 2.364 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc([N+](=O)[O-])c2cnccc21 ZINC000419010701 467161608 /nfs/dbraw/zinc/16/16/08/467161608.db2.gz YNAGIRDHYJKEMR-STQMWFEESA-N 1 1 330.388 2.034 10 5 EEBEMO C[C@]12CC[N@@H+](C[C@H](O)COc3cccc([N+](=O)[O-])c3)C[C@H]1C2(F)F ZINC000428721062 467262044 /nfs/dbraw/zinc/26/20/44/467262044.db2.gz SKUANFXGCPKYGJ-CFVMTHIKSA-N 1 1 342.342 2.312 10 5 EEBEMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1ccccc1[N+](=O)[O-] ZINC000420454742 467412663 /nfs/dbraw/zinc/41/26/63/467412663.db2.gz DOUIADGCZOTPDJ-UHFFFAOYSA-N 1 1 347.396 2.202 10 5 EEBEMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1cccc([N+](=O)[O-])c1 ZINC000420461208 467415275 /nfs/dbraw/zinc/41/52/75/467415275.db2.gz OCTFCCYMORMFOG-UHFFFAOYSA-N 1 1 347.396 2.202 10 5 EEBEMO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)[C@@H]1CCN2CCO[C@H]1C2 ZINC000449357529 467632979 /nfs/dbraw/zinc/63/29/79/467632979.db2.gz AXCLKJLRFMUAND-IOTGCTKJSA-N 1 1 331.416 2.403 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000517937210 468102241 /nfs/dbraw/zinc/10/22/41/468102241.db2.gz PBXVRUAEHDUYGX-SFHVURJKSA-N 1 1 346.431 2.307 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCOCC3(CCC3)C2)c1 ZINC000589510423 468158253 /nfs/dbraw/zinc/15/82/53/468158253.db2.gz OEKTWRDMXBFTMZ-UHFFFAOYSA-N 1 1 334.372 2.384 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCOCC3(CCC3)C2)c1 ZINC000589510423 468158257 /nfs/dbraw/zinc/15/82/57/468158257.db2.gz OEKTWRDMXBFTMZ-UHFFFAOYSA-N 1 1 334.372 2.384 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(C(=O)c3cc([N+](=O)[O-])cc(C(F)(F)F)c3)[C@@H]2C1 ZINC000590045956 468207089 /nfs/dbraw/zinc/20/70/89/468207089.db2.gz ZDCKLRSTMQPZBC-TVQRCGJNSA-N 1 1 343.305 2.390 10 5 EEBEMO Cc1[nH+]cn(CCCCc2noc(-c3c([N+](=O)[O-])cnn3C)n2)c1C ZINC000594535577 468616884 /nfs/dbraw/zinc/61/68/84/468616884.db2.gz YUYNWJANSJKJCT-UHFFFAOYSA-N 1 1 345.363 2.215 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000597861368 468697253 /nfs/dbraw/zinc/69/72/53/468697253.db2.gz SUJQBLRARQCLEZ-SNVBAGLBSA-N 1 1 341.358 2.405 10 5 EEBEMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595442618 468854297 /nfs/dbraw/zinc/85/42/97/468854297.db2.gz VSKBUVNCXQMFKY-ZIAGYGMSSA-N 1 1 340.351 2.276 10 5 EEBEMO CCOC(=O)C[C@H]1C[C@@H](OC)C[N@H+]1Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595442618 468854300 /nfs/dbraw/zinc/85/43/00/468854300.db2.gz VSKBUVNCXQMFKY-ZIAGYGMSSA-N 1 1 340.351 2.276 10 5 EEBEMO COCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C(C)(C)C1 ZINC000593336912 468943045 /nfs/dbraw/zinc/94/30/45/468943045.db2.gz AWBCBBNLFSPRIU-UHFFFAOYSA-N 1 1 335.404 2.086 10 5 EEBEMO COCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C(C)(C)C1 ZINC000593336912 468943049 /nfs/dbraw/zinc/94/30/49/468943049.db2.gz AWBCBBNLFSPRIU-UHFFFAOYSA-N 1 1 335.404 2.086 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](C(=O)NC(C)C)C2)ccc1[N+](=O)[O-] ZINC000595849195 469042222 /nfs/dbraw/zinc/04/22/22/469042222.db2.gz DPMSIQSGWLPWTH-CQSZACIVSA-N 1 1 335.404 2.340 10 5 EEBEMO NC(=O)c1cccc2c1CC[N@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000595902514 469074147 /nfs/dbraw/zinc/07/41/47/469074147.db2.gz KRHARKTVVOCHAP-UHFFFAOYSA-N 1 1 341.367 2.131 10 5 EEBEMO NC(=O)c1cccc2c1CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC000595902514 469074154 /nfs/dbraw/zinc/07/41/54/469074154.db2.gz KRHARKTVVOCHAP-UHFFFAOYSA-N 1 1 341.367 2.131 10 5 EEBEMO C[C@@H](C[N@H+](C)CCCN(C)C)Nc1nc2ccccc2cc1[N+](=O)[O-] ZINC000596362018 469251680 /nfs/dbraw/zinc/25/16/80/469251680.db2.gz YBYJKZUBSBPQPY-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EEBEMO C[C@@H](C[N@@H+](C)CCCN(C)C)Nc1nc2ccccc2cc1[N+](=O)[O-] ZINC000596362018 469251683 /nfs/dbraw/zinc/25/16/83/469251683.db2.gz YBYJKZUBSBPQPY-AWEZNQCLSA-N 1 1 345.447 2.827 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCN(C[C@@H]3CCCC[N@@H+]3C)CC2)n1 ZINC000611616406 469293854 /nfs/dbraw/zinc/29/38/54/469293854.db2.gz LVNDBNYCFYWLFP-INIZCTEOSA-N 1 1 347.463 2.213 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H]1CCCC[N@H+]1CCO ZINC000452796736 485481108 /nfs/dbraw/zinc/48/11/08/485481108.db2.gz LDWPLVZBXMCHFP-HNNXBMFYSA-N 1 1 349.431 2.097 10 5 EEBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776591526 577463602 /nfs/dbraw/zinc/46/36/02/577463602.db2.gz IUOPSDFXFQUQGF-DZGCQCFKSA-N 1 1 336.388 2.292 10 5 EEBEMO COCC[N@H+]1CCC[C@@H](NC(=O)/C(C)=C/c2ccc([N+](=O)[O-])cc2)C1 ZINC000755264230 577822642 /nfs/dbraw/zinc/82/26/42/577822642.db2.gz VXQVGUYTFIOTSU-WCRPCQDQSA-N 1 1 347.415 2.225 10 5 EEBEMO COC(=O)[C@H]1[C@H](C[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)C1(F)F ZINC000894679814 683022003 /nfs/dbraw/zinc/02/20/03/683022003.db2.gz UHLVKLUJTBVIGG-QWHCGFSZSA-N 1 1 328.315 2.123 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1c(C)c(C)ccc1[N+](=O)[O-] ZINC000896137146 684855941 /nfs/dbraw/zinc/85/59/41/684855941.db2.gz BOYSBCJAFIGWMS-CQSZACIVSA-N 1 1 335.404 2.052 10 5 EEBEMO Cc1c[nH]c(C(=O)NCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC001266613876 1176989214 /nfs/dbraw/zinc/98/92/14/1176989214.db2.gz JMAFHGPQTDZPLZ-UHFFFAOYSA-N 1 1 343.387 2.021 10 5 EEBEMO Cc1c[nH]c(C(=O)NCC[N@@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC001266613876 1176989217 /nfs/dbraw/zinc/98/92/17/1176989217.db2.gz JMAFHGPQTDZPLZ-UHFFFAOYSA-N 1 1 343.387 2.021 10 5 EEBEMO CN(CC[NH2+]Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cc(C2CC2)[nH]n1 ZINC001266843180 1177528490 /nfs/dbraw/zinc/52/84/90/1177528490.db2.gz FXNZIBXFDJZTIL-UHFFFAOYSA-N 1 1 343.387 2.057 10 5 EEBEMO O=C(CCc1ccoc1)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001267678104 1180147421 /nfs/dbraw/zinc/14/74/21/1180147421.db2.gz MLDOPHRBMHSTKY-UHFFFAOYSA-N 1 1 343.383 2.369 10 5 EEBEMO Cc1ccc(F)cc1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001267837881 1180611171 /nfs/dbraw/zinc/61/11/71/1180611171.db2.gz OPYDBSACIWFOSS-HZPDHXFCSA-N 1 1 349.406 2.318 10 5 EEBEMO Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)cc1 ZINC001482218568 1184269920 /nfs/dbraw/zinc/26/99/20/1184269920.db2.gz RAUQAPGNPSFTLI-HZPDHXFCSA-N 1 1 331.416 2.179 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC2 ZINC000880183503 1201415394 /nfs/dbraw/zinc/41/53/94/1201415394.db2.gz SWAAGTJTHVVEND-UXLLHSPISA-N 1 1 334.372 2.046 10 5 EEBEMO C[C@H](NC(=O)N1CC[C@H]2[C@H](CC[N@H+]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000868121026 1201747724 /nfs/dbraw/zinc/74/77/24/1201747724.db2.gz CXMNERFBXQPQDX-BJJXKVORSA-N 1 1 332.404 2.391 10 5 EEBEMO Cc1c(CNC(=O)N2CC[C@H]3[C@H](CC[N@@H+]3C)C2)cccc1[N+](=O)[O-] ZINC000868535408 1201829632 /nfs/dbraw/zinc/82/96/32/1201829632.db2.gz RVEWXHJCVFDXEV-ZBFHGGJFSA-N 1 1 332.404 2.139 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@H+]1C[C@@H]2CCC[C@]2(C(F)(F)F)C1 ZINC000886615452 1202534241 /nfs/dbraw/zinc/53/42/41/1202534241.db2.gz GSDWMXRCGXNXJL-FZMZJTMJSA-N 1 1 345.321 2.421 10 5 EEBEMO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C)CCc1ccc2c(c1)OCO2 ZINC000887093303 1204199985 /nfs/dbraw/zinc/19/99/85/1204199985.db2.gz GXRWREADHKRPSC-UHFFFAOYSA-N 1 1 332.360 2.003 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000928083978 1206336827 /nfs/dbraw/zinc/33/68/27/1206336827.db2.gz BYPDLEMDKKBMPX-TZMCWYRMSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928083978 1206336830 /nfs/dbraw/zinc/33/68/30/1206336830.db2.gz BYPDLEMDKKBMPX-TZMCWYRMSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@@H]1[C@@H](N[C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000903300103 1240204290 /nfs/dbraw/zinc/20/42/90/1240204290.db2.gz GESOGZBCLMTGFN-UHOFOFEASA-N 1 1 329.404 2.100 10 5 EEBEMO COC(=O)C[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000852413774 1292105448 /nfs/dbraw/zinc/10/54/48/1292105448.db2.gz AJNOEUQZNPDWBS-MRXNPFEDSA-N 1 1 336.388 2.436 10 5 EEBEMO COC(=O)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000852413774 1292105455 /nfs/dbraw/zinc/10/54/55/1292105455.db2.gz AJNOEUQZNPDWBS-MRXNPFEDSA-N 1 1 336.388 2.436 10 5 EEBEMO CCCCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3C[C@H]3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276900380 1300176236 /nfs/dbraw/zinc/17/62/36/1300176236.db2.gz IEMZUPYETISGMU-AHCXZYCDSA-N 1 1 337.464 2.402 10 5 EEBEMO CCCCCC[N@@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276900380 1300176243 /nfs/dbraw/zinc/17/62/43/1300176243.db2.gz IEMZUPYETISGMU-AHCXZYCDSA-N 1 1 337.464 2.402 10 5 EEBEMO CCCCCC[N@H+]1C[C@@]2(C)CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]2(C)C1 ZINC001276900380 1300176249 /nfs/dbraw/zinc/17/62/49/1300176249.db2.gz IEMZUPYETISGMU-AHCXZYCDSA-N 1 1 337.464 2.402 10 5 EEBEMO COc1ccc(C[N@@H+](C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)cc1 ZINC001278907794 1318630767 /nfs/dbraw/zinc/63/07/67/1318630767.db2.gz IZKLZEUUUONTRN-IAGOWNOFSA-N 1 1 349.431 2.029 10 5 EEBEMO COc1ccc(C[N@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)cc1 ZINC001278907794 1318630776 /nfs/dbraw/zinc/63/07/76/1318630776.db2.gz IZKLZEUUUONTRN-IAGOWNOFSA-N 1 1 349.431 2.029 10 5 EEBEMO COc1ccc(C[N@@H+](C)CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)cc1 ZINC001278907794 1318630787 /nfs/dbraw/zinc/63/07/87/1318630787.db2.gz IZKLZEUUUONTRN-IAGOWNOFSA-N 1 1 349.431 2.029 10 5 EEBEMO CCc1ncoc1C(=O)NCCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001265920857 1323487500 /nfs/dbraw/zinc/48/75/00/1323487500.db2.gz AMPPUHOXQXAAFT-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO CCn1cc(C(=O)NCC[N@@H+](CC)Cc2cccc([N+](=O)[O-])c2)cn1 ZINC001317478157 1331628456 /nfs/dbraw/zinc/62/84/56/1331628456.db2.gz VVODMLGSGAUGBI-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO CCc1ccccc1C[NH2+]CC1(NC(=O)[C@@H]2CC2[N+](=O)[O-])CCCC1 ZINC001318631775 1332570783 /nfs/dbraw/zinc/57/07/83/1332570783.db2.gz FSLJQAJGULOLPS-IAGOWNOFSA-N 1 1 345.443 2.433 10 5 EEBEMO 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5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000595330533 468815080 /nfs/dbraw/zinc/81/50/80/468815080.db2.gz LIJNKFMZVZIWIN-INIZCTEOSA-N 1 1 337.395 2.421 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000595330533 468815083 /nfs/dbraw/zinc/81/50/83/468815083.db2.gz LIJNKFMZVZIWIN-INIZCTEOSA-N 1 1 337.395 2.421 10 5 EEBEMO C[C@@]12COC[C@H]1C[N@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760924 468994156 /nfs/dbraw/zinc/99/41/56/468994156.db2.gz VFXCVBULQDQYHP-MLGOLLRUSA-N 1 1 330.344 2.113 10 5 EEBEMO C[C@@]12COC[C@H]1C[N@@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760924 468994163 /nfs/dbraw/zinc/99/41/63/468994163.db2.gz VFXCVBULQDQYHP-MLGOLLRUSA-N 1 1 330.344 2.113 10 5 EEBEMO CN(CCC[NH+]1CCN(C)CC1)c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599043414 469096872 /nfs/dbraw/zinc/09/68/72/469096872.db2.gz LCMXGEODPLRFSK-UHFFFAOYSA-N 1 1 343.431 2.217 10 5 EEBEMO CO[C@H]1C[C@@H](C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000599093076 469117109 /nfs/dbraw/zinc/11/71/09/469117109.db2.gz UWSYUPRVYJMICT-UHOFOFEASA-N 1 1 330.388 2.432 10 5 EEBEMO O=C(Cc1ccc(F)cc1[N+](=O)[O-])N1CC[NH2+][C@H](c2ccccc2)C1 ZINC000593737261 469118351 /nfs/dbraw/zinc/11/83/51/469118351.db2.gz HRVUQSUWLYODPD-INIZCTEOSA-N 1 1 343.358 2.450 10 5 EEBEMO O=C(CC[N@H+]1CCO[C@@H](C(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000601971037 469120245 /nfs/dbraw/zinc/12/02/45/469120245.db2.gz ACUOTOFEBMMSBB-CYBMUJFWSA-N 1 1 343.330 2.279 10 5 EEBEMO COc1cc(N2C[C@@H](C)[N@@H+](CCO)[C@@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596256325 469223658 /nfs/dbraw/zinc/22/36/58/469223658.db2.gz AGHDMBKCRIRHMT-PHIMTYICSA-N 1 1 343.811 2.148 10 5 EEBEMO COc1cc(N2C[C@@H](C)[N@H+](CCO)[C@@H](C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596256325 469223659 /nfs/dbraw/zinc/22/36/59/469223659.db2.gz AGHDMBKCRIRHMT-PHIMTYICSA-N 1 1 343.811 2.148 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)Nc2ccc([N+](=O)[O-])c3ccncc23)C1 ZINC000599829533 469386183 /nfs/dbraw/zinc/38/61/83/469386183.db2.gz HJWWXGDFUUSFDZ-NSHDSACASA-N 1 1 329.360 2.359 10 5 EEBEMO CCCC(=O)N[C@H]1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153897354 527953620 /nfs/dbraw/zinc/95/36/20/527953620.db2.gz UGNVXUSGFGVACB-HOCLYGCPSA-N 1 1 335.404 2.009 10 5 EEBEMO CCCC(=O)N[C@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153897354 527953631 /nfs/dbraw/zinc/95/36/31/527953631.db2.gz UGNVXUSGFGVACB-HOCLYGCPSA-N 1 1 335.404 2.009 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000177714226 529071578 /nfs/dbraw/zinc/07/15/78/529071578.db2.gz KOYSAFBCYYQKTM-XJKSGUPXSA-N 1 1 334.420 2.338 10 5 EEBEMO C/C(=C/C(=O)N[C@H](C)[C@@H](C)[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752029672 577764851 /nfs/dbraw/zinc/76/48/51/577764851.db2.gz MYTPWMQRFBAQRK-QETREBILSA-N 1 1 347.415 2.224 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@H]3COCC[C@H]32)c2ncc([N+](=O)[O-])cc12 ZINC000756888198 577852532 /nfs/dbraw/zinc/85/25/32/577852532.db2.gz OCRZXTSHMVEACI-SWLSCSKDSA-N 1 1 331.376 2.106 10 5 EEBEMO O=[N+]([O-])c1ccc(CC[N@@H+]2CCc3nc[nH]c3C23CCOCC3)cc1 ZINC000895069988 683690159 /nfs/dbraw/zinc/69/01/59/683690159.db2.gz MQOOLUYCSMVUSU-UHFFFAOYSA-N 1 1 342.399 2.424 10 5 EEBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3nc[nH]c3C23CCOCC3)cc1 ZINC000895069988 683690163 /nfs/dbraw/zinc/69/01/63/683690163.db2.gz MQOOLUYCSMVUSU-UHFFFAOYSA-N 1 1 342.399 2.424 10 5 EEBEMO Cc1nc(C(=O)NCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC001690985412 1176424387 /nfs/dbraw/zinc/42/43/87/1176424387.db2.gz DXTHYIKOLWZDKH-UHFFFAOYSA-N 1 1 332.360 2.061 10 5 EEBEMO Cc1nc(C(=O)NCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2)c(C)o1 ZINC001690985412 1176424393 /nfs/dbraw/zinc/42/43/93/1176424393.db2.gz DXTHYIKOLWZDKH-UHFFFAOYSA-N 1 1 332.360 2.061 10 5 EEBEMO CCn1nccc1C(=O)NCC[N@@H+](CC)Cc1cccc([N+](=O)[O-])c1 ZINC001691014731 1176496681 /nfs/dbraw/zinc/49/66/81/1176496681.db2.gz FZSXUGDYBNTXJL-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO O=C(NC1(C[NH2+]Cc2cccc(F)c2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001269545647 1184370759 /nfs/dbraw/zinc/37/07/59/1184370759.db2.gz XTAPNDAKKAFDRG-HUUCEWRRSA-N 1 1 335.379 2.010 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001272013650 1186957196 /nfs/dbraw/zinc/95/71/96/1186957196.db2.gz PBGRLJMSEFLTMU-IAGOWNOFSA-N 1 1 331.416 2.119 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272013650 1186957205 /nfs/dbraw/zinc/95/72/05/1186957205.db2.gz PBGRLJMSEFLTMU-IAGOWNOFSA-N 1 1 331.416 2.119 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272013650 1186957213 /nfs/dbraw/zinc/95/72/13/1186957213.db2.gz PBGRLJMSEFLTMU-IAGOWNOFSA-N 1 1 331.416 2.119 10 5 EEBEMO CC(C)CCC[NH2+]C[C@H]1CC[C@H](NC(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001484567434 1191420872 /nfs/dbraw/zinc/42/08/72/1191420872.db2.gz JZONLCOZVWAPHQ-KLHDSHLOSA-N 1 1 325.453 2.352 10 5 EEBEMO CCS(=O)(=O)C1(C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872088205 1198043436 /nfs/dbraw/zinc/04/34/36/1198043436.db2.gz LUTKRHHGOPGLKW-JTQLQIEISA-N 1 1 330.381 2.352 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[NH2+]Cc2ncc(Cl)s2)c1 ZINC000872244085 1198108212 /nfs/dbraw/zinc/10/82/12/1198108212.db2.gz BWJSZJRHFNIJHS-SNVBAGLBSA-N 1 1 343.792 2.234 10 5 EEBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850042 1200957255 /nfs/dbraw/zinc/95/72/55/1200957255.db2.gz SYJAXQMGTDANKY-KDOFPFPSSA-N 1 1 345.399 2.201 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000880609071 1201540025 /nfs/dbraw/zinc/54/00/25/1201540025.db2.gz PLPPPUAOCGFIDB-PHIMTYICSA-N 1 1 331.376 2.026 10 5 EEBEMO Cc1ccc(CNC(=O)NC2C[C@H]3CC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000868677708 1201857587 /nfs/dbraw/zinc/85/75/87/1201857587.db2.gz RREBTQUVURPYBD-GOOCMWNKSA-N 1 1 332.404 2.328 10 5 EEBEMO Cc1cc(NC(=O)NC[C@H]2CC[N@H+]2C2CCOCC2)ccc1[N+](=O)[O-] ZINC000930732587 1206578752 /nfs/dbraw/zinc/57/87/52/1206578752.db2.gz NSGADIHWNNWZDM-OAHLLOKOSA-N 1 1 348.403 2.278 10 5 EEBEMO Cc1cccc(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1[N+](=O)[O-] ZINC000096995673 1213931154 /nfs/dbraw/zinc/93/11/54/1213931154.db2.gz HDLSGWWPLBYPAG-AWEZNQCLSA-N 1 1 336.388 2.417 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1csnn1 ZINC001273541072 1279563634 /nfs/dbraw/zinc/56/36/34/1279563634.db2.gz MVMKWMVXNYLJHZ-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)c1nccnc1C ZINC001197543608 1284675170 /nfs/dbraw/zinc/67/51/70/1284675170.db2.gz ROTADISCUFYDLI-GFCCVEGCSA-N 1 1 329.360 2.291 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3OCCC[C@@H]3C2)c1 ZINC001118290350 1306335602 /nfs/dbraw/zinc/33/56/02/1306335602.db2.gz KARLPQJRHCKOBA-CJNGLKHVSA-N 1 1 334.372 2.382 10 5 EEBEMO COc1ccccc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001317467879 1331494718 /nfs/dbraw/zinc/49/47/18/1331494718.db2.gz LKLQQSBNFRDNDB-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO COc1ccccc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001317467879 1331494719 /nfs/dbraw/zinc/49/47/19/1331494719.db2.gz LKLQQSBNFRDNDB-UHFFFAOYSA-N 1 1 343.383 2.465 10 5 EEBEMO CC[N@H+](CCNC(=O)CC1CCOCC1)Cc1ccccc1[N+](=O)[O-] ZINC001317476570 1331620381 /nfs/dbraw/zinc/62/03/81/1331620381.db2.gz BLOUPHNSLFUKII-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO CC[N@@H+](CCNC(=O)CC1CCOCC1)Cc1ccccc1[N+](=O)[O-] ZINC001317476570 1331620383 /nfs/dbraw/zinc/62/03/83/1331620383.db2.gz BLOUPHNSLFUKII-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO COc1cccc(C[NH+]2CCN(c3ccncc3[N+](=O)[O-])CC2)c1 ZINC001335513922 1336388018 /nfs/dbraw/zinc/38/80/18/1336388018.db2.gz XXTXFJFYYGUDNL-UHFFFAOYSA-N 1 1 328.372 2.321 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001344683171 1337409934 /nfs/dbraw/zinc/40/99/34/1337409934.db2.gz CCRFNOCNOLJKNF-RAIGVLPGSA-N 1 1 334.376 2.065 10 5 EEBEMO C[N@H+]1CCCC12CCN(C(=O)c1cc3c(cc1[N+](=O)[O-])OCO3)CC2 ZINC001597734453 1349930703 /nfs/dbraw/zinc/93/07/03/1349930703.db2.gz CZOFPVJLSBRAJS-UHFFFAOYSA-N 1 1 347.371 2.024 10 5 EEBEMO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CO)C(C)(C)C ZINC001644971306 1352772093 /nfs/dbraw/zinc/77/20/93/1352772093.db2.gz UILDUQZDXQXVRU-CYBMUJFWSA-N 1 1 334.376 2.484 10 5 EEBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cc3nn[nH]n3)CC2)c(Cl)c1 ZINC001654683165 1354155043 /nfs/dbraw/zinc/15/50/43/1354155043.db2.gz VGZZYMXEYLJDIG-UHFFFAOYSA-N 1 1 336.783 2.216 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@H](c2cn(C)nn2)C1 ZINC001655067072 1354164650 /nfs/dbraw/zinc/16/46/50/1354164650.db2.gz VPCWKQJLOSMOEI-LBPRGKRZSA-N 1 1 331.376 2.112 10 5 EEBEMO COC(=O)[C@@]1(C)C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC001655312122 1354170612 /nfs/dbraw/zinc/17/06/12/1354170612.db2.gz PVSFZWHEBOWVPH-SJCJKPOMSA-N 1 1 349.387 2.054 10 5 EEBEMO Cc1ccnc(C(=O)NCCC[N@@H+](C)Cc2csc([N+](=O)[O-])c2)n1 ZINC001660116352 1354399709 /nfs/dbraw/zinc/39/97/09/1354399709.db2.gz JYUGAOJSZVEDCK-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO Cc1ccnc(C(=O)NCCC[N@H+](C)Cc2csc([N+](=O)[O-])c2)n1 ZINC001660116352 1354399713 /nfs/dbraw/zinc/39/97/13/1354399713.db2.gz JYUGAOJSZVEDCK-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO O=C(NCC1([NH2+]CC2CC3(CCC3)C2)CCCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001666759598 1355587073 /nfs/dbraw/zinc/58/70/73/1355587073.db2.gz CHNXTJHIGQEUGC-HUUCEWRRSA-N 1 1 335.448 2.251 10 5 EEBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1cncnc1 ZINC001673430121 1356689685 /nfs/dbraw/zinc/68/96/85/1356689685.db2.gz ZTIVBSOTQDXPHT-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)c1cncnc1 ZINC001673430121 1356689688 /nfs/dbraw/zinc/68/96/88/1356689688.db2.gz ZTIVBSOTQDXPHT-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO CNC(=O)[C@H]1CC[N@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000817282823 784624629 /nfs/dbraw/zinc/62/46/29/784624629.db2.gz LDEINOMCTRLCNA-QMMMGPOBSA-N 1 1 332.187 2.470 10 5 EEBEMO CNC(=O)[C@H]1CC[N@@H+](Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000817282823 784624632 /nfs/dbraw/zinc/62/46/32/784624632.db2.gz LDEINOMCTRLCNA-QMMMGPOBSA-N 1 1 332.187 2.470 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)c1C ZINC000907787750 784866759 /nfs/dbraw/zinc/86/67/59/784866759.db2.gz ARIKISTWGMTGJV-KBPBESRZSA-N 1 1 335.379 2.470 10 5 EEBEMO C[N@@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C(C)(C)C ZINC000912030779 787899461 /nfs/dbraw/zinc/89/94/61/787899461.db2.gz IATNJWSKDVYRMY-HNNXBMFYSA-N 1 1 349.387 2.126 10 5 EEBEMO C[N@H+]1CCN(C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)C[C@H]1C(C)(C)C ZINC000912030779 787899470 /nfs/dbraw/zinc/89/94/70/787899470.db2.gz IATNJWSKDVYRMY-HNNXBMFYSA-N 1 1 349.387 2.126 10 5 EEBEMO C[C@H]1CC[N@@H+](CCNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001136975865 788378592 /nfs/dbraw/zinc/37/85/92/788378592.db2.gz NGCWJWACKFIIFE-LBPRGKRZSA-N 1 1 342.399 2.402 10 5 EEBEMO C[C@@H]1COC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001176364865 798441325 /nfs/dbraw/zinc/44/13/25/798441325.db2.gz IBMCDEGGNTUXDQ-LDYMZIIASA-N 1 1 338.751 2.423 10 5 EEBEMO 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CCOc1cccc(N2CC[N@@H+](C[C@@H](C)O)[C@@H](CC)C2)c1[N+](=O)[O-] ZINC000183148726 464807584 /nfs/dbraw/zinc/80/75/84/464807584.db2.gz OPPCIRCUZOIZRD-KGLIPLIRSA-N 1 1 337.420 2.275 10 5 EEBEMO Cc1cc(C)cc([C@H]2CC[N@@H+](C[C@H](O)Cn3cc([N+](=O)[O-])cn3)C2)c1 ZINC000183479150 464869540 /nfs/dbraw/zinc/86/95/40/464869540.db2.gz DLOHQXLUIZFUEJ-YJBOKZPZSA-N 1 1 344.415 2.259 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)N1CC[N@H+](C)CC12CCCCC2 ZINC000176995629 464902942 /nfs/dbraw/zinc/90/29/42/464902942.db2.gz YSLIAVUXPCXQON-UHFFFAOYSA-N 1 1 332.404 2.389 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@@H+](C)CCCCO ZINC000276418709 464924853 /nfs/dbraw/zinc/92/48/53/464924853.db2.gz QPHYUSBGYCQOKZ-JTQLQIEISA-N 1 1 329.784 2.280 10 5 EEBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000177179169 464951719 /nfs/dbraw/zinc/95/17/19/464951719.db2.gz DUQDTTWLNOFANI-CQSZACIVSA-N 1 1 343.387 2.203 10 5 EEBEMO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([N@H+]2CCC[C@H]2C(N)=O)CC1 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Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[N@H+](C[C@@H](C)O)[C@H](C)C1 ZINC000302680399 466165041 /nfs/dbraw/zinc/16/50/41/466165041.db2.gz OTLWALCLJZWIIB-VXGBXAGGSA-N 1 1 327.812 2.448 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3C[C@H]4CCC[C@@H](C3)C4O)n2)cc1 ZINC000363228930 466295454 /nfs/dbraw/zinc/29/54/54/466295454.db2.gz YIFDPLNFVCEDCN-OCZCAGDBSA-N 1 1 344.371 2.238 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3C[C@H]4CCC[C@@H](C3)C4O)n2)cc1 ZINC000363228930 466295461 /nfs/dbraw/zinc/29/54/61/466295461.db2.gz YIFDPLNFVCEDCN-OCZCAGDBSA-N 1 1 344.371 2.238 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCN3CCOC[C@@H]3C2)o1 ZINC000363888542 466646833 /nfs/dbraw/zinc/64/68/33/466646833.db2.gz MRFBXEFXSRCSRW-AWEZNQCLSA-N 1 1 343.383 2.371 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCN3CCOC[C@@H]3C2)o1 ZINC000363888542 466646835 /nfs/dbraw/zinc/64/68/35/466646835.db2.gz MRFBXEFXSRCSRW-AWEZNQCLSA-N 1 1 343.383 2.371 10 5 EEBEMO O=C(CC[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1)Nc1ccccc1 ZINC000411482592 466833867 /nfs/dbraw/zinc/83/38/67/466833867.db2.gz SVPQGIIQCRCZBS-UHFFFAOYSA-N 1 1 326.356 2.377 10 5 EEBEMO O=C(c1[nH]nc2ccc([N+](=O)[O-])cc21)N1CCCC[C@@H]1[C@H]1CC[NH2+]C1 ZINC000423964023 466930257 /nfs/dbraw/zinc/93/02/57/466930257.db2.gz FPZXFJWYXJCBPW-XHDPSFHLSA-N 1 1 343.387 2.075 10 5 EEBEMO COC[C@@H]1CCC[N@@H+](C[C@H](O)COc2ccccc2[N+](=O)[O-])CC1 ZINC000452109955 467325550 /nfs/dbraw/zinc/32/55/50/467325550.db2.gz XRJUCCWSZGZWGB-CABCVRRESA-N 1 1 338.404 2.083 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](n3cccn3)C2)c1 ZINC000589737406 468180769 /nfs/dbraw/zinc/18/07/69/468180769.db2.gz NNMFZJZWJRGZJN-AWEZNQCLSA-N 1 1 330.344 2.025 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](n3cccn3)C2)c1 ZINC000589737406 468180770 /nfs/dbraw/zinc/18/07/70/468180770.db2.gz NNMFZJZWJRGZJN-AWEZNQCLSA-N 1 1 330.344 2.025 10 5 EEBEMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CC[N@@H+]1C(C)(C)C ZINC000594792337 468686945 /nfs/dbraw/zinc/68/69/45/468686945.db2.gz PMRNAGYFJRBDLX-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1c([N+](=O)[O-])cccc1S(=O)(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000594792337 468686950 /nfs/dbraw/zinc/68/69/50/468686950.db2.gz PMRNAGYFJRBDLX-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO CC1(CC(F)F)C[NH+](C[C@H](O)COc2cccc([N+](=O)[O-])c2)C1 ZINC000592446670 468699993 /nfs/dbraw/zinc/69/99/93/468699993.db2.gz MTHNORSECUXYBZ-LBPRGKRZSA-N 1 1 330.331 2.312 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1(S(=O)(=O)CC)CC1 ZINC000594993339 468740555 /nfs/dbraw/zinc/74/05/55/468740555.db2.gz OPPBEBYUUOWPGP-UHFFFAOYSA-N 1 1 342.417 2.050 10 5 EEBEMO CN(C)C(=O)N(C)[C@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000601196732 468778161 /nfs/dbraw/zinc/77/81/61/468778161.db2.gz TYLSKDITEPVSLX-ZDUSSCGKSA-N 1 1 343.387 2.335 10 5 EEBEMO C[N@H+]1C[C@@H](CNC(=O)c2ccc([N+](=O)[O-])o2)[C@H](c2ccccc2)C1 ZINC000592881660 468814399 /nfs/dbraw/zinc/81/43/99/468814399.db2.gz MXOPJRUMSLSLDA-KGLIPLIRSA-N 1 1 329.356 2.263 10 5 EEBEMO CN(CCc1ccccc1[N+](=O)[O-])C(=O)Cn1c[nH+]c2c1CCCC2 ZINC000560993229 468856774 /nfs/dbraw/zinc/85/67/74/468856774.db2.gz LARCVTQLDHBNTC-UHFFFAOYSA-N 1 1 342.399 2.371 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[NH2+][C@@H]3C[C@H](O)C34CCC4)o2)cc1 ZINC000595778564 469005161 /nfs/dbraw/zinc/00/51/61/469005161.db2.gz TUXDIVIUXXUAGU-OLZOCXBDSA-N 1 1 330.344 2.038 10 5 EEBEMO CCC1([NH+](C)C)CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CC1 ZINC000601790778 469027997 /nfs/dbraw/zinc/02/79/97/469027997.db2.gz BFVUHLIXKPMVKU-UHFFFAOYSA-N 1 1 345.403 2.418 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])c(N2CCN(C[C@H]3CCCC[N@@H+]3C)CC2)n1 ZINC000611616407 469293663 /nfs/dbraw/zinc/29/36/63/469293663.db2.gz LVNDBNYCFYWLFP-MRXNPFEDSA-N 1 1 347.463 2.213 10 5 EEBEMO CC[N@H+]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2C(=O)NC2CC2)C1 ZINC000732568149 577184715 /nfs/dbraw/zinc/18/47/15/577184715.db2.gz PXYVOWAEBBVRRF-ZDUSSCGKSA-N 1 1 332.404 2.383 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]4COCC[C@H]43)n2)c1 ZINC000756881768 577852216 /nfs/dbraw/zinc/85/22/16/577852216.db2.gz HAUREUPTFLSPSJ-GOEBONIOSA-N 1 1 343.387 2.312 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@H]4COCC[C@@H]43)n2)c1 ZINC000756881773 577852277 /nfs/dbraw/zinc/85/22/77/577852277.db2.gz HAUREUPTFLSPSJ-HOCLYGCPSA-N 1 1 343.387 2.312 10 5 EEBEMO Cn1cc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cn1 ZINC000162142062 679415086 /nfs/dbraw/zinc/41/50/86/679415086.db2.gz KBOQDUMQSQBJAR-UHFFFAOYSA-N 1 1 325.166 2.381 10 5 EEBEMO O=C(NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1cc[nH]c1 ZINC001481169893 1179981595 /nfs/dbraw/zinc/98/15/95/1179981595.db2.gz WNYWZKFCOOGUBO-UHFFFAOYSA-N 1 1 328.372 2.317 10 5 EEBEMO COCCC(=O)N1CCC(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001267714557 1180256589 /nfs/dbraw/zinc/25/65/89/1180256589.db2.gz KWYBKNVFRPMMOS-UHFFFAOYSA-N 1 1 349.431 2.302 10 5 EEBEMO CN(CCC[NH2+]Cc1ccc(Cl)s1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001268790771 1183707636 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KWXSQGPRVJGCTE-RNCFNFMXSA-N 1 1 341.209 2.140 10 5 EEBEMO C[C@@H](CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-])C[NH+]1CCN(C)CC1 ZINC000872031402 1198030847 /nfs/dbraw/zinc/03/08/47/1198030847.db2.gz JMQGAZUXSXJUDP-KBPBESRZSA-N 1 1 338.427 2.268 10 5 EEBEMO CN1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2cccnc21 ZINC000872317534 1198145094 /nfs/dbraw/zinc/14/50/94/1198145094.db2.gz VREIUAMZRZFPTM-UHFFFAOYSA-N 1 1 328.372 2.321 10 5 EEBEMO CN1CC[N@@H+](CCOc2cccc([N+](=O)[O-])c2)Cc2cccnc21 ZINC000872317534 1198145098 /nfs/dbraw/zinc/14/50/98/1198145098.db2.gz VREIUAMZRZFPTM-UHFFFAOYSA-N 1 1 328.372 2.321 10 5 EEBEMO Nc1ccc2c(c1)OCC[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000866690652 1201581426 /nfs/dbraw/zinc/58/14/26/1201581426.db2.gz FTXFTTFRLLAGSL-UHFFFAOYSA-N 1 1 329.356 2.450 10 5 EEBEMO Nc1ccc2c(c1)OCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000866690652 1201581429 /nfs/dbraw/zinc/58/14/29/1201581429.db2.gz FTXFTTFRLLAGSL-UHFFFAOYSA-N 1 1 329.356 2.450 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCN([C@@H]2CCC[N@H+](C)C2)CC1 ZINC000881985402 1201798112 /nfs/dbraw/zinc/79/81/12/1201798112.db2.gz MFHCKYPYEHMACQ-OAHLLOKOSA-N 1 1 346.431 2.014 10 5 EEBEMO C/C(=C/c1ccc([N+](=O)[O-])cc1)C(=O)N1C[C@H]2C[N@H+](C)C[C@@]2(C)C1 ZINC000887929418 1204510230 /nfs/dbraw/zinc/51/02/30/1204510230.db2.gz VWORJQSICPISFT-UTCNALHMSA-N 1 1 329.400 2.408 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC000931262552 1206620213 /nfs/dbraw/zinc/62/02/13/1206620213.db2.gz XTOMGDSUTKVURL-YVEFUNNKSA-N 1 1 348.403 2.409 10 5 EEBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679307 1207439571 /nfs/dbraw/zinc/43/95/71/1207439571.db2.gz YAPNHPRFODGMNU-HNNXBMFYSA-N 1 1 328.372 2.289 10 5 EEBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679307 1207439574 /nfs/dbraw/zinc/43/95/74/1207439574.db2.gz YAPNHPRFODGMNU-HNNXBMFYSA-N 1 1 328.372 2.289 10 5 EEBEMO C[C@@H]1[C@H](N[C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000903301992 1240208944 /nfs/dbraw/zinc/20/89/44/1240208944.db2.gz VRKNKMNXZIYPQH-WQVCFCJDSA-N 1 1 329.404 2.100 10 5 EEBEMO Cn1cc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2(CO)CCC2)cn1 ZINC000852073642 1291981996 /nfs/dbraw/zinc/98/19/96/1291981996.db2.gz WYOSTEQHFBYLNJ-INIZCTEOSA-N 1 1 348.378 2.461 10 5 EEBEMO Cc1noc(C[N@H+]2CCC[C@@H]3CC4(CC[C@@H]32)OCCO4)c1[N+](=O)[O-] ZINC000852142476 1292010838 /nfs/dbraw/zinc/01/08/38/1292010838.db2.gz ZLWBNQFHEWHJQZ-OLZOCXBDSA-N 1 1 337.376 2.399 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C[N@H+]3CC[C@H](O)C3)cc2)n1 ZINC000853795096 1292457681 /nfs/dbraw/zinc/45/76/81/1292457681.db2.gz KNBFJNKQAYBBLR-INIZCTEOSA-N 1 1 342.399 2.477 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1csnn1 ZINC001280836019 1296396899 /nfs/dbraw/zinc/39/68/99/1296396899.db2.gz QUMAQDJNQLLFNT-UHFFFAOYSA-N 1 1 349.416 2.040 10 5 EEBEMO O=[N+]([O-])c1ccnn1CN1CCC[C@H](c2[nH+]cc3n2CCCC3)C1 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O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2CCC[N@@H+](CCCO)C2)c1 ZINC000295103283 464706304 /nfs/dbraw/zinc/70/63/04/464706304.db2.gz KRBWTYYYTMJHOY-ZDUSSCGKSA-N 1 1 327.812 2.185 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)c(CN[C@H]2CCC[N@H+](CCCO)C2)c1 ZINC000295103283 464706309 /nfs/dbraw/zinc/70/63/09/464706309.db2.gz KRBWTYYYTMJHOY-ZDUSSCGKSA-N 1 1 327.812 2.185 10 5 EEBEMO CN(C(=O)c1c[nH]c2cccc([N+](=O)[O-])c12)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000342921050 465388621 /nfs/dbraw/zinc/38/86/21/465388621.db2.gz MXVXAKOBMRIJKK-GFCCVEGCSA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[NH+](C2CC2)CC1 ZINC000299373368 465722808 /nfs/dbraw/zinc/72/28/08/465722808.db2.gz ZKNMLLBNLYVWJW-LBPRGKRZSA-N 1 1 343.387 2.486 10 5 EEBEMO CCOc1ccc(C(=O)N2CC[C@H](C[N@@H+](C)CC)C2)cc1[N+](=O)[O-] ZINC000362483100 465774394 /nfs/dbraw/zinc/77/43/94/465774394.db2.gz HUKYKMLDHVEFBI-CYBMUJFWSA-N 1 1 335.404 2.407 10 5 EEBEMO COc1cc(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000353330537 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ZINC000595752932 468991078 /nfs/dbraw/zinc/99/10/78/468991078.db2.gz ZNVPGYCBZPRTNK-HBYGRHMLSA-N 1 1 332.360 2.094 10 5 EEBEMO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)[C@H]1O ZINC000595752932 468991081 /nfs/dbraw/zinc/99/10/81/468991081.db2.gz ZNVPGYCBZPRTNK-HBYGRHMLSA-N 1 1 332.360 2.094 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(C[N@H+]3CC[C@@H]4COC[C@H]4C3)n2)cc1 ZINC000595836575 469033530 /nfs/dbraw/zinc/03/35/30/469033530.db2.gz WSCFHEQRUOVPEI-CHWSQXEVSA-N 1 1 330.344 2.113 10 5 EEBEMO O=C(NCCc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000598975977 469073708 /nfs/dbraw/zinc/07/37/08/469073708.db2.gz LJZCKYFKMKDMMU-QGZVFWFLSA-N 1 1 346.431 2.453 10 5 EEBEMO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[NH+]1CCN(C)CC1 ZINC000599038419 469095576 /nfs/dbraw/zinc/09/55/76/469095576.db2.gz QCVXPWYSSPLMLC-CYBMUJFWSA-N 1 1 329.404 2.191 10 5 EEBEMO Cc1cc(C(=O)N[C@H]2C[C@H]([NH+]3CCOCC3)C2(C)C)ccc1[N+](=O)[O-] ZINC000603109531 469266990 /nfs/dbraw/zinc/26/69/90/469266990.db2.gz 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CCc1ncsc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001480873235 1176522341 /nfs/dbraw/zinc/52/23/41/1176522341.db2.gz YCVFFTQCZDAIKQ-UHFFFAOYSA-N 1 1 348.428 2.476 10 5 EEBEMO CCc1ncsc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001480873235 1176522343 /nfs/dbraw/zinc/52/23/43/1176522343.db2.gz YCVFFTQCZDAIKQ-UHFFFAOYSA-N 1 1 348.428 2.476 10 5 EEBEMO C[C@H]([NH2+]CCCN1CCC[N@@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034426 1198032118 /nfs/dbraw/zinc/03/21/18/1198032118.db2.gz OEABGLGGWBUHKE-AWEZNQCLSA-N 1 1 338.427 2.412 10 5 EEBEMO C[C@H](NCCC[N@@H+]1CCCN(C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034426 1198032122 /nfs/dbraw/zinc/03/21/22/1198032122.db2.gz OEABGLGGWBUHKE-AWEZNQCLSA-N 1 1 338.427 2.412 10 5 EEBEMO C[C@H](NCCC[N@H+]1CCCN(C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034426 1198032128 /nfs/dbraw/zinc/03/21/28/1198032128.db2.gz OEABGLGGWBUHKE-AWEZNQCLSA-N 1 1 338.427 2.412 10 5 EEBEMO C[C@H](NCCCN1CCC[N@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034426 1198032133 /nfs/dbraw/zinc/03/21/33/1198032133.db2.gz OEABGLGGWBUHKE-AWEZNQCLSA-N 1 1 338.427 2.412 10 5 EEBEMO C[C@H](NCCCN1CCC[N@@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034426 1198032139 /nfs/dbraw/zinc/03/21/39/1198032139.db2.gz OEABGLGGWBUHKE-AWEZNQCLSA-N 1 1 338.427 2.412 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC000880180518 1201413658 /nfs/dbraw/zinc/41/36/58/1201413658.db2.gz SRPSSDGDHXIZGK-WBVHZDCISA-N 1 1 334.372 2.391 10 5 EEBEMO C[C@H](NC(=O)N1CC[C@@H]2[C@@H](CC[N@H+]2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000868121027 1201747501 /nfs/dbraw/zinc/74/75/01/1201747501.db2.gz CXMNERFBXQPQDX-DUVNUKRYSA-N 1 1 332.404 2.391 10 5 EEBEMO C[C@H]1[C@H](NC(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000928424872 1206381510 /nfs/dbraw/zinc/38/15/10/1206381510.db2.gz FXOOBTFWCPXBLM-IINYFYTJSA-N 1 1 325.796 2.390 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2OC(F)F)CC[N@H+]1C ZINC000928441701 1206384299 /nfs/dbraw/zinc/38/42/99/1206384299.db2.gz TUELDBIFFDYBLX-GZMMTYOYSA-N 1 1 329.303 2.019 10 5 EEBEMO C[N@H+]1CC[C@H]1CNC(=O)Nc1ccc(Br)c([N+](=O)[O-])c1 ZINC000930544570 1206566228 /nfs/dbraw/zinc/56/62/28/1206566228.db2.gz HGKNBKVZVKZIJY-VIFPVBQESA-N 1 1 343.181 2.183 10 5 EEBEMO O=[N+]([O-])c1cccc(F)c1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931288009 1206622236 /nfs/dbraw/zinc/62/22/36/1206622236.db2.gz GTJSSWOOJAIBLS-UHFFFAOYSA-N 1 1 337.395 2.421 10 5 EEBEMO COc1ccc(CN2CCC([N@H+]3CCCOCC3)CC2)cc1[N+](=O)[O-] ZINC000931290972 1206622424 /nfs/dbraw/zinc/62/24/24/1206622424.db2.gz JGWYMRGDVWDMSZ-UHFFFAOYSA-N 1 1 349.431 2.290 10 5 EEBEMO CC(C)(C)OC(=O)[C@H]1CC[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000246233184 1212094715 /nfs/dbraw/zinc/09/47/15/1212094715.db2.gz GMWZKKGEDUMXBT-DZGCQCFKSA-N 1 1 336.388 2.292 10 5 EEBEMO O=[N+]([O-])c1ncccc1C[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC001192747680 1282140206 /nfs/dbraw/zinc/14/02/06/1282140206.db2.gz WSKNTHDDFLUJHV-GFCCVEGCSA-N 1 1 328.376 2.365 10 5 EEBEMO O=[N+]([O-])c1ncccc1C[N@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC001192747680 1282140211 /nfs/dbraw/zinc/14/02/11/1282140211.db2.gz WSKNTHDDFLUJHV-GFCCVEGCSA-N 1 1 328.376 2.365 10 5 EEBEMO O=C(NC[C@@H]1CC[N@H+]1C1CCCC1)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000863035549 1296091210 /nfs/dbraw/zinc/09/12/10/1296091210.db2.gz XAXPXUCOUFHEPL-ZDUSSCGKSA-N 1 1 348.359 2.250 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[C@H]3C[N@H+](C)C[C@H]32)c1 ZINC001124025429 1310808215 /nfs/dbraw/zinc/80/82/15/1310808215.db2.gz MWFZVHHLMKKPRZ-RRFJBIMHSA-N 1 1 347.415 2.129 10 5 EEBEMO Cc1[nH+]ccn1CCNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1 ZINC001142761535 1315725804 /nfs/dbraw/zinc/72/58/04/1315725804.db2.gz DPFAYGFNUJPRCZ-UHFFFAOYSA-N 1 1 326.715 2.322 10 5 EEBEMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)NC[C@@H]1CC[N@H+](C2CC2)C1 ZINC001291882384 1328343428 /nfs/dbraw/zinc/34/34/28/1328343428.db2.gz KNFLJVZJDATVIP-LBPRGKRZSA-N 1 1 337.807 2.391 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc(F)ccc1C ZINC001316891342 1331957306 /nfs/dbraw/zinc/95/73/06/1331957306.db2.gz XSFPRDJBXGZNRY-HZPDHXFCSA-N 1 1 337.395 2.128 10 5 EEBEMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(F)ccc1C ZINC001316891342 1331957307 /nfs/dbraw/zinc/95/73/07/1331957307.db2.gz XSFPRDJBXGZNRY-HZPDHXFCSA-N 1 1 337.395 2.128 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc(F)ccc1C ZINC001316891342 1331957311 /nfs/dbraw/zinc/95/73/11/1331957311.db2.gz XSFPRDJBXGZNRY-HZPDHXFCSA-N 1 1 337.395 2.128 10 5 EEBEMO CN1CC[NH+](C(C)(C)CNc2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC001324327537 1333658968 /nfs/dbraw/zinc/65/89/68/1333658968.db2.gz PCKWNYBPKOYITM-UHFFFAOYSA-N 1 1 343.431 2.003 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001330324397 1334823542 /nfs/dbraw/zinc/82/35/42/1334823542.db2.gz UBMGCZMVWSQAOZ-SECBINFHSA-N 1 1 333.314 2.022 10 5 EEBEMO COCCC(=O)N1CCC([N@@H+](C)Cc2csc([N+](=O)[O-])c2)CC1 ZINC001330992308 1334942851 /nfs/dbraw/zinc/94/28/51/1334942851.db2.gz YGHSDZLMPVCEAX-UHFFFAOYSA-N 1 1 341.433 2.116 10 5 EEBEMO C[C@H]1C[C@H](NC(=O)C(F)(F)Oc2cccc([N+](=O)[O-])c2)CC[N@H+]1C ZINC000848583995 1338725319 /nfs/dbraw/zinc/72/53/19/1338725319.db2.gz LBCVEWDURZWNQU-WDEREUQCSA-N 1 1 343.330 2.165 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001616345808 1352328333 /nfs/dbraw/zinc/32/83/33/1352328333.db2.gz IVRSZAMVXHJWJX-HNNXBMFYSA-N 1 1 333.388 2.057 10 5 EEBEMO CN(CC[N@@H+](C)C1CC1)C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001625432388 1352448843 /nfs/dbraw/zinc/44/88/43/1352448843.db2.gz HIELJLBSLQCEAM-UHFFFAOYSA-N 1 1 325.796 2.343 10 5 EEBEMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)CCc1cc(F)ccc1[N+](=O)[O-] ZINC001654653402 1354154614 /nfs/dbraw/zinc/15/46/14/1354154614.db2.gz NFLOXKFELQSSKP-LBPRGKRZSA-N 1 1 335.379 2.362 10 5 EEBEMO C[N@H+]1CC[C@@H](CC(=O)NCc2cc(F)c(Cl)c([N+](=O)[O-])c2)C1 ZINC000913386628 788834457 /nfs/dbraw/zinc/83/44/57/788834457.db2.gz XMRKGRGRSPOILJ-VIFPVBQESA-N 1 1 329.759 2.345 10 5 EEBEMO O=[N+]([O-])c1ccc(C[NH+]2CCC(Cn3cnnc3)CC2)c([N+](=O)[O-])c1 ZINC000844411593 789079909 /nfs/dbraw/zinc/07/99/09/789079909.db2.gz FYKOXZLMNIHZPA-UHFFFAOYSA-N 1 1 346.347 2.007 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000844433987 789120088 /nfs/dbraw/zinc/12/00/88/789120088.db2.gz PGTZHZKYGLZPQF-UKRRQHHQSA-N 1 1 342.342 2.456 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000844654308 789276923 /nfs/dbraw/zinc/27/69/23/789276923.db2.gz PNCYECYNSMQARM-UHFFFAOYSA-N 1 1 347.419 2.039 10 5 EEBEMO CCON(C)C(=O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000846062274 790049732 /nfs/dbraw/zinc/04/97/32/790049732.db2.gz BKUCKNHLMMMALF-UHFFFAOYSA-N 1 1 333.344 2.354 10 5 EEBEMO O=C(NCc1c[nH+]c2n1CCC2)[C@H]1C[C@@H]1c1cccc([N+](=O)[O-])c1 ZINC001177745199 799097212 /nfs/dbraw/zinc/09/72/12/799097212.db2.gz MKGSEVFNPIUMJB-CABCVRRESA-N 1 1 326.356 2.157 10 5 EEBEMO C[N@@H+](CCCNC(=O)CC1CCOCC1)Cc1ccccc1[N+](=O)[O-] ZINC001479763475 1098926505 /nfs/dbraw/zinc/92/65/05/1098926505.db2.gz MRJRQLKSHSEIGV-UHFFFAOYSA-N 1 1 349.431 2.350 10 5 EEBEMO CC[N@H+](CCCNC(=O)c1cocn1)Cc1csc([N+](=O)[O-])c1 ZINC001479839241 1099126267 /nfs/dbraw/zinc/12/62/67/1099126267.db2.gz OGHVLBXTVIRQGK-UHFFFAOYSA-N 1 1 338.389 2.286 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cocn1)Cc1csc([N+](=O)[O-])c1 ZINC001479839241 1099126273 /nfs/dbraw/zinc/12/62/73/1099126273.db2.gz OGHVLBXTVIRQGK-UHFFFAOYSA-N 1 1 338.389 2.286 10 5 EEBEMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N1CCc2c1cccc2[N+](=O)[O-] ZINC001456721269 1109276095 /nfs/dbraw/zinc/27/60/95/1109276095.db2.gz BWQLINHFHPOHEO-UHFFFAOYSA-N 1 1 335.323 2.378 10 5 EEBEMO C[C@@H](CNC(=O)c1cc(C[NH+](C)C)on1)c1ccccc1[N+](=O)[O-] ZINC001538550884 1124029249 /nfs/dbraw/zinc/02/92/49/1124029249.db2.gz QQONEURHOJFZNG-NSHDSACASA-N 1 1 332.360 2.178 10 5 EEBEMO CN(c1ncc(Br)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C)C1 ZINC000053250804 214172717 /nfs/dbraw/zinc/17/27/17/214172717.db2.gz VTEJOTLPOTVSPW-SNVBAGLBSA-N 1 1 329.198 2.283 10 5 EEBEMO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1CC[N@H+]2CCC[C@@H]2C1 ZINC000178629974 232321114 /nfs/dbraw/zinc/32/11/14/232321114.db2.gz YFBJILHNEXVLDH-IUODEOHRSA-N 1 1 343.387 2.486 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC(C)(C)CCN1CC[NH+](C)CC1 ZINC000184219996 235336147 /nfs/dbraw/zinc/33/61/47/235336147.db2.gz IFSSBJRBBGSVSK-UHFFFAOYSA-N 1 1 348.447 2.049 10 5 EEBEMO CCOc1ccc(NC(=O)C[NH2+][C@H](C)c2cn[nH]c2)c([N+](=O)[O-])c1 ZINC000494703085 247008298 /nfs/dbraw/zinc/00/82/98/247008298.db2.gz LVPMWYYPLWXZCR-SNVBAGLBSA-N 1 1 333.348 2.006 10 5 EEBEMO CN(C(=O)c1ccc([N+](=O)[O-])[nH]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000268772850 252224156 /nfs/dbraw/zinc/22/41/56/252224156.db2.gz YPGDBBDSHWRZAI-CQSZACIVSA-N 1 1 328.372 2.269 10 5 EEBEMO Cn1cnnc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CC1 ZINC000193736927 160185826 /nfs/dbraw/zinc/18/58/26/160185826.db2.gz 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C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C(C)(C)C)cc1 ZINC001267193912 1178470335 /nfs/dbraw/zinc/47/03/35/1178470335.db2.gz FZQGTKGIAHHHAB-HZPDHXFCSA-N 1 1 333.432 2.197 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1c[nH]cc1C)Cc1cccc([N+](=O)[O-])c1 ZINC001481016507 1179502339 /nfs/dbraw/zinc/50/23/39/1179502339.db2.gz MYFOVBFJJKPYEF-UHFFFAOYSA-N 1 1 330.388 2.483 10 5 EEBEMO COc1cc(C(=O)N[C@@H]2CC[N@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1F ZINC001269847085 1184665363 /nfs/dbraw/zinc/66/53/63/1184665363.db2.gz RCHWFHNBKVBPPR-GHMZBOCLSA-N 1 1 337.351 2.099 10 5 EEBEMO CCc1oncc1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272125909 1187935866 /nfs/dbraw/zinc/93/58/66/1187935866.db2.gz PVJLNABKEPONHI-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO CCc1oncc1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272125909 1187935869 /nfs/dbraw/zinc/93/58/69/1187935869.db2.gz PVJLNABKEPONHI-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO Cc1conc1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272145309 1187952581 /nfs/dbraw/zinc/95/25/81/1187952581.db2.gz LNHAHGGVGWEIGB-UHFFFAOYSA-N 1 1 332.360 2.095 10 5 EEBEMO Cc1conc1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001272145309 1187952584 /nfs/dbraw/zinc/95/25/84/1187952584.db2.gz LNHAHGGVGWEIGB-UHFFFAOYSA-N 1 1 332.360 2.095 10 5 EEBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1nccs1 ZINC001670876710 1190955288 /nfs/dbraw/zinc/95/52/88/1190955288.db2.gz VLSZUQISGJYLAB-UHFFFAOYSA-N 1 1 338.414 2.165 10 5 EEBEMO C[C@@H](N[C@H]1CC[N@@H+](CC(C)(C)O)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872092313 1198044373 /nfs/dbraw/zinc/04/43/73/1198044373.db2.gz OCUWHHDEVCZSAQ-NEPJUHHUSA-N 1 1 325.384 2.230 10 5 EEBEMO C[C@@H]([NH2+][C@H]1CCN(CC(C)(C)O)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872092313 1198044384 /nfs/dbraw/zinc/04/43/84/1198044384.db2.gz OCUWHHDEVCZSAQ-NEPJUHHUSA-N 1 1 325.384 2.230 10 5 EEBEMO CC(=O)c1ccc(N(C)CC[NH+]2CC3(C2)CCOCC3)c([N+](=O)[O-])c1 ZINC000866255805 1201476935 /nfs/dbraw/zinc/47/69/35/1201476935.db2.gz BZGKBRJEELEFQE-UHFFFAOYSA-N 1 1 347.415 2.346 10 5 EEBEMO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](Cc1ccc(-n3ccnc3)nc1)CC2 ZINC000779204947 1209335886 /nfs/dbraw/zinc/33/58/86/1209335886.db2.gz HYEVOKDTTGOLBA-UHFFFAOYSA-N 1 1 336.355 2.129 10 5 EEBEMO O=[N+]([O-])c1cnc2c(c1)C[N@H+](Cc1ccc(-n3ccnc3)nc1)CC2 ZINC000779204947 1209335887 /nfs/dbraw/zinc/33/58/87/1209335887.db2.gz HYEVOKDTTGOLBA-UHFFFAOYSA-N 1 1 336.355 2.129 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1CNC(=O)[C@@H]1CC[C@@H]2CCCC[N@H+]21 ZINC000900295216 1234171128 /nfs/dbraw/zinc/17/11/28/1234171128.db2.gz ZNABUFGFDJHROO-ZFWWWQNUSA-N 1 1 333.388 2.237 10 5 EEBEMO O=[N+]([O-])c1ccc(F)cc1CN1C[C@H]2CC[C@@H](C1)N2C1CC[NH2+]CC1 ZINC000903510446 1240738483 /nfs/dbraw/zinc/73/84/83/1240738483.db2.gz PRQZIWCSPVIRES-CALCHBBNSA-N 1 1 348.422 2.135 10 5 EEBEMO Cc1c(C[C@@H](C[NH3+])CN[C@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C ZINC000903988871 1242891259 /nfs/dbraw/zinc/89/12/59/1242891259.db2.gz ZQEBTNAVYZYBGY-OCCSQVGLSA-N 1 1 331.420 2.105 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)c1nccnc1C ZINC001197543612 1284674894 /nfs/dbraw/zinc/67/48/94/1284674894.db2.gz ROTADISCUFYDLI-LBPRGKRZSA-N 1 1 329.360 2.291 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001490325453 1291217934 /nfs/dbraw/zinc/21/79/34/1291217934.db2.gz SUROQBDEKWBGBI-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001490325453 1291217940 /nfs/dbraw/zinc/21/79/40/1291217940.db2.gz SUROQBDEKWBGBI-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC001490325453 1291217952 /nfs/dbraw/zinc/21/79/52/1291217952.db2.gz SUROQBDEKWBGBI-HUUCEWRRSA-N 1 1 339.823 2.333 10 5 EEBEMO COc1ccc(NC(=O)N[C@@H]2CC[C@H]3C[N@@H+](C)C[C@@H]32)c([N+](=O)[O-])c1 ZINC001123425455 1310563716 /nfs/dbraw/zinc/56/37/16/1310563716.db2.gz KSEOFQGEDFMIGV-WCFLWFBJSA-N 1 1 334.376 2.065 10 5 EEBEMO Cc1cc(NC(=O)Cn2c[nH+]cc2C)n(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001124763419 1310946960 /nfs/dbraw/zinc/94/69/60/1310946960.db2.gz KRADEUWGWMISCJ-UHFFFAOYSA-N 1 1 340.343 2.233 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC001161493713 1320517251 /nfs/dbraw/zinc/51/72/51/1320517251.db2.gz GMNWCVWQODTYEW-JTQLQIEISA-N 1 1 348.359 2.120 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC001161493713 1320517253 /nfs/dbraw/zinc/51/72/53/1320517253.db2.gz GMNWCVWQODTYEW-JTQLQIEISA-N 1 1 348.359 2.120 10 5 EEBEMO O=C(NCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccn[nH]1 ZINC001265153854 1322951996 /nfs/dbraw/zinc/95/19/96/1322951996.db2.gz LKPUVLFEEHCSED-UHFFFAOYSA-N 1 1 343.387 2.102 10 5 EEBEMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CCC[N@H+]2CCC[C@@H]2C1 ZINC001318354826 1332515329 /nfs/dbraw/zinc/51/53/29/1332515329.db2.gz UPGUKZXCVGYFJP-CYBMUJFWSA-N 1 1 328.372 2.386 10 5 EEBEMO O=[N+]([O-])CC[N@@H+]1CCC[C@H]([C@@H](O)c2ccc(Br)cc2)C1 ZINC001618266724 1352348482 /nfs/dbraw/zinc/34/84/82/1352348482.db2.gz YLENLJMRNPVRCK-JSGCOSHPSA-N 1 1 343.221 2.471 10 5 EEBEMO O=C(NC1CCN(c2cc[nH+]cc2)CC1)c1cc(O)cc([N+](=O)[O-])c1 ZINC001558799547 1342488794 /nfs/dbraw/zinc/48/87/94/1342488794.db2.gz JNDVDSWSRLVRDY-UHFFFAOYSA-N 1 1 342.355 2.094 10 5 EEBEMO CN(CC(C)(C)C[NH2+]CCc1cccs1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001570673638 1343100083 /nfs/dbraw/zinc/10/00/83/1343100083.db2.gz HUXNQYBVTYVGEU-ZIAGYGMSSA-N 1 1 339.461 2.030 10 5 EEBEMO C[C@@H]1C[N@@H+](C)[C@@H](C)CN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001596461092 1349907201 /nfs/dbraw/zinc/90/72/01/1349907201.db2.gz KOKAQWOXQBIIFA-WDEREUQCSA-N 1 1 325.796 2.342 10 5 EEBEMO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001643886118 1352755352 /nfs/dbraw/zinc/75/53/52/1352755352.db2.gz QCZSSIAERIOWGX-BDJLRTHQSA-N 1 1 332.360 2.095 10 5 EEBEMO C[C@@H]1C[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C[C@]1(C)CO ZINC001643886118 1352755356 /nfs/dbraw/zinc/75/53/56/1352755356.db2.gz QCZSSIAERIOWGX-BDJLRTHQSA-N 1 1 332.360 2.095 10 5 EEBEMO COC(=O)c1cc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)o1 ZINC001644141366 1352758241 /nfs/dbraw/zinc/75/82/41/1352758241.db2.gz MHUMMVCEGPMTGO-KRWDZBQOSA-N 1 1 348.355 2.280 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])c(N)n1 ZINC001651332522 1354048952 /nfs/dbraw/zinc/04/89/52/1354048952.db2.gz ZQCKAAMCPILMNY-TZMCWYRMSA-N 1 1 342.403 2.290 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1ncccn1)Cc1ccc([N+](=O)[O-])cc1 ZINC001566570095 1125747395 /nfs/dbraw/zinc/74/73/95/1125747395.db2.gz VAKXYCPRWSXSKF-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO C[NH+](C)Cc1ccc(C(=O)NCCNc2ccc([N+](=O)[O-])cc2)o1 ZINC001441234808 1094617411 /nfs/dbraw/zinc/61/74/11/1094617411.db2.gz GFAZVVMJVPUNBA-UHFFFAOYSA-N 1 1 332.360 2.091 10 5 EEBEMO Cn1nccc1C[C@@H]1CCC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001460970198 1110330330 /nfs/dbraw/zinc/33/03/30/1110330330.db2.gz DNHHAQCYAMRNGJ-HNNXBMFYSA-N 1 1 330.388 2.414 10 5 EEBEMO COc1cc(C(=O)NC[C@@]23CC[N@@H+](C2)CCC3)cc([N+](=O)[O-])c1C ZINC001520323533 1119145802 /nfs/dbraw/zinc/14/58/02/1119145802.db2.gz IKNYLFQKVPSWDD-QGZVFWFLSA-N 1 1 333.388 2.128 10 5 EEBEMO [NH3+][C@@H]1CCCCCN1S(=O)(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC000080988585 217347580 /nfs/dbraw/zinc/34/75/80/217347580.db2.gz MQXPIUBKCJHWLJ-LBPRGKRZSA-N 1 1 333.797 2.098 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000054647080 292140664 /nfs/dbraw/zinc/14/06/64/292140664.db2.gz QOYSQAYIDXMZON-CQSZACIVSA-N 1 1 334.420 2.311 10 5 EEBEMO CCCc1[nH]nc(C(=O)N2CCCC[C@@H]([NH+]3CCCC3)C2)c1[N+](=O)[O-] ZINC000109689053 159351025 /nfs/dbraw/zinc/35/10/25/159351025.db2.gz PLADMGIWKPVWSY-CYBMUJFWSA-N 1 1 349.435 2.361 10 5 EEBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCC[C@H]2CN2CCOCC2)c1 ZINC000109821338 159353444 /nfs/dbraw/zinc/35/34/44/159353444.db2.gz AAYXRGPAMBGXPG-KRWDZBQOSA-N 1 1 349.431 2.160 10 5 EEBEMO Cc1cc(C(=O)N2CCC([N@@H+]3CCO[C@@H](C)C3)CC2)cc([N+](=O)[O-])c1 ZINC000194449779 160194622 /nfs/dbraw/zinc/19/46/22/160194622.db2.gz BAZOJMGTIIQZNY-AWEZNQCLSA-N 1 1 347.415 2.229 10 5 EEBEMO C[N@H+]1CC[C@H]2[C@@H](CCCN2C(=O)c2cc(F)c(F)cc2[N+](=O)[O-])C1 ZINC000246245820 160269909 /nfs/dbraw/zinc/26/99/09/160269909.db2.gz JJTXGZNCAIYPSP-HZMBPMFUSA-N 1 1 339.342 2.429 10 5 EEBEMO O=[N+]([O-])c1ccc(NCCCN2CCN(c3cc[nH+]cc3)CC2)cn1 ZINC000344441093 161227822 /nfs/dbraw/zinc/22/78/22/161227822.db2.gz VGOITWGYPJDJFU-UHFFFAOYSA-N 1 1 342.403 2.009 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(N2CCN(C3C[C@H]4CC[C@@H](C3)[N@@H+]4C)CC2)n1 ZINC000364872806 165301583 /nfs/dbraw/zinc/30/15/83/165301583.db2.gz ZXBORLKFHKEIAC-XYPWUTKMSA-N 1 1 345.447 2.045 10 5 EEBEMO O=[N+]([O-])c1cnc2ccc(N3CCC[N@H+](C4CCCC4)CC3)nn21 ZINC000371343536 275041674 /nfs/dbraw/zinc/04/16/74/275041674.db2.gz FPBRIKBEDNQVPG-UHFFFAOYSA-N 1 1 330.392 2.092 10 5 EEBEMO C[N@@H+](Cc1ccccc1)C1CN(C(=O)c2cccc([O-])c2[N+](=O)[O-])C1 ZINC000288448167 275059404 /nfs/dbraw/zinc/05/94/04/275059404.db2.gz PHQOMPFBLLEFKP-UHFFFAOYSA-N 1 1 341.367 2.257 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[C@]3(CC[N@@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135097 275382132 /nfs/dbraw/zinc/38/21/32/275382132.db2.gz LRKWGWCLFMRBQS-SFHVURJKSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[C@]3(CC[N@H+](C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135097 275382135 /nfs/dbraw/zinc/38/21/35/275382135.db2.gz LRKWGWCLFMRBQS-SFHVURJKSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135097 275382137 /nfs/dbraw/zinc/38/21/37/275382137.db2.gz LRKWGWCLFMRBQS-SFHVURJKSA-N 1 1 346.431 2.259 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2CC[C@]3(CCN(C)C3)C2)cccc1[N+](=O)[O-] ZINC000292135097 275382139 /nfs/dbraw/zinc/38/21/39/275382139.db2.gz LRKWGWCLFMRBQS-SFHVURJKSA-N 1 1 346.431 2.259 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)cc1 ZINC000371065077 277137371 /nfs/dbraw/zinc/13/73/71/277137371.db2.gz UWBMHZGDBRDVJT-GDBMZVCRSA-N 1 1 344.346 2.304 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(F)cc1 ZINC000371065077 277137373 /nfs/dbraw/zinc/13/73/73/277137373.db2.gz UWBMHZGDBRDVJT-GDBMZVCRSA-N 1 1 344.346 2.304 10 5 EEBEMO COc1cccc(N2CCN(C[C@@H]3CCCC[N@H+]3C)CC2)c1[N+](=O)[O-] ZINC000185386970 278015966 /nfs/dbraw/zinc/01/59/66/278015966.db2.gz XFQNIBJKMLEJAO-HNNXBMFYSA-N 1 1 348.447 2.210 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1N1CCN(c2cc[nH+]c(N(C)C)n2)CC1 ZINC000131647289 281260011 /nfs/dbraw/zinc/26/00/11/281260011.db2.gz IKLBJKSUVVYMQR-UHFFFAOYSA-N 1 1 342.403 2.086 10 5 EEBEMO CCc1[nH+]ccn1[C@H]1CCCN(c2ccc(C(N)=O)cc2[N+](=O)[O-])C1 ZINC000122953403 288641950 /nfs/dbraw/zinc/64/19/50/288641950.db2.gz HOUCOECZLJCTHZ-ZDUSSCGKSA-N 1 1 343.387 2.294 10 5 EEBEMO CCC[N@H+]1CC[C@H](CNc2cc3c(cc2[N+](=O)[O-])OCC(=O)N3)C1 ZINC000091457262 462880641 /nfs/dbraw/zinc/88/06/41/462880641.db2.gz DMPVWRUOJSRYMQ-LLVKDONJSA-N 1 1 334.376 2.070 10 5 EEBEMO COCCN(C)C(=O)[C@@H]1CCC[N@@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000070037949 463370762 /nfs/dbraw/zinc/37/07/62/463370762.db2.gz QSHIWRXKHNRZRM-MRXNPFEDSA-N 1 1 349.431 2.220 10 5 EEBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)c2cc([N+](=O)[O-])ccc2N(C)C)C1 ZINC000161180018 463407796 /nfs/dbraw/zinc/40/77/96/463407796.db2.gz PINKPOIWHNVALC-DOMZBBRYSA-N 1 1 334.420 2.119 10 5 EEBEMO CC[C@H]1CN(Cc2ccc(OC)c([N+](=O)[O-])c2)CC[N@H+]1CCOC ZINC000106113845 463505843 /nfs/dbraw/zinc/50/58/43/463505843.db2.gz WNZLKVLSYWTJIG-HNNXBMFYSA-N 1 1 337.420 2.146 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](N3CCOCC3)C2)ccc1Cl ZINC000170812114 463710699 /nfs/dbraw/zinc/71/06/99/463710699.db2.gz OJQXQSCMNSZUST-ZDUSSCGKSA-N 1 1 325.796 2.155 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](N3CCOCC3)C2)ccc1Cl ZINC000170812114 463710704 /nfs/dbraw/zinc/71/07/04/463710704.db2.gz OJQXQSCMNSZUST-ZDUSSCGKSA-N 1 1 325.796 2.155 10 5 EEBEMO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cnc(N2CCOCC2)c(F)c1 ZINC000185070192 463746303 /nfs/dbraw/zinc/74/63/03/463746303.db2.gz FUFHRHFTNSJZIG-UHFFFAOYSA-N 1 1 346.362 2.255 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[N@H+]2CCCC[C@@H]2C1 ZINC000172803042 464145832 /nfs/dbraw/zinc/14/58/32/464145832.db2.gz VNFISRBSCRGTGC-MRXNPFEDSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCN2CCCC[C@@H]2C1 ZINC000172803042 464145837 /nfs/dbraw/zinc/14/58/37/464145837.db2.gz VNFISRBSCRGTGC-MRXNPFEDSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCN2CCCC[C@@H]2C1 ZINC000172803042 464145842 /nfs/dbraw/zinc/14/58/42/464145842.db2.gz VNFISRBSCRGTGC-MRXNPFEDSA-N 1 1 346.431 2.402 10 5 EEBEMO Cc1cc(N2CC[C@H]3OCCN(C)[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000284853337 464366184 /nfs/dbraw/zinc/36/61/84/464366184.db2.gz DVDDRMJHGRGNFX-ZWKOTPCHSA-N 1 1 342.399 2.361 10 5 EEBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc([N+](=O)[O-])c4cccnc43)C[C@@H]21 ZINC000285153412 464469867 /nfs/dbraw/zinc/46/98/67/464469867.db2.gz UBIUHLDKBFZZDD-JKSUJKDBSA-N 1 1 328.372 2.052 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCCC[C@@H]1c1cn[nH]c1 ZINC000182173752 464590386 /nfs/dbraw/zinc/59/03/86/464590386.db2.gz SYXOXBNYQWWBGY-HUUCEWRRSA-N 1 1 346.387 2.285 10 5 EEBEMO CC(C)[N@H+]1C[C@@H](C)[C@@H](NC(=O)NCCNc2ccccc2[N+](=O)[O-])C1 ZINC000176844397 464865146 /nfs/dbraw/zinc/86/51/46/464865146.db2.gz GONHBZZZCJMPLO-HIFRSBDPSA-N 1 1 349.435 2.035 10 5 EEBEMO Cc1[nH+]ccn1C[C@@H]1CCCN1C(=O)Cc1cccc([N+](=O)[O-])c1 ZINC000177178031 464951150 /nfs/dbraw/zinc/95/11/50/464951150.db2.gz UDDSRMFBQYNUOZ-INIZCTEOSA-N 1 1 328.372 2.333 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CNC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000362399406 465707270 /nfs/dbraw/zinc/70/72/70/465707270.db2.gz CZRJGGOPSQRZJO-JTQLQIEISA-N 1 1 327.331 2.016 10 5 EEBEMO COc1ccc(NC(=O)C[N@@H+]2CCC[C@@H]3COCC[C@H]32)c([N+](=O)[O-])c1 ZINC000362445656 465745816 /nfs/dbraw/zinc/74/58/16/465745816.db2.gz DSONQGBDHPNJHT-IUODEOHRSA-N 1 1 349.387 2.043 10 5 EEBEMO COc1ccc(NC(=O)C[N@H+]2CCC[C@@H]3COCC[C@H]32)c([N+](=O)[O-])c1 ZINC000362445656 465745825 /nfs/dbraw/zinc/74/58/25/465745825.db2.gz DSONQGBDHPNJHT-IUODEOHRSA-N 1 1 349.387 2.043 10 5 EEBEMO CSc1cccc(C(=O)N2CC[NH+](CCCF)CC2)c1[N+](=O)[O-] ZINC000600077150 468450550 /nfs/dbraw/zinc/45/05/50/468450550.db2.gz WGWVJXGJKKRJBD-UHFFFAOYSA-N 1 1 341.408 2.434 10 5 EEBEMO O=[N+]([O-])c1ccc(OCC[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1 ZINC000371634380 465911554 /nfs/dbraw/zinc/91/15/54/465911554.db2.gz JQTRYZWQFPQULC-QGZVFWFLSA-N 1 1 349.431 2.160 10 5 EEBEMO Cn1cc(C[N@H+]2C[C@@H]3COC[C@]3(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597210980 468480795 /nfs/dbraw/zinc/48/07/95/468480795.db2.gz JJDPVKIHHNAHQF-QAPCUYQASA-N 1 1 342.399 2.464 10 5 EEBEMO O=C(COc1ccc([N+](=O)[O-])cc1)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600230085 468502597 /nfs/dbraw/zinc/50/25/97/468502597.db2.gz ZCLSUUIVPSSMOL-MRXNPFEDSA-N 1 1 347.415 2.497 10 5 EEBEMO CC(=O)c1ccc2c(c1)CC[N@H+](CCn1ccc([N+](=O)[O-])n1)CC2 ZINC000374331819 467040465 /nfs/dbraw/zinc/04/04/65/467040465.db2.gz QOQKFEDWWIVPTG-UHFFFAOYSA-N 1 1 328.372 2.095 10 5 EEBEMO Cc1cc(N2C[C@H](C)[N@H+](CCO)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000419011142 467161279 /nfs/dbraw/zinc/16/12/79/467161279.db2.gz ZFIAETWBBGRIDF-UONOGXRCSA-N 1 1 344.415 2.343 10 5 EEBEMO C[C@H](C(=O)N1CCOC[C@@H]1[C@@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000597695096 468640872 /nfs/dbraw/zinc/64/08/72/468640872.db2.gz QALCMRACVWHJEB-RRQGHBQHSA-N 1 1 347.415 2.020 10 5 EEBEMO C[C@@]1(NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@@H+](Cc2ccccc2)C1 ZINC000583385105 468690123 /nfs/dbraw/zinc/69/01/23/468690123.db2.gz SOPBZBDTIRPTJL-GOSISDBHSA-N 1 1 340.383 2.384 10 5 EEBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@@H](C)n2ncnc21 ZINC000595069154 468752282 /nfs/dbraw/zinc/75/22/82/468752282.db2.gz NEZDPGYBTGQCSC-GYSYKLTISA-N 1 1 344.375 2.199 10 5 EEBEMO CC(C)[N@H+]1CC[C@@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601172652 468770098 /nfs/dbraw/zinc/77/00/98/468770098.db2.gz DWTJYKSTGQZJBV-SECBINFHSA-N 1 1 335.330 2.266 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C[C@@H](c1cccc(F)c1)[NH+]1CCN(c2c([N+](=O)[O-])ncn2C)CC1 ZINC000604122286 469458596 /nfs/dbraw/zinc/45/85/96/469458596.db2.gz HVCNTPRCWMIDEG-LBPRGKRZSA-N 1 1 333.367 2.351 10 5 EEBEMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)N[C@@H]1CCC[N@@H+](C)C1 ZINC000604445996 469479473 /nfs/dbraw/zinc/47/94/73/469479473.db2.gz YIWLADLCHXHDBZ-ZYHUDNBSSA-N 1 1 341.795 2.226 10 5 EEBEMO O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619574236 469642612 /nfs/dbraw/zinc/64/26/12/469642612.db2.gz JOEHJGLBTVGXPT-OCCSQVGLSA-N 1 1 346.362 2.334 10 5 EEBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000747827181 577950799 /nfs/dbraw/zinc/95/07/99/577950799.db2.gz FXJIWERFHMMMSF-CHWSQXEVSA-N 1 1 347.371 2.209 10 5 EEBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000747827181 577950800 /nfs/dbraw/zinc/95/08/00/577950800.db2.gz FXJIWERFHMMMSF-CHWSQXEVSA-N 1 1 347.371 2.209 10 5 EEBEMO Cc1ocnc1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001691203395 1177711239 /nfs/dbraw/zinc/71/12/39/1177711239.db2.gz SNLQCGQAPBCFDH-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO O=C(NCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccns1 ZINC001481171198 1179982854 /nfs/dbraw/zinc/98/28/54/1179982854.db2.gz UELQGAKKFYQCIX-UHFFFAOYSA-N 1 1 346.412 2.446 10 5 EEBEMO CCN(CC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001268450135 1182633783 /nfs/dbraw/zinc/63/37/83/1182633783.db2.gz QCLQQAYWVFOWQZ-IAGOWNOFSA-N 1 1 331.416 2.167 10 5 EEBEMO CN(C(=O)C[N@@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2O)c1ccc([N+](=O)[O-])cc1 ZINC000872258270 1198115673 /nfs/dbraw/zinc/11/56/73/1198115673.db2.gz AOSAIGZRFWZUML-UAGQMJEPSA-N 1 1 347.415 2.039 10 5 EEBEMO CN(C(=O)C[N@H+]1CCC[C@H]2[C@@H]1C(C)(C)[C@H]2O)c1ccc([N+](=O)[O-])cc1 ZINC000872258270 1198115674 /nfs/dbraw/zinc/11/56/74/1198115674.db2.gz AOSAIGZRFWZUML-UAGQMJEPSA-N 1 1 347.415 2.039 10 5 EEBEMO COC(=O)Cc1ccc(N[C@@H]2CCC[N@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC000865927571 1198427488 /nfs/dbraw/zinc/42/74/88/1198427488.db2.gz DGMWVBDWLFIMBT-CYBMUJFWSA-N 1 1 339.367 2.156 10 5 EEBEMO COC(=O)Cc1ccc(N[C@@H]2CCC[N@@H+](CCF)C2)c([N+](=O)[O-])c1 ZINC000865927571 1198427492 /nfs/dbraw/zinc/42/74/92/1198427492.db2.gz DGMWVBDWLFIMBT-CYBMUJFWSA-N 1 1 339.367 2.156 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000868396792 1201805559 /nfs/dbraw/zinc/80/55/59/1201805559.db2.gz NWALNIKCBWRQTK-SWLSCSKDSA-N 1 1 332.404 2.185 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC(C)([NH+]2CCOCC2)CC1 ZINC000882661014 1201915322 /nfs/dbraw/zinc/91/53/22/1201915322.db2.gz QMQIRKXKFAPSIG-UHFFFAOYSA-N 1 1 347.415 2.489 10 5 EEBEMO COc1ccc(OCCN2C[C@]3(C)C[N@@H+](C)C[C@]3(C)C2)c([N+](=O)[O-])c1 ZINC000931309873 1206623582 /nfs/dbraw/zinc/62/35/82/1206623582.db2.gz HOUJBLVROMVPHW-HDICACEKSA-N 1 1 349.431 2.256 10 5 EEBEMO COc1ccc(OCC[N@H+]2Cc3c[nH]nc3[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000931460013 1207386737 /nfs/dbraw/zinc/38/67/37/1207386737.db2.gz UPPBYPSVLSJPST-LLVKDONJSA-N 1 1 332.360 2.325 10 5 EEBEMO COc1ccc(OCC[N@@H+]2Cc3c[nH]nc3[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000931460013 1207386741 /nfs/dbraw/zinc/38/67/41/1207386741.db2.gz UPPBYPSVLSJPST-LLVKDONJSA-N 1 1 332.360 2.325 10 5 EEBEMO Cn1nccc1C1=CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000796143241 1215342412 /nfs/dbraw/zinc/34/24/12/1215342412.db2.gz OAEFCHUUCBFCMF-KRWDZBQOSA-N 1 1 328.372 2.151 10 5 EEBEMO O=C(NCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[C@H]2CCCC[N@H+]21 ZINC000900646056 1234605498 /nfs/dbraw/zinc/60/54/98/1234605498.db2.gz HLGWNATWNMFPSP-CJNGLKHVSA-N 1 1 333.388 2.107 10 5 EEBEMO COC(=O)C[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000852413772 1292106049 /nfs/dbraw/zinc/10/60/49/1292106049.db2.gz AJNOEUQZNPDWBS-INIZCTEOSA-N 1 1 336.388 2.436 10 5 EEBEMO COC(=O)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000852413772 1292106051 /nfs/dbraw/zinc/10/60/51/1292106051.db2.gz AJNOEUQZNPDWBS-INIZCTEOSA-N 1 1 336.388 2.436 10 5 EEBEMO CCc1noc(C[C@]2(O)CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856593212 1293576655 /nfs/dbraw/zinc/57/66/55/1293576655.db2.gz QGKPEPPWRDOVLX-QGZVFWFLSA-N 1 1 346.387 2.110 10 5 EEBEMO CCc1noc(C[C@]2(O)CCC[N@@H+](Cc3cccc([N+](=O)[O-])c3)C2)n1 ZINC000856593212 1293576665 /nfs/dbraw/zinc/57/66/65/1293576665.db2.gz QGKPEPPWRDOVLX-QGZVFWFLSA-N 1 1 346.387 2.110 10 5 EEBEMO C[N@@H+](CCc1ccccc1)CC(=O)Nc1ccc(N)c([N+](=O)[O-])c1 ZINC001160703670 1320240828 /nfs/dbraw/zinc/24/08/28/1320240828.db2.gz UURCKXLHROQKDE-UHFFFAOYSA-N 1 1 328.372 2.290 10 5 EEBEMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@@H]2C1 ZINC001262265231 1322265895 /nfs/dbraw/zinc/26/58/95/1322265895.db2.gz NOEUNXOWNSIBMJ-HUUCEWRRSA-N 1 1 335.379 2.410 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001319487796 1332710306 /nfs/dbraw/zinc/71/03/06/1332710306.db2.gz SGLCKXXAFBTISR-DOMZBBRYSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@@H]1c1ccc(F)cc1 ZINC001319487796 1332710309 /nfs/dbraw/zinc/71/03/09/1332710309.db2.gz SGLCKXXAFBTISR-DOMZBBRYSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(F)cc1 ZINC001319487798 1332710448 /nfs/dbraw/zinc/71/04/48/1332710448.db2.gz SGLCKXXAFBTISR-SWLSCSKDSA-N 1 1 332.335 2.237 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2ccc([N+](=O)[O-])[nH]2)[C@H]1c1ccc(F)cc1 ZINC001319487798 1332710451 /nfs/dbraw/zinc/71/04/51/1332710451.db2.gz SGLCKXXAFBTISR-SWLSCSKDSA-N 1 1 332.335 2.237 10 5 EEBEMO CC(C)c1ccccc1C[N@@H+](C)CCN(C)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001319999326 1332808148 /nfs/dbraw/zinc/80/81/48/1332808148.db2.gz DLWZBNFDKGPKDD-IAGOWNOFSA-N 1 1 333.432 2.365 10 5 EEBEMO CC(C)c1ccccc1C[N@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001319999326 1332808151 /nfs/dbraw/zinc/80/81/51/1332808151.db2.gz DLWZBNFDKGPKDD-IAGOWNOFSA-N 1 1 333.432 2.365 10 5 EEBEMO CC(C)c1ccccc1C[N@@H+](C)CCN(C)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001319999326 1332808153 /nfs/dbraw/zinc/80/81/53/1332808153.db2.gz DLWZBNFDKGPKDD-IAGOWNOFSA-N 1 1 333.432 2.365 10 5 EEBEMO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(=O)[nH]1 ZINC001473825525 1339114654 /nfs/dbraw/zinc/11/46/54/1339114654.db2.gz WBYGWRUKGBNFNU-UHFFFAOYSA-N 1 1 330.344 2.156 10 5 EEBEMO Cc1[nH]c(CNC(=O)CCCNc2ccc([N+](=O)[O-])cc2)c(C)[nH+]1 ZINC001558461719 1342478142 /nfs/dbraw/zinc/47/81/42/1342478142.db2.gz HFGILSLNWFQRBK-UHFFFAOYSA-N 1 1 331.376 2.443 10 5 EEBEMO CC[N@H+](CCNC(=O)c1snnc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567326593 1342741366 /nfs/dbraw/zinc/74/13/66/1342741366.db2.gz OHEFDPATQCXCGD-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1snnc1C)Cc1ccccc1[N+](=O)[O-] ZINC001567326593 1342741371 /nfs/dbraw/zinc/74/13/71/1342741371.db2.gz OHEFDPATQCXCGD-UHFFFAOYSA-N 1 1 349.416 2.007 10 5 EEBEMO O=C(Cc1ccc(Cl)c([N+](=O)[O-])c1)N1CC[N@@H+]2C[C@@H](F)C[C@H]2C1 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ALRFZHQUROCJMT-NVXWUHKLSA-N 1 1 333.432 2.297 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1c(C)cccc1C ZINC001479843237 1099133500 /nfs/dbraw/zinc/13/35/00/1099133500.db2.gz ALRFZHQUROCJMT-NVXWUHKLSA-N 1 1 333.432 2.297 10 5 EEBEMO COc1cc(C(=O)NCCNc2ccc(C)c[nH+]2)cc([N+](=O)[O-])c1C ZINC001456124127 1109098028 /nfs/dbraw/zinc/09/80/28/1109098028.db2.gz AEVBHAJYAUKCJA-UHFFFAOYSA-N 1 1 344.371 2.457 10 5 EEBEMO CCOC(=O)CC[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)CC1CC1 ZINC001459391527 1110166869 /nfs/dbraw/zinc/16/68/69/1110166869.db2.gz HWUKLAXHAYDWEK-INIZCTEOSA-N 1 1 336.388 2.293 10 5 EEBEMO COc1ccc(OCC[N@H+]2CC[C@@H](c3ncccn3)C2)c([N+](=O)[O-])c1 ZINC001460857201 1110326405 /nfs/dbraw/zinc/32/64/05/1110326405.db2.gz LFFQBFSLEBVDNC-CYBMUJFWSA-N 1 1 344.371 2.262 10 5 EEBEMO C[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 ZINC001473896002 1110584623 /nfs/dbraw/zinc/58/46/23/1110584623.db2.gz CSZBUNVRBQFBJP-WDNDVIMCSA-N 1 1 348.403 2.287 10 5 EEBEMO C[N@@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1[C@H]2CN(C(=O)OC(C)(C)C)C[C@H]21 ZINC001473896002 1110584625 /nfs/dbraw/zinc/58/46/25/1110584625.db2.gz CSZBUNVRBQFBJP-WDNDVIMCSA-N 1 1 348.403 2.287 10 5 EEBEMO C[C@H](C(=O)OC[C@@H]1CC[N@H+]1C1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC001526620138 1120554966 /nfs/dbraw/zinc/55/49/66/1120554966.db2.gz GWJSTCGVKYVLMS-GUYCJALGSA-N 1 1 348.399 2.495 10 5 EEBEMO O=C(NCCc1ccc([N+](=O)[O-])cc1)c1cnn(-c2cc[nH+]cc2)c1 ZINC001527955330 1120920695 /nfs/dbraw/zinc/92/06/95/1120920695.db2.gz YQXSZDBGKOFGTO-UHFFFAOYSA-N 1 1 337.339 2.148 10 5 EEBEMO CC[N@@H+]1CC[C@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001568490238 1124546467 /nfs/dbraw/zinc/54/64/67/1124546467.db2.gz IVAWUKXZDZUGHF-LBPRGKRZSA-N 1 1 331.294 2.324 10 5 EEBEMO CC[N@H+]1CC[C@H]1C(=O)NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001568490238 1124546474 /nfs/dbraw/zinc/54/64/74/1124546474.db2.gz IVAWUKXZDZUGHF-LBPRGKRZSA-N 1 1 331.294 2.324 10 5 EEBEMO COc1ccc(C(=O)N(C)CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])o1 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WKKOEMYECXUTTL-CJNGLKHVSA-N 1 1 348.403 2.088 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)N2CC[NH+](C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000125910754 292302511 /nfs/dbraw/zinc/30/25/11/292302511.db2.gz OTAIIQHGYXATDS-ZDUSSCGKSA-N 1 1 332.404 2.010 10 5 EEBEMO Cc1c(C(=O)N2CC[N@H+]3CCC[C@@H]3C2)cc([N+](=O)[O-])c(C)c1[N+](=O)[O-] ZINC000195450775 160212881 /nfs/dbraw/zinc/21/28/81/160212881.db2.gz SIXPAIYJOMMFDG-GFCCVEGCSA-N 1 1 348.359 2.040 10 5 EEBEMO C[C@@H]1CC[N@@H+](C[C@@H](O)Cn2cc([N+](=O)[O-])cn2)[C@@H](c2ccco2)C1 ZINC000247211443 160315017 /nfs/dbraw/zinc/31/50/17/160315017.db2.gz CLHFKYMKPZMCOC-BPLDGKMQSA-N 1 1 334.376 2.218 10 5 EEBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000341974960 161028580 /nfs/dbraw/zinc/02/85/80/161028580.db2.gz IBGBXBNQIREMIF-SUMWQHHRSA-N 1 1 333.388 2.424 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCCCC[C@@H]1CCO ZINC000342048699 161035287 /nfs/dbraw/zinc/03/52/87/161035287.db2.gz OBYDDXXBENKZIO-CQSZACIVSA-N 1 1 335.404 2.469 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCCCC[C@@H]1CCO ZINC000342048699 161035288 /nfs/dbraw/zinc/03/52/88/161035288.db2.gz OBYDDXXBENKZIO-CQSZACIVSA-N 1 1 335.404 2.469 10 5 EEBEMO CO[C@@H](C)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)C ZINC000343518994 161143221 /nfs/dbraw/zinc/14/32/21/161143221.db2.gz CIRJJIKSHXEOMG-UONOGXRCSA-N 1 1 326.393 2.080 10 5 EEBEMO CCCNC(=O)[C@H]1CCC[N@@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C1 ZINC000352426158 162131371 /nfs/dbraw/zinc/13/13/71/162131371.db2.gz RBFUGMOTGCKKNN-AWEZNQCLSA-N 1 1 335.404 2.342 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H]2CN2CCOCC2)c(F)c1 ZINC000352693411 162248240 /nfs/dbraw/zinc/24/82/40/162248240.db2.gz KUPIABDXHZMNEY-INIZCTEOSA-N 1 1 337.395 2.421 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2CN2CCOCC2)c(F)c1 ZINC000352693411 162248244 /nfs/dbraw/zinc/24/82/44/162248244.db2.gz KUPIABDXHZMNEY-INIZCTEOSA-N 1 1 337.395 2.421 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@H]1C ZINC000122988790 222194964 /nfs/dbraw/zinc/19/49/64/222194964.db2.gz IJUUOQGZRSUNMZ-DGCLKSJQSA-N 1 1 334.376 2.304 10 5 EEBEMO COC(=O)c1cc(N2CC[C@H]3CC[C@@H](C2)[N@H+]3C)cc(C)c1[N+](=O)[O-] ZINC000095416561 274000376 /nfs/dbraw/zinc/00/03/76/274000376.db2.gz IQYLAPSEVBAUDJ-OLZOCXBDSA-N 1 1 333.388 2.363 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000354520144 277136864 /nfs/dbraw/zinc/13/68/64/277136864.db2.gz HELNBGDMDDWDDF-BXUZGUMPSA-N 1 1 349.778 2.147 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2cc([N+](=O)[O-])n[nH]2)[C@H]1c1ccc(Cl)cc1 ZINC000354520144 277136865 /nfs/dbraw/zinc/13/68/65/277136865.db2.gz HELNBGDMDDWDDF-BXUZGUMPSA-N 1 1 349.778 2.147 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)Cc2ccc(OC)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000525033118 317037472 /nfs/dbraw/zinc/03/74/72/317037472.db2.gz BBFHXMRPYXIBIP-ZFWWWQNUSA-N 1 1 349.431 2.335 10 5 EEBEMO Cc1cc(CNC(=O)c2ccc([N+](=O)[O-])cn2)cc(N2CCCC2)[nH+]1 ZINC000577360660 320251226 /nfs/dbraw/zinc/25/12/26/320251226.db2.gz XJWDARJGBCKCHQ-UHFFFAOYSA-N 1 1 341.371 2.223 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000113271327 462584362 /nfs/dbraw/zinc/58/43/62/462584362.db2.gz PDHISCSNJFKWRW-SWLSCSKDSA-N 1 1 333.388 2.130 10 5 EEBEMO CCCn1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000128906756 462680088 /nfs/dbraw/zinc/68/00/88/462680088.db2.gz UFLAAZMLCJQUDU-AWEZNQCLSA-N 1 1 330.392 2.283 10 5 EEBEMO CCCn1cc(C[N@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cn1 ZINC000128906756 462680092 /nfs/dbraw/zinc/68/00/92/462680092.db2.gz UFLAAZMLCJQUDU-AWEZNQCLSA-N 1 1 330.392 2.283 10 5 EEBEMO Cn1cc[nH+]c1CC1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000121903970 463215221 /nfs/dbraw/zinc/21/52/21/463215221.db2.gz CQYNAPLFNLTNMY-UHFFFAOYSA-N 1 1 343.387 2.005 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)S(=O)(=O)c2csc([N+](=O)[O-])c2)[C@H](C)C1 ZINC000097162590 463339507 /nfs/dbraw/zinc/33/95/07/463339507.db2.gz MCKKHZISIGPUOQ-ZYHUDNBSSA-N 1 1 347.462 2.007 10 5 EEBEMO Cc1c(C[N@@H+]2CCCN(Cc3cnn(C)c3)CC2)cccc1[N+](=O)[O-] ZINC000105869852 463483240 /nfs/dbraw/zinc/48/32/40/463483240.db2.gz ICHSBFBUNCOZCK-UHFFFAOYSA-N 1 1 343.431 2.345 10 5 EEBEMO Cc1c(CN2CCC[N@@H+](Cc3cnn(C)c3)CC2)cccc1[N+](=O)[O-] ZINC000105869852 463483244 /nfs/dbraw/zinc/48/32/44/463483244.db2.gz ICHSBFBUNCOZCK-UHFFFAOYSA-N 1 1 343.431 2.345 10 5 EEBEMO Cc1c(CN2CCC[N@H+](Cc3cnn(C)c3)CC2)cccc1[N+](=O)[O-] ZINC000105869852 463483249 /nfs/dbraw/zinc/48/32/49/463483249.db2.gz ICHSBFBUNCOZCK-UHFFFAOYSA-N 1 1 343.431 2.345 10 5 EEBEMO CC[C@@H]1CN(c2cc(OC)c(F)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000125511779 463552056 /nfs/dbraw/zinc/55/20/56/463552056.db2.gz QZAFHSGYKMVUJO-GFCCVEGCSA-N 1 1 341.383 2.290 10 5 EEBEMO CC[N@H+]1CCC[C@H](Nc2ccc(C(=O)NC3CC3)cc2[N+](=O)[O-])C1 ZINC000112075927 463690172 /nfs/dbraw/zinc/69/01/72/463690172.db2.gz CQBXVXPREOQLJM-AWEZNQCLSA-N 1 1 332.404 2.383 10 5 EEBEMO O=C(NC1CC1)c1ccc(N2CC[N@H+]3CCCC[C@@H]3C2)c([N+](=O)[O-])c1 ZINC000112077184 463690262 /nfs/dbraw/zinc/69/02/62/463690262.db2.gz VGRMKGYOOWIKOJ-OAHLLOKOSA-N 1 1 344.415 2.162 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000173524902 464276494 /nfs/dbraw/zinc/27/64/94/464276494.db2.gz CNFMTSWDUJEBNZ-KGLIPLIRSA-N 1 1 334.420 2.256 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)N2CCC([N@@H+]3CCO[C@H](C)C3)CC2)c1 ZINC000173625408 464295639 /nfs/dbraw/zinc/29/56/39/464295639.db2.gz BJAFMFZAZXWDGP-CQSZACIVSA-N 1 1 347.415 2.229 10 5 EEBEMO CCNC(=O)C[C@@H]1CCCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000284913214 464389318 /nfs/dbraw/zinc/38/93/18/464389318.db2.gz VLHYMZIEYYSCFZ-HNNXBMFYSA-N 1 1 335.404 2.354 10 5 EEBEMO C[N@H+](Cc1cccnc1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 ZINC000190446334 464647398 /nfs/dbraw/zinc/64/73/98/464647398.db2.gz MQUBHUOELPRFRP-HNNXBMFYSA-N 1 1 327.388 2.343 10 5 EEBEMO COC(=O)c1cc(C)nc(N2CC[N@H+](C3CC3)C[C@H](C)C2)c1[N+](=O)[O-] ZINC000295067321 464694140 /nfs/dbraw/zinc/69/41/40/464694140.db2.gz ZQAORQRUTNMDOV-NSHDSACASA-N 1 1 348.403 2.005 10 5 EEBEMO CCOC(=O)C1(COC)CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000366288627 465633960 /nfs/dbraw/zinc/63/39/60/465633960.db2.gz VWIFTNNMXWODLB-UHFFFAOYSA-N 1 1 336.388 2.387 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000362452098 465751992 /nfs/dbraw/zinc/75/19/92/465751992.db2.gz UWOYZJOXAHDQIP-XJKSGUPXSA-N 1 1 333.388 2.343 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C[N@H+]1CCCC[C@H]1CN1CCOCC1 ZINC000366655009 465856859 /nfs/dbraw/zinc/85/68/59/465856859.db2.gz XPSDVZFMDYPDDF-KRWDZBQOSA-N 1 1 349.431 2.290 10 5 EEBEMO C[C@@]1(c2ccccc2)CC[N@@H+](CCn2cc([N+](=O)[O-])ccc2=O)C1 ZINC000362712770 465962444 /nfs/dbraw/zinc/96/24/44/465962444.db2.gz XKDTUGVEJOVJFM-GOSISDBHSA-N 1 1 327.384 2.420 10 5 EEBEMO CNc1ccc(C(=O)NC2C[C@H]3CCC[C@@H](C2)[N@@H+]3C)cc1[N+](=O)[O-] ZINC000325167224 466654871 /nfs/dbraw/zinc/65/48/71/466654871.db2.gz NLJATAZNGMUOBA-AGUYFDCRSA-N 1 1 332.404 2.382 10 5 EEBEMO O=C(CC[N@@H+]1CCOC[C@H]1CC(F)F)Nc1ccc([N+](=O)[O-])cc1 ZINC000411721305 466885770 /nfs/dbraw/zinc/88/57/70/466885770.db2.gz HZWDZXQWYLXENU-CYBMUJFWSA-N 1 1 343.330 2.279 10 5 EEBEMO O=C(CC[N@H+]1CCOC[C@H]1CC(F)F)Nc1ccc([N+](=O)[O-])cc1 ZINC000411721305 466885775 /nfs/dbraw/zinc/88/57/75/466885775.db2.gz HZWDZXQWYLXENU-CYBMUJFWSA-N 1 1 343.330 2.279 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](c3n[n-]c(=O)o3)C2)ccc1[N+](=O)[O-] ZINC000450897054 467199758 /nfs/dbraw/zinc/19/97/58/467199758.db2.gz PVOZZLOTVGESMF-LLVKDONJSA-N 1 1 334.332 2.072 10 5 EEBEMO C[C@@H]1C[N@H+](CCO)CCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000457116335 467758080 /nfs/dbraw/zinc/75/80/80/467758080.db2.gz IURBZPXMFYNBBW-CYBMUJFWSA-N 1 1 349.431 2.031 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000457116335 467758083 /nfs/dbraw/zinc/75/80/83/467758083.db2.gz IURBZPXMFYNBBW-CYBMUJFWSA-N 1 1 349.431 2.031 10 5 EEBEMO CCCc1n[nH]c(C(=O)NC[C@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000600470125 468567858 /nfs/dbraw/zinc/56/78/58/468567858.db2.gz GBXCORCXEOTUBS-GFCCVEGCSA-N 1 1 335.408 2.017 10 5 EEBEMO CC[N@H+]1CC[C@H]2CC[C@@H](C1)N2c1c([N+](=O)[O-])c(C(F)(F)F)nn1C ZINC000601125532 468751898 /nfs/dbraw/zinc/75/18/98/468751898.db2.gz HZNIFEOUDNQXOY-ZJUUUORDSA-N 1 1 347.341 2.410 10 5 EEBEMO Nc1nccc([C@H]2CCC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000595461342 468861997 /nfs/dbraw/zinc/86/19/97/468861997.db2.gz MIXIHKIYKKCQFC-NSHDSACASA-N 1 1 331.351 2.486 10 5 EEBEMO Nc1nccc([C@H]2CCC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000595461342 468862000 /nfs/dbraw/zinc/86/20/00/468862000.db2.gz MIXIHKIYKKCQFC-NSHDSACASA-N 1 1 331.351 2.486 10 5 EEBEMO COCC[N@H+]1CCN(CCOc2ccccc2[N+](=O)[O-])C(C)(C)C1 ZINC000593101273 468871731 /nfs/dbraw/zinc/87/17/31/468871731.db2.gz PICCLQAQCQDTPC-UHFFFAOYSA-N 1 1 337.420 2.016 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@H+]3CCC[C@](O)(C4CC4)C3)n2)c1 ZINC000595749694 468986600 /nfs/dbraw/zinc/98/66/00/468986600.db2.gz GEPFKCWVMZYYGU-QGZVFWFLSA-N 1 1 344.371 2.382 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@](O)(C4CC4)C3)n2)c1 ZINC000595749694 468986609 /nfs/dbraw/zinc/98/66/09/468986609.db2.gz GEPFKCWVMZYYGU-QGZVFWFLSA-N 1 1 344.371 2.382 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@](O)(C3CC3)C2)c2c(c1)COCO2 ZINC000595752664 468987872 /nfs/dbraw/zinc/98/78/72/468987872.db2.gz VDXJPVRSHNOIED-QGZVFWFLSA-N 1 1 334.372 2.198 10 5 EEBEMO Nc1cc(N2CC[NH+](Cc3ccsc3)CC2)cc(CO)c1[N+](=O)[O-] ZINC000587045612 469084574 /nfs/dbraw/zinc/08/45/74/469084574.db2.gz XSFVROPZYNHOHR-UHFFFAOYSA-N 1 1 348.428 2.053 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+]2C2CCCC2)n1 ZINC000599164737 469145330 /nfs/dbraw/zinc/14/53/30/469145330.db2.gz LGQXNKDEVJNAIL-GFCCVEGCSA-N 1 1 334.376 2.205 10 5 EEBEMO O=[N+]([O-])c1cc2c(cc1C[N@H+]1CCC[C@@H]3COCC[C@H]31)OCCO2 ZINC000611285352 469220295 /nfs/dbraw/zinc/22/02/95/469220295.db2.gz GKDUTKPHNQSUES-TZMCWYRMSA-N 1 1 334.372 2.367 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)CCN1c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC000596266609 469226779 /nfs/dbraw/zinc/22/67/79/469226779.db2.gz VBCTVKNPVZRSMI-JTQLQIEISA-N 1 1 333.310 2.116 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2C[C@@H]3CCC[C@]3(CO)C2)c2c(c1)COCO2 ZINC000599635457 469318251 /nfs/dbraw/zinc/31/82/51/469318251.db2.gz KEHVENXTDGTUKC-WMLDXEAASA-N 1 1 334.372 2.056 10 5 EEBEMO Cc1sc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@H](F)C2)cc1[N+](=O)[O-] ZINC000619253089 469559290 /nfs/dbraw/zinc/55/92/90/469559290.db2.gz RQCBKVPHBQYXMH-MNOVXSKESA-N 1 1 327.381 2.223 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3ccc4[nH]c5ccccc5c(=O)c4c3)[C@H]2C1 ZINC000646914849 470774176 /nfs/dbraw/zinc/77/41/76/470774176.db2.gz DUPQCUDLWGLLCW-KUHUBIRLSA-N 1 1 347.418 2.457 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)c3cccc4c(=O)c5ccccc5[nH]c34)[C@@H]2C1 ZINC000646916623 470775742 /nfs/dbraw/zinc/77/57/42/470775742.db2.gz MFGJUANBCPQNLL-FZKQIMNGSA-N 1 1 347.418 2.457 10 5 EEBEMO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1 ZINC000361578418 485659499 /nfs/dbraw/zinc/65/94/99/485659499.db2.gz RPPHKVSUMTVXOC-NSHDSACASA-N 1 1 327.768 2.298 10 5 EEBEMO CC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCOC1 ZINC000361578418 485659503 /nfs/dbraw/zinc/65/95/03/485659503.db2.gz RPPHKVSUMTVXOC-NSHDSACASA-N 1 1 327.768 2.298 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccnc2c1cccc2[N+](=O)[O-] ZINC000418990517 533985110 /nfs/dbraw/zinc/98/51/10/533985110.db2.gz CUKMQNJYVPNKEU-STQMWFEESA-N 1 1 330.388 2.034 10 5 EEBEMO CC(C)[C@H]1CC[N@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000438500866 535198719 /nfs/dbraw/zinc/19/87/19/535198719.db2.gz KJROGPMMGXWGAG-NSHDSACASA-N 1 1 335.360 2.240 10 5 EEBEMO CC(C)[C@H]1CC[N@@H+](CC(=O)Nc2cc3c(cc2[N+](=O)[O-])OCO3)C1 ZINC000438500866 535198722 /nfs/dbraw/zinc/19/87/22/535198722.db2.gz KJROGPMMGXWGAG-NSHDSACASA-N 1 1 335.360 2.240 10 5 EEBEMO C[N@@H+](CCNC(=O)c1ocnc1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001267217252 1178520919 /nfs/dbraw/zinc/52/09/19/1178520919.db2.gz CLNCAUSLMLUEOO-UHFFFAOYSA-N 1 1 344.371 2.322 10 5 EEBEMO C[N@@H+](CCNC(=O)CC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001267232887 1178559262 /nfs/dbraw/zinc/55/92/62/1178559262.db2.gz OLTQFFOEVFIDCJ-UHFFFAOYSA-N 1 1 348.447 2.019 10 5 EEBEMO CN(CCNC(=O)CC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC001267232887 1178559267 /nfs/dbraw/zinc/55/92/67/1178559267.db2.gz OLTQFFOEVFIDCJ-UHFFFAOYSA-N 1 1 348.447 2.019 10 5 EEBEMO COC(=O)[C@]12CCC[C@H]1[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000880182916 1201414930 /nfs/dbraw/zinc/41/49/30/1201414930.db2.gz FCNDCFWUQAONCR-INMHGKMJSA-N 1 1 334.372 2.046 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1N1CC[NH+](CCc2cnccn2)CC1 ZINC000866120418 1201439271 /nfs/dbraw/zinc/43/92/71/1201439271.db2.gz ZGERNEBYWFJDGA-UHFFFAOYSA-N 1 1 327.388 2.058 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)[C@@H]3C[C@H]3c3cccc([N+](=O)[O-])c3)C[C@]2(C)C1 ZINC000887938900 1204513644 /nfs/dbraw/zinc/51/36/44/1204513644.db2.gz FJPPYOGZVBIMJW-VUNQQRPYSA-N 1 1 329.400 2.108 10 5 EEBEMO CC(C)(C)OC(=O)N1CCC[C@H]1[C@@H]1CCC[N@@H+](CC[N+](=O)[O-])C1 ZINC000929429442 1206473965 /nfs/dbraw/zinc/47/39/65/1206473965.db2.gz JPCPGBTVAZZLFA-KGLIPLIRSA-N 1 1 327.425 2.375 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2ccccc2OC[C@H]1CO ZINC000934211636 1207923410 /nfs/dbraw/zinc/92/34/10/1207923410.db2.gz HJQIZWVVDMRVEN-FZKQIMNGSA-N 1 1 344.367 2.435 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CC[NH+](CCO[C@H]3CC3(F)F)CC2)cc1 ZINC000851715602 1277724823 /nfs/dbraw/zinc/72/48/23/1277724823.db2.gz ZLXMZDYQOIFBPY-AWEZNQCLSA-N 1 1 327.331 2.141 10 5 EEBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001187913389 1279697946 /nfs/dbraw/zinc/69/79/46/1279697946.db2.gz KSGLTTNVQDRCSV-KWCYVHTRSA-N 1 1 333.388 2.442 10 5 EEBEMO Cc1noc(COC(=O)[C@]2(F)CC[N@H+](C(C)(C)C)C2)c1[N+](=O)[O-] ZINC000853919280 1292527931 /nfs/dbraw/zinc/52/79/31/1292527931.db2.gz XJKAUAYVCZLCQJ-AWEZNQCLSA-N 1 1 329.328 2.147 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc(F)c([N+](=O)[O-])cc1F ZINC000855164225 1293096029 /nfs/dbraw/zinc/09/60/29/1293096029.db2.gz JSAZXKHLFHZXQJ-SECBINFHSA-N 1 1 327.331 2.476 10 5 EEBEMO CC[C@H](C)[N@@H+](C)CCN1C(=O)N[C@](C)(c2cccc([N+](=O)[O-])c2)C1=O ZINC000863503870 1296311610 /nfs/dbraw/zinc/31/16/10/1296311610.db2.gz SPUXXMBRFLMSPU-YVEFUNNKSA-N 1 1 348.403 2.092 10 5 EEBEMO C[C@@H]1CN(C(=O)c2ccc(N)c([N+](=O)[O-])c2)CC[N@H+]1C1CCCC1 ZINC001123944494 1310769164 /nfs/dbraw/zinc/76/91/64/1310769164.db2.gz YJBFIXHLUOGZAP-GFCCVEGCSA-N 1 1 332.404 2.266 10 5 EEBEMO CCc1ccc(C[NH+]2CCN(c3nn(C)cc3[N+](=O)[O-])CC2)s1 ZINC001162568546 1320900623 /nfs/dbraw/zinc/90/06/23/1320900623.db2.gz SLBRWNOTNCVBRC-UHFFFAOYSA-N 1 1 335.433 2.274 10 5 EEBEMO O=C(NCC1([NH2+]CC/C=C/c2ccccc2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480311 1324247295 /nfs/dbraw/zinc/24/72/95/1324247295.db2.gz JWMAPYFDPYGGFG-VAJLHQMSSA-N 1 1 343.427 2.384 10 5 EEBEMO Cc1c(CNC(=O)c2cnn(-c3cc[nH+]cc3)c2)cccc1[N+](=O)[O-] ZINC001585015843 1348775686 /nfs/dbraw/zinc/77/56/86/1348775686.db2.gz NKBAKKYVCCZHGH-UHFFFAOYSA-N 1 1 337.339 2.414 10 5 EEBEMO Cc1ncccc1CC(=O)NCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001317461944 1332252961 /nfs/dbraw/zinc/25/29/61/1332252961.db2.gz JPRYUGYFCAZMQD-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO O=C(COC1CCCC1)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001318108738 1332472653 /nfs/dbraw/zinc/47/26/53/1332472653.db2.gz RZFWABAVSHYXIP-UHFFFAOYSA-N 1 1 347.415 2.102 10 5 EEBEMO CCOCC(=O)N1CCC2(C[NH+](Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC001319392971 1332694266 /nfs/dbraw/zinc/69/42/66/1332694266.db2.gz LBVZEVFHAMVRPG-UHFFFAOYSA-N 1 1 347.415 2.056 10 5 EEBEMO C[S@@](=O)c1ccc(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1 ZINC001335507325 1336386294 /nfs/dbraw/zinc/38/62/94/1336386294.db2.gz QFDTWSMJWAQQCI-BXKMTCNYSA-N 1 1 348.424 2.330 10 5 EEBEMO C[N@@H+](CC(=O)N1CCCCc2ccc([N+](=O)[O-])cc21)[C@@H]1CCC[C@H]1O ZINC001557580015 1342450931 /nfs/dbraw/zinc/45/09/31/1342450931.db2.gz NRNAKKKTSNQLTM-NVXWUHKLSA-N 1 1 347.415 2.109 10 5 EEBEMO CC[C@@H](NC(=O)N1CC[C@H]2C[N@@H+](C)C[C@@H]21)c1cccc([N+](=O)[O-])c1 ZINC001679150675 1357629441 /nfs/dbraw/zinc/62/94/41/1357629441.db2.gz GSIPIXCXNZSMCQ-IMJJTQAJSA-N 1 1 332.404 2.391 10 5 EEBEMO C[C@@]12CN(C(=O)[C@@H]3CC3[N+](=O)[O-])C[C@@]1(C)C[NH+](Cc1ccccc1)C2 ZINC001641928775 1352727113 /nfs/dbraw/zinc/72/71/13/1352727113.db2.gz YSTQQFZOABZSTR-PSBWJHGTSA-N 1 1 343.427 2.022 10 5 EEBEMO COC(=O)[C@]1(C)CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001642254607 1352729247 /nfs/dbraw/zinc/72/92/47/1352729247.db2.gz NHPSWOIMEBCHRI-MRXNPFEDSA-N 1 1 346.343 2.030 10 5 EEBEMO COC(=O)[C@]1(C)CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001642254607 1352729250 /nfs/dbraw/zinc/72/92/50/1352729250.db2.gz NHPSWOIMEBCHRI-MRXNPFEDSA-N 1 1 346.343 2.030 10 5 EEBEMO C[C@@H](Nc1c2cc(F)ccc2ncc1[N+](=O)[O-])[C@@H](C)[NH+]1CCOCC1 ZINC001642236214 1352729439 /nfs/dbraw/zinc/72/94/39/1352729439.db2.gz OVARUTADUSZXOD-VXGBXAGGSA-N 1 1 348.378 2.225 10 5 EEBEMO C[NH+](C)CCSc1ccc(S(=O)(=O)C(F)F)cc1[N+](=O)[O-] ZINC001655274151 1354168961 /nfs/dbraw/zinc/16/89/61/1354168961.db2.gz YSKTWSVGTJQTDC-UHFFFAOYSA-N 1 1 340.373 2.245 10 5 EEBEMO O=[N+]([O-])c1cnc2ccc(F)cc2c1NCc1c[nH+]c2n1CCC2 ZINC001655856848 1354187584 /nfs/dbraw/zinc/18/75/84/1354187584.db2.gz WTYGGEYNTHYCIZ-UHFFFAOYSA-N 1 1 327.319 2.459 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccccc1C1CC1 ZINC001660128080 1354401292 /nfs/dbraw/zinc/40/12/92/1354401292.db2.gz GMIZXFLOXGFTLJ-IAGOWNOFSA-N 1 1 331.416 2.167 10 5 EEBEMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1C1CC1 ZINC001660128080 1354401294 /nfs/dbraw/zinc/40/12/94/1354401294.db2.gz GMIZXFLOXGFTLJ-IAGOWNOFSA-N 1 1 331.416 2.167 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccccc1C1CC1 ZINC001660128080 1354401298 /nfs/dbraw/zinc/40/12/98/1354401298.db2.gz GMIZXFLOXGFTLJ-IAGOWNOFSA-N 1 1 331.416 2.167 10 5 EEBEMO CN(CC[N@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccncc1 ZINC001698981570 1405196581 /nfs/dbraw/zinc/19/65/81/1405196581.db2.gz NXOXIDHENUDEKU-UHFFFAOYSA-N 1 1 328.372 2.194 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-])C(=O)c1ccncc1 ZINC001698981570 1405196588 /nfs/dbraw/zinc/19/65/88/1405196588.db2.gz NXOXIDHENUDEKU-UHFFFAOYSA-N 1 1 328.372 2.194 10 5 EEBEMO Cc1c(C(=O)OC[C@H]2C[N@@H+](CC(C)C)CCO2)cccc1[N+](=O)[O-] ZINC000073185333 784027363 /nfs/dbraw/zinc/02/73/63/784027363.db2.gz QFKRTACIASNBOU-CQSZACIVSA-N 1 1 336.388 2.417 10 5 EEBEMO CC(C)(C)[N@@H+]1CC[C@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911474192 787467499 /nfs/dbraw/zinc/46/74/99/787467499.db2.gz WDEAZOQUHYYQDE-LBPRGKRZSA-N 1 1 327.331 2.362 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911474192 787467504 /nfs/dbraw/zinc/46/75/04/787467504.db2.gz WDEAZOQUHYYQDE-LBPRGKRZSA-N 1 1 327.331 2.362 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000823979947 788005971 /nfs/dbraw/zinc/00/59/71/788005971.db2.gz FFYVOAXHYYVQEB-FZMZJTMJSA-N 1 1 335.408 2.371 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000844433984 789119857 /nfs/dbraw/zinc/11/98/57/789119857.db2.gz PGTZHZKYGLZPQF-HIFRSBDPSA-N 1 1 342.342 2.456 10 5 EEBEMO CN1C[C@]2(C)C[N@@H+](CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1 ZINC000823755514 798762531 /nfs/dbraw/zinc/76/25/31/798762531.db2.gz PWSFTVLXPKDDRE-HDICACEKSA-N 1 1 346.431 2.197 10 5 EEBEMO C[N@@H+]1C[C@@]2(C)CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000823755514 798762536 /nfs/dbraw/zinc/76/25/36/798762536.db2.gz PWSFTVLXPKDDRE-HDICACEKSA-N 1 1 346.431 2.197 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(CCC(=O)Nc3ccc([N+](=O)[O-])cc3)C[C@@]2(C)C1 ZINC000823755514 798762540 /nfs/dbraw/zinc/76/25/40/798762540.db2.gz PWSFTVLXPKDDRE-HDICACEKSA-N 1 1 346.431 2.197 10 5 EEBEMO CCn1ccc(C(=O)NCCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001566497923 1125664511 /nfs/dbraw/zinc/66/45/11/1125664511.db2.gz MDGUBCLRGMEWKG-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO Cn1cc([N+](=O)[O-])c(C(=O)Nc2c[nH+]ccc2Nc2ccccc2)n1 ZINC001452704621 1105653370 /nfs/dbraw/zinc/65/33/70/1105653370.db2.gz QGFPECAUPLFTPI-UHFFFAOYSA-N 1 1 338.327 2.141 10 5 EEBEMO C[C@@H](CNC(=O)c1ccc([N+](=O)[O-])cc1N)[N@@H+](C)Cc1ccccc1 ZINC001465155908 1110411993 /nfs/dbraw/zinc/41/19/93/1110411993.db2.gz CLOMDAQBMAUDGW-ZDUSSCGKSA-N 1 1 342.399 2.427 10 5 EEBEMO CN(C)c1cccc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)n1 ZINC001473713956 1110579239 /nfs/dbraw/zinc/57/92/39/1110579239.db2.gz GEIYQPOEOFBTRL-QGZVFWFLSA-N 1 1 330.388 2.053 10 5 EEBEMO O=C(C[N@@H+]1CCCC[C@@]12CCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001473895561 1110584532 /nfs/dbraw/zinc/58/45/32/1110584532.db2.gz OLBCJFFHAISKAE-SFHVURJKSA-N 1 1 345.399 2.129 10 5 EEBEMO O=C(C[N@H+]1CCCC[C@@]12CCOC2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001473895561 1110584534 /nfs/dbraw/zinc/58/45/34/1110584534.db2.gz OLBCJFFHAISKAE-SFHVURJKSA-N 1 1 345.399 2.129 10 5 EEBEMO C[C@H](CNC(=O)c1cc(C[NH+](C)C)on1)c1ccccc1[N+](=O)[O-] ZINC001538550883 1124029224 /nfs/dbraw/zinc/02/92/24/1124029224.db2.gz QQONEURHOJFZNG-LLVKDONJSA-N 1 1 332.360 2.178 10 5 EEBEMO C[C@H]1CC[C@@](CO)([N@@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000187909824 236336241 /nfs/dbraw/zinc/33/62/41/236336241.db2.gz QOFGSXMMVXXDEG-YVEFUNNKSA-N 1 1 336.388 2.444 10 5 EEBEMO C[C@@H](C[N@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)CS(C)(=O)=O ZINC000451554169 243157067 /nfs/dbraw/zinc/15/70/67/243157067.db2.gz ZLHPWPJOHCFEFQ-ZFWWWQNUSA-N 1 1 340.445 2.455 10 5 EEBEMO Cc1c(NC(=O)[C@@H](C)[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)cccc1[N+](=O)[O-] ZINC000111318080 220138330 /nfs/dbraw/zinc/13/83/30/220138330.db2.gz PZIUVDUAVWKPSC-HABKJSAYSA-N 1 1 333.388 2.218 10 5 EEBEMO Cc1c(NC(=O)[C@@H](C)[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)cccc1[N+](=O)[O-] ZINC000111318080 220138332 /nfs/dbraw/zinc/13/83/32/220138332.db2.gz PZIUVDUAVWKPSC-HABKJSAYSA-N 1 1 333.388 2.218 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1NC(=O)N1C[C@H]2CCC[N@H+]2C[C@@H]1C ZINC000091983468 218098064 /nfs/dbraw/zinc/09/80/64/218098064.db2.gz NIDPFCSSFCSQJX-WCQYABFASA-N 1 1 334.376 2.304 10 5 EEBEMO O=[N+]([O-])c1cc(CN2CCC[N@H+](C3CC3)CC2)c2c(c1)COCO2 ZINC000061041092 285086774 /nfs/dbraw/zinc/08/67/74/285086774.db2.gz QTZUCCWRSNNSEC-UHFFFAOYSA-N 1 1 333.388 2.131 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000123857298 292284351 /nfs/dbraw/zinc/28/43/51/292284351.db2.gz NFEVGASQORTFKS-CQSZACIVSA-N 1 1 349.431 2.015 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@H]1C ZINC000123857298 292284353 /nfs/dbraw/zinc/28/43/53/292284353.db2.gz NFEVGASQORTFKS-CQSZACIVSA-N 1 1 349.431 2.015 10 5 EEBEMO O=[N+]([O-])c1cccc(OCC[N@H+]2CCCC[C@@H]2CN2CCOCC2)c1 ZINC000109821335 159354030 /nfs/dbraw/zinc/35/40/30/159354030.db2.gz AAYXRGPAMBGXPG-QGZVFWFLSA-N 1 1 349.431 2.160 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000245468327 160237872 /nfs/dbraw/zinc/23/78/72/160237872.db2.gz KOYSAFBCYYQKTM-CJNGLKHVSA-N 1 1 334.420 2.338 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000245655178 160247137 /nfs/dbraw/zinc/24/71/37/160247137.db2.gz CLLKJPWGALGWHH-WBVHZDCISA-N 1 1 346.431 2.406 10 5 EEBEMO C[C@@H](CNC(=O)c1ccc(OC(F)F)c([N+](=O)[O-])c1)[N@@H+](C)C1CC1 ZINC000358969498 164026118 /nfs/dbraw/zinc/02/61/18/164026118.db2.gz CRGBMRDMIBTFFI-VIFPVBQESA-N 1 1 343.330 2.409 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H]2CN2CCOCC2)cc1F ZINC000375952492 167233208 /nfs/dbraw/zinc/23/32/08/167233208.db2.gz BUGCJPPCUZFDGI-OAHLLOKOSA-N 1 1 337.395 2.421 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2CN2CCOCC2)cc1F ZINC000375952492 167233211 /nfs/dbraw/zinc/23/32/11/167233211.db2.gz BUGCJPPCUZFDGI-OAHLLOKOSA-N 1 1 337.395 2.421 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN(C)[C@@H]1CC[N@@H+](C)[C@H](C)C1 ZINC000123808504 222334058 /nfs/dbraw/zinc/33/40/58/222334058.db2.gz SJPCSEIDKUVXKD-ZIAGYGMSSA-N 1 1 334.420 2.256 10 5 EEBEMO O=C1CCc2cc([N+](=O)[O-])c(N3CC[N@H+]4CCCC[C@@H]4C3)cc2N1 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332.360 2.095 10 5 EEBEMO CNc1c(C(=O)N2CC[NH2+][C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000457012605 1187123625 /nfs/dbraw/zinc/12/36/25/1187123625.db2.gz GMTUVIXBDGISIS-HNNXBMFYSA-N 1 1 340.383 2.423 10 5 EEBEMO Cc1ccc(C[N@H+](C)CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)c(C)n1 ZINC001486368331 1193868421 /nfs/dbraw/zinc/86/84/21/1193868421.db2.gz OFGRMMKFUHRWMS-IAGOWNOFSA-N 1 1 348.447 2.032 10 5 EEBEMO C[C@H]([NH2+]C[C@H]1CC[C@H](C(=O)N(C)C)O1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052631 1198035387 /nfs/dbraw/zinc/03/53/87/1198035387.db2.gz DUPIYDRYBLSDPJ-MISXGVKJSA-N 1 1 339.367 2.020 10 5 EEBEMO C[C@@H](NC[C@@H]1CCC[N@H+]1CCCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872076082 1198040585 /nfs/dbraw/zinc/04/05/85/1198040585.db2.gz XCSCLGHTPPNETH-OLZOCXBDSA-N 1 1 325.384 2.231 10 5 EEBEMO C[C@@H]([NH2+]C[C@@H]1CCCN1CCCO)c1c(F)cccc1[N+](=O)[O-] ZINC000872076082 1198040593 /nfs/dbraw/zinc/04/05/93/1198040593.db2.gz XCSCLGHTPPNETH-OLZOCXBDSA-N 1 1 325.384 2.231 10 5 EEBEMO 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ZINC000191182664 464792446 /nfs/dbraw/zinc/79/24/46/464792446.db2.gz AFGVOQNOKZLMSN-KCXAZCMYSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000191182664 464792449 /nfs/dbraw/zinc/79/24/49/464792449.db2.gz AFGVOQNOKZLMSN-KCXAZCMYSA-N 1 1 334.372 2.247 10 5 EEBEMO C[C@@H](CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[N@H+]1CCC[C@@H](C)C1 ZINC000301687770 466010747 /nfs/dbraw/zinc/01/07/47/466010747.db2.gz MIJGNBUWRKIWRW-NEPJUHHUSA-N 1 1 348.403 2.458 10 5 EEBEMO C[C@@H](CNc1cc2c(cc1[N+](=O)[O-])OCC(=O)N2)[N@H+]1CCC[C@H](C)C1 ZINC000301687772 466011440 /nfs/dbraw/zinc/01/14/40/466011440.db2.gz MIJGNBUWRKIWRW-RYUDHWBXSA-N 1 1 348.403 2.458 10 5 EEBEMO O=[N+]([O-])c1ccccc1/C=C/CN1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000597236499 468490511 /nfs/dbraw/zinc/49/05/11/468490511.db2.gz RAGASHOHKUHQEK-RCFWFJCLSA-N 1 1 331.416 2.139 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C[N@H+]1CCC[C@@H](c2ccnc(N)n2)C1 ZINC000368037603 466571425 /nfs/dbraw/zinc/57/14/25/466571425.db2.gz ACOYEVLJXTUUAT-CQSZACIVSA-N 1 1 327.388 2.655 10 5 EEBEMO O=C(c1cc2cc([N+](=O)[O-])ccc2s1)N1CC[NH2+]C[C@H]1C(F)F ZINC000368558717 466669187 /nfs/dbraw/zinc/66/91/87/466669187.db2.gz WKDVFSQNAGYYLA-JTQLQIEISA-N 1 1 341.339 2.489 10 5 EEBEMO COc1cc(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)c([N+](=O)[O-])cc1F ZINC000373675889 466885192 /nfs/dbraw/zinc/88/51/92/466885192.db2.gz UAWAKOWKTHVYPK-MNOVXSKESA-N 1 1 325.340 2.018 10 5 EEBEMO CCOc1cc(C[N@@H+](C[C@@H]2CCC(=O)N2)C(C)C)ccc1[N+](=O)[O-] ZINC000412074004 466996007 /nfs/dbraw/zinc/99/60/07/466996007.db2.gz JGVQZRFAXSFVES-AWEZNQCLSA-N 1 1 335.404 2.483 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449784300 467714150 /nfs/dbraw/zinc/71/41/50/467714150.db2.gz ABEQGXWVLYFVDV-AWEZNQCLSA-N 1 1 345.399 2.353 10 5 EEBEMO COC(=O)[C@@H]([NH2+]CCCNc1nc(C)cc(C)c1[N+](=O)[O-])C(C)C ZINC000450596851 467876525 /nfs/dbraw/zinc/87/65/25/467876525.db2.gz GLFRYXFJUQGZML-ZDUSSCGKSA-N 1 1 338.408 2.196 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CCN1CC[C@@]2(C1)CCC[NH2+]C2 ZINC000518187785 468108141 /nfs/dbraw/zinc/10/81/41/468108141.db2.gz IIKLCPSEMNGTCD-SFHVURJKSA-N 1 1 346.431 2.307 10 5 EEBEMO Cc1cc(OCC(=O)NC[C@H]2CC[N@H+]2C2CCCC2)ccc1[N+](=O)[O-] ZINC000600468612 468565758 /nfs/dbraw/zinc/56/57/58/468565758.db2.gz FILINWYDTBQWCL-OAHLLOKOSA-N 1 1 347.415 2.415 10 5 EEBEMO COc1cccc(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000600468716 468566250 /nfs/dbraw/zinc/56/62/50/468566250.db2.gz GYMUQOGUOXVSBJ-ZDUSSCGKSA-N 1 1 333.388 2.350 10 5 EEBEMO C[N@@H+]1CCO[C@H](CSc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000591953136 468581626 /nfs/dbraw/zinc/58/16/26/468581626.db2.gz CLZMVUMYEJLGFH-QMMMGPOBSA-N 1 1 326.403 2.022 10 5 EEBEMO C[N@H+]1CCO[C@H](CSc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000591953136 468581629 /nfs/dbraw/zinc/58/16/29/468581629.db2.gz CLZMVUMYEJLGFH-QMMMGPOBSA-N 1 1 326.403 2.022 10 5 EEBEMO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000597574904 468604381 /nfs/dbraw/zinc/60/43/81/468604381.db2.gz IRZJTILVYLKTHH-HUUCEWRRSA-N 1 1 335.379 2.470 10 5 EEBEMO CNC(=O)[C@@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000592184767 468648632 /nfs/dbraw/zinc/64/86/32/468648632.db2.gz PRHJWQLQKZXMNN-CYBMUJFWSA-N 1 1 331.294 2.095 10 5 EEBEMO C[C@@H](Nc1c([N+](=O)[O-])c(C(F)(F)F)nn1C)C1=CC[N@@H+](C)CC1 ZINC000601139638 468758539 /nfs/dbraw/zinc/75/85/39/468758539.db2.gz LCTIESDYMYIGQN-MRVPVSSYSA-N 1 1 333.314 2.409 10 5 EEBEMO O=C(NCCc1c[nH]c2ccc([N+](=O)[O-])cc12)[C@@H]1CCC[N@H+]1C1CC1 ZINC000571847498 468846949 /nfs/dbraw/zinc/84/69/49/468846949.db2.gz CHLQCXWACDBXFC-KRWDZBQOSA-N 1 1 342.399 2.362 10 5 EEBEMO CC[C@@H]1C[N@H+](C)CCCN1S(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC000601407711 468862121 /nfs/dbraw/zinc/86/21/21/468862121.db2.gz BVLSGYXBNYVGKR-LLVKDONJSA-N 1 1 347.462 2.070 10 5 EEBEMO CC[C@@H]1C[N@@H+](C)CCCN1S(=O)(=O)c1cc(C)sc1[N+](=O)[O-] ZINC000601407711 468862125 /nfs/dbraw/zinc/86/21/25/468862125.db2.gz BVLSGYXBNYVGKR-LLVKDONJSA-N 1 1 347.462 2.070 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[N@H+]1CCC[C@@H](CCF)C1 ZINC000595755015 468990367 /nfs/dbraw/zinc/99/03/67/468990367.db2.gz DZEBXTIFKOVLCB-KBPBESRZSA-N 1 1 326.368 2.406 10 5 EEBEMO C[C@@H]1CC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C[C@H](C)O1 ZINC000595781946 469007898 /nfs/dbraw/zinc/00/78/98/469007898.db2.gz WWVOTMXMYMZQRF-OLZOCXBDSA-N 1 1 349.387 2.392 10 5 EEBEMO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)c2ccnn2C)cc1[N+](=O)[O-] ZINC000599052933 469100975 /nfs/dbraw/zinc/10/09/75/469100975.db2.gz BRIQMUVBPPWOPR-YPMHNXCESA-N 1 1 334.376 2.111 10 5 EEBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2ccncc2[N+](=O)[O-])cc1 ZINC000599141255 469134909 /nfs/dbraw/zinc/13/49/09/469134909.db2.gz ZWUSQUXMODHQRV-AWEZNQCLSA-N 1 1 328.372 2.107 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2ccncc2[N+](=O)[O-])cc1 ZINC000599141255 469134917 /nfs/dbraw/zinc/13/49/17/469134917.db2.gz ZWUSQUXMODHQRV-AWEZNQCLSA-N 1 1 328.372 2.107 10 5 EEBEMO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC(c3ncc[nH]3)CC1)OCCO2 ZINC000611266511 469214807 /nfs/dbraw/zinc/21/48/07/469214807.db2.gz MWASPWDPLGTLCS-UHFFFAOYSA-N 1 1 344.371 2.469 10 5 EEBEMO COc1cc(N[C@@H](C)C[N@H+](C)CCCN(C)C)c([N+](=O)[O-])cc1F ZINC000596361963 469249856 /nfs/dbraw/zinc/24/98/56/469249856.db2.gz WHQRMVRPBQNUQU-LBPRGKRZSA-N 1 1 342.415 2.426 10 5 EEBEMO COc1cc(N[C@@H](C)C[N@@H+](C)CCCN(C)C)c([N+](=O)[O-])cc1F ZINC000596361963 469249861 /nfs/dbraw/zinc/24/98/61/469249861.db2.gz WHQRMVRPBQNUQU-LBPRGKRZSA-N 1 1 342.415 2.426 10 5 EEBEMO O=[N+]([O-])c1ncccc1NCc1ccc(C[N@@H+]2CC[C@H](O)C2)cc1 ZINC000596425534 469262010 /nfs/dbraw/zinc/26/20/10/469262010.db2.gz ZWNSCJSVUXUZQM-HNNXBMFYSA-N 1 1 328.372 2.169 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21 ZINC000599680337 469335391 /nfs/dbraw/zinc/33/53/91/469335391.db2.gz ADIUUUBKHXPCCI-XGWLTEMNSA-N 1 1 333.388 2.077 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC12CCOCC2 ZINC000618318275 469960550 /nfs/dbraw/zinc/96/05/50/469960550.db2.gz NIDOLPSCFRQHTB-UHFFFAOYSA-N 1 1 333.388 2.487 10 5 EEBEMO COc1ccc(CC(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000610178058 469985697 /nfs/dbraw/zinc/98/56/97/469985697.db2.gz MXVSVKNZCSINID-GXTWGEPZSA-N 1 1 335.404 2.087 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2)C[C@H]1CC ZINC000173790268 528737681 /nfs/dbraw/zinc/73/76/81/528737681.db2.gz JRCSLWPYEMRNDI-MRXNPFEDSA-N 1 1 349.431 2.097 10 5 EEBEMO CC[C@@H]1[C@H](CO)CC[N@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000451259997 535962703 /nfs/dbraw/zinc/96/27/03/535962703.db2.gz UBQBGOQPBYYQSU-XJKSGUPXSA-N 1 1 335.404 2.325 10 5 EEBEMO C/C(=C/C(=O)OCCC[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752344118 577769376 /nfs/dbraw/zinc/76/93/76/577769376.db2.gz AWFVWEJUZMLCAZ-YPKPFQOOSA-N 1 1 334.372 2.264 10 5 EEBEMO Cc1cc(C(=O)NC/C=C/C[NH2+]Cc2csc([N+](=O)[O-])c2)no1 ZINC001268513157 1183148175 /nfs/dbraw/zinc/14/81/75/1183148175.db2.gz RQZUHRQZNATFRC-NSCUHMNNSA-N 1 1 336.373 2.029 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CC1 ZINC001627894025 1193492679 /nfs/dbraw/zinc/49/26/79/1193492679.db2.gz MMPNKZJQTSQAQZ-UHFFFAOYSA-N 1 1 325.796 2.391 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000825708358 1198773546 /nfs/dbraw/zinc/77/35/46/1198773546.db2.gz GNLMYZLLDFFMPB-GFCCVEGCSA-N 1 1 341.795 2.089 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@@H](O)CC1(O)CCCCC1)C2 ZINC000878302920 1200385092 /nfs/dbraw/zinc/38/50/92/1200385092.db2.gz AUIUKQBMVJMQQE-HNNXBMFYSA-N 1 1 334.416 2.399 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@@H](O)CC1(O)CCCCC1)C2 ZINC000878302920 1200385101 /nfs/dbraw/zinc/38/51/01/1200385101.db2.gz AUIUKQBMVJMQQE-HNNXBMFYSA-N 1 1 334.416 2.399 10 5 EEBEMO O=[N+]([O-])c1ccc(CC[N@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1 ZINC000779203424 1209335698 /nfs/dbraw/zinc/33/56/98/1209335698.db2.gz XCQQXJRLXDGTMT-UHFFFAOYSA-N 1 1 328.328 2.499 10 5 EEBEMO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@@H+](CCO)CC1CC1 ZINC000796183183 1215484522 /nfs/dbraw/zinc/48/45/22/1215484522.db2.gz RWRCAKDISYFRMH-SNVBAGLBSA-N 1 1 341.795 2.280 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CCc2[nH+]c[nH]c2C1 ZINC001186626196 1279160697 /nfs/dbraw/zinc/16/06/97/1279160697.db2.gz FWAOHJQPFLJKLU-LURJTMIESA-N 1 1 330.270 2.040 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CCc2[nH]c[nH+]c2C1 ZINC001186626196 1279160705 /nfs/dbraw/zinc/16/07/05/1279160705.db2.gz FWAOHJQPFLJKLU-LURJTMIESA-N 1 1 330.270 2.040 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[N@H+]1CCc2cc(O)ccc2C1 ZINC001198828575 1285360647 /nfs/dbraw/zinc/36/06/47/1285360647.db2.gz LPGHYGATDCJLHE-MRXNPFEDSA-N 1 1 344.367 2.098 10 5 EEBEMO Cn1ncc2c1CC(C)(C)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000854058517 1292603530 /nfs/dbraw/zinc/60/35/30/1292603530.db2.gz OXZYGCGWCUMBLI-QGZVFWFLSA-N 1 1 344.415 2.446 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 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ZINC000457005717 467730331 /nfs/dbraw/zinc/73/03/31/467730331.db2.gz YXIGQVFVSXKLDI-INIZCTEOSA-N 1 1 326.356 2.085 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H]([C@H]3CCOC3)C2)c1 ZINC000589503235 468158318 /nfs/dbraw/zinc/15/83/18/468158318.db2.gz LDARWBYHDIAMNB-KBPBESRZSA-N 1 1 334.372 2.240 10 5 EEBEMO O=C1C[C@H]([NH+]2CCC(CCF)CC2)C(=O)N1c1cccc([N+](=O)[O-])c1 ZINC000600886132 468675469 /nfs/dbraw/zinc/67/54/69/468675469.db2.gz LRUSIWPRZVVVRU-HNNXBMFYSA-N 1 1 349.362 2.298 10 5 EEBEMO CC[N@H+]1CC[C@@H](CNC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601006264 468715955 /nfs/dbraw/zinc/71/59/55/468715955.db2.gz SZQJVFSYMZZHJN-AWEZNQCLSA-N 1 1 331.416 2.475 10 5 EEBEMO C[C@H]1CN(c2nc3c(cc2[N+](=O)[O-])CCCC3)CC[N@H+]1CC(C)(C)O ZINC000583627468 468731186 /nfs/dbraw/zinc/73/11/86/468731186.db2.gz CXQPJJLUBXGREU-ZDUSSCGKSA-N 1 1 348.447 2.150 10 5 EEBEMO CCc1[nH+]ccn1[C@H](C)CC(=O)N1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000592782618 468784718 /nfs/dbraw/zinc/78/47/18/468784718.db2.gz 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COc1ccc(C(=O)N2CC[N@@H+](C)[C@H](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000603140858 469279123 /nfs/dbraw/zinc/27/91/23/469279123.db2.gz BDTSUCXTLJYYFR-HNNXBMFYSA-N 1 1 335.404 2.406 10 5 EEBEMO O=c1ccc([C@@H]2CCC[N@H+]2CCOc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000599640111 469320337 /nfs/dbraw/zinc/32/03/37/469320337.db2.gz BUTFBLDTKDXGSV-ZDUSSCGKSA-N 1 1 330.344 2.306 10 5 EEBEMO O=c1ccc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])n[nH]1 ZINC000599640111 469320340 /nfs/dbraw/zinc/32/03/40/469320340.db2.gz BUTFBLDTKDXGSV-ZDUSSCGKSA-N 1 1 330.344 2.306 10 5 EEBEMO COc1ccc([C@@H]2CC[N@@H+](CCn3cc([N+](=O)[O-])cn3)C2)cc1F ZINC000599680562 469336323 /nfs/dbraw/zinc/33/63/23/469336323.db2.gz SANAITRAUHGHQU-CYBMUJFWSA-N 1 1 334.351 2.429 10 5 EEBEMO O=C(c1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[C@@H]([NH+]2CCC2)[C@@H](F)C1 ZINC000619253072 469559277 /nfs/dbraw/zinc/55/92/77/469559277.db2.gz QYNLBROABCBUBI-GOEBONIOSA-N 1 1 346.362 2.334 10 5 EEBEMO C[C@@H]1CCOCC[N@H+]1CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 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GWYJNDFVULGBEK-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO O=C(NC/C=C/C[NH2+]Cc1ccc(C2CCC2)cc1)[C@@H]1CC1[N+](=O)[O-] ZINC001483007672 1187989925 /nfs/dbraw/zinc/98/99/25/1187989925.db2.gz NPWGFTPVTCAOKY-ZHEVZCJESA-N 1 1 343.427 2.381 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)CC[N@H+]1C ZINC000928453414 1206387137 /nfs/dbraw/zinc/38/71/37/1206387137.db2.gz KLDMIHINCXLTCS-ZFWWWQNUSA-N 1 1 346.431 2.020 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])cc1)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000902903702 1239000574 /nfs/dbraw/zinc/00/05/74/1239000574.db2.gz CGDQRCSAEQDMLR-UONOGXRCSA-N 1 1 336.417 2.296 10 5 EEBEMO Cn1ncc([N+](=O)[O-])c1N1C[C@@H]2C[N@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC001187654067 1279620067 /nfs/dbraw/zinc/62/00/67/1279620067.db2.gz CADPSSOVYMXAEN-CVEARBPZSA-N 1 1 341.415 2.287 10 5 EEBEMO O=C(CC[NH2+]C1(c2ncccn2)CCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001197324727 1284566624 /nfs/dbraw/zinc/56/66/24/1284566624.db2.gz DKMIESGOHYYANB-UHFFFAOYSA-N 1 1 341.371 2.382 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1ccnnc1)Cc1ccccc1[N+](=O)[O-] ZINC001490350919 1291175408 /nfs/dbraw/zinc/17/54/08/1291175408.db2.gz YFVIUTGAEIWNGP-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NC(=O)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000856283015 1293472286 /nfs/dbraw/zinc/47/22/86/1293472286.db2.gz KWAISIXQZXAFRX-UHFFFAOYSA-N 1 1 347.419 2.181 10 5 EEBEMO COC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]2CCC[C@H]21 ZINC000859955511 1294724563 /nfs/dbraw/zinc/72/45/63/1294724563.db2.gz VAJLYLABEYUNRR-HZMVEIRTSA-N 1 1 348.399 2.292 10 5 EEBEMO C[C@@]12COC[C@H]1C[N@@H+](Cn1cc(-c3ccc([N+](=O)[O-])cc3)cn1)C2 ZINC001118594294 1308894827 /nfs/dbraw/zinc/89/48/27/1308894827.db2.gz YAUFTVFSDFXCHX-NVXWUHKLSA-N 1 1 328.372 2.384 10 5 EEBEMO C[N@@H+]1CCO[C@H](CSCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000842653385 1315746192 /nfs/dbraw/zinc/74/61/92/1315746192.db2.gz LZLYDUUZSHWOMV-LBPRGKRZSA-N 1 1 327.362 2.067 10 5 EEBEMO C[N@H+]1CCO[C@H](CSCc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000842653385 1315746194 /nfs/dbraw/zinc/74/61/94/1315746194.db2.gz LZLYDUUZSHWOMV-LBPRGKRZSA-N 1 1 327.362 2.067 10 5 EEBEMO C[N@H+]1CCCC[C@H]1C(=O)NCCCc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001303529629 1331357815 /nfs/dbraw/zinc/35/78/15/1331357815.db2.gz WOOKBFWZFHPFOS-HNNXBMFYSA-N 1 1 345.403 2.004 10 5 EEBEMO C[N@@H+](CCCNC(=O)COC(C)(C)C)Cc1ccccc1[N+](=O)[O-] ZINC001316817895 1331849540 /nfs/dbraw/zinc/84/95/40/1331849540.db2.gz RPHXPKCFYLYBCS-UHFFFAOYSA-N 1 1 337.420 2.348 10 5 EEBEMO C[N@H+](C[C@H]1CCCCO1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474626 1338704783 /nfs/dbraw/zinc/70/47/83/1338704783.db2.gz FIGDGMUALOTQLK-SJORKVTESA-N 1 1 347.415 2.369 10 5 EEBEMO C[N@@H+](C[C@H]1CCCCO1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474626 1338704786 /nfs/dbraw/zinc/70/47/86/1338704786.db2.gz FIGDGMUALOTQLK-SJORKVTESA-N 1 1 347.415 2.369 10 5 EEBEMO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC(C3(O)CC3)CC2)o1 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XLOKGGMWOMXSAW-CYBMUJFWSA-N 1 1 334.420 2.419 10 5 EEBEMO CN(c1nn(C)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](Cc2ccccc2)C1 ZINC001639590573 1352699819 /nfs/dbraw/zinc/69/98/19/1352699819.db2.gz RMOBPFOHNKBPDQ-OAHLLOKOSA-N 1 1 329.404 2.429 10 5 EEBEMO Cc1nn(C)c(N2C[C@H]3CC[N@@H+](Cc4ccccc4)[C@H]3C2)c1[N+](=O)[O-] ZINC001640057255 1352705357 /nfs/dbraw/zinc/70/53/57/1352705357.db2.gz INRPLGIPFITCAT-CVEARBPZSA-N 1 1 341.415 2.347 10 5 EEBEMO CC(C)(C)n1c[nH+]cc1[C@H]1CCCN(c2ncc([N+](=O)[O-])c(N)n2)C1 ZINC001643315911 1352745512 /nfs/dbraw/zinc/74/55/12/1352745512.db2.gz APJRYLWCLHRZOH-NSHDSACASA-N 1 1 345.407 2.303 10 5 EEBEMO COC(=O)c1cc([N+](=O)[O-])cc(Cl)c1N1C[C@H]2CC[N@@H+](C)[C@H]2C1 ZINC001651081760 1354039307 /nfs/dbraw/zinc/03/93/07/1354039307.db2.gz KADPXWMTHDQISF-RNCFNFMXSA-N 1 1 339.779 2.175 10 5 EEBEMO O=C(CC[NH2+][C@H](c1ncccn1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001655654830 1354181108 /nfs/dbraw/zinc/18/11/08/1354181108.db2.gz HXYKNFDHBCOAFE-INIZCTEOSA-N 1 1 341.371 2.454 10 5 EEBEMO O=C(NCCC1CC[NH+](Cc2ccccc2F)CC1)[C@@H]1CC1[N+](=O)[O-] ZINC001698721854 1405026689 /nfs/dbraw/zinc/02/66/89/1405026689.db2.gz SXUIQLGWXTXXQJ-NVXWUHKLSA-N 1 1 349.406 2.209 10 5 EEBEMO CC(C)C[N@H+]1CCC[C@@H]1C(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC001135672581 784225132 /nfs/dbraw/zinc/22/51/32/784225132.db2.gz BRNDXOPBSKPYCX-MRXNPFEDSA-N 1 1 334.420 2.243 10 5 EEBEMO CC[N@H+]1CC[C@@H]1CNC(=O)c1ccc(Br)c([N+](=O)[O-])c1 ZINC000712334255 803200254 /nfs/dbraw/zinc/20/02/54/803200254.db2.gz HZECBKWFMZTZJH-SNVBAGLBSA-N 1 1 342.193 2.181 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cocn1)Cc1ccccc1[N+](=O)[O-] ZINC001479838817 1099126382 /nfs/dbraw/zinc/12/63/82/1099126382.db2.gz HVLBBCKSIUXEIV-UHFFFAOYSA-N 1 1 332.360 2.225 10 5 EEBEMO Cc1[nH]ccc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001496682091 1101280661 /nfs/dbraw/zinc/28/06/61/1101280661.db2.gz ZHLXCGUCXWSSNU-UHFFFAOYSA-N 1 1 330.388 2.435 10 5 EEBEMO Cc1[nH]ccc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001496682091 1101280667 /nfs/dbraw/zinc/28/06/67/1101280667.db2.gz ZHLXCGUCXWSSNU-UHFFFAOYSA-N 1 1 330.388 2.435 10 5 EEBEMO COC(=O)Cc1ccc(NCC[N@H+]2CCC(C)(C)C2)c([N+](=O)[O-])c1 ZINC001458691484 1109936004 /nfs/dbraw/zinc/93/60/04/1109936004.db2.gz CZHNBJHPMDSMQU-UHFFFAOYSA-N 1 1 335.404 2.454 10 5 EEBEMO C[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1(CO)CC1 ZINC001460077507 1110254839 /nfs/dbraw/zinc/25/48/39/1110254839.db2.gz QXAIPJLKDULCCC-UHFFFAOYSA-N 1 1 338.751 2.255 10 5 EEBEMO C[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1(CO)CC1 ZINC001460077507 1110254841 /nfs/dbraw/zinc/25/48/41/1110254841.db2.gz QXAIPJLKDULCCC-UHFFFAOYSA-N 1 1 338.751 2.255 10 5 EEBEMO C[C@@H]1[C@H](C)[N@@H+](C)CCN1C(=O)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001466488408 1110436663 /nfs/dbraw/zinc/43/66/63/1110436663.db2.gz GUEMCDHZOSIKRV-WDEREUQCSA-N 1 1 325.796 2.342 10 5 EEBEMO O=C(Nc1n[nH]c2ccc([N+](=O)[O-])cc21)[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC001466636329 1110440171 /nfs/dbraw/zinc/44/01/71/1110440171.db2.gz RDEZHPCNGIJKOU-QMTHXVAHSA-N 1 1 329.360 2.427 10 5 EEBEMO CCSc1ccc([N+](=O)[O-])cc1C(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1 ZINC001526288313 1120489446 /nfs/dbraw/zinc/48/94/46/1120489446.db2.gz YNYZELCCDZYEKK-RISCZKNCSA-N 1 1 335.429 2.483 10 5 EEBEMO COc1ccc(OC(=O)c2cnn(-c3cc[nH+]cc3)c2)cc1[N+](=O)[O-] ZINC001528962270 1121255930 /nfs/dbraw/zinc/25/59/30/1121255930.db2.gz YUJRIBRFUMXYAB-UHFFFAOYSA-N 1 1 340.295 2.403 10 5 EEBEMO CC[C@@H]1C[N@@H+](CC)CCN1C(=O)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000456381186 244238687 /nfs/dbraw/zinc/23/86/87/244238687.db2.gz NTAFZYLHMNJWNC-LLVKDONJSA-N 1 1 341.358 2.358 10 5 EEBEMO Cn1cc(CN2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000105869848 204172766 /nfs/dbraw/zinc/17/27/66/204172766.db2.gz UOWLDDQXAYOPPE-UHFFFAOYSA-N 1 1 343.431 2.079 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177712844 207382281 /nfs/dbraw/zinc/38/22/81/207382281.db2.gz HKNPXQUOAJFIBF-AWEZNQCLSA-N 1 1 334.420 2.340 10 5 EEBEMO CCN1CCC[C@H]1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177712844 207382288 /nfs/dbraw/zinc/38/22/88/207382288.db2.gz HKNPXQUOAJFIBF-AWEZNQCLSA-N 1 1 334.420 2.340 10 5 EEBEMO CCN1CCC[C@H]1C[N@@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177712844 207382295 /nfs/dbraw/zinc/38/22/95/207382295.db2.gz HKNPXQUOAJFIBF-AWEZNQCLSA-N 1 1 334.420 2.340 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116311177 152048351 /nfs/dbraw/zinc/04/83/51/152048351.db2.gz MLTRDRAXXNPSAY-ZDUSSCGKSA-N 1 1 343.387 2.065 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](c2cnn(C)c2)C1 ZINC000116311177 152048354 /nfs/dbraw/zinc/04/83/54/152048354.db2.gz MLTRDRAXXNPSAY-ZDUSSCGKSA-N 1 1 343.387 2.065 10 5 EEBEMO O=C1[C@H]([NH2+][C@@H](CO)c2ccsc2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000352034158 162039317 /nfs/dbraw/zinc/03/93/17/162039317.db2.gz YTHXZEYCKXANDA-CABCVRRESA-N 1 1 347.396 2.085 10 5 EEBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cccc([N+](=O)[O-])c2N)CC1 ZINC000368793024 166128899 /nfs/dbraw/zinc/12/88/99/166128899.db2.gz ZKHGSAZQJLZZPM-UHFFFAOYSA-N 1 1 329.360 2.159 10 5 EEBEMO CC[NH+]1CCN(C[C@@H](C)CNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000278422212 274353866 /nfs/dbraw/zinc/35/38/66/274353866.db2.gz IPXDFRBISQAQSU-ZDUSSCGKSA-N 1 1 346.435 2.157 10 5 EEBEMO O=C(c1ccc(N2CCCC2)c([N+](=O)[O-])c1)N1CC[N@H+]2CCC[C@H]2C1 ZINC000195314054 275012497 /nfs/dbraw/zinc/01/24/97/275012497.db2.gz QJVQGMJULGWPIX-HNNXBMFYSA-N 1 1 344.415 2.115 10 5 EEBEMO CC[N@H+]1C[C@H](C)N(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C ZINC000342482193 276250884 /nfs/dbraw/zinc/25/08/84/276250884.db2.gz XZOQOEBVHCHLIP-NEPJUHHUSA-N 1 1 336.392 2.004 10 5 EEBEMO C[N@H+]1CCCC[C@H]1CN1CCN(c2cccc(F)c2[N+](=O)[O-])CC1 ZINC000069561859 277046926 /nfs/dbraw/zinc/04/69/26/277046926.db2.gz XVCCVBXBHBOADG-AWEZNQCLSA-N 1 1 336.411 2.340 10 5 EEBEMO COCC(C)(C)[NH+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2C)CC1 ZINC000425005145 314317963 /nfs/dbraw/zinc/31/79/63/314317963.db2.gz VSQYHJOCXFJBFK-UHFFFAOYSA-N 1 1 335.404 2.086 10 5 EEBEMO C[C@@H]1COCC[N@H+]1C1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000575327563 320101354 /nfs/dbraw/zinc/10/13/54/320101354.db2.gz YSKSBUAKIGLPPK-GFCCVEGCSA-N 1 1 325.434 2.341 10 5 EEBEMO CCOc1ccc(C(=O)N2C[C@H]3CCC[N@H+]3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000113226847 462578063 /nfs/dbraw/zinc/57/80/63/462578063.db2.gz JGLPNFVSTAEXNR-GXTWGEPZSA-N 1 1 333.388 2.302 10 5 EEBEMO CCCC(=O)N[C@@H]1CCC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153897263 462705760 /nfs/dbraw/zinc/70/57/60/462705760.db2.gz UGNVXUSGFGVACB-ZBFHGGJFSA-N 1 1 335.404 2.009 10 5 EEBEMO CCCC(=O)N[C@@H]1CCC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000153897263 462705765 /nfs/dbraw/zinc/70/57/65/462705765.db2.gz UGNVXUSGFGVACB-ZBFHGGJFSA-N 1 1 335.404 2.009 10 5 EEBEMO CC[C@H]1CN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC[N@@H+]1CCOC ZINC000110560510 463659245 /nfs/dbraw/zinc/65/92/45/463659245.db2.gz CLTWTYBGEGXTAH-HNNXBMFYSA-N 1 1 335.404 2.344 10 5 EEBEMO CC[C@H]1CN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC[N@H+]1CCOC ZINC000110560510 463659247 /nfs/dbraw/zinc/65/92/47/463659247.db2.gz CLTWTYBGEGXTAH-HNNXBMFYSA-N 1 1 335.404 2.344 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000174247857 464383410 /nfs/dbraw/zinc/38/34/10/464383410.db2.gz UIMQIRLLCYRMBW-CQSZACIVSA-N 1 1 349.431 2.340 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc(CC)c([N+](=O)[O-])c2)C[C@H]1C ZINC000174247857 464383417 /nfs/dbraw/zinc/38/34/17/464383417.db2.gz UIMQIRLLCYRMBW-CQSZACIVSA-N 1 1 349.431 2.340 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245645715 464501935 /nfs/dbraw/zinc/50/19/35/464501935.db2.gz BMSRZBMLZNJSDG-RHSMWYFYSA-N 1 1 340.383 2.352 10 5 EEBEMO COc1cc(C[N@@H+](C)CCCCO)c([N+](=O)[O-])cc1OC(F)F ZINC000276600931 464995471 /nfs/dbraw/zinc/99/54/71/464995471.db2.gz FJTIUWYFEYFSOX-UHFFFAOYSA-N 1 1 334.319 2.409 10 5 EEBEMO CC[C@H]1CN(C(=O)/C=C\c2ccc([N+](=O)[O-])cc2)CC[N@H+]1CCOC ZINC000254929769 465019523 /nfs/dbraw/zinc/01/95/23/465019523.db2.gz RQUVLCMVXNTBCG-HWYHOQROSA-N 1 1 347.415 2.177 10 5 EEBEMO CC[N@H+]1C[C@@H](C)N(c2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C[C@H]1C ZINC000342482205 465324578 /nfs/dbraw/zinc/32/45/78/465324578.db2.gz XZOQOEBVHCHLIP-VXGBXAGGSA-N 1 1 336.392 2.004 10 5 EEBEMO Cc1c(C(=O)N2CCC([N@H+]3CCCOCC3)CC2)cccc1[N+](=O)[O-] ZINC000600006692 468435457 /nfs/dbraw/zinc/43/54/57/468435457.db2.gz CDVSEYIRJWBGFT-UHFFFAOYSA-N 1 1 347.415 2.230 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000362448992 465748762 /nfs/dbraw/zinc/74/87/62/465748762.db2.gz NSROXMNXFIPFNQ-CJNGLKHVSA-N 1 1 333.388 2.343 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000362451454 465750035 /nfs/dbraw/zinc/75/00/35/465750035.db2.gz SQZJOTHMTMNCSG-SWLSCSKDSA-N 1 1 349.387 2.043 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]2COCC[C@H]21 ZINC000362451454 465750039 /nfs/dbraw/zinc/75/00/39/465750039.db2.gz SQZJOTHMTMNCSG-SWLSCSKDSA-N 1 1 349.387 2.043 10 5 EEBEMO COCC[N@H+]1CCCN(C(=O)C(C)(C)c2ccccc2[N+](=O)[O-])CC1 ZINC000340317246 465985622 /nfs/dbraw/zinc/98/56/22/465985622.db2.gz VPZGESLQFKJJSK-UHFFFAOYSA-N 1 1 349.431 2.053 10 5 EEBEMO COc1cc(C[N@@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000361511064 466059810 /nfs/dbraw/zinc/05/98/10/466059810.db2.gz OBWRNOGGKRLTCK-QGZVFWFLSA-N 1 1 336.388 2.373 10 5 EEBEMO COc1cc(C[N@H+]2C[C@@]3(CCOC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000361511064 466059817 /nfs/dbraw/zinc/05/98/17/466059817.db2.gz OBWRNOGGKRLTCK-QGZVFWFLSA-N 1 1 336.388 2.373 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000340821876 466362974 /nfs/dbraw/zinc/36/29/74/466362974.db2.gz RVTIOKWSFHPEJE-AWEZNQCLSA-N 1 1 347.371 2.182 10 5 EEBEMO C[C@@H]1C[C@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000411322880 466807403 /nfs/dbraw/zinc/80/74/03/466807403.db2.gz DHMJSMQPAFRPAF-CZUORRHYSA-N 1 1 334.420 2.338 10 5 EEBEMO Nc1nccc([C@H]2CCC[N@@H+](CCc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000366004149 467023898 /nfs/dbraw/zinc/02/38/98/467023898.db2.gz NJAMNAWDUZUDBV-AWEZNQCLSA-N 1 1 327.388 2.389 10 5 EEBEMO COc1cc(C[NH2+][C@](C)(CO)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000451035785 467231963 /nfs/dbraw/zinc/23/19/63/467231963.db2.gz CNUFBOHURLMCHW-QGZVFWFLSA-N 1 1 332.356 2.306 10 5 EEBEMO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CCC[C@H]1O)c1ccc([N+](=O)[O-])cc1 ZINC000449734458 467703006 /nfs/dbraw/zinc/70/30/06/467703006.db2.gz BZXXMLMIFOCWCN-NUEKZKHPSA-N 1 1 330.388 2.168 10 5 EEBEMO C[C@@H](NC(=O)Cc1c(F)cc([N+](=O)[O-])cc1F)C1=CC[N@@H+](C)CC1 ZINC000487031764 468019166 /nfs/dbraw/zinc/01/91/66/468019166.db2.gz ADOLQWYVDWDHRT-SNVBAGLBSA-N 1 1 339.342 2.182 10 5 EEBEMO COc1cc(C[N@H+]2CC[C@@H](CO)[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000488717752 468098872 /nfs/dbraw/zinc/09/88/72/468098872.db2.gz LGNQJWDURRDTIF-ZJUUUORDSA-N 1 1 346.330 2.408 10 5 EEBEMO O=C(N[C@H]1CC[N@H+](C2CC2)C1)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601016260 468719353 /nfs/dbraw/zinc/71/93/53/468719353.db2.gz IQPWSNFSRQPPDK-AWEZNQCLSA-N 1 1 329.400 2.369 10 5 EEBEMO CCN(C(=O)CCOc1cc(C)ccc1[N+](=O)[O-])[C@H]1CC[N@@H+](C)C1 ZINC000597946297 468721426 /nfs/dbraw/zinc/72/14/26/468721426.db2.gz NSAQHUVGGZNEGA-AWEZNQCLSA-N 1 1 335.404 2.225 10 5 EEBEMO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cc1 ZINC000594976306 468735985 /nfs/dbraw/zinc/73/59/85/468735985.db2.gz ZFBPBPCJKKVSST-LJQANCHMSA-N 1 1 341.411 2.451 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCCC[C@H]2C2(O)CC2)c([N+](=O)[O-])c1 ZINC000571405307 468784593 /nfs/dbraw/zinc/78/45/93/468784593.db2.gz KEMKWJNXKDDVNV-INIZCTEOSA-N 1 1 336.388 2.362 10 5 EEBEMO Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@@H+]2C(C)(C)C)c([N+](=O)[O-])s1 ZINC000601461435 468883903 /nfs/dbraw/zinc/88/39/03/468883903.db2.gz DPTWULYIIOHCLL-JTQLQIEISA-N 1 1 347.462 2.116 10 5 EEBEMO Cc1cc(S(=O)(=O)NC[C@@H]2CC[N@H+]2C(C)(C)C)c([N+](=O)[O-])s1 ZINC000601461435 468883906 /nfs/dbraw/zinc/88/39/06/468883906.db2.gz DPTWULYIIOHCLL-JTQLQIEISA-N 1 1 347.462 2.116 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000598507416 468892675 /nfs/dbraw/zinc/89/26/75/468892675.db2.gz AUAUFXKYAFBXSS-HNNXBMFYSA-N 1 1 340.383 2.303 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1Cc1ccccc1 ZINC000598507416 468892681 /nfs/dbraw/zinc/89/26/81/468892681.db2.gz AUAUFXKYAFBXSS-HNNXBMFYSA-N 1 1 340.383 2.303 10 5 EEBEMO Cc1ncc([N+](=O)[O-])cc1C(=O)NC[C@H]1CCC[N@@H+](CC2CC2)C1 ZINC000598561456 468914593 /nfs/dbraw/zinc/91/45/93/468914593.db2.gz RASDFOXGIYKONB-CQSZACIVSA-N 1 1 332.404 2.150 10 5 EEBEMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000595672524 468948189 /nfs/dbraw/zinc/94/81/89/468948189.db2.gz ADDGCUUHKZUMOQ-GOEBONIOSA-N 1 1 346.387 2.363 10 5 EEBEMO C[C@H]1CN(c2ccnc3cc([N+](=O)[O-])ccc32)CC[N@H+]1CC(C)(C)O ZINC000593477136 468997810 /nfs/dbraw/zinc/99/78/10/468997810.db2.gz WFMWWSHHIIKDTQ-ZDUSSCGKSA-N 1 1 344.415 2.424 10 5 EEBEMO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)c2ccnn2C)cc1[N+](=O)[O-] ZINC000599052930 469101961 /nfs/dbraw/zinc/10/19/61/469101961.db2.gz BRIQMUVBPPWOPR-AAEUAGOBSA-N 1 1 334.376 2.111 10 5 EEBEMO O=c1oc2ccc([N+](=O)[O-])cc2n1CCC[N@H+]1CC[C@@H](C(F)F)C1 ZINC000611180004 469184478 /nfs/dbraw/zinc/18/44/78/469184478.db2.gz PNDDFQJUUBDZFU-SNVBAGLBSA-N 1 1 341.314 2.480 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000604198338 469462927 /nfs/dbraw/zinc/46/29/27/469462927.db2.gz GXLUSSMNZFCAFS-HNNXBMFYSA-N 1 1 346.431 2.022 10 5 EEBEMO O=C(CCc1cccc([N+](=O)[O-])c1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619253568 469559688 /nfs/dbraw/zinc/55/96/88/469559688.db2.gz ZUYADLCRZJHAGA-HZPDHXFCSA-N 1 1 335.379 2.172 10 5 EEBEMO C[C@@H]1CC[N@@H+](Cc2ccccc2)CCN1C(=O)c1c[nH]nc1[N+](=O)[O-] ZINC000619788565 469682122 /nfs/dbraw/zinc/68/21/22/469682122.db2.gz SPEXIAIHSKPABN-CYBMUJFWSA-N 1 1 343.387 2.055 10 5 EEBEMO C[C@@H]1CC[C@H](C)C[N@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181934849 534219187 /nfs/dbraw/zinc/21/91/87/534219187.db2.gz SMOFNVQOJJHJHR-QWHCGFSZSA-N 1 1 326.418 2.489 10 5 EEBEMO C[C@@H]1CC[C@H](C)C[N@@H+]1CCS(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000181934849 534219193 /nfs/dbraw/zinc/21/91/93/534219193.db2.gz SMOFNVQOJJHJHR-QWHCGFSZSA-N 1 1 326.418 2.489 10 5 EEBEMO O=[N+]([O-])c1ccc([C@@H](O)CN2CCC(C[NH+]3CCCC3)CC2)cc1 ZINC000776578682 577463037 /nfs/dbraw/zinc/46/30/37/577463037.db2.gz IDTQSINMWDXDEJ-SFHVURJKSA-N 1 1 333.432 2.436 10 5 EEBEMO CCOCC(=O)N1CCC([N@@H+](C)Cc2csc([N+](=O)[O-])c2)CC1 ZINC001485751963 1191932637 /nfs/dbraw/zinc/93/26/37/1191932637.db2.gz LXBRDSKRDOPZSU-UHFFFAOYSA-N 1 1 341.433 2.116 10 5 EEBEMO CCOCC(=O)N1CCC(C[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001481509190 1181596904 /nfs/dbraw/zinc/59/69/04/1181596904.db2.gz LOGONIPKHVEURE-UHFFFAOYSA-N 1 1 349.431 2.302 10 5 EEBEMO C[C@@H]([NH2+]CC1(S(C)(=O)=O)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070038 1198039593 /nfs/dbraw/zinc/03/95/93/1198039593.db2.gz WNSMEVOTEDEUDI-SNVBAGLBSA-N 1 1 330.381 2.352 10 5 EEBEMO C[C@@H](N[C@H]1CCC[N@H+](CCCO)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872076141 1198041886 /nfs/dbraw/zinc/04/18/86/1198041886.db2.gz YDNMOXLWTPEZFL-OLZOCXBDSA-N 1 1 325.384 2.231 10 5 EEBEMO C[C@@H](N[C@H]1CCC[N@@H+](CCCO)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872076141 1198041891 /nfs/dbraw/zinc/04/18/91/1198041891.db2.gz YDNMOXLWTPEZFL-OLZOCXBDSA-N 1 1 325.384 2.231 10 5 EEBEMO CC[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)[C@@H]1CCOC1 ZINC000812878917 1200966190 /nfs/dbraw/zinc/96/61/90/1200966190.db2.gz KAKVSMALZBKJOV-GFCCVEGCSA-N 1 1 325.340 2.173 10 5 EEBEMO C[C@@H]([NH2+]CC(=O)N1C[C@@H](C)OC(C)(C)C1)c1ccccc1[N+](=O)[O-] ZINC000930236524 1206543307 /nfs/dbraw/zinc/54/33/07/1206543307.db2.gz XOTUTVHVRUXJCO-CHWSQXEVSA-N 1 1 335.404 2.271 10 5 EEBEMO C[N@@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H]1CO ZINC000931399249 1207370166 /nfs/dbraw/zinc/37/01/66/1207370166.db2.gz NLVVZTFXKRGWEO-NSHDSACASA-N 1 1 334.203 2.010 10 5 EEBEMO C[N@H+]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H]1CO ZINC000931399249 1207370168 /nfs/dbraw/zinc/37/01/68/1207370168.db2.gz NLVVZTFXKRGWEO-NSHDSACASA-N 1 1 334.203 2.010 10 5 EEBEMO O=[N+]([O-])c1c(NC[C@H]2C[N@H+]3CCC[C@@H]3CO2)ccc2cnccc21 ZINC000858374498 1294099952 /nfs/dbraw/zinc/09/99/52/1294099952.db2.gz NWBZOAVPROFFLB-KGLIPLIRSA-N 1 1 328.372 2.418 10 5 EEBEMO CO[C@@H]1C[N@@H+](C)[C@](C)(COC(=O)[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000861350705 1295359566 /nfs/dbraw/zinc/35/95/66/1295359566.db2.gz FCTBXGHLDFQFNO-PVUWLOKVSA-N 1 1 336.388 2.351 10 5 EEBEMO C[N@H+]1C[C@@]2(C)CN(Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C[C@@]2(C)C1 ZINC000931315091 1297131980 /nfs/dbraw/zinc/13/19/80/1297131980.db2.gz UHEYSXDOLZFCNN-CALCHBBNSA-N 1 1 329.404 2.245 10 5 EEBEMO CCC[N@H+]1CCCC[C@H]1C(=O)N1CC(Oc2ccc([N+](=O)[O-])cc2)C1 ZINC001138247336 1314582589 /nfs/dbraw/zinc/58/25/89/1314582589.db2.gz KCJYYEHMQHCVAP-KRWDZBQOSA-N 1 1 347.415 2.449 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@H+](C)[C@H]1c1ccc(F)cc1 ZINC001253632613 1317900168 /nfs/dbraw/zinc/90/01/68/1317900168.db2.gz HPZWRIRASQKXPK-HOCLYGCPSA-N 1 1 346.362 2.248 10 5 EEBEMO Cn1cc([N+](=O)[O-])cc1C(=O)N[C@H]1CC[N@@H+](C)[C@H]1c1ccc(F)cc1 ZINC001253632613 1317900171 /nfs/dbraw/zinc/90/01/71/1317900171.db2.gz HPZWRIRASQKXPK-HOCLYGCPSA-N 1 1 346.362 2.248 10 5 EEBEMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@@H](C)C1 ZINC001161000183 1320349589 /nfs/dbraw/zinc/34/95/89/1320349589.db2.gz GULLKNMNVJZACF-NSHDSACASA-N 1 1 336.348 2.059 10 5 EEBEMO CCc1nc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)co1 ZINC001492232371 1331103656 /nfs/dbraw/zinc/10/36/56/1331103656.db2.gz ZBCYAIDPJAJCNR-UHFFFAOYSA-N 1 1 332.360 2.007 10 5 EEBEMO Cc1[nH]ccc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001316819886 1331911699 /nfs/dbraw/zinc/91/16/99/1331911699.db2.gz XYOPLVHCRXBVQQ-UHFFFAOYSA-N 1 1 330.388 2.483 10 5 EEBEMO O=C(NCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1cc(F)c[nH]1 ZINC001317553808 1332295118 /nfs/dbraw/zinc/29/51/18/1332295118.db2.gz CEGALWRMBKEICM-UHFFFAOYSA-N 1 1 346.362 2.456 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccsc1 ZINC001317685856 1332372264 /nfs/dbraw/zinc/37/22/64/1332372264.db2.gz FCJPQECVNCPARN-ZIAGYGMSSA-N 1 1 325.434 2.130 10 5 EEBEMO CC(C)[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccsc1 ZINC001317685856 1332372266 /nfs/dbraw/zinc/37/22/66/1332372266.db2.gz FCJPQECVNCPARN-ZIAGYGMSSA-N 1 1 325.434 2.130 10 5 EEBEMO CC(C)[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccsc1 ZINC001317685856 1332372269 /nfs/dbraw/zinc/37/22/69/1332372269.db2.gz FCJPQECVNCPARN-ZIAGYGMSSA-N 1 1 325.434 2.130 10 5 EEBEMO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001571611808 1343251291 /nfs/dbraw/zinc/25/12/91/1343251291.db2.gz MZUXSCNBRRAFOZ-HZPDHXFCSA-N 1 1 337.464 2.401 10 5 EEBEMO CC(C)N(CC[N@H+](C)CC1CC2(CCC2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001571611808 1343251298 /nfs/dbraw/zinc/25/12/98/1343251298.db2.gz MZUXSCNBRRAFOZ-HZPDHXFCSA-N 1 1 337.464 2.401 10 5 EEBEMO CC(C)N(CC[N@@H+](C)CC1CC2(CCC2)C1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001571611808 1343251306 /nfs/dbraw/zinc/25/13/06/1343251306.db2.gz MZUXSCNBRRAFOZ-HZPDHXFCSA-N 1 1 337.464 2.401 10 5 EEBEMO C[N@@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)Cc1cccc(=O)[nH]1 ZINC001648420896 1353428873 /nfs/dbraw/zinc/42/88/73/1353428873.db2.gz IHSRESBPOAGNCU-UHFFFAOYSA-N 1 1 348.334 2.295 10 5 EEBEMO Cc1ncsc1C(=O)NCC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663146560 1354926501 /nfs/dbraw/zinc/92/65/01/1354926501.db2.gz NJAPOROIDMCUFV-UHFFFAOYSA-N 1 1 334.401 2.222 10 5 EEBEMO Cc1ncsc1C(=O)NCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001663146560 1354926505 /nfs/dbraw/zinc/92/65/05/1354926505.db2.gz NJAPOROIDMCUFV-UHFFFAOYSA-N 1 1 334.401 2.222 10 5 EEBEMO Cc1ccc(C[N@H+](CCCNC(=O)[C@@H]2C[C@H]2[N+](=O)[O-])C(C)C)c(C)n1 ZINC001664510652 1355181812 /nfs/dbraw/zinc/18/18/12/1355181812.db2.gz SBLATIRDPOJNPE-IAGOWNOFSA-N 1 1 348.447 2.080 10 5 EEBEMO Cc1ccc(C[N@@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c(C)n1 ZINC001664510652 1355181815 /nfs/dbraw/zinc/18/18/15/1355181815.db2.gz SBLATIRDPOJNPE-IAGOWNOFSA-N 1 1 348.447 2.080 10 5 EEBEMO Cc1ccc(C[N@H+](CCCNC(=O)[C@@H]2CC2[N+](=O)[O-])C(C)C)c(C)n1 ZINC001664510652 1355181818 /nfs/dbraw/zinc/18/18/18/1355181818.db2.gz SBLATIRDPOJNPE-IAGOWNOFSA-N 1 1 348.447 2.080 10 5 EEBEMO CC(C)c1ccccc1C[NH2+]C/C=C\CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001668821995 1356012906 /nfs/dbraw/zinc/01/29/06/1356012906.db2.gz UOZPZENJKOPFIV-MBZYTVFJSA-N 1 1 331.416 2.237 10 5 EEBEMO Cc1nn(C[N@H+](C[C@H]2CCC(=O)N2)C(C)C)c2cc([N+](=O)[O-])ccc12 ZINC000840190019 782370110 /nfs/dbraw/zinc/37/01/10/782370110.db2.gz TZMWVBITOIIWHZ-CYBMUJFWSA-N 1 1 345.403 2.199 10 5 EEBEMO COC(=O)/C=C\c1ccc(N[C@@H]2CC[N@H+](C3CC3)C2)c([N+](=O)[O-])c1 ZINC000920337722 770678858 /nfs/dbraw/zinc/67/88/58/770678858.db2.gz XVZBPLHCUCLPRI-RBWDJNPFSA-N 1 1 331.372 2.430 10 5 EEBEMO 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ZINC001544924209 1124173233 /nfs/dbraw/zinc/17/32/33/1124173233.db2.gz ZLYGDOVRYIHDEY-UHFFFAOYSA-N 1 1 337.767 2.155 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)Cc2ccccc2)n1 ZINC000191474952 237256825 /nfs/dbraw/zinc/25/68/25/237256825.db2.gz GYQYPAZJIOAVGC-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO COCCN(C)C(=O)[C@H]1CCC[N@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000070039376 203071643 /nfs/dbraw/zinc/07/16/43/203071643.db2.gz DLKKNTKHRDYJKH-ZBFHGGJFSA-N 1 1 349.431 2.473 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1CC[N@H+]2CCCC[C@@H]2C1 ZINC000156114393 206057135 /nfs/dbraw/zinc/05/71/35/206057135.db2.gz NKYWOUCYHXKZKT-CYBMUJFWSA-N 1 1 334.376 2.305 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@@H](c2cnn(C)c2)C1 ZINC000116311180 152049857 /nfs/dbraw/zinc/04/98/57/152049857.db2.gz MLTRDRAXXNPSAY-CYBMUJFWSA-N 1 1 343.387 2.065 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](c2cnn(C)c2)C1 ZINC000116311180 152049861 /nfs/dbraw/zinc/04/98/61/152049861.db2.gz MLTRDRAXXNPSAY-CYBMUJFWSA-N 1 1 343.387 2.065 10 5 EEBEMO CCc1n[nH]c(C2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000190690348 152217481 /nfs/dbraw/zinc/21/74/81/152217481.db2.gz VAJYFNFDXHNDAL-HNNXBMFYSA-N 1 1 345.403 2.188 10 5 EEBEMO CCc1nc(C2CC[NH+](C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)n[nH]1 ZINC000190690348 152217483 /nfs/dbraw/zinc/21/74/83/152217483.db2.gz VAJYFNFDXHNDAL-HNNXBMFYSA-N 1 1 345.403 2.188 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000123857027 292284359 /nfs/dbraw/zinc/28/43/59/292284359.db2.gz NFEVGASQORTFKS-AWEZNQCLSA-N 1 1 349.431 2.015 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)Cc2cccc([N+](=O)[O-])c2C)C[C@@H]1C ZINC000123857027 292284360 /nfs/dbraw/zinc/28/43/60/292284360.db2.gz NFEVGASQORTFKS-AWEZNQCLSA-N 1 1 349.431 2.015 10 5 EEBEMO CN1CC[C@@H](NC(=O)c2n[nH]cc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000246352626 160275545 /nfs/dbraw/zinc/27/55/45/160275545.db2.gz FTRBKSGHUQOSKP-BXUZGUMPSA-N 1 1 349.778 2.147 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000246352626 160275546 /nfs/dbraw/zinc/27/55/46/160275546.db2.gz FTRBKSGHUQOSKP-BXUZGUMPSA-N 1 1 349.778 2.147 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2[nH]ncc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000246352626 160275547 /nfs/dbraw/zinc/27/55/47/160275547.db2.gz FTRBKSGHUQOSKP-BXUZGUMPSA-N 1 1 349.778 2.147 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)c2ccc([N+](=O)[O-])c(OC)c2)[C@@H](C)C1 ZINC000247536920 160328109 /nfs/dbraw/zinc/32/81/09/160328109.db2.gz XSSMWXILGIMXHR-GXTWGEPZSA-N 1 1 335.404 2.406 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCCCC[C@@H]1CCO ZINC000342015655 161032185 /nfs/dbraw/zinc/03/21/85/161032185.db2.gz JAYYXLUMPYOZSO-CQSZACIVSA-N 1 1 335.404 2.469 10 5 EEBEMO COc1cc(C[N@@H+](C)C2CCC(NC(C)=O)CC2)ccc1[N+](=O)[O-] ZINC000344121141 161200308 /nfs/dbraw/zinc/20/03/08/161200308.db2.gz SNLFMOHSUVEAIA-UHFFFAOYSA-N 1 1 335.404 2.483 10 5 EEBEMO C[NH+]1CCN(CCCNc2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000291689024 275330230 /nfs/dbraw/zinc/33/02/30/275330230.db2.gz SFJFTGVDJQGHAX-UHFFFAOYSA-N 1 1 329.404 2.192 10 5 EEBEMO Cc1cccc2c1C[NH2+]CCN2S(=O)(=O)c1ccc([N+](=O)[O-])cc1 ZINC000420452169 313963410 /nfs/dbraw/zinc/96/34/10/313963410.db2.gz ABHFDAGCYYYDIX-UHFFFAOYSA-N 1 1 347.396 2.202 10 5 EEBEMO C[NH+](C)C[C@@H]1CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000448883481 315396738 /nfs/dbraw/zinc/39/67/38/315396738.db2.gz QYDJWHHXUQOXRB-AWEZNQCLSA-N 1 1 343.387 2.151 10 5 EEBEMO O=C(Cn1c[nH+]c2c1CCCC2)NCCc1cccc([N+](=O)[O-])c1 ZINC000543692605 318165822 /nfs/dbraw/zinc/16/58/22/318165822.db2.gz NBPRMPANJFKSTG-UHFFFAOYSA-N 1 1 328.372 2.029 10 5 EEBEMO COC(=O)CC1([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000565778995 319213576 /nfs/dbraw/zinc/21/35/76/319213576.db2.gz UDPUGPIDXPWEJJ-UHFFFAOYSA-N 1 1 331.328 2.435 10 5 EEBEMO COc1cccc([N+](=O)[O-])c1N1CCC[C@@H](C[NH+]2CCOCC2)C1 ZINC000581895258 324338282 /nfs/dbraw/zinc/33/82/82/324338282.db2.gz YBNQIRGNKVDDCZ-AWEZNQCLSA-N 1 1 335.404 2.152 10 5 EEBEMO C[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000113601546 462605915 /nfs/dbraw/zinc/60/59/15/462605915.db2.gz PRBYXZUVLLEAPA-XJKSGUPXSA-N 1 1 332.404 2.015 10 5 EEBEMO COc1ccc(CC(=O)NCC[N@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000067907073 463065986 /nfs/dbraw/zinc/06/59/86/463065986.db2.gz QFBMOLXWNFLTRH-CYBMUJFWSA-N 1 1 335.404 2.137 10 5 EEBEMO COc1ccc(CN(C)C(=O)[C@@H]2C[C@@H]3CCCC[N@H+]3C2)cc1[N+](=O)[O-] ZINC000081651749 463476849 /nfs/dbraw/zinc/47/68/49/463476849.db2.gz MDOGBMTURNYCAE-CABCVRRESA-N 1 1 347.415 2.436 10 5 EEBEMO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H](O)CN1CCCCC1)C1CC1 ZINC000151253575 463500297 /nfs/dbraw/zinc/50/02/97/463500297.db2.gz BPNGSVAMSSJAIE-MSOLQXFVSA-N 1 1 347.459 2.352 10 5 EEBEMO Cc1ccc(S(=O)(=O)NCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000058561804 463608745 /nfs/dbraw/zinc/60/87/45/463608745.db2.gz RRAMGBMOVTZGKE-ZDUSSCGKSA-N 1 1 341.433 2.056 10 5 EEBEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])s1 ZINC000261700576 463832848 /nfs/dbraw/zinc/83/28/48/463832848.db2.gz CZVHWRWBXGHMNI-GFCCVEGCSA-N 1 1 347.396 2.452 10 5 EEBEMO CCc1n[nH]c(C(=O)N2CCC[C@@H](n3ccnc3CC)C2)c1[N+](=O)[O-] ZINC000171820680 463930290 /nfs/dbraw/zinc/93/02/90/463930290.db2.gz LYLJZBCYDAGVNK-LLVKDONJSA-N 1 1 346.391 2.117 10 5 EEBEMO Cc1cc(N2CC[C@@H]3OCCN(C)[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000284853318 464366352 /nfs/dbraw/zinc/36/63/52/464366352.db2.gz DVDDRMJHGRGNFX-MSOLQXFVSA-N 1 1 342.399 2.361 10 5 EEBEMO C[N@H+]1CCO[C@H]2CCN(c3ccc4cc([N+](=O)[O-])ccc4n3)C[C@@H]21 ZINC000284961092 464406537 /nfs/dbraw/zinc/40/65/37/464406537.db2.gz KEODNFSCPYFJKR-HOTGVXAUSA-N 1 1 328.372 2.052 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)[C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC000245475450 464486641 /nfs/dbraw/zinc/48/66/41/464486641.db2.gz RXFWVTKNMVTNSX-IRXDYDNUSA-N 1 1 346.431 2.116 10 5 EEBEMO C[N@H+](Cc1cccnc1)C[C@H]1CCN(c2ccc([N+](=O)[O-])cn2)C1 ZINC000190446357 464647607 /nfs/dbraw/zinc/64/76/07/464647607.db2.gz MQUBHUOELPRFRP-OAHLLOKOSA-N 1 1 327.388 2.343 10 5 EEBEMO COC(=O)c1cc(C)nc(N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000286023252 464778055 /nfs/dbraw/zinc/77/80/55/464778055.db2.gz AQBSHIRAXIVPTM-NWDGAFQWSA-N 1 1 336.392 2.004 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C)[C@@]1(CO)CC[C@@H](C)C1 ZINC000249533107 464887437 /nfs/dbraw/zinc/88/74/37/464887437.db2.gz BMXYOEKJTKMIPN-PXAZEXFGSA-N 1 1 335.404 2.325 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](O)CN1CCCCC1)CCC2 ZINC000192721799 464984690 /nfs/dbraw/zinc/98/46/90/464984690.db2.gz MYUPTMFFZGEHMB-FUHWJXTLSA-N 1 1 333.432 2.409 10 5 EEBEMO O=C(CC[N@H+]1CCC[C@H]1c1cc[nH]n1)Nc1ccccc1[N+](=O)[O-] ZINC000298448361 465397924 /nfs/dbraw/zinc/39/79/24/465397924.db2.gz HHCYTOSBTGGNCX-AWEZNQCLSA-N 1 1 329.360 2.484 10 5 EEBEMO C[N@@H+]1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000554864304 468447154 /nfs/dbraw/zinc/44/71/54/468447154.db2.gz YNGAFEHMFNQKEP-CHWSQXEVSA-N 1 1 349.778 2.147 10 5 EEBEMO C[N@H+]1CC[C@@H](NC(=O)c2c[nH]nc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000554864304 468447158 /nfs/dbraw/zinc/44/71/58/468447158.db2.gz YNGAFEHMFNQKEP-CHWSQXEVSA-N 1 1 349.778 2.147 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[NH2+][C@H](Cc2ccccc2)c2ncco2)c1 ZINC000594054611 468473908 /nfs/dbraw/zinc/47/39/08/468473908.db2.gz ISMMCOFNJOZVCF-OAHLLOKOSA-N 1 1 327.344 2.353 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108134 468487261 /nfs/dbraw/zinc/48/72/61/468487261.db2.gz SBQAVZYPBWVTKO-MCIONIFRSA-N 1 1 335.404 2.131 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)NC[C@@H](C)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594108134 468487265 /nfs/dbraw/zinc/48/72/65/468487265.db2.gz SBQAVZYPBWVTKO-MCIONIFRSA-N 1 1 335.404 2.131 10 5 EEBEMO C[NH+]1CCN(C(=O)Nc2cc(Br)cc([N+](=O)[O-])c2)CC1 ZINC000347160747 466440496 /nfs/dbraw/zinc/44/04/96/466440496.db2.gz UDCFEWMUDVYVJM-UHFFFAOYSA-N 1 1 343.181 2.137 10 5 EEBEMO CC[N@@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])[C@H]1CCOC1 ZINC000411748370 466893049 /nfs/dbraw/zinc/89/30/49/466893049.db2.gz RTUSAVMHCFZWNJ-LBPRGKRZSA-N 1 1 337.376 2.043 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(CN2CC[C@]3(C2)CCC[N@@H+](C)C3)c1 ZINC000590375031 468242065 /nfs/dbraw/zinc/24/20/65/468242065.db2.gz DZIOEAFBNNIBPE-GOSISDBHSA-N 1 1 347.415 2.299 10 5 EEBEMO CO[C@@](C)(CO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594508040 468611432 /nfs/dbraw/zinc/61/14/32/468611432.db2.gz AACNZCQCMBQIFQ-OAHLLOKOSA-N 1 1 337.401 2.205 10 5 EEBEMO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H](O)[C@@H]2CCc2ccccc2)c1 ZINC000592166860 468644840 /nfs/dbraw/zinc/64/48/40/468644840.db2.gz JZVNQFNNMKOEMK-ROUUACIJSA-N 1 1 344.415 2.249 10 5 EEBEMO O=C(CCN1CCC[C@@H]([C@@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000592478426 468706313 /nfs/dbraw/zinc/70/63/13/468706313.db2.gz BGTYVOARRKQMHP-CABCVRRESA-N 1 1 346.431 2.387 10 5 EEBEMO C[C@@H]1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CS1(=O)=O ZINC000594975189 468736195 /nfs/dbraw/zinc/73/61/95/468736195.db2.gz MISIIFZAUWHLDR-KOLCDFICSA-N 1 1 332.809 2.304 10 5 EEBEMO Cc1cc(S(=O)(=O)N[C@@H]2CC[N@H+](C(C)(C)C)C2)c([N+](=O)[O-])s1 ZINC000601464587 468885557 /nfs/dbraw/zinc/88/55/57/468885557.db2.gz REEOFBMGIXUROJ-SNVBAGLBSA-N 1 1 347.462 2.116 10 5 EEBEMO Nc1cc(N2CC[C@@H]3[C@@H](CCC[N@H+]3C3CC3)C2)cc(CO)c1[N+](=O)[O-] ZINC000588004072 469102538 /nfs/dbraw/zinc/10/25/38/469102538.db2.gz TZWSTYFHWUQGDA-YVEFUNNKSA-N 1 1 346.431 2.122 10 5 EEBEMO O=[N+]([O-])c1ccc2ncnc(NC[C@@H]3CC[N@H+]3C3CCCC3)c2c1 ZINC000599166574 469146422 /nfs/dbraw/zinc/14/64/22/469146422.db2.gz YFBSETJAUVDTQS-AWEZNQCLSA-N 1 1 327.388 2.967 10 5 EEBEMO CC[C@H]([NH2+]Cc1cnc(C(=O)OC)cn1)c1cccc([N+](=O)[O-])c1 ZINC000599355157 469223652 /nfs/dbraw/zinc/22/36/52/469223652.db2.gz VIEJAEXRLIIEOH-AWEZNQCLSA-N 1 1 330.344 2.412 10 5 EEBEMO Cc1nc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)ccc1[N+](=O)[O-] ZINC000596514833 469289527 /nfs/dbraw/zinc/28/95/27/469289527.db2.gz MZFNJVPQVHAYMP-HUUCEWRRSA-N 1 1 332.404 2.354 10 5 EEBEMO O=C(C[N@H+]1CC[C@H]2CC[C@@H](C1)S2)N1CCc2cc([N+](=O)[O-])ccc21 ZINC000599552634 469291049 /nfs/dbraw/zinc/29/10/49/469291049.db2.gz GVEDYUIWGMTIFF-CABCVRRESA-N 1 1 347.440 2.454 10 5 EEBEMO CC[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000776598114 577464020 /nfs/dbraw/zinc/46/40/20/577464020.db2.gz RIYKHAWPAJLTCS-HIFRSBDPSA-N 1 1 343.374 2.290 10 5 EEBEMO CC[C@@H]1C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCN1CC(F)F ZINC000776598114 577464021 /nfs/dbraw/zinc/46/40/21/577464021.db2.gz RIYKHAWPAJLTCS-HIFRSBDPSA-N 1 1 343.374 2.290 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000177159473 680075060 /nfs/dbraw/zinc/07/50/60/680075060.db2.gz KDTRKAZQCPEFSH-MRXNPFEDSA-N 1 1 344.419 2.227 10 5 EEBEMO CCO[C@H](CN[C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])C[NH+](C)C ZINC000926958588 693043677 /nfs/dbraw/zinc/04/36/77/693043677.db2.gz GWCNJMGHSJVANJ-IUODEOHRSA-N 1 1 327.400 2.221 10 5 EEBEMO CCC[N@H+](CCNC(=O)c1cccnn1)Cc1ccccc1[N+](=O)[O-] ZINC001481149453 1179924863 /nfs/dbraw/zinc/92/48/63/1179924863.db2.gz GXGGPXWYILUUEG-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO CCC[N@@H+](CCNC(=O)c1cccnn1)Cc1ccccc1[N+](=O)[O-] ZINC001481149453 1179924868 /nfs/dbraw/zinc/92/48/68/1179924868.db2.gz GXGGPXWYILUUEG-UHFFFAOYSA-N 1 1 343.387 2.027 10 5 EEBEMO Cc1nc[nH]c1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001481198922 1180079677 /nfs/dbraw/zinc/07/96/77/1180079677.db2.gz NRVKBXMMWPIWRT-UHFFFAOYSA-N 1 1 343.387 2.021 10 5 EEBEMO COCC(C)(C)C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482614183 1187408555 /nfs/dbraw/zinc/40/85/55/1187408555.db2.gz PBPFBENTYMMWQQ-UHFFFAOYSA-N 1 1 337.420 2.158 10 5 EEBEMO COCC(C)(C)C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001482614183 1187408556 /nfs/dbraw/zinc/40/85/56/1187408556.db2.gz PBPFBENTYMMWQQ-UHFFFAOYSA-N 1 1 337.420 2.158 10 5 EEBEMO Cn1cccc1C(=O)NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001482985230 1187940464 /nfs/dbraw/zinc/94/04/64/1187940464.db2.gz YZNLOSGWRYFZTB-IHWYPQMZSA-N 1 1 334.401 2.071 10 5 EEBEMO CCCc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)cc1 ZINC001273084341 1194375224 /nfs/dbraw/zinc/37/52/24/1194375224.db2.gz KMVROHUKQAWCPX-IAGOWNOFSA-N 1 1 345.443 2.433 10 5 EEBEMO O=C(OCC[NH+]1CCSCC1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000127503722 1200852240 /nfs/dbraw/zinc/85/22/40/1200852240.db2.gz NHZCSRPPTFDNEF-UHFFFAOYSA-N 1 1 330.793 2.454 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2C[N@@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000868396791 1201805624 /nfs/dbraw/zinc/80/56/24/1201805624.db2.gz NWALNIKCBWRQTK-IUODEOHRSA-N 1 1 332.404 2.185 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H]([NH+]2CCOCC2)CC1 ZINC000882548727 1201893934 /nfs/dbraw/zinc/89/39/34/1201893934.db2.gz GZEKAMYNAATDDD-HNNXBMFYSA-N 1 1 347.415 2.489 10 5 EEBEMO Cc1cc(NC(=O)NCCCCC[NH+]2CCNCC2)ccc1[N+](=O)[O-] ZINC000926086063 1206189581 /nfs/dbraw/zinc/18/95/81/1206189581.db2.gz FYZKUDJINIOFFJ-UHFFFAOYSA-N 1 1 349.435 2.100 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC000928434564 1206382843 /nfs/dbraw/zinc/38/28/43/1206382843.db2.gz JCHVBALVUYSMMQ-DOMZBBRYSA-N 1 1 340.383 2.479 10 5 EEBEMO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](C[C@H](O)C3(O)CCCC3)C2)cc1 ZINC000930641230 1206572486 /nfs/dbraw/zinc/57/24/86/1206572486.db2.gz WQGCQYVLFDCOON-WBVHZDCISA-N 1 1 334.416 2.440 10 5 EEBEMO COc1ccc(CNC(=O)[C@H]2CC[C@@H]3CCCC[N@@H+]23)cc1[N+](=O)[O-] ZINC000900299798 1234178019 /nfs/dbraw/zinc/17/80/19/1234178019.db2.gz KGOUYXLFFAIGLW-UONOGXRCSA-N 1 1 333.388 2.237 10 5 EEBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)c1cscn1 ZINC001277014770 1300835193 /nfs/dbraw/zinc/83/51/93/1300835193.db2.gz YWJQZWDGBNISPZ-UHFFFAOYSA-N 1 1 338.414 2.165 10 5 EEBEMO O=C(NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1)[C@H]1C[C@H]2C[C@H]2C1 ZINC001277151665 1301531900 /nfs/dbraw/zinc/53/19/00/1301531900.db2.gz WLLPLCKAYOPJSE-ITGUQSILSA-N 1 1 335.429 2.441 10 5 EEBEMO Cn1ccc(C(=O)NCCC[N@@H+](C)Cc2cccc([N+](=O)[O-])c2)c1 ZINC001265824666 1323403659 /nfs/dbraw/zinc/40/36/59/1323403659.db2.gz BDIDUEWGLFGDBI-UHFFFAOYSA-N 1 1 330.388 2.185 10 5 EEBEMO CN1CC[NH+](C(C)(C)CNc2nc3c(cc2[N+](=O)[O-])CCCC3)CC1 ZINC001326000419 1334013134 /nfs/dbraw/zinc/01/31/34/1334013134.db2.gz ZLCVQRSRXYYUTJ-UHFFFAOYSA-N 1 1 347.463 2.307 10 5 EEBEMO Cc1c[nH+]cn1CC(=O)Nc1nc(-c2ccc([N+](=O)[O-])cc2)c[nH]1 ZINC001611532980 1352302249 /nfs/dbraw/zinc/30/22/49/1352302249.db2.gz GLDOHALLAOXHDH-UHFFFAOYSA-N 1 1 326.316 2.129 10 5 EEBEMO O=[N+]([O-])CC[N@@H+]1CCC[C@H]([C@H](O)c2ccc(Br)cc2)C1 ZINC001618266721 1352348705 /nfs/dbraw/zinc/34/87/05/1352348705.db2.gz YLENLJMRNPVRCK-GXTWGEPZSA-N 1 1 343.221 2.471 10 5 EEBEMO CC[N@H+](CCNC(=O)Cc1cccnc1)Cc1ccccc1[N+](=O)[O-] ZINC001663372338 1354954441 /nfs/dbraw/zinc/95/44/41/1354954441.db2.gz CLSHHFPJZVPCHS-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1cccnc1)Cc1ccccc1[N+](=O)[O-] ZINC001663372338 1354954445 /nfs/dbraw/zinc/95/44/45/1354954445.db2.gz CLSHHFPJZVPCHS-UHFFFAOYSA-N 1 1 342.399 2.171 10 5 EEBEMO Cc1c(C(=O)N2CC[C@H]3[C@H]2CCC[N@@H+]3C)cc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001594215505 1349875094 /nfs/dbraw/zinc/87/50/94/1349875094.db2.gz WNGOYYOFYKXYTE-UONOGXRCSA-N 1 1 348.359 2.120 10 5 EEBEMO O=C(NCc1c[nH+]c2n1CCC2)c1c[nH]c2ccc([N+](=O)[O-])cc21 ZINC001638058929 1352684276 /nfs/dbraw/zinc/68/42/76/1352684276.db2.gz UDBOKYOTNKSQLH-UHFFFAOYSA-N 1 1 325.328 2.149 10 5 EEBEMO O=C(CC[NH2+][C@@H](c1ncccn1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001655654831 1354180910 /nfs/dbraw/zinc/18/09/10/1354180910.db2.gz HXYKNFDHBCOAFE-MRXNPFEDSA-N 1 1 341.371 2.454 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccncc1 ZINC001667529256 1355754588 /nfs/dbraw/zinc/75/45/88/1355754588.db2.gz NCUCXFIRTQHJPX-UHFFFAOYSA-N 1 1 328.372 2.194 10 5 EEBEMO C[C@H](CNC(=O)N1C[C@H]2C[N@@H+](C)C[C@@]2(C)C1)c1ccccc1[N+](=O)[O-] ZINC001685531372 1358334343 /nfs/dbraw/zinc/33/43/43/1358334343.db2.gz CIIZBALGEVPHDA-LBTNJELSSA-N 1 1 346.431 2.291 10 5 EEBEMO CC[N@H+]1CC[C@@H](N(C)C(=O)Nc2ccc(N)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000823979946 788006172 /nfs/dbraw/zinc/00/61/72/788006172.db2.gz FFYVOAXHYYVQEB-BXUZGUMPSA-N 1 1 335.408 2.371 10 5 EEBEMO C[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@@H+]1C ZINC001146526503 791320547 /nfs/dbraw/zinc/32/05/47/791320547.db2.gz JNCWDDHUOFKXHD-CYBMUJFWSA-N 1 1 340.383 2.433 10 5 EEBEMO C[C@@H]1CN(C(=O)c2ccnc(-c3ccccc3)c2[N+](=O)[O-])CC[N@H+]1C ZINC001146526503 791320557 /nfs/dbraw/zinc/32/05/57/791320557.db2.gz JNCWDDHUOFKXHD-CYBMUJFWSA-N 1 1 340.383 2.433 10 5 EEBEMO C[C@H]1C[N@@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2c[nH]nc21 ZINC001175210558 798033091 /nfs/dbraw/zinc/03/30/91/798033091.db2.gz BVHNPVWUMLDHPX-NSHDSACASA-N 1 1 329.360 2.266 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[C@@H]([NH+]2CCOCC2)C1(C)C ZINC000828133620 800608858 /nfs/dbraw/zinc/60/88/58/800608858.db2.gz BGQRDYZFLVMPAD-LSDHHAIUSA-N 1 1 347.415 2.132 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)Cc2cc(F)c(Cl)cc2[N+](=O)[O-])C1 ZINC000790565872 808804301 /nfs/dbraw/zinc/80/43/01/808804301.db2.gz VIWODRJDBWETIC-SNVBAGLBSA-N 1 1 329.759 2.140 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001566550279 1125721455 /nfs/dbraw/zinc/72/14/55/1125721455.db2.gz GKZZNVBYCATZBG-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001566550279 1125721461 /nfs/dbraw/zinc/72/14/61/1125721461.db2.gz GKZZNVBYCATZBG-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1ccc(C)cc1C ZINC001566550279 1125721468 /nfs/dbraw/zinc/72/14/68/1125721468.db2.gz GKZZNVBYCATZBG-IAGOWNOFSA-N 1 1 333.432 2.297 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)Cc1ccoc1 ZINC001496690442 1101288427 /nfs/dbraw/zinc/28/84/27/1101288427.db2.gz IBBNRCPNEPHRGJ-UHFFFAOYSA-N 1 1 331.372 2.321 10 5 EEBEMO CCC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1ccc(C)c(C)c1 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332.360 2.177 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CN[C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872031978 1198031108 /nfs/dbraw/zinc/03/11/08/1198031108.db2.gz OQUJEWCYJJIQLA-CHWSQXEVSA-N 1 1 325.384 2.495 10 5 EEBEMO COCCN1CCC[C@@H]1C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872031978 1198031118 /nfs/dbraw/zinc/03/11/18/1198031118.db2.gz OQUJEWCYJJIQLA-CHWSQXEVSA-N 1 1 325.384 2.495 10 5 EEBEMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000865997232 1198449330 /nfs/dbraw/zinc/44/93/30/1198449330.db2.gz VPLWEDPFNZBYJS-VIFPVBQESA-N 1 1 348.325 2.266 10 5 EEBEMO CC(C)[N@@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCOC1 ZINC000812293618 1200644363 /nfs/dbraw/zinc/64/43/63/1200644363.db2.gz VAERSZRPAWVEPI-HNNXBMFYSA-N 1 1 331.376 2.310 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)c1cc2nsnc2c([N+](=O)[O-])c1 ZINC000777798567 1206487534 /nfs/dbraw/zinc/48/75/34/1206487534.db2.gz CHHZXIMDHUTQLE-SNVBAGLBSA-N 1 1 349.416 2.204 10 5 EEBEMO 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C[C@@H]1C[N@@H+](CCCOC(=O)[C@@H]2C[C@H]2c2ccc([N+](=O)[O-])cc2)CCO1 ZINC001123025038 1310448275 /nfs/dbraw/zinc/44/82/75/1310448275.db2.gz WBODQNRFJSUHOT-XOKHGSTOSA-N 1 1 348.399 2.352 10 5 EEBEMO Cc1cccc(NC[C@@H]2CCCN2C(=O)c2cc([N+](=O)[O-])c[nH]2)[nH+]1 ZINC001293343228 1328679993 /nfs/dbraw/zinc/67/99/93/1328679993.db2.gz YWYQXQJPFLUNCB-LBPRGKRZSA-N 1 1 329.360 2.343 10 5 EEBEMO CCc1[nH+]ccn1CCNc1c2ccccc2n(C)c(=O)c1[N+](=O)[O-] ZINC001164137824 1321300856 /nfs/dbraw/zinc/30/08/56/1321300856.db2.gz BANWFRRWVUWSSY-UHFFFAOYSA-N 1 1 341.371 2.318 10 5 EEBEMO Cc1[nH]c(CNc2sc(S(C)(=O)=O)cc2[N+](=O)[O-])c(C)[nH+]1 ZINC001164182639 1321311163 /nfs/dbraw/zinc/31/11/63/1321311163.db2.gz UUIIIZCXPRVYDV-UHFFFAOYSA-N 1 1 330.391 2.012 10 5 EEBEMO O=C(NCC1([NH2+]Cc2ccccc2C2CC2)CCC1)[C@@H]1CC1[N+](=O)[O-] ZINC001280480286 1324246702 /nfs/dbraw/zinc/24/67/02/1324246702.db2.gz ISSICGYPQCDPIV-IAGOWNOFSA-N 1 1 343.427 2.358 10 5 EEBEMO CN(CCC[N@@H+](C)CCC1CCCCC1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] 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COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CCC[C@H]3COCC[C@@H]32)c1 ZINC000589501696 468158335 /nfs/dbraw/zinc/15/83/35/468158335.db2.gz WFJMEBMBMRHNAU-ZFWWWQNUSA-N 1 1 334.372 2.382 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ccc(CN3CC[N@H+]4C[C@H](O)C[C@H]4C3)o2)c1 ZINC000594612438 468636747 /nfs/dbraw/zinc/63/67/47/468636747.db2.gz KTUHURCTYQOPBM-JKSUJKDBSA-N 1 1 343.383 2.106 10 5 EEBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000592185260 468648829 /nfs/dbraw/zinc/64/88/29/468648829.db2.gz ODWWGINCFPWGIS-ZDUSSCGKSA-N 1 1 349.284 2.234 10 5 EEBEMO CNC(=O)[C@]1(C(F)(F)F)CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000592185260 468648836 /nfs/dbraw/zinc/64/88/36/468648836.db2.gz ODWWGINCFPWGIS-ZDUSSCGKSA-N 1 1 349.284 2.234 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CC[N@@H+]1C(C)(C)C ZINC000594793032 468687297 /nfs/dbraw/zinc/68/72/97/468687297.db2.gz SPVCWBYRKNLDOR-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000594793032 468687301 /nfs/dbraw/zinc/68/73/01/468687301.db2.gz SPVCWBYRKNLDOR-LBPRGKRZSA-N 1 1 341.433 2.054 10 5 EEBEMO CCN(C(=O)CCOc1ccccc1[N+](=O)[O-])[C@H]1CC[N@@H+](CC)C1 ZINC000598040088 468746179 /nfs/dbraw/zinc/74/61/79/468746179.db2.gz CDTFCCPVTKOAGG-AWEZNQCLSA-N 1 1 335.404 2.306 10 5 EEBEMO CCN(C(=O)CCNc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@@H+](CC)C1 ZINC000598042538 468747340 /nfs/dbraw/zinc/74/73/40/468747340.db2.gz PMDMLJPBODDPFL-CQSZACIVSA-N 1 1 334.420 2.340 10 5 EEBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@H](O)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000601298436 468816439 /nfs/dbraw/zinc/81/64/39/468816439.db2.gz HVEXKUFEVGKNTJ-STQMWFEESA-N 1 1 340.330 2.023 10 5 EEBEMO C[N@@H+]1C[C@H]2[C@@H](CCN2C(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)C1 ZINC000601596253 468931401 /nfs/dbraw/zinc/93/14/01/468931401.db2.gz VZFUWTRJITZGMV-BBRMVZONSA-N 1 1 329.400 2.179 10 5 EEBEMO COCC[N@@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C(C)(C)C1 ZINC000593336799 468943087 /nfs/dbraw/zinc/94/30/87/468943087.db2.gz ADXFLPAJRCYUKA-UHFFFAOYSA-N 1 1 335.404 2.086 10 5 EEBEMO COCC[N@H+]1CCN(C(=O)c2cccc([N+](=O)[O-])c2C)C(C)(C)C1 ZINC000593336799 468943090 /nfs/dbraw/zinc/94/30/90/468943090.db2.gz ADXFLPAJRCYUKA-UHFFFAOYSA-N 1 1 335.404 2.086 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595689528 468956044 /nfs/dbraw/zinc/95/60/44/468956044.db2.gz RDFRYSMPVAXOME-CALCHBBNSA-N 1 1 333.388 2.200 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1C[C@]2(C)COC[C@]2(C)C1 ZINC000595689528 468956048 /nfs/dbraw/zinc/95/60/48/468956048.db2.gz RDFRYSMPVAXOME-CALCHBBNSA-N 1 1 333.388 2.200 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CCC[C@](O)(C3CC3)C2)cccc1[N+](=O)[O-] ZINC000595749388 468986144 /nfs/dbraw/zinc/98/61/44/468986144.db2.gz FTSVFERAMQFEOT-GOSISDBHSA-N 1 1 347.415 2.469 10 5 EEBEMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1nnc(-c3ccc([N+](=O)[O-])cc3)o1)C2 ZINC000595756161 468990874 /nfs/dbraw/zinc/99/08/74/468990874.db2.gz FFIZUMHBDWMOHA-BLLLJJGKSA-N 1 1 330.344 2.113 10 5 EEBEMO Cn1nccc1[C@@H](CO)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000599056253 469102901 /nfs/dbraw/zinc/10/29/01/469102901.db2.gz UOIYCGWBORABJB-LSDHHAIUSA-N 1 1 330.388 2.374 10 5 EEBEMO C[C@@H]1C[C@@H]([NH+]2CCOCC2)CN1c1ccc2cnccc2c1[N+](=O)[O-] ZINC000599082379 469110353 /nfs/dbraw/zinc/11/03/53/469110353.db2.gz QBKBPZJIKNOSEV-UKRRQHHQSA-N 1 1 342.399 2.442 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCN(C2CCC2)C1=O ZINC000599094651 469118051 /nfs/dbraw/zinc/11/80/51/469118051.db2.gz XJWXOWQHBNLGFA-IAQYHMDHSA-N 1 1 333.388 2.407 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000610959533 469123763 /nfs/dbraw/zinc/12/37/63/469123763.db2.gz CWBWRWAQWQUTLZ-NSHDSACASA-N 1 1 331.294 2.438 10 5 EEBEMO COc1cc(N2CC(C[NH+]3CCOCC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596239421 469218561 /nfs/dbraw/zinc/21/85/61/469218561.db2.gz HDEYXCVDXJAVHS-UHFFFAOYSA-N 1 1 341.795 2.025 10 5 EEBEMO C[C@@H]1C[N@H+](CCNc2c3ccccc3ncc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000596429480 469263360 /nfs/dbraw/zinc/26/33/60/469263360.db2.gz JOYAXFNKXOWIRB-QWHCGFSZSA-N 1 1 330.388 2.086 10 5 EEBEMO C[C@@H]1C[N@@H+](CCNc2c3ccccc3ncc2[N+](=O)[O-])[C@@H](C)CO1 ZINC000596429480 469263364 /nfs/dbraw/zinc/26/33/64/469263364.db2.gz JOYAXFNKXOWIRB-QWHCGFSZSA-N 1 1 330.388 2.086 10 5 EEBEMO COc1cc(CN2CCC[N@@H+](C[C@H]3CCCO3)CC2)ccc1[N+](=O)[O-] ZINC000611515167 469269535 /nfs/dbraw/zinc/26/95/35/469269535.db2.gz APUATQTYUXNSLV-MRXNPFEDSA-N 1 1 349.431 2.290 10 5 EEBEMO O=[N+]([O-])c1ccc([O-])cc1CN1CC2(CCOCC2)CC[C@H]1CO ZINC000599543555 469287534 /nfs/dbraw/zinc/28/75/34/469287534.db2.gz RAZHGRUJRRTWQV-AWEZNQCLSA-N 1 1 336.388 2.054 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCOCC2(CC2)C1 ZINC000611815498 469329035 /nfs/dbraw/zinc/32/90/35/469329035.db2.gz HQKGIUXLENUUHH-UHFFFAOYSA-N 1 1 333.388 2.344 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@H](O)C[NH+]1CC(CC(F)(F)F)C1 ZINC000612681080 469524677 /nfs/dbraw/zinc/52/46/77/469524677.db2.gz LQRKSKJMMUAJJS-LLVKDONJSA-N 1 1 334.294 2.219 10 5 EEBEMO Cc1c(C[N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cnn1C ZINC000619184308 469545303 /nfs/dbraw/zinc/54/53/03/469545303.db2.gz JAYMUCWZJWVAAJ-UHFFFAOYSA-N 1 1 331.376 2.097 10 5 EEBEMO Cc1sc(C(=O)N2CC[C@H]([NH+]3CCC3)[C@@H](F)C2)cc1[N+](=O)[O-] ZINC000619253090 469559820 /nfs/dbraw/zinc/55/98/20/469559820.db2.gz RQCBKVPHBQYXMH-QWRGUYRKSA-N 1 1 327.381 2.223 10 5 EEBEMO O=C(C[N@@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595829888 485609854 /nfs/dbraw/zinc/60/98/54/485609854.db2.gz JIACMCXWYSAWER-WDEREUQCSA-N 1 1 339.779 2.155 10 5 EEBEMO O=C(C[N@H+]1CC[C@H]2COC[C@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595829888 485609858 /nfs/dbraw/zinc/60/98/58/485609858.db2.gz JIACMCXWYSAWER-WDEREUQCSA-N 1 1 339.779 2.155 10 5 EEBEMO C[C@H]1CC[C@@](CO)([N@@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000187969509 533728018 /nfs/dbraw/zinc/72/80/18/533728018.db2.gz WMNQSRLQXSKRMY-SUMWQHHRSA-N 1 1 335.404 2.041 10 5 EEBEMO COc1cc([N+](=O)[O-])c(C(=O)N[C@@H]2CC[N@@H+](C)[C@H]2C)cc1SC ZINC000928450685 683206472 /nfs/dbraw/zinc/20/64/72/683206472.db2.gz UTNIJEILHDZGNI-GXSJLCMTSA-N 1 1 339.417 2.148 10 5 EEBEMO C[C@H]1C[N@H+](C)C[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000722243089 693317062 /nfs/dbraw/zinc/31/70/62/693317062.db2.gz FZFDZRNKOSGANC-JOYOIKCWSA-N 1 1 328.210 2.397 10 5 EEBEMO C[C@H]1C[N@@H+](C)C[C@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000722243089 693317066 /nfs/dbraw/zinc/31/70/66/693317066.db2.gz FZFDZRNKOSGANC-JOYOIKCWSA-N 1 1 328.210 2.397 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC001267241505 1178591650 /nfs/dbraw/zinc/59/16/50/1178591650.db2.gz ZNVGQCGRYCJMMA-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO CC[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC001267241505 1178591655 /nfs/dbraw/zinc/59/16/55/1178591655.db2.gz ZNVGQCGRYCJMMA-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO CC[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC001267241505 1178591659 /nfs/dbraw/zinc/59/16/59/1178591659.db2.gz ZNVGQCGRYCJMMA-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO C/C(=C/C(=O)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1)C1CC1 ZINC001267675033 1180141662 /nfs/dbraw/zinc/14/16/62/1180141662.db2.gz ZALIWFXAJPZJIQ-JYRVWZFOSA-N 1 1 329.400 2.499 10 5 EEBEMO Cc1ccc(F)c(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)c1 ZINC001270743354 1185358733 /nfs/dbraw/zinc/35/87/33/1185358733.db2.gz OUXWMXCCBALNDU-GDBMZVCRSA-N 1 1 349.406 2.318 10 5 EEBEMO O=C(Cc1cccc(F)c1[N+](=O)[O-])NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000869449357 1200089146 /nfs/dbraw/zinc/08/91/46/1200089146.db2.gz ZREOUDOGTJJKOB-AWEZNQCLSA-N 1 1 335.379 2.410 10 5 EEBEMO C[C@@]([NH3+])(C(=O)N1CC[C@]2(CC2(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000867983563 1201720190 /nfs/dbraw/zinc/72/01/90/1201720190.db2.gz PZJWDCDLSIJAPY-KBPBESRZSA-N 1 1 325.315 2.026 10 5 EEBEMO Cc1ccc(CNC(=O)NC[C@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000868355180 1201796698 /nfs/dbraw/zinc/79/66/98/1201796698.db2.gz PJSOWLRDKMOWTN-CQSZACIVSA-N 1 1 332.404 2.187 10 5 EEBEMO Cc1c(C(=O)N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000928102430 1206344599 /nfs/dbraw/zinc/34/45/99/1206344599.db2.gz MJKLSNIDIDSPGF-UKRRQHHQSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1c(C(=O)N[C@@H]2CCC[N@H+]3CCSC[C@H]23)cccc1[N+](=O)[O-] ZINC000928102430 1206344602 /nfs/dbraw/zinc/34/46/02/1206344602.db2.gz MJKLSNIDIDSPGF-UKRRQHHQSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000931309618 1206623496 /nfs/dbraw/zinc/62/34/96/1206623496.db2.gz DXTCLVQMRUZGSK-DOPJRALCSA-N 1 1 346.431 2.195 10 5 EEBEMO Cc1c(NC(=O)CCN2C[C@H]3C[N@H+](C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000933737644 1207830435 /nfs/dbraw/zinc/83/04/35/1207830435.db2.gz AOVCQTQBBBYUDK-KDOFPFPSSA-N 1 1 346.431 2.115 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2C[C@H]3CN(C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000933737644 1207830455 /nfs/dbraw/zinc/83/04/55/1207830455.db2.gz AOVCQTQBBBYUDK-KDOFPFPSSA-N 1 1 346.431 2.115 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@H]3CN(C)C[C@@]3(C)C2)cccc1[N+](=O)[O-] ZINC000933737644 1207830461 /nfs/dbraw/zinc/83/04/61/1207830461.db2.gz AOVCQTQBBBYUDK-KDOFPFPSSA-N 1 1 346.431 2.115 10 5 EEBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@@H]12 ZINC001187913392 1279697742 /nfs/dbraw/zinc/69/77/42/1279697742.db2.gz KSGLTTNVQDRCSV-MRVWCRGKSA-N 1 1 333.388 2.442 10 5 EEBEMO Nc1n[nH]c(C2CC[NH+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2)n1 ZINC000852056886 1291975328 /nfs/dbraw/zinc/97/53/28/1291975328.db2.gz RSYXXXNMDMZKMO-UHFFFAOYSA-N 1 1 336.783 2.328 10 5 EEBEMO O=C(NCCC[NH+]1CCOCC1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000858102353 1294006470 /nfs/dbraw/zinc/00/64/70/1294006470.db2.gz ADNIRMIXXOMCDF-UHFFFAOYSA-N 1 1 343.383 2.200 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CNC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC000859208299 1294349486 /nfs/dbraw/zinc/34/94/86/1294349486.db2.gz LRJZBGWUUSWAAR-NSHDSACASA-N 1 1 341.795 2.089 10 5 EEBEMO C[NH+](C)C[C@@H](NC(=O)[C@@H]1CC1[N+](=O)[O-])c1ccc(Cl)c(Cl)c1 ZINC000863037045 1296093398 /nfs/dbraw/zinc/09/33/98/1296093398.db2.gz GIQSICAFKDMPFI-OASPWFOLSA-N 1 1 346.214 2.378 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)NC[C@@]12CC[N@@H+](C1)CCC2 ZINC001123824860 1310718424 /nfs/dbraw/zinc/71/84/24/1310718424.db2.gz PYYFDVJLESOKAP-QGZVFWFLSA-N 1 1 333.388 2.209 10 5 EEBEMO C[N@@H+](CCCNC(=O)c1cncc(F)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC001264976359 1322826902 /nfs/dbraw/zinc/82/69/02/1322826902.db2.gz WWZWFGZRWMSNHZ-UHFFFAOYSA-N 1 1 346.362 2.381 10 5 EEBEMO Cc1cnoc1C(=O)NCCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001265948633 1323511462 /nfs/dbraw/zinc/51/14/62/1323511462.db2.gz XSOXVSHHPKVDKG-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO CC[N@@H+](CCCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC001316891453 1331957195 /nfs/dbraw/zinc/95/71/95/1331957195.db2.gz YQDBRTSIZIETDG-HZPDHXFCSA-N 1 1 345.399 2.426 10 5 EEBEMO CC[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2o1 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C[N@@H+](CCCNc1ncc([N+](=O)[O-])cc1C(N)=O)C1CCCCC1 ZINC000298303832 465359147 /nfs/dbraw/zinc/35/91/47/465359147.db2.gz MLTNJEJJYBXNRW-UHFFFAOYSA-N 1 1 335.408 2.155 10 5 EEBEMO COCCNC(=O)[C@H]1CC[C@H](C)[N@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000064995102 462732832 /nfs/dbraw/zinc/73/28/32/462732832.db2.gz YEHIEIRPJYBPRL-AAEUAGOBSA-N 1 1 341.433 2.019 10 5 EEBEMO COCCNC(=O)[C@H]1CC[C@H](C)[N@@H+](Cc2csc([N+](=O)[O-])c2)C1 ZINC000064995102 462732839 /nfs/dbraw/zinc/73/28/39/462732839.db2.gz YEHIEIRPJYBPRL-AAEUAGOBSA-N 1 1 341.433 2.019 10 5 EEBEMO O=[N+]([O-])c1cnccc1NCC[NH+]1CCN(c2ccccc2)CC1 ZINC000066808365 462932372 /nfs/dbraw/zinc/93/23/72/462932372.db2.gz PWMQKFWAWMEHNY-UHFFFAOYSA-N 1 1 327.388 2.224 10 5 EEBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H](C(N)=O)CC[C@H]1C ZINC000069704057 463307119 /nfs/dbraw/zinc/30/71/19/463307119.db2.gz XBTPUBIGMYEBMH-OLZOCXBDSA-N 1 1 335.404 2.468 10 5 EEBEMO COCCN(C)C(=O)[C@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000070039374 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1 1 341.433 2.006 10 5 EEBEMO C[C@H]1CC[C@](CO)([N@@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000281998716 464663409 /nfs/dbraw/zinc/66/34/09/464663409.db2.gz IQWDQJJUPZOIPG-GUYCJALGSA-N 1 1 335.404 2.406 10 5 EEBEMO COCCC[N@@H+](C)CCNC(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000182863613 464745328 /nfs/dbraw/zinc/74/53/28/464745328.db2.gz FLJGTOFTALMHQL-BUHFOSPRSA-N 1 1 335.404 2.083 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000191204439 464798227 /nfs/dbraw/zinc/79/82/27/464798227.db2.gz JFSWWYNBJYQEHU-WWGRRREGSA-N 1 1 334.372 2.247 10 5 EEBEMO COC(=O)[C@@H]1[C@H]2CCC[C@@H]2C[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000191204439 464798233 /nfs/dbraw/zinc/79/82/33/464798233.db2.gz JFSWWYNBJYQEHU-WWGRRREGSA-N 1 1 334.372 2.247 10 5 EEBEMO CNC(=O)[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000183675296 464896945 /nfs/dbraw/zinc/89/69/45/464896945.db2.gz HZKAHXLYODFEJV-CQSZACIVSA-N 1 1 332.360 2.110 10 5 EEBEMO O=C(Cc1c[nH]c2ccc([N+](=O)[O-])cc12)N1CC[NH+](CCCF)CC1 ZINC000600075429 468449976 /nfs/dbraw/zinc/44/99/76/468449976.db2.gz DPZZMCOZHUWTGY-UHFFFAOYSA-N 1 1 348.378 2.122 10 5 EEBEMO C[N@@H+](CCNS(=O)(=O)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000330848061 465828445 /nfs/dbraw/zinc/82/84/45/465828445.db2.gz CXEUDMCNQREADF-UHFFFAOYSA-N 1 1 341.433 2.138 10 5 EEBEMO CC[N@H+]1CC[C@@H](CN[C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000353446072 465887903 /nfs/dbraw/zinc/88/79/03/465887903.db2.gz ZNHVCRMPXZEQCQ-WMLDXEAASA-N 1 1 343.431 2.349 10 5 EEBEMO CCOC(=O)C1(O)CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000347370268 466595927 /nfs/dbraw/zinc/59/59/27/466595927.db2.gz VBHQYIRCIJJASI-SDNWHVSQSA-N 1 1 348.399 2.388 10 5 EEBEMO C[C@@H]1C[C@@H]([N@@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CCN1C ZINC000411322877 466807472 /nfs/dbraw/zinc/80/74/72/466807472.db2.gz DHMJSMQPAFRPAF-CJNGLKHVSA-N 1 1 334.420 2.338 10 5 EEBEMO COc1cc(C[N@H+](C[C@H]2CCC(=O)N2)C(C)C)c([N+](=O)[O-])cc1F ZINC000412066115 466992160 /nfs/dbraw/zinc/99/21/60/466992160.db2.gz DSKFRAONBLRTHG-GFCCVEGCSA-N 1 1 339.367 2.232 10 5 EEBEMO COc1cc(C[N@@H+](C[C@H]2CCC(=O)N2)C(C)C)c([N+](=O)[O-])cc1F ZINC000412066115 466992162 /nfs/dbraw/zinc/99/21/62/466992162.db2.gz DSKFRAONBLRTHG-GFCCVEGCSA-N 1 1 339.367 2.232 10 5 EEBEMO Cc1c(NC(=O)CCN2CCC[C@]3(CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420358890 467377234 /nfs/dbraw/zinc/37/72/34/467377234.db2.gz FHVDYLZGXXITHE-GOSISDBHSA-N 1 1 346.431 2.307 10 5 EEBEMO C[N@@H+](CCN=c1[nH]c2ccc([N+](=O)[O-])cc2[nH]1)Cc1ccccc1 ZINC000395432731 467436680 /nfs/dbraw/zinc/43/66/80/467436680.db2.gz QVVWVFLCRKXICO-UHFFFAOYSA-N 1 1 325.372 2.437 10 5 EEBEMO CCCc1n[nH]c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)c1[N+](=O)[O-] ZINC000600470127 468567716 /nfs/dbraw/zinc/56/77/16/468567716.db2.gz GBXCORCXEOTUBS-LBPRGKRZSA-N 1 1 335.408 2.017 10 5 EEBEMO C[C@@H](CNc1ccc([N+](=O)[O-])c(N)c1F)[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591769 468630295 /nfs/dbraw/zinc/63/02/95/468630295.db2.gz KAVPXYQSQZOODG-GARJFASQSA-N 1 1 326.372 2.226 10 5 EEBEMO C[C@@H](CNc1ccc([N+](=O)[O-])c(N)c1F)[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000594591769 468630301 /nfs/dbraw/zinc/63/03/01/468630301.db2.gz KAVPXYQSQZOODG-GARJFASQSA-N 1 1 326.372 2.226 10 5 EEBEMO C[C@@H]1C[N@H+](C(C)(C)CNc2ncc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000601100781 468741576 /nfs/dbraw/zinc/74/15/76/468741576.db2.gz BKNMDODPXOHICV-PHIMTYICSA-N 1 1 326.372 2.429 10 5 EEBEMO C[C@@H]1C[N@@H+](C(C)(C)CNc2ncc(F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000601100781 468741581 /nfs/dbraw/zinc/74/15/81/468741581.db2.gz BKNMDODPXOHICV-PHIMTYICSA-N 1 1 326.372 2.429 10 5 EEBEMO CCN(C(=O)Cn1ccc2cc([N+](=O)[O-])ccc21)[C@H]1CC[N@@H+](CC)C1 ZINC000598043236 468747365 /nfs/dbraw/zinc/74/73/65/468747365.db2.gz SDWOAXZDTFSLDC-INIZCTEOSA-N 1 1 344.415 2.492 10 5 EEBEMO CC[N@H+]1C[C@H](C)N(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C[C@@H]1C ZINC000601135626 468755922 /nfs/dbraw/zinc/75/59/22/468755922.db2.gz ICCDTMGCTOYJMU-IUCAKERBSA-N 1 1 335.330 2.266 10 5 EEBEMO C[N@H+]1CCN(c2ncc(F)cc2[N+](=O)[O-])C[C@H]1Cc1ccccc1 ZINC000601161816 468766221 /nfs/dbraw/zinc/76/62/21/468766221.db2.gz UNEWQPZDYYTXLT-OAHLLOKOSA-N 1 1 330.363 2.492 10 5 EEBEMO COCCC[N@@H+](C)CCNC(=O)C1(c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000601234996 468792133 /nfs/dbraw/zinc/79/21/33/468792133.db2.gz KQAOIGZYFVYQPD-UHFFFAOYSA-N 1 1 349.431 2.101 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])s1 ZINC000601306643 468819274 /nfs/dbraw/zinc/81/92/74/468819274.db2.gz NPRRPBZGPMMYBL-SNVBAGLBSA-N 1 1 347.462 2.117 10 5 EEBEMO Cc1cc(S(=O)(=O)NCC[N@@H+]2CCCC[C@H]2C)c([N+](=O)[O-])s1 ZINC000601306643 468819278 /nfs/dbraw/zinc/81/92/78/468819278.db2.gz NPRRPBZGPMMYBL-SNVBAGLBSA-N 1 1 347.462 2.117 10 5 EEBEMO O=[N+]([O-])c1cnn(C[C@@H](O)C[N@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000595672526 468948480 /nfs/dbraw/zinc/94/84/80/468948480.db2.gz ADDGCUUHKZUMOQ-HOCLYGCPSA-N 1 1 346.387 2.363 10 5 EEBEMO COc1ccc(C[N@H+]2CCC[C@@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000595848394 469041552 /nfs/dbraw/zinc/04/15/52/469041552.db2.gz ADLMCTVVIDZAIW-CQSZACIVSA-N 1 1 335.404 2.340 10 5 EEBEMO CCCC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000611515370 469269215 /nfs/dbraw/zinc/26/92/15/469269215.db2.gz SBIOLDBHEYBAJC-UHFFFAOYSA-N 1 1 335.404 2.484 10 5 EEBEMO O=[N+]([O-])c1cnc2ccccc2c1N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000596537583 469296241 /nfs/dbraw/zinc/29/62/41/469296241.db2.gz IALLQAQKCIAERT-AWEZNQCLSA-N 1 1 342.399 2.178 10 5 EEBEMO O=C(c1c[nH]c2cc([N+](=O)[O-])ccc12)N1CC[C@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619252650 469558792 /nfs/dbraw/zinc/55/87/92/469558792.db2.gz LLZPVDFZCSEYIU-ZBFHGGJFSA-N 1 1 346.362 2.334 10 5 EEBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@H](O)C3)cc2)cn1 ZINC000596424208 485612660 /nfs/dbraw/zinc/61/26/60/485612660.db2.gz RFQWMTQOIMPGPZ-INIZCTEOSA-N 1 1 328.372 2.169 10 5 EEBEMO Cc1nn(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000761292169 577681299 /nfs/dbraw/zinc/68/12/99/577681299.db2.gz PHAQVLHDAXZZMY-HNNXBMFYSA-N 1 1 329.404 2.379 10 5 EEBEMO CC(C)(C)OC(=O)[C@@H]1CC[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178865939 681282484 /nfs/dbraw/zinc/28/24/84/681282484.db2.gz GMWZKKGEDUMXBT-HIFRSBDPSA-N 1 1 336.388 2.292 10 5 EEBEMO Cc1cnoc1C(=O)N(C)CC[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001482640228 1187467138 /nfs/dbraw/zinc/46/71/38/1187467138.db2.gz ASUPQNKNSKMFAD-UHFFFAOYSA-N 1 1 332.360 2.095 10 5 EEBEMO Cc1cnoc1C(=O)N(C)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001482640228 1187467141 /nfs/dbraw/zinc/46/71/41/1187467141.db2.gz ASUPQNKNSKMFAD-UHFFFAOYSA-N 1 1 332.360 2.095 10 5 EEBEMO CC[NH+]1CCN([C@H](C)CN[C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872022596 1198028527 /nfs/dbraw/zinc/02/85/27/1198028527.db2.gz KAEMSIMRPUPHCX-ZIAGYGMSSA-N 1 1 338.427 2.411 10 5 EEBEMO C[C@H]([NH2+]C[C@H]1CC[C@@H](C(=O)N(C)C)O1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052633 1198035636 /nfs/dbraw/zinc/03/56/36/1198035636.db2.gz DUPIYDRYBLSDPJ-WDMOLILDSA-N 1 1 339.367 2.020 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1CNc1cc2n(n1)CC[N@@H+](C)C2 ZINC000865844320 1198399971 /nfs/dbraw/zinc/39/99/71/1198399971.db2.gz IXSDPWABTIWJML-UHFFFAOYSA-N 1 1 331.376 2.248 10 5 EEBEMO CC(C)(O)C[N@H+]1CC[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000865998247 1198449640 /nfs/dbraw/zinc/44/96/40/1198449640.db2.gz ABZKDFLCUBYREN-LBPRGKRZSA-N 1 1 330.388 2.400 10 5 EEBEMO C[N@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)[C@@H]1C[C@H]1c1ccc([N+](=O)[O-])cc1 ZINC000874827782 1199022532 /nfs/dbraw/zinc/02/25/32/1199022532.db2.gz UDCHRVBDJIGCEV-VVLHAWIVSA-N 1 1 329.400 2.393 10 5 EEBEMO C[N@H+]1CCN(C(=O)c2n[nH]c3ccc([N+](=O)[O-])cc32)CCC1(C)C ZINC000871152058 1201071475 /nfs/dbraw/zinc/07/14/75/1201071475.db2.gz MATMRYFMUQNJLM-UHFFFAOYSA-N 1 1 331.376 2.027 10 5 EEBEMO C[N@@H+]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC1(C)C ZINC000871152058 1201071484 /nfs/dbraw/zinc/07/14/84/1201071484.db2.gz MATMRYFMUQNJLM-UHFFFAOYSA-N 1 1 331.376 2.027 10 5 EEBEMO C[N@H+]1CCN(C(=O)c2[nH]nc3ccc([N+](=O)[O-])cc32)CCC1(C)C ZINC000871152058 1201071490 /nfs/dbraw/zinc/07/14/90/1201071490.db2.gz MATMRYFMUQNJLM-UHFFFAOYSA-N 1 1 331.376 2.027 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@@H+]2CCSC[C@H]12 ZINC000928099493 1206342962 /nfs/dbraw/zinc/34/29/62/1206342962.db2.gz RJLTWQPRNYCDOJ-HUUCEWRRSA-N 1 1 335.429 2.213 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1C(=O)N[C@@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000928099493 1206342963 /nfs/dbraw/zinc/34/29/63/1206342963.db2.gz RJLTWQPRNYCDOJ-HUUCEWRRSA-N 1 1 335.429 2.213 10 5 EEBEMO O=[N+]([O-])c1cccc(OCCN2CCC([N@H+]3CCCOCC3)CC2)c1 ZINC000931290735 1206622503 /nfs/dbraw/zinc/62/25/03/1206622503.db2.gz DKFUCIMRHHBCBH-UHFFFAOYSA-N 1 1 349.431 2.160 10 5 EEBEMO CC(C)[N@@H+]1CCO[C@H](C(N)=NO[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653253 1210713980 /nfs/dbraw/zinc/71/39/80/1210713980.db2.gz WBWILYCKHQHGHZ-DOMZBBRYSA-N 1 1 336.392 2.263 10 5 EEBEMO CC(C)[N@H+]1CCO[C@H](C(N)=NO[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653253 1210713984 /nfs/dbraw/zinc/71/39/84/1210713984.db2.gz WBWILYCKHQHGHZ-DOMZBBRYSA-N 1 1 336.392 2.263 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852299010 1292081923 /nfs/dbraw/zinc/08/19/23/1292081923.db2.gz LGPNSZYHHDJXKV-UHFFFAOYSA-N 1 1 331.372 2.363 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[N@H+]1CCC2=C(CCC(=O)N2)C1 ZINC000852299010 1292081931 /nfs/dbraw/zinc/08/19/31/1292081931.db2.gz LGPNSZYHHDJXKV-UHFFFAOYSA-N 1 1 331.372 2.363 10 5 EEBEMO CN(C)c1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C(C)(C)C ZINC000855166917 1293097736 /nfs/dbraw/zinc/09/77/36/1293097736.db2.gz SMERBBWGMPBYHJ-ZDUSSCGKSA-N 1 1 334.420 2.263 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])cc([N+](=O)[O-])c1 ZINC000855166170 1293097782 /nfs/dbraw/zinc/09/77/82/1293097782.db2.gz DPDXDPGZTIVUEB-LLVKDONJSA-N 1 1 336.348 2.106 10 5 EEBEMO Cc1nn(CN2CCC[C@@H](c3[nH+]cc4n3CCCC4)C2)cc1[N+](=O)[O-] ZINC000799941388 1305512635 /nfs/dbraw/zinc/51/26/35/1305512635.db2.gz SCGJKMSDHPQQOW-CQSZACIVSA-N 1 1 344.419 2.470 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@@H]3OCCC[C@H]3C2)c1 ZINC001118290349 1306335715 /nfs/dbraw/zinc/33/57/15/1306335715.db2.gz KARLPQJRHCKOBA-BBRMVZONSA-N 1 1 334.372 2.382 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@@H](NC(=O)CCCNc3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC001263995681 1322580638 /nfs/dbraw/zinc/58/06/38/1322580638.db2.gz JMXYKGNLEJFVGT-RRQGHBQHSA-N 1 1 346.431 2.243 10 5 EEBEMO Cc1cccc(C(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001492194442 1331081267 /nfs/dbraw/zinc/08/12/67/1331081267.db2.gz WEGLPSQEWAXMFI-UHFFFAOYSA-N 1 1 328.372 2.160 10 5 EEBEMO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccnn1C ZINC001620516140 1352359848 /nfs/dbraw/zinc/35/98/48/1352359848.db2.gz GIZKSYPXJKULJO-SECBINFHSA-N 1 1 337.767 2.271 10 5 EEBEMO COC(=O)c1cc(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)c(C)o1 ZINC001644141367 1352758068 /nfs/dbraw/zinc/75/80/68/1352758068.db2.gz MHUMMVCEGPMTGO-QGZVFWFLSA-N 1 1 348.355 2.280 10 5 EEBEMO Cc1cc([C@@H]2CCCC[N@@H+]2CCn2cc([N+](=O)[O-])ccc2=O)[nH]n1 ZINC001644653632 1352765216 /nfs/dbraw/zinc/76/52/16/1352765216.db2.gz MWUKFFGTACNJOQ-HNNXBMFYSA-N 1 1 331.376 2.015 10 5 EEBEMO Cc1cc([C@@H]2CCCC[N@H+]2CCn2cc([N+](=O)[O-])ccc2=O)[nH]n1 ZINC001644653632 1352765219 /nfs/dbraw/zinc/76/52/19/1352765219.db2.gz MWUKFFGTACNJOQ-HNNXBMFYSA-N 1 1 331.376 2.015 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCCn2nccc21 ZINC001648139766 1353418092 /nfs/dbraw/zinc/41/80/92/1353418092.db2.gz PDNSTPPOCMVSDI-LBPRGKRZSA-N 1 1 329.360 2.163 10 5 EEBEMO O=[N+]([O-])c1ccc(O)cc1CN1CCC(O)(C[NH+]2CCCCC2)CC1 ZINC001648591735 1353435495 /nfs/dbraw/zinc/43/54/95/1353435495.db2.gz ONESVGDNCNVCSS-UHFFFAOYSA-N 1 1 349.431 2.113 10 5 EEBEMO CCc1ccc2c(c1)CC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C2 ZINC001648661001 1353438006 /nfs/dbraw/zinc/43/80/06/1353438006.db2.gz OLPCNZVCNUWJDO-UHFFFAOYSA-N 1 1 327.384 2.377 10 5 EEBEMO Cc1cc(C(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc(C)n1 ZINC001663193653 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CCCc1[nH]nc(C(=O)N2CC[N@@H+](C3CCCC3)[C@H](C)C2)c1[N+](=O)[O-] ZINC001123943152 1310769630 /nfs/dbraw/zinc/76/96/30/1310769630.db2.gz LXQWWQCBYKVTHZ-GFCCVEGCSA-N 1 1 349.435 2.359 10 5 EEBEMO O=C(c1cnn(-c2cc[nH+]cc2)c1)N1CCc2cc([N+](=O)[O-])ccc21 ZINC001124619417 1310926910 /nfs/dbraw/zinc/92/69/10/1310926910.db2.gz OHTWRYPTLVUWKS-UHFFFAOYSA-N 1 1 335.323 2.378 10 5 EEBEMO Cc1cc([N+](=O)[O-])cc(C(=O)N2CC[NH2+][C@@H](c3ccccc3)C2)n1 ZINC001142264595 1315540940 /nfs/dbraw/zinc/54/09/40/1315540940.db2.gz UUSOTPNFYIVUAS-MRXNPFEDSA-N 1 1 326.356 2.085 10 5 EEBEMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)NCc1c[nH+]c2n1CCC2 ZINC001154930716 1317390268 /nfs/dbraw/zinc/39/02/68/1317390268.db2.gz BFWXXSXFMCSLDG-UHFFFAOYSA-N 1 1 339.355 2.009 10 5 EEBEMO CC[N@H+]1CCCN(C(=O)c2cc([N+](=O)[O-])cc([N+](=O)[O-])c2)[C@H](C)C1 ZINC001161000182 1320349836 /nfs/dbraw/zinc/34/98/36/1320349836.db2.gz GULLKNMNVJZACF-LLVKDONJSA-N 1 1 336.348 2.059 10 5 EEBEMO CN(CCC[NH2+]Cc1ccc(C2CC2)cc1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001322505914 1333273506 /nfs/dbraw/zinc/27/35/06/1333273506.db2.gz TWEDFXLRFXRGHD-IAGOWNOFSA-N 1 1 331.416 2.167 10 5 EEBEMO Cc1cc(NC(=O)Cn2ncc3ccc([N+](=O)[O-])cc32)cc(C)[nH+]1 ZINC001323080245 1333381375 /nfs/dbraw/zinc/38/13/75/1333381375.db2.gz QTVXXMLVHKVPAU-UHFFFAOYSA-N 1 1 325.328 2.017 10 5 EEBEMO Cc1cnc(C(=O)NCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC001567294037 1342734452 /nfs/dbraw/zinc/73/44/52/1342734452.db2.gz IBNJMUIPAMTDRC-UHFFFAOYSA-N 1 1 342.399 2.468 10 5 EEBEMO Cc1cnc(C(=O)NCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1C ZINC001567294037 1342734458 /nfs/dbraw/zinc/73/44/58/1342734458.db2.gz IBNJMUIPAMTDRC-UHFFFAOYSA-N 1 1 342.399 2.468 10 5 EEBEMO O=C(CC[N@H+]1CC[C@H](c2cnccn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC001620617849 1344554423 /nfs/dbraw/zinc/55/44/23/1344554423.db2.gz QWZGBZDFRAQHKX-ZDUSSCGKSA-N 1 1 341.371 2.203 10 5 EEBEMO CC(C)(C)OC(=O)NC[C@@]12C[N@@H+](CC[N+](=O)[O-])C[C@@H]1CCCC2 ZINC001648667979 1353437923 /nfs/dbraw/zinc/43/79/23/1353437923.db2.gz 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Cc1nc([C@H]2CC[N@@H+](CCC(=O)Nc3ccccc3[N+](=O)[O-])C2)no1 ZINC001473791712 1110581028 /nfs/dbraw/zinc/58/10/28/1110581028.db2.gz ICTJMKLVQMKADE-LBPRGKRZSA-N 1 1 345.359 2.104 10 5 EEBEMO CC[NH+](CC)CC[C@H](C)NC(=O)c1n[nH]c2ccc([N+](=O)[O-])cc21 ZINC001521000645 1119207575 /nfs/dbraw/zinc/20/75/75/1119207575.db2.gz PQOIIITXGLISQV-NSHDSACASA-N 1 1 333.392 2.321 10 5 EEBEMO O=C(NC/C=C\C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccccc1O ZINC001568818782 1124837211 /nfs/dbraw/zinc/83/72/11/1124837211.db2.gz YTZDIBKKKBJFAW-ARJAWSKDSA-N 1 1 347.396 2.438 10 5 EEBEMO COC(=O)[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000066833591 215082934 /nfs/dbraw/zinc/08/29/34/215082934.db2.gz YMYKHEZAGAVXTE-STQMWFEESA-N 1 1 349.387 2.115 10 5 EEBEMO COC(=O)[C@H]1CCC[N@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000066833591 215082938 /nfs/dbraw/zinc/08/29/38/215082938.db2.gz YMYKHEZAGAVXTE-STQMWFEESA-N 1 1 349.387 2.115 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)[C@@H](C)CN1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000419009377 239397240 /nfs/dbraw/zinc/39/72/40/239397240.db2.gz VXPFMMUKZQTKEU-QWHCGFSZSA-N 1 1 330.388 2.034 10 5 EEBEMO O=C(CC[N@H+]1CCC[C@@]2(CCOC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000451903117 243303029 /nfs/dbraw/zinc/30/30/29/243303029.db2.gz PFSJTMWTJSSSST-QGZVFWFLSA-N 1 1 333.388 2.426 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCC[C@]3(CCOC3)C2)c([N+](=O)[O-])c1 ZINC000451902463 243303242 /nfs/dbraw/zinc/30/32/42/243303242.db2.gz OMFAWXWECXVFMT-KRWDZBQOSA-N 1 1 336.388 2.485 10 5 EEBEMO C[C@@H](C[NH+]1CCOCC1)C(=O)N(Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000273025076 256258572 /nfs/dbraw/zinc/25/85/72/256258572.db2.gz CPWWPTGDGCNHRZ-AWEZNQCLSA-N 1 1 347.415 2.054 10 5 EEBEMO Cc1nc([N+](=O)[O-])cn1CC(=O)Nc1cccc2c1C[N@H+](C1CC1)C2 ZINC000377188649 154078725 /nfs/dbraw/zinc/07/87/25/154078725.db2.gz MDZZJAYGGKFLSI-UHFFFAOYSA-N 1 1 341.371 2.216 10 5 EEBEMO CN(CC(=O)NC1C[C@H]2CCC[C@@H](C1)[N@@H+]2C)c1ccccc1[N+](=O)[O-] ZINC000080718907 159144549 /nfs/dbraw/zinc/14/45/49/159144549.db2.gz 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EEBEMO COC(=O)c1cc(C)nc(N2CCC[C@@H]3C[N@@H+](C)CC[C@@H]32)c1[N+](=O)[O-] ZINC000283793587 269554928 /nfs/dbraw/zinc/55/49/28/269554928.db2.gz SKSHUNNVBSSXGT-OCCSQVGLSA-N 1 1 348.403 2.005 10 5 EEBEMO COCC[N@H+]1CCCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000267505717 274027288 /nfs/dbraw/zinc/02/72/88/274027288.db2.gz NMEOLQLLKHBMMN-UHFFFAOYSA-N 1 1 330.388 2.302 10 5 EEBEMO C[C@H]1C[N@@H+](CCCNc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCO1 ZINC000278600492 274381061 /nfs/dbraw/zinc/38/10/61/274381061.db2.gz ZMLKNYHOYGNYOG-LBPRGKRZSA-N 1 1 333.392 2.384 10 5 EEBEMO O=C1C[C@@H]([C@H]2CCCC[N@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751159 275019961 /nfs/dbraw/zinc/01/99/61/275019961.db2.gz GSRQRWMXQPOZMF-MEBBXXQBSA-N 1 1 339.342 2.364 10 5 EEBEMO O=C1C[C@@H]([C@H]2CCCC[N@@H+]2Cc2c(F)cc([N+](=O)[O-])cc2F)CN1 ZINC000351751159 275019962 /nfs/dbraw/zinc/01/99/62/275019962.db2.gz GSRQRWMXQPOZMF-MEBBXXQBSA-N 1 1 339.342 2.364 10 5 EEBEMO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@H](n2cc(CO)nn2)C1 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Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1CCOC[C@@H]1[C@H]1CCC[N@@H+]1C ZINC000597696043 468641867 /nfs/dbraw/zinc/64/18/67/468641867.db2.gz VAEMIELGRDPAEG-NVXWUHKLSA-N 1 1 347.415 2.147 10 5 EEBEMO Cn1nc(C(F)(F)F)c([N+](=O)[O-])c1N[C@H]1CC[N@@H+](CC2CC2)C1 ZINC000601116297 468747799 /nfs/dbraw/zinc/74/77/99/468747799.db2.gz PYYZWUDWDPVCQN-VIFPVBQESA-N 1 1 333.314 2.243 10 5 EEBEMO CC[C@@H]([NH2+]Cc1coc(S(N)(=O)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000595422420 468846929 /nfs/dbraw/zinc/84/69/29/468846929.db2.gz XQLQCUFHSJMTCX-CYBMUJFWSA-N 1 1 339.373 2.076 10 5 EEBEMO CC[N@@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)[C@H]1CCCOC1 ZINC000593067920 468859200 /nfs/dbraw/zinc/85/92/00/468859200.db2.gz BGTVLZGYQHVWBO-AWEZNQCLSA-N 1 1 349.387 2.394 10 5 EEBEMO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@H+]1CCC[C@](O)(C2CC2)C1 ZINC000595749721 468986154 /nfs/dbraw/zinc/98/61/54/468986154.db2.gz GTUOEKDWFILUSI-SJKOYZFVSA-N 1 1 333.388 2.159 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCC[C@](O)(C3CC3)C2)c([N+](=O)[O-])c1 ZINC000595749980 468987100 /nfs/dbraw/zinc/98/71/00/468987100.db2.gz JDLXFLQCTKSRKV-QGZVFWFLSA-N 1 1 336.388 2.219 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+]2CC[C@@H]3COC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000595834978 469033146 /nfs/dbraw/zinc/03/31/46/469033146.db2.gz UBCHMLYQNDYVPY-KGLIPLIRSA-N 1 1 333.388 2.200 10 5 EEBEMO CC(C)NC(=O)[C@@H]1CCC[N@@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000595848434 469042023 /nfs/dbraw/zinc/04/20/23/469042023.db2.gz AUWDSNCIBUYESU-CQSZACIVSA-N 1 1 335.404 2.210 10 5 EEBEMO CCC[N@@H+](C)CC(C)(C)NCC(=O)N1CCc2ccc([N+](=O)[O-])cc21 ZINC000595874112 469056877 /nfs/dbraw/zinc/05/68/77/469056877.db2.gz SYVWPLCQNNSXIO-UHFFFAOYSA-N 1 1 348.447 2.194 10 5 EEBEMO O=C(NCCc1ccccc1[N+](=O)[O-])NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000598994567 469080467 /nfs/dbraw/zinc/08/04/67/469080467.db2.gz BCTHAYGAWZPQRM-MRXNPFEDSA-N 1 1 346.431 2.453 10 5 EEBEMO Cn1cc[nH+]c1N1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599049068 469100428 /nfs/dbraw/zinc/10/04/28/469100428.db2.gz RWYGSCYVUFNXRT-UHFFFAOYSA-N 1 1 338.371 2.203 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCO[C@@H]1c1nc(C)no1 ZINC000599091842 469116208 /nfs/dbraw/zinc/11/62/08/469116208.db2.gz GNSRVXJZLDMLMQ-RJIBLYRGSA-N 1 1 348.359 2.476 10 5 EEBEMO CCOc1cc(C[N@H+](C)[C@H]2CCCCN(C)C2=O)ccc1[N+](=O)[O-] ZINC000601970274 469118029 /nfs/dbraw/zinc/11/80/29/469118029.db2.gz NNGWLYYRHNBQRK-HNNXBMFYSA-N 1 1 335.404 2.436 10 5 EEBEMO CCOc1cc(C[N@@H+](C)[C@H]2CCCCN(C)C2=O)ccc1[N+](=O)[O-] ZINC000601970274 469118033 /nfs/dbraw/zinc/11/80/33/469118033.db2.gz NNGWLYYRHNBQRK-HNNXBMFYSA-N 1 1 335.404 2.436 10 5 EEBEMO O=C(CC[N@H+]1CCO[C@@H](C(F)F)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000601978273 469124726 /nfs/dbraw/zinc/12/47/26/469124726.db2.gz XAJXJCXDHQGOTA-CYBMUJFWSA-N 1 1 343.330 2.279 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@@H]2CNc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000599139325 469134135 /nfs/dbraw/zinc/13/41/35/469134135.db2.gz KDPMUFGYBZPXQG-OAHLLOKOSA-N 1 1 342.399 2.993 10 5 EEBEMO O=c1[nH]ccc(NCc2ccc(C[NH+]3CCOCC3)cc2)c1[N+](=O)[O-] ZINC000596061266 469134249 /nfs/dbraw/zinc/13/42/49/469134249.db2.gz IDGRECAROFXQRR-UHFFFAOYSA-N 1 1 344.371 2.140 10 5 EEBEMO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596268333 469227665 /nfs/dbraw/zinc/22/76/65/469227665.db2.gz JPYBOGQPYLSVBY-UHFFFAOYSA-N 1 1 347.415 2.489 10 5 EEBEMO Cc1ccnc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)c1[N+](=O)[O-] ZINC000596515166 469289811 /nfs/dbraw/zinc/28/98/11/469289811.db2.gz ZSZCNKIUSAOIKH-ZIAGYGMSSA-N 1 1 332.404 2.354 10 5 EEBEMO O=C(C[N@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000599681930 469336160 /nfs/dbraw/zinc/33/61/60/469336160.db2.gz RMWAVISGCQBNME-JBCWJZNQSA-N 1 1 339.779 2.032 10 5 EEBEMO O=C(C[N@@H+]1CC[C@@H]2CC[C@@H](O)[C@@H]21)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000599681930 469336163 /nfs/dbraw/zinc/33/61/63/469336163.db2.gz RMWAVISGCQBNME-JBCWJZNQSA-N 1 1 339.779 2.032 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)c2ccc(N3CCCC3)c([N+](=O)[O-])c2)C1 ZINC000604199389 469463027 /nfs/dbraw/zinc/46/30/27/469463027.db2.gz QRYIRVNZWAFQEA-AWEZNQCLSA-N 1 1 332.404 2.019 10 5 EEBEMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CCC[N@@H+](C)C2)cc1SC ZINC000609135975 469894318 /nfs/dbraw/zinc/89/43/18/469894318.db2.gz VFJYFYOZTDZPOJ-JTQLQIEISA-N 1 1 339.417 2.149 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@H](C)C1 ZINC000610178276 469985902 /nfs/dbraw/zinc/98/59/02/469985902.db2.gz RSRZCSMCIGVPFN-YPMHNXCESA-N 1 1 349.387 2.126 10 5 EEBEMO O=C(C[N@@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595829887 485609793 /nfs/dbraw/zinc/60/97/93/485609793.db2.gz JIACMCXWYSAWER-QWRGUYRKSA-N 1 1 339.779 2.155 10 5 EEBEMO O=C(C[N@H+]1CC[C@H]2COC[C@@H]2C1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595829887 485609796 /nfs/dbraw/zinc/60/97/96/485609796.db2.gz JIACMCXWYSAWER-QWRGUYRKSA-N 1 1 339.779 2.155 10 5 EEBEMO CN1CCC[N@H+](CCCNCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000729683876 576672078 /nfs/dbraw/zinc/67/20/78/576672078.db2.gz FAISDJXVKZVXDM-UHFFFAOYSA-N 1 1 340.855 2.365 10 5 EEBEMO CN1CCC[N@@H+](CCCNCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000729683876 576672080 /nfs/dbraw/zinc/67/20/80/576672080.db2.gz FAISDJXVKZVXDM-UHFFFAOYSA-N 1 1 340.855 2.365 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928430670 683027754 /nfs/dbraw/zinc/02/77/54/683027754.db2.gz YYHCUERCHBYIAO-WPRPVWTQSA-N 1 1 342.193 2.180 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2ccc([N+](=O)[O-])cc2Br)CC[N@H+]1C ZINC000928448805 683197060 /nfs/dbraw/zinc/19/70/60/683197060.db2.gz OTHRJRAXXRDTFE-QPUJVOFHSA-N 1 1 342.193 2.180 10 5 EEBEMO COc1cc([N+](=O)[O-])c(C(=O)N[C@H]2CC[N@@H+](C)[C@H]2C)cc1SC ZINC000928450688 683206342 /nfs/dbraw/zinc/20/63/42/683206342.db2.gz UTNIJEILHDZGNI-ONGXEEELSA-N 1 1 339.417 2.148 10 5 EEBEMO COC1(CC(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC001268236420 1182056102 /nfs/dbraw/zinc/05/61/02/1182056102.db2.gz XJHBIJMLOAFLHX-UHFFFAOYSA-N 1 1 349.431 2.444 10 5 EEBEMO CCc1cc(C(=O)N(C)CCC[NH2+]Cc2ccc([N+](=O)[O-])cc2)n[nH]1 ZINC001268783139 1183700898 /nfs/dbraw/zinc/70/08/98/1183700898.db2.gz YXMJGAXPPLTAEO-UHFFFAOYSA-N 1 1 345.403 2.132 10 5 EEBEMO CC[C@@](O)(C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(F)(F)F ZINC000905874191 1189945955 /nfs/dbraw/zinc/94/59/55/1189945955.db2.gz HZJSIARKTREGDY-CQSZACIVSA-N 1 1 347.337 2.420 10 5 EEBEMO O=C(/C=C/c1ccc[nH]1)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001483729671 1190833596 /nfs/dbraw/zinc/83/35/96/1190833596.db2.gz ZPBYJEJHAXUAPG-ONEGZZNKSA-N 1 1 346.412 2.436 10 5 EEBEMO CC[N@@H+](CCC(C)C)CC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001485031298 1191621418 /nfs/dbraw/zinc/62/14/18/1191621418.db2.gz LUQLLAULZRGESF-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO CC[N@H+](CCC(C)C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031298 1191621420 /nfs/dbraw/zinc/62/14/20/1191621420.db2.gz LUQLLAULZRGESF-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO CC[N@@H+](CCC(C)C)CC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001485031298 1191621421 /nfs/dbraw/zinc/62/14/21/1191621421.db2.gz LUQLLAULZRGESF-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO C[C@H]([NH2+]C[C@@H]1CC[C@@H](C(=O)N(C)C)O1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052632 1198035454 /nfs/dbraw/zinc/03/54/54/1198035454.db2.gz DUPIYDRYBLSDPJ-MJVIPROJSA-N 1 1 339.367 2.020 10 5 EEBEMO C[C@H]1[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N2CCCC2)CC[N@H+]1C ZINC000928450361 1206386502 /nfs/dbraw/zinc/38/65/02/1206386502.db2.gz IANPJWABISQSLE-SWLSCSKDSA-N 1 1 332.404 2.017 10 5 EEBEMO O=[N+]([O-])CC[NH+]1CCC(O)(Cc2ccc(OC(F)(F)F)cc2)CC1 ZINC000930241248 1206543596 /nfs/dbraw/zinc/54/35/96/1206543596.db2.gz DAEPQLYVGOHBCH-UHFFFAOYSA-N 1 1 348.321 2.231 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1NC(=O)N1C[C@@H]2C[N@@H+](C)C[C@]2(C)C1 ZINC000930884802 1206590109 /nfs/dbraw/zinc/59/01/09/1206590109.db2.gz ROGZIQNQMPEEQW-MEDUHNTESA-N 1 1 334.376 2.019 10 5 EEBEMO O=C(C[NH2+][C@@]1(c2ccccc2)C[C@@H](O)C1)Nc1ccccc1[N+](=O)[O-] ZINC001197573410 1284669211 /nfs/dbraw/zinc/66/92/11/1284669211.db2.gz JWIXBUUDNVLWDA-UJKQEGAGSA-N 1 1 341.367 2.173 10 5 EEBEMO C[C@@H]([NH2+]CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)c1ccns1 ZINC000860056989 1294782199 /nfs/dbraw/zinc/78/21/99/1294782199.db2.gz XSEXKWVILCYUJC-SNVBAGLBSA-N 1 1 332.385 2.291 10 5 EEBEMO COc1c(C)[nH]cc(C[N@@H+](C)CCc2ccc([N+](=O)[O-])cc2)c1=O ZINC000931323702 1297139201 /nfs/dbraw/zinc/13/92/01/1297139201.db2.gz WPRHSXSKOUDAEB-UHFFFAOYSA-N 1 1 331.372 2.275 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC001161493714 1320517223 /nfs/dbraw/zinc/51/72/23/1320517223.db2.gz GMNWCVWQODTYEW-SNVBAGLBSA-N 1 1 348.359 2.120 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N2CC[N@@H+](C3CC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC001161493714 1320517225 /nfs/dbraw/zinc/51/72/25/1320517225.db2.gz GMNWCVWQODTYEW-SNVBAGLBSA-N 1 1 348.359 2.120 10 5 EEBEMO CC[N@H+](CCCNC(=O)c1ccn[nH]1)Cc1csc([N+](=O)[O-])c1 ZINC001265101600 1322920705 /nfs/dbraw/zinc/92/07/05/1322920705.db2.gz RWALNDLDPUGTTI-UHFFFAOYSA-N 1 1 337.405 2.021 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1ccn[nH]1)Cc1csc([N+](=O)[O-])c1 ZINC001265101600 1322920707 /nfs/dbraw/zinc/92/07/07/1322920707.db2.gz RWALNDLDPUGTTI-UHFFFAOYSA-N 1 1 337.405 2.021 10 5 EEBEMO CC(C)[N@H+]1CCC[C@H](C(=O)NCc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC001297105883 1329943401 /nfs/dbraw/zinc/94/34/01/1329943401.db2.gz MRQGDNRBZDSSKG-LBPRGKRZSA-N 1 1 345.403 2.208 10 5 EEBEMO CCC[N@@H+](CCNC(=O)C1=CCOCC1)Cc1cccc([N+](=O)[O-])c1 ZINC001317542162 1332290903 /nfs/dbraw/zinc/29/09/03/1332290903.db2.gz NBICUNQUEQWVKI-UHFFFAOYSA-N 1 1 347.415 2.270 10 5 EEBEMO O=C(CCC(F)F)NCC1C[NH+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001318139071 1332477171 /nfs/dbraw/zinc/47/71/71/1332477171.db2.gz WHKGEJVHUJGLQO-UHFFFAOYSA-N 1 1 327.331 2.188 10 5 EEBEMO COc1cc(C(=O)Nc2cc(C)[nH+]c(C)c2)c([N+](=O)[O-])cc1OC ZINC001319543393 1332718391 /nfs/dbraw/zinc/71/83/91/1332718391.db2.gz SWRHLLOCZUGUPM-UHFFFAOYSA-N 1 1 331.328 2.298 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H]1CC[C@@H]2C[N@@H+](C)C[C@H]12 ZINC001347726711 1337519551 /nfs/dbraw/zinc/51/95/51/1337519551.db2.gz CLDRLVYPHKSNDR-KWCYVHTRSA-N 1 1 348.403 2.455 10 5 EEBEMO C[N@H+](C[C@@H]1CCCCO1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474625 1338704682 /nfs/dbraw/zinc/70/46/82/1338704682.db2.gz FIGDGMUALOTQLK-IRXDYDNUSA-N 1 1 347.415 2.369 10 5 EEBEMO C[N@@H+](C[C@@H]1CCCCO1)CN1CC[C@@H](c2ccc([N+](=O)[O-])cc2)C1=O ZINC000848474625 1338704685 /nfs/dbraw/zinc/70/46/85/1338704685.db2.gz FIGDGMUALOTQLK-IRXDYDNUSA-N 1 1 347.415 2.369 10 5 EEBEMO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H]2C[C@H](O)CC[C@@H]2C1 ZINC001559995967 1342506104 /nfs/dbraw/zinc/50/61/04/1342506104.db2.gz HIALIHUVZHEANI-RSUWNVLCSA-N 1 1 333.388 2.015 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001567281906 1342732743 /nfs/dbraw/zinc/73/27/43/1342732743.db2.gz XSRXVGNKGAVJKJ-ZIAGYGMSSA-N 1 1 333.413 2.115 10 5 EEBEMO C[N@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001567281906 1342732746 /nfs/dbraw/zinc/73/27/46/1342732746.db2.gz XSRXVGNKGAVJKJ-ZIAGYGMSSA-N 1 1 333.413 2.115 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cc2ccccc2s1 ZINC001567281906 1342732749 /nfs/dbraw/zinc/73/27/49/1342732749.db2.gz XSRXVGNKGAVJKJ-ZIAGYGMSSA-N 1 1 333.413 2.115 10 5 EEBEMO CC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001659926197 1354389976 /nfs/dbraw/zinc/38/99/76/1354389976.db2.gz UZYGIMKEVXYYCD-KRWDZBQOSA-N 1 1 343.383 2.249 10 5 EEBEMO CC[N@@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001659926197 1354389979 /nfs/dbraw/zinc/38/99/79/1354389979.db2.gz UZYGIMKEVXYYCD-KRWDZBQOSA-N 1 1 343.383 2.249 10 5 EEBEMO O=C(CC[N@H+]1CC[C@@H](c2ncccn2)C1)Nc1ccccc1[N+](=O)[O-] ZINC001660357175 1354447902 /nfs/dbraw/zinc/44/79/02/1354447902.db2.gz HAVSGTLHTWDQTM-CYBMUJFWSA-N 1 1 341.371 2.203 10 5 EEBEMO CCC[N@H+]1CCC[C@H]1C(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911478930 787497898 /nfs/dbraw/zinc/49/78/98/787497898.db2.gz VWINBBZAQIGSCO-ZDUSSCGKSA-N 1 1 327.331 2.364 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(C(=O)OC[C@@H]2C[N@@H+](CC(C)C)CCO2)c1 ZINC000174282129 792055589 /nfs/dbraw/zinc/05/55/89/792055589.db2.gz MJJUTRGXJMPUSX-AWEZNQCLSA-N 1 1 336.388 2.417 10 5 EEBEMO NC(=O)[C@H](C1CC1)[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC1 ZINC001175503760 798136792 /nfs/dbraw/zinc/13/67/92/798136792.db2.gz RFKQKDOSJUJAIK-INIZCTEOSA-N 1 1 344.371 2.212 10 5 EEBEMO NC(=O)[C@H](C1CC1)[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)CC1CC1 ZINC001175503760 798136794 /nfs/dbraw/zinc/13/67/94/798136794.db2.gz RFKQKDOSJUJAIK-INIZCTEOSA-N 1 1 344.371 2.212 10 5 EEBEMO C[C@H](c1ccccc1)[NH+]1CCN(C(=O)c2cc([N+](=O)[O-])c[nH]2)CC1 ZINC001170072413 807093224 /nfs/dbraw/zinc/09/32/24/807093224.db2.gz MFKMPHYSCFMGDY-CYBMUJFWSA-N 1 1 328.372 2.442 10 5 EEBEMO C[N@@H+](CCCNC(=O)c1ccsn1)Cc1cccc([N+](=O)[O-])c1 ZINC001479778461 1098962461 /nfs/dbraw/zinc/96/24/61/1098962461.db2.gz 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C[N@H+]1CC[C@H](NC(=O)c2c(N)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245645722 277168697 /nfs/dbraw/zinc/16/86/97/277168697.db2.gz BMSRZBMLZNJSDG-WMLDXEAASA-N 1 1 340.383 2.352 10 5 EEBEMO C[NH+](C)C[C@H]1CCCN1C(=O)c1cc(-c2ccc([N+](=O)[O-])cc2)[nH]n1 ZINC000448883483 315396847 /nfs/dbraw/zinc/39/68/47/315396847.db2.gz QYDJWHHXUQOXRB-CQSZACIVSA-N 1 1 343.387 2.151 10 5 EEBEMO O=C(Cn1c[nH+]c2c1CCCC2)NCCc1ccccc1[N+](=O)[O-] ZINC000547767250 318320739 /nfs/dbraw/zinc/32/07/39/318320739.db2.gz PXCOUXCAWKXVPD-UHFFFAOYSA-N 1 1 328.372 2.029 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@H+]2CC[C@H](O)CC23CCC3)c2c(c1)COCO2 ZINC000580429275 324060972 /nfs/dbraw/zinc/06/09/72/324060972.db2.gz JMWXRZJGGPYTMR-HNNXBMFYSA-N 1 1 334.372 2.341 10 5 EEBEMO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](O)CC23CCC3)c2c(c1)COCO2 ZINC000580429275 324060974 /nfs/dbraw/zinc/06/09/74/324060974.db2.gz JMWXRZJGGPYTMR-HNNXBMFYSA-N 1 1 334.372 2.341 10 5 EEBEMO C[C@@H](Oc1ccc(Cl)cc1[N+](=O)[O-])C(=O)NC[C@@H]1CCC[N@H+]1C ZINC000358698695 465271588 /nfs/dbraw/zinc/27/15/88/465271588.db2.gz MBDLZUDOKBKFNR-PWSUYJOCSA-N 1 1 341.795 2.226 10 5 EEBEMO Cc1c(NC(=O)N2C[C@@H](C)[C@H]([NH+]3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC000177700297 463769457 /nfs/dbraw/zinc/76/94/57/463769457.db2.gz IWVRJRWHZRYRPN-MLGOLLRUSA-N 1 1 348.403 2.088 10 5 EEBEMO O=C1C[C@]2(CC[N@@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C2)CN1 ZINC000294224583 464436221 /nfs/dbraw/zinc/43/62/21/464436221.db2.gz SNFNKHZOSYXHOF-CQSZACIVSA-N 1 1 343.305 2.326 10 5 EEBEMO O=C1C[C@]2(CC[N@H+](Cc3cc([N+](=O)[O-])ccc3C(F)(F)F)C2)CN1 ZINC000294224583 464436228 /nfs/dbraw/zinc/43/62/28/464436228.db2.gz SNFNKHZOSYXHOF-CQSZACIVSA-N 1 1 343.305 2.326 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000246129957 464548984 /nfs/dbraw/zinc/54/89/84/464548984.db2.gz JMPMEYMAXIWMQR-STQMWFEESA-N 1 1 341.433 2.006 10 5 EEBEMO Cc1[nH+]ccn1C[C@H]1CCCN1C(=O)NCc1ccc([N+](=O)[O-])cc1 ZINC000175930112 464660740 /nfs/dbraw/zinc/66/07/40/464660740.db2.gz DEOVBIHNYHTDCM-MRXNPFEDSA-N 1 1 343.387 2.474 10 5 EEBEMO CCOc1ccc(C(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000177115308 464934888 /nfs/dbraw/zinc/93/48/88/464934888.db2.gz KVJQFCFCDPFLIY-DGCLKSJQSA-N 1 1 333.388 2.349 10 5 EEBEMO COc1cc(C[NH2+]Cc2c3c(nn2C)CCCC3)c([N+](=O)[O-])cc1O ZINC000361060702 465738416 /nfs/dbraw/zinc/73/84/16/465738416.db2.gz NLBCTFOSDIHDTB-UHFFFAOYSA-N 1 1 346.387 2.211 10 5 EEBEMO C[C@@H]1CN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@H+]1CCO ZINC000302380368 466136983 /nfs/dbraw/zinc/13/69/83/466136983.db2.gz GPQHETHQAPEBMG-SNVBAGLBSA-N 1 1 333.310 2.116 10 5 EEBEMO Cc1c[nH+]cn1C1CCN(C(=O)c2cc(F)cc([N+](=O)[O-])c2N)CC1 ZINC000372307206 466294286 /nfs/dbraw/zinc/29/42/86/466294286.db2.gz DGPFXHDWKCZONR-UHFFFAOYSA-N 1 1 347.350 2.298 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000367447790 466341855 /nfs/dbraw/zinc/34/18/55/466341855.db2.gz KWCQDYMUVMGGOB-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@@]2(C1)CCCOC2 ZINC000367447790 466341864 /nfs/dbraw/zinc/34/18/64/466341864.db2.gz KWCQDYMUVMGGOB-QGZVFWFLSA-N 1 1 333.388 2.344 10 5 EEBEMO COc1ccc(NC(=O)C[N@@H+]2CC[C@]3(C2)CCCOC3)c([N+](=O)[O-])c1 ZINC000367452818 466346669 /nfs/dbraw/zinc/34/66/69/466346669.db2.gz WMKLZSZHCUZGAV-KRWDZBQOSA-N 1 1 349.387 2.044 10 5 EEBEMO COc1ccc(NC(=O)C[N@H+]2CC[C@]3(C2)CCCOC3)c([N+](=O)[O-])c1 ZINC000367452818 466346674 /nfs/dbraw/zinc/34/66/74/466346674.db2.gz WMKLZSZHCUZGAV-KRWDZBQOSA-N 1 1 349.387 2.044 10 5 EEBEMO Cc1c[nH+]cn1C1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)CC1 ZINC000363712083 466574396 /nfs/dbraw/zinc/57/43/96/466574396.db2.gz IYJIWZYRIMIWEX-UHFFFAOYSA-N 1 1 344.371 2.342 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCC[C@@H](c3ccncn3)C2)c1 ZINC000370996535 467067188 /nfs/dbraw/zinc/06/71/88/467067188.db2.gz DZNYPHDYZHPCQK-RHSMWYFYSA-N 1 1 328.372 2.298 10 5 EEBEMO C[C@H]1C[N@@H+](CCO)CCN1c1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000450951903 467214136 /nfs/dbraw/zinc/21/41/36/467214136.db2.gz GUSCNIBBYYZDSI-AWEZNQCLSA-N 1 1 342.399 2.160 10 5 EEBEMO COc1cc(C[N@@H+](C)CCN2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434693421 467418578 /nfs/dbraw/zinc/41/85/78/467418578.db2.gz MMSMHNPGUIVMCC-OKILXGFUSA-N 1 1 337.420 2.144 10 5 EEBEMO COc1cc(CN(C)CC[N@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434693421 467418585 /nfs/dbraw/zinc/41/85/85/467418585.db2.gz MMSMHNPGUIVMCC-OKILXGFUSA-N 1 1 337.420 2.144 10 5 EEBEMO COc1cc(CN(C)CC[N@@H+]2C[C@@H](C)O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000434693421 467418588 /nfs/dbraw/zinc/41/85/88/467418588.db2.gz MMSMHNPGUIVMCC-OKILXGFUSA-N 1 1 337.420 2.144 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449784748 467714708 /nfs/dbraw/zinc/71/47/08/467714708.db2.gz CFOHJBKGASPWJA-CQSZACIVSA-N 1 1 345.399 2.353 10 5 EEBEMO CC(C)([NH2+]CC(=O)N1CCOC[C@H]1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000590020759 468206758 /nfs/dbraw/zinc/20/67/58/468206758.db2.gz BMYPSIXSQOVPKK-INIZCTEOSA-N 1 1 347.415 2.057 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1C(=O)NC[C@@H]1CC[N@H+]1C1CCCC1 ZINC000600472665 468566915 /nfs/dbraw/zinc/56/69/15/468566915.db2.gz OCORSNVBVHSEKW-AWEZNQCLSA-N 1 1 333.388 2.350 10 5 EEBEMO CC(C)NC(=O)C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131352 468632599 /nfs/dbraw/zinc/63/25/99/468632599.db2.gz YSPNGQKSZPQXQG-WKILWMFISA-N 1 1 349.431 2.225 10 5 EEBEMO CC(C)NC(=O)C[N@@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000592131352 468632603 /nfs/dbraw/zinc/63/26/03/468632603.db2.gz YSPNGQKSZPQXQG-WKILWMFISA-N 1 1 349.431 2.225 10 5 EEBEMO COC[C@@H](CC[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)OC ZINC000595060288 468750103 /nfs/dbraw/zinc/75/01/03/468750103.db2.gz MGSAYTOISAEBKV-CVEARBPZSA-N 1 1 348.403 2.059 10 5 EEBEMO CC[N@@H+](C)C[C@H]1CCN(c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601126090 468751948 /nfs/dbraw/zinc/75/19/48/468751948.db2.gz YKQYKEYKPRMYON-SECBINFHSA-N 1 1 335.330 2.125 10 5 EEBEMO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1C[C@H](C)n2ncnc21 ZINC000595069156 468752113 /nfs/dbraw/zinc/75/21/13/468752113.db2.gz NEZDPGYBTGQCSC-SUNKGSAMSA-N 1 1 344.375 2.199 10 5 EEBEMO CC(C)[N@H+]1CC[C@H](N(C)c2c([N+](=O)[O-])c(C(F)(F)F)nn2C)C1 ZINC000601172653 468770076 /nfs/dbraw/zinc/77/00/76/468770076.db2.gz DWTJYKSTGQZJBV-VIFPVBQESA-N 1 1 335.330 2.266 10 5 EEBEMO O=[N+]([O-])c1cccc(N2CC[NH+](CCO[C@H]3CC3(F)F)CC2)c1 ZINC000595290479 468801183 /nfs/dbraw/zinc/80/11/83/468801183.db2.gz KGSHHULUSMFVTB-AWEZNQCLSA-N 1 1 327.331 2.141 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000595330534 468814865 /nfs/dbraw/zinc/81/48/65/468814865.db2.gz LIJNKFMZVZIWIN-MRXNPFEDSA-N 1 1 337.395 2.421 10 5 EEBEMO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1CN1CCOCC1 ZINC000595330534 468814870 /nfs/dbraw/zinc/81/48/70/468814870.db2.gz LIJNKFMZVZIWIN-MRXNPFEDSA-N 1 1 337.395 2.421 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](O)CC23CCC3)c1 ZINC000593034379 468846601 /nfs/dbraw/zinc/84/66/01/468846601.db2.gz FZCKHINLOIQULY-AWEZNQCLSA-N 1 1 334.372 2.261 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+]2CC[C@H](O)CC23CCC3)c1 ZINC000593034379 468846605 /nfs/dbraw/zinc/84/66/05/468846605.db2.gz FZCKHINLOIQULY-AWEZNQCLSA-N 1 1 334.372 2.261 10 5 EEBEMO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(C3(O)CC3)CC2)cccc1[N+](=O)[O-] ZINC000593049967 468851443 /nfs/dbraw/zinc/85/14/43/468851443.db2.gz NDQBXUKKZDPVKW-ZDUSSCGKSA-N 1 1 347.415 2.467 10 5 EEBEMO COC(=O)c1ccnc(NCC[N@@H+]2[C@H](C)CCC[C@@H]2C)c1[N+](=O)[O-] ZINC000598596647 468927220 /nfs/dbraw/zinc/92/72/20/468927220.db2.gz RCGJZLPABVHSAC-TXEJJXNPSA-N 1 1 336.392 2.451 10 5 EEBEMO C[C@@]1(F)C[NH2+]CCN(C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000598912921 469046933 /nfs/dbraw/zinc/04/69/33/469046933.db2.gz CZUMFOBXHSOWFB-CYBMUJFWSA-N 1 1 330.747 2.414 10 5 EEBEMO CC(C)C[N@@H+](C)CCCNC(=O)c1[nH]nc(C(C)C)c1[N+](=O)[O-] ZINC000593754922 469124614 /nfs/dbraw/zinc/12/46/14/469124614.db2.gz 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CC[C@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000174980814 529303260 /nfs/dbraw/zinc/30/32/60/529303260.db2.gz ISBLTMBQNZZLBJ-UONOGXRCSA-N 1 1 332.404 2.092 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@@H]([C@H]3CCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000747822988 577950636 /nfs/dbraw/zinc/95/06/36/577950636.db2.gz GJNILTQZPDVDRA-KGLIPLIRSA-N 1 1 345.403 2.354 10 5 EEBEMO C[C@@H]1[C@@H](NC(=O)N(Cc2ccccc2[N+](=O)[O-])C2CC2)CC[N@H+]1C ZINC000925329394 692753303 /nfs/dbraw/zinc/75/33/03/692753303.db2.gz ANVVCLHXQXEKQH-DOMZBBRYSA-N 1 1 332.404 2.361 10 5 EEBEMO CCCSCC(=O)NCC1C[NH+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001267673642 1180140580 /nfs/dbraw/zinc/14/05/80/1180140580.db2.gz DQGYWXGSPDZDSK-UHFFFAOYSA-N 1 1 337.445 2.286 10 5 EEBEMO C[C@@H](C[N+](=O)[O-])OC(=O)c1cnn(-c2cc[nH+]cc2)c1C(F)F ZINC000814041887 1199270129 /nfs/dbraw/zinc/27/01/29/1199270129.db2.gz RZHRRDNSGKVZQF-QMMMGPOBSA-N 1 1 326.259 2.027 10 5 EEBEMO COc1cc(C(=O)N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])cc1F ZINC000871158369 1201079483 /nfs/dbraw/zinc/07/94/83/1201079483.db2.gz ZQFVXWPITBFBID-UHFFFAOYSA-N 1 1 339.367 2.299 10 5 EEBEMO Cc1ccc(S(=O)(=O)N2CC[N@H+](C)C(C)(C)CC2)cc1[N+](=O)[O-] ZINC000867681820 1201657519 /nfs/dbraw/zinc/65/75/19/1201657519.db2.gz NULXVMAQMJOWAX-UHFFFAOYSA-N 1 1 341.433 2.008 10 5 EEBEMO C[C@]([NH3+])(C(=O)N1CC[C@]2(CC2(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000867983566 1201720199 /nfs/dbraw/zinc/72/01/99/1201720199.db2.gz PZJWDCDLSIJAPY-KGLIPLIRSA-N 1 1 325.315 2.026 10 5 EEBEMO CC[N@H+]1CC[C@H]1CNC(=O)[C@@H](C)Oc1ccc(Cl)cc1[N+](=O)[O-] ZINC000882485487 1201880351 /nfs/dbraw/zinc/88/03/51/1201880351.db2.gz SYJQKZJZMFQSHM-PWSUYJOCSA-N 1 1 341.795 2.226 10 5 EEBEMO Cc1ccc(CNC(=O)N2CC[C@H]3[C@@H](CC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000869055122 1201929983 /nfs/dbraw/zinc/92/99/83/1201929983.db2.gz QZIALMCOJMKIBW-GJZGRUSLSA-N 1 1 332.404 2.139 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)C(C)(C)c3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1 ZINC000887931597 1204511109 /nfs/dbraw/zinc/51/11/09/1204511109.db2.gz AIBMOAOAAGQNGY-KDOFPFPSSA-N 1 1 331.416 2.283 10 5 EEBEMO Cc1cc(C(=O)N[C@H]2CCC[N@H+]3CCSC[C@H]23)ccc1[N+](=O)[O-] ZINC000928102004 1206344158 /nfs/dbraw/zinc/34/41/58/1206344158.db2.gz KXZXRINYDPBPQN-DZGCQCFKSA-N 1 1 335.429 2.213 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)c2cc(C(F)(F)F)ccc2[N+](=O)[O-])CC[N@H+]1C ZINC000928433560 1206382944 /nfs/dbraw/zinc/38/29/44/1206382944.db2.gz MPNMUTNPGSRDML-KWQFWETISA-N 1 1 331.294 2.436 10 5 EEBEMO COc1ccc([N+](=O)[O-])cc1CN1CCC([N@H+]2CCCOCC2)CC1 ZINC000931284068 1206621696 /nfs/dbraw/zinc/62/16/96/1206621696.db2.gz NBCJPZQSXGZZKH-UHFFFAOYSA-N 1 1 349.431 2.290 10 5 EEBEMO CC(C)[N@@H+]1CCO[C@@H](C(N)=NO[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653254 1210714070 /nfs/dbraw/zinc/71/40/70/1210714070.db2.gz WBWILYCKHQHGHZ-IUODEOHRSA-N 1 1 336.392 2.263 10 5 EEBEMO CC(C)[N@H+]1CCO[C@@H](C(N)=NO[C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000779653254 1210714072 /nfs/dbraw/zinc/71/40/72/1210714072.db2.gz WBWILYCKHQHGHZ-IUODEOHRSA-N 1 1 336.392 2.263 10 5 EEBEMO C[N@H+]1CC[C@H]2CN(C(=O)[C@@H]3C[C@H]3c3ccc([N+](=O)[O-])cc3)CC[C@@H]21 ZINC000827247322 1238682523 /nfs/dbraw/zinc/68/25/23/1238682523.db2.gz WCXOUAFRHYMMDL-LLLHUVSDSA-N 1 1 329.400 2.251 10 5 EEBEMO COc1ccc(C[N@@H+]2CC[C@H]2CNc2nn(C)cc2[N+](=O)[O-])cc1 ZINC001187081460 1279390229 /nfs/dbraw/zinc/39/02/29/1279390229.db2.gz LSADFHPEIRPWPI-ZDUSSCGKSA-N 1 1 331.376 2.023 10 5 EEBEMO COc1ccc(C[N@H+]2CC[C@H]2CNc2nn(C)cc2[N+](=O)[O-])cc1 ZINC001187081460 1279390242 /nfs/dbraw/zinc/39/02/42/1279390242.db2.gz LSADFHPEIRPWPI-ZDUSSCGKSA-N 1 1 331.376 2.023 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@H]1CNC(=O)c1cc(F)c(F)cc1[N+](=O)[O-] ZINC000857635093 1293874201 /nfs/dbraw/zinc/87/42/01/1293874201.db2.gz RFNTZPAEQZGNPH-VIFPVBQESA-N 1 1 327.331 2.476 10 5 EEBEMO Cc1ccc(NCC[N@H+]2CC[C@@H](O)C2)c([N+](=O)[O-])c1Br ZINC000858813038 1294233607 /nfs/dbraw/zinc/23/36/07/1294233607.db2.gz ZOKXGECEEZNDCS-SNVBAGLBSA-N 1 1 344.209 2.144 10 5 EEBEMO CC(C)(C)[N@H+]1CC[C@@H]1CNC(=O)N1Cc2ccc([N+](=O)[O-])cc2C1 ZINC001118564047 1308884600 /nfs/dbraw/zinc/88/46/00/1308884600.db2.gz PXVPQUTZLCSORJ-OAHLLOKOSA-N 1 1 332.404 2.493 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@@H]1CC[N@@H+](CC2CC2)C1 ZINC001293251694 1328646084 /nfs/dbraw/zinc/64/60/84/1328646084.db2.gz DNWBKMRCKPQVMN-CYBMUJFWSA-N 1 1 333.388 2.208 10 5 EEBEMO COc1ccc2ncc([N+](=O)[O-])c(N[C@@H]3CC[C@H]4C[N@@H+](C)C[C@H]43)c2c1 ZINC001164380669 1321367578 /nfs/dbraw/zinc/36/75/78/1321367578.db2.gz YQIWJVJMARVAGG-SGIREYDYSA-N 1 1 342.399 2.326 10 5 EEBEMO O=C(CCc1cc(F)ccc1[N+](=O)[O-])N[C@@H]1CC[N@H+]2CCC[C@H]2C1 ZINC001262265229 1322266106 /nfs/dbraw/zinc/26/61/06/1322266106.db2.gz NOEUNXOWNSIBMJ-CABCVRRESA-N 1 1 335.379 2.410 10 5 EEBEMO C[N@H+](CCNC(=O)CCc1ccoc1)Cc1cccc([N+](=O)[O-])c1 ZINC001492222285 1331096627 /nfs/dbraw/zinc/09/66/27/1331096627.db2.gz JMVQQHWDYJQPCZ-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1ccoc1)Cc1cccc([N+](=O)[O-])c1 ZINC001492222285 1331096633 /nfs/dbraw/zinc/09/66/33/1331096633.db2.gz JMVQQHWDYJQPCZ-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO C[N@H+](CCNC(=O)C1(C(F)F)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001317446113 1332244865 /nfs/dbraw/zinc/24/48/65/1332244865.db2.gz VFOJXXJTZDVPQS-UHFFFAOYSA-N 1 1 327.331 2.188 10 5 EEBEMO C[N@@H+](CCNC(=O)C1(C(F)F)CC1)Cc1cccc([N+](=O)[O-])c1 ZINC001317446113 1332244866 /nfs/dbraw/zinc/24/48/66/1332244866.db2.gz VFOJXXJTZDVPQS-UHFFFAOYSA-N 1 1 327.331 2.188 10 5 EEBEMO CC[N@H+](CCNC(=O)c1ccsn1)Cc1ccccc1[N+](=O)[O-] ZINC001317481365 1332259921 /nfs/dbraw/zinc/25/99/21/1332259921.db2.gz DZWREVJKMGIBBT-UHFFFAOYSA-N 1 1 334.401 2.303 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1ccsn1)Cc1ccccc1[N+](=O)[O-] ZINC001317481365 1332259922 /nfs/dbraw/zinc/25/99/22/1332259922.db2.gz DZWREVJKMGIBBT-UHFFFAOYSA-N 1 1 334.401 2.303 10 5 EEBEMO C[N@H+]1CC[C@@H]2CN(C(=O)CCc3c(Cl)cccc3[N+](=O)[O-])C[C@@H]21 ZINC001333484425 1336057493 /nfs/dbraw/zinc/05/74/93/1336057493.db2.gz 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CCn1cc([N+](=O)[O-])c(C(=O)N[C@H](C)C[N@@H+](C)Cc2ccccc2)n1 ZINC000191700549 152268736 /nfs/dbraw/zinc/26/87/36/152268736.db2.gz ZFTZWVKBXBJXKS-CYBMUJFWSA-N 1 1 345.403 2.062 10 5 EEBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246294693 160272723 /nfs/dbraw/zinc/27/27/23/160272723.db2.gz PDRJTSFWXMPTOM-IEAZIUSSSA-N 1 1 348.399 2.434 10 5 EEBEMO COC(=O)[C@@H]1C[C@@H]2CCCC[C@H]2[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246294693 160272726 /nfs/dbraw/zinc/27/27/26/160272726.db2.gz PDRJTSFWXMPTOM-IEAZIUSSSA-N 1 1 348.399 2.434 10 5 EEBEMO CC[C@@H]1C[N@H+]2CCC[C@H]2CN1C(=O)CNc1ccccc1[N+](=O)[O-] ZINC000246916349 160300972 /nfs/dbraw/zinc/30/09/72/160300972.db2.gz ISBLTMBQNZZLBJ-KGLIPLIRSA-N 1 1 332.404 2.092 10 5 EEBEMO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CC[C@]2(C1)CCCOC2 ZINC000341974959 161028711 /nfs/dbraw/zinc/02/87/11/161028711.db2.gz IBGBXBNQIREMIF-GUYCJALGSA-N 1 1 333.388 2.424 10 5 EEBEMO 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ZINC000543001414 318149075 /nfs/dbraw/zinc/14/90/75/318149075.db2.gz ORSAYTNHHANODC-UHFFFAOYSA-N 1 1 330.344 2.317 10 5 EEBEMO CN(C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000347889106 465288329 /nfs/dbraw/zinc/28/83/29/465288329.db2.gz JJQQTYYCSDBJSV-CYBMUJFWSA-N 1 1 328.372 2.385 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C ZINC000117281459 462793995 /nfs/dbraw/zinc/79/39/95/462793995.db2.gz RTNBVEMODYRQPZ-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)C[C@H]1C ZINC000117281459 462794002 /nfs/dbraw/zinc/79/40/02/462794002.db2.gz RTNBVEMODYRQPZ-CQSZACIVSA-N 1 1 335.404 2.086 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCCNS(=O)(=O)c1ccc([N+](=O)[O-])s1 ZINC000066327432 462874682 /nfs/dbraw/zinc/87/46/82/462874682.db2.gz LWYZWVUXKUTKBI-LLVKDONJSA-N 1 1 347.462 2.199 10 5 EEBEMO Cn1cc(C[N@@H+]2CCCN(Cc3csc([N+](=O)[O-])c3)CC2)cn1 ZINC000105869869 463482977 /nfs/dbraw/zinc/48/29/77/463482977.db2.gz 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CCc1ccc(C(=O)N2CC[N@@H+](CCOC)CC2(C)C)cc1[N+](=O)[O-] ZINC000593338984 468944103 /nfs/dbraw/zinc/94/41/03/468944103.db2.gz MAVUNMAWTSHBCS-UHFFFAOYSA-N 1 1 349.431 2.340 10 5 EEBEMO [NH3+][C@@H]1CCO[C@@H]([C@H]2CCCC[N@H+]2Cc2cc([O-])ccc2[N+](=O)[O-])C1 ZINC000593728657 469110921 /nfs/dbraw/zinc/11/09/21/469110921.db2.gz BIIAQXCNUAOSIV-KBRIMQKVSA-N 1 1 335.404 2.161 10 5 EEBEMO COC(=O)c1c(Cl)c(NC[C@@H]2CC[N@@H+](C)C2)ccc1[N+](=O)[O-] ZINC000596112284 469160182 /nfs/dbraw/zinc/16/01/82/469160182.db2.gz MFTWPZDLSIMUID-VIFPVBQESA-N 1 1 327.768 2.398 10 5 EEBEMO O=[N+]([O-])c1ccc(NCc2ccc(C[N@@H+]3CC[C@@H](O)C3)cc2)cn1 ZINC000596424210 485613038 /nfs/dbraw/zinc/61/30/38/485613038.db2.gz RFQWMTQOIMPGPZ-MRXNPFEDSA-N 1 1 328.372 2.169 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@](O)(C3CC3)C2)c([N+](=O)[O-])cc1OC ZINC000597206764 485615838 /nfs/dbraw/zinc/61/58/38/485615838.db2.gz VMNGWJRSYGUSQW-QGZVFWFLSA-N 1 1 336.388 2.349 10 5 EEBEMO Cc1c([N+](=O)[O-])cc(C(=O)N(C)[C@@H]2CC[N@H+](C3CC3)C2)cc1[N+](=O)[O-] 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ZINC001264984939 1322833052 /nfs/dbraw/zinc/83/30/52/1322833052.db2.gz HHBMUYWWCHRRHD-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO C[N@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC001264984939 1322833062 /nfs/dbraw/zinc/83/30/62/1322833062.db2.gz HHBMUYWWCHRRHD-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO C[N@@H+](CCCNC(=O)[C@@H]1CC1[N+](=O)[O-])Cc1cccc(C(F)F)c1 ZINC001264984939 1322833065 /nfs/dbraw/zinc/83/30/65/1322833065.db2.gz HHBMUYWWCHRRHD-ZIAGYGMSSA-N 1 1 341.358 2.228 10 5 EEBEMO Cc1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CCC2)c(C)c1 ZINC001280480295 1324246655 /nfs/dbraw/zinc/24/66/55/1324246655.db2.gz JDPYTAYPZFFBBQ-HZPDHXFCSA-N 1 1 331.416 2.097 10 5 EEBEMO CCc1[nH]ccc1C(=O)NCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001492239506 1331140622 /nfs/dbraw/zinc/14/06/22/1331140622.db2.gz QOAVCYSZBPOROA-UHFFFAOYSA-N 1 1 330.388 2.347 10 5 EEBEMO CCC[N@H+](CCNC(=O)c1cnsn1)Cc1ccccc1[N+](=O)[O-] ZINC001317540654 1332290034 /nfs/dbraw/zinc/29/00/34/1332290034.db2.gz 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CC(C)C[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])c(F)cc1N ZINC000846291774 790119954 /nfs/dbraw/zinc/11/99/54/790119954.db2.gz RNVMRZQFDUVAPM-UHFFFAOYSA-N 1 1 326.372 2.024 10 5 EEBEMO COC(=O)c1ccc([N+](=O)[O-])c(N2CCC[C@H](c3[nH+]ccn3C)C2)c1 ZINC000443963821 794635681 /nfs/dbraw/zinc/63/56/81/794635681.db2.gz PGYLIOHDZNTUKS-ZDUSSCGKSA-N 1 1 344.371 2.499 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@@H+]2CC[C@]3(C2)CCCOC3)nc1-c1ccncc1 ZINC000789566037 808062780 /nfs/dbraw/zinc/06/27/80/808062780.db2.gz NGUWCWBYSSLTQF-KRWDZBQOSA-N 1 1 343.387 2.313 10 5 EEBEMO O=[N+]([O-])c1cn(C[N@H+]2CC[C@]3(C2)CCCOC3)nc1-c1ccncc1 ZINC000789566037 808062789 /nfs/dbraw/zinc/06/27/89/808062789.db2.gz NGUWCWBYSSLTQF-KRWDZBQOSA-N 1 1 343.387 2.313 10 5 EEBEMO COc1ccc(CC(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC001466717618 1110442153 /nfs/dbraw/zinc/44/21/53/1110442153.db2.gz YOGFZFRELQBRGH-CQSZACIVSA-N 1 1 335.404 2.135 10 5 EEBEMO Cn1cnnc1CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC001473810599 1110581178 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1 1 335.404 2.082 10 5 EEBEMO CCc1[nH]nc(C(=O)N2[C@@H](C)CCC[C@H]2CC[NH+](C)C)c1[N+](=O)[O-] ZINC000914443355 683784701 /nfs/dbraw/zinc/78/47/01/683784701.db2.gz MMODMGJGJKLZTC-RYUDHWBXSA-N 1 1 337.424 2.215 10 5 EEBEMO CC(C)(C)OC(=O)N1CC[C@@H]([C@H]2CCCC[N@H+]2CC[N+](=O)[O-])C1 ZINC000930582894 684097867 /nfs/dbraw/zinc/09/78/67/684097867.db2.gz KUBWYHHHQZEPJM-ZIAGYGMSSA-N 1 1 327.425 2.375 10 5 EEBEMO O=C(NCCNc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H]2CCCC[N@H+]21 ZINC000899988139 693954767 /nfs/dbraw/zinc/95/47/67/693954767.db2.gz YSDLEULSXMHERT-CZUORRHYSA-N 1 1 332.404 2.140 10 5 EEBEMO C[C@@H]1C[N@H+](C)C[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000722243090 693317100 /nfs/dbraw/zinc/31/71/00/693317100.db2.gz FZFDZRNKOSGANC-SKDRFNHKSA-N 1 1 328.210 2.397 10 5 EEBEMO C[C@@H]1C[N@@H+](C)C[C@@H]1NCc1ccc(Br)cc1[N+](=O)[O-] ZINC000722243090 693317104 /nfs/dbraw/zinc/31/71/04/693317104.db2.gz FZFDZRNKOSGANC-SKDRFNHKSA-N 1 1 328.210 2.397 10 5 EEBEMO CCCn1cc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001266332063 1176314789 /nfs/dbraw/zinc/31/47/89/1176314789.db2.gz ATZCOOSSCPJZQA-UHFFFAOYSA-N 1 1 345.403 2.063 10 5 EEBEMO CC[N@@H+](CCNC(=O)Cc1ccco1)Cc1ccc([N+](=O)[O-])cc1 ZINC001691044866 1177011144 /nfs/dbraw/zinc/01/11/44/1177011144.db2.gz KAQHPAQHMNAVCX-UHFFFAOYSA-N 1 1 331.372 2.369 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1cncs1)Cc1ccc([N+](=O)[O-])cc1 ZINC001480965285 1179389353 /nfs/dbraw/zinc/38/93/53/1179389353.db2.gz JGOUZVGKTNSSNK-UHFFFAOYSA-N 1 1 334.401 2.303 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C/CNC(=O)CC1(C)CCCC1 ZINC001268535462 1183194666 /nfs/dbraw/zinc/19/46/66/1183194666.db2.gz GYVHAAGMHZRYOG-AATRIKPKSA-N 1 1 349.435 2.061 10 5 EEBEMO Cc1ncc([N+](=O)[O-])n1CC[S@@](=O)Cc1c(C)cc(C)[nH+]c1C ZINC000871609050 1197789776 /nfs/dbraw/zinc/78/97/76/1197789776.db2.gz QQCRYLLMXBURGC-HSZRJFAPSA-N 1 1 336.417 2.369 10 5 EEBEMO COC1CCN(CC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])CC1 ZINC000872043552 1198033740 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2.481 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC([N@@H+](C)CCCO)CC1 ZINC000881985231 1201798338 /nfs/dbraw/zinc/79/83/38/1201798338.db2.gz JBNDQMBSLHSJPO-UHFFFAOYSA-N 1 1 335.404 2.080 10 5 EEBEMO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000882446612 1201872828 /nfs/dbraw/zinc/87/28/28/1201872828.db2.gz FQHGMFLVXQWOQT-UHFFFAOYSA-N 1 1 347.415 2.489 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)C(F)(F)c3ccc([N+](=O)[O-])cc3)C[C@]2(C)C1 ZINC000887929027 1204510291 /nfs/dbraw/zinc/51/02/91/1204510291.db2.gz GCXBRNHAFKMRKS-DOMZBBRYSA-N 1 1 339.342 2.097 10 5 EEBEMO CCc1cccc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001492284975 1331138020 /nfs/dbraw/zinc/13/80/20/1331138020.db2.gz QULJOIFNADUQHX-UHFFFAOYSA-N 1 1 342.399 2.414 10 5 EEBEMO O=C(CCC(F)F)N[C@@H]1[C@H]2C[N@H+](Cc3cccc([N+](=O)[O-])c3)C[C@H]21 ZINC001317212436 1332138225 /nfs/dbraw/zinc/13/82/25/1332138225.db2.gz QLXLCFHGGFFTGQ-VIKVFOODSA-N 1 1 339.342 2.187 10 5 EEBEMO CC(C)c1ccc(C[NH2+]C/C=C/CNC(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001321056281 1333007395 /nfs/dbraw/zinc/00/73/95/1333007395.db2.gz DIFOPQLPMSGUCK-MULDZMIYSA-N 1 1 331.416 2.237 10 5 EEBEMO Nc1c(Cl)cc(C(=O)N[C@@H]2CC[N@@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC001617000950 1352334725 /nfs/dbraw/zinc/33/47/25/1352334725.db2.gz NAXXLIBDOXEMJK-LLVKDONJSA-N 1 1 338.795 2.045 10 5 EEBEMO O=[N+]([O-])c1ccc(O)cc1CN1CCC([NH2+]C2CCOCC2)CC1 ZINC001620577765 1344461207 /nfs/dbraw/zinc/46/12/07/1344461207.db2.gz WKMJUSVJPJPFQP-UHFFFAOYSA-N 1 1 335.404 2.033 10 5 EEBEMO CN(CC(=O)N1CCC2(CCC[N@H+]2C)CC1)c1ccccc1[N+](=O)[O-] ZINC001597734823 1349930642 /nfs/dbraw/zinc/93/06/42/1349930642.db2.gz LHFDCGNMTSZJPZ-UHFFFAOYSA-N 1 1 346.431 2.118 10 5 EEBEMO C[N@H+]1C[C@@]23CN(C[C@H](O)c4cccc([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001660700423 1354520248 /nfs/dbraw/zinc/52/02/48/1354520248.db2.gz JEIRSSRSDQMWEB-GBESFXJTSA-N 1 1 345.443 2.436 10 5 EEBEMO O=C(NCCC1CC[NH+](CC2=CCCCC2)CC1)[C@@H]1CC1[N+](=O)[O-] 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10 5 EEBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1CCC[C@]2(CCOC2)C1 ZINC000451903150 243303850 /nfs/dbraw/zinc/30/38/50/243303850.db2.gz PLAFFDQWJMTSJH-DYVFJYSZSA-N 1 1 333.388 2.424 10 5 EEBEMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@@H+]1CCOC ZINC000117306870 221051596 /nfs/dbraw/zinc/05/15/96/221051596.db2.gz MODIMBLERGRXFM-OAHLLOKOSA-N 1 1 335.404 2.086 10 5 EEBEMO CC[C@@H]1CN(C(=O)c2ccc([N+](=O)[O-])c(C)c2)CC[N@H+]1CCOC ZINC000117306870 221051599 /nfs/dbraw/zinc/05/15/99/221051599.db2.gz MODIMBLERGRXFM-OAHLLOKOSA-N 1 1 335.404 2.086 10 5 EEBEMO CCOc1ccc(C(=O)N(C)C[C@@H]2CCC[N@@H+](C)C2)cc1[N+](=O)[O-] ZINC000115439490 152022474 /nfs/dbraw/zinc/02/24/74/152022474.db2.gz BRAFTRVQXRWWDL-CYBMUJFWSA-N 1 1 335.404 2.407 10 5 EEBEMO CN(C)c1noc(C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000189536092 160143323 /nfs/dbraw/zinc/14/33/23/160143323.db2.gz WHCHHINNCBDDGZ-UHFFFAOYSA-N 1 1 331.376 2.423 10 5 EEBEMO COc1ccc(OCCN2C[C@@H]3CCC[N@H+]3C[C@@H]2C)c([N+](=O)[O-])c1 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330.388 2.152 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000117397860 462801468 /nfs/dbraw/zinc/80/14/68/462801468.db2.gz HKDGSCXPZNFCHG-ZDUSSCGKSA-N 1 1 336.392 2.169 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000117397860 462801472 /nfs/dbraw/zinc/80/14/72/462801472.db2.gz HKDGSCXPZNFCHG-ZDUSSCGKSA-N 1 1 336.392 2.169 10 5 EEBEMO O=C(N[C@H]1CC[N@@H+](CC2CC2)C1)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000108300958 463595467 /nfs/dbraw/zinc/59/54/67/463595467.db2.gz GGHQMRMSQNOSPO-LBPRGKRZSA-N 1 1 328.372 2.290 10 5 EEBEMO COc1ccccc1[C@@H]1C[NH2+]CCN1C(=O)c1ccc([N+](=O)[O-])cc1 ZINC000261628666 463807467 /nfs/dbraw/zinc/80/74/67/463807467.db2.gz AVMCBOTYWQFMNM-INIZCTEOSA-N 1 1 341.367 2.390 10 5 EEBEMO CCC[N@H+]1CC[C@@H](CNc2nc(C)cc(C(=O)OC)c2[N+](=O)[O-])C1 ZINC000283680282 463970385 /nfs/dbraw/zinc/97/03/85/463970385.db2.gz XPBGESAKVFOVLN-LBPRGKRZSA-N 1 1 336.392 2.229 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])ccc2N)[C@@H]1c1ccccc1 ZINC000188703498 464347529 /nfs/dbraw/zinc/34/75/29/464347529.db2.gz UWCCCTRQHBZMIL-IRXDYDNUSA-N 1 1 340.383 2.352 10 5 EEBEMO Cc1cc(N2CC[C@H]3OCCN(C)[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000284853325 464366524 /nfs/dbraw/zinc/36/65/24/464366524.db2.gz DVDDRMJHGRGNFX-QZTJIDSGSA-N 1 1 342.399 2.361 10 5 EEBEMO C[N@H+]1CCO[C@@H]2CCN(c3ccc4ncccc4c3[N+](=O)[O-])C[C@@H]21 ZINC000285166053 464473495 /nfs/dbraw/zinc/47/34/95/464473495.db2.gz USCXXPBGRBAAKJ-JKSUJKDBSA-N 1 1 328.372 2.052 10 5 EEBEMO C[N@H+]1CCN(CCNc2ncc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC000281642626 464531660 /nfs/dbraw/zinc/53/16/60/464531660.db2.gz MNWSMJAIUUXIRU-UHFFFAOYSA-N 1 1 327.816 2.081 10 5 EEBEMO CC[N@H+]1CCC[C@H]1CN(C)CCOc1ccc(OC)cc1[N+](=O)[O-] ZINC000175356307 464531978 /nfs/dbraw/zinc/53/19/78/464531978.db2.gz HEGZAHBZPDJSGY-AWEZNQCLSA-N 1 1 337.420 2.398 10 5 EEBEMO CO[C@H]1C[C@@H]([N@H+](C)CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000285441705 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1 327.772 2.046 10 5 EEBEMO CC(C)c1ccc(C(=O)NC2CC([NH+]3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000600067154 468448156 /nfs/dbraw/zinc/44/81/56/468448156.db2.gz ROSLXFSMCSWWEU-UHFFFAOYSA-N 1 1 347.415 2.311 10 5 EEBEMO CCOc1ccc(C(=O)N2CC[NH+](CCCF)CC2)cc1[N+](=O)[O-] ZINC000600072642 468449299 /nfs/dbraw/zinc/44/92/99/468449299.db2.gz ZGXZGNQUMZZNHG-UHFFFAOYSA-N 1 1 339.367 2.111 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)COCc1ccco1)C2 ZINC000305471198 466410794 /nfs/dbraw/zinc/41/07/94/466410794.db2.gz YDBMULKINSUPLI-AWEZNQCLSA-N 1 1 332.356 2.124 10 5 EEBEMO O=[N+]([O-])c1cccc2c1CC[N@H+](C[C@H](O)COCc1ccco1)C2 ZINC000305471198 466410801 /nfs/dbraw/zinc/41/08/01/466410801.db2.gz YDBMULKINSUPLI-AWEZNQCLSA-N 1 1 332.356 2.124 10 5 EEBEMO C[N@H+]1CC[C@@](O)(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000358253537 466573941 /nfs/dbraw/zinc/57/39/41/466573941.db2.gz OBAHSKOWLGKFGA-RBUKOAKNSA-N 1 1 341.411 2.340 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@H](c3n[n-]c(=O)o3)C2)ccc1[N+](=O)[O-] ZINC000450897055 467200119 /nfs/dbraw/zinc/20/01/19/467200119.db2.gz PVOZZLOTVGESMF-NSHDSACASA-N 1 1 334.332 2.072 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000436418275 467534636 /nfs/dbraw/zinc/53/46/36/467534636.db2.gz HCQTVYMNROZUMD-HNNXBMFYSA-N 1 1 332.404 2.010 10 5 EEBEMO CCOc1cc(C[N@@H+]2CCC[C@H](NC(=O)CC)C2)ccc1[N+](=O)[O-] ZINC000492726157 467729793 /nfs/dbraw/zinc/72/97/93/467729793.db2.gz ZPZVSSCBQFKAQY-AWEZNQCLSA-N 1 1 335.404 2.484 10 5 EEBEMO CCOc1cc(C[N@H+]2CCC[C@H](NC(=O)CC)C2)ccc1[N+](=O)[O-] ZINC000492726157 467729795 /nfs/dbraw/zinc/72/97/95/467729795.db2.gz ZPZVSSCBQFKAQY-AWEZNQCLSA-N 1 1 335.404 2.484 10 5 EEBEMO C[N@H+]1C[C@@H]2CCN(Cc3ccc(Br)cc3[N+](=O)[O-])[C@@H]2C1 ZINC000591849704 468530418 /nfs/dbraw/zinc/53/04/18/468530418.db2.gz JFTJVFRMQKDWCC-SMDDNHRTSA-N 1 1 340.221 2.493 10 5 EEBEMO CNc1c(C(=O)NC[C@@H]2CC[N@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000600470354 468567589 /nfs/dbraw/zinc/56/75/89/468567589.db2.gz NMKPRZCYTSRJNM-ZDUSSCGKSA-N 1 1 332.404 2.383 10 5 EEBEMO C[NH+](C)CCN(Cc1ccccn1)Cc1cc(O)ccc1[N+](=O)[O-] ZINC000583468085 468701747 /nfs/dbraw/zinc/70/17/47/468701747.db2.gz GNNZGLSTUPKJLG-UHFFFAOYSA-N 1 1 330.388 2.259 10 5 EEBEMO Cc1c(NC(=O)CCN2CC[C@@]3(C2)CCC[NH2+]C3)cccc1[N+](=O)[O-] ZINC000583694035 468742185 /nfs/dbraw/zinc/74/21/85/468742185.db2.gz UDCGWUCMMUQQFF-SFHVURJKSA-N 1 1 346.431 2.307 10 5 EEBEMO C[C@](CO)([NH2+]Cc1cnn(CC(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000601150012 468762695 /nfs/dbraw/zinc/76/26/95/468762695.db2.gz RVLADPLQOWLGTI-OAHLLOKOSA-N 1 1 340.330 2.054 10 5 EEBEMO CCC[N@H+]1CC[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C1 ZINC000598341577 468837064 /nfs/dbraw/zinc/83/70/64/468837064.db2.gz CMQMMIBMTMTALV-LLVKDONJSA-N 1 1 343.330 2.410 10 5 EEBEMO CCOc1cc(C[N@H+]2CC[C@H](Cn3ccnn3)C2)ccc1[N+](=O)[O-] ZINC000595607301 468921011 /nfs/dbraw/zinc/92/10/11/468921011.db2.gz LAXGRQGAVVKKNV-AWEZNQCLSA-N 1 1 331.376 2.107 10 5 EEBEMO C[C@@]12COC[C@]1(C)C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C2 ZINC000595689475 468955805 /nfs/dbraw/zinc/95/58/05/468955805.db2.gz QDYUBSXBNASXHN-CALCHBBNSA-N 1 1 333.388 2.282 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)[C@H](C)CN1c1ccnc2cc([N+](=O)[O-])ccc21 ZINC000593480020 468998390 /nfs/dbraw/zinc/99/83/90/468998390.db2.gz SZDBXOMCKTXMCH-CHWSQXEVSA-N 1 1 330.388 2.034 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCc2nccnc2C1 ZINC000595864742 469052277 /nfs/dbraw/zinc/05/22/77/469052277.db2.gz RVHNTHRTIWPHQX-UHFFFAOYSA-N 1 1 341.371 2.080 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCc2nccnc2C1 ZINC000595864742 469052280 /nfs/dbraw/zinc/05/22/80/469052280.db2.gz RVHNTHRTIWPHQX-UHFFFAOYSA-N 1 1 341.371 2.080 10 5 EEBEMO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCOCC3)C2)cc1OC(F)F ZINC000599094475 469117785 /nfs/dbraw/zinc/11/77/85/469117785.db2.gz JPMWKMXQTPPRNB-UHFFFAOYSA-N 1 1 343.330 2.471 10 5 EEBEMO O=C(CC[N@H+]1CCO[C@H](C(F)F)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000601971038 469120072 /nfs/dbraw/zinc/12/00/72/469120072.db2.gz ACUOTOFEBMMSBB-ZDUSSCGKSA-N 1 1 343.330 2.279 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)c2c(Br)cccc2[N+](=O)[O-])C1 ZINC000599357743 469225429 /nfs/dbraw/zinc/22/54/29/469225429.db2.gz XJGWAGYVJYIBHD-SECBINFHSA-N 1 1 342.193 2.181 10 5 EEBEMO Nc1cc(NC[C@H]2CCC[N@@H+](CC3CC3)C2)cc(CO)c1[N+](=O)[O-] ZINC000596569605 469303328 /nfs/dbraw/zinc/30/33/28/469303328.db2.gz ACAKJTYHGBXXKL-CYBMUJFWSA-N 1 1 334.420 2.203 10 5 EEBEMO COC(=O)[C@](C)(NCC[C@@H]1CCC[N@H+]1C)c1cccc([N+](=O)[O-])c1 ZINC000599647209 469322576 /nfs/dbraw/zinc/32/25/76/469322576.db2.gz AFUDINDOOQMZES-WMLDXEAASA-N 1 1 335.404 2.057 10 5 EEBEMO CN(CC1C[NH+](C)C1)C(=O)c1ccc2[nH]c3ccccc3c(=O)c2c1 ZINC000618190767 469916992 /nfs/dbraw/zinc/91/69/92/469916992.db2.gz FRCPRSMXOVWWRQ-UHFFFAOYSA-N 1 1 335.407 2.315 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC34CCOCC4)o2)cc1 ZINC000618316861 469960134 /nfs/dbraw/zinc/96/01/34/469960134.db2.gz PPBWWLOGVKXCQD-UHFFFAOYSA-N 1 1 330.344 2.400 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+]3CCC34CCOCC4)o2)cc1 ZINC000618316861 469960137 /nfs/dbraw/zinc/96/01/37/469960137.db2.gz PPBWWLOGVKXCQD-UHFFFAOYSA-N 1 1 330.344 2.400 10 5 EEBEMO CC[N@H+]1CC[C@H](N(C)C(=O)c2cc3c(cc2[N+](=O)[O-])OCO3)[C@@H](C)C1 ZINC000610178273 469985739 /nfs/dbraw/zinc/98/57/39/469985739.db2.gz RSRZCSMCIGVPFN-AAEUAGOBSA-N 1 1 349.387 2.126 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H]2COC[C@@H]2C1 ZINC000595829429 485609510 /nfs/dbraw/zinc/60/95/10/485609510.db2.gz HTULLQMJVYKPRF-KBPBESRZSA-N 1 1 333.388 2.200 10 5 EEBEMO O=[N+]([O-])c1cccnc1NCc1ccc(C[N@@H+]2CC[C@@H](O)C2)cc1 ZINC000596423087 485613072 /nfs/dbraw/zinc/61/30/72/485613072.db2.gz JEDNOTLILRUAOU-OAHLLOKOSA-N 1 1 328.372 2.169 10 5 EEBEMO O=C(N[C@@H]1CCC[N@@H+]2CCSC[C@H]12)c1cc(F)cc([N+](=O)[O-])c1 ZINC000928096931 682134544 /nfs/dbraw/zinc/13/45/44/682134544.db2.gz SXQMXOZKPHPQIG-ZIAGYGMSSA-N 1 1 339.392 2.044 10 5 EEBEMO O=C(N[C@@H]1CCC[N@H+]2CCSC[C@H]12)c1cc(F)cc([N+](=O)[O-])c1 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C[C@H](C[NH+]1CCOCC1)C(=O)N(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000273062398 256261444 /nfs/dbraw/zinc/26/14/44/256261444.db2.gz JGJRYMOLTMECPH-CQSZACIVSA-N 1 1 347.415 2.054 10 5 EEBEMO CCOc1ccccc1C[N@@H+](C)CCn1cc([N+](=O)[O-])ccc1=O ZINC000090518162 292219001 /nfs/dbraw/zinc/21/90/01/292219001.db2.gz ZAEQVHVXUUZZEZ-UHFFFAOYSA-N 1 1 331.372 2.287 10 5 EEBEMO CC[C@@H]1CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[N@H+]1C[C@H](C)O ZINC000255166164 160396960 /nfs/dbraw/zinc/39/69/60/160396960.db2.gz SGCAHHUXTSJHHZ-YZFBUXBQSA-N 1 1 333.432 2.385 10 5 EEBEMO C[N@@H+]1C[C@H]2CN(Cc3coc(-c4ccc([N+](=O)[O-])cc4)n3)C[C@H]2C1 ZINC000193623155 160184257 /nfs/dbraw/zinc/18/42/57/160184257.db2.gz RRJNAROQWNJRCX-OKILXGFUSA-N 1 1 328.372 2.243 10 5 EEBEMO C[N@@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000272704541 269011199 /nfs/dbraw/zinc/01/11/99/269011199.db2.gz VQPNOZDYIZBQHT-DLBZAZTESA-N 1 1 341.367 2.476 10 5 EEBEMO C[N@H+]1CC[C@H](NC(=O)c2cc(O)cc([N+](=O)[O-])c2)[C@H]1c1ccccc1 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HPGMBMIYLYMNIB-CQSZACIVSA-N 1 1 335.404 2.168 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccccc2[N+](=O)[O-])C[C@H]1CC ZINC000116769571 462773358 /nfs/dbraw/zinc/77/33/58/462773358.db2.gz HPGMBMIYLYMNIB-CQSZACIVSA-N 1 1 335.404 2.168 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000157890274 463182515 /nfs/dbraw/zinc/18/25/15/463182515.db2.gz IGINUDVEFBGIRH-ZACQAIPSSA-N 1 1 336.388 2.242 10 5 EEBEMO CO[C@@H]1CC[C@@H]2OCC[N@@H+](CCOc3ccc([N+](=O)[O-])cc3)[C@@H]2C1 ZINC000157890274 463182525 /nfs/dbraw/zinc/18/25/25/463182525.db2.gz IGINUDVEFBGIRH-ZACQAIPSSA-N 1 1 336.388 2.242 10 5 EEBEMO Cc1cnn([C@@H]2CCC[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000137050412 463275332 /nfs/dbraw/zinc/27/53/32/463275332.db2.gz YSKWBKAVJUSNQE-SJORKVTESA-N 1 1 330.388 2.470 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CC[C@@H](N3CCOCC3)C2)c1 ZINC000170812126 463710634 /nfs/dbraw/zinc/71/06/34/463710634.db2.gz QEOHJJVKVRCZLU-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@H](N3CCOCC3)C2)c1 ZINC000170812126 463710639 /nfs/dbraw/zinc/71/06/39/463710639.db2.gz QEOHJJVKVRCZLU-CQSZACIVSA-N 1 1 325.796 2.155 10 5 EEBEMO Cc1cccc([N+](=O)[O-])c1S(=O)(=O)N(C)[C@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000246041941 464535929 /nfs/dbraw/zinc/53/59/29/464535929.db2.gz BHVUMHVEISASPB-STQMWFEESA-N 1 1 341.433 2.006 10 5 EEBEMO Cc1cc(OCC(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000281654639 464536585 /nfs/dbraw/zinc/53/65/85/464536585.db2.gz NCIATWIIBNMKNH-KBPBESRZSA-N 1 1 335.404 2.223 10 5 EEBEMO COc1cc(C(=O)N(C)[C@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000295105815 464707358 /nfs/dbraw/zinc/70/73/58/464707358.db2.gz XTRDIDLBMLJBSA-QWRGUYRKSA-N 1 1 339.367 2.297 10 5 EEBEMO COC(=O)c1cc(C)nc(N(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c1[N+](=O)[O-] ZINC000286023254 464777783 /nfs/dbraw/zinc/77/77/83/464777783.db2.gz AQBSHIRAXIVPTM-VXGBXAGGSA-N 1 1 336.392 2.004 10 5 EEBEMO Cc1ccc([C@@H](C)NC(=O)N2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000176738241 464836610 /nfs/dbraw/zinc/83/66/10/464836610.db2.gz HIIBRSCNEIMSJH-CYBMUJFWSA-N 1 1 332.404 2.454 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)[C@H]1CCN(C2CC2)C1 ZINC000348221793 465496943 /nfs/dbraw/zinc/49/69/43/465496943.db2.gz VWEQINBOCKXWIR-INIZCTEOSA-N 1 1 346.431 2.400 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)[C@H]1CC[N@@H+](C2CC2)C1 ZINC000348221793 465496947 /nfs/dbraw/zinc/49/69/47/465496947.db2.gz VWEQINBOCKXWIR-INIZCTEOSA-N 1 1 346.431 2.400 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN(C)[C@H]1CC[N@H+](C2CC2)C1 ZINC000348221793 465496951 /nfs/dbraw/zinc/49/69/51/465496951.db2.gz VWEQINBOCKXWIR-INIZCTEOSA-N 1 1 346.431 2.400 10 5 EEBEMO C[C@@H](C(=O)N1CC[NH+](CCCF)CC1)c1ccc([N+](=O)[O-])cc1F ZINC000600077033 468450659 /nfs/dbraw/zinc/45/06/59/468450659.db2.gz URWUDUWSDOFGCR-GFCCVEGCSA-N 1 1 341.358 2.341 10 5 EEBEMO O=C(N[C@@H]1CC[N@H+]2CCCC[C@H]12)c1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000299508955 465780928 /nfs/dbraw/zinc/78/09/28/465780928.db2.gz BBFADOYJXCDVIM-HZPDHXFCSA-N 1 1 328.372 2.433 10 5 EEBEMO COc1ccc(C[N@H+]2CCC[C@H](C(=O)N3CCCC3)C2)cc1[N+](=O)[O-] ZINC000353558937 465978334 /nfs/dbraw/zinc/97/83/34/465978334.db2.gz FHSBMDGNXPDGQH-HNNXBMFYSA-N 1 1 347.415 2.438 10 5 EEBEMO CN(C(=O)c1cc([N+](=O)[O-])c[nH]1)[C@@H]1CC[N@@H+](Cc2ccccc2)C1 ZINC000353719675 466092892 /nfs/dbraw/zinc/09/28/92/466092892.db2.gz DRSMTQVRBYIHHU-CQSZACIVSA-N 1 1 328.372 2.269 10 5 EEBEMO CN(c1nnc(-c2cccc([N+](=O)[O-])c2)n1C)[C@@H]1CC[N@H+](C2CC2)C1 ZINC000349718445 466205172 /nfs/dbraw/zinc/20/51/72/466205172.db2.gz GCTJLMROKDZAOQ-OAHLLOKOSA-N 1 1 342.403 2.063 10 5 EEBEMO Nc1cccc([N+](=O)[O-])c1C(=O)NC[C@H]1CC[N@H+]1C1CCCCC1 ZINC000600228824 468502053 /nfs/dbraw/zinc/50/20/53/468502053.db2.gz GFQYODPKLIKUKN-CYBMUJFWSA-N 1 1 332.404 2.314 10 5 EEBEMO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CCC[C@H](c3ccncn3)C2)c1 ZINC000370996537 467067025 /nfs/dbraw/zinc/06/70/25/467067025.db2.gz DZNYPHDYZHPCQK-YOEHRIQHSA-N 1 1 328.372 2.298 10 5 EEBEMO Cc1c(NC(=O)CCN2CCC[C@@]3(CC[NH2+]C3)C2)cccc1[N+](=O)[O-] ZINC000420358915 467377246 /nfs/dbraw/zinc/37/72/46/467377246.db2.gz FHVDYLZGXXITHE-SFHVURJKSA-N 1 1 346.431 2.307 10 5 EEBEMO O=C(Cc1ccccc1[N+](=O)[O-])N1CC[NH2+][C@@H](c2ccccc2)C1 ZINC000457002466 467729473 /nfs/dbraw/zinc/72/94/73/467729473.db2.gz WOFAZXIABVMMEA-MRXNPFEDSA-N 1 1 325.368 2.310 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNc1c2ccccc2ncc1[N+](=O)[O-] ZINC000488116326 468072508 /nfs/dbraw/zinc/07/25/08/468072508.db2.gz OBDKVWCTSROWOW-CYBMUJFWSA-N 1 1 330.388 2.088 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1NC(=O)CCN1CC[C@]2(C1)CCC[NH2+]C2 ZINC000517937209 468102254 /nfs/dbraw/zinc/10/22/54/468102254.db2.gz PBXVRUAEHDUYGX-GOSISDBHSA-N 1 1 346.431 2.307 10 5 EEBEMO CCN(C(=O)c1cc(=O)[nH]c2ccc([N+](=O)[O-])cc21)[C@@H]1CC[N@@H+](C)C1 ZINC000597946349 468721297 /nfs/dbraw/zinc/72/12/97/468721297.db2.gz OWQAJGYIWIIDFP-GFCCVEGCSA-N 1 1 344.371 2.015 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@H](O)C[N@H+]2CC[C@@]3(CC3(F)F)C2)c1 ZINC000593114616 468875390 /nfs/dbraw/zinc/87/53/90/468875390.db2.gz DQDKOAFXYNJUOX-TZMCWYRMSA-N 1 1 328.315 2.066 10 5 EEBEMO C[N@H+]1C[C@H]2CCN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)[C@@H]2C1 ZINC000601596255 468931260 /nfs/dbraw/zinc/93/12/60/468931260.db2.gz VZFUWTRJITZGMV-CZUORRHYSA-N 1 1 329.400 2.179 10 5 EEBEMO C[C@H]1CC[N@@H+](Cc2ccccc2)CCN1c1c([N+](=O)[O-])ncn1C ZINC000610468864 468975584 /nfs/dbraw/zinc/97/55/84/468975584.db2.gz OWHZXGWMAFFOBF-AWEZNQCLSA-N 1 1 329.404 2.429 10 5 EEBEMO O=[N+]([O-])c1c(NC2CC([NH+]3CCOCC3)C2)ccc2ncccc21 ZINC000599093852 469117627 /nfs/dbraw/zinc/11/76/27/469117627.db2.gz AQZNEUHPARSFOW-UHFFFAOYSA-N 1 1 328.372 2.418 10 5 EEBEMO CCOc1cc(C[N@H+](C)[C@@H]2CCCCN(C)C2=O)ccc1[N+](=O)[O-] ZINC000601970275 469120034 /nfs/dbraw/zinc/12/00/34/469120034.db2.gz NNGWLYYRHNBQRK-OAHLLOKOSA-N 1 1 335.404 2.436 10 5 EEBEMO CCOc1cc(C[N@@H+](C)[C@@H]2CCCCN(C)C2=O)ccc1[N+](=O)[O-] ZINC000601970275 469120037 /nfs/dbraw/zinc/12/00/37/469120037.db2.gz NNGWLYYRHNBQRK-OAHLLOKOSA-N 1 1 335.404 2.436 10 5 EEBEMO COc1ccc(OCC[N@@H+]2CCO[C@@H](C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000601978196 469125299 /nfs/dbraw/zinc/12/52/99/469125299.db2.gz VQLMEWNLRTVJBM-CQSZACIVSA-N 1 1 346.330 2.338 10 5 EEBEMO COc1ccc(OCC[N@H+]2CCO[C@@H](C(F)F)CC2)c([N+](=O)[O-])c1 ZINC000601978196 469125305 /nfs/dbraw/zinc/12/53/05/469125305.db2.gz VQLMEWNLRTVJBM-CQSZACIVSA-N 1 1 346.330 2.338 10 5 EEBEMO COCC[N@H+]1CCCN(c2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596076516 469142887 /nfs/dbraw/zinc/14/28/87/469142887.db2.gz GQRGRZUWIADESI-UHFFFAOYSA-N 1 1 343.811 2.415 10 5 EEBEMO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+]1C[C@@H]2CCC[C@]2(CO)C1 ZINC000599639342 469318930 /nfs/dbraw/zinc/31/89/30/469318930.db2.gz CWOIJZZQLUNXSQ-IIYDPXPESA-N 1 1 333.388 2.016 10 5 EEBEMO O=c1ccc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)n[nH]1 ZINC000599641692 469320026 /nfs/dbraw/zinc/32/00/26/469320026.db2.gz OHBWCFPSXXJFNR-OAHLLOKOSA-N 1 1 330.344 2.306 10 5 EEBEMO O=C(c1cc2cccc([N+](=O)[O-])c2[nH]1)N1CC[C@@H]([NH+]2CCC2)[C@H](F)C1 ZINC000619574237 469642959 /nfs/dbraw/zinc/64/29/59/469642959.db2.gz JOEHJGLBTVGXPT-TZMCWYRMSA-N 1 1 346.362 2.334 10 5 EEBEMO CC(C)c1ccc(C(=O)N2C[C@@H](C)[N@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-] ZINC000416313299 528065926 /nfs/dbraw/zinc/06/59/26/528065926.db2.gz RJCSDPQNSFVFSL-ZIAGYGMSSA-N 1 1 349.431 2.245 10 5 EEBEMO CC(C)c1ccc(C(=O)N2C[C@@H](C)[N@@H+](CCO)C[C@H]2C)cc1[N+](=O)[O-] ZINC000416313299 528065929 /nfs/dbraw/zinc/06/59/29/528065929.db2.gz RJCSDPQNSFVFSL-ZIAGYGMSSA-N 1 1 349.431 2.245 10 5 EEBEMO COCCN(C)C(=O)[C@@H]1CCC[N@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000229463453 536769626 /nfs/dbraw/zinc/76/96/26/536769626.db2.gz DLKKNTKHRDYJKH-GOEBONIOSA-N 1 1 349.431 2.473 10 5 EEBEMO Cc1nn(C[N@H+]2CCC[C@@]3(CCCOC3)C2)c2ncc([N+](=O)[O-])cc12 ZINC000749960537 577984855 /nfs/dbraw/zinc/98/48/55/577984855.db2.gz WKGDSMHEVRLSHG-QGZVFWFLSA-N 1 1 345.403 2.498 10 5 EEBEMO C[N@H+](CCNC(=O)c1cc2c([nH]1)CCC2)Cc1ccccc1[N+](=O)[O-] ZINC001690987495 1176424010 /nfs/dbraw/zinc/42/40/10/1176424010.db2.gz GBLFHOIXDICJNN-UHFFFAOYSA-N 1 1 342.399 2.273 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc2c([nH]1)CCC2)Cc1ccccc1[N+](=O)[O-] ZINC001690987495 1176424014 /nfs/dbraw/zinc/42/40/14/1176424014.db2.gz GBLFHOIXDICJNN-UHFFFAOYSA-N 1 1 342.399 2.273 10 5 EEBEMO Cc1ncoc1C(=O)NCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC001266588066 1176894939 /nfs/dbraw/zinc/89/49/39/1176894939.db2.gz IUBVQJBEMVDZIA-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)c1cccnc1 ZINC001271950488 1186681452 /nfs/dbraw/zinc/68/14/52/1186681452.db2.gz INFMVLOFHKBEIZ-UHFFFAOYSA-N 1 1 328.372 2.194 10 5 EEBEMO CC(C)(C)c1ccc(C[NH2+]C2(CNC(=O)[C@@H]3CC3[N+](=O)[O-])CC2)cc1 ZINC001483732154 1190838528 /nfs/dbraw/zinc/83/85/28/1190838528.db2.gz DRGLPXCULNAXTO-HZPDHXFCSA-N 1 1 345.443 2.388 10 5 EEBEMO C[C@@H]([NH2+][C@@H](C)C1(S(C)(=O)=O)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070870 1198040644 /nfs/dbraw/zinc/04/06/44/1198040644.db2.gz ILDZWUHJAVLQPN-ZJUUUORDSA-N 1 1 330.381 2.350 10 5 EEBEMO CC[N@@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812850041 1200957515 /nfs/dbraw/zinc/95/75/15/1200957515.db2.gz SYJAXQMGTDANKY-KBXCAEBGSA-N 1 1 345.399 2.201 10 5 EEBEMO Cc1ccc(N2CC[NH+](CCc3cnccn3)CC2)c([N+](=O)[O-])c1 ZINC000866120011 1201438970 /nfs/dbraw/zinc/43/89/70/1201438970.db2.gz PJHOXFOANPETBI-UHFFFAOYSA-N 1 1 327.388 2.058 10 5 EEBEMO C[C@@H]1CC[C@H](CO)[N@@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000880438426 1201489040 /nfs/dbraw/zinc/48/90/40/1201489040.db2.gz HHVIFOSZDYNJKF-MWLCHTKSSA-N 1 1 327.768 2.032 10 5 EEBEMO C[C@@H]1CC[C@H](CO)[N@H+]1CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000880438426 1201489041 /nfs/dbraw/zinc/48/90/41/1201489041.db2.gz HHVIFOSZDYNJKF-MWLCHTKSSA-N 1 1 327.768 2.032 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2CC[N@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000869052731 1201930202 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338.427 2.412 10 5 EEBEMO C[C@@H](NCCCN1CCC[N@@H+](C)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034427 1198032001 /nfs/dbraw/zinc/03/20/01/1198032001.db2.gz OEABGLGGWBUHKE-CQSZACIVSA-N 1 1 338.427 2.412 10 5 EEBEMO O=C1OCCN1C[C@@H]1CCN(c2cc[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000865839765 1198397641 /nfs/dbraw/zinc/39/76/41/1198397641.db2.gz SGLVMTFHBOPZIB-GFCCVEGCSA-N 1 1 342.355 2.422 10 5 EEBEMO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCc4[nH]cnc4C3)CC2)cc1 ZINC000810252857 1199404924 /nfs/dbraw/zinc/40/49/24/1199404924.db2.gz KFVCKUVKWUXMIM-AWEZNQCLSA-N 1 1 341.415 2.434 10 5 EEBEMO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](C[C@@H](O)C3(O)CCCC3)C2)cc1 ZINC000930641219 1206572470 /nfs/dbraw/zinc/57/24/70/1206572470.db2.gz WQGCQYVLFDCOON-DOTOQJQBSA-N 1 1 334.416 2.440 10 5 EEBEMO CCOc1cc(C[N@H+]2[C@H](C)CC[C@@H](C(N)=O)[C@H]2C)ccc1[N+](=O)[O-] ZINC000930909591 1206591771 /nfs/dbraw/zinc/59/17/71/1206591771.db2.gz GQZDUUGNIGSZAF-YRGRVCCFSA-N 1 1 335.404 2.468 10 5 EEBEMO CC[C@@](O)(C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000931468862 1207388507 /nfs/dbraw/zinc/38/85/07/1207388507.db2.gz GVGSXRAGDAHDKK-QWHCGFSZSA-N 1 1 336.310 2.095 10 5 EEBEMO O=C(Nc1cccc([N+](=O)[O-])c1)N[C@H]1CCC[N@H+]2CCSC[C@H]12 ZINC000902906305 1239018761 /nfs/dbraw/zinc/01/87/61/1239018761.db2.gz SSBYSWQUIAQIJC-UONOGXRCSA-N 1 1 336.417 2.296 10 5 EEBEMO C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CS1(=O)=O ZINC000850369641 1277202475 /nfs/dbraw/zinc/20/24/75/1277202475.db2.gz WWZLHXCDDLFPPJ-BXKDBHETSA-N 1 1 332.809 2.304 10 5 EEBEMO O=[N+]([O-])c1ccc(Cl)cc1N1CCC([N@H+]2CC[C@H](O)C2)CC1 ZINC000853966981 1292560904 /nfs/dbraw/zinc/56/09/04/1292560904.db2.gz ZLZKADMRJHDUMW-ZDUSSCGKSA-N 1 1 325.796 2.284 10 5 EEBEMO Nc1cc(F)c([N+](=O)[O-])cc1C(=O)NC[C@H]1CC[N@H+]1C1CCCC1 ZINC000863031512 1296086250 /nfs/dbraw/zinc/08/62/50/1296086250.db2.gz HLIHMWVWPGVVCX-LLVKDONJSA-N 1 1 336.367 2.063 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ncn(C[N@H+]3CCC[C@@]4(CCOC4)C3)n2)c1 ZINC000840139659 1315306339 /nfs/dbraw/zinc/30/63/39/1315306339.db2.gz ACBVAWOCAGLOML-QGZVFWFLSA-N 1 1 343.387 2.313 10 5 EEBEMO CCOc1cccc([N+](=O)[O-])c1C(=O)N[C@H]1C[N@H+](C2CC2)C[C@@H]1C ZINC001150119502 1316165507 /nfs/dbraw/zinc/16/55/07/1316165507.db2.gz DVVHMQQUXLMVET-AAEUAGOBSA-N 1 1 333.388 2.206 10 5 EEBEMO CC[N@@H+](C)[C@H]1CCN(C(=O)NC[C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC001251305940 1317446613 /nfs/dbraw/zinc/44/66/13/1317446613.db2.gz ZKZKVELVVUONEJ-KBPBESRZSA-N 1 1 334.420 2.434 10 5 EEBEMO O=C(c1cc([N+](=O)[O-])c[nH]1)N1C[C@H]2CC[N@@H+](Cc3ccccc3)[C@H]2C1 ZINC001299674568 1319893518 /nfs/dbraw/zinc/89/35/18/1319893518.db2.gz LCLZBBTXTXRZIK-PBHICJAKSA-N 1 1 340.383 2.269 10 5 EEBEMO Nc1nccc(C(=O)Nc2cccc3c2C[N@H+](C2CC2)C3)c1[N+](=O)[O-] ZINC001295930207 1329853645 /nfs/dbraw/zinc/85/36/45/1329853645.db2.gz JJEMTKHHMWQYFE-UHFFFAOYSA-N 1 1 339.355 2.302 10 5 EEBEMO Cc1c[nH]c(C(=O)N(C)CCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC001327269841 1334256506 /nfs/dbraw/zinc/25/65/06/1334256506.db2.gz AVBLRTAMTTWXFS-UHFFFAOYSA-N 1 1 345.403 2.220 10 5 EEBEMO COC(=O)[C@H]1CCC[N@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848479299 1338705480 /nfs/dbraw/zinc/70/54/80/1338705480.db2.gz WDKXLPHCZDOILN-ZDUSSCGKSA-N 1 1 344.371 2.301 10 5 EEBEMO COC(=O)[C@H]1CCC[N@@H+](Cn2cc(-c3ccccc3[N+](=O)[O-])cn2)C1 ZINC000848479299 1338705484 /nfs/dbraw/zinc/70/54/84/1338705484.db2.gz WDKXLPHCZDOILN-ZDUSSCGKSA-N 1 1 344.371 2.301 10 5 EEBEMO CCNc1ccc(C(=O)NCC[N@H+]2CCC(C)(C)C2)cc1[N+](=O)[O-] ZINC001617112885 1352336503 /nfs/dbraw/zinc/33/65/03/1352336503.db2.gz XSHBFYPMZWVVEO-UHFFFAOYSA-N 1 1 334.420 2.488 10 5 EEBEMO CC/C(C)=C/C(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001566971724 1342670565 /nfs/dbraw/zinc/67/05/65/1342670565.db2.gz CEKHFKZMPYOZIZ-OEBAIATKSA-N 1 1 329.400 2.498 10 5 EEBEMO CC[N@H+]1C[C@H](NC(=O)c2cc(OC)c(F)cc2[N+](=O)[O-])C(C)(C)C1 ZINC001639266446 1352696209 /nfs/dbraw/zinc/69/62/09/1352696209.db2.gz LQKMWZLIPICIAR-AWEZNQCLSA-N 1 1 339.367 2.203 10 5 EEBEMO CC(C)(C)OC(=O)NC[C@]12C[N@@H+](CC[N+](=O)[O-])C[C@H]1CCCC2 ZINC001648667981 1353437992 /nfs/dbraw/zinc/43/79/92/1353437992.db2.gz IEHDEYQIUGFNCI-CZUORRHYSA-N 1 1 327.425 2.280 10 5 EEBEMO COC(=O)[C@@]1(C)C[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001654497699 1354150394 /nfs/dbraw/zinc/15/03/94/1354150394.db2.gz CGIWNROGMOIPDR-JKDFXYPNSA-N 1 1 349.387 2.053 10 5 EEBEMO COC(=O)[C@@]1(C)C[N@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC001654497699 1354150395 /nfs/dbraw/zinc/15/03/95/1354150395.db2.gz CGIWNROGMOIPDR-JKDFXYPNSA-N 1 1 349.387 2.053 10 5 EEBEMO Cc1ccc(C[NH2+]CC2(NC(=O)[C@@H]3CC3[N+](=O)[O-])CCCC2)cc1C ZINC001665921406 1355409439 /nfs/dbraw/zinc/40/94/39/1355409439.db2.gz KVZQSFNZGLQOEF-IAGOWNOFSA-N 1 1 345.443 2.487 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1CCOCC1 ZINC001673412436 1356688662 /nfs/dbraw/zinc/68/86/62/1356688662.db2.gz LVKFDTMEGQJDDT-UHFFFAOYSA-N 1 1 349.431 2.302 10 5 EEBEMO COCC[N@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@H]1CCOC1 ZINC000782975943 764788373 /nfs/dbraw/zinc/78/83/73/764788373.db2.gz ITTNCISXJDKZMQ-KRWDZBQOSA-N 1 1 346.387 2.153 10 5 EEBEMO COCC[N@@H+](Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1)[C@H]1CCOC1 ZINC000782975943 764788377 /nfs/dbraw/zinc/78/83/77/764788377.db2.gz ITTNCISXJDKZMQ-KRWDZBQOSA-N 1 1 346.387 2.153 10 5 EEBEMO COc1cc([N+](=O)[O-])ccc1C(=O)N1C[C@]2(C)C[N@@H+](C)C[C@]2(C)C1 ZINC000913278446 788738644 /nfs/dbraw/zinc/73/86/44/788738644.db2.gz GSQYXKYIUPACFZ-CALCHBBNSA-N 1 1 333.388 2.017 10 5 EEBEMO C[N@H+]1C[C@@H](NC(=O)c2ccc(OC(F)F)c([N+](=O)[O-])c2)C(C)(C)C1 ZINC001472029636 1110539417 /nfs/dbraw/zinc/53/94/17/1110539417.db2.gz SUNOOHRBJGRGIE-GFCCVEGCSA-N 1 1 343.330 2.266 10 5 EEBEMO CC(C)(C)OC(=O)[C@@]12COC[C@@H]1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C2 ZINC001473629205 1110577791 /nfs/dbraw/zinc/57/77/91/1110577791.db2.gz HQUBNQXJGPKEBG-KSSFIOAISA-N 1 1 348.399 2.385 10 5 EEBEMO Cn1nccc1C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC001473899364 1110585066 /nfs/dbraw/zinc/58/50/66/1110585066.db2.gz MLVHBBVZUFSNGC-AWEZNQCLSA-N 1 1 345.359 2.444 10 5 EEBEMO C[N@H+]1C[C@@H]2CC[C@H](NC(=O)NC(C)(C)c3ccc([N+](=O)[O-])cc3)[C@H]2C1 ZINC001519930775 1119114922 /nfs/dbraw/zinc/11/49/22/1119114922.db2.gz MYYXJLJRRNMAAQ-RCBQFDQVSA-N 1 1 346.431 2.469 10 5 EEBEMO Cc1cc(OCC(=O)N2CC[N@H+](C)C[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC001538547058 1124029335 /nfs/dbraw/zinc/02/93/35/1124029335.db2.gz UKXUZIFQPPWSES-OAHLLOKOSA-N 1 1 349.431 2.471 10 5 EEBEMO Cn1cnc([N+](=O)[O-])c1C[NH2+]C/C=C/CNC(=O)C1CCCCCC1 ZINC001568825379 1124843403 /nfs/dbraw/zinc/84/34/03/1124843403.db2.gz JKEPRRZZPJBBGW-VOTSOKGWSA-N 1 1 349.435 2.061 10 5 EEBEMO CC[C@@H]1[C@@H](CO)CC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451254585 243050400 /nfs/dbraw/zinc/05/04/00/243050400.db2.gz LSBIOXOMDHWIPO-ZWNOBZJWSA-N 1 1 341.795 2.280 10 5 EEBEMO CC[C@@H]1[C@@H](CO)CC[N@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000451254585 243050403 /nfs/dbraw/zinc/05/04/03/243050403.db2.gz LSBIOXOMDHWIPO-ZWNOBZJWSA-N 1 1 341.795 2.280 10 5 EEBEMO C[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CC[C@H](O)CC1 ZINC000275911725 256387060 /nfs/dbraw/zinc/38/70/60/256387060.db2.gz XHHIXNPMOLPSOF-MQMHXKEQSA-N 1 1 332.360 2.380 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+](C)[C@H]2CC[C@H](O)CC2)cccc1[N+](=O)[O-] ZINC000275824369 256382959 /nfs/dbraw/zinc/38/29/59/256382959.db2.gz HPRBCAMGPOMUPA-HDJSIYSDSA-N 1 1 335.404 2.467 10 5 EEBEMO CCN(CC)C(=O)[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000065296864 292155204 /nfs/dbraw/zinc/15/52/04/292155204.db2.gz XRAAHKVTDIMFQD-INIZCTEOSA-N 1 1 335.404 2.306 10 5 EEBEMO Cc1c(NC(=O)[C@@H](C)N2CCC[N@H+](C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000172542681 152091955 /nfs/dbraw/zinc/09/19/55/152091955.db2.gz PLAFQKRSWNNUGF-CQSZACIVSA-N 1 1 346.431 2.400 10 5 EEBEMO CC(C)[N@H+]1C[C@@H](C)[C@H](NC(=O)CCOc2ccccc2[N+](=O)[O-])C1 ZINC000252663556 160393548 /nfs/dbraw/zinc/39/35/48/160393548.db2.gz RSPLKIGAJZJYTO-ZIAGYGMSSA-N 1 1 335.404 2.209 10 5 EEBEMO CCOC(=O)c1ccnc(N[C@H]2C[N@H+](C(C)C)C[C@H]2C)c1[N+](=O)[O-] ZINC000247491299 160326248 /nfs/dbraw/zinc/32/62/48/160326248.db2.gz WWXIZAOWHDUULI-YPMHNXCESA-N 1 1 336.392 2.307 10 5 EEBEMO CO[C@H]1C[N@@H+](CCCn2c3cc([N+](=O)[O-])ccc3oc2=O)CC[C@@H]1C ZINC000342740208 161086889 /nfs/dbraw/zinc/08/68/89/161086889.db2.gz RATONQXXTRGACD-LRDDRELGSA-N 1 1 349.387 2.250 10 5 EEBEMO C[N@H+]1CCCC[C@H]1CCC(=O)NCCNc1ccccc1[N+](=O)[O-] ZINC000352370389 162108809 /nfs/dbraw/zinc/10/88/09/162108809.db2.gz GLYZGRMLEPNPBS-AWEZNQCLSA-N 1 1 334.420 2.387 10 5 EEBEMO C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CCN(c2cnccn2)CC1 ZINC000364316385 165093800 /nfs/dbraw/zinc/09/38/00/165093800.db2.gz LSPHHAFUVPSCEQ-UHFFFAOYSA-N 1 1 327.388 2.486 10 5 EEBEMO C[C@@H]1C[N@H+](CCO)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000450950547 274348727 /nfs/dbraw/zinc/34/87/27/274348727.db2.gz CYSXUICYPSHVGL-SNVBAGLBSA-N 1 1 333.310 2.116 10 5 EEBEMO C[C@@H]1C[N@@H+](CCO)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000450950547 274348728 /nfs/dbraw/zinc/34/87/28/274348728.db2.gz CYSXUICYPSHVGL-SNVBAGLBSA-N 1 1 333.310 2.116 10 5 EEBEMO Cc1cc(S(=O)(=O)N[C@H](C)C[N@H+](C)C(C)C)c(C)cc1[N+](=O)[O-] ZINC000416483897 313234540 /nfs/dbraw/zinc/23/45/40/313234540.db2.gz OTRZMKPXYTYMRL-CYBMUJFWSA-N 1 1 343.449 2.219 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000421762955 314158198 /nfs/dbraw/zinc/15/81/98/314158198.db2.gz OXHJVVDPEOCJQW-CQSZACIVSA-N 1 1 335.404 2.052 10 5 EEBEMO O=[N+]([O-])c1cc2c(nc1NCC[N@@H+]1C[C@H]3CC[C@@H](C1)O3)CCCC2 ZINC000574752235 320053820 /nfs/dbraw/zinc/05/38/20/320053820.db2.gz DKAUUPIMWQBXPF-OKILXGFUSA-N 1 1 332.404 2.144 10 5 EEBEMO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC[N@H+]1CCO ZINC000339099032 465081447 /nfs/dbraw/zinc/08/14/47/465081447.db2.gz IRNQCBNNALLZDJ-NSHDSACASA-N 1 1 347.337 2.112 10 5 EEBEMO C[C@@H]1C[N@H+]2CCC[C@@H]2CN1C(=O)NCCc1ccc([N+](=O)[O-])cc1 ZINC000113601544 462606021 /nfs/dbraw/zinc/60/60/21/462606021.db2.gz PRBYXZUVLLEAPA-CZUORRHYSA-N 1 1 332.404 2.015 10 5 EEBEMO C[N@@H+](Cc1ccc(F)cc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075718512 462753565 /nfs/dbraw/zinc/75/35/65/462753565.db2.gz ZORUOHNZFNVCSH-ZDUSSCGKSA-N 1 1 342.758 2.077 10 5 EEBEMO C[N@H+](Cc1ccc(F)cc1Cl)C[C@H](O)Cn1cc([N+](=O)[O-])cn1 ZINC000075718512 462753571 /nfs/dbraw/zinc/75/35/71/462753571.db2.gz ZORUOHNZFNVCSH-ZDUSSCGKSA-N 1 1 342.758 2.077 10 5 EEBEMO CCOCC[N@@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1CC ZINC000116768138 462773110 /nfs/dbraw/zinc/77/31/10/462773110.db2.gz OORZUPHHVLRCRE-OAHLLOKOSA-N 1 1 335.404 2.168 10 5 EEBEMO CCOCC[N@H+]1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)C[C@H]1CC ZINC000116768138 462773113 /nfs/dbraw/zinc/77/31/13/462773113.db2.gz OORZUPHHVLRCRE-OAHLLOKOSA-N 1 1 335.404 2.168 10 5 EEBEMO CNC(=O)c1ccc(N2CCC([N@H+]3CCC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000154946592 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ZINC000933736435 1207829723 /nfs/dbraw/zinc/82/97/23/1207829723.db2.gz WITHGSUXWGKESS-DYVFJYSZSA-N 1 1 343.387 2.028 10 5 EEBEMO C[N@H+]1CCC[C@H](NC(=O)c2cccc([N+](=O)[O-])c2Br)C1 ZINC000159081180 1208428699 /nfs/dbraw/zinc/42/86/99/1208428699.db2.gz SPSNSTQJQBSMHG-VIFPVBQESA-N 1 1 342.193 2.181 10 5 EEBEMO Cc1nc(C(=O)NCCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])co1 ZINC001490184684 1291016129 /nfs/dbraw/zinc/01/61/29/1291016129.db2.gz URUJRISKWUKCLW-UHFFFAOYSA-N 1 1 332.360 2.143 10 5 EEBEMO Cc1ccc([N+](=O)[O-])c(OCCC(=O)N[C@@H]2CC[C@@H]3C[N@H+](C)C[C@@H]23)c1 ZINC001124025428 1310807281 /nfs/dbraw/zinc/80/72/81/1310807281.db2.gz MWFZVHHLMKKPRZ-RBSFLKMASA-N 1 1 347.415 2.129 10 5 EEBEMO CNc1ccc([N+](=O)[O-])cc1NC(=O)c1cnn(-c2cc[nH+]cc2)c1 ZINC001143092683 1315861074 /nfs/dbraw/zinc/86/10/74/1315861074.db2.gz GNCOQUJHTRPRSY-UHFFFAOYSA-N 1 1 338.327 2.470 10 5 EEBEMO C[C@H]1CN(C(=O)CNc2ccccc2[N+](=O)[O-])CC[N@H+]1C1CCCC1 ZINC001154879349 1317367321 /nfs/dbraw/zinc/36/73/21/1317367321.db2.gz 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Cc1cc(NC(=O)N2C[C@H](C)[C@H]([NH+]3CCOCC3)C2)ccc1[N+](=O)[O-] ZINC000153854581 224167801 /nfs/dbraw/zinc/16/78/01/224167801.db2.gz WKKOEMYECXUTTL-XJKSGUPXSA-N 1 1 348.403 2.088 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)NCCCCc1ccc([N+](=O)[O-])cc1 ZINC000119735910 221388937 /nfs/dbraw/zinc/38/89/37/221388937.db2.gz LPFDFZRIXIEJDY-INIZCTEOSA-N 1 1 334.420 2.311 10 5 EEBEMO C[N@@H+](CCNS(=O)(=O)c1ccc([N+](=O)[O-])s1)C1CCCCC1 ZINC000068346251 292162260 /nfs/dbraw/zinc/16/22/60/292162260.db2.gz SRGHNPGMKYAQMV-UHFFFAOYSA-N 1 1 347.462 2.199 10 5 EEBEMO C[C@@H]1CCCC[N@H+]1CCNC(=O)CN(C)c1ccccc1[N+](=O)[O-] ZINC000079561332 159134052 /nfs/dbraw/zinc/13/40/52/159134052.db2.gz OHRHXJBETYEJCS-CQSZACIVSA-N 1 1 334.420 2.022 10 5 EEBEMO CO[C@H](C)C[N@@H+](C[C@@H](O)COc1ccccc1[N+](=O)[O-])C(C)C ZINC000343518995 161142987 /nfs/dbraw/zinc/14/29/87/161142987.db2.gz CIRJJIKSHXEOMG-ZIAGYGMSSA-N 1 1 326.393 2.080 10 5 EEBEMO C[C@@H]([NH2+][C@H](CO)c1ccsc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000352032680 162037450 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KWJYQHSWEQYCBZ-AWEZNQCLSA-N 1 1 348.447 2.500 10 5 EEBEMO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000159849686 311347013 /nfs/dbraw/zinc/34/70/13/311347013.db2.gz GUTUOXKMZDBHFW-INIZCTEOSA-N 1 1 335.404 2.180 10 5 EEBEMO CCOC(=O)c1cc(N2CCC[C@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000425288230 314373043 /nfs/dbraw/zinc/37/30/43/314373043.db2.gz UDKDIYHYAOTOEG-BLLLJJGKSA-N 1 1 333.388 2.302 10 5 EEBEMO C[C@]1(CNc2ncc([N+](=O)[O-])c(N)n2)CCC[N@H+]1Cc1ccccc1 ZINC000160794764 463371839 /nfs/dbraw/zinc/37/18/39/463371839.db2.gz BLECDSMZVSNVBT-QGZVFWFLSA-N 1 1 342.403 2.434 10 5 EEBEMO O=[N+]([O-])c1ccc2[nH]c(N3CC[NH+](Cc4cccnc4)CC3)nc2c1 ZINC000277708476 463926026 /nfs/dbraw/zinc/92/60/26/463926026.db2.gz FVDPLOTUZXMZIA-UHFFFAOYSA-N 1 1 338.371 2.188 10 5 EEBEMO COc1ccccc1[C@H]1C[NH2+]CCN1C(=O)c1cccc([N+](=O)[O-])c1 ZINC000262078085 463942138 /nfs/dbraw/zinc/94/21/38/463942138.db2.gz XJVKKRPNNNTHGT-MRXNPFEDSA-N 1 1 341.367 2.390 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2noc(CN3CCC[N@H+](C4CC4)CC3)n2)cc1 ZINC000172345830 464058483 /nfs/dbraw/zinc/05/84/83/464058483.db2.gz LLJLGJMMZYFNQX-UHFFFAOYSA-N 1 1 343.387 2.315 10 5 EEBEMO CCc1n[nH]c(C(=O)N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c1[N+](=O)[O-] ZINC000179220809 464085428 /nfs/dbraw/zinc/08/54/28/464085428.db2.gz QQCRHTFNYCIKBX-DZGCQCFKSA-N 1 1 343.387 2.056 10 5 EEBEMO COc1ccc(OCC[N@@H+](C)[C@@H]2CCN(C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525498 464276224 /nfs/dbraw/zinc/27/62/24/464276224.db2.gz UYBICOMAETYGAQ-ZIAGYGMSSA-N 1 1 337.420 2.397 10 5 EEBEMO COc1ccc(OCCN(C)[C@@H]2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525498 464276227 /nfs/dbraw/zinc/27/62/27/464276227.db2.gz UYBICOMAETYGAQ-ZIAGYGMSSA-N 1 1 337.420 2.397 10 5 EEBEMO COc1ccc(OCCN(C)[C@@H]2CC[N@@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000173525498 464276231 /nfs/dbraw/zinc/27/62/31/464276231.db2.gz UYBICOMAETYGAQ-ZIAGYGMSSA-N 1 1 337.420 2.397 10 5 EEBEMO Cc1ccc([C@H]2CCCC[N@H+]2C[C@H](O)Cn2cc([N+](=O)[O-])cn2)o1 ZINC000173654133 464301332 /nfs/dbraw/zinc/30/13/32/464301332.db2.gz FVAZTOOEQDQVNV-LSDHHAIUSA-N 1 1 334.376 2.281 10 5 EEBEMO Cc1cc(N2CCC[N@@H+](CCO)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000292785120 464341588 /nfs/dbraw/zinc/34/15/88/464341588.db2.gz MXWOQFFXCWVAHK-UHFFFAOYSA-N 1 1 347.337 2.426 10 5 EEBEMO CC(C)Oc1cc(C(=O)N2CC[C@H]3C[N@@H+](C)C[C@@H]32)ccc1[N+](=O)[O-] ZINC000591083820 468406075 /nfs/dbraw/zinc/40/60/75/468406075.db2.gz VJEANMDGGXWXMH-ZFWWWQNUSA-N 1 1 333.388 2.158 10 5 EEBEMO C[C@H]1C[C@@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000272220849 464523490 /nfs/dbraw/zinc/52/34/90/464523490.db2.gz KNJGYRTWIMKSLS-ONGXEEELSA-N 1 1 349.416 2.154 10 5 EEBEMO COc1cc(C(=O)N(C)[C@@H]2CC[N@@H+](C)[C@@H](C)C2)c([N+](=O)[O-])cc1F ZINC000295105817 464707278 /nfs/dbraw/zinc/70/72/78/464707278.db2.gz XTRDIDLBMLJBSA-WDEREUQCSA-N 1 1 339.367 2.297 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)C(=O)Cn2ccc3cc([N+](=O)[O-])ccc32)CC[N@H+]1C ZINC000265919131 464733341 /nfs/dbraw/zinc/73/33/41/464733341.db2.gz BRQBOXUXZWSWRU-HIFRSBDPSA-N 1 1 344.415 2.491 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)NCCc2ccccc2[N+](=O)[O-])CC[N@H+]1C ZINC000266746626 464806983 /nfs/dbraw/zinc/80/69/83/464806983.db2.gz GCQLBDLZONTYTQ-UKRRQHHQSA-N 1 1 334.420 2.261 10 5 EEBEMO Cc1cc(N2CC[NH+](C[C@H](O)c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000266843402 464840962 /nfs/dbraw/zinc/84/09/62/464840962.db2.gz NSGYEWRLEGOPNM-KRWDZBQOSA-N 1 1 342.399 2.154 10 5 EEBEMO CC[N@H+]1CCC[C@@H]1CN(C)C(=O)CCOc1ccccc1[N+](=O)[O-] ZINC000176989908 464901090 /nfs/dbraw/zinc/90/10/90/464901090.db2.gz XGRBULVDTDGHPF-CQSZACIVSA-N 1 1 335.404 2.306 10 5 EEBEMO CC[C@H]1CN(c2ccccc2)CC[N@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC000184014614 464937616 /nfs/dbraw/zinc/93/76/16/464937616.db2.gz INQLBMDENAOKHO-HNNXBMFYSA-N 1 1 329.404 2.392 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)NCC[N@@H+]1CCCC[C@H]1C ZINC000330492323 465680372 /nfs/dbraw/zinc/68/03/72/465680372.db2.gz QTBQPEWRZQAPFL-CYBMUJFWSA-N 1 1 341.433 2.056 10 5 EEBEMO O=C(Cn1ccc2cc([N+](=O)[O-])ccc21)N1CC[NH+](CCCF)CC1 ZINC000600072419 468449232 /nfs/dbraw/zinc/44/92/32/468449232.db2.gz RFXJGMQGZQFGME-UHFFFAOYSA-N 1 1 348.378 2.053 10 5 EEBEMO C[C@H]1[C@@H](NC(=O)c2ccc([N+](=O)[O-])cn2)CC[N@H+]1Cc1ccccc1 ZINC000366598049 465825710 /nfs/dbraw/zinc/82/57/10/465825710.db2.gz NFEJREREMOWTCY-BBRMVZONSA-N 1 1 340.383 2.383 10 5 EEBEMO C[N@@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccc2c(c1)OC(F)(F)O2 ZINC000594035704 468468267 /nfs/dbraw/zinc/46/82/67/468468267.db2.gz SUADDCBADSYSMU-UHFFFAOYSA-N 1 1 340.286 2.245 10 5 EEBEMO Cn1ccnc1[C@@H]([NH2+]CC[C@H]1CCOC1)c1cccc([N+](=O)[O-])c1 ZINC000353692924 466072814 /nfs/dbraw/zinc/07/28/14/466072814.db2.gz WGKFXQGRDZMVQW-BBRMVZONSA-N 1 1 330.388 2.434 10 5 EEBEMO COc1cc(F)c([N+](=O)[O-])c(N2CC[N@@H+](CC(C)(C)O)[C@@H](C)C2)c1 ZINC000302514871 466149893 /nfs/dbraw/zinc/14/98/93/466149893.db2.gz UWHAETHOEOZFKY-NSHDSACASA-N 1 1 341.383 2.024 10 5 EEBEMO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC(CO)(CO)C3)o2)c1 ZINC000597219205 468483371 /nfs/dbraw/zinc/48/33/71/468483371.db2.gz NMAVHEHHCYCBMP-UHFFFAOYSA-N 1 1 332.356 2.032 10 5 EEBEMO C[N@H+]1CCCC[C@@H]1C(=O)NCCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000589530579 468159971 /nfs/dbraw/zinc/15/99/71/468159971.db2.gz REDDZXWVQHAJDL-MRXNPFEDSA-N 1 1 330.388 2.219 10 5 EEBEMO CCc1nc(C[NH2+]C[C@H](O)COc2cccc([N+](=O)[O-])c2)cs1 ZINC000591734710 468512260 /nfs/dbraw/zinc/51/22/60/468512260.db2.gz CTCGXISQSBIIPX-ZDUSSCGKSA-N 1 1 337.401 2.143 10 5 EEBEMO O=C(CCN1CCC[C@H]([C@H]2CCC[NH2+]2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000592478429 468706771 /nfs/dbraw/zinc/70/67/71/468706771.db2.gz BGTYVOARRKQMHP-LSDHHAIUSA-N 1 1 346.431 2.387 10 5 EEBEMO CCN(C(=O)CCCNc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@@H+](C)C1 ZINC000597946974 468721159 /nfs/dbraw/zinc/72/11/59/468721159.db2.gz UJQWOFHACAONLS-MRXNPFEDSA-N 1 1 334.420 2.340 10 5 EEBEMO COCC[N@@H+]1CCC[C@@H]1CN[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595033608 468746568 /nfs/dbraw/zinc/74/65/68/468746568.db2.gz GZRVPXGNAHHAIR-UKRRQHHQSA-N 1 1 337.420 2.365 10 5 EEBEMO COCC[N@H+]1CCC[C@@H]1CN[C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595033608 468746570 /nfs/dbraw/zinc/74/65/70/468746570.db2.gz GZRVPXGNAHHAIR-UKRRQHHQSA-N 1 1 337.420 2.365 10 5 EEBEMO Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@@H+](C(C)C)C2)c([N+](=O)[O-])s1 ZINC000601394464 468856810 /nfs/dbraw/zinc/85/68/10/468856810.db2.gz SXSSBENATVVUON-LLVKDONJSA-N 1 1 347.462 2.116 10 5 EEBEMO Cc1cc(S(=O)(=O)N[C@@H]2CCC[N@H+](C(C)C)C2)c([N+](=O)[O-])s1 ZINC000601394464 468856816 /nfs/dbraw/zinc/85/68/16/468856816.db2.gz SXSSBENATVVUON-LLVKDONJSA-N 1 1 347.462 2.116 10 5 EEBEMO Nc1nccc([C@@H]2CCC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000595461341 468861838 /nfs/dbraw/zinc/86/18/38/468861838.db2.gz MIXIHKIYKKCQFC-LLVKDONJSA-N 1 1 331.351 2.486 10 5 EEBEMO Nc1nccc([C@@H]2CCC[N@@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000595461341 468861841 /nfs/dbraw/zinc/86/18/41/468861841.db2.gz MIXIHKIYKKCQFC-LLVKDONJSA-N 1 1 331.351 2.486 10 5 EEBEMO O=[N+]([O-])c1cccc(OC[C@@H](O)C[N@H+]2CCC[C@H](CCF)C2)c1 ZINC000595754416 468991118 /nfs/dbraw/zinc/99/11/18/468991118.db2.gz BCYRXULMMBBCQO-HIFRSBDPSA-N 1 1 326.368 2.406 10 5 EEBEMO C[C@@]12COC[C@@H]1C[N@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760922 468994315 /nfs/dbraw/zinc/99/43/15/468994315.db2.gz VFXCVBULQDQYHP-BLLLJJGKSA-N 1 1 330.344 2.113 10 5 EEBEMO C[C@@]12COC[C@@H]1C[N@@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760922 468994327 /nfs/dbraw/zinc/99/43/27/468994327.db2.gz VFXCVBULQDQYHP-BLLLJJGKSA-N 1 1 330.344 2.113 10 5 EEBEMO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@H]1CCC[N@@H+]1CCCO ZINC000593474834 468996977 /nfs/dbraw/zinc/99/69/77/468996977.db2.gz BFULCWOZXWZALY-AWEZNQCLSA-N 1 1 330.388 2.402 10 5 EEBEMO CCN1C(=O)N=NC1C1CC[NH+](Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000610775283 469068779 /nfs/dbraw/zinc/06/87/79/469068779.db2.gz RDOZFIQIKUFDGI-UHFFFAOYSA-N 1 1 349.366 2.431 10 5 EEBEMO CN(C)CC[N@@H+](C)CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC000563034493 469145531 /nfs/dbraw/zinc/14/55/31/469145531.db2.gz BBEWSGXBTIEUBW-UHFFFAOYSA-N 1 1 335.452 2.164 10 5 EEBEMO CN(CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2)CC[NH+](C)C ZINC000563034493 469145537 /nfs/dbraw/zinc/14/55/37/469145537.db2.gz BBEWSGXBTIEUBW-UHFFFAOYSA-N 1 1 335.452 2.164 10 5 EEBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H]1C[N@H+](C)CCO1 ZINC000615204808 469180279 /nfs/dbraw/zinc/18/02/79/469180279.db2.gz TUSSDMZQJFPTNC-GXFFZTMASA-N 1 1 341.795 2.006 10 5 EEBEMO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)N[C@@H](C)[C@H]1C[N@@H+](C)CCO1 ZINC000615204808 469180284 /nfs/dbraw/zinc/18/02/84/469180284.db2.gz TUSSDMZQJFPTNC-GXFFZTMASA-N 1 1 341.795 2.006 10 5 EEBEMO O=[N+]([O-])c1cccc(OCC[N@@H+]2C[C@@H](CO)[C@H](C(F)(F)F)C2)c1 ZINC000602988036 469209324 /nfs/dbraw/zinc/20/93/24/469209324.db2.gz ZCXLUIMJCQUXER-GXFFZTMASA-N 1 1 334.294 2.076 10 5 EEBEMO Cc1cc(N[C@@H]2C[C@@H]([NH+]3CCOCC3)C23CCC3)ncc1[N+](=O)[O-] ZINC000596514903 469289703 /nfs/dbraw/zinc/28/97/03/469289703.db2.gz MKGFTMJMFCOBIW-HUUCEWRRSA-N 1 1 332.404 2.354 10 5 EEBEMO O=C(Nc1ccc([N+](=O)[O-])c2ccncc12)N1CC[NH+](C2CC2)CC1 ZINC000599829534 469386085 /nfs/dbraw/zinc/38/60/85/469386085.db2.gz HKAFMIGHINOLTH-UHFFFAOYSA-N 1 1 341.371 2.455 10 5 EEBEMO C[N@H+]1CCC[C@@H](NC(=O)C2CCN(c3ccccc3[N+](=O)[O-])CC2)C1 ZINC000604198339 469462448 /nfs/dbraw/zinc/46/24/48/469462448.db2.gz GXLUSSMNZFCAFS-OAHLLOKOSA-N 1 1 346.431 2.022 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(C(=O)N(C)C)CC1 ZINC000175030471 528611738 /nfs/dbraw/zinc/61/17/38/528611738.db2.gz HIBAJLJFEPGUGQ-UHFFFAOYSA-N 1 1 335.404 2.294 10 5 EEBEMO O=C1c2cccc([N+](=O)[O-])c2C(=O)N1C[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000176203651 677790953 /nfs/dbraw/zinc/79/09/53/677790953.db2.gz PFIXMWYGDFPGHJ-RYUDHWBXSA-N 1 1 329.356 2.270 10 5 EEBEMO C[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])[N@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000025501299 684830875 /nfs/dbraw/zinc/83/08/75/684830875.db2.gz NPTYJEXJKOXVCO-RWMBFGLXSA-N 1 1 333.392 2.152 10 5 EEBEMO C[C@@H](CNc1nc2ccccn2c1[N+](=O)[O-])[N@@H+]1C[C@@H](C)O[C@@H](C)C1 ZINC000025501299 684830877 /nfs/dbraw/zinc/83/08/77/684830877.db2.gz NPTYJEXJKOXVCO-RWMBFGLXSA-N 1 1 333.392 2.152 10 5 EEBEMO Cc1ncoc1C(=O)NCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001691205557 1177712269 /nfs/dbraw/zinc/71/22/69/1177712269.db2.gz YLTKEECHXGAURC-UHFFFAOYSA-N 1 1 344.371 2.286 10 5 EEBEMO CC(C)n1cc(C(=O)NCC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001480935661 1178878192 /nfs/dbraw/zinc/87/81/92/1178878192.db2.gz JFNXTTQEZWZGFB-UHFFFAOYSA-N 1 1 345.403 2.234 10 5 EEBEMO CC1(C)CCC[N@H+]1CCNC(=O)c1cc(Cl)c(N)c([N+](=O)[O-])c1 ZINC001299259036 1193431267 /nfs/dbraw/zinc/43/12/67/1193431267.db2.gz PAZALEOVZCHBCX-UHFFFAOYSA-N 1 1 340.811 2.435 10 5 EEBEMO CN(CC[N@@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001272013612 1186957291 /nfs/dbraw/zinc/95/72/91/1186957291.db2.gz NJJPFZYFRGXXBC-ZIAGYGMSSA-N 1 1 341.358 2.180 10 5 EEBEMO CN(CC[N@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272013612 1186957297 /nfs/dbraw/zinc/95/72/97/1186957297.db2.gz NJJPFZYFRGXXBC-ZIAGYGMSSA-N 1 1 341.358 2.180 10 5 EEBEMO CN(CC[N@@H+](C)Cc1cccc(C(F)F)c1)C(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001272013612 1186957303 /nfs/dbraw/zinc/95/73/03/1186957303.db2.gz NJJPFZYFRGXXBC-ZIAGYGMSSA-N 1 1 341.358 2.180 10 5 EEBEMO CC(C)[N@@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCOC1 ZINC000812290646 1200622095 /nfs/dbraw/zinc/62/20/95/1200622095.db2.gz FGIZHILKJLTRDZ-OAHLLOKOSA-N 1 1 331.376 2.310 10 5 EEBEMO Cc1nc([N+](=O)[O-])cn1CCC(=O)O[C@H](C)C[C@H]1CCCC[N@H+]1C ZINC000870786211 1200877921 /nfs/dbraw/zinc/87/79/21/1200877921.db2.gz ACJLYZFMJGGMNE-TZMCWYRMSA-N 1 1 338.408 2.296 10 5 EEBEMO CCO[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171780 1201139997 /nfs/dbraw/zinc/13/99/97/1201139997.db2.gz AIKZTZOWXLMAMP-ARFHVFGLSA-N 1 1 334.372 2.137 10 5 EEBEMO CCO[C@@H]1C[C@H]1C(=O)O[C@H]1CC[N@@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000813171780 1201140004 /nfs/dbraw/zinc/14/00/04/1201140004.db2.gz AIKZTZOWXLMAMP-ARFHVFGLSA-N 1 1 334.372 2.137 10 5 EEBEMO CCOC(=O)Cc1ccc(N2CC[C@H]3[C@H](CC[N@H+]3C)C2)c([N+](=O)[O-])c1 ZINC000866208407 1201465560 /nfs/dbraw/zinc/46/55/60/1201465560.db2.gz IYSBFYFCCCPMEE-CABCVRRESA-N 1 1 347.415 2.231 10 5 EEBEMO CC[N@H+]1CC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000882478378 1201878313 /nfs/dbraw/zinc/87/83/13/1201878313.db2.gz SFMQMOCUCFKNTC-HNNXBMFYSA-N 1 1 346.431 2.409 10 5 EEBEMO CCOc1ccc([N+](=O)[O-])cc1NC(=O)N1CC[C@H]2C[N@@H+](C)C[C@H]21 ZINC000931261601 1206620110 /nfs/dbraw/zinc/62/01/10/1206620110.db2.gz CJPWAIYIALNLBH-SMDDNHRTSA-N 1 1 334.376 2.161 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679308 1207439630 /nfs/dbraw/zinc/43/96/30/1207439630.db2.gz YAPNHPRFODGMNU-OAHLLOKOSA-N 1 1 328.372 2.289 10 5 EEBEMO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CCc3nc[nH]c3C23CCC3)c1 ZINC000931679308 1207439632 /nfs/dbraw/zinc/43/96/32/1207439632.db2.gz YAPNHPRFODGMNU-OAHLLOKOSA-N 1 1 328.372 2.289 10 5 EEBEMO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]1C[C@@H]2CCC[C@]2(C(N)=O)C1 ZINC000933760603 1207836911 /nfs/dbraw/zinc/83/69/11/1207836911.db2.gz WNLHFKYRPQWDRY-KSSFIOAISA-N 1 1 347.415 2.469 10 5 EEBEMO C[C@@H]1[C@H](N[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC[N@H+]1C ZINC000903300104 1240205259 /nfs/dbraw/zinc/20/52/59/1240205259.db2.gz GESOGZBCLMTGFN-WQVCFCJDSA-N 1 1 329.404 2.100 10 5 EEBEMO Cc1ccc(CN2C[C@H]3CC[C@@H](C2)[N@@H+]3C2CC[NH2+]CC2)cc1[N+](=O)[O-] ZINC000903505425 1240712891 /nfs/dbraw/zinc/71/28/91/1240712891.db2.gz BCRAGRLLGDQWKQ-HDICACEKSA-N 1 1 344.459 2.304 10 5 EEBEMO Cc1[nH]c(CNc2c3cc([N+](=O)[O-])ccc3ncc2[N+](=O)[O-])c(C)[nH+]1 ZINC001187662530 1279610258 /nfs/dbraw/zinc/61/02/58/1279610258.db2.gz FIORWGBDTXRTIL-UHFFFAOYSA-N 1 1 342.315 2.425 10 5 EEBEMO C[N@H+](CCCNC(=O)Cc1cccnc1)Cc1csc([N+](=O)[O-])c1 ZINC001490174995 1291009577 /nfs/dbraw/zinc/00/95/77/1291009577.db2.gz DZFKIYVVOZZNIZ-UHFFFAOYSA-N 1 1 348.428 2.232 10 5 EEBEMO C[N@@H+](CCCNC(=O)Cc1cccnc1)Cc1csc([N+](=O)[O-])c1 ZINC001490174995 1291009585 /nfs/dbraw/zinc/00/95/85/1291009585.db2.gz DZFKIYVVOZZNIZ-UHFFFAOYSA-N 1 1 348.428 2.232 10 5 EEBEMO COCC[N@H+]1CC[C@H](NC(=O)c2cc([N+](=O)[O-])cc3ccccc32)C1 ZINC000859273000 1294370416 /nfs/dbraw/zinc/37/04/16/1294370416.db2.gz ZTMZRYIPDWXLAL-AWEZNQCLSA-N 1 1 343.383 2.199 10 5 EEBEMO CC[N@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c([N+](=O)[O-])c2N)C1 ZINC001142004605 1315417799 /nfs/dbraw/zinc/41/77/99/1315417799.db2.gz DMWDRVFFNJBLRJ-GFCCVEGCSA-N 1 1 342.399 2.402 10 5 EEBEMO C[N@H+]1CCN(C(=O)COc2cccc([N+](=O)[O-])c2)C[C@@H]1C(C)(C)C ZINC001163924916 1321248774 /nfs/dbraw/zinc/24/87/74/1321248774.db2.gz NEPJEDQKCYWQJO-OAHLLOKOSA-N 1 1 335.404 2.162 10 5 EEBEMO CC[N@@H+](CCCNC(=O)c1cnc(C)[nH]1)Cc1ccc([N+](=O)[O-])cc1 ZINC001265104478 1322921361 /nfs/dbraw/zinc/92/13/61/1322921361.db2.gz ULKKXUFVMWYYEG-UHFFFAOYSA-N 1 1 345.403 2.268 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)n1 ZINC001289307068 1328018311 /nfs/dbraw/zinc/01/83/11/1328018311.db2.gz PSSHTIRJRBKYQO-UHFFFAOYSA-N 1 1 344.375 2.449 10 5 EEBEMO Cc1c[nH]c(Nc2ccc(C(=O)c3nccn3C)cc2[N+](=O)[O-])[nH+]1 ZINC001319869953 1332789121 /nfs/dbraw/zinc/78/91/21/1332789121.db2.gz PEHSWGMZEZSMCF-UHFFFAOYSA-N 1 1 326.316 2.334 10 5 EEBEMO CCc1cc(C(=O)N(C)CC[N@@H+](C)Cc2ccc([N+](=O)[O-])cc2)no1 ZINC001320072282 1332819157 /nfs/dbraw/zinc/81/91/57/1332819157.db2.gz GHOIXDONDVKVEL-UHFFFAOYSA-N 1 1 346.387 2.349 10 5 EEBEMO Nc1nccc(C(=O)O[C@H]2CC[N@@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000848790026 1338764669 /nfs/dbraw/zinc/76/46/69/1338764669.db2.gz IYTVJAMFCLZZFP-ZDUSSCGKSA-N 1 1 342.355 2.003 10 5 EEBEMO CC[C@H](NC(=O)N1C[C@H]2CC[N@@H+](C)[C@H]2C1)c1cccc([N+](=O)[O-])c1 ZINC001564497483 1342549809 /nfs/dbraw/zinc/54/98/09/1342549809.db2.gz SFALOYANEMMMNK-KBMXLJTQSA-N 1 1 332.404 2.391 10 5 EEBEMO Cc1ncccc1C(=O)NCC1([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC001569415350 1342867337 /nfs/dbraw/zinc/86/73/37/1342867337.db2.gz CQGPUBZUVIIKIE-UHFFFAOYSA-N 1 1 346.412 2.412 10 5 EEBEMO CC(C)=CC[NH2+]Cc1ccc(CNC(=O)[C@@H]2CC2[N+](=O)[O-])c(F)c1 ZINC001677643684 1357382124 /nfs/dbraw/zinc/38/21/24/1357382124.db2.gz WDEQJKDBGOZEMA-GDBMZVCRSA-N 1 1 335.379 2.163 10 5 EEBEMO Cc1[nH]nc(C(=O)Nc2cc[nH+]c(N3CCCCC3)c2)c1[N+](=O)[O-] ZINC001647955565 1353411025 /nfs/dbraw/zinc/41/10/25/1353411025.db2.gz LBZQTAWAMGAEOJ-UHFFFAOYSA-N 1 1 330.348 2.264 10 5 EEBEMO CC[C@]1(O)CCC[N@@H+](CCCn2c(=O)oc3ccc([N+](=O)[O-])cc32)C1 ZINC001647993502 1353412537 /nfs/dbraw/zinc/41/25/37/1353412537.db2.gz PAKWSRZGWLECOX-KRWDZBQOSA-N 1 1 349.387 2.130 10 5 EEBEMO O=C(NC1CC1)c1cc([N+](=O)[O-])ccc1NCc1c[nH+]c2n1CCC2 ZINC001652234005 1354082634 /nfs/dbraw/zinc/08/26/34/1354082634.db2.gz KOBYAJUMBVHXGS-UHFFFAOYSA-N 1 1 341.371 2.242 10 5 EEBEMO CCc1cc(NC[C@@H]2CC[N@H+]2C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC001652252792 1354083749 /nfs/dbraw/zinc/08/37/49/1354083749.db2.gz QXNYKBDGCKYLKP-HNNXBMFYSA-N 1 1 327.388 2.152 10 5 EEBEMO COC(=O)[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC001654172771 1354142189 /nfs/dbraw/zinc/14/21/89/1354142189.db2.gz MFDIPLDDCWAMKQ-MNOVXSKESA-N 1 1 346.343 2.028 10 5 EEBEMO COC(=O)[C@H]1CC[N@@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC001654172771 1354142193 /nfs/dbraw/zinc/14/21/93/1354142193.db2.gz MFDIPLDDCWAMKQ-MNOVXSKESA-N 1 1 346.343 2.028 10 5 EEBEMO C[C@@H]1C[N@@H+](C2CC2)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001654649177 1354154193 /nfs/dbraw/zinc/15/41/93/1354154193.db2.gz FVVUXQYWSMUOBT-LLVKDONJSA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@@H]1C[N@H+](C2CC2)CCN1C(=O)c1c[nH]c2cc([N+](=O)[O-])ccc12 ZINC001654649177 1354154197 /nfs/dbraw/zinc/15/41/97/1354154197.db2.gz FVVUXQYWSMUOBT-LLVKDONJSA-N 1 1 328.372 2.385 10 5 EEBEMO Cc1c(NC(=O)CC[N@@H+]2C[C@@H]3C[C@H](O)CC[C@@H]3C2)cccc1[N+](=O)[O-] ZINC001655057550 1354163501 /nfs/dbraw/zinc/16/35/01/1354163501.db2.gz PCYDSKFSHBALFO-QLFBSQMISA-N 1 1 347.415 2.325 10 5 EEBEMO CC(C)CC[N@@H+](C)CCC1CCN(C(=O)[C@@H]2C[C@H]2[N+](=O)[O-])CC1 ZINC001667413649 1355737603 /nfs/dbraw/zinc/73/76/03/1355737603.db2.gz QKCOHUVCCIULOU-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO CC(C)CC[N@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001667413649 1355737609 /nfs/dbraw/zinc/73/76/09/1355737609.db2.gz QKCOHUVCCIULOU-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO CC(C)CC[N@@H+](C)CCC1CCN(C(=O)[C@@H]2CC2[N+](=O)[O-])CC1 ZINC001667413649 1355737617 /nfs/dbraw/zinc/73/76/17/1355737617.db2.gz QKCOHUVCCIULOU-HZPDHXFCSA-N 1 1 325.453 2.258 10 5 EEBEMO Cc1ccn(C)c1C(=O)N(C)CC[N@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001667556761 1355759332 /nfs/dbraw/zinc/75/93/32/1355759332.db2.gz KCQPXLICNDCGOL-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO Cc1ccn(C)c1C(=O)N(C)CC[N@@H+](C)Cc1cccc([N+](=O)[O-])c1 ZINC001667556761 1355759337 /nfs/dbraw/zinc/75/93/37/1355759337.db2.gz KCQPXLICNDCGOL-UHFFFAOYSA-N 1 1 344.415 2.446 10 5 EEBEMO CCc1nc[nH]c1C(=O)NCC=CC[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC001699338201 1405340293 /nfs/dbraw/zinc/34/02/93/1405340293.db2.gz OLMPEHLVSOTSJL-ARJAWSKDSA-N 1 1 349.416 2.018 10 5 EEBEMO C[N@@H+](CCNC(=O)CCc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000906405641 783885718 /nfs/dbraw/zinc/88/57/18/783885718.db2.gz WWSXBBYPZASTGP-UHFFFAOYSA-N 1 1 325.796 2.391 10 5 EEBEMO C[C@H](CNC(=O)c1cc(Cl)c(F)c([N+](=O)[O-])c1N)[N@@H+](C)C1CC1 ZINC001136598253 787268211 /nfs/dbraw/zinc/26/82/11/787268211.db2.gz YLJSNAAGFSEFNO-SSDOTTSWSA-N 1 1 344.774 2.182 10 5 EEBEMO C[C@@H]1CC[C@H](C)[N@@H+]1CC(=O)NCc1cc([N+](=O)[O-])c(F)cc1F ZINC000911473416 787466512 /nfs/dbraw/zinc/46/65/12/787466512.db2.gz CFDWFZSHDYVLQD-AOOOYVTPSA-N 1 1 327.331 2.362 10 5 EEBEMO O=C(Nc1cc([N+](=O)[O-])n[nH]1)[C@H]1CCC[N@@H+](Cc2cccc(F)c2)C1 ZINC001177806533 799131857 /nfs/dbraw/zinc/13/18/57/799131857.db2.gz 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325.796 2.342 10 5 EEBEMO COc1ccc(CC(=O)N[C@H]2CCC[N@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC001466717617 1110442033 /nfs/dbraw/zinc/44/20/33/1110442033.db2.gz YOGFZFRELQBRGH-AWEZNQCLSA-N 1 1 335.404 2.135 10 5 EEBEMO CC[N@@H+](C)[C@@H]1CCN(C(=O)C(F)(F)c2ccc([N+](=O)[O-])cc2)C1 ZINC001472447655 1110556295 /nfs/dbraw/zinc/55/62/95/1110556295.db2.gz HJNUFALGYWSQPD-CYBMUJFWSA-N 1 1 327.331 2.239 10 5 EEBEMO CCn1cc([N+](=O)[O-])c(C(=O)N[C@@H](C)[C@H]2CCC[N@H+](C3CCC3)C2)n1 ZINC000191703953 237269656 /nfs/dbraw/zinc/26/96/56/237269656.db2.gz VWKBCIXYHWDJBD-STQMWFEESA-N 1 1 349.435 2.194 10 5 EEBEMO C[C@@H]1[C@H](CO)CC[N@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000425967437 241189400 /nfs/dbraw/zinc/18/94/00/241189400.db2.gz OHSMZBSOGWFCRG-OCCSQVGLSA-N 1 1 330.388 2.198 10 5 EEBEMO [NH3+][C@@H]1CCCCCN1S(=O)(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000081004712 217349310 /nfs/dbraw/zinc/34/93/10/217349310.db2.gz YWBNCVYHWMAKFT-LBPRGKRZSA-N 1 1 333.797 2.098 10 5 EEBEMO 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2.379 10 5 EEBEMO CC[N@@H+](CCNC(=O)c1[nH]c(C)nc1C)Cc1ccc([N+](=O)[O-])cc1 ZINC001481001143 1179457128 /nfs/dbraw/zinc/45/71/28/1179457128.db2.gz ODKFZZMKSNZEET-UHFFFAOYSA-N 1 1 345.403 2.187 10 5 EEBEMO CC[N@@H+]1[C@H](C)CN(C(=O)COc2ccc([N+](=O)[O-])c(F)c2)C[C@@H]1C ZINC000880608447 1201540226 /nfs/dbraw/zinc/54/02/26/1201540226.db2.gz BXBVUAWCFLGEGX-TXEJJXNPSA-N 1 1 339.367 2.054 10 5 EEBEMO Cc1cc([N+](=O)[O-])ccc1S(=O)(=O)N1CC[N@H+](C)C(C)(C)CC1 ZINC000867681841 1201657561 /nfs/dbraw/zinc/65/75/61/1201657561.db2.gz OVLZMPPFYQKMOH-UHFFFAOYSA-N 1 1 341.433 2.008 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000868382752 1201803430 /nfs/dbraw/zinc/80/34/30/1201803430.db2.gz KIPODUJNADALBT-OCCSQVGLSA-N 1 1 332.404 2.328 10 5 EEBEMO Cc1ccc(CNC(=O)N[C@@H]2C[C@@H](C)[N@H+](C3CC3)C2)cc1[N+](=O)[O-] ZINC000868382753 1201803639 /nfs/dbraw/zinc/80/36/39/1201803639.db2.gz KIPODUJNADALBT-TZMCWYRMSA-N 1 1 332.404 2.328 10 5 EEBEMO 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325.434 2.284 10 5 EEBEMO O=[N+]([O-])c1cc2c(nc1NC[C@@H]1C[N@H+]3CCC[C@@H]3CO1)CCCC2 ZINC001328119496 1334400432 /nfs/dbraw/zinc/40/04/32/1334400432.db2.gz MWGDMHNAAMMTAU-ZIAGYGMSSA-N 1 1 332.404 2.144 10 5 EEBEMO C[C@@]12COC[C@H]1C[N@@H+](Cn1cc(-c3ccccc3[N+](=O)[O-])cn1)C2 ZINC001333721213 1336114551 /nfs/dbraw/zinc/11/45/51/1336114551.db2.gz FKRUJKPNBQMGRA-RHSMWYFYSA-N 1 1 328.372 2.384 10 5 EEBEMO COC(=O)c1cc([N+](=O)[O-])c(C)cc1NCc1c[nH+]c2n1CCC2 ZINC001612913286 1352312150 /nfs/dbraw/zinc/31/21/50/1352312150.db2.gz SQQOXLYQROYWJR-UHFFFAOYSA-N 1 1 330.344 2.445 10 5 EEBEMO C[C@@H]1CC[N@@H+](CCNC(=O)c2cc(Cl)c(F)c([N+](=O)[O-])c2N)C1 ZINC001618607809 1352351837 /nfs/dbraw/zinc/35/18/37/1352351837.db2.gz CYTXFVUBKJQOGP-MRVPVSSYSA-N 1 1 344.774 2.041 10 5 EEBEMO C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001644977452 1352772081 /nfs/dbraw/zinc/77/20/81/1352772081.db2.gz MADXUULCQZLNSM-CYBMUJFWSA-N 1 1 343.383 2.249 10 5 EEBEMO C[C@H](c1ccccc1)[N@@H+](CCO)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001644977452 1352772083 /nfs/dbraw/zinc/77/20/83/1352772083.db2.gz MADXUULCQZLNSM-CYBMUJFWSA-N 1 1 343.383 2.249 10 5 EEBEMO Cc1ccc(CC(=O)NCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cn1 ZINC001663335995 1354949873 /nfs/dbraw/zinc/94/98/73/1354949873.db2.gz VQAXPNZTHZTSBL-UHFFFAOYSA-N 1 1 342.399 2.089 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)CC1(O)CCC1 ZINC001673434954 1356690957 /nfs/dbraw/zinc/69/09/57/1356690957.db2.gz ZYQNLTJCYZISIA-UHFFFAOYSA-N 1 1 349.431 2.180 10 5 EEBEMO CCn1ccnc1C(=O)N(C)CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001698984569 1405200288 /nfs/dbraw/zinc/20/02/88/1405200288.db2.gz FVHWBVPAOISRIE-UHFFFAOYSA-N 1 1 345.403 2.015 10 5 EEBEMO C[C@@H]1[C@@H](C)[N@H+](C)C[C@H](C)N1C(=O)COc1ccc([N+](=O)[O-])c(F)c1 ZINC000844646601 789290756 /nfs/dbraw/zinc/29/07/56/789290756.db2.gz VKRHSFAFUNHBOO-QJPTWQEYSA-N 1 1 339.367 2.052 10 5 EEBEMO C[C@@H]1[C@H](NC(=O)NCCc2ccc(Cl)cc2[N+](=O)[O-])CC[N@H+]1C 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CCn1cnnc1[C@H]1CCC[N@@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000161343397 463422809 /nfs/dbraw/zinc/42/28/09/463422809.db2.gz IXKHQLKBIGVSHB-AWEZNQCLSA-N 1 1 345.403 2.465 10 5 EEBEMO Cn1cc(C[N@@H+]2[C@@H]3CC[C@H]2CC(O)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000126535568 463645033 /nfs/dbraw/zinc/64/50/33/463645033.db2.gz PLRCCSQWOZXFML-SJPCQFCGSA-N 1 1 342.399 2.483 10 5 EEBEMO C[C@@H]1C[C@@H](N(C)c2cc3c(cc2[N+](=O)[O-])CCC(=O)N3)CC[N@H+]1C ZINC000172765469 464140344 /nfs/dbraw/zinc/14/03/44/464140344.db2.gz XGMPXDNSKCKGKI-YPMHNXCESA-N 1 1 332.404 2.398 10 5 EEBEMO CC(C)Oc1cc(C(=O)N2CC[C@@H]3C[N@@H+](C)C[C@H]32)ccc1[N+](=O)[O-] ZINC000591083819 468405683 /nfs/dbraw/zinc/40/56/83/468405683.db2.gz VJEANMDGGXWXMH-UKRRQHHQSA-N 1 1 333.388 2.158 10 5 EEBEMO C[C@H]1C[NH+](C)C[C@H](C)N1C(=O)C(F)(F)c1ccc([N+](=O)[O-])cc1 ZINC000272181458 464509192 /nfs/dbraw/zinc/50/91/92/464509192.db2.gz SRRIVCYZSFLJIC-QWRGUYRKSA-N 1 1 327.331 2.238 10 5 EEBEMO C[C@@H]1C[C@H](N(C)C(=O)c2cc3nsnc3c([N+](=O)[O-])c2)CC[N@H+]1C ZINC000272220848 464523543 /nfs/dbraw/zinc/52/35/43/464523543.db2.gz KNJGYRTWIMKSLS-MWLCHTKSSA-N 1 1 349.416 2.154 10 5 EEBEMO Cc1ccc([N+](=O)[O-])cc1S(=O)(=O)N(C)[C@@H]1CC[N@@H+](C)[C@@H](C)C1 ZINC000246135438 464548671 /nfs/dbraw/zinc/54/86/71/464548671.db2.gz JVMDTQALXWTJIQ-QWHCGFSZSA-N 1 1 341.433 2.006 10 5 EEBEMO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](C)CS(C)(=O)=O ZINC000176970998 464896303 /nfs/dbraw/zinc/89/63/03/464896303.db2.gz IOVXUIRAFBPRHM-ZDUSSCGKSA-N 1 1 328.434 2.486 10 5 EEBEMO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](C)CS(C)(=O)=O ZINC000176970998 464896306 /nfs/dbraw/zinc/89/63/06/464896306.db2.gz IOVXUIRAFBPRHM-ZDUSSCGKSA-N 1 1 328.434 2.486 10 5 EEBEMO C[C@@](O)(C[NH+]1CCN(c2ncccc2[N+](=O)[O-])CC1)c1ccccc1 ZINC000298188555 465326569 /nfs/dbraw/zinc/32/65/69/465326569.db2.gz WNTPKSVEHRUOLZ-GOSISDBHSA-N 1 1 342.399 2.020 10 5 EEBEMO Cc1c(NC(=O)CC[N@H+](C)[C@@H]2CCN(C3CC3)C2)cccc1[N+](=O)[O-] 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ZINC000595752298 468988166 /nfs/dbraw/zinc/98/81/66/468988166.db2.gz WSTPOVGRKZVPIW-KRWDZBQOSA-N 1 1 334.372 2.118 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@]2(O)C[C@H]2C1 ZINC000595755975 468990323 /nfs/dbraw/zinc/99/03/23/468990323.db2.gz AJWWNQQUOMECLS-KNHMANMVSA-N 1 1 330.344 2.163 10 5 EEBEMO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1CC[C@@]2(O)C[C@H]2C1 ZINC000595755975 468990331 /nfs/dbraw/zinc/99/03/31/468990331.db2.gz AJWWNQQUOMECLS-KNHMANMVSA-N 1 1 330.344 2.163 10 5 EEBEMO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@](O)(C4CC4)C3)o2)cc1 ZINC000595753274 468990980 /nfs/dbraw/zinc/99/09/80/468990980.db2.gz XYCQDHMGZFWCRL-KRWDZBQOSA-N 1 1 344.371 2.382 10 5 EEBEMO C[C@]12COC[C@@H]1C[N@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760923 468993537 /nfs/dbraw/zinc/99/35/37/468993537.db2.gz VFXCVBULQDQYHP-LRDDRELGSA-N 1 1 330.344 2.113 10 5 EEBEMO C[C@]12COC[C@@H]1C[N@@H+](Cc1nc(-c3cccc([N+](=O)[O-])c3)no1)C2 ZINC000595760923 468993547 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5 EEBEMO CN(CCC[N@@H+](C)Cc1ccco1)c1cc(N)c([N+](=O)[O-])c(CO)c1 ZINC000588083419 469113243 /nfs/dbraw/zinc/11/32/43/469113243.db2.gz TZRFAKBZQZVGTR-UHFFFAOYSA-N 1 1 348.403 2.221 10 5 EEBEMO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCOCC3)C2)c2ccncc21 ZINC000599095405 469117916 /nfs/dbraw/zinc/11/79/16/469117916.db2.gz SYVWFDUNKOBNHJ-UHFFFAOYSA-N 1 1 328.372 2.418 10 5 EEBEMO O=C1[C@H]([N@@H+]2CC[C@H](C(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000611179669 469184153 /nfs/dbraw/zinc/18/41/53/469184153.db2.gz HJCYGGSLCGDZHQ-GXFFZTMASA-N 1 1 325.315 2.287 10 5 EEBEMO O=C1[C@H]([N@H+]2CC[C@H](C(F)F)C2)CCN1c1cccc([N+](=O)[O-])c1 ZINC000611179669 469184159 /nfs/dbraw/zinc/18/41/59/469184159.db2.gz HJCYGGSLCGDZHQ-GXFFZTMASA-N 1 1 325.315 2.287 10 5 EEBEMO O=[N+]([O-])c1cncc(Cl)c1N1CCC([N@H+]2CCCOCC2)CC1 ZINC000596268660 469227682 /nfs/dbraw/zinc/22/76/82/469227682.db2.gz NTXJFUUCVMHPIO-UHFFFAOYSA-N 1 1 340.811 2.334 10 5 EEBEMO O=C(CC[N@@H+]1C[C@@H]2CCC[C@]2(CO)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000599639596 469319010 /nfs/dbraw/zinc/31/90/10/469319010.db2.gz JNFOTYZDRAMZAP-SUMWQHHRSA-N 1 1 333.388 2.018 10 5 EEBEMO O=[N+]([O-])c1ccccc1OC[C@@H](O)C[NH+]1CC2(C1)CC(F)(F)C2 ZINC000612110405 469397575 /nfs/dbraw/zinc/39/75/75/469397575.db2.gz LSGULGSCHMPBQI-NSHDSACASA-N 1 1 328.315 2.066 10 5 EEBEMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@@H+]1CCc2sccc2C1 ZINC000532391742 485542064 /nfs/dbraw/zinc/54/20/64/485542064.db2.gz OPBXBZZPYKJZMQ-LLVKDONJSA-N 1 1 346.412 2.228 10 5 EEBEMO C[C@H](CNC(=O)c1ccc([N+](=O)[O-])cn1)[N@H+]1CCc2sccc2C1 ZINC000532391742 485542072 /nfs/dbraw/zinc/54/20/72/485542072.db2.gz OPBXBZZPYKJZMQ-LLVKDONJSA-N 1 1 346.412 2.228 10 5 EEBEMO COc1cc(C[N@@H+]2CCC[C@@H](Cn3cncn3)C2)c([N+](=O)[O-])cc1F ZINC000184216302 533802457 /nfs/dbraw/zinc/80/24/57/533802457.db2.gz VRFDMCDLEWMFPA-GFCCVEGCSA-N 1 1 349.366 2.246 10 5 EEBEMO COc1cc(C[N@H+]2CCC[C@@H](Cn3cncn3)C2)c([N+](=O)[O-])cc1F ZINC000184216302 533802463 /nfs/dbraw/zinc/80/24/63/533802463.db2.gz VRFDMCDLEWMFPA-GFCCVEGCSA-N 1 1 349.366 2.246 10 5 EEBEMO Cc1nn(CN(C)[C@H]2CC[N@H+](C3CC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764988884 577492444 /nfs/dbraw/zinc/49/24/44/577492444.db2.gz FHZOKDORCOUGDY-HNNXBMFYSA-N 1 1 329.404 2.379 10 5 EEBEMO C/C(=C\C(=O)N[C@H](C)[C@@H](C)[NH+]1CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000752029656 577764837 /nfs/dbraw/zinc/76/48/37/577764837.db2.gz MYTPWMQRFBAQRK-MSIAHBHRSA-N 1 1 347.415 2.224 10 5 EEBEMO CN(CCC[N@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)CC(C)(C)O ZINC001484741332 1191493790 /nfs/dbraw/zinc/49/37/90/1191493790.db2.gz UOPLPTLSEGCKEQ-UHFFFAOYSA-N 1 1 343.449 2.098 10 5 EEBEMO CN(CCC[N@@H+](C)Cc1csc([N+](=O)[O-])c1)C(=O)CC(C)(C)O ZINC001484741332 1191493791 /nfs/dbraw/zinc/49/37/91/1191493791.db2.gz UOPLPTLSEGCKEQ-UHFFFAOYSA-N 1 1 343.449 2.098 10 5 EEBEMO COCC[N@H+]1CCC[C@H]1CN[C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872031981 1198031312 /nfs/dbraw/zinc/03/13/12/1198031312.db2.gz OQUJEWCYJJIQLA-STQMWFEESA-N 1 1 325.384 2.495 10 5 EEBEMO COCCN1CCC[C@H]1C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872031981 1198031318 /nfs/dbraw/zinc/03/13/18/1198031318.db2.gz OQUJEWCYJJIQLA-STQMWFEESA-N 1 1 325.384 2.495 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1F ZINC000879131292 1200879357 /nfs/dbraw/zinc/87/93/57/1200879357.db2.gz ZCTOFRDFERHVPO-IAGOWNOFSA-N 1 1 332.331 2.358 10 5 EEBEMO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H](O)[C@H](Oc3ccccc3)C2)cc1F ZINC000879131292 1200879363 /nfs/dbraw/zinc/87/93/63/1200879363.db2.gz ZCTOFRDFERHVPO-IAGOWNOFSA-N 1 1 332.331 2.358 10 5 EEBEMO C[N@H+]1C[C@@H]2CN(C(=O)C3(c4ccc([N+](=O)[O-])cc4)CCC3)C[C@]2(C)C1 ZINC000887921961 1204507338 /nfs/dbraw/zinc/50/73/38/1204507338.db2.gz VFCRLZCEMWCGPH-QAPCUYQASA-N 1 1 343.427 2.427 10 5 EEBEMO C[C@@H]1CN(C(=O)C[N@H+](C)CCc2ccccc2[N+](=O)[O-])CC(C)(C)O1 ZINC000930439517 1206557897 /nfs/dbraw/zinc/55/78/97/1206557897.db2.gz ISROMBQHOOVAKI-CQSZACIVSA-N 1 1 349.431 2.095 10 5 EEBEMO C[C@@H]1CN(C(=O)C[N@@H+](C)CCc2ccccc2[N+](=O)[O-])CC(C)(C)O1 ZINC000930439517 1206557898 /nfs/dbraw/zinc/55/78/98/1206557898.db2.gz ISROMBQHOOVAKI-CQSZACIVSA-N 1 1 349.431 2.095 10 5 EEBEMO C[N@H+]1CCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])ccc1N1CCCCC1 ZINC000194748273 1211261784 /nfs/dbraw/zinc/26/17/84/1211261784.db2.gz NIABFSIBURLTRQ-HNNXBMFYSA-N 1 1 346.431 2.409 10 5 EEBEMO Cc1c(C[C@@H](C[NH3+])CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cnn1C ZINC000903988870 1242892448 /nfs/dbraw/zinc/89/24/48/1242892448.db2.gz ZQEBTNAVYZYBGY-JSGCOSHPSA-N 1 1 331.420 2.105 10 5 EEBEMO CC(F)(F)CC(=O)N[C@@H]1[C@H]2C[N@@H+](Cc3ccccc3[N+](=O)[O-])C[C@H]21 ZINC001491326124 1258953072 /nfs/dbraw/zinc/95/30/72/1258953072.db2.gz DCHWFWYCAWYFJU-JYAVWHMHSA-N 1 1 339.342 2.187 10 5 EEBEMO COCC[N@@H+](C)CCCNC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000858457662 1294121820 /nfs/dbraw/zinc/12/18/20/1294121820.db2.gz LIKFMAGNJSMBGV-UHFFFAOYSA-N 1 1 345.399 2.446 10 5 EEBEMO O=C1OC[C@H]2C[N@H+](Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C[C@@H]12 ZINC000862544566 1295873009 /nfs/dbraw/zinc/87/30/09/1295873009.db2.gz BNFYJNUIRHDVLX-IUODEOHRSA-N 1 1 328.324 2.460 10 5 EEBEMO O=C(CC[N@H+]1C[C@@H]2C[C@H]1CS2)Nc1cc([N+](=O)[O-])ccc1F ZINC000839202187 1315204520 /nfs/dbraw/zinc/20/45/20/1315204520.db2.gz ZTMMNBMJGAUOPV-QWRGUYRKSA-N 1 1 325.365 2.252 10 5 EEBEMO Cc1ccc(CC[NH2+]CC(C)(C)CN(C)C(=O)[C@@H]2CC2[N+](=O)[O-])cc1 ZINC001282295172 1325680908 /nfs/dbraw/zinc/68/09/08/1325680908.db2.gz QYKRYLQFUNXFGA-IAGOWNOFSA-N 1 1 347.459 2.277 10 5 EEBEMO CCc1nc(C(=O)NCCC[N@@H+](C)Cc2ccccc2[N+](=O)[O-])co1 ZINC001316817933 1331849501 /nfs/dbraw/zinc/84/95/01/1331849501.db2.gz RTGWFPOHTDDXJD-UHFFFAOYSA-N 1 1 346.387 2.397 10 5 EEBEMO Cc1ccn(C)c1C(=O)NCCC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC001316821542 1331913130 /nfs/dbraw/zinc/91/31/30/1331913130.db2.gz PDJYNGJWYXDAKF-UHFFFAOYSA-N 1 1 344.415 2.494 10 5 EEBEMO CC(C)=CC[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1C[C@H]1[N+](=O)[O-] ZINC001326449875 1334096730 /nfs/dbraw/zinc/09/67/30/1334096730.db2.gz RKTHOZXTRQPXPY-IAGOWNOFSA-N 1 1 331.416 2.366 10 5 EEBEMO CC(C)=CC[N@@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449875 1334096735 /nfs/dbraw/zinc/09/67/35/1334096735.db2.gz RKTHOZXTRQPXPY-IAGOWNOFSA-N 1 1 331.416 2.366 10 5 EEBEMO CC(C)=CC[N@H+](C)Cc1ccccc1CNC(=O)[C@@H]1CC1[N+](=O)[O-] ZINC001326449875 1334096737 /nfs/dbraw/zinc/09/67/37/1334096737.db2.gz RKTHOZXTRQPXPY-IAGOWNOFSA-N 1 1 331.416 2.366 10 5 EEBEMO C[C@H]1C[N@@H+](C2CC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC001611460510 1352300930 /nfs/dbraw/zinc/30/09/30/1352300930.db2.gz JLWUYXXOCBHAPV-NSHDSACASA-N 1 1 328.372 2.385 10 5 EEBEMO C[C@H]1C[N@H+](C2CC2)CCN1C(=O)c1cc2cccc([N+](=O)[O-])c2[nH]1 ZINC001611460510 1352300933 /nfs/dbraw/zinc/30/09/33/1352300933.db2.gz JLWUYXXOCBHAPV-NSHDSACASA-N 1 1 328.372 2.385 10 5 EEBEMO CC[C@H](C[NH+]1CCOCC1)Nc1c2ccccc2ncc1[N+](=O)[O-] ZINC001612934506 1352312601 /nfs/dbraw/zinc/31/26/01/1352312601.db2.gz VNYXUDBLSHDVMI-CYBMUJFWSA-N 1 1 330.388 2.088 10 5 EEBEMO COc1ccc(C[N@H+]2CCC[C@@H](c3cn(C)nn3)C2)cc1[N+](=O)[O-] ZINC001620661941 1352361516 /nfs/dbraw/zinc/36/15/16/1352361516.db2.gz SILDRFVEYGICJX-CYBMUJFWSA-N 1 1 331.376 2.112 10 5 EEBEMO C[N@H+](CCNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1)Cc1cccc([N+](=O)[O-])c1 ZINC001567321783 1342739328 /nfs/dbraw/zinc/73/93/28/1342739328.db2.gz FMOKCFGHRULRMN-XYJQFASLSA-N 1 1 343.427 2.435 10 5 EEBEMO C[N@@H+](CCNC(=O)[C@H]1[C@H]2[C@@H]1[C@@H]1CC[C@H]2C1)Cc1cccc([N+](=O)[O-])c1 ZINC001567321783 1342739333 /nfs/dbraw/zinc/73/93/33/1342739333.db2.gz FMOKCFGHRULRMN-XYJQFASLSA-N 1 1 343.427 2.435 10 5 EEBEMO C[N@@H+](CCNC(=O)c1cc2ccccc2c([N+](=O)[O-])c1N)C1CC1 ZINC001597738515 1349930950 /nfs/dbraw/zinc/93/09/50/1349930950.db2.gz JSJAHLSUTWAWML-UHFFFAOYSA-N 1 1 328.372 2.154 10 5 EEBEMO Cc1nccnc1[C@H](C)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001655515101 1354176062 /nfs/dbraw/zinc/17/60/62/1354176062.db2.gz OOXFMZUOPSEWBQ-NWDGAFQWSA-N 1 1 329.360 2.371 10 5 EEBEMO Cn1nccc1C[C@@H]1CCC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001660693781 1354517997 /nfs/dbraw/zinc/51/79/97/1354517997.db2.gz CEYDKEMHDHWYON-INIZCTEOSA-N 1 1 330.388 2.414 10 5 EEBEMO CN(CC[N@@H+](C)Cc1ccc([N+](=O)[O-])cc1)C(=O)C1(C)CCOCC1 ZINC001667638409 1355773109 /nfs/dbraw/zinc/77/31/09/1355773109.db2.gz MXLNPRPNUVPEHC-UHFFFAOYSA-N 1 1 349.431 2.302 10 5 EEBEMO C[C@H]1CN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C ZINC000906815729 784154553 /nfs/dbraw/zinc/15/45/53/784154553.db2.gz OVNSCLZOJSSXIW-NSHDSACASA-N 1 1 325.796 2.343 10 5 EEBEMO C[C@H]1CN(C(=O)CCc2ccc([N+](=O)[O-])cc2Cl)CC[N@H+]1C ZINC000906815729 784154555 /nfs/dbraw/zinc/15/45/55/784154555.db2.gz OVNSCLZOJSSXIW-NSHDSACASA-N 1 1 325.796 2.343 10 5 EEBEMO C[C@H]1CN(C(=O)c2[nH]nc([N+](=O)[O-])c2Cl)CC[N@H+]1C1CCCC1 ZINC001177712718 799089322 /nfs/dbraw/zinc/08/93/22/799089322.db2.gz JHAOKACXOYSGOM-VIFPVBQESA-N 1 1 341.799 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