smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1COc2ccccc21 ZINC000577655147 1014459240 /nfs/dbraw/zinc/45/92/40/1014459240.db2.gz AGDXVJNKFIALAS-ZBFHGGJFSA-N 1 0 326.396 3.682 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430195119 1014795358 /nfs/dbraw/zinc/79/53/58/1014795358.db2.gz NAKIVMDIRTZCLW-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218740 1015074812 /nfs/dbraw/zinc/07/48/12/1015074812.db2.gz KXHVCLKCXYLBML-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000449065959 1032111844 /nfs/dbraw/zinc/11/18/44/1032111844.db2.gz XTLQZAKZLUIORB-YJBOKZPZSA-N 1 0 343.427 3.546 20 5 EHBDRO COc1ccc([C@H](C[NH+]2CCCC2)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000302049411 1015183747 /nfs/dbraw/zinc/18/37/47/1015183747.db2.gz MZEFWKJZMZECCN-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO CC1=C[C@H](C)C[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282942 1015780400 /nfs/dbraw/zinc/78/04/00/1015780400.db2.gz GVQPOCQIIJDSIS-WCQYABFASA-N 1 0 328.372 3.604 20 5 EHBDRO CC1=C[C@@H](C)C[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282939 1015780419 /nfs/dbraw/zinc/78/04/19/1015780419.db2.gz GVQPOCQIIJDSIS-DGCLKSJQSA-N 1 0 328.372 3.604 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153740 1016507286 /nfs/dbraw/zinc/50/72/86/1016507286.db2.gz BKZUJMQUUZUVBB-RDTXWAMCSA-N 1 0 341.411 3.971 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226895 1016663486 /nfs/dbraw/zinc/66/34/86/1016663486.db2.gz DJIBNAFALYIQGT-AAEUAGOBSA-N 1 0 339.823 3.697 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000175730051 1016976854 /nfs/dbraw/zinc/97/68/54/1016976854.db2.gz GPPJGWVOZIVWPT-GOSISDBHSA-N 1 0 341.411 3.925 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H](CO)C3)s2)cc1 ZINC000414565731 1016979505 /nfs/dbraw/zinc/97/95/05/1016979505.db2.gz FJIDHPSXMYAOHN-DZGCQCFKSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc2c(c1)OCCO2 ZINC000449069655 1032157506 /nfs/dbraw/zinc/15/75/06/1032157506.db2.gz XYSNKVAZZAQFNA-KBPBESRZSA-N 1 0 342.395 3.648 20 5 EHBDRO CCC(CC)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1cccs1 ZINC000538174868 1032196737 /nfs/dbraw/zinc/19/67/37/1032196737.db2.gz GYMOYMZMZNJOIU-QGZVFWFLSA-N 1 0 349.456 3.585 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000538188642 1032206451 /nfs/dbraw/zinc/20/64/51/1032206451.db2.gz UHZBDPBBBMGCBO-HNNXBMFYSA-N 1 0 336.338 3.993 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449129754 1032225370 /nfs/dbraw/zinc/22/53/70/1032225370.db2.gz WIRISMSYGUVHBJ-HUUCEWRRSA-N 1 0 328.412 3.842 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449178099 1032273781 /nfs/dbraw/zinc/27/37/81/1032273781.db2.gz TZRJLHMDEJCFRG-ACJLOTCBSA-N 1 0 332.375 3.642 20 5 EHBDRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449192676 1032289276 /nfs/dbraw/zinc/28/92/76/1032289276.db2.gz UUQNPOFUQJFAGA-BXWFABGCSA-N 1 0 342.439 3.670 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1COc2ccccc21 ZINC000449202503 1032326311 /nfs/dbraw/zinc/32/63/11/1032326311.db2.gz FSIXXPHKJNQNDD-JKIFEVAISA-N 1 0 326.396 3.680 20 5 EHBDRO COCC[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000449228051 1032346166 /nfs/dbraw/zinc/34/61/66/1032346166.db2.gz RSRNOMNZSPFIKB-XJKSGUPXSA-N 1 0 332.400 3.795 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000449249258 1032353307 /nfs/dbraw/zinc/35/33/07/1032353307.db2.gz IRQCVNGPQNWVQM-WBMJQRKESA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000573219727 1032362362 /nfs/dbraw/zinc/36/23/62/1032362362.db2.gz LOPHAFCHTRRRNZ-HOTGVXAUSA-N 1 0 328.343 3.835 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccc(OCC3CC3)cc2)c1 ZINC000480282827 1032384980 /nfs/dbraw/zinc/38/49/80/1032384980.db2.gz YFLVQDRGJPZCJN-UHFFFAOYSA-N 1 0 326.396 3.716 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)OCCc2sccc21 ZINC000449337006 1032474828 /nfs/dbraw/zinc/47/48/28/1032474828.db2.gz OXJRHSNZMJOWGV-UGSOOPFHSA-N 1 0 346.452 3.665 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449379144 1032506051 /nfs/dbraw/zinc/50/60/51/1032506051.db2.gz GWMMPMDAULUGDD-SCXUMTSISA-N 1 0 332.322 3.555 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H](C)CCCCO)o2)c([N+](=O)[O-])c1 ZINC000449424167 1032539067 /nfs/dbraw/zinc/53/90/67/1032539067.db2.gz CWOBWYLWAYPPTB-CYBMUJFWSA-N 1 0 348.399 3.504 20 5 EHBDRO CC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000090068450 1032555782 /nfs/dbraw/zinc/55/57/82/1032555782.db2.gz ZQCMNWFTRZYZRJ-UHFFFAOYSA-N 1 0 326.400 3.553 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000449472427 1032592389 /nfs/dbraw/zinc/59/23/89/1032592389.db2.gz AEFMRSXFNQMXMU-HZPDHXFCSA-N 1 0 332.444 3.855 20 5 EHBDRO CO[C@@](C)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449484541 1032634515 /nfs/dbraw/zinc/63/45/15/1032634515.db2.gz MTGPUWAZPZPPKZ-QIBOZCLASA-N 1 0 326.396 3.759 20 5 EHBDRO COc1ccc(C2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000593040580 1032675471 /nfs/dbraw/zinc/67/54/71/1032675471.db2.gz HPRRGILURWWBTC-AWEZNQCLSA-N 1 0 341.411 3.939 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC(C[NH+]3CCCCCC3)CC2)c1 ZINC000610275532 1017282195 /nfs/dbraw/zinc/28/21/95/1017282195.db2.gz XSNKFLQJRQZUEQ-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000377246774 1017523359 /nfs/dbraw/zinc/52/33/59/1017523359.db2.gz WKOKZPOXFLXEKQ-AWEZNQCLSA-N 1 0 348.834 3.673 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC000377246775 1017523674 /nfs/dbraw/zinc/52/36/74/1017523674.db2.gz WKOKZPOXFLXEKQ-CQSZACIVSA-N 1 0 348.834 3.673 20 5 EHBDRO Cc1cc(N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610281962 1017614738 /nfs/dbraw/zinc/61/47/38/1017614738.db2.gz MKQYVOBZIOYWDA-SFHVURJKSA-N 1 0 325.412 3.614 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]([C@H](C)c1ccccc1Cl)C1CC1 ZINC001167325505 1018067943 /nfs/dbraw/zinc/06/79/43/1018067943.db2.gz CGGSZXVYORIEAA-GFCCVEGCSA-N 1 0 348.834 3.979 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH3+])CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000415492445 1018101717 /nfs/dbraw/zinc/10/17/17/1018101717.db2.gz CADBYWPEMBINAC-KRWDZBQOSA-N 1 0 342.399 3.540 20 5 EHBDRO CO[C@@]1(C)CCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000480810422 1018407696 /nfs/dbraw/zinc/40/76/96/1018407696.db2.gz FJGVMEVSCLWIDW-SFHVURJKSA-N 1 0 329.400 3.847 20 5 EHBDRO CCOc1cc(C[NH+]2CCC3(CC3(F)F)CC2)ccc1[N+](=O)[O-] ZINC000593073356 1032769841 /nfs/dbraw/zinc/76/98/41/1032769841.db2.gz QVTAJJJTXROUAL-UHFFFAOYSA-N 1 0 326.343 3.615 20 5 EHBDRO Cc1cc(N2CCC[C@@H](OC(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000593486567 1032785341 /nfs/dbraw/zinc/78/53/41/1032785341.db2.gz AOPCDLVGZDETQK-OAHLLOKOSA-N 1 0 329.400 3.845 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190850 1018989413 /nfs/dbraw/zinc/98/94/13/1018989413.db2.gz MNHFIYNNJLNKRB-APWZRJJASA-N 1 0 339.439 3.595 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1)CC1CC1 ZINC000536618918 1019196461 /nfs/dbraw/zinc/19/64/61/1019196461.db2.gz NSEPDVASKFCPTR-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](c3cc(C)ccn3)C2)ccc1[N+](=O)[O-] ZINC000579608381 1019258817 /nfs/dbraw/zinc/25/88/17/1019258817.db2.gz RZURRZXMDNDFFZ-INIZCTEOSA-N 1 0 341.411 3.686 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000433606506 1019436727 /nfs/dbraw/zinc/43/67/27/1019436727.db2.gz GPBLWTPQKXPZGS-KRWDZBQOSA-N 1 0 339.439 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]4CC[NH2+][C@H]4C3)s2)cc1 ZINC000592432486 1032839015 /nfs/dbraw/zinc/83/90/15/1032839015.db2.gz LDEJTRDHFIQZND-DYVFJYSZSA-N 1 0 343.452 3.507 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CCCC[N@@H+]2C2CC2)ccc2ncccc21 ZINC000433803701 1019646159 /nfs/dbraw/zinc/64/61/59/1019646159.db2.gz NGLOZNNAGBBSQN-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC001167433887 1019991932 /nfs/dbraw/zinc/99/19/32/1019991932.db2.gz OJZOEUBAZDOELB-UHFFFAOYSA-N 1 0 344.386 3.820 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000156828166 1020474527 /nfs/dbraw/zinc/47/45/27/1020474527.db2.gz AGTTUMXUGMGUMC-INIZCTEOSA-N 1 0 349.337 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](CC3CCSCC3)CC2)cc1 ZINC000602473344 1032905643 /nfs/dbraw/zinc/90/56/43/1032905643.db2.gz FYFLFIWCFCATDS-UHFFFAOYSA-N 1 0 336.457 3.581 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)n1 ZINC000126399591 1020647246 /nfs/dbraw/zinc/64/72/46/1020647246.db2.gz OYSJODICPAUNRF-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138306 1020727936 /nfs/dbraw/zinc/72/79/36/1020727936.db2.gz XTNUSENHHZKUON-UONOGXRCSA-N 1 0 333.432 3.822 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)[C@@H](O)CC ZINC000449639299 1032942005 /nfs/dbraw/zinc/94/20/05/1032942005.db2.gz OJMZBZVGQPRZAW-WBVHZDCISA-N 1 0 348.399 3.503 20 5 EHBDRO C[N@H+](CCc1cccc(NC(=O)c2csc([N+](=O)[O-])c2)c1)C1CC1 ZINC000341236722 1021147045 /nfs/dbraw/zinc/14/70/45/1021147045.db2.gz OJADITMRZNGCSO-UHFFFAOYSA-N 1 0 345.424 3.545 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000426289917 1021195819 /nfs/dbraw/zinc/19/58/19/1021195819.db2.gz NSCVCXLRLBNMJK-LSDHHAIUSA-N 1 0 343.402 3.972 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000507372149 1021225656 /nfs/dbraw/zinc/22/56/56/1021225656.db2.gz OZDLBYOQXQLRSH-MRXNPFEDSA-N 1 0 347.462 3.992 20 5 EHBDRO CCc1nc(C)c(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000426324784 1021263863 /nfs/dbraw/zinc/26/38/63/1021263863.db2.gz RWCNGGVEJVVKQH-HOCLYGCPSA-N 1 0 343.427 3.955 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@@H]4C3)CC2)cn1 ZINC000602555411 1032970075 /nfs/dbraw/zinc/97/00/75/1032970075.db2.gz HMKWHFGXXWDWTI-BFYDXBDKSA-N 1 0 344.459 3.517 20 5 EHBDRO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000518606314 1021367968 /nfs/dbraw/zinc/36/79/68/1021367968.db2.gz JWACGEYOHVPWHR-YDTIJZNPSA-N 1 0 328.343 3.859 20 5 EHBDRO C[N@@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCC1CCCCC1 ZINC000507582923 1021372007 /nfs/dbraw/zinc/37/20/07/1021372007.db2.gz HSCHKOUMGOIBKR-UHFFFAOYSA-N 1 0 333.432 3.826 20 5 EHBDRO CC(C)[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000602573474 1032979809 /nfs/dbraw/zinc/97/98/09/1032979809.db2.gz QMPYKQMGLTZUCF-HNNXBMFYSA-N 1 0 340.383 3.660 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437103031 1021576227 /nfs/dbraw/zinc/57/62/27/1021576227.db2.gz IGIASPIITUVAHT-HUUCEWRRSA-N 1 0 325.412 3.554 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@H]1CCCCO1 ZINC000602595504 1032990561 /nfs/dbraw/zinc/99/05/61/1032990561.db2.gz BNGQLVXSZUFKOS-CYBMUJFWSA-N 1 0 332.322 3.662 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CCF)cc1 ZINC000437254720 1021678737 /nfs/dbraw/zinc/67/87/37/1021678737.db2.gz XCKBXNHIMLRXTP-UHFFFAOYSA-N 1 0 340.358 3.507 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(OC2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000090911924 1021696301 /nfs/dbraw/zinc/69/63/01/1021696301.db2.gz YNKITYMTVLXKFN-ZDUSSCGKSA-N 1 0 327.384 3.772 20 5 EHBDRO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270531888 1021714913 /nfs/dbraw/zinc/71/49/13/1021714913.db2.gz UNIAHDPZAOVSNF-KDURUIRLSA-N 1 0 330.431 3.912 20 5 EHBDRO CC(C)c1ccc(C[N@H+](CCn2cc([N+](=O)[O-])cn2)C2CC2)cc1 ZINC000471717324 1021828036 /nfs/dbraw/zinc/82/80/36/1021828036.db2.gz YAMDKQQTSCEQED-UHFFFAOYSA-N 1 0 328.416 3.579 20 5 EHBDRO Cc1c(C[N@H+](CCc2ccccc2)[C@@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000437503838 1021897166 /nfs/dbraw/zinc/89/71/66/1021897166.db2.gz FQNLBSJYZVCAHT-LJQANCHMSA-N 1 0 340.423 3.737 20 5 EHBDRO CC[C@]1(CO)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602625562 1033018035 /nfs/dbraw/zinc/01/80/35/1033018035.db2.gz STADXSWOUYYPLC-HNNXBMFYSA-N 1 0 346.349 3.598 20 5 EHBDRO C[N@H+](CCc1ccccn1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602608878 1033026721 /nfs/dbraw/zinc/02/67/21/1033026721.db2.gz YHDXCFIZQNTAOH-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000517181857 1022100448 /nfs/dbraw/zinc/10/04/48/1022100448.db2.gz RMWMFJGYYZOZCE-UHFFFAOYSA-N 1 0 348.443 3.581 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]([C@H]2CCOC2)C1 ZINC000441295803 1022138125 /nfs/dbraw/zinc/13/81/25/1022138125.db2.gz UATQVSYPTUBEPB-CVEARBPZSA-N 1 0 348.443 3.631 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CC[C@@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471788849 1022206569 /nfs/dbraw/zinc/20/65/69/1022206569.db2.gz QSPZOHFOXBKDMY-LSBZLQRGSA-N 1 0 344.411 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@H]3CCCC(F)(F)C3)nc2c1 ZINC000602652520 1033040865 /nfs/dbraw/zinc/04/08/65/1033040865.db2.gz MDGJPWWIVTXTDQ-JTQLQIEISA-N 1 0 325.315 3.651 20 5 EHBDRO CC(C)[C@H]1[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000894921031 1022248777 /nfs/dbraw/zinc/24/87/77/1022248777.db2.gz VLJVRMAKDYWOFN-MRXNPFEDSA-N 1 0 338.835 3.885 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc2ccccc2[nH]1 ZINC000101596226 1022307960 /nfs/dbraw/zinc/30/79/60/1022307960.db2.gz GNFKIEIJOQBXSR-UHFFFAOYSA-N 1 0 325.368 3.765 20 5 EHBDRO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCC1 ZINC000438342690 1022580520 /nfs/dbraw/zinc/58/05/20/1022580520.db2.gz UAIKKZXNWJLUNJ-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO C[C@H](CCc1ccccc1)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425997856 1022646811 /nfs/dbraw/zinc/64/68/11/1022646811.db2.gz ZKSJZSFZWJAXSM-MRXNPFEDSA-N 1 0 342.443 3.697 20 5 EHBDRO CC[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602692229 1033072448 /nfs/dbraw/zinc/07/24/48/1033072448.db2.gz WLCWDZCXZTYFKE-VIFPVBQESA-N 1 0 331.294 3.804 20 5 EHBDRO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1([NH+](C)C)CCC1 ZINC000438481759 1022703099 /nfs/dbraw/zinc/70/30/99/1022703099.db2.gz YSRHHSSUWBNASP-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO Cc1ccccc1[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441440477 1022802244 /nfs/dbraw/zinc/80/22/44/1022802244.db2.gz QFFDFVFOIBGWQN-UZLBHIALSA-N 1 0 340.423 3.908 20 5 EHBDRO CC(C)(C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000438588542 1022826404 /nfs/dbraw/zinc/82/64/04/1022826404.db2.gz RCGLVXFQNBVUMO-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CCN(CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CCC(F)(F)F ZINC000426078911 1022858999 /nfs/dbraw/zinc/85/89/99/1022858999.db2.gz OHVZLEBHLDISPM-CYBMUJFWSA-N 1 0 347.381 3.828 20 5 EHBDRO COc1ccc(C[NH2+]C[C@]2(C)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000550254977 1022874555 /nfs/dbraw/zinc/87/45/55/1022874555.db2.gz MMWQUJMSFZZSQO-LPHOPBHVSA-N 1 0 326.396 3.887 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@H]1C ZINC000509578310 1023075923 /nfs/dbraw/zinc/07/59/23/1023075923.db2.gz HFKSEQCLGDTGAR-DDBGAENHSA-N 1 0 348.349 3.916 20 5 EHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507189953 1023182179 /nfs/dbraw/zinc/18/21/79/1023182179.db2.gz XHEQJTCKAAEKQM-KRWDZBQOSA-N 1 0 328.416 3.616 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000178387044 1023204858 /nfs/dbraw/zinc/20/48/58/1023204858.db2.gz WZEKJEGTTMMHLD-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276872538 1023270642 /nfs/dbraw/zinc/27/06/42/1023270642.db2.gz HRCDZQIRSLRSLG-QGZVFWFLSA-N 1 0 344.411 3.549 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000276874660 1023278371 /nfs/dbraw/zinc/27/83/71/1023278371.db2.gz HZEJEKFYQZGVCS-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276892515 1023315342 /nfs/dbraw/zinc/31/53/42/1023315342.db2.gz KLMFIADRGDUNOI-KRWDZBQOSA-N 1 0 344.411 3.597 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(OCC3CC3)cc2)cc1[N+](=O)[O-] ZINC000276966519 1023493256 /nfs/dbraw/zinc/49/32/56/1023493256.db2.gz NXLNWUIFAWHCJP-UHFFFAOYSA-N 1 0 342.395 3.682 20 5 EHBDRO CCC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000548488333 1023496215 /nfs/dbraw/zinc/49/62/15/1023496215.db2.gz NRVKQVNJVSQZQB-YOEHRIQHSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[C@@H](C)[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341879442 1023513907 /nfs/dbraw/zinc/51/39/07/1023513907.db2.gz UVISNGHERZHEDH-IAQYHMDHSA-N 1 0 336.823 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCC(F)(F)C3)cs2)c1 ZINC000610787771 1023516773 /nfs/dbraw/zinc/51/67/73/1023516773.db2.gz NPLMJKKTOUMULZ-LLVKDONJSA-N 1 0 339.367 3.996 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(C(=O)C(C)(C)C)CC1 ZINC000610799335 1023682011 /nfs/dbraw/zinc/68/20/11/1023682011.db2.gz SKCXLGUFSQYXJU-CQSZACIVSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000610831064 1023780942 /nfs/dbraw/zinc/78/09/42/1023780942.db2.gz HVTRAEZIZUOZNM-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO CCC1(CC)[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@H]1OC ZINC000610845665 1023788122 /nfs/dbraw/zinc/78/81/22/1023788122.db2.gz DASJTARBDBJUOD-CVEARBPZSA-N 1 0 347.415 3.762 20 5 EHBDRO CCC1(CC)[C@@H](OC)C[C@@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610845666 1023788142 /nfs/dbraw/zinc/78/81/42/1023788142.db2.gz DASJTARBDBJUOD-HOTGVXAUSA-N 1 0 347.415 3.762 20 5 EHBDRO CCO[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000610930482 1023877495 /nfs/dbraw/zinc/87/74/95/1023877495.db2.gz SMUSNBJDDDJKOQ-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+][C@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])C2)CO1 ZINC000897779295 1033171828 /nfs/dbraw/zinc/17/18/28/1033171828.db2.gz OXWFYWMPZCJWDB-NTWVUQQSSA-N 1 0 344.455 3.853 20 5 EHBDRO CC(C)c1ccc(CN2C[C@@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000520600162 1024211614 /nfs/dbraw/zinc/21/16/14/1024211614.db2.gz GMWQQZNNNBJHNE-OALUTQOASA-N 1 0 330.428 3.862 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H]3O[C@H]2[C@H]2C[C@H]23)s1 ZINC000897822545 1033195694 /nfs/dbraw/zinc/19/56/94/1033195694.db2.gz CCIGDPUCRMCFBA-DBMJBKLQSA-N 1 0 342.420 3.589 20 5 EHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500306 1024242972 /nfs/dbraw/zinc/24/29/72/1024242972.db2.gz SMICETROQZKRJV-ZWNOBZJWSA-N 1 0 327.222 3.978 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000320358385 1024322457 /nfs/dbraw/zinc/32/24/57/1024322457.db2.gz MIQUXUDRGXVUBY-NSHDSACASA-N 1 0 331.338 3.756 20 5 EHBDRO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000463385173 1024333519 /nfs/dbraw/zinc/33/35/19/1024333519.db2.gz AAPIMBPREPRLMO-ODIFPOPNSA-N 1 0 326.396 3.993 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000446483174 1024417750 /nfs/dbraw/zinc/41/77/50/1024417750.db2.gz BBJZTFNHHBHIGT-UHFFFAOYSA-N 1 0 336.436 3.537 20 5 EHBDRO Cc1ccc(C)c([C@H](C)[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000346275565 1024565475 /nfs/dbraw/zinc/56/54/75/1024565475.db2.gz AWVZBOPZDFMDOF-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccnn1-c1ccccc1 ZINC000467330110 1024664462 /nfs/dbraw/zinc/66/44/62/1024664462.db2.gz NJTBEPAFAWAGTL-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C(=O)OC(C)C)CC1 ZINC000895828859 1024892911 /nfs/dbraw/zinc/89/29/11/1024892911.db2.gz OPSDLFYRXKQRGY-RVDMUPIBSA-N 1 0 346.427 3.662 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3C[C@H]4CCC[C@H]43)cs2)c1 ZINC000897952464 1033259461 /nfs/dbraw/zinc/25/94/61/1033259461.db2.gz GRIRILLYCPDBSO-HFBAOOFYSA-N 1 0 329.425 3.997 20 5 EHBDRO C/C=C\C[C@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000472148062 1025150768 /nfs/dbraw/zinc/15/07/68/1025150768.db2.gz VOELQGUETPTUJC-XQJDBVBESA-N 1 0 332.425 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cccc4[nH]ccc43)c2c1 ZINC000515475656 1025277502 /nfs/dbraw/zinc/27/75/02/1025277502.db2.gz CJKNRZJYGQKMJY-UHFFFAOYSA-N 1 0 334.379 3.890 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC1CCC(C)([NH+]2CCC2)CC1 ZINC000896257561 1025287747 /nfs/dbraw/zinc/28/77/47/1025287747.db2.gz NTOIZBVGXHQJKX-UHFFFAOYSA-N 1 0 333.432 3.560 20 5 EHBDRO CCN(CCC[NH+](C)C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000515660424 1025465168 /nfs/dbraw/zinc/46/51/68/1025465168.db2.gz ZXCJVWHKKZEPAK-UHFFFAOYSA-N 1 0 331.416 3.628 20 5 EHBDRO CO[C@@H](C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000451057494 1025479288 /nfs/dbraw/zinc/47/92/88/1025479288.db2.gz SWSAVXVBRLMFIU-MRXNPFEDSA-N 1 0 328.412 3.677 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000451162573 1025619955 /nfs/dbraw/zinc/61/99/55/1025619955.db2.gz NQKFLNHGVQTGSR-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056829 1025621593 /nfs/dbraw/zinc/62/15/93/1025621593.db2.gz BCTYOOSJPPJNRL-ZBFHGGJFSA-N 1 0 341.411 3.971 20 5 EHBDRO C[C@@H](c1nc(C(C)(C)C)no1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511093111 1025648837 /nfs/dbraw/zinc/64/88/37/1025648837.db2.gz BYPJLWAMDDLWFS-LBPRGKRZSA-N 1 0 332.404 3.511 20 5 EHBDRO C[C@@H]1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H]1n1ccnc1 ZINC000129709337 1025770633 /nfs/dbraw/zinc/77/06/33/1025770633.db2.gz XAIZTKFCACXELK-WBMJQRKESA-N 1 0 334.807 3.528 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451412184 1025945029 /nfs/dbraw/zinc/94/50/29/1025945029.db2.gz FWFSNZZCDLBFFL-KURKYZTESA-N 1 0 348.443 3.507 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCC23CCCC3)cccc1[N+](=O)[O-] ZINC000451451877 1025978899 /nfs/dbraw/zinc/97/88/99/1025978899.db2.gz BOVVEIFQYGXXNI-MRXNPFEDSA-N 1 0 331.416 3.544 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000505855008 1025980773 /nfs/dbraw/zinc/98/07/73/1025980773.db2.gz AEDHELUDVFLGMY-MRXNPFEDSA-N 1 0 342.395 3.504 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nc(-c2ccn3c[nH+]cc3c2)no1 ZINC000351076519 1026055968 /nfs/dbraw/zinc/05/59/68/1026055968.db2.gz IOEVBWXKLWJLBQ-UHFFFAOYSA-N 1 0 341.714 3.613 20 5 EHBDRO CCOc1ccccc1OCC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511109433 1026069188 /nfs/dbraw/zinc/06/91/88/1026069188.db2.gz RWKVGWOCXNZFOK-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO Cc1nc(CC[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451550865 1026101166 /nfs/dbraw/zinc/10/11/66/1026101166.db2.gz SRHMPICDMHUWEX-OAHLLOKOSA-N 1 0 331.441 3.782 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]Cc2ncccc2O)s1 ZINC000475345114 1026503793 /nfs/dbraw/zinc/50/37/93/1026503793.db2.gz ZRUHADMZCLSIOU-UHFFFAOYSA-N 1 0 341.392 3.714 20 5 EHBDRO COc1cccc(N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000475394563 1026558031 /nfs/dbraw/zinc/55/80/31/1026558031.db2.gz WLWZULMALJSBFH-JKSUJKDBSA-N 1 0 347.459 3.694 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000479528422 1026675763 /nfs/dbraw/zinc/67/57/63/1026675763.db2.gz QRGOWKLVFZUNFO-HIFRSBDPSA-N 1 0 338.448 3.831 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418284 1026790036 /nfs/dbraw/zinc/79/00/36/1026790036.db2.gz NVLNIOWGVDTDBA-ACJLOTCBSA-N 1 0 349.394 3.514 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000531443669 1026926362 /nfs/dbraw/zinc/92/63/62/1026926362.db2.gz IGGZLBLMOAQKAK-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310435247 1027005190 /nfs/dbraw/zinc/00/51/90/1027005190.db2.gz OFOAGBQALWHMSP-UPJWGTAASA-N 1 0 337.420 3.547 20 5 EHBDRO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000472247765 1027072695 /nfs/dbraw/zinc/07/26/95/1027072695.db2.gz SVVPBZSVMSVMJH-SFHVURJKSA-N 1 0 348.422 3.520 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)C1 ZINC000531692625 1027191823 /nfs/dbraw/zinc/19/18/23/1027191823.db2.gz REIQFWMWJYFPSN-AEFFLSMTSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1cccc(F)c1)N(C)C ZINC000531677954 1027203029 /nfs/dbraw/zinc/20/30/29/1027203029.db2.gz QMHBKMOOJRCTIN-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](CO)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000531696812 1027215443 /nfs/dbraw/zinc/21/54/43/1027215443.db2.gz GWFGURLWGGXKER-GOEBONIOSA-N 1 0 346.402 3.544 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1OC1CC[NH+](CCc2ccccc2)CC1 ZINC001225667993 1027219426 /nfs/dbraw/zinc/21/94/26/1027219426.db2.gz XHCKOCRLDCEPAI-UHFFFAOYSA-N 1 0 344.386 3.820 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H](c1ccco1)N1CCCCC1 ZINC000061013464 1027268860 /nfs/dbraw/zinc/26/88/60/1027268860.db2.gz ADGDTRPNNYCVNE-KRWDZBQOSA-N 1 0 329.400 3.505 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000310625641 1027489995 /nfs/dbraw/zinc/48/99/95/1027489995.db2.gz CUTYMFVFNVKSPZ-YRNRMSPPSA-N 1 0 339.439 3.908 20 5 EHBDRO Cc1c(CN2CCC[N@H+](Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000501851010 1027596485 /nfs/dbraw/zinc/59/64/85/1027596485.db2.gz MAWJVLGIJXFTSA-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000501868775 1027611448 /nfs/dbraw/zinc/61/14/48/1027611448.db2.gz FYEOYTXYTVMHAA-KRWDZBQOSA-N 1 0 326.396 3.681 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)c1 ZINC000420945041 1027906160 /nfs/dbraw/zinc/90/61/60/1027906160.db2.gz KEZDZFBYOUDFNJ-LBPRGKRZSA-N 1 0 332.322 3.638 20 5 EHBDRO Cc1cnc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656082 1028046438 /nfs/dbraw/zinc/04/64/38/1028046438.db2.gz ORPDITTUJGKMLN-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444610073 1028074215 /nfs/dbraw/zinc/07/42/15/1028074215.db2.gz NYXYVDSSNQSNTC-AWEZNQCLSA-N 1 0 336.395 3.769 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691013 1028163967 /nfs/dbraw/zinc/16/39/67/1028163967.db2.gz WRENWHMBJIWOAU-HOTGVXAUSA-N 1 0 346.431 3.545 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774639 1028263664 /nfs/dbraw/zinc/26/36/64/1028263664.db2.gz XIPOTSPPRPLUJG-LSDHHAIUSA-N 1 0 333.432 3.598 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000421373205 1028331307 /nfs/dbraw/zinc/33/13/07/1028331307.db2.gz DPRQUGHKONQHEP-GDBMZVCRSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1ccc(Cl)cc1NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000137255357 1028527546 /nfs/dbraw/zinc/52/75/46/1028527546.db2.gz CWVVNIUVSOMYPT-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000162343992 1028625074 /nfs/dbraw/zinc/62/50/74/1028625074.db2.gz JKENJBHNNHVYSI-CZUORRHYSA-N 1 0 329.400 3.961 20 5 EHBDRO CN(C[C@@H]1CCC[N@@H+]1C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000421706669 1028702431 /nfs/dbraw/zinc/70/24/31/1028702431.db2.gz VLZJCTIZZUOALV-INIZCTEOSA-N 1 0 333.435 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCN(C3CCCC3)C1)CCC2 ZINC000583064227 1028715006 /nfs/dbraw/zinc/71/50/06/1028715006.db2.gz ISPNGHAGZNTJAO-DNVCBOLYSA-N 1 0 329.444 3.579 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2C[C@H]2C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000424163650 1028863186 /nfs/dbraw/zinc/86/31/86/1028863186.db2.gz ALZRJTGJVPRHAT-YJBOKZPZSA-N 1 0 340.427 3.521 20 5 EHBDRO CC(C)c1ccc(-c2nc(C3([NH3+])CCCCC3)no2)cc1[N+](=O)[O-] ZINC000424343038 1029023343 /nfs/dbraw/zinc/02/33/43/1029023343.db2.gz IYYRCYKWSPSCDB-UHFFFAOYSA-N 1 0 330.388 3.886 20 5 EHBDRO CCOc1ccc([C@H](C)NCCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504900471 1029027604 /nfs/dbraw/zinc/02/76/04/1029027604.db2.gz YNRNLMWPUODOBA-INIZCTEOSA-N 1 0 349.475 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCOc2ccc(C(F)(F)F)cc2)c1 ZINC000237844897 1029458716 /nfs/dbraw/zinc/45/87/16/1029458716.db2.gz NXRAVWHPBNLNLS-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000533248717 1029526427 /nfs/dbraw/zinc/52/64/27/1029526427.db2.gz MLFHECFMTIZLJF-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285223 1029574378 /nfs/dbraw/zinc/57/43/78/1029574378.db2.gz XUAKTXAIKNBLPT-GXTWGEPZSA-N 1 0 333.432 3.741 20 5 EHBDRO CC(C)[NH+](CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1)C(C)C ZINC000347390238 1029722580 /nfs/dbraw/zinc/72/25/80/1029722580.db2.gz MEIAMXDJRADHDQ-UHFFFAOYSA-N 1 0 347.415 3.580 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525246130 1029756546 /nfs/dbraw/zinc/75/65/46/1029756546.db2.gz NMPWJKFSHMQQCY-UONOGXRCSA-N 1 0 332.400 3.742 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCC[C@H]1O ZINC000428458667 1029854609 /nfs/dbraw/zinc/85/46/09/1029854609.db2.gz CUPPOCCXBKFHFO-IAGOWNOFSA-N 1 0 330.384 3.590 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475648067 1029856478 /nfs/dbraw/zinc/85/64/78/1029856478.db2.gz IKUUDFIKQCGRCL-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000446939048 1029860011 /nfs/dbraw/zinc/86/00/11/1029860011.db2.gz LJJVLIMACOTXSH-LJQANCHMSA-N 1 0 328.412 3.926 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258794 1029959609 /nfs/dbraw/zinc/95/96/09/1029959609.db2.gz WDZPYGKJWYWTFV-GXTWGEPZSA-N 1 0 332.404 3.741 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453253339 1029983161 /nfs/dbraw/zinc/98/31/61/1029983161.db2.gz HZAQQAWQDJWRGB-NEPJUHHUSA-N 1 0 334.338 3.911 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453253348 1029984218 /nfs/dbraw/zinc/98/42/18/1029984218.db2.gz HZAQQAWQDJWRGB-VXGBXAGGSA-N 1 0 334.338 3.911 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000453278942 1030020439 /nfs/dbraw/zinc/02/04/39/1030020439.db2.gz DEWCTZUURBAKHT-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H](C)CCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453284385 1030025241 /nfs/dbraw/zinc/02/52/41/1030025241.db2.gz WBJHFFPPFASJSN-AUUYWEPGSA-N 1 0 346.427 3.838 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453363896 1030178095 /nfs/dbraw/zinc/17/80/95/1030178095.db2.gz ROEMIINLBHECRJ-XCRHUMRWSA-N 1 0 327.384 3.561 20 5 EHBDRO Cc1cc(C)c(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000453372064 1030193970 /nfs/dbraw/zinc/19/39/70/1030193970.db2.gz RYXSHJNVQLNTLX-SFHVURJKSA-N 1 0 325.412 3.718 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])nc1 ZINC000453413601 1030226289 /nfs/dbraw/zinc/22/62/89/1030226289.db2.gz HZWQMSZAHPOVFG-APWZRJJASA-N 1 0 339.439 3.842 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447527169 1030248481 /nfs/dbraw/zinc/24/84/81/1030248481.db2.gz FLKSNHDFEDFNOS-SJORKVTESA-N 1 0 342.443 3.842 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447507441 1030255561 /nfs/dbraw/zinc/25/55/61/1030255561.db2.gz HUDCPBKXAHSIMJ-WOJBJXKFSA-N 1 0 339.439 3.865 20 5 EHBDRO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532125090 1030417574 /nfs/dbraw/zinc/41/75/74/1030417574.db2.gz ZRAMYYWACYFZBX-HNNXBMFYSA-N 1 0 334.416 3.539 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+]([C@H]3CCc4ccc(F)cc43)CC2)c1 ZINC000482831019 1030740563 /nfs/dbraw/zinc/74/05/63/1030740563.db2.gz ZIHUYHSKVXDOSH-IBGZPJMESA-N 1 0 341.386 3.543 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000527286532 1030770359 /nfs/dbraw/zinc/77/03/59/1030770359.db2.gz NVVPFCRFNIAJMX-XMUSRXTASA-N 1 0 337.423 3.774 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000161887052 1030772426 /nfs/dbraw/zinc/77/24/26/1030772426.db2.gz BGVRUYFXPRPRJQ-AWEZNQCLSA-N 1 0 342.395 3.915 20 5 EHBDRO CCN(CC(=O)Nc1c(C)cccc1C)Cc1cccc([N+](=O)[O-])c1 ZINC000171389523 1030911078 /nfs/dbraw/zinc/91/10/78/1030911078.db2.gz XQCAXADWQGQUAI-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCS2 ZINC000343447319 1030933170 /nfs/dbraw/zinc/93/31/70/1030933170.db2.gz SODSRKOGNGCWHB-KRWDZBQOSA-N 1 0 344.436 3.973 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)NC(C)(C)CC[NH+]1CCCCCC1 ZINC000476783868 1030954841 /nfs/dbraw/zinc/95/48/41/1030954841.db2.gz XVBUKXXGOLCWMC-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC3(CC2)C(F)(F)C3(F)F)cc1 ZINC000593054974 1031171969 /nfs/dbraw/zinc/17/19/69/1031171969.db2.gz OTBZLCPMDBKFEK-UHFFFAOYSA-N 1 0 332.297 3.504 20 5 EHBDRO Cc1cc(NC[C@@H](c2cccs2)[NH+]2CCCC2)ncc1[N+](=O)[O-] ZINC000080585176 1031196924 /nfs/dbraw/zinc/19/69/24/1031196924.db2.gz GQYRYKQAFHGPKC-AWEZNQCLSA-N 1 0 332.429 3.609 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@]1(C)CCCO1 ZINC000340496904 1031295051 /nfs/dbraw/zinc/29/50/51/1031295051.db2.gz HFHRTTWFLCBQSQ-HZMBPMFUSA-N 1 0 332.322 3.661 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H](C)C1CCCCC1 ZINC000483739118 1031312923 /nfs/dbraw/zinc/31/29/23/1031312923.db2.gz CNJNKXBZSYVKRX-ZIAGYGMSSA-N 1 0 333.432 3.870 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc([C@H]3CCCCC34CC[NH2+]CC4)n2)c1 ZINC000904081589 1031714819 /nfs/dbraw/zinc/71/48/19/1031714819.db2.gz NNCXRWGWXIBVMC-OAHLLOKOSA-N 1 0 342.399 3.672 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[C@@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000904092979 1031743810 /nfs/dbraw/zinc/74/38/10/1031743810.db2.gz FVGYLUZJHAMCKA-MAZHCROVSA-N 1 0 342.399 3.937 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000537975068 1032056478 /nfs/dbraw/zinc/05/64/78/1032056478.db2.gz ASCRFJHBVDOMAP-GOSISDBHSA-N 1 0 342.395 3.786 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCCc1nc2ccccc2[nH]1 ZINC000594501984 1033404627 /nfs/dbraw/zinc/40/46/27/1033404627.db2.gz ADYLITDIUSYFGT-HNNXBMFYSA-N 1 0 336.395 3.681 20 5 EHBDRO CC(C)(C)OC(=O)[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594507408 1033409240 /nfs/dbraw/zinc/40/92/40/1033409240.db2.gz MANHOJXYDUTPAJ-DVOMOZLQSA-N 1 0 346.427 3.682 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000594523903 1033431636 /nfs/dbraw/zinc/43/16/36/1033431636.db2.gz VBWDOFNHGVCORW-MRXNPFEDSA-N 1 0 334.416 3.575 20 5 EHBDRO COc1cc(C[NH2+]Cc2cc(C)cc(C)c2)c([N+](=O)[O-])cc1OC ZINC000594973214 1033577676 /nfs/dbraw/zinc/57/76/76/1033577676.db2.gz IXAVPUYCKBPSJP-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3CCC(O)CC3)s2)cc1 ZINC000594990894 1033621015 /nfs/dbraw/zinc/62/10/15/1033621015.db2.gz CGPVESOLNVJAPM-UHFFFAOYSA-N 1 0 346.452 3.964 20 5 EHBDRO CC1(C)OCC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000594995196 1033623584 /nfs/dbraw/zinc/62/35/84/1033623584.db2.gz LGOLLSGDEYYKNP-AWEZNQCLSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057260 1033635331 /nfs/dbraw/zinc/63/53/31/1033635331.db2.gz VYNJIYOEZZSXNR-HIFRSBDPSA-N 1 0 335.448 3.517 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CO[C@@H](C4CC4)C3)o2)c1 ZINC000599006382 1033640110 /nfs/dbraw/zinc/64/01/10/1033640110.db2.gz HTWYBDMZTYYTAF-KBXCAEBGSA-N 1 0 328.368 3.512 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000595066247 1033643647 /nfs/dbraw/zinc/64/36/47/1033643647.db2.gz HBGCPSHQOOIUKG-KBXCAEBGSA-N 1 0 344.411 3.950 20 5 EHBDRO C[C@H](COc1c(F)cccc1F)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000595072438 1033647134 /nfs/dbraw/zinc/64/71/34/1033647134.db2.gz HUDDFAGYAHIWBF-VXGBXAGGSA-N 1 0 336.338 3.991 20 5 EHBDRO COCc1csc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595077155 1033696885 /nfs/dbraw/zinc/69/68/85/1033696885.db2.gz MNAYDGVKHLWFKF-NSHDSACASA-N 1 0 336.413 3.662 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2c(C(F)(F)F)cnn2C)cccc1[N+](=O)[O-] ZINC000599059999 1033698159 /nfs/dbraw/zinc/69/81/59/1033698159.db2.gz KYJLMYWNRIDHLW-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089276 1033699205 /nfs/dbraw/zinc/69/92/05/1033699205.db2.gz NBWMPSDUGGHEPQ-OXJNMPFZSA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000595296303 1033721680 /nfs/dbraw/zinc/72/16/80/1033721680.db2.gz ZRPKGWABZNXCHB-CYBMUJFWSA-N 1 0 335.791 3.752 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599094658 1033731670 /nfs/dbraw/zinc/73/16/70/1033731670.db2.gz XKEPDUOLVVCCGR-SGTLLEGYSA-N 1 0 327.384 3.800 20 5 EHBDRO Cc1ccc(C)n1C1CC[NH+](Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000595309380 1033738314 /nfs/dbraw/zinc/73/83/14/1033738314.db2.gz RWKDUWXXOWWOCI-UHFFFAOYSA-N 1 0 331.391 3.989 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000595324877 1033741463 /nfs/dbraw/zinc/74/14/63/1033741463.db2.gz CIORXQOOXNPBKT-INIZCTEOSA-N 1 0 344.386 3.773 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599163108 1033779217 /nfs/dbraw/zinc/77/92/17/1033779217.db2.gz AZGHGTWRFOMUSR-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCO)[C@@H]1CCCc2ccccc21 ZINC000595375213 1033782918 /nfs/dbraw/zinc/78/29/18/1033782918.db2.gz QHDQMOQFNICCHK-GOSISDBHSA-N 1 0 344.386 3.606 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595414492 1033790905 /nfs/dbraw/zinc/79/09/05/1033790905.db2.gz KQQHEKPPDHSGOR-GJZGRUSLSA-N 1 0 347.459 3.530 20 5 EHBDRO Cc1noc(C[N@@H+]2CCCC[C@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595404027 1033805274 /nfs/dbraw/zinc/80/52/74/1033805274.db2.gz PBIQVVGSMXCURZ-INIZCTEOSA-N 1 0 329.400 3.879 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](c1ccccc1)C1(CO)CCC1 ZINC000595502846 1033833756 /nfs/dbraw/zinc/83/37/56/1033833756.db2.gz WYSJWORVOQCELK-SFHVURJKSA-N 1 0 344.386 3.727 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000593723352 1033851113 /nfs/dbraw/zinc/85/11/13/1033851113.db2.gz XNCMQKFMPIDPRC-QBIMZIAESA-N 1 0 327.384 3.561 20 5 EHBDRO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000089513465 1033870496 /nfs/dbraw/zinc/87/04/96/1033870496.db2.gz FELXEBJYBQEBHP-KRWDZBQOSA-N 1 0 328.368 3.607 20 5 EHBDRO CN1CCC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000608836166 1033908840 /nfs/dbraw/zinc/90/88/40/1033908840.db2.gz UKIYJYJISFNRLJ-CYBMUJFWSA-N 1 0 331.441 3.507 20 5 EHBDRO CCC(C)(C)[C@H](C)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595640015 1033930479 /nfs/dbraw/zinc/93/04/79/1033930479.db2.gz YXYVLARMYYCDKO-JTQLQIEISA-N 1 0 327.812 3.601 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000612049436 1033958700 /nfs/dbraw/zinc/95/87/00/1033958700.db2.gz PNANRNDTLCLMIV-GUYCJALGSA-N 1 0 326.396 3.812 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450252505 1033968228 /nfs/dbraw/zinc/96/82/28/1033968228.db2.gz ITJCSNYQFYCSPF-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000603853711 1033976015 /nfs/dbraw/zinc/97/60/15/1033976015.db2.gz KHPXTNFVBKJDLO-KGLIPLIRSA-N 1 0 328.416 3.818 20 5 EHBDRO COc1ccc(OC2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000603854930 1033978140 /nfs/dbraw/zinc/97/81/40/1033978140.db2.gz RZEQCDVOPJYIDY-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO COc1ccccc1C[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000603857608 1033980621 /nfs/dbraw/zinc/98/06/21/1033980621.db2.gz DFXNUAQGFRHTBC-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNc2cccnc2[N+](=O)[O-])cc1 ZINC000603857855 1033982857 /nfs/dbraw/zinc/98/28/57/1033982857.db2.gz VQJKLBMHDSZLBK-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CCc2ccccc21 ZINC000595881795 1034017830 /nfs/dbraw/zinc/01/78/30/1034017830.db2.gz WSSMANCLKGFVCX-CQSZACIVSA-N 1 0 337.379 3.898 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000596099815 1034061642 /nfs/dbraw/zinc/06/16/42/1034061642.db2.gz XQLOKWPXDWFOIR-RYUDHWBXSA-N 1 0 348.369 3.843 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688045 1034116148 /nfs/dbraw/zinc/11/61/48/1034116148.db2.gz BNGUZGQGSJRJAW-BAABZTOOSA-N 1 0 342.399 3.823 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000596308863 1034164661 /nfs/dbraw/zinc/16/46/61/1034164661.db2.gz XCMITZQLDDEYHO-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](C[C@@H]3CCOC3)C3CC3)o2)cc1 ZINC000129948554 1034232369 /nfs/dbraw/zinc/23/23/69/1034232369.db2.gz MSNIXDCYKRBHOV-AWEZNQCLSA-N 1 0 342.395 3.856 20 5 EHBDRO CC(C)c1ccc(CNCCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000061558274 1034347099 /nfs/dbraw/zinc/34/70/99/1034347099.db2.gz NDKUNOCEONKKRW-UHFFFAOYSA-N 1 0 333.476 3.930 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCOC2)ccc1Oc1ccc(F)cc1 ZINC000604419098 1034371617 /nfs/dbraw/zinc/37/16/17/1034371617.db2.gz GQHPCAYKEXXNID-AWEZNQCLSA-N 1 0 346.358 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484497 1034388675 /nfs/dbraw/zinc/38/86/75/1034388675.db2.gz XRGADLLIOPOVLK-IBGZPJMESA-N 1 0 342.395 3.906 20 5 EHBDRO COc1cc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000060356185 1034423857 /nfs/dbraw/zinc/42/38/57/1034423857.db2.gz HXIWXVAQMKOCGX-UHFFFAOYSA-N 1 0 346.452 4.000 20 5 EHBDRO CCC[N@@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])CC1CCCCC1 ZINC000060495833 1034600757 /nfs/dbraw/zinc/60/07/57/1034600757.db2.gz SAYKZSIPLAQHIB-UHFFFAOYSA-N 1 0 333.432 3.826 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000597225015 1034625579 /nfs/dbraw/zinc/62/55/79/1034625579.db2.gz LOTZPSJAFNQSCE-WSSFADSRSA-N 1 0 330.428 3.889 20 5 EHBDRO COc1ccc(C[NH2+]CC[C@@H]2CCc3ccccc3N2)cc1[N+](=O)[O-] ZINC000593319713 1034657968 /nfs/dbraw/zinc/65/79/68/1034657968.db2.gz WXUIFOGQZKRFSB-INIZCTEOSA-N 1 0 341.411 3.510 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000172170620 1034849086 /nfs/dbraw/zinc/84/90/86/1034849086.db2.gz ZWAXAGOWODDEBL-WDEREUQCSA-N 1 0 339.823 3.744 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3NC2=O)cc1[N+](=O)[O-] ZINC000411480729 1034893715 /nfs/dbraw/zinc/89/37/15/1034893715.db2.gz YKNXFNNPYJALCD-SUMWQHHRSA-N 1 0 339.395 3.507 20 5 EHBDRO Cc1c(F)cccc1NC(=O)CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000411766360 1035013667 /nfs/dbraw/zinc/01/36/67/1035013667.db2.gz BODZRTHIROCZTM-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000310635232 1035037694 /nfs/dbraw/zinc/03/76/94/1035037694.db2.gz BKFBUAMSYJDZAP-CJNGLKHVSA-N 1 0 349.431 3.645 20 5 EHBDRO CC(C)(C)c1ccc([C@@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452593 1035127309 /nfs/dbraw/zinc/12/73/09/1035127309.db2.gz YMMNZCBSAZQKRF-SFHVURJKSA-N 1 0 342.443 3.926 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1=CC[N@H+](C)CC1 ZINC000511367840 1035181924 /nfs/dbraw/zinc/18/19/24/1035181924.db2.gz ADKQOYVNDUFAFY-JTQLQIEISA-N 1 0 329.322 3.676 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000376204400 1035412591 /nfs/dbraw/zinc/41/25/91/1035412591.db2.gz ARXULKUGYQVIFM-AWEZNQCLSA-N 1 0 340.427 3.815 20 5 EHBDRO CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540617674 1035507476 /nfs/dbraw/zinc/50/74/76/1035507476.db2.gz YDMKOOGMWOJDRA-HIFRSBDPSA-N 1 0 332.400 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000571580721 1035542594 /nfs/dbraw/zinc/54/25/94/1035542594.db2.gz ASAJBERRFHDOMN-BEFAXECRSA-N 1 0 337.423 3.698 20 5 EHBDRO CC[NH+](CC)CCCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581671494 1035544443 /nfs/dbraw/zinc/54/44/43/1035544443.db2.gz WPASVWSKZQDSLH-AWEZNQCLSA-N 1 0 333.354 3.520 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CSc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000571761249 1035624384 /nfs/dbraw/zinc/62/43/84/1035624384.db2.gz CNTHVQUVMYBDLJ-WFASDCNBSA-N 1 0 330.409 3.799 20 5 EHBDRO CC(C)(C)Oc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000443422989 1035777677 /nfs/dbraw/zinc/77/76/77/1035777677.db2.gz AIPVKCZTZVDCHD-HUUCEWRRSA-N 1 0 333.432 3.811 20 5 EHBDRO CCOC[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180152573 1035852089 /nfs/dbraw/zinc/85/20/89/1035852089.db2.gz CUJTXZVKEWATMC-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC([NH2+]Cc2ccccc2)CC1 ZINC000595509196 1035890860 /nfs/dbraw/zinc/89/08/60/1035890860.db2.gz DIGWMSLMTALEFT-INIZCTEOSA-N 1 0 339.439 3.910 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000492517687 1035908032 /nfs/dbraw/zinc/90/80/32/1035908032.db2.gz YLZFRYKVOXQTSA-ZDUSSCGKSA-N 1 0 330.384 3.892 20 5 EHBDRO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)C2 ZINC000540910795 1035941681 /nfs/dbraw/zinc/94/16/81/1035941681.db2.gz NRTWEMOYZBLOFH-UHFFFAOYSA-N 1 0 342.395 3.560 20 5 EHBDRO C[C@@H](O)CN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070158 1035952617 /nfs/dbraw/zinc/95/26/17/1035952617.db2.gz DYXAJRILWJMBMK-CYBMUJFWSA-N 1 0 334.803 3.631 20 5 EHBDRO C[C@H](O)CN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541070171 1035952809 /nfs/dbraw/zinc/95/28/09/1035952809.db2.gz DYXAJRILWJMBMK-ZDUSSCGKSA-N 1 0 334.803 3.631 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000582577704 1035990131 /nfs/dbraw/zinc/99/01/31/1035990131.db2.gz WMUWAKFQLPQYBY-HFTRVMKXSA-N 1 0 334.460 3.693 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccc(OC)c(F)c2)ccc1[N+](=O)[O-] ZINC000492579535 1036025040 /nfs/dbraw/zinc/02/50/40/1036025040.db2.gz AJOATYUKEOGBER-LBPRGKRZSA-N 1 0 348.374 3.992 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2cccc(OC)c2)ccc1[N+](=O)[O-] ZINC000492609647 1036044182 /nfs/dbraw/zinc/04/41/82/1036044182.db2.gz UNFHBNMFCXDIJP-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO COCC[C@H](C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000414213304 1036091897 /nfs/dbraw/zinc/09/18/97/1036091897.db2.gz XXFWZPAZKPUZFZ-KXBFYZLASA-N 1 0 328.412 3.946 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056197230 1036139239 /nfs/dbraw/zinc/13/92/39/1036139239.db2.gz AXLNYAHKWDMCJO-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000535265765 1036260716 /nfs/dbraw/zinc/26/07/16/1036260716.db2.gz MNYRACFVDWVAGF-QGZVFWFLSA-N 1 0 334.379 3.742 20 5 EHBDRO CC[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000414268864 1036375883 /nfs/dbraw/zinc/37/58/83/1036375883.db2.gz UBUPDGFOCWQVDP-XQQFMLRXSA-N 1 0 348.369 3.843 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541545025 1036422939 /nfs/dbraw/zinc/42/29/39/1036422939.db2.gz HIBLNSCQMPDPIF-RTBURBONSA-N 1 0 346.427 3.980 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000541566578 1036442228 /nfs/dbraw/zinc/44/22/28/1036442228.db2.gz PTSCUFHSINONSD-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO CC1(C)CCC[N@@H+]1CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572652668 1036447882 /nfs/dbraw/zinc/44/78/82/1036447882.db2.gz ZLRXOYDDGHDSML-AWEZNQCLSA-N 1 0 345.365 3.662 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@](O)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000589950085 1036677728 /nfs/dbraw/zinc/67/77/28/1036677728.db2.gz UBEDLIUIXYWYDC-VHDGCEQUSA-N 1 0 346.349 3.872 20 5 EHBDRO CCC[C@H]([NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459811946 1036717180 /nfs/dbraw/zinc/71/71/80/1036717180.db2.gz VJUHDPQPHROLQO-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135535 1036783727 /nfs/dbraw/zinc/78/37/27/1036783727.db2.gz OASBPCYQDKYZBE-NWDGAFQWSA-N 1 0 343.349 3.961 20 5 EHBDRO COc1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2F)ccc1Cl ZINC000590196467 1036793889 /nfs/dbraw/zinc/79/38/89/1036793889.db2.gz BNJNKOFBVSARRY-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO COC[C@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590175602 1036800785 /nfs/dbraw/zinc/80/07/85/1036800785.db2.gz WVNIMZSIBHPFMF-LBPRGKRZSA-N 1 0 346.349 3.862 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000539493332 1036817988 /nfs/dbraw/zinc/81/79/88/1036817988.db2.gz MCHMWSLFTQZNPD-ZDUSSCGKSA-N 1 0 327.812 3.601 20 5 EHBDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000414347653 1036859080 /nfs/dbraw/zinc/85/90/80/1036859080.db2.gz WTWOMIHVINSWSM-FNHZYXHNSA-N 1 0 340.423 3.928 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000542049074 1037025882 /nfs/dbraw/zinc/02/58/82/1037025882.db2.gz QBNUFHDVKNYMBN-YXJHDRRASA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524440 1037092837 /nfs/dbraw/zinc/09/28/37/1037092837.db2.gz CZEUSYNOJDTJTF-LRDDRELGSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccccc1F ZINC000761526609 1037102036 /nfs/dbraw/zinc/10/20/36/1037102036.db2.gz PCCWADCHRHTIQH-LLVKDONJSA-N 1 0 338.766 3.944 20 5 EHBDRO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cc(F)c(F)c(F)c1 ZINC000539729944 1037130582 /nfs/dbraw/zinc/13/05/82/1037130582.db2.gz YZTUOJVQVBVZGZ-UHFFFAOYSA-N 1 0 340.301 3.523 20 5 EHBDRO Cc1ccc(-c2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206330 1037136916 /nfs/dbraw/zinc/13/69/16/1037136916.db2.gz WFRXGZGNSDPHSO-UPJWGTAASA-N 1 0 330.388 3.887 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308450 1037242531 /nfs/dbraw/zinc/24/25/31/1037242531.db2.gz YPFXHIWGHXBHSG-RBUKOAKNSA-N 1 0 328.412 3.945 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]4COCC[C@H]43)o2)cc1 ZINC000539891304 1037313410 /nfs/dbraw/zinc/31/34/10/1037313410.db2.gz RUDYXGBYVIUFIZ-MAUKXSAKSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CC[NH2+]C4(CCC4)C3)o2)c1 ZINC000591282633 1037320204 /nfs/dbraw/zinc/32/02/04/1037320204.db2.gz IMLVUKFKPLEQSQ-HNNXBMFYSA-N 1 0 341.411 3.619 20 5 EHBDRO CC[N@H+](CCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177012126 1037323325 /nfs/dbraw/zinc/32/33/25/1037323325.db2.gz NFEGWQLDCDYXDT-UHFFFAOYSA-N 1 0 325.368 3.801 20 5 EHBDRO C[N@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C1CCCC1 ZINC000591321022 1037341034 /nfs/dbraw/zinc/34/10/34/1037341034.db2.gz NQBBOSWKMXOHRU-UHFFFAOYSA-N 1 0 347.462 3.992 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2OC(F)(F)F)cc1 ZINC000058093281 1037476349 /nfs/dbraw/zinc/47/63/49/1037476349.db2.gz JAXKNZUWXLCWQN-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC(C)(C)C1 ZINC000412032929 1037485551 /nfs/dbraw/zinc/48/55/51/1037485551.db2.gz HRCFTMLPCWNPTC-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCOC1 ZINC000462868928 1037492768 /nfs/dbraw/zinc/49/27/68/1037492768.db2.gz TXBVBJIMKLOOOK-INIZCTEOSA-N 1 0 330.384 3.854 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC(OCC2CCCC2)CC1 ZINC000177500869 1037558068 /nfs/dbraw/zinc/55/80/68/1037558068.db2.gz OIPKMUAYWLGEBL-UHFFFAOYSA-N 1 0 336.407 3.905 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000546899178 1037573382 /nfs/dbraw/zinc/57/33/82/1037573382.db2.gz WQFSYHDVYMIUOP-OAHLLOKOSA-N 1 0 349.822 3.533 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)C1CC1 ZINC000540159600 1037617545 /nfs/dbraw/zinc/61/75/45/1037617545.db2.gz ALEURVDILDGAKT-XKGZKEIXSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCCOc3ccc(F)cc32)cc1 ZINC000540170177 1037639206 /nfs/dbraw/zinc/63/92/06/1037639206.db2.gz ZHAWBIZKYDYEAE-QGZVFWFLSA-N 1 0 346.358 3.616 20 5 EHBDRO C[C@H]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000463070371 1037732800 /nfs/dbraw/zinc/73/28/00/1037732800.db2.gz NMCWHAFFEAAEDL-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO CC(C)[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000026266640 1037811562 /nfs/dbraw/zinc/81/15/62/1037811562.db2.gz KRDBVXKSZIIVHX-LJQANCHMSA-N 1 0 341.411 3.910 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410481 1037907513 /nfs/dbraw/zinc/90/75/13/1037907513.db2.gz ZNLCJWYWDFNHES-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCS[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000592379936 1037952246 /nfs/dbraw/zinc/95/22/46/1037952246.db2.gz BFIWMJJAQVIIJE-ABAIWWIYSA-N 1 0 348.424 3.847 20 5 EHBDRO COCCOc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000897469471 1038088516 /nfs/dbraw/zinc/08/85/16/1038088516.db2.gz KSBWMJVJAXRXGE-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO Cc1cc(N(C)CC2CC[NH+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461776374 1038604546 /nfs/dbraw/zinc/60/45/46/1038604546.db2.gz CKGUTOQGVNBVIO-UHFFFAOYSA-N 1 0 345.365 3.700 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([NH+](C)C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461950145 1038690753 /nfs/dbraw/zinc/69/07/53/1038690753.db2.gz STKDTVONFCVPJX-GFCCVEGCSA-N 1 0 345.365 3.843 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893255215 1038738157 /nfs/dbraw/zinc/73/81/57/1038738157.db2.gz HHUKGPZNYMDYDI-UKRRQHHQSA-N 1 0 326.824 3.932 20 5 EHBDRO CC[C@@]1(CO)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000190227474 1038908796 /nfs/dbraw/zinc/90/87/96/1038908796.db2.gz MMXTWSWIUDZRAO-LJQANCHMSA-N 1 0 344.411 3.839 20 5 EHBDRO C[N@@H+](Cc1ccccc1)CC1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000033997516 1039315166 /nfs/dbraw/zinc/31/51/66/1039315166.db2.gz DZLNWIAGDHXJDX-UHFFFAOYSA-N 1 0 339.439 3.943 20 5 EHBDRO C[C@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cccnc1 ZINC000181622102 1039427469 /nfs/dbraw/zinc/42/74/69/1039427469.db2.gz AUVSFJJCXNNPLS-ZDUSSCGKSA-N 1 0 338.367 3.538 20 5 EHBDRO C[C@@H]1C[C@@H](CCNc2ncccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000511603748 1039429963 /nfs/dbraw/zinc/42/99/63/1039429963.db2.gz MDGPRTLCQXQBDV-NVXWUHKLSA-N 1 0 340.427 3.702 20 5 EHBDRO COC1(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC000480307082 1039432785 /nfs/dbraw/zinc/43/27/85/1039432785.db2.gz MGSQZPNYSBVPFA-UHFFFAOYSA-N 1 0 326.824 3.730 20 5 EHBDRO CCC(O)(CC)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236858069 1039475050 /nfs/dbraw/zinc/47/50/50/1039475050.db2.gz LWNIWGAENLAMKM-UHFFFAOYSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCN([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494829 1039484060 /nfs/dbraw/zinc/48/40/60/1039484060.db2.gz BEICKWFBVRKEGU-LPHOPBHVSA-N 1 0 339.439 3.828 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974700 1039520694 /nfs/dbraw/zinc/52/06/94/1039520694.db2.gz IVNBWIURMNDNRF-CZUORRHYSA-N 1 0 345.374 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccc3c1OCO3)CCCC2 ZINC000417309120 1039664019 /nfs/dbraw/zinc/66/40/19/1039664019.db2.gz DOAKULWQQKWNRD-KRWDZBQOSA-N 1 0 340.379 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC([NH+]3CCCCC3)C1)CCCC2 ZINC000417328096 1039674864 /nfs/dbraw/zinc/67/48/64/1039674864.db2.gz HYHZWDWLIICTKV-NLPFYKDJSA-N 1 0 343.471 3.969 20 5 EHBDRO C[NH+](C)CCc1ccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000110281709 1039972250 /nfs/dbraw/zinc/97/22/50/1039972250.db2.gz NJGWIUZMRWGQGH-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(c2ccc(Cl)cc2)CC1 ZINC000553333063 1039981258 /nfs/dbraw/zinc/98/12/58/1039981258.db2.gz BLNXDEIKLIBXOV-UHFFFAOYSA-N 1 0 332.787 3.906 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCCCC3)C2)c(OC(F)F)c1 ZINC000480821188 1040064260 /nfs/dbraw/zinc/06/42/60/1040064260.db2.gz HFLYWJJDWWKWQA-UHFFFAOYSA-N 1 0 341.358 3.625 20 5 EHBDRO CCOc1cc(NC[C@H](c2cccc(F)c2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000486449160 1040145934 /nfs/dbraw/zinc/14/59/34/1040145934.db2.gz IMBXQKSVBHFBAK-QGZVFWFLSA-N 1 0 347.390 3.847 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[NH+]2CCCC2)cc1C(F)(F)F ZINC000489887828 1040222592 /nfs/dbraw/zinc/22/25/92/1040222592.db2.gz OMNCWJMHDXEYJR-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555170020 1040251578 /nfs/dbraw/zinc/25/15/78/1040251578.db2.gz PVXZWQAVDIMKHL-NEPJUHHUSA-N 1 0 343.349 3.595 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000490013329 1040308412 /nfs/dbraw/zinc/30/84/12/1040308412.db2.gz LTXJJGGAWCTLAJ-INIZCTEOSA-N 1 0 331.460 3.915 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000490092147 1040352833 /nfs/dbraw/zinc/35/28/33/1040352833.db2.gz YVCISCVTMHAOBR-ZTFGCOKTSA-N 1 0 348.443 3.629 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069279 1040430278 /nfs/dbraw/zinc/43/02/78/1040430278.db2.gz GNHRALPPEIRXMF-HOCLYGCPSA-N 1 0 333.432 3.824 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000490309109 1040491160 /nfs/dbraw/zinc/49/11/60/1040491160.db2.gz SMQHYRDCWDFNQD-TWMKSMIVSA-N 1 0 331.460 3.993 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@@H](C)C[NH+]1CCCCCC1 ZINC000479794407 1040610463 /nfs/dbraw/zinc/61/04/63/1040610463.db2.gz GIEIWWBUBJBUOE-HNNXBMFYSA-N 1 0 347.459 3.514 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000555563089 1040837070 /nfs/dbraw/zinc/83/70/70/1040837070.db2.gz SSQTXFLWVNKWBK-RDJZCZTQSA-N 1 0 348.443 3.629 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735775 1040885415 /nfs/dbraw/zinc/88/54/15/1040885415.db2.gz SHPRGLJINCGHBX-AWEZNQCLSA-N 1 0 330.388 3.799 20 5 EHBDRO C[C@H](CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150155 1040927353 /nfs/dbraw/zinc/92/73/53/1040927353.db2.gz VRRFTATWRBMZSS-RDTXWAMCSA-N 1 0 331.460 3.639 20 5 EHBDRO O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1csc([N+](=O)[O-])c1 ZINC000044506218 1040942832 /nfs/dbraw/zinc/94/28/32/1040942832.db2.gz RRXTXEXFNKCNKQ-UHFFFAOYSA-N 1 0 345.424 3.895 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000027906052 1041021614 /nfs/dbraw/zinc/02/16/14/1041021614.db2.gz AXGHYNYUSQEZOY-QGZVFWFLSA-N 1 0 339.395 3.543 20 5 EHBDRO COc1ccc(OCCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000481531285 1041041206 /nfs/dbraw/zinc/04/12/06/1041041206.db2.gz GAQKONCSEFHOSI-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000052039917 1041147954 /nfs/dbraw/zinc/14/79/54/1041147954.db2.gz DCKUTPIVTDPRQP-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000481720079 1041282955 /nfs/dbraw/zinc/28/29/55/1041282955.db2.gz SIHCGSRDQXVBRZ-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO C[NH+](C)CCc1ccc(CNc2c(Cl)cccc2[N+](=O)[O-])cc1 ZINC000432155869 1041663506 /nfs/dbraw/zinc/66/35/06/1041663506.db2.gz HAQLNDJQVWVQPJ-UHFFFAOYSA-N 1 0 333.819 3.964 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H](C(=O)NC(C)C)C1 ZINC000124774343 1041735774 /nfs/dbraw/zinc/73/57/74/1041735774.db2.gz QKLBSMLQPMEVSY-HRCADAONSA-N 1 0 347.459 3.637 20 5 EHBDRO CC[C@H]([NH2+]C[C@](C)(O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181794853 1042211908 /nfs/dbraw/zinc/21/19/08/1042211908.db2.gz UZBDFNIUTCSXNF-ROUUACIJSA-N 1 0 332.375 3.682 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1C[C@@H](C)CC[C@H]1C(C)C ZINC000541614930 1042220793 /nfs/dbraw/zinc/22/07/93/1042220793.db2.gz VYBCEWCALQCCKE-CWRNSKLLSA-N 1 0 347.459 3.892 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593194 1042375962 /nfs/dbraw/zinc/37/59/62/1042375962.db2.gz PTUAHWYBLSWISY-MRXNPFEDSA-N 1 0 326.396 3.901 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1cccc([N+](=O)[O-])c1 ZINC000343887274 1042462492 /nfs/dbraw/zinc/46/24/92/1042462492.db2.gz JHVXIWIIWCOONP-GFCCVEGCSA-N 1 0 340.408 3.964 20 5 EHBDRO COc1cc(F)c(CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000568033617 1042620747 /nfs/dbraw/zinc/62/07/47/1042620747.db2.gz TVQDPLQAYSIADI-UHFFFAOYSA-N 1 0 348.374 3.776 20 5 EHBDRO COc1ccccc1OCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343933825 1042874853 /nfs/dbraw/zinc/87/48/53/1042874853.db2.gz RSUCTYKMRMQVOQ-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CC1(C)[C@@H](C(F)(F)F)CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000330945803 1042911454 /nfs/dbraw/zinc/91/14/54/1042911454.db2.gz ABSGBCMDOZGHTE-ZDUSSCGKSA-N 1 0 332.322 3.636 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)C2CC[NH+](C3CC3)CC2)cc1[N+](=O)[O-] ZINC000585753342 1043022509 /nfs/dbraw/zinc/02/25/09/1043022509.db2.gz JRFBTCOSRRZSTR-UHFFFAOYSA-N 1 0 345.443 3.705 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC2CC(O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000432416582 1043134878 /nfs/dbraw/zinc/13/48/78/1043134878.db2.gz HGGHHDDKPVFKRJ-NSRCDFIJSA-N 1 0 344.411 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H](c3ncc[nH]3)C2)nc1-c1ccccc1 ZINC000090090084 1043374941 /nfs/dbraw/zinc/37/49/41/1043374941.db2.gz DUUVGTTULUEXPY-OAHLLOKOSA-N 1 0 349.394 3.764 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210858 1044163621 /nfs/dbraw/zinc/16/36/21/1044163621.db2.gz FWIQXLHOROAZRZ-IRXDYDNUSA-N 1 0 331.460 3.681 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000512212894 1044174538 /nfs/dbraw/zinc/17/45/38/1044174538.db2.gz MFSWSWYNDNOWLH-LJQANCHMSA-N 1 0 343.427 3.664 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H]1CC(C)C ZINC000500465834 1044878702 /nfs/dbraw/zinc/87/87/02/1044878702.db2.gz KHZCEINGVSCTNK-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H](c1ccco1)N1CCCCC1 ZINC000183422375 1125556007 /nfs/dbraw/zinc/55/60/07/1125556007.db2.gz LEBHYGKXXSRZLY-SFHVURJKSA-N 1 0 343.427 3.813 20 5 EHBDRO Cc1ccc(C[C@@H](CO)[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1C ZINC001308427192 1126165811 /nfs/dbraw/zinc/16/58/11/1126165811.db2.gz UFNNKNOMKDUZCL-SFHVURJKSA-N 1 0 342.439 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491632 1127499043 /nfs/dbraw/zinc/49/90/43/1127499043.db2.gz DLYJTQIFZXOEDH-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000765335159 1127599507 /nfs/dbraw/zinc/59/95/07/1127599507.db2.gz RFXOLMYAGWNUEQ-GJZGRUSLSA-N 1 0 326.396 3.805 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765352304 1127603053 /nfs/dbraw/zinc/60/30/53/1127603053.db2.gz XASVRHPYSWHUJF-GJZGRUSLSA-N 1 0 331.460 3.978 20 5 EHBDRO CN(C[C@H]1CCC[N@H+](C)C1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172235133 1127838508 /nfs/dbraw/zinc/83/85/08/1127838508.db2.gz IXOOHLQXTCJBRD-INIZCTEOSA-N 1 0 347.462 3.802 20 5 EHBDRO CCc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+](C)C)cc1 ZINC000301428296 1127872659 /nfs/dbraw/zinc/87/26/59/1127872659.db2.gz MXLNTXZEIASYSP-QGZVFWFLSA-N 1 0 328.416 3.575 20 5 EHBDRO Cc1cnc(Nc2cccc(C[NH+]3CCSCC3)c2)c([N+](=O)[O-])c1 ZINC000301443716 1127932501 /nfs/dbraw/zinc/93/25/01/1127932501.db2.gz NKUZKUJEOQKOKQ-UHFFFAOYSA-N 1 0 344.440 3.591 20 5 EHBDRO C[C@@H](CC(N)=O)[NH2+]Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000765788396 1128367305 /nfs/dbraw/zinc/36/73/05/1128367305.db2.gz FZFUBGYFWDXEPP-LBPRGKRZSA-N 1 0 326.827 4.000 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])c1nccs1 ZINC000273134352 1128444183 /nfs/dbraw/zinc/44/41/83/1128444183.db2.gz UISXJBQKVMEFIA-SNVBAGLBSA-N 1 0 325.821 3.940 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063151 1128438684 /nfs/dbraw/zinc/43/86/84/1128438684.db2.gz MVAURWNQFASBPI-DOMZBBRYSA-N 1 0 326.824 3.932 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301469259 1128456887 /nfs/dbraw/zinc/45/68/87/1128456887.db2.gz NRKNIRRFINOMAE-LBPRGKRZSA-N 1 0 331.338 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000215110682 1128485179 /nfs/dbraw/zinc/48/51/79/1128485179.db2.gz HJAIQUJJIJAVHU-UHFFFAOYSA-N 1 0 326.396 3.681 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000301554965 1128496526 /nfs/dbraw/zinc/49/65/26/1128496526.db2.gz ICXPBAWNVXSAHO-MWLCHTKSSA-N 1 0 329.322 3.651 20 5 EHBDRO COc1cc(N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609978 1128517234 /nfs/dbraw/zinc/51/72/34/1128517234.db2.gz BUCFYTUYAXOSQV-RHSMWYFYSA-N 1 0 341.411 3.678 20 5 EHBDRO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301602408 1128519732 /nfs/dbraw/zinc/51/97/32/1128519732.db2.gz WHTMXMGDPLJALI-RDJZCZTQSA-N 1 0 340.427 3.621 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(CSC)cc1 ZINC000921688519 1128524877 /nfs/dbraw/zinc/52/48/77/1128524877.db2.gz ZHFDGFTWNGGOBG-UHFFFAOYSA-N 1 0 332.425 3.756 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000273790050 1128667544 /nfs/dbraw/zinc/66/75/44/1128667544.db2.gz YLOYFHMQAKAWQL-LBPRGKRZSA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)n1 ZINC000542864956 1128711796 /nfs/dbraw/zinc/71/17/96/1128711796.db2.gz PNEKATWFCSQPKE-KRWDZBQOSA-N 1 0 346.475 3.699 20 5 EHBDRO CC(C)[C@H](C)NC(=O)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153853491 1128774392 /nfs/dbraw/zinc/77/43/92/1128774392.db2.gz DJCQNAAYWWBYHM-GJZGRUSLSA-N 1 0 347.459 3.529 20 5 EHBDRO Cc1nc(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301633302 1128778727 /nfs/dbraw/zinc/77/87/27/1128778727.db2.gz DHDBCYHDJKPFOH-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO CCc1ccc([C@@H](CNc2ccc([N+](=O)[O-])c(C)n2)[NH+](C)C)cc1 ZINC000301646007 1128814522 /nfs/dbraw/zinc/81/45/22/1128814522.db2.gz NSFJNXDCCYBSGM-QGZVFWFLSA-N 1 0 328.416 3.575 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000494760628 1120780276 /nfs/dbraw/zinc/78/02/76/1120780276.db2.gz PHNVCYLLPNVSOB-MRXNPFEDSA-N 1 0 346.814 3.774 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000495045875 1120940096 /nfs/dbraw/zinc/94/00/96/1120940096.db2.gz MPAOHLUTQJDKSN-KSSFIOAISA-N 1 0 344.386 3.991 20 5 EHBDRO CC(C)[N@@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCC1 ZINC000193202303 1120975297 /nfs/dbraw/zinc/97/52/97/1120975297.db2.gz VDESHMOBECWEDV-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCC1 ZINC000193216784 1120985501 /nfs/dbraw/zinc/98/55/01/1120985501.db2.gz AMXCVJNZMWWTIS-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000301060973 1121278858 /nfs/dbraw/zinc/27/88/58/1121278858.db2.gz BVHLKKKBKOHLER-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301087857 1121533611 /nfs/dbraw/zinc/53/36/11/1121533611.db2.gz KEYUIKSVPRIXEO-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO COC1(C)CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000272356963 1121552798 /nfs/dbraw/zinc/55/27/98/1121552798.db2.gz MGGGXQOUEFWVGJ-UHFFFAOYSA-N 1 0 330.384 3.856 20 5 EHBDRO C[NH+]1CCC(CCNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301092848 1121584316 /nfs/dbraw/zinc/58/43/16/1121584316.db2.gz FXWRFNCYFXVZFM-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380199 1121596662 /nfs/dbraw/zinc/59/66/62/1121596662.db2.gz BRNLJXUGSOIIOA-APWZRJJASA-N 1 0 339.439 3.595 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000301095849 1121596787 /nfs/dbraw/zinc/59/67/87/1121596787.db2.gz MRLGVMWOPPJPQR-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000301737761 1129012979 /nfs/dbraw/zinc/01/29/79/1129012979.db2.gz IPRLWUZLOQZDCD-HNNXBMFYSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCCO2 ZINC000194414882 1121883797 /nfs/dbraw/zinc/88/37/97/1121883797.db2.gz ZITOHYFXVVOPPC-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000496676990 1122152830 /nfs/dbraw/zinc/15/28/30/1122152830.db2.gz FIXJDTTWGGCZDR-MRXNPFEDSA-N 1 0 341.367 3.550 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301156647 1122184610 /nfs/dbraw/zinc/18/46/10/1122184610.db2.gz AMKHQXMTYIOXEX-INIZCTEOSA-N 1 0 343.402 3.710 20 5 EHBDRO Cc1ccc([C@H](CNc2cccc(F)c2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000301164348 1122208123 /nfs/dbraw/zinc/20/81/23/1122208123.db2.gz UXXLEXVUUCABAQ-HNNXBMFYSA-N 1 0 333.363 3.884 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2F)[NH+]2CCCC2)o1 ZINC000301165184 1122218864 /nfs/dbraw/zinc/21/88/64/1122218864.db2.gz VFFQADDTUXOYET-MRXNPFEDSA-N 1 0 333.363 3.884 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000125824526 1122345565 /nfs/dbraw/zinc/34/55/65/1122345565.db2.gz STPKWTUTKSXRTQ-HIFRSBDPSA-N 1 0 345.365 3.662 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCC[C@H]1O ZINC000497144530 1122351339 /nfs/dbraw/zinc/35/13/39/1122351339.db2.gz KMWNSQBAZLRDGV-CRAIPNDOSA-N 1 0 344.411 3.838 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CC)C(C)(C)O ZINC000556237695 1122890344 /nfs/dbraw/zinc/89/03/44/1122890344.db2.gz FCZXZOPBBZTCDO-IUODEOHRSA-N 1 0 326.462 3.605 20 5 EHBDRO Cc1nc2c(o1)CCC[C@H]2[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000925463872 1123031974 /nfs/dbraw/zinc/03/19/74/1123031974.db2.gz BBJHFMUQSMJAMX-MRXNPFEDSA-N 1 0 329.400 3.881 20 5 EHBDRO CCC[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)[C@H]1CCc2ccccc2C1 ZINC000919951298 1123243717 /nfs/dbraw/zinc/24/37/17/1123243717.db2.gz QNXXOHVUDFGCKE-SFHVURJKSA-N 1 0 342.443 3.635 20 5 EHBDRO CC(C)[N@@H+](Cc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000919953917 1123244606 /nfs/dbraw/zinc/24/46/06/1123244606.db2.gz FHAZOFQQENAIFJ-UHFFFAOYSA-N 1 0 330.413 3.874 20 5 EHBDRO Cc1cc(F)ccc1[C@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744584 1123554246 /nfs/dbraw/zinc/55/42/46/1123554246.db2.gz LAXLRXJCQCVPFF-LJQANCHMSA-N 1 0 344.386 3.740 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000609705031 1123647546 /nfs/dbraw/zinc/64/75/46/1123647546.db2.gz IGENVMHWRZNIMV-UHFFFAOYSA-N 1 0 332.787 3.555 20 5 EHBDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090809969 1123793015 /nfs/dbraw/zinc/79/30/15/1123793015.db2.gz AULIWBRBFQQTJP-WMZOPIPTSA-N 1 0 334.460 3.549 20 5 EHBDRO CC[C@]1([NH2+]Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CCOC1 ZINC000616487693 1124011625 /nfs/dbraw/zinc/01/16/25/1124011625.db2.gz CISCFLLVXZDXOL-SFHVURJKSA-N 1 0 346.383 3.522 20 5 EHBDRO COc1c([N+](=O)[O-])cc(Cl)c(C)c1NCC(C)(C)C[NH+](C)C ZINC001168769442 1131275409 /nfs/dbraw/zinc/27/54/09/1131275409.db2.gz SSVGUFLVZGLVQB-UHFFFAOYSA-N 1 0 329.828 3.565 20 5 EHBDRO Cc1cc(C)cc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181809850 1125046292 /nfs/dbraw/zinc/04/62/92/1125046292.db2.gz IFSXQSWOUNQXCX-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000181819688 1125047567 /nfs/dbraw/zinc/04/75/67/1125047567.db2.gz MYKKHCNIBBRRPM-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000181829530 1125053732 /nfs/dbraw/zinc/05/37/32/1125053732.db2.gz SXKJYJHOHCGJMW-UHFFFAOYSA-N 1 0 334.464 3.637 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000182990645 1125417269 /nfs/dbraw/zinc/41/72/69/1125417269.db2.gz MTLLQKAZOCYHHM-GFCCVEGCSA-N 1 0 347.440 3.953 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301847939 1129192183 /nfs/dbraw/zinc/19/21/83/1129192183.db2.gz CCNFQOCURIIEQA-INIZCTEOSA-N 1 0 340.427 3.577 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938965 1129394415 /nfs/dbraw/zinc/39/44/15/1129394415.db2.gz XQZDCIBXUHPQOP-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@H]2CCCc3ccccc32)cc1 ZINC000531163522 1129404917 /nfs/dbraw/zinc/40/49/17/1129404917.db2.gz DNBWVWUVSBXZFN-FQEVSTJZSA-N 1 0 340.423 3.857 20 5 EHBDRO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383680 1129504569 /nfs/dbraw/zinc/50/45/69/1129504569.db2.gz CLSQHRJCGPYMRK-QWHCGFSZSA-N 1 0 326.824 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccc(F)cc3)CC2)cc1 ZINC000091869537 1129526072 /nfs/dbraw/zinc/52/60/72/1129526072.db2.gz YUMJVSLTIMNAIK-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO CC(C)[C@H](O)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000123825872 1129556169 /nfs/dbraw/zinc/55/61/69/1129556169.db2.gz CVFONNKHCCEONE-SWLSCSKDSA-N 1 0 334.441 3.991 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000922538808 1129565802 /nfs/dbraw/zinc/56/58/02/1129565802.db2.gz WKMYQYYEKMNKGT-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CN(C/C=C/c1ccccc1[N+](=O)[O-])Cc1nc2ccccc2n1C ZINC000093363906 1129585725 /nfs/dbraw/zinc/58/57/25/1129585725.db2.gz ZOPXKWIPWQJTHK-VQHVLOKHSA-N 1 0 336.395 3.627 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)cccc1[N+](=O)[O-] ZINC000155070381 1129609928 /nfs/dbraw/zinc/60/99/28/1129609928.db2.gz CESJTZRVXGBWEH-BBRMVZONSA-N 1 0 333.457 3.918 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)c1ccc(CC)c([N+](=O)[O-])c1 ZINC000124583177 1129617959 /nfs/dbraw/zinc/61/79/59/1129617959.db2.gz ZIFFAVDYQYTWMQ-UHFFFAOYSA-N 1 0 327.384 3.519 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214939 1129619626 /nfs/dbraw/zinc/61/96/26/1129619626.db2.gz HVUKIXAKCTWXNN-INIZCTEOSA-N 1 0 342.395 3.602 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ncc([N+](=O)[O-])s1 ZINC000390940180 1129643147 /nfs/dbraw/zinc/64/31/47/1129643147.db2.gz PETXPJUQODYMFF-CQSZACIVSA-N 1 0 346.456 3.764 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C(=O)N(C)C(C)C)CC1 ZINC000330738182 1129644203 /nfs/dbraw/zinc/64/42/03/1129644203.db2.gz ZBKKHNNNDSBRBC-OAHLLOKOSA-N 1 0 347.459 3.543 20 5 EHBDRO C[C@H]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000391136519 1129651540 /nfs/dbraw/zinc/65/15/40/1129651540.db2.gz PXTXYPPTFQLPDO-JTQLQIEISA-N 1 0 334.759 3.828 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CCC3(CCOCC3)O2)cc1[N+](=O)[O-] ZINC000922814103 1129676153 /nfs/dbraw/zinc/67/61/53/1129676153.db2.gz QJNMYCCSZUUJGE-INIZCTEOSA-N 1 0 348.443 3.536 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000391839310 1129687581 /nfs/dbraw/zinc/68/75/81/1129687581.db2.gz LSXIRMWTRAIZTQ-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO Cc1cc(NC[C@@](C)(O)c2ccsc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302165687 1129771340 /nfs/dbraw/zinc/77/13/40/1129771340.db2.gz KTIXXCOINYODNA-QGZVFWFLSA-N 1 0 343.408 3.833 20 5 EHBDRO COc1ccccc1[C@H](CNc1cccc(C)c1[N+](=O)[O-])[NH+](C)C ZINC000302480137 1129779464 /nfs/dbraw/zinc/77/94/64/1129779464.db2.gz GJQUNOHJAJSVBT-INIZCTEOSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]3C3CCCC3)n2)cc1 ZINC000055927280 1129790479 /nfs/dbraw/zinc/79/04/79/1129790479.db2.gz ZTKOZVOKWGNXQT-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196573 1129806345 /nfs/dbraw/zinc/80/63/45/1129806345.db2.gz TUFCMTDDOWAITG-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2 ZINC000132100591 1129875615 /nfs/dbraw/zinc/87/56/15/1129875615.db2.gz XVXCKEPGDHDXSJ-QWHCGFSZSA-N 1 0 342.395 3.778 20 5 EHBDRO C[C@@H](NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000601929807 1129887136 /nfs/dbraw/zinc/88/71/36/1129887136.db2.gz BYSRBXHYQHLBJS-RBSFLKMASA-N 1 0 341.411 3.511 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000076664336 1129976445 /nfs/dbraw/zinc/97/64/45/1129976445.db2.gz GKKKFEJBJZPRBH-OAHLLOKOSA-N 1 0 330.388 3.530 20 5 EHBDRO CC(C)([NH2+]CCC(=O)Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000429227610 1130068719 /nfs/dbraw/zinc/06/87/19/1130068719.db2.gz PLUSNHQETZOSKY-UHFFFAOYSA-N 1 0 345.374 3.587 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)CNC(=O)c1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000171927351 1130097825 /nfs/dbraw/zinc/09/78/25/1130097825.db2.gz XVTLFTXGNJLRDX-GFCCVEGCSA-N 1 0 347.440 3.516 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173349663 1130213885 /nfs/dbraw/zinc/21/38/85/1130213885.db2.gz OVBJWZXNLIPIMY-HUUCEWRRSA-N 1 0 343.402 3.911 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)cc1[N+](=O)[O-] ZINC000245508317 1130224141 /nfs/dbraw/zinc/22/41/41/1130224141.db2.gz RSEYKXYFKWIAKM-MKVSYHDVSA-N 1 0 334.416 3.602 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000245870559 1130325143 /nfs/dbraw/zinc/32/51/43/1130325143.db2.gz LADHCOQOQBCUBU-GGBBIFEXSA-N 1 0 346.427 3.602 20 5 EHBDRO CC(C)n1cnnc1[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191464 1130353880 /nfs/dbraw/zinc/35/38/80/1130353880.db2.gz UBSOWEIZGBFNTQ-GDBMZVCRSA-N 1 0 343.431 3.708 20 5 EHBDRO CC[C@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000730817664 1130741145 /nfs/dbraw/zinc/74/11/45/1130741145.db2.gz QPINYMWSAMJINX-IBGZPJMESA-N 1 0 342.395 3.876 20 5 EHBDRO CC1(C)CCc2cc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)ccc2O1 ZINC000731677545 1130831136 /nfs/dbraw/zinc/83/11/36/1130831136.db2.gz UTYVERWGRQOALY-UHFFFAOYSA-N 1 0 326.396 3.988 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[C@@H]([NH+]4CCCC4)CC3)sc2c1 ZINC000737413413 1131572473 /nfs/dbraw/zinc/57/24/73/1131572473.db2.gz BLDUYVREYBEGIB-CYBMUJFWSA-N 1 0 346.456 3.659 20 5 EHBDRO CCC1CCC([N@H+](C)Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742147040 1131691257 /nfs/dbraw/zinc/69/12/57/1131691257.db2.gz YTOHJMCJVRSJPX-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H](CCO)c1ccccc1)CC2 ZINC001172898649 1131883120 /nfs/dbraw/zinc/88/31/20/1131883120.db2.gz IHXFKMXGFJWDDN-ICSRJNTNSA-N 1 0 340.423 3.556 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901028 1131883615 /nfs/dbraw/zinc/88/36/15/1131883615.db2.gz FSVBYCSVYQUSPE-KBXCAEBGSA-N 1 0 340.423 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1CCC3(COC3)CC1)CC2 ZINC001172899869 1131883873 /nfs/dbraw/zinc/88/38/73/1131883873.db2.gz FDNFQDLEVNOVQE-SFHVURJKSA-N 1 0 344.455 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCCc3cccnc31)CC2 ZINC001172901991 1131884565 /nfs/dbraw/zinc/88/45/65/1131884565.db2.gz SDGHDKFKRULEPL-HKUYNNGSSA-N 1 0 337.423 3.904 20 5 EHBDRO CC(C)([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172902567 1131885079 /nfs/dbraw/zinc/88/50/79/1131885079.db2.gz KSSJZMRFNDBIDS-KRWDZBQOSA-N 1 0 325.412 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCCc3cccnc31)CC2 ZINC001172901993 1131885097 /nfs/dbraw/zinc/88/50/97/1131885097.db2.gz SDGHDKFKRULEPL-MJGOQNOKSA-N 1 0 337.423 3.904 20 5 EHBDRO CC(=O)[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901662 1131885315 /nfs/dbraw/zinc/88/53/15/1131885315.db2.gz PRNYAYTUACMKCI-ICSRJNTNSA-N 1 0 338.407 3.762 20 5 EHBDRO CC[N@H+](Cc1ccncc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172905050 1131887034 /nfs/dbraw/zinc/88/70/34/1131887034.db2.gz BUFMIZWSTBFCNC-GOSISDBHSA-N 1 0 325.412 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCc3ccncc31)CC2 ZINC001172908191 1131887797 /nfs/dbraw/zinc/88/77/97/1131887797.db2.gz KZQZIBNJZVRDQT-YLJYHZDGSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1Cc3ccc(F)cc3C1)CC2 ZINC001172915242 1131902471 /nfs/dbraw/zinc/90/24/71/1131902471.db2.gz MNTQDTWKOSHQLG-SFHVURJKSA-N 1 0 326.371 3.997 20 5 EHBDRO COCCC1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172915508 1131902699 /nfs/dbraw/zinc/90/26/99/1131902699.db2.gz NPHHAOQLQHIZSJ-GOSISDBHSA-N 1 0 332.444 3.591 20 5 EHBDRO Nc1ccc(C2([NH2+][C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)cc1 ZINC001172909535 1131916287 /nfs/dbraw/zinc/91/62/87/1131916287.db2.gz SJFBBBBGNMBUEE-GOSISDBHSA-N 1 0 337.423 3.703 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2cccc(F)c2)c1F ZINC001173174824 1131991216 /nfs/dbraw/zinc/99/12/16/1131991216.db2.gz DAEAPLSPXDQZAE-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001173189247 1131995611 /nfs/dbraw/zinc/99/56/11/1131995611.db2.gz JXACYPBALGSAIC-GHMZBOCLSA-N 1 0 346.349 3.651 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2C[C@@H]3CCCC[C@H]3C2)c1F ZINC001173194240 1131995642 /nfs/dbraw/zinc/99/56/42/1131995642.db2.gz YTRTVRFUIPNBQQ-RDBSUJKOSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)CC2CC(F)(F)C2)c1F ZINC001173195474 1131996119 /nfs/dbraw/zinc/99/61/19/1131996119.db2.gz GONQWSJOSQRWBM-SNVBAGLBSA-N 1 0 346.349 3.651 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccnc(F)c1)C1CC1 ZINC001173220681 1132004456 /nfs/dbraw/zinc/00/44/56/1132004456.db2.gz DTWYFUYIJWVLQZ-KZULUSFZSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)[C@H](O)c1ccc(Cl)cc1 ZINC001173220160 1132004768 /nfs/dbraw/zinc/00/47/68/1132004768.db2.gz VAXNFGMHZZTCCP-VFVRVIDISA-N 1 0 348.830 3.891 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173223212 1132005048 /nfs/dbraw/zinc/00/50/48/1132005048.db2.gz HCUPIZMRRLGNJW-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1cccc2c1C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173223962 1132005065 /nfs/dbraw/zinc/00/50/65/1132005065.db2.gz CJRGJRLXVZNVCP-AWEZNQCLSA-N 1 0 326.396 3.593 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173224202 1132005240 /nfs/dbraw/zinc/00/52/40/1132005240.db2.gz MRWLDKYGNTZTOQ-OAHLLOKOSA-N 1 0 327.428 3.797 20 5 EHBDRO Cc1ccnc(C(C)(C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173226178 1132006875 /nfs/dbraw/zinc/00/68/75/1132006875.db2.gz VTRHJFNJRGXKMM-OAHLLOKOSA-N 1 0 327.428 3.797 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC001173229581 1132007560 /nfs/dbraw/zinc/00/75/60/1132007560.db2.gz NURDXTLSMGCWOP-BBRMVZONSA-N 1 0 348.830 3.545 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001173229923 1132007732 /nfs/dbraw/zinc/00/77/32/1132007732.db2.gz BURQXRVNYVUIEF-LBPRGKRZSA-N 1 0 331.803 3.633 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2c(F)cc(F)cc21 ZINC001173227573 1132008392 /nfs/dbraw/zinc/00/83/92/1132008392.db2.gz HBGFFUATNRPKCL-APPDUMDISA-N 1 0 348.349 3.917 20 5 EHBDRO COc1cc2c(cc1C)C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173234327 1132010987 /nfs/dbraw/zinc/01/09/87/1132010987.db2.gz OEPDJNZOCKTGJP-KBXCAEBGSA-N 1 0 340.423 3.600 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173213547 1132014292 /nfs/dbraw/zinc/01/42/92/1132014292.db2.gz GFOQYYLZURQKGN-KDOFPFPSSA-N 1 0 340.423 3.682 20 5 EHBDRO CC[C@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@H]1c1ccccc1 ZINC000746382061 1132504773 /nfs/dbraw/zinc/50/47/73/1132504773.db2.gz LLHYMIIRJVZQLA-FUHWJXTLSA-N 1 0 342.443 3.881 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC001168785300 1132535263 /nfs/dbraw/zinc/53/52/63/1132535263.db2.gz KYKODYIIUGMDEL-LJQANCHMSA-N 1 0 344.411 3.969 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC001175156711 1132569746 /nfs/dbraw/zinc/56/97/46/1132569746.db2.gz SBTYOOBXQBHATB-UHFFFAOYSA-N 1 0 331.460 3.744 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001168976226 1132617472 /nfs/dbraw/zinc/61/74/72/1132617472.db2.gz ZWIDGGLBZCTULX-TVQRCGJNSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2OCc2ccccc2)C1 ZINC001168958888 1132620490 /nfs/dbraw/zinc/62/04/90/1132620490.db2.gz RDRYBDZEEHHBPG-FCGDIQPGSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2N2CCCCCC2)C1 ZINC001168965703 1132621552 /nfs/dbraw/zinc/62/15/52/1132621552.db2.gz CEXAIADAXNVSNU-SJLPKXTDSA-N 1 0 331.460 3.602 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ccncc2C(F)(F)F)C2CC2)C1 ZINC001168997162 1132627714 /nfs/dbraw/zinc/62/77/14/1132627714.db2.gz BUEUFORJBUVEIR-GMXABZIVSA-N 1 0 343.349 3.587 20 5 EHBDRO CC1CC[NH+](CC[C@@H]2CCCN2Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001175353274 1132647672 /nfs/dbraw/zinc/64/76/72/1132647672.db2.gz VKAYTFUYDMKBNV-SFHVURJKSA-N 1 0 349.450 3.820 20 5 EHBDRO CC(=O)Nc1ccc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169151471 1132679065 /nfs/dbraw/zinc/67/90/65/1132679065.db2.gz KDHTYRIVZSCKHF-KBXCAEBGSA-N 1 0 348.447 3.509 20 5 EHBDRO CC1(C)[C@@H](c2ccccc2F)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175454431 1132686599 /nfs/dbraw/zinc/68/65/99/1132686599.db2.gz STUNELFNLJBWEK-OAHLLOKOSA-N 1 0 329.375 3.897 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539513 1132781624 /nfs/dbraw/zinc/78/16/24/1132781624.db2.gz OLJXNAQUIOADKG-QAPCUYQASA-N 1 0 332.444 3.921 20 5 EHBDRO CC(C)[C@@H](Cc1ccccc1)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC001176121190 1132853949 /nfs/dbraw/zinc/85/39/49/1132853949.db2.gz FBHZKDBKGVVFMK-LJQANCHMSA-N 1 0 328.412 3.831 20 5 EHBDRO Cc1nn(C[N@H+]2CCC[C@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766238 1133050284 /nfs/dbraw/zinc/05/02/84/1133050284.db2.gz RLKANKYCLLOLJY-AWEZNQCLSA-N 1 0 331.420 3.506 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000768093615 1133090933 /nfs/dbraw/zinc/09/09/33/1133090933.db2.gz PABCGYAWAFGTPT-GJZGRUSLSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@](C)(O)c1ccccc1Cl ZINC001178431785 1133163096 /nfs/dbraw/zinc/16/30/96/1133163096.db2.gz UYOIKQXRRJUOKB-SFHVURJKSA-N 1 0 348.830 3.862 20 5 EHBDRO C[C@H]1CCc2nc(C[NH2+]CCc3ccccc3[N+](=O)[O-])sc2C1 ZINC001178609606 1133185852 /nfs/dbraw/zinc/18/58/52/1133185852.db2.gz IMMNCLDZLQESON-LBPRGKRZSA-N 1 0 331.441 3.508 20 5 EHBDRO CC1(C)CCC[N@@H+]1CCNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001178933658 1133210689 /nfs/dbraw/zinc/21/06/89/1133210689.db2.gz BIMJCWVDAMBAOZ-UHFFFAOYSA-N 1 0 343.427 3.819 20 5 EHBDRO COC[C@H](CC(C)(C)C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001179034823 1133225303 /nfs/dbraw/zinc/22/53/03/1133225303.db2.gz RBIYFMLAXAOKNA-LBPRGKRZSA-N 1 0 346.374 3.737 20 5 EHBDRO O=C1C[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCCN1 ZINC000769109028 1133228110 /nfs/dbraw/zinc/22/81/10/1133228110.db2.gz PNSNVVDHKLIGKU-UHFFFAOYSA-N 1 0 338.838 3.968 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](CO)CCc2ccccc2)cc1[N+](=O)[O-] ZINC001179616631 1133264880 /nfs/dbraw/zinc/26/48/80/1133264880.db2.gz RYXLGTMJBYWXBA-GOSISDBHSA-N 1 0 342.439 3.802 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC001179662715 1133272074 /nfs/dbraw/zinc/27/20/74/1133272074.db2.gz TYFYCQRFKRKSFH-CQSZACIVSA-N 1 0 349.456 3.727 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H](CCO)C3CCCC3)o2)c1 ZINC001179670521 1133273027 /nfs/dbraw/zinc/27/30/27/1133273027.db2.gz VEIHPPOURGNGMJ-GOSISDBHSA-N 1 0 344.411 3.886 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cc(F)ccc2N(C)C)cc1[N+](=O)[O-] ZINC001179830200 1133287016 /nfs/dbraw/zinc/28/70/16/1133287016.db2.gz MOVODZMEYSFYFP-LBPRGKRZSA-N 1 0 347.390 3.659 20 5 EHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483375 1133288975 /nfs/dbraw/zinc/28/89/75/1133288975.db2.gz MNSYVIMCBYMZKI-CPSHHHPTSA-N 1 0 340.423 3.972 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001180505086 1133387011 /nfs/dbraw/zinc/38/70/11/1133387011.db2.gz FQGJBXFPEZWUHV-UHFFFAOYSA-N 1 0 342.395 3.962 20 5 EHBDRO C[C@H]1CSCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181444479 1133487920 /nfs/dbraw/zinc/48/79/20/1133487920.db2.gz ALPBRXDQWYJMIO-SNVBAGLBSA-N 1 0 334.363 3.799 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1Cc2ccccc2O[C@H](C)C1 ZINC001182127294 1133574887 /nfs/dbraw/zinc/57/48/87/1133574887.db2.gz MLFFGXFDULBYJD-CQSZACIVSA-N 1 0 326.396 3.995 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000746663003 1133975022 /nfs/dbraw/zinc/97/50/22/1133975022.db2.gz KHYBCPNFMICDCH-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[N@H+](CCNc1cc(C)c(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC001185179832 1134044377 /nfs/dbraw/zinc/04/43/77/1134044377.db2.gz HLJZFJIUOYXRFM-UHFFFAOYSA-N 1 0 331.338 3.818 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000788582851 1134148146 /nfs/dbraw/zinc/14/81/46/1134148146.db2.gz NRFUHZXHOARHPZ-AEFFLSMTSA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602146 1134149634 /nfs/dbraw/zinc/14/96/34/1134149634.db2.gz LYSUSBHBEYNQCT-DXCKQFNASA-N 1 0 335.448 3.669 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788693996 1134157549 /nfs/dbraw/zinc/15/75/49/1134157549.db2.gz SVWFQPVWEVPMKG-SOZUMNATSA-N 1 0 347.390 3.743 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788666071 1134159123 /nfs/dbraw/zinc/15/91/23/1134159123.db2.gz PXTYANODQMOIGH-DIFFPNOSSA-N 1 0 349.818 3.869 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(N[C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788710748 1134161946 /nfs/dbraw/zinc/16/19/46/1134161946.db2.gz ISPWGWHJMIQLCM-ZDUSSCGKSA-N 1 0 328.416 3.720 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000789366166 1134263445 /nfs/dbraw/zinc/26/34/45/1134263445.db2.gz MZWUVRYPOGZWQO-KUHUBIRLSA-N 1 0 328.412 3.850 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789457009 1134277540 /nfs/dbraw/zinc/27/75/40/1134277540.db2.gz PZYVNJZTYSWLJK-QGZVFWFLSA-N 1 0 348.830 3.938 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508204 1134288227 /nfs/dbraw/zinc/28/82/27/1134288227.db2.gz ZUZYNILOULPDBO-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO CCOc1cc(N(CC(C)C)CC2CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC001187403908 1134331651 /nfs/dbraw/zinc/33/16/51/1134331651.db2.gz FCRQTRQOKZJDKO-UHFFFAOYSA-N 1 0 349.475 3.798 20 5 EHBDRO C[NH2+]C1(CNc2c(Br)cccc2[N+](=O)[O-])CCCCC1 ZINC001187430580 1134338190 /nfs/dbraw/zinc/33/81/90/1134338190.db2.gz LNCSGKMQJZYADY-UHFFFAOYSA-N 1 0 342.237 3.692 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000775387117 1134697605 /nfs/dbraw/zinc/69/76/05/1134697605.db2.gz WYBUIKIVMRGEHD-ZNOIYHFQSA-N 1 0 326.396 3.541 20 5 EHBDRO CC[C@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000775389786 1134704033 /nfs/dbraw/zinc/70/40/33/1134704033.db2.gz HBEHNSPECMIUGB-IBGZPJMESA-N 1 0 341.411 3.757 20 5 EHBDRO CC(C)N(CC[NH+]1C[C@H](C)C[C@@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527813 1134712798 /nfs/dbraw/zinc/71/27/98/1134712798.db2.gz HLMYVPHIOJJBFY-IAGOWNOFSA-N 1 0 333.476 3.783 20 5 EHBDRO CCCN1CC[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC001203236107 1134727214 /nfs/dbraw/zinc/72/72/14/1134727214.db2.gz XWIKVDFWNJCUBS-CQSZACIVSA-N 1 0 345.468 3.897 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC001170298093 1134737888 /nfs/dbraw/zinc/73/78/88/1134737888.db2.gz ZXPSZIMHVBTIPF-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCOc3ccccc32)c([N+](=O)[O-])c1 ZINC001170300180 1134738648 /nfs/dbraw/zinc/73/86/48/1134738648.db2.gz YHQKUTZNWHRPSA-CXAGYDPISA-N 1 0 342.395 3.648 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC001170305645 1134739699 /nfs/dbraw/zinc/73/96/99/1134739699.db2.gz OLEOIZLNZQICMF-SGTLLEGYSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3c2cccc3F)c([N+](=O)[O-])c1 ZINC001170305492 1134739704 /nfs/dbraw/zinc/73/97/04/1134739704.db2.gz LRNPNEDMWAFSER-XIKOKIGWSA-N 1 0 344.386 3.951 20 5 EHBDRO CC[C@H](C)[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC001170316300 1134745485 /nfs/dbraw/zinc/74/54/85/1134745485.db2.gz WGMSFYCLZNMNMT-LBPRGKRZSA-N 1 0 345.365 3.530 20 5 EHBDRO COc1ccc(C[C@H](C)n2ccc3cccc(C[NH3+])c32)c([N+](=O)[O-])c1 ZINC001170319647 1134746682 /nfs/dbraw/zinc/74/66/82/1134746682.db2.gz XVPCDLQWHHHWAG-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2CC3(C2)CC(F)(F)C3)c([N+](=O)[O-])c1 ZINC001170317266 1134746853 /nfs/dbraw/zinc/74/68/53/1134746853.db2.gz DIWVFLOUJLTVJX-LLVKDONJSA-N 1 0 340.370 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170323404 1134747201 /nfs/dbraw/zinc/74/72/01/1134747201.db2.gz JMTSLPVMDWNQSC-PBHICJAKSA-N 1 0 340.423 3.854 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CCC(OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170334496 1134751643 /nfs/dbraw/zinc/75/16/43/1134751643.db2.gz FPQYDHKQZDHAFM-AWEZNQCLSA-N 1 0 348.443 3.568 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ncccc1C ZINC001170309230 1134753238 /nfs/dbraw/zinc/75/32/38/1134753238.db2.gz PNVKGNMETPSSRP-RHSMWYFYSA-N 1 0 343.427 3.979 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170344337 1134758303 /nfs/dbraw/zinc/75/83/03/1134758303.db2.gz ANQYNCPAECPRFN-CQSZACIVSA-N 1 0 346.402 3.848 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879803 1134812487 /nfs/dbraw/zinc/81/24/87/1134812487.db2.gz LEENVLNJIGPILY-NSHDSACASA-N 1 0 335.282 3.570 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804386454 1135052725 /nfs/dbraw/zinc/05/27/25/1135052725.db2.gz CHORWQKFYOVTMZ-AWEZNQCLSA-N 1 0 348.359 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000804812739 1135201837 /nfs/dbraw/zinc/20/18/37/1135201837.db2.gz SHZWFUFIHVRMKF-HXUWFJFHSA-N 1 0 337.423 3.697 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194162529 1135235890 /nfs/dbraw/zinc/23/58/90/1135235890.db2.gz FGGHRSRLSHPTES-GHMZBOCLSA-N 1 0 339.823 3.601 20 5 EHBDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457534 1135270089 /nfs/dbraw/zinc/27/00/89/1135270089.db2.gz NVYPKEHUIDKLNS-CABCVRRESA-N 1 0 326.824 3.930 20 5 EHBDRO CCCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@H](C)C1 ZINC001194714603 1135311617 /nfs/dbraw/zinc/31/16/17/1135311617.db2.gz IWFYJJRIKUUNMX-YOEHRIQHSA-N 1 0 347.459 3.875 20 5 EHBDRO Cc1c(C[N@@H+]2C[C@H](C)C[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250333 1135398847 /nfs/dbraw/zinc/39/88/47/1135398847.db2.gz MBUCTEKVNBDKTA-CZUORRHYSA-N 1 0 348.443 3.703 20 5 EHBDRO CCCCC[C@H]1CCCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329082 1135546384 /nfs/dbraw/zinc/54/63/84/1135546384.db2.gz KZTXKRFUMCOYPX-INIZCTEOSA-N 1 0 333.432 3.629 20 5 EHBDRO Cc1ccc(C[C@@]2(C)CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC001196595265 1135582503 /nfs/dbraw/zinc/58/25/03/1135582503.db2.gz RILZXLKFOXSNPH-LJQANCHMSA-N 1 0 325.412 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H](C3CCOCC3)C2)c(F)c1 ZINC001197283386 1135672683 /nfs/dbraw/zinc/67/26/83/1135672683.db2.gz BHKRZLWOBZZZHT-HNNXBMFYSA-N 1 0 336.407 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CCOC2CCCCC2)c1 ZINC001649139490 1135847248 /nfs/dbraw/zinc/84/72/48/1135847248.db2.gz YGKYOTAESSMEEU-UHFFFAOYSA-N 1 0 344.358 3.635 20 5 EHBDRO [NH3+]CCN(Cc1cnc(C2CCCC2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000809734989 1135874398 /nfs/dbraw/zinc/87/43/98/1135874398.db2.gz PJHRXDZPPZXDKP-UHFFFAOYSA-N 1 0 346.456 3.674 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809950313 1135905340 /nfs/dbraw/zinc/90/53/40/1135905340.db2.gz FZGCOQVKIHUYEH-ZDUSSCGKSA-N 1 0 346.258 3.818 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C[C@@H]1CCOc2ccccc21 ZINC001201692885 1136057499 /nfs/dbraw/zinc/05/74/99/1136057499.db2.gz IOCMLJIMQGVWQB-AWEZNQCLSA-N 1 0 346.814 3.947 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482895 1136091324 /nfs/dbraw/zinc/09/13/24/1136091324.db2.gz WQNMISQFJUQGPI-CHWSQXEVSA-N 1 0 346.258 3.864 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811486138 1136092569 /nfs/dbraw/zinc/09/25/69/1136092569.db2.gz JXDGWMPEMBYPSY-TVQRCGJNSA-N 1 0 333.215 3.806 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H](O)c1ccccc1 ZINC000811471958 1136095438 /nfs/dbraw/zinc/09/54/38/1136095438.db2.gz OSERSBBCHDJKRO-CQSZACIVSA-N 1 0 341.194 3.725 20 5 EHBDRO C[C@H](c1cc(F)ccc1F)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276601 1136131006 /nfs/dbraw/zinc/13/10/06/1136131006.db2.gz KUIQHEYPXLVLRI-PIGZYNQJSA-N 1 0 336.338 3.599 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279830 1136133539 /nfs/dbraw/zinc/13/35/39/1136133539.db2.gz ZELIPEADOGLSBY-BEFAXECRSA-N 1 0 328.412 3.938 20 5 EHBDRO Cc1ccc(C[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000776280079 1136133715 /nfs/dbraw/zinc/13/37/15/1136133715.db2.gz ZJULPOUDGYHJKM-KRWDZBQOSA-N 1 0 334.441 3.909 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847511 1136259384 /nfs/dbraw/zinc/25/93/84/1136259384.db2.gz DSJZYOMGWITDER-FZKQIMNGSA-N 1 0 332.375 3.678 20 5 EHBDRO Cc1ccccc1C1CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776582541 1136442440 /nfs/dbraw/zinc/44/24/40/1136442440.db2.gz RZNVJMSBPBBWCB-HXUWFJFHSA-N 1 0 340.423 3.816 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585017 1136442523 /nfs/dbraw/zinc/44/25/23/1136442523.db2.gz QXZCMFQLLSPSJU-VPWXQRGCSA-N 1 0 340.423 3.815 20 5 EHBDRO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585343 1136442551 /nfs/dbraw/zinc/44/25/51/1136442551.db2.gz WASMTHCBEOFIGG-ACJLOTCBSA-N 1 0 348.830 3.845 20 5 EHBDRO CC(C)[C@H](c1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581324 1136444960 /nfs/dbraw/zinc/44/49/60/1136444960.db2.gz CLIOXAAXPCXIEO-RBUKOAKNSA-N 1 0 328.412 3.957 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591252 1136451234 /nfs/dbraw/zinc/45/12/34/1136451234.db2.gz IETFKUXXOIPIBY-RTBURBONSA-N 1 0 344.386 3.995 20 5 EHBDRO CN(Cc1ccc(-c2cnn(C)c2)s1)Cc1ccccc1[N+](=O)[O-] ZINC000338946462 1136464917 /nfs/dbraw/zinc/46/49/17/1136464917.db2.gz WYDGRSKXHCECAD-UHFFFAOYSA-N 1 0 342.424 3.689 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc(C(F)F)cc1[N+](=O)[O-])CC2 ZINC000853468102 1136535095 /nfs/dbraw/zinc/53/50/95/1136535095.db2.gz VWINSBKUCTXIKG-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO CC(C)([NH2+]C[C@@H](O)c1cc2ccccc2o1)c1ccccc1[N+](=O)[O-] ZINC000815121190 1136553132 /nfs/dbraw/zinc/55/31/32/1136553132.db2.gz SDUFECUNYSWXEY-MRXNPFEDSA-N 1 0 340.379 3.899 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(C2CC2)c1 ZINC000815577027 1136613079 /nfs/dbraw/zinc/61/30/79/1136613079.db2.gz DZWBMATZAJEZNQ-YJYMSZOUSA-N 1 0 326.396 3.856 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(C2CC2)c1 ZINC000815577026 1136613207 /nfs/dbraw/zinc/61/32/07/1136613207.db2.gz DZWBMATZAJEZNQ-ORAYPTAESA-N 1 0 326.396 3.856 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000776816418 1136706979 /nfs/dbraw/zinc/70/69/79/1136706979.db2.gz RRZVSGOMBMMOPG-BZNIZROVSA-N 1 0 343.408 3.589 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961854 1136891107 /nfs/dbraw/zinc/89/11/07/1136891107.db2.gz VVOIPONRXYOYGE-IRXDYDNUSA-N 1 0 344.411 3.833 20 5 EHBDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818979452 1136895853 /nfs/dbraw/zinc/89/58/53/1136895853.db2.gz MPHGTZHUYQACBY-HNAYVOBHSA-N 1 0 342.439 3.974 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(Sc3ccccc3)CC2)cc1 ZINC000819045666 1136901897 /nfs/dbraw/zinc/90/18/97/1136901897.db2.gz GBKHZZZEHDKIMI-QGZVFWFLSA-N 1 0 344.436 3.543 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000819251890 1136924608 /nfs/dbraw/zinc/92/46/08/1136924608.db2.gz VWJRAYKADMIHRJ-XKGZKEIXSA-N 1 0 340.423 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333739 1136932397 /nfs/dbraw/zinc/93/23/97/1136932397.db2.gz REAOCOISQOVEML-ZWKOTPCHSA-N 1 0 348.349 3.574 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030876 1136933848 /nfs/dbraw/zinc/93/38/48/1136933848.db2.gz BZNAVAYJTYHFIJ-RHSMWYFYSA-N 1 0 327.384 3.513 20 5 EHBDRO C[C@@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858483979 1136972203 /nfs/dbraw/zinc/97/22/03/1136972203.db2.gz GBNVLZCAUWCQOS-KZULUSFZSA-N 1 0 326.400 3.764 20 5 EHBDRO Cc1cccc([C@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)c1 ZINC000859849268 1137034363 /nfs/dbraw/zinc/03/43/63/1137034363.db2.gz BXNSLGONYRIQRN-RBUKOAKNSA-N 1 0 328.412 3.924 20 5 EHBDRO C[NH+](C)CCCCCOC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860571735 1137066943 /nfs/dbraw/zinc/06/69/43/1137066943.db2.gz HIWLKCDHRFTFLX-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO Cc1nc(F)ccc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824820973 1137153785 /nfs/dbraw/zinc/15/37/85/1137153785.db2.gz RSALAEKRXPIWSW-MRXNPFEDSA-N 1 0 329.375 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000863583535 1137192747 /nfs/dbraw/zinc/19/27/47/1137192747.db2.gz ZBWHYIORTOGUJC-ROUUACIJSA-N 1 0 346.814 3.949 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(Cl)cc1N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000845492697 1137294951 /nfs/dbraw/zinc/29/49/51/1137294951.db2.gz WWGYRNKUZQIDOX-LBPRGKRZSA-N 1 0 341.814 3.842 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])cc1C(F)F)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000865799143 1137312666 /nfs/dbraw/zinc/31/26/66/1137312666.db2.gz JOYCKBSUJAKPDC-QYJAPNMZSA-N 1 0 325.359 3.594 20 5 EHBDRO C[NH+]1CCC2(CCN(c3ccc([N+](=O)[O-])cc3C(F)F)CC2)CC1 ZINC000866054859 1137326901 /nfs/dbraw/zinc/32/69/01/1137326901.db2.gz JYJCLKIYXLRZNT-UHFFFAOYSA-N 1 0 339.386 3.845 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000866306983 1137343893 /nfs/dbraw/zinc/34/38/93/1137343893.db2.gz PSWXUMZMPCYTSE-BBRMVZONSA-N 1 0 336.407 3.746 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(C)(C)C(C)(F)F ZINC000866543652 1137363621 /nfs/dbraw/zinc/36/36/21/1137363621.db2.gz ZYMQHWHRPWBZBK-LLVKDONJSA-N 1 0 343.374 3.583 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2cn(C)c3ncccc23)cccc1[N+](=O)[O-] ZINC000866570163 1137365730 /nfs/dbraw/zinc/36/57/30/1137365730.db2.gz DPIDNLDYQMUZNB-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccnn1C ZINC000866613973 1137369638 /nfs/dbraw/zinc/36/96/38/1137369638.db2.gz KJRLFWKDYQKCSW-STQMWFEESA-N 1 0 334.445 3.550 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@H](O)c1cccc(F)c1 ZINC000773045266 1137461371 /nfs/dbraw/zinc/46/13/71/1137461371.db2.gz YORLBCMPSRFDGN-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000773048551 1137461992 /nfs/dbraw/zinc/46/19/92/1137461992.db2.gz RKHNTROEEIGFHV-UUWFMWQGSA-N 1 0 332.375 3.897 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000773133448 1137467609 /nfs/dbraw/zinc/46/76/09/1137467609.db2.gz FYEGVYSDFQPWHP-MWNCTCPHSA-N 1 0 338.498 3.933 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cc3c(s2)CCCC3)cc1[N+](=O)[O-] ZINC001649161060 1137487377 /nfs/dbraw/zinc/48/73/77/1137487377.db2.gz JTKWQHVPMQVWMN-UHFFFAOYSA-N 1 0 332.425 3.834 20 5 EHBDRO Cc1ccccc1C1([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC001171469609 1137492485 /nfs/dbraw/zinc/49/24/85/1137492485.db2.gz HSSZQESJFDWFLY-UHFFFAOYSA-N 1 0 326.396 3.951 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017164 1137564731 /nfs/dbraw/zinc/56/47/31/1137564731.db2.gz VPCAWVSRPBJJPS-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1c2ccccc2C[C@@H]1O ZINC000872029029 1137566142 /nfs/dbraw/zinc/56/61/42/1137566142.db2.gz VBRLAHITHNETHM-SDDDUWNISA-N 1 0 344.436 3.626 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1OCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872046288 1137567513 /nfs/dbraw/zinc/56/75/13/1137567513.db2.gz WDSIRNRBANZDAJ-SJKOYZFVSA-N 1 0 330.359 3.699 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000872059969 1137568694 /nfs/dbraw/zinc/56/86/94/1137568694.db2.gz KZQVHAHEQFWOLI-GOEBONIOSA-N 1 0 340.851 3.974 20 5 EHBDRO C[C@@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064605 1137569183 /nfs/dbraw/zinc/56/91/83/1137569183.db2.gz IUHWAWQZYATFBP-FZKQIMNGSA-N 1 0 332.375 3.682 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000872129534 1137573084 /nfs/dbraw/zinc/57/30/84/1137573084.db2.gz KNPALFQYKYCGHW-APIJFGDWSA-N 1 0 334.416 3.613 20 5 EHBDRO Cc1nccnc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000872133160 1137573422 /nfs/dbraw/zinc/57/34/22/1137573422.db2.gz KVPCEKKOYSYMEQ-YQQAZPJKSA-N 1 0 340.427 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](O)c2c(Cl)cccc2Cl)cc1 ZINC000124251781 1137584422 /nfs/dbraw/zinc/58/44/22/1137584422.db2.gz DEFUHJPZXQVDNF-AWEZNQCLSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000873131392 1137590919 /nfs/dbraw/zinc/59/09/19/1137590919.db2.gz OZTZCKPWFBRXCU-VQIMIIECSA-N 1 0 341.411 3.617 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1 ZINC000873186332 1137593079 /nfs/dbraw/zinc/59/30/79/1137593079.db2.gz MNQFFRXECXXVLK-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124487362 1137598111 /nfs/dbraw/zinc/59/81/11/1137598111.db2.gz BIURVZYWJAMPQP-IGNZVWTISA-N 1 0 332.375 3.897 20 5 EHBDRO CC(C)[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000876902259 1137664946 /nfs/dbraw/zinc/66/49/46/1137664946.db2.gz LJCUDDCNUUEROD-DQPZFDDXSA-N 1 0 332.379 3.621 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc2ccccc21 ZINC000876905993 1137665064 /nfs/dbraw/zinc/66/50/64/1137665064.db2.gz OAJBXBYBVLMQCU-JEYLPNPQSA-N 1 0 336.395 3.999 20 5 EHBDRO C[C@@H]1CCCc2ccccc2[C@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877373596 1137674843 /nfs/dbraw/zinc/67/48/43/1137674843.db2.gz FCECDFSYWRBJQK-QOOYBSBZSA-N 1 0 340.427 3.798 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC2(CCOCC2)[C@@H]1C1CC1 ZINC000877553516 1137681184 /nfs/dbraw/zinc/68/11/84/1137681184.db2.gz UPJCMYMJBBAWMB-SFHVURJKSA-N 1 0 330.428 3.603 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)cc1[N+](=O)[O-] ZINC000877730070 1137687001 /nfs/dbraw/zinc/68/70/01/1137687001.db2.gz LHDSQEXKKZPSJW-UHFFFAOYSA-N 1 0 342.395 3.838 20 5 EHBDRO CC(C)[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000877963998 1137697292 /nfs/dbraw/zinc/69/72/92/1137697292.db2.gz ACJBAVWYYPWFGK-UHFFFAOYSA-N 1 0 336.779 3.671 20 5 EHBDRO CC[C@@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878183168 1137706212 /nfs/dbraw/zinc/70/62/12/1137706212.db2.gz CSHMOSWWOUFWTQ-SNVBAGLBSA-N 1 0 336.779 3.530 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1C ZINC000878354796 1137712317 /nfs/dbraw/zinc/71/23/17/1137712317.db2.gz BCQZKCRZFMEJCC-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@]12C[C@H]1CCCC2 ZINC000879262969 1137742791 /nfs/dbraw/zinc/74/27/91/1137742791.db2.gz KPKSDKMCMVFANR-WRSAYESZSA-N 1 0 342.399 3.703 20 5 EHBDRO COc1cc(CN2CCC[C@H]2c2cncc(C)c2)c([N+](=O)[O-])cc1F ZINC000879750535 1137757855 /nfs/dbraw/zinc/75/78/55/1137757855.db2.gz WNYDAHLOQPRDAK-INIZCTEOSA-N 1 0 345.374 3.783 20 5 EHBDRO CC(C)c1cc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)[nH]n1 ZINC000879918307 1137762551 /nfs/dbraw/zinc/76/25/51/1137762551.db2.gz ABSUNHPTQFYEBL-AWEZNQCLSA-N 1 0 346.406 3.960 20 5 EHBDRO Cc1cc(N2CCC3(CCCCO3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000882950003 1137839425 /nfs/dbraw/zinc/83/94/25/1137839425.db2.gz QYSRJPIZOZRZIW-UHFFFAOYSA-N 1 0 341.411 3.991 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)F ZINC000883259586 1137851041 /nfs/dbraw/zinc/85/10/41/1137851041.db2.gz RHDHQCBQOPYYMK-NEPJUHHUSA-N 1 0 330.379 3.546 20 5 EHBDRO COC[C@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883320095 1137854621 /nfs/dbraw/zinc/85/46/21/1137854621.db2.gz ARHPVMOLUINKSY-YJLNNSPDSA-N 1 0 326.396 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)CCC2 ZINC000331675284 1137916814 /nfs/dbraw/zinc/91/68/14/1137916814.db2.gz PQBPXXIKWUNCAJ-ATZDWAIDSA-N 1 0 332.444 3.893 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000119294205 1137940174 /nfs/dbraw/zinc/94/01/74/1137940174.db2.gz LNVVYNVYKYFIAO-HYVNUMGLSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1[nH]c(C2CCN(c3c(Cl)cccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000884708885 1137970260 /nfs/dbraw/zinc/97/02/60/1137970260.db2.gz NSGGNTDSCMJLOW-UHFFFAOYSA-N 1 0 334.807 3.972 20 5 EHBDRO COCCC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000122957300 1138264930 /nfs/dbraw/zinc/26/49/30/1138264930.db2.gz DHSWBBKENQDTLX-QGZVFWFLSA-N 1 0 332.444 3.712 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000124045776 1138278300 /nfs/dbraw/zinc/27/83/00/1138278300.db2.gz KRLWWRKTKRWQEQ-SFHVURJKSA-N 1 0 341.411 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCOC3)o2)c(Cl)c1 ZINC000263810494 1138372304 /nfs/dbraw/zinc/37/23/04/1138372304.db2.gz MUMYZTJLAXXTKZ-NSHDSACASA-N 1 0 336.775 3.634 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CC[NH+](C2CCC2)CC1 ZINC000264892165 1138669089 /nfs/dbraw/zinc/66/90/89/1138669089.db2.gz FOPMHGMKSTZJIK-UHFFFAOYSA-N 1 0 345.446 3.698 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000264938818 1138680717 /nfs/dbraw/zinc/68/07/17/1138680717.db2.gz HHWHVOBDTFGTMC-UHFFFAOYSA-N 1 0 331.338 3.580 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000338268951 1138808556 /nfs/dbraw/zinc/80/85/56/1138808556.db2.gz ANSQLSIKSXZROF-UHFFFAOYSA-N 1 0 339.351 3.655 20 5 EHBDRO CCC(CC)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000173727616 1139374207 /nfs/dbraw/zinc/37/42/07/1139374207.db2.gz WWBPRWATCVMIEI-SECBINFHSA-N 1 0 347.337 3.719 20 5 EHBDRO CC(C)Oc1cccc([C@@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000179672455 1139773520 /nfs/dbraw/zinc/77/35/20/1139773520.db2.gz QBCDPPMJCBVRNE-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)OC(=O)C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000181821546 1139934411 /nfs/dbraw/zinc/93/44/11/1139934411.db2.gz LKDYKKHEAURBDG-SFHVURJKSA-N 1 0 342.395 3.767 20 5 EHBDRO COCc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192636335 1140541527 /nfs/dbraw/zinc/54/15/27/1140541527.db2.gz LFTHQIDFRKTJLE-IBGZPJMESA-N 1 0 326.396 3.908 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000266142200 1140647050 /nfs/dbraw/zinc/64/70/50/1140647050.db2.gz HKKXRLHCJUEFLC-STQMWFEESA-N 1 0 332.425 3.838 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000266931810 1140740482 /nfs/dbraw/zinc/74/04/82/1140740482.db2.gz SXEMZYHBWYWUQV-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2csc(C)n2)cc1[N+](=O)[O-] ZINC000271113268 1141308520 /nfs/dbraw/zinc/30/85/20/1141308520.db2.gz HSTYUAFARXGNAS-LLVKDONJSA-N 1 0 335.429 3.652 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cnn(C)c1C ZINC000271142857 1141313354 /nfs/dbraw/zinc/31/33/54/1141313354.db2.gz OTXOZOPXXPHJPB-TZMCWYRMSA-N 1 0 348.472 3.858 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000271255229 1141334985 /nfs/dbraw/zinc/33/49/85/1141334985.db2.gz LLBCNVOHMDPWBH-TZMCWYRMSA-N 1 0 332.425 3.980 20 5 EHBDRO CC(C)OC(=O)C[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275500 1141492124 /nfs/dbraw/zinc/49/21/24/1141492124.db2.gz BYVYDFNBGKKQDA-LSDHHAIUSA-N 1 0 334.416 3.710 20 5 EHBDRO [NH3+]CCN(Cc1cnc(C2CCCC2)s1)c1ccccc1[N+](=O)[O-] ZINC000348905211 1141606792 /nfs/dbraw/zinc/60/67/92/1141606792.db2.gz QISUEHGWTGPKDP-UHFFFAOYSA-N 1 0 346.456 3.674 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000023744717 202108234 /nfs/dbraw/zinc/10/82/34/202108234.db2.gz MMLZFKIHXFXDLM-OAHLLOKOSA-N 1 0 333.413 3.574 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000047460109 201108205 /nfs/dbraw/zinc/10/82/05/201108205.db2.gz UHZJDZMYIIFHJB-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO CC(C)C[NH+]1CCN(c2nc3ccccc3c(Cl)c2[N+](=O)[O-])CC1 ZINC001164655035 719332244 /nfs/dbraw/zinc/33/22/44/719332244.db2.gz ZDTJPMWSBIJVIZ-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(c3c(F)cccc3[N+](=O)[O-])C2)CC1 ZINC000557536215 1014142551 /nfs/dbraw/zinc/14/25/51/1014142551.db2.gz VFUJVOBBOUROGZ-OAHLLOKOSA-N 1 0 335.423 3.682 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000339503480 1014601660 /nfs/dbraw/zinc/60/16/60/1014601660.db2.gz BRMDSBXTLIXBTL-DSVHZNLOSA-N 1 0 344.436 3.696 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H](C)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000608836361 1014953036 /nfs/dbraw/zinc/95/30/36/1014953036.db2.gz AQOBMAVESPUFFX-LBPRGKRZSA-N 1 0 330.384 3.999 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824579 1015437759 /nfs/dbraw/zinc/43/77/59/1015437759.db2.gz KRUQDRPNIAYHFF-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NC[C@H](c1ccccc1)[NH+](CC)CC ZINC000327560421 1015447394 /nfs/dbraw/zinc/44/73/94/1015447394.db2.gz LETVZJYLPZWURJ-MRXNPFEDSA-N 1 0 345.447 3.615 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H]1Cn1cnc2ccccc21 ZINC000339905660 1015874345 /nfs/dbraw/zinc/87/43/45/1015874345.db2.gz ACRSNBYAROOWAZ-MRXNPFEDSA-N 1 0 336.395 3.609 20 5 EHBDRO CCOc1cc(NC[C@H](C2CCCCC2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471254188 1016145642 /nfs/dbraw/zinc/14/56/42/1016145642.db2.gz RPXIKMTWHSPWFY-QGZVFWFLSA-N 1 0 335.448 3.916 20 5 EHBDRO CC[C@@H](C)[N@H+](CCc1ccccc1F)Cc1onc(C)c1[N+](=O)[O-] ZINC001167244548 1016741626 /nfs/dbraw/zinc/74/16/26/1016741626.db2.gz UPZJFGDOCVSHMD-GFCCVEGCSA-N 1 0 335.379 3.874 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000449069657 1032157924 /nfs/dbraw/zinc/15/79/24/1032157924.db2.gz XYSNKVAZZAQFNA-UONOGXRCSA-N 1 0 342.395 3.648 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449071755 1032159888 /nfs/dbraw/zinc/15/98/88/1032159888.db2.gz OMYSDCWDVJKJLL-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO COc1ccc(CNC[C@@H]([NH3+])c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000414844372 1017237660 /nfs/dbraw/zinc/23/76/60/1017237660.db2.gz KTGVGBROVQZQFC-QGZVFWFLSA-N 1 0 343.427 3.516 20 5 EHBDRO O=C(CC[NH2+][C@@H]1CC[C@H]2CCCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000548825370 1032250830 /nfs/dbraw/zinc/25/08/30/1032250830.db2.gz FRZUKDQNFGMSKJ-BZUAXINKSA-N 1 0 345.443 3.872 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449174619 1032266431 /nfs/dbraw/zinc/26/64/31/1032266431.db2.gz PMPLTBOJYPPPAH-GJZGRUSLSA-N 1 0 344.411 3.592 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000459790222 1032476372 /nfs/dbraw/zinc/47/63/72/1032476372.db2.gz GKYKHMIHYKOPKK-HNNXBMFYSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccc4c[nH]nc4c3)C2)cc1 ZINC000449500938 1032678968 /nfs/dbraw/zinc/67/89/68/1032678968.db2.gz OSNGRZIZDGBKGI-QGZVFWFLSA-N 1 0 336.395 3.851 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000472649751 1017201851 /nfs/dbraw/zinc/20/18/51/1017201851.db2.gz VEJONHNFBAZHSC-BPUTZDHNSA-N 1 0 348.472 3.805 20 5 EHBDRO CC[C@@H]1C[C@@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503967 1032687674 /nfs/dbraw/zinc/68/76/74/1032687674.db2.gz VGLPYUHZRPUFTF-VDZJLULYSA-N 1 0 332.444 3.979 20 5 EHBDRO Cc1cccc(C)c1[C@H](C)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893825 1017259359 /nfs/dbraw/zinc/25/93/59/1017259359.db2.gz MUWINFAPGHEBSM-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CCC[NH2+]CCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414874855 1017265767 /nfs/dbraw/zinc/26/57/67/1017265767.db2.gz SUINPBXLPNSPOR-UHFFFAOYSA-N 1 0 337.807 3.597 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000177242527 1017602122 /nfs/dbraw/zinc/60/21/22/1017602122.db2.gz SJLTUPUEZRNPAJ-JTQLQIEISA-N 1 0 344.358 3.825 20 5 EHBDRO Cc1cnc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610284255 1017622478 /nfs/dbraw/zinc/62/24/78/1017622478.db2.gz DWBMCJURVYCAOS-QGZVFWFLSA-N 1 0 340.427 3.937 20 5 EHBDRO CCC[C@H]([NH2+]C1CCN(C(=O)OCC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000120175938 1017714294 /nfs/dbraw/zinc/71/42/94/1017714294.db2.gz INGZQSHZCZEOSM-KRWDZBQOSA-N 1 0 349.431 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NC1CC([NH+]2CCCCC2)C1 ZINC000593469590 1032740211 /nfs/dbraw/zinc/74/02/11/1032740211.db2.gz OWPRTHBVQGKPMO-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1nc2ccccc2nc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000282396150 1018108156 /nfs/dbraw/zinc/10/81/56/1018108156.db2.gz HGUKHJYHDJEIKL-UHFFFAOYSA-N 1 0 336.395 3.521 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCN(C)Cc1ccccc1 ZINC000468627383 1018513983 /nfs/dbraw/zinc/51/39/83/1018513983.db2.gz MWYPTYSZMIMSFL-GHRIWEEISA-N 1 0 339.439 3.720 20 5 EHBDRO C[C@@H](c1ccc(F)cc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866481 1018543628 /nfs/dbraw/zinc/54/36/28/1018543628.db2.gz AJWDMJSBDYDBJB-AAEUAGOBSA-N 1 0 348.353 3.515 20 5 EHBDRO Cc1ccnc([C@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000594008453 1032771005 /nfs/dbraw/zinc/77/10/05/1032771005.db2.gz OXEPKSFPMUSJKW-INIZCTEOSA-N 1 0 341.411 3.557 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc2c(c1)OCO2 ZINC000468633847 1018570286 /nfs/dbraw/zinc/57/02/86/1018570286.db2.gz WZCKJNFCZHLILR-NTUHNPAUSA-N 1 0 326.352 3.517 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cn2c(cccc2C)n1 ZINC000592402983 1032799895 /nfs/dbraw/zinc/79/98/95/1032799895.db2.gz JYGZZLVKGJIVCA-HNNXBMFYSA-N 1 0 338.411 3.753 20 5 EHBDRO CC[C@@H]([NH2+][C@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402536 1032796799 /nfs/dbraw/zinc/79/67/99/1032796799.db2.gz IRKFUDHFAMXJIB-QZTJIDSGSA-N 1 0 332.375 3.898 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000322473399 1019119163 /nfs/dbraw/zinc/11/91/63/1019119163.db2.gz PFBGZDFNODWRKA-XGWLTEMNSA-N 1 0 338.835 3.764 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433517 1019125278 /nfs/dbraw/zinc/12/52/78/1019125278.db2.gz PJCFFHQZCSWPFS-OXJNMPFZSA-N 1 0 339.439 3.862 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2C2CC2)c(OC(F)F)c1 ZINC000433802581 1019646317 /nfs/dbraw/zinc/64/63/17/1019646317.db2.gz JPWCLJLDDYUXOH-CYBMUJFWSA-N 1 0 341.358 3.625 20 5 EHBDRO CSc1cc(CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)ccn1 ZINC000340791091 1019988823 /nfs/dbraw/zinc/98/88/23/1019988823.db2.gz GJNGEFAPGVIXMK-UHFFFAOYSA-N 1 0 340.408 3.602 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000594044175 1032871305 /nfs/dbraw/zinc/87/13/05/1032871305.db2.gz QADKJMAEQKQOOS-LLVKDONJSA-N 1 0 328.359 3.907 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc3nccnc3c2)C2CC2)cc1 ZINC000602438714 1032888447 /nfs/dbraw/zinc/88/84/47/1032888447.db2.gz HVUGYWQJQMPTSE-UHFFFAOYSA-N 1 0 334.379 3.703 20 5 EHBDRO C[NH+](C)Cc1ccc(NCc2csc([N+](=O)[O-])c2)cc1Cl ZINC000280394821 1020358893 /nfs/dbraw/zinc/35/88/93/1020358893.db2.gz XHENOMFDAUYHJS-UHFFFAOYSA-N 1 0 325.821 3.983 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000610476502 1020415176 /nfs/dbraw/zinc/41/51/76/1020415176.db2.gz WIKVCDAYICLDAS-USXIJHARSA-N 1 0 336.407 3.759 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCCOCC3)o2)c([N+](=O)[O-])c1 ZINC000345693112 1020436105 /nfs/dbraw/zinc/43/61/05/1020436105.db2.gz ODTPKVUZTVSQNE-CYBMUJFWSA-N 1 0 346.383 3.522 20 5 EHBDRO CCN(CC)C(=O)C1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000237000025 1020509451 /nfs/dbraw/zinc/50/94/51/1020509451.db2.gz VBQFNFUDHSPBQG-UHFFFAOYSA-N 1 0 347.459 3.564 20 5 EHBDRO C[C@@H]([NH2+]CCCCNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000183175891 1020510758 /nfs/dbraw/zinc/51/07/58/1020510758.db2.gz RFADXYIHAQCADJ-CYBMUJFWSA-N 1 0 337.420 3.550 20 5 EHBDRO C[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186636 1020542945 /nfs/dbraw/zinc/54/29/45/1020542945.db2.gz BPFDIQXJBPXMOY-YQQAZPJKSA-N 1 0 331.460 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2c2nc3c([nH]2)CCCC3)cc1 ZINC000276107261 1020649944 /nfs/dbraw/zinc/64/99/44/1020649944.db2.gz WWVZVRDBTPSRDC-GOSISDBHSA-N 1 0 340.427 3.576 20 5 EHBDRO CO[C@H]([C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627034 1032923807 /nfs/dbraw/zinc/92/38/07/1032923807.db2.gz FOKDNRWCYAKQKN-KZULUSFZSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000276347669 1021069993 /nfs/dbraw/zinc/06/99/93/1021069993.db2.gz KTERRCUZOIIUDN-CYBMUJFWSA-N 1 0 330.432 3.748 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(C)(C)O ZINC000518404476 1021161692 /nfs/dbraw/zinc/16/16/92/1021161692.db2.gz WKMPKBATNVEZIC-MRXNPFEDSA-N 1 0 334.441 3.962 20 5 EHBDRO Cc1ccc(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495390 1021179102 /nfs/dbraw/zinc/17/91/02/1021179102.db2.gz LJEWIPBXNMKGSW-LJQANCHMSA-N 1 0 339.439 3.610 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCCC(F)(F)F)cc1Br ZINC000602557617 1032972983 /nfs/dbraw/zinc/97/29/83/1032972983.db2.gz YIYRINXAZZZWDB-UHFFFAOYSA-N 1 0 347.156 3.851 20 5 EHBDRO Cc1ccccc1O[C@@H](C)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559066 1032973130 /nfs/dbraw/zinc/97/31/30/1032973130.db2.gz SRYMAVKUSIHQFF-ZDUSSCGKSA-N 1 0 341.367 3.602 20 5 EHBDRO CC(C)[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccnc1 ZINC000602573484 1032980530 /nfs/dbraw/zinc/98/05/30/1032980530.db2.gz QMPYKQMGLTZUCF-OAHLLOKOSA-N 1 0 340.383 3.660 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC[C@H]1CC ZINC000518746228 1021505025 /nfs/dbraw/zinc/50/50/25/1021505025.db2.gz NFLUVCGVUBHOPI-OAHLLOKOSA-N 1 0 348.447 3.543 20 5 EHBDRO COc1cc(C[N@@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670758 1021639105 /nfs/dbraw/zinc/63/91/05/1021639105.db2.gz RHBUNVPQVBMEIP-ZIAGYGMSSA-N 1 0 334.416 3.623 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000519751496 1021658853 /nfs/dbraw/zinc/65/88/53/1021658853.db2.gz XOJUQFPOLQUWNW-HIFRSBDPSA-N 1 0 326.396 3.730 20 5 EHBDRO C[C@H]1C[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602580793 1033000709 /nfs/dbraw/zinc/00/07/09/1033000709.db2.gz HBQNNVNIJZWIEC-QWRGUYRKSA-N 1 0 332.322 3.518 20 5 EHBDRO COc1ccc([C@H](OC)[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602583747 1033003402 /nfs/dbraw/zinc/00/34/02/1033003402.db2.gz SJSNCDYUZHHKAK-IFXJQAMLSA-N 1 0 344.411 3.512 20 5 EHBDRO CCC(CC)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000519192566 1021915563 /nfs/dbraw/zinc/91/55/63/1021915563.db2.gz KPUGICGZJNLRRN-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO Cc1nc(N(CC[NH+](C)C)Cc2cccc(Cl)c2)ccc1[N+](=O)[O-] ZINC000471746677 1021973920 /nfs/dbraw/zinc/97/39/20/1021973920.db2.gz FIQHFDXDEPIZRY-UHFFFAOYSA-N 1 0 348.834 3.520 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CC[C@@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471788850 1022207167 /nfs/dbraw/zinc/20/71/67/1022207167.db2.gz QSPZOHFOXBKDMY-POZUXBRTSA-N 1 0 344.411 3.997 20 5 EHBDRO CCc1ccc(C(=O)NCCCC[N@@H+]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000471802843 1022280601 /nfs/dbraw/zinc/28/06/01/1022280601.db2.gz DCSYSHOUEJPKQS-OAHLLOKOSA-N 1 0 347.459 3.542 20 5 EHBDRO CC(F)(F)CCC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602671548 1033049206 /nfs/dbraw/zinc/04/92/06/1033049206.db2.gz KXPCDOOHXBNTCS-UHFFFAOYSA-N 1 0 343.193 3.944 20 5 EHBDRO CC(=O)c1cc(NC[C@H](c2ccc(C)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000550386439 1022418466 /nfs/dbraw/zinc/41/84/66/1022418466.db2.gz GXCXETBOYKLLRX-LJQANCHMSA-N 1 0 341.411 3.821 20 5 EHBDRO CC[C@@](C)(O)C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517710751 1022602197 /nfs/dbraw/zinc/60/21/97/1022602197.db2.gz CPELJDHLOUXRRV-LJQANCHMSA-N 1 0 343.427 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(Nc3ccc4c[nH+]ccc4c3)CC2)cn1 ZINC000602687678 1033069509 /nfs/dbraw/zinc/06/95/09/1033069509.db2.gz LFKQGQYEALKKEF-UHFFFAOYSA-N 1 0 349.394 3.619 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000438482209 1022705670 /nfs/dbraw/zinc/70/56/70/1022705670.db2.gz XMUFFMCHDLEWCR-MQDFFIGUSA-N 1 0 328.343 3.861 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000550211587 1022763518 /nfs/dbraw/zinc/76/35/18/1022763518.db2.gz HJBRODFURDXPMS-RDJZCZTQSA-N 1 0 348.443 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn4ccnc4s3)C2)cc1 ZINC000894722124 1022818334 /nfs/dbraw/zinc/81/83/34/1022818334.db2.gz ILSODVDMWCWXSL-CQSZACIVSA-N 1 0 342.424 3.684 20 5 EHBDRO Cc1c(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697645 1022903423 /nfs/dbraw/zinc/90/34/23/1022903423.db2.gz IEQQEGLSNQLCNF-HXUWFJFHSA-N 1 0 340.423 3.775 20 5 EHBDRO Cc1ccc(CN(C)CC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000506942081 1023016748 /nfs/dbraw/zinc/01/67/48/1023016748.db2.gz CVPNEZKUVJKILR-UHFFFAOYSA-N 1 0 347.802 3.627 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003549 1023081620 /nfs/dbraw/zinc/08/16/20/1023081620.db2.gz WLQJUULOZPGUBZ-ZFWWWQNUSA-N 1 0 329.375 3.981 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000506417042 1023088423 /nfs/dbraw/zinc/08/84/23/1023088423.db2.gz PEZOOLRZYCBPCL-QGZVFWFLSA-N 1 0 343.427 3.771 20 5 EHBDRO COc1ccc(OCC[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000441476440 1023097747 /nfs/dbraw/zinc/09/77/47/1023097747.db2.gz POUOFLFSBIRUEM-IJEWVQPXSA-N 1 0 334.416 3.635 20 5 EHBDRO CCC1(C)CC[NH+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000507196166 1023185375 /nfs/dbraw/zinc/18/53/75/1023185375.db2.gz LPAJVTCMAHMEAG-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCC1 ZINC000184635022 1023195594 /nfs/dbraw/zinc/19/55/94/1023195594.db2.gz FLSYABDUMKYJIB-CYBMUJFWSA-N 1 0 329.400 3.961 20 5 EHBDRO Cn1cc(C[NH+]2CCC(CCF)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000602734326 1033124588 /nfs/dbraw/zinc/12/45/88/1033124588.db2.gz QAJNCNKNCFALDQ-UHFFFAOYSA-N 1 0 346.406 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[C@H]3O)s2)cc1 ZINC000449736457 1033134606 /nfs/dbraw/zinc/13/46/06/1033134606.db2.gz MQFFQJXJOVEUMQ-XJKSGUPXSA-N 1 0 332.425 3.574 20 5 EHBDRO CCOC(=O)C1CCC([NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000602752912 1033145748 /nfs/dbraw/zinc/14/57/48/1033145748.db2.gz WQZLQCNYEBEUCX-KAMYIIQDSA-N 1 0 346.427 3.710 20 5 EHBDRO C[C@H](c1ccccc1Cl)[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176211366 1023866668 /nfs/dbraw/zinc/86/66/68/1023866668.db2.gz WNOTYBFAELDSBN-GFCCVEGCSA-N 1 0 334.807 3.670 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000164539332 1023959802 /nfs/dbraw/zinc/95/98/02/1023959802.db2.gz JFAQQBAMECGJNX-DZGCQCFKSA-N 1 0 342.395 3.566 20 5 EHBDRO Cc1cc(NCc2ccc(OCCC[NH+](C)C)cc2)ccc1[N+](=O)[O-] ZINC000514173087 1024197933 /nfs/dbraw/zinc/19/79/33/1024197933.db2.gz UFSSVZYEGFVKFG-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO Cc1cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000507796902 1024424576 /nfs/dbraw/zinc/42/45/76/1024424576.db2.gz OJTRLODBPUKXIC-AWEZNQCLSA-N 1 0 346.818 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000505559741 1024484194 /nfs/dbraw/zinc/48/41/94/1024484194.db2.gz MGMNOTLBAWHEJC-HXUWFJFHSA-N 1 0 340.423 3.819 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000342267989 1024631174 /nfs/dbraw/zinc/63/11/74/1024631174.db2.gz PTTAFEOXPBYDDC-SFHVURJKSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CSCCc3ccccc32)c1 ZINC000539055023 1024717294 /nfs/dbraw/zinc/71/72/94/1024717294.db2.gz RPDCHVPQQJSKKO-GOSISDBHSA-N 1 0 328.437 3.758 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@@H]12 ZINC000248454667 1024770146 /nfs/dbraw/zinc/77/01/46/1024770146.db2.gz ZOMHRVPJMGIDPC-KCXAZCMYSA-N 1 0 342.399 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](c2ccc3cccnc3n2)C1 ZINC000602889967 1033244315 /nfs/dbraw/zinc/24/43/15/1033244315.db2.gz XROGWXZLYJIYCE-HNNXBMFYSA-N 1 0 334.379 3.528 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000427971124 1024916391 /nfs/dbraw/zinc/91/63/91/1024916391.db2.gz JFXQUDOXNUMOFH-UAGQMJEPSA-N 1 0 332.444 3.853 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539225112 1024969334 /nfs/dbraw/zinc/96/93/34/1024969334.db2.gz KNFHYHOSAKVFDE-WMLDXEAASA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccccc1[C@@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000515203794 1025088550 /nfs/dbraw/zinc/08/85/50/1025088550.db2.gz NNSTWEJVRMKVHE-RBUKOAKNSA-N 1 0 326.396 3.604 20 5 EHBDRO O=[N+]([O-])c1cccc(CNC[C@H]2CCC[N@@H+]2CC2CCCCC2)c1 ZINC000520974069 1025141229 /nfs/dbraw/zinc/14/12/29/1025141229.db2.gz QPSHVGQERVHJQE-LJQANCHMSA-N 1 0 331.460 3.729 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896227662 1025262366 /nfs/dbraw/zinc/26/23/66/1025262366.db2.gz NUNQXHYFWUEOTB-MFBWXBCUSA-N 1 0 344.308 3.974 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](Cc1c([N+](=O)[O-])ncn1C)C1CCCC1 ZINC000425440809 1025285535 /nfs/dbraw/zinc/28/55/35/1025285535.db2.gz CFJDDMVXZVKDGE-CQSZACIVSA-N 1 0 328.416 3.834 20 5 EHBDRO CC(C)C[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000092008613 1025350347 /nfs/dbraw/zinc/35/03/47/1025350347.db2.gz ISSUCOHKWBOKEZ-UHFFFAOYSA-N 1 0 328.416 3.616 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000521424639 1025382318 /nfs/dbraw/zinc/38/23/18/1025382318.db2.gz QWNHDIBXDHKWKR-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240800 1025489277 /nfs/dbraw/zinc/48/92/77/1025489277.db2.gz RFGPMOAFHOPEDG-TZMCWYRMSA-N 1 0 333.432 3.741 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000896495173 1025499912 /nfs/dbraw/zinc/49/99/12/1025499912.db2.gz IKVAQTMRKBOHFU-NTCAYCPXSA-N 1 0 340.427 3.611 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000563286673 1025606765 /nfs/dbraw/zinc/60/67/65/1025606765.db2.gz BTUPGHLNQPHDFC-LJQANCHMSA-N 1 0 326.396 3.563 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478227 1025658973 /nfs/dbraw/zinc/65/89/73/1025658973.db2.gz HEEKVOKEPUDIPW-OCCSQVGLSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063419 1025948975 /nfs/dbraw/zinc/94/89/75/1025948975.db2.gz SXSUOJOGLYPKTA-WDEREUQCSA-N 1 0 336.775 3.775 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCc1cccc2cccnc21 ZINC000516087838 1025967059 /nfs/dbraw/zinc/96/70/59/1025967059.db2.gz CZOBWVVQDDHAAK-SFHVURJKSA-N 1 0 333.391 3.963 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@H]1C ZINC000478209353 1026024301 /nfs/dbraw/zinc/02/43/01/1026024301.db2.gz QJXRUOQAJHUSFM-FTLABTOESA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1nccn1CCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552113 1026105230 /nfs/dbraw/zinc/10/52/30/1026105230.db2.gz VQYRHQSTVZTRPE-GOSISDBHSA-N 1 0 342.443 3.760 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1NCC2 ZINC000469870662 1026124988 /nfs/dbraw/zinc/12/49/88/1026124988.db2.gz LDHXDAKYBROUKM-UHFFFAOYSA-N 1 0 325.412 3.973 20 5 EHBDRO CCC(CC)n1ccc(CN(C)CCc2ccccc2[N+](=O)[O-])n1 ZINC000511124607 1026241511 /nfs/dbraw/zinc/24/15/11/1026241511.db2.gz SWGNCGZRIZXXSA-UHFFFAOYSA-N 1 0 330.432 3.827 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000523010913 1026356489 /nfs/dbraw/zinc/35/64/89/1026356489.db2.gz ZSNBQSLSJYTZNR-HNNXBMFYSA-N 1 0 344.386 3.807 20 5 EHBDRO COCCC[C@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000475345072 1026504730 /nfs/dbraw/zinc/50/47/30/1026504730.db2.gz YZOGMZJTZXDUCC-GOSISDBHSA-N 1 0 328.412 3.722 20 5 EHBDRO COc1cc(C[NH2+]C[C@@]2(C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000339445878 1026565344 /nfs/dbraw/zinc/56/53/44/1026565344.db2.gz SOUWWHOEGVXOIB-DNVCBOLYSA-N 1 0 342.395 3.592 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000161337057 1026732169 /nfs/dbraw/zinc/73/21/69/1026732169.db2.gz YNSAAFBVNGHTFA-MOPGFXCFSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)(CC[NH+]1CCCCCC1)NCc1csc([N+](=O)[O-])c1 ZINC000479594823 1026733303 /nfs/dbraw/zinc/73/33/03/1026733303.db2.gz UQYDZZYIWSCPCK-UHFFFAOYSA-N 1 0 325.478 3.791 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C[NH+](C)C)cc1C ZINC000909595944 1026963623 /nfs/dbraw/zinc/96/36/23/1026963623.db2.gz BHJSJVTUWFWQJA-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CC(=O)c1ccc(NCCCC[N@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000076795445 1027323580 /nfs/dbraw/zinc/32/35/80/1027323580.db2.gz PGLAFOHJCRRWLA-AWEZNQCLSA-N 1 0 333.432 3.721 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2nn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000186485264 1027375349 /nfs/dbraw/zinc/37/53/49/1027375349.db2.gz DBNPRAXDIRZIDL-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO CN(C)C(C)(C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237079737 1027375184 /nfs/dbraw/zinc/37/51/84/1027375184.db2.gz JJRFDAOMCGYKEN-UHFFFAOYSA-N 1 0 333.457 3.753 20 5 EHBDRO Cc1sc(C(=O)NC[C@@H]([NH3+])c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000151981138 1027694917 /nfs/dbraw/zinc/69/49/17/1027694917.db2.gz YVAZMZNQGCFDCO-CQSZACIVSA-N 1 0 347.440 3.518 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000909598622 1027697560 /nfs/dbraw/zinc/69/75/60/1027697560.db2.gz CIQDPSLGLPJWKB-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO Cc1ccc(C[N@H+](Cc2ccccc2)CC2(CO)CC2)cc1[N+](=O)[O-] ZINC000342863857 1027719837 /nfs/dbraw/zinc/71/98/37/1027719837.db2.gz SLMHSBZSBIVJCF-UHFFFAOYSA-N 1 0 340.423 3.678 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCOc2ccccc2C(F)(F)F)c1 ZINC000237810049 1027761766 /nfs/dbraw/zinc/76/17/66/1027761766.db2.gz LZOYNAUSMHKNCY-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO CCC[N@H+](C)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000533397913 1027766663 /nfs/dbraw/zinc/76/66/63/1027766663.db2.gz DJZKMVFLGKPNPW-GOSISDBHSA-N 1 0 341.411 3.925 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)cc1 ZINC000420955711 1027924381 /nfs/dbraw/zinc/92/43/81/1027924381.db2.gz WZCMMJLKOBGGRV-LBPRGKRZSA-N 1 0 332.322 3.638 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+]([C@@H]3CCCc4ccccc43)CC2)n1 ZINC000366743547 1027957460 /nfs/dbraw/zinc/95/74/60/1027957460.db2.gz GHBMCSSJKIWHSO-QGZVFWFLSA-N 1 0 326.400 3.506 20 5 EHBDRO CC(C)(C)c1cnc(N2C(C)(C)CC([NH3+])CC2(C)C)c([N+](=O)[O-])c1 ZINC001167626056 1027973404 /nfs/dbraw/zinc/97/34/04/1027973404.db2.gz VSJWFHDOZJWDFM-UHFFFAOYSA-N 1 0 334.464 3.772 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([C@H](C)[NH3+])cc1 ZINC000422878459 1028012833 /nfs/dbraw/zinc/01/28/33/1028012833.db2.gz TVLQTTLMRGUTKR-ZDUSSCGKSA-N 1 0 327.384 3.792 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000909605989 1028056009 /nfs/dbraw/zinc/05/60/09/1028056009.db2.gz RVPWWPRDLDDXPR-AWEZNQCLSA-N 1 0 341.411 3.707 20 5 EHBDRO Cc1cnc(NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000078664432 1028062894 /nfs/dbraw/zinc/06/28/94/1028062894.db2.gz QDQGPOWCQOPNPX-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000444688389 1028159679 /nfs/dbraw/zinc/15/96/79/1028159679.db2.gz JKWIZOWWEYRLLA-KRWDZBQOSA-N 1 0 336.395 3.582 20 5 EHBDRO COCC[C@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000502433130 1028197965 /nfs/dbraw/zinc/19/79/65/1028197965.db2.gz HADIDYOVOXODTB-IUODEOHRSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CC1CCC1)C(C)C ZINC000444776237 1028266923 /nfs/dbraw/zinc/26/69/23/1028266923.db2.gz OWCFZNOEDHSHOM-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[NH2+]C[C@@H](C)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285342 1028324051 /nfs/dbraw/zinc/32/40/51/1028324051.db2.gz ZJWABFRPJBNPGT-CHWSQXEVSA-N 1 0 333.457 3.829 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000421377681 1028336232 /nfs/dbraw/zinc/33/62/32/1028336232.db2.gz HSVCSHJXXMBRQN-DDBAPUKQSA-N 1 0 332.444 3.853 20 5 EHBDRO COCC[N@H+](CCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000519918403 1028358048 /nfs/dbraw/zinc/35/80/48/1028358048.db2.gz QBQJMQJTTYINFF-UHFFFAOYSA-N 1 0 328.412 3.594 20 5 EHBDRO CC(=O)c1cc(N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000572898102 1028366657 /nfs/dbraw/zinc/36/66/57/1028366657.db2.gz LFBMXHPQLLNHKW-ORAYPTAESA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc(C[NH+](C)C)cc2C)cc1[N+](=O)[O-] ZINC000909615487 1028511708 /nfs/dbraw/zinc/51/17/08/1028511708.db2.gz LHVGXXICCDLGDL-UHFFFAOYSA-N 1 0 333.413 3.587 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755655 1028799777 /nfs/dbraw/zinc/79/97/77/1028799777.db2.gz IEFLGEFNMYCIEZ-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@]2(F)c2ccccc2)n1 ZINC000424333959 1028983419 /nfs/dbraw/zinc/98/34/19/1028983419.db2.gz YCQYQWIRDJHKLF-DFGXFYAUSA-N 1 0 344.390 3.502 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CC(C)(C)C ZINC000504894966 1029039916 /nfs/dbraw/zinc/03/99/16/1029039916.db2.gz PMBYNFDDXYRCPV-ZIAGYGMSSA-N 1 0 340.489 3.852 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000237364709 1029076213 /nfs/dbraw/zinc/07/62/13/1029076213.db2.gz SVYFWRXBDAIPIF-CHWSQXEVSA-N 1 0 327.384 3.965 20 5 EHBDRO C[N@H+](CCc1ccccn1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183734320 1029320371 /nfs/dbraw/zinc/32/03/71/1029320371.db2.gz BUBQRPFOAYIHBC-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC000248168533 1029412483 /nfs/dbraw/zinc/41/24/83/1029412483.db2.gz UEEPBINSZSTLBJ-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513823529 1029523565 /nfs/dbraw/zinc/52/35/65/1029523565.db2.gz VZMSUWKWWHHDTI-ONIAQPFYSA-N 1 0 334.460 3.693 20 5 EHBDRO CC[NH+]1CCC(CNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000044526385 1029678158 /nfs/dbraw/zinc/67/81/58/1029678158.db2.gz YRHMOTOLCHTBTP-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000162953231 1029737287 /nfs/dbraw/zinc/73/72/87/1029737287.db2.gz PKXXTRZGILAMGH-JIBOQIRGSA-N 1 0 338.473 3.715 20 5 EHBDRO Cc1c(C[N@H+](CCCO)Cc2cccc(Cl)c2)cccc1[N+](=O)[O-] ZINC000441092344 1029786927 /nfs/dbraw/zinc/78/69/27/1029786927.db2.gz GMPDZYMVTAQQLC-UHFFFAOYSA-N 1 0 348.830 3.941 20 5 EHBDRO COc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000525308818 1029787892 /nfs/dbraw/zinc/78/78/92/1029787892.db2.gz CVVYXILJKPRNGJ-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000150985528 1029826904 /nfs/dbraw/zinc/82/69/04/1029826904.db2.gz ASMJIMCYOFWZBB-SFHVURJKSA-N 1 0 326.396 3.714 20 5 EHBDRO COc1cccc(CCC[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000533802374 1029850367 /nfs/dbraw/zinc/85/03/67/1029850367.db2.gz NHSOEFVZWAGWFN-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC2(CC2)CC1 ZINC000446976561 1029870358 /nfs/dbraw/zinc/87/03/58/1029870358.db2.gz WYVQYOWQOMRJHH-ZDUSSCGKSA-N 1 0 331.416 3.624 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCC2CCOCC2)cc1[N+](=O)[O-] ZINC000453235526 1029958277 /nfs/dbraw/zinc/95/82/77/1029958277.db2.gz MFKHJPJVVNTKRY-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000453307289 1030078405 /nfs/dbraw/zinc/07/84/05/1030078405.db2.gz BWISUICDCKRTIZ-HUUCEWRRSA-N 1 0 348.443 3.993 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)C1CC1 ZINC000453318486 1030094371 /nfs/dbraw/zinc/09/43/71/1030094371.db2.gz MCOGOHWWWBFYPK-QAPCUYQASA-N 1 0 344.455 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCCOC2)s1 ZINC000237956522 1030140759 /nfs/dbraw/zinc/14/07/59/1030140759.db2.gz HOFSWNBSDVTAMT-CYBMUJFWSA-N 1 0 332.425 3.840 20 5 EHBDRO CC1CC[NH+](CCCN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447516942 1030239610 /nfs/dbraw/zinc/23/96/10/1030239610.db2.gz IOTJHWYOQRLQGB-LJQANCHMSA-N 1 0 331.460 3.684 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccncc1F ZINC000550819830 1030274851 /nfs/dbraw/zinc/27/48/51/1030274851.db2.gz RPTPTGYNBPBRLQ-LLVKDONJSA-N 1 0 328.347 3.504 20 5 EHBDRO COc1ccccc1[C@@H](CNc1sccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000302006020 1030285330 /nfs/dbraw/zinc/28/53/30/1030285330.db2.gz VJJIGLWTZNBYIO-OAHLLOKOSA-N 1 0 347.440 3.914 20 5 EHBDRO Cc1ccsc1[C@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447583753 1030314771 /nfs/dbraw/zinc/31/47/71/1030314771.db2.gz CAXKLVPLOLAQHJ-HOTGVXAUSA-N 1 0 332.425 3.665 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000447594503 1030331328 /nfs/dbraw/zinc/33/13/28/1030331328.db2.gz ZHZQKXUOYBHFRW-WMLDXEAASA-N 1 0 347.459 3.661 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)n1 ZINC000526954269 1030503028 /nfs/dbraw/zinc/50/30/28/1030503028.db2.gz DPUKKFPPBRUGII-FRRDWIJNSA-N 1 0 330.388 3.887 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000520460086 1030552740 /nfs/dbraw/zinc/55/27/40/1030552740.db2.gz WOSZGSIOBWFUKA-UHFFFAOYSA-N 1 0 348.443 3.705 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC1([NH+](C)C)CCCCC1 ZINC000537644002 1030731273 /nfs/dbraw/zinc/73/12/73/1030731273.db2.gz BXAGMQFFIRKINQ-UHFFFAOYSA-N 1 0 347.459 3.514 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000160440810 1030757968 /nfs/dbraw/zinc/75/79/68/1030757968.db2.gz LGGKINBDIYWRBS-ZDUSSCGKSA-N 1 0 347.440 3.766 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H](CO)C1CCCCC1)C1CC1 ZINC000550896273 1030777085 /nfs/dbraw/zinc/77/70/85/1030777085.db2.gz ZUYXWATZUTWYJH-RBUKOAKNSA-N 1 0 346.471 3.694 20 5 EHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623431 1030793630 /nfs/dbraw/zinc/79/36/30/1030793630.db2.gz AFUFJFGCNGIEKP-XHDPSFHLSA-N 1 0 339.823 3.697 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000448373541 1031008312 /nfs/dbraw/zinc/00/83/12/1031008312.db2.gz QXENEWKJHXDPNB-INIZCTEOSA-N 1 0 332.425 3.526 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245073 1031052031 /nfs/dbraw/zinc/05/20/31/1031052031.db2.gz GVPCKCZBQIEQLU-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+](CC2CC2)CC2CCC2)cccc1[N+](=O)[O-] ZINC000483269248 1031078716 /nfs/dbraw/zinc/07/87/16/1031078716.db2.gz RECUWKIQMLSUMT-UHFFFAOYSA-N 1 0 345.443 3.744 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000903289025 1031331223 /nfs/dbraw/zinc/33/12/23/1031331223.db2.gz PWKLUFXAIDYSQG-LSDHHAIUSA-N 1 0 341.411 3.971 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOCc1ccccc1)C1CC1 ZINC000484491523 1031614739 /nfs/dbraw/zinc/61/47/39/1031614739.db2.gz ZPMCRJBVJOWLFE-LJQANCHMSA-N 1 0 340.423 3.722 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)C[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000475741016 1031736552 /nfs/dbraw/zinc/73/65/52/1031736552.db2.gz WHJUIDMUBJQCLR-IPYPFGDCSA-N 1 0 333.432 3.598 20 5 EHBDRO C[NH+](C)CCOc1ccccc1CNc1ccc([N+](=O)[O-])cc1Cl ZINC000477666155 1031757499 /nfs/dbraw/zinc/75/74/99/1031757499.db2.gz MIWNLXAYIHXCPZ-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(CCO)CCCCC1)CCC2 ZINC000192941478 1031973975 /nfs/dbraw/zinc/97/39/75/1031973975.db2.gz PIUGJDIPVDMKJH-SFHVURJKSA-N 1 0 332.444 3.895 20 5 EHBDRO CC[C@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000926959778 1031979671 /nfs/dbraw/zinc/97/96/71/1031979671.db2.gz CWRSFOZZUPZUEL-KBPBESRZSA-N 1 0 333.354 3.518 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000537961005 1032047963 /nfs/dbraw/zinc/04/79/63/1032047963.db2.gz RYEHIHOZIFVJEQ-GOSISDBHSA-N 1 0 344.386 3.853 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000537974563 1032054784 /nfs/dbraw/zinc/05/47/84/1032054784.db2.gz GYRFLTBACXSRBF-IBGZPJMESA-N 1 0 342.395 3.649 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485948 1033365702 /nfs/dbraw/zinc/36/57/02/1033365702.db2.gz TZRWEYUWGDVNRN-HIFRSBDPSA-N 1 0 334.445 3.508 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2ccc(CCO)cc2)cc1[N+](=O)[O-] ZINC000898172780 1033366623 /nfs/dbraw/zinc/36/66/23/1033366623.db2.gz ZANXHARLOOXUMI-UHFFFAOYSA-N 1 0 328.412 3.543 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000594514499 1033420536 /nfs/dbraw/zinc/42/05/36/1033420536.db2.gz JUSVPOIPIBIWSU-KBXCAEBGSA-N 1 0 325.412 3.532 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000594523902 1033431746 /nfs/dbraw/zinc/43/17/46/1033431746.db2.gz VBWDOFNHGVCORW-INIZCTEOSA-N 1 0 334.416 3.575 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000594738160 1033509789 /nfs/dbraw/zinc/50/97/89/1033509789.db2.gz BCDHIPREQBYIIF-FZKQIMNGSA-N 1 0 325.412 3.775 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000594936898 1033586577 /nfs/dbraw/zinc/58/65/77/1033586577.db2.gz XRQOPGSSNIUTFX-GJZGRUSLSA-N 1 0 344.411 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC[C@H]3CCCOC3)o2)c1 ZINC000598984854 1033609925 /nfs/dbraw/zinc/60/99/25/1033609925.db2.gz DQCLUNXMYJMHIB-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO CCCC[NH+]1CCC(N[C@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595016108 1033609902 /nfs/dbraw/zinc/60/99/02/1033609902.db2.gz QCDDBVVNQWRCLN-CQSZACIVSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cccc([C@@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])OC)c1 ZINC000598986461 1033610996 /nfs/dbraw/zinc/61/09/96/1033610996.db2.gz AGIPPNRHAXPGSX-WMHRWZGDSA-N 1 0 342.395 3.594 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])nc1 ZINC000598990602 1033614333 /nfs/dbraw/zinc/61/43/33/1033614333.db2.gz HLFKZLDSNUAIQF-VURMDHGXSA-N 1 0 325.412 3.879 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000594993761 1033624103 /nfs/dbraw/zinc/62/41/03/1033624103.db2.gz GMMMOSZXNQHPNH-HZPDHXFCSA-N 1 0 342.395 3.648 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC000595005842 1033629624 /nfs/dbraw/zinc/62/96/24/1033629624.db2.gz DTJNDCUWKONXFU-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@@H]([S@@](C)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000595061447 1033639609 /nfs/dbraw/zinc/63/96/09/1033639609.db2.gz KZFGMRYJRFBBSB-UNNNGVNHSA-N 1 0 338.473 3.715 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cnc(C(F)(F)F)nc2)cccc1[N+](=O)[O-] ZINC000595061192 1033640007 /nfs/dbraw/zinc/64/00/07/1033640007.db2.gz QXONUFQJKOFWTJ-SNVBAGLBSA-N 1 0 340.305 3.563 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCN1C1CCCCC1 ZINC000598992025 1033644498 /nfs/dbraw/zinc/64/44/98/1033644498.db2.gz JQPCZTQHQCRJDA-IWHGQQBYSA-N 1 0 329.444 3.605 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000595046635 1033662920 /nfs/dbraw/zinc/66/29/20/1033662920.db2.gz LWBSDNQSYONQCE-UKRRQHHQSA-N 1 0 334.416 3.746 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C1CC1)[C@H]1CCCCO1 ZINC000595044489 1033663596 /nfs/dbraw/zinc/66/35/96/1033663596.db2.gz ALYJPADQFRQXRL-XZOAIXRZSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1ccc([C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599020517 1033667220 /nfs/dbraw/zinc/66/72/20/1033667220.db2.gz SFRICCOJKBQVMT-FHHGHWCOSA-N 1 0 339.395 3.753 20 5 EHBDRO CC1(C)CC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC(C)(C)[NH2+]1 ZINC000599021550 1033667239 /nfs/dbraw/zinc/66/72/39/1033667239.db2.gz AFMMEDZPXGZJCD-UHFFFAOYSA-N 1 0 328.416 3.864 20 5 EHBDRO Cn1ncc(C2CC2)c1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595075430 1033693877 /nfs/dbraw/zinc/69/38/77/1033693877.db2.gz BOAUMGBPHAHDBY-GOSISDBHSA-N 1 0 340.427 3.763 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCCOC1 ZINC000599055303 1033707776 /nfs/dbraw/zinc/70/77/76/1033707776.db2.gz DEJKBVYRMOMKDQ-LSDHHAIUSA-N 1 0 338.473 3.872 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073934 1033717353 /nfs/dbraw/zinc/71/73/53/1033717353.db2.gz NDPCZMGQGRPLNZ-PBHICJAKSA-N 1 0 347.459 3.661 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCO)[C@H]1CCCc2ccccc21 ZINC000595375214 1033783414 /nfs/dbraw/zinc/78/34/14/1033783414.db2.gz QHDQMOQFNICCHK-SFHVURJKSA-N 1 0 344.386 3.606 20 5 EHBDRO Cc1noc(C[N@@H+]2CCCC[C@@H]2CCc2ccccc2)c1[N+](=O)[O-] ZINC000595404028 1033809471 /nfs/dbraw/zinc/80/94/71/1033809471.db2.gz PBIQVVGSMXCURZ-MRXNPFEDSA-N 1 0 329.400 3.879 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@]2(C)Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595562788 1033843358 /nfs/dbraw/zinc/84/33/58/1033843358.db2.gz MAOBLHNUBQZPIM-KRWDZBQOSA-N 1 0 333.363 3.628 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CC=CC1)[C@H]1CC[C@H](O)CC1 ZINC000595562811 1033844322 /nfs/dbraw/zinc/84/43/22/1033844322.db2.gz MFJDXHRVTHWPNJ-IYARVYRRSA-N 1 0 330.428 3.667 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000593721366 1033847196 /nfs/dbraw/zinc/84/71/96/1033847196.db2.gz HXMRYHUBEQEOPA-OGWOLHLISA-N 1 0 341.411 3.869 20 5 EHBDRO CN1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000608836046 1033911458 /nfs/dbraw/zinc/91/14/58/1033911458.db2.gz FBYCMQYXTURSTD-CQSZACIVSA-N 1 0 331.441 3.507 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)OCCO2 ZINC000063994965 1033934431 /nfs/dbraw/zinc/93/44/31/1033934431.db2.gz TUEPMHCQXQWJPT-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO Cc1c(CN2C[C@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976012 1033969311 /nfs/dbraw/zinc/96/93/11/1033969311.db2.gz KRQPAHPXSNRLEN-AUUYWEPGSA-N 1 0 326.396 3.865 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)C1 ZINC000603855872 1033980512 /nfs/dbraw/zinc/98/05/12/1033980512.db2.gz CBQHJWPKTVVVRN-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H](C4CCC4)C3)o2)cc1 ZINC000595839450 1034004238 /nfs/dbraw/zinc/00/42/38/1034004238.db2.gz YMGJOYDFBOOJOV-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H]2CC[C@@H](C1)S2 ZINC000599552826 1034005112 /nfs/dbraw/zinc/00/51/12/1034005112.db2.gz JJJGQWKPRCJDNY-CVEARBPZSA-N 1 0 336.457 3.852 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000596308485 1034165035 /nfs/dbraw/zinc/16/50/35/1034165035.db2.gz STONXNBSUVACKW-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000456260296 1034258131 /nfs/dbraw/zinc/25/81/31/1034258131.db2.gz HUVPBMVQFARSCG-QGZVFWFLSA-N 1 0 339.395 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3CCC[N@H+](CC4CC4)C3)c2c1 ZINC000596570368 1034293708 /nfs/dbraw/zinc/29/37/08/1034293708.db2.gz IQQLELYAFRUDDQ-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649649 1034345644 /nfs/dbraw/zinc/34/56/44/1034345644.db2.gz DRMFZBROZBTYLG-PXAZEXFGSA-N 1 0 341.411 3.914 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000310510722 1034530963 /nfs/dbraw/zinc/53/09/63/1034530963.db2.gz DHYUNJJBSDRJNN-LSDHHAIUSA-N 1 0 349.431 3.520 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000534473967 1034599236 /nfs/dbraw/zinc/59/92/36/1034599236.db2.gz DYFUIKPECIEVCP-UHFFFAOYSA-N 1 0 338.407 3.707 20 5 EHBDRO CCOc1ccccc1[C@@H](CC)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742880 1034600210 /nfs/dbraw/zinc/60/02/10/1034600210.db2.gz GZICGVKRLXCMSS-QZTJIDSGSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)c1ccc([C@@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000534665854 1034791226 /nfs/dbraw/zinc/79/12/26/1034791226.db2.gz OBDZWWVZYXQTHK-KRWDZBQOSA-N 1 0 328.416 3.752 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](c2cccs2)C2CC2)c1[N+](=O)[O-] ZINC000892488331 1034813957 /nfs/dbraw/zinc/81/39/57/1034813957.db2.gz KXOFCUHKCOKOBY-CQSZACIVSA-N 1 0 334.397 3.611 20 5 EHBDRO COC[C@H]1CCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000450950329 1034970821 /nfs/dbraw/zinc/97/08/21/1034970821.db2.gz VBURXFLVNNXCLN-AWEZNQCLSA-N 1 0 329.400 3.704 20 5 EHBDRO CC(C)([NH2+]CCC(=O)NCC1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000411761731 1035019202 /nfs/dbraw/zinc/01/92/02/1035019202.db2.gz VXKXUXGWYZTLTI-UHFFFAOYSA-N 1 0 347.459 3.506 20 5 EHBDRO O=[N+]([O-])c1cccc(CN2CC3(CCOCC3)[C@H]2c2ccccc2)c1 ZINC000412001750 1035275003 /nfs/dbraw/zinc/27/50/03/1035275003.db2.gz QZQJEBMFOIQPQV-LJQANCHMSA-N 1 0 338.407 3.949 20 5 EHBDRO C[C@@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000310659641 1035281562 /nfs/dbraw/zinc/28/15/62/1035281562.db2.gz XNQMZDANZAKRCX-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000188625060 1035442512 /nfs/dbraw/zinc/44/25/12/1035442512.db2.gz RPMZEGXHOQCSJL-CORIIIEPSA-N 1 0 346.349 3.729 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540617675 1035507055 /nfs/dbraw/zinc/50/70/55/1035507055.db2.gz YDMKOOGMWOJDRA-UKRRQHHQSA-N 1 0 332.400 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@H]1CCCC[N@H+]1CC(C)C ZINC000443386890 1035612261 /nfs/dbraw/zinc/61/22/61/1035612261.db2.gz NOXJWHYFXGQWCJ-MRXNPFEDSA-N 1 0 348.447 3.535 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000386471252 1035661886 /nfs/dbraw/zinc/66/18/86/1035661886.db2.gz UUMXEUUIOZNXEC-KRWDZBQOSA-N 1 0 340.427 3.704 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000325721842 1035680887 /nfs/dbraw/zinc/68/08/87/1035680887.db2.gz UKPCRPGUKZFXOO-IBGZPJMESA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C2CCC(C(F)F)CC2)n1 ZINC000414190069 1035981523 /nfs/dbraw/zinc/98/15/23/1035981523.db2.gz RGEVELQGVNTUHN-HOAMVYINSA-N 1 0 342.390 3.689 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000609158420 1036034219 /nfs/dbraw/zinc/03/42/19/1036034219.db2.gz GIRSUOURFUDYMA-LBPRGKRZSA-N 1 0 347.440 3.516 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H]2CCCOC2)c2ccccc2)c1 ZINC000180182357 1036049203 /nfs/dbraw/zinc/04/92/03/1036049203.db2.gz KKBXUPMMQIBPMO-KXBFYZLASA-N 1 0 326.396 3.700 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@](C)(O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000156968433 1036114781 /nfs/dbraw/zinc/11/47/81/1036114781.db2.gz ILJVOLLIARSDEQ-WBVHZDCISA-N 1 0 334.441 3.995 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCO1 ZINC000511505769 1036273303 /nfs/dbraw/zinc/27/33/03/1036273303.db2.gz FZRMAPSMYZQSHX-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO CC(C)c1ccc(CN2C[C@H]([NH+]3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000589188628 1036298135 /nfs/dbraw/zinc/29/81/35/1036298135.db2.gz DPHTWEYOGBJMSA-DOTOQJQBSA-N 1 0 331.460 3.777 20 5 EHBDRO CCCC[C@@H](C)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000589310156 1036355579 /nfs/dbraw/zinc/35/55/79/1036355579.db2.gz ZDZOOFJMMWZDCK-LLVKDONJSA-N 1 0 327.812 3.697 20 5 EHBDRO CCN(Cc1cccc(F)c1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000120123649 1036356701 /nfs/dbraw/zinc/35/67/01/1036356701.db2.gz APSJKHFVNMHLIA-CYBMUJFWSA-N 1 0 345.374 3.583 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000589500078 1036439855 /nfs/dbraw/zinc/43/98/55/1036439855.db2.gz QXFGMDVUMSYHOA-LJQANCHMSA-N 1 0 344.411 3.704 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000464690477 1036670655 /nfs/dbraw/zinc/67/06/55/1036670655.db2.gz VZYPBGXYAJZHJM-ZDUSSCGKSA-N 1 0 342.436 3.850 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939098 1036687637 /nfs/dbraw/zinc/68/76/37/1036687637.db2.gz OYGPWPWDVJOFMA-SWLSCSKDSA-N 1 0 346.349 3.654 20 5 EHBDRO C[C@H](CNc1cccc(F)c1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000057138167 1036719998 /nfs/dbraw/zinc/71/99/98/1036719998.db2.gz NIXOZLGOYZZSBM-LLVKDONJSA-N 1 0 335.404 3.654 20 5 EHBDRO Cc1cc(C)cc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180396875 1036770739 /nfs/dbraw/zinc/77/07/39/1036770739.db2.gz XNYIIEWCXRWNQQ-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ncc(Br)s1 ZINC000180417743 1036776773 /nfs/dbraw/zinc/77/67/73/1036776773.db2.gz QPYRBSMSKORXLT-MRVPVSSYSA-N 1 0 342.218 3.665 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([NH2+]C(C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590134323 1036784623 /nfs/dbraw/zinc/78/46/23/1036784623.db2.gz JDVGQOVGPHPXFW-GFCCVEGCSA-N 1 0 345.365 3.889 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)N(C)C ZINC000443004429 1036794602 /nfs/dbraw/zinc/79/46/02/1036794602.db2.gz DCUCOYVGOFRNTM-OXQOHEQNSA-N 1 0 341.455 3.993 20 5 EHBDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237683214 1036864920 /nfs/dbraw/zinc/86/49/20/1036864920.db2.gz JTFULGTVBDAEMT-LSDHHAIUSA-N 1 0 342.443 3.911 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2CCCc2ccccc2)n1 ZINC000443637414 1036914014 /nfs/dbraw/zinc/91/40/14/1036914014.db2.gz IYBLFRPPGGQMPV-GOSISDBHSA-N 1 0 342.443 3.669 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000590653745 1036992665 /nfs/dbraw/zinc/99/26/65/1036992665.db2.gz LZOVMRFTVMRSRP-JSGCOSHPSA-N 1 0 332.322 3.661 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000590653746 1036993676 /nfs/dbraw/zinc/99/36/76/1036993676.db2.gz LZOVMRFTVMRSRP-OCCSQVGLSA-N 1 0 332.322 3.661 20 5 EHBDRO O=C(C[NH2+][C@@H]1CCCC12CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000590778056 1037045366 /nfs/dbraw/zinc/04/53/66/1037045366.db2.gz XVJRKSPZVFAHIU-MRXNPFEDSA-N 1 0 331.416 3.626 20 5 EHBDRO Cc1cc(N2CCC[C@]3(CCCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542123338 1037085709 /nfs/dbraw/zinc/08/57/09/1037085709.db2.gz QXAPHZXWOYAEPE-IBGZPJMESA-N 1 0 341.411 3.848 20 5 EHBDRO C[N@H+](CCCNCc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000761522474 1037089798 /nfs/dbraw/zinc/08/97/98/1037089798.db2.gz QKUHVTGCPTZJLX-UHFFFAOYSA-N 1 0 347.846 3.860 20 5 EHBDRO COCC1(C)CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000542119354 1037094542 /nfs/dbraw/zinc/09/45/42/1037094542.db2.gz XCSSFULWNGFLKO-UHFFFAOYSA-N 1 0 329.400 3.704 20 5 EHBDRO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1CCCC[C@@H]1C ZINC000761520409 1037098277 /nfs/dbraw/zinc/09/82/77/1037098277.db2.gz FAYVCUCMLRBQLX-STQMWFEESA-N 1 0 325.840 3.601 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769550 1037157458 /nfs/dbraw/zinc/15/74/58/1037157458.db2.gz XBMRNMHBUNKGDR-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO CCC[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824618 1037226515 /nfs/dbraw/zinc/22/65/15/1037226515.db2.gz JBFXZQMYXOGVGJ-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[C@H](O)C3)s2)cc1 ZINC000188808817 1037330572 /nfs/dbraw/zinc/33/05/72/1037330572.db2.gz JJUXJCVKBBVTCS-DOMZBBRYSA-N 1 0 332.425 3.574 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)Oc1ccccc1C ZINC000462738129 1037344561 /nfs/dbraw/zinc/34/45/61/1037344561.db2.gz LBTZUGGBXRTZBA-HNNXBMFYSA-N 1 0 344.411 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCN2CCCCC2)c2ccccc2)c1 ZINC000491383429 1037437099 /nfs/dbraw/zinc/43/70/99/1037437099.db2.gz RKUXIADBPDDEFC-HXUWFJFHSA-N 1 0 339.439 3.760 20 5 EHBDRO COCCc1nc(C)c([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271859625 1037524409 /nfs/dbraw/zinc/52/44/09/1037524409.db2.gz ZFADGJPYQDCYKB-NEPJUHHUSA-N 1 0 349.456 3.960 20 5 EHBDRO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789393 1037532307 /nfs/dbraw/zinc/53/23/07/1037532307.db2.gz MCQOUCOXQPPUKP-HBUWYVDXSA-N 1 0 344.411 3.836 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000462914412 1037545750 /nfs/dbraw/zinc/54/57/50/1037545750.db2.gz YRUMRGYDDTXTGG-INIZCTEOSA-N 1 0 343.402 3.658 20 5 EHBDRO Cc1ccc(NC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000045951309 1037579601 /nfs/dbraw/zinc/57/96/01/1037579601.db2.gz QQHNQPUFYLLNKR-HNNXBMFYSA-N 1 0 348.447 3.679 20 5 EHBDRO CCC[C@H](C)[C@@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573615419 1037630247 /nfs/dbraw/zinc/63/02/47/1037630247.db2.gz WTRXJQKKOCNUNP-IINYFYTJSA-N 1 0 334.338 3.500 20 5 EHBDRO CC(C)c1nc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)c2ccccn21 ZINC000573808662 1037756842 /nfs/dbraw/zinc/75/68/42/1037756842.db2.gz PKXJQIRUUVNWDR-UHFFFAOYSA-N 1 0 338.411 3.698 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540326432 1037824133 /nfs/dbraw/zinc/82/41/33/1037824133.db2.gz WXZGTDBLLWPRPV-PBHICJAKSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H](C[NH2+][C@@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000897460720 1037850134 /nfs/dbraw/zinc/85/01/34/1037850134.db2.gz VFYDQCNHPNURQJ-GOEBONIOSA-N 1 0 325.412 3.631 20 5 EHBDRO Cc1ccc(C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CC2CC2)cn1 ZINC000592145498 1037867190 /nfs/dbraw/zinc/86/71/90/1037867190.db2.gz SLTLNIHQOIFUMG-UHFFFAOYSA-N 1 0 325.412 3.753 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000251926361 1037884888 /nfs/dbraw/zinc/88/48/88/1037884888.db2.gz STHCQQPZNJQXQX-YOEHRIQHSA-N 1 0 347.459 3.521 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(c2cccc(Cl)c2)CC1 ZINC000540414647 1037912787 /nfs/dbraw/zinc/91/27/87/1037912787.db2.gz CHMZHPNQQUNZRK-UHFFFAOYSA-N 1 0 332.787 3.906 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccccc2)C2(CO)CC=CC2)cs1 ZINC000592175228 1037914940 /nfs/dbraw/zinc/91/49/40/1037914940.db2.gz BYBMCCNUSGPWJN-QGZVFWFLSA-N 1 0 344.436 3.816 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@H]2CSc3ccccc3O2)cc1 ZINC000592373051 1037924322 /nfs/dbraw/zinc/92/43/22/1037924322.db2.gz SAXYJEYCEDPZDZ-HNNXBMFYSA-N 1 0 330.409 3.628 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000120200464 1038142079 /nfs/dbraw/zinc/14/20/79/1038142079.db2.gz WGBRXNBEXNKUIF-DNVCBOLYSA-N 1 0 327.428 3.857 20 5 EHBDRO CCCC[NH+](CCCC)CCNc1cc([N+](=O)[O-])c2nccn2c1 ZINC001167732942 1038323097 /nfs/dbraw/zinc/32/30/97/1038323097.db2.gz JKBKTHFHNMODRQ-UHFFFAOYSA-N 1 0 333.436 3.557 20 5 EHBDRO CC[C@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104673464 1038451625 /nfs/dbraw/zinc/45/16/25/1038451625.db2.gz GLUFCWJTGIKWFU-AWEZNQCLSA-N 1 0 329.400 3.914 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2)cc1F ZINC000538712190 1038484843 /nfs/dbraw/zinc/48/48/43/1038484843.db2.gz OSHOZPCYKYLCIY-NSHDSACASA-N 1 0 334.347 3.602 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC(C)(C)O ZINC000538726563 1038508813 /nfs/dbraw/zinc/50/88/13/1038508813.db2.gz DWQNJZBVENZTAX-UHFFFAOYSA-N 1 0 334.441 3.916 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC000365794661 1038540326 /nfs/dbraw/zinc/54/03/26/1038540326.db2.gz KSULLOJIQAOJOW-MRXNPFEDSA-N 1 0 343.339 3.546 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461962776 1038698726 /nfs/dbraw/zinc/69/87/26/1038698726.db2.gz XNBQVPIGJGCHMY-GFCCVEGCSA-N 1 0 345.365 3.700 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000479851754 1038786856 /nfs/dbraw/zinc/78/68/56/1038786856.db2.gz NQIUNFWYBXHKRM-GOSISDBHSA-N 1 0 341.411 3.902 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)C ZINC000479866936 1038845686 /nfs/dbraw/zinc/84/56/86/1038845686.db2.gz SZDJCBCRAVECDX-IQBZNYMQSA-N 1 0 334.416 3.566 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2c3ccccc3CC[C@H]2C)c1[N+](=O)[O-] ZINC000893269346 1038941451 /nfs/dbraw/zinc/94/14/51/1038941451.db2.gz NWJZKKHFDURHLP-PXAZEXFGSA-N 1 0 342.395 3.722 20 5 EHBDRO Cc1cccc([C@H]2CCCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000478008174 1039112665 /nfs/dbraw/zinc/11/26/65/1039112665.db2.gz CVADXDOSTQAOSJ-QGZVFWFLSA-N 1 0 328.416 3.717 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480090344 1039140812 /nfs/dbraw/zinc/14/08/12/1039140812.db2.gz WGSCCDPFVCXOKK-AEFFLSMTSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000905854370 1039160186 /nfs/dbraw/zinc/16/01/86/1039160186.db2.gz VVPBGFHJKDBMGI-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1cccc(C[NH+]2CCN([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000026852642 1039178938 /nfs/dbraw/zinc/17/89/38/1039178938.db2.gz LIMZRJKNTHDIEC-KRWDZBQOSA-N 1 0 339.439 3.782 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](O)C23CCCC3)o1 ZINC000552316901 1039200268 /nfs/dbraw/zinc/20/02/68/1039200268.db2.gz RXOQSCQKQBJZOH-GOSISDBHSA-N 1 0 342.395 3.734 20 5 EHBDRO COc1cc(C[N@H+](CCc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000485548154 1039228868 /nfs/dbraw/zinc/22/88/68/1039228868.db2.gz TVSFCUVGNHRLLH-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1ccc([C@@H]2CCCN2Cc2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000015366927 1039277263 /nfs/dbraw/zinc/27/72/63/1039277263.db2.gz JETZQMOLTQZULR-SFHVURJKSA-N 1 0 342.395 3.949 20 5 EHBDRO CC(C)(C)[NH2+]CCC(=O)O[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000906087585 1039284433 /nfs/dbraw/zinc/28/44/33/1039284433.db2.gz OAELCUAGSKLBLZ-CYBMUJFWSA-N 1 0 348.321 3.520 20 5 EHBDRO C[C@@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417553 1039430795 /nfs/dbraw/zinc/43/07/95/1039430795.db2.gz NTJAGIRNARRXBM-JTQLQIEISA-N 1 0 343.214 3.791 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]Cc1c(F)cccc1[N+](=O)[O-] ZINC000500815751 1039538359 /nfs/dbraw/zinc/53/83/59/1039538359.db2.gz MJGSXKLCFWGTEX-UHFFFAOYSA-N 1 0 332.375 3.819 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417299056 1039641173 /nfs/dbraw/zinc/64/11/73/1039641173.db2.gz LWWQGSVIOKMSFY-ZWKOTPCHSA-N 1 0 343.427 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1c3ccccc3C[C@@H]1O)CCCC2 ZINC000417309702 1039659457 /nfs/dbraw/zinc/65/94/57/1039659457.db2.gz FIHKFSANGVRIQR-HSALFYBXSA-N 1 0 338.407 3.610 20 5 EHBDRO COc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991068 1039764330 /nfs/dbraw/zinc/76/43/30/1039764330.db2.gz BOYFCGANNOVSKY-KDOFPFPSSA-N 1 0 345.374 3.600 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc([C@@H](C)[NH3+])cc1 ZINC000584776174 1039783322 /nfs/dbraw/zinc/78/33/22/1039783322.db2.gz KXJZYEMHXHGBMT-CYBMUJFWSA-N 1 0 330.384 3.981 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(Cc1cccs1)C1CC1 ZINC000027107581 1039895972 /nfs/dbraw/zinc/89/59/72/1039895972.db2.gz SOXBUKCWAILCPL-UHFFFAOYSA-N 1 0 345.424 3.568 20 5 EHBDRO O=C(CC[N@H+](Cc1cccs1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000027109479 1039897869 /nfs/dbraw/zinc/89/78/69/1039897869.db2.gz JTHLFYRIYAWHIF-UHFFFAOYSA-N 1 0 345.424 3.650 20 5 EHBDRO Cc1ccc(Sc2ccc(C[N@@H+](C)[C@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883321 1039906137 /nfs/dbraw/zinc/90/61/37/1039906137.db2.gz CBQBIHZRHARFPP-CQSZACIVSA-N 1 0 346.452 3.867 20 5 EHBDRO C[C@@H]([N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000027132900 1039938545 /nfs/dbraw/zinc/93/85/45/1039938545.db2.gz NEJSCMALINTLCJ-SNVBAGLBSA-N 1 0 327.812 3.553 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](C)C1CCCCC1 ZINC000553436631 1040061786 /nfs/dbraw/zinc/06/17/86/1040061786.db2.gz HMKTYCJYBWSXIG-AWEZNQCLSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCO[C@@H](C(F)(F)F)C2)cc1 ZINC000584856299 1040113935 /nfs/dbraw/zinc/11/39/35/1040113935.db2.gz OMKYXWTUZQPQKI-UKRRQHHQSA-N 1 0 346.349 3.617 20 5 EHBDRO Cc1cc(N2CCC[C@@H](OCC3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000489933761 1040245610 /nfs/dbraw/zinc/24/56/10/1040245610.db2.gz IFEICCQALKAQJZ-MRXNPFEDSA-N 1 0 341.411 3.847 20 5 EHBDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893320987 1040253374 /nfs/dbraw/zinc/25/33/74/1040253374.db2.gz WQJQPUKDDMFUKM-LSDHHAIUSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000490019317 1040310766 /nfs/dbraw/zinc/31/07/66/1040310766.db2.gz JGWSERDMQYZCOK-GOSISDBHSA-N 1 0 325.412 3.714 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042479 1040317203 /nfs/dbraw/zinc/31/72/03/1040317203.db2.gz VQNBYVJQIFRNLF-LJQANCHMSA-N 1 0 326.396 3.767 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCCc2ccccc2F)n1 ZINC000479511045 1040331221 /nfs/dbraw/zinc/33/12/21/1040331221.db2.gz FYUWNVSZXPTCFJ-IRXDYDNUSA-N 1 0 346.406 3.637 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000481130208 1040386873 /nfs/dbraw/zinc/38/68/73/1040386873.db2.gz ZZIIZQGBWGAPDX-HOTGVXAUSA-N 1 0 339.439 3.692 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000486772277 1040427842 /nfs/dbraw/zinc/42/78/42/1040427842.db2.gz KPEPJLIIRNVDEB-CQSZACIVSA-N 1 0 349.431 3.587 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000481194434 1040472171 /nfs/dbraw/zinc/47/21/71/1040472171.db2.gz WALTYDWNKBGNKD-PAPYEOQZSA-N 1 0 333.432 3.645 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000123090148 1040483509 /nfs/dbraw/zinc/48/35/09/1040483509.db2.gz GECKAYUMESDVBT-XHDPSFHLSA-N 1 0 340.383 3.566 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847049 1040575291 /nfs/dbraw/zinc/57/52/91/1040575291.db2.gz LQPGOCDWAWMIPC-STQMWFEESA-N 1 0 342.399 3.806 20 5 EHBDRO Cc1nccn1C[C@@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115167 1040778543 /nfs/dbraw/zinc/77/85/43/1040778543.db2.gz HVUCDKTWRGWGNW-UGSOOPFHSA-N 1 0 342.443 3.748 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000600198327 1040821144 /nfs/dbraw/zinc/82/11/44/1040821144.db2.gz WMOWPLBDTPRTQR-ZBFHGGJFSA-N 1 0 348.443 3.703 20 5 EHBDRO Cc1nc(F)ccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278833042 1040883439 /nfs/dbraw/zinc/88/34/39/1040883439.db2.gz VDEUGTWFLLQMRL-UHFFFAOYSA-N 1 0 343.280 3.746 20 5 EHBDRO Cc1cnc(C2CC[NH+](CCOc3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000433161774 1040931196 /nfs/dbraw/zinc/93/11/96/1040931196.db2.gz KVPXLCRNCVGWCN-UHFFFAOYSA-N 1 0 347.440 3.618 20 5 EHBDRO CCC[C@@H](C)[N@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182645 1040944465 /nfs/dbraw/zinc/94/44/65/1040944465.db2.gz NEFVVCIDCFUKLO-LLVKDONJSA-N 1 0 346.374 3.868 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCc2ccccc2O)c2cc([N+](=O)[O-])ccc21 ZINC000433169942 1040966405 /nfs/dbraw/zinc/96/64/05/1040966405.db2.gz UCMDCRRRGMWHDZ-KRWDZBQOSA-N 1 0 326.396 3.855 20 5 EHBDRO CC[C@@H](C)[C@H](O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236869273 1040971566 /nfs/dbraw/zinc/97/15/66/1040971566.db2.gz DWBHLENVKLYQRD-MLGOLLRUSA-N 1 0 334.441 3.820 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721023 1041043661 /nfs/dbraw/zinc/04/36/61/1041043661.db2.gz FJQLBDLEXLWSPX-LSDHHAIUSA-N 1 0 342.399 3.655 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000570986057 1041157987 /nfs/dbraw/zinc/15/79/87/1041157987.db2.gz ZHXFJEFEDQBOHG-LJQANCHMSA-N 1 0 348.406 3.617 20 5 EHBDRO CC(=O)c1cc(NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000587257381 1041167620 /nfs/dbraw/zinc/16/76/20/1041167620.db2.gz OBXUWRGXZJIHDH-GASCZTMLSA-N 1 0 347.459 3.967 20 5 EHBDRO CC(=O)Oc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000155721954 1041197013 /nfs/dbraw/zinc/19/70/13/1041197013.db2.gz LXAVTOUNKHEOEC-UHFFFAOYSA-N 1 0 340.379 3.685 20 5 EHBDRO Cc1cc([C@@](C)(O)C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000164181627 1041220917 /nfs/dbraw/zinc/22/09/17/1041220917.db2.gz VICPYIUKRXCTIM-DJJJIMSYSA-N 1 0 346.427 3.623 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](CO)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433286165 1041222720 /nfs/dbraw/zinc/22/27/20/1041222720.db2.gz UFRXWXZZOMGPSC-ROUUACIJSA-N 1 0 344.386 3.780 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCCc2ccccn2)c2cc([N+](=O)[O-])ccc21 ZINC000433295456 1041246830 /nfs/dbraw/zinc/24/68/30/1041246830.db2.gz PBTGWXZIUJULCH-SFHVURJKSA-N 1 0 325.412 3.935 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC1(C)C ZINC000419314400 1041270949 /nfs/dbraw/zinc/27/09/49/1041270949.db2.gz HYVWIHKXJYFOEK-AAEUAGOBSA-N 1 0 339.823 3.601 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccc(-c2cc[nH]n2)o1 ZINC000433319987 1041276307 /nfs/dbraw/zinc/27/63/07/1041276307.db2.gz KIDQUSCIGWADBP-UHFFFAOYSA-N 1 0 346.774 3.564 20 5 EHBDRO Cc1ccc(CN(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000093889139 1042577310 /nfs/dbraw/zinc/57/73/10/1042577310.db2.gz BOLIXRGAGDXEAI-LFPIHBKWSA-N 1 0 346.452 3.834 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCCO2 ZINC000344049568 1043169155 /nfs/dbraw/zinc/16/91/55/1043169155.db2.gz PHKPWWQCKQPXAI-KRWDZBQOSA-N 1 0 326.396 3.949 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCn1ccnc1C ZINC000344892317 1044657332 /nfs/dbraw/zinc/65/73/32/1044657332.db2.gz XRSFXAJTZFKMDM-QINSGFPZSA-N 1 0 328.416 3.573 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000572422530 1044875101 /nfs/dbraw/zinc/87/51/01/1044875101.db2.gz BANDVKYTMFTCCD-XHDPSFHLSA-N 1 0 326.352 3.662 20 5 EHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697750 1126856740 /nfs/dbraw/zinc/85/67/40/1126856740.db2.gz SIPRZQUQFUHMJU-DZGCQCFKSA-N 1 0 329.400 3.913 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(C(=O)C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000122891391 1127133976 /nfs/dbraw/zinc/13/39/76/1127133976.db2.gz LJTPWOUGRZQAGU-QGZVFWFLSA-N 1 0 347.459 3.673 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000083170875 1127221142 /nfs/dbraw/zinc/22/11/42/1127221142.db2.gz AVFYGWYVPCSIGW-ZDUSSCGKSA-N 1 0 341.342 3.865 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000764490315 1127498418 /nfs/dbraw/zinc/49/84/18/1127498418.db2.gz PFKJYYJDIXNFRW-UHFFFAOYSA-N 1 0 341.367 3.710 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039955 1127568887 /nfs/dbraw/zinc/56/88/87/1127568887.db2.gz USRGYCZPIAHOLJ-DZGCQCFKSA-N 1 0 348.472 3.816 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1(C(F)(F)F)CC1)C1CC1 ZINC000552099437 1127578533 /nfs/dbraw/zinc/57/85/33/1127578533.db2.gz IWPDLVDLKNEVPY-CYBMUJFWSA-N 1 0 328.334 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C3CCCC3)C2)cc1OC(F)F ZINC000301390937 1127741643 /nfs/dbraw/zinc/74/16/43/1127741643.db2.gz GSUPZOMURGVWEL-LBPRGKRZSA-N 1 0 341.358 3.625 20 5 EHBDRO Cc1cnc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444914 1127892057 /nfs/dbraw/zinc/89/20/57/1127892057.db2.gz NRPXYXQGNBOLEV-XJKSGUPXSA-N 1 0 346.456 3.855 20 5 EHBDRO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553337308 1128411193 /nfs/dbraw/zinc/41/11/93/1128411193.db2.gz FJPYNSXREXBRDB-YPMHNXCESA-N 1 0 343.349 3.677 20 5 EHBDRO O=C(CCCC[NH2+]Cc1ccccc1[N+](=O)[O-])OCc1ccccc1 ZINC000273167122 1128446561 /nfs/dbraw/zinc/44/65/61/1128446561.db2.gz JVWCVELDZLDFQU-UHFFFAOYSA-N 1 0 342.395 3.598 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000301553670 1128496753 /nfs/dbraw/zinc/49/67/53/1128496753.db2.gz WBHHQCRTJIBFBZ-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(C)n1)[NH+](C)C ZINC000553706714 1128515379 /nfs/dbraw/zinc/51/53/79/1128515379.db2.gz YVCRVVBTKWNSQI-KSSFIOAISA-N 1 0 328.416 3.710 20 5 EHBDRO Cc1nc(Nc2cccc(C[NH+]3CCSCC3)c2)ccc1[N+](=O)[O-] ZINC000301627505 1128761183 /nfs/dbraw/zinc/76/11/83/1128761183.db2.gz HUNHXCBVVLPVHS-UHFFFAOYSA-N 1 0 344.440 3.591 20 5 EHBDRO Cc1cc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000301650586 1128849663 /nfs/dbraw/zinc/84/96/63/1128849663.db2.gz GHWWXSUNMNQIAG-INIZCTEOSA-N 1 0 346.475 3.779 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000172169427 1120207306 /nfs/dbraw/zinc/20/73/06/1120207306.db2.gz RVSBCEHZEOLQQI-WDEREUQCSA-N 1 0 339.823 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000609196220 1120543561 /nfs/dbraw/zinc/54/35/61/1120543561.db2.gz HBVXKTCUJRYNNT-MRXNPFEDSA-N 1 0 344.386 3.992 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1c2cc(F)ccc2C[C@@H]1C ZINC000542497100 1120789069 /nfs/dbraw/zinc/78/90/69/1120789069.db2.gz XDWMAVAVIXEWNJ-VOJFVSQTSA-N 1 0 330.359 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H](CCO)C1CCCCC1 ZINC000494803689 1120846774 /nfs/dbraw/zinc/84/67/74/1120846774.db2.gz HQKFRJNJDNTSGJ-HNNXBMFYSA-N 1 0 326.824 3.669 20 5 EHBDRO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[NH+]1CCCC1 ZINC000301080868 1121471944 /nfs/dbraw/zinc/47/19/44/1121471944.db2.gz POQREJJVMGRELG-QGZVFWFLSA-N 1 0 328.416 3.675 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000193630281 1121514734 /nfs/dbraw/zinc/51/47/34/1121514734.db2.gz OFUDUTQNCVINGX-OAHLLOKOSA-N 1 0 327.384 3.664 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)nc1 ZINC000301086242 1121521915 /nfs/dbraw/zinc/52/19/15/1121521915.db2.gz MUFWAQSBSYLRTF-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N(C)C ZINC000609223261 1121569003 /nfs/dbraw/zinc/56/90/03/1121569003.db2.gz CHQFUIWLOAKYPU-LLVKDONJSA-N 1 0 337.807 3.548 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cnc2ccsc2c1 ZINC000089580691 1121633775 /nfs/dbraw/zinc/63/37/75/1121633775.db2.gz YBTNMJHSSXEVGV-LBPRGKRZSA-N 1 0 343.408 3.934 20 5 EHBDRO COc1cc(CN(C)Cc2ccc(F)cc2C)c([N+](=O)[O-])cc1F ZINC000488023523 1121634352 /nfs/dbraw/zinc/63/43/52/1121634352.db2.gz IBKBFWOZEFDIBL-UHFFFAOYSA-N 1 0 336.338 3.822 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCN(C/C=C\c2ccccc2)CC1 ZINC000301100849 1121692224 /nfs/dbraw/zinc/69/22/24/1121692224.db2.gz OIRKZNIQPGXCHA-YVMONPNESA-N 1 0 341.386 3.569 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301112580 1121953145 /nfs/dbraw/zinc/95/31/45/1121953145.db2.gz WDUXIYISRRGPIF-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272722562 1121963861 /nfs/dbraw/zinc/96/38/61/1121963861.db2.gz XSTVDMBNNZSCNK-OWCLPIDISA-N 1 0 331.460 3.898 20 5 EHBDRO C[C@@H](CCCO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000154131649 1122254495 /nfs/dbraw/zinc/25/44/95/1122254495.db2.gz SMYPDTLGADPZHS-ZDUSSCGKSA-N 1 0 348.374 3.777 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000301788529 1129071199 /nfs/dbraw/zinc/07/11/99/1129071199.db2.gz PWIIBULWHPASRI-DOMZBBRYSA-N 1 0 335.835 3.701 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CC)C(C)(C)O ZINC000556237699 1122890149 /nfs/dbraw/zinc/89/01/49/1122890149.db2.gz FCZXZOPBBZTCDO-WFASDCNBSA-N 1 0 326.462 3.605 20 5 EHBDRO CC(C)c1ccc(C[N@H+](C)C[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894618 1123171999 /nfs/dbraw/zinc/17/19/99/1123171999.db2.gz CLXAZBCJPHOICK-SFHVURJKSA-N 1 0 342.439 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000255437461 1129107934 /nfs/dbraw/zinc/10/79/34/1129107934.db2.gz PDGVPFBDGGNBAQ-CNRGFGOASA-N 1 0 329.444 3.558 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000919962541 1123247894 /nfs/dbraw/zinc/24/78/94/1123247894.db2.gz LBLKHLYAVKGUDZ-KRWDZBQOSA-N 1 0 329.375 3.983 20 5 EHBDRO C[N@@H+]1CCC[C@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486195 1123375039 /nfs/dbraw/zinc/37/50/39/1123375039.db2.gz SGADYMTWMPUJBV-QMMMGPOBSA-N 1 0 337.729 3.773 20 5 EHBDRO CCC(CC)(CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@@H](C)c1ccccc1 ZINC000609513114 1123602856 /nfs/dbraw/zinc/60/28/56/1123602856.db2.gz YHIHKDNBVOURSU-AWEZNQCLSA-N 1 0 345.447 3.650 20 5 EHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001842 1123710446 /nfs/dbraw/zinc/71/04/46/1123710446.db2.gz DSIHTARBBOQNJP-CXAGYDPISA-N 1 0 334.416 3.862 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC000610003515 1123711686 /nfs/dbraw/zinc/71/16/86/1123711686.db2.gz GUFJCGIUAPDLOV-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO CCC[NH+]1CCC(N[C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652743 1123727618 /nfs/dbraw/zinc/72/76/18/1123727618.db2.gz MSVNPZWOQGSMKV-CQSZACIVSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccnc(NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000301248001 1123734201 /nfs/dbraw/zinc/73/42/01/1123734201.db2.gz BGMDYQJVGRROSV-AWEZNQCLSA-N 1 0 328.416 3.840 20 5 EHBDRO COc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc(OC)c1 ZINC000195677104 1123734373 /nfs/dbraw/zinc/73/43/73/1123734373.db2.gz HJTMVJMMBKFRJC-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)N(C)C1CC1 ZINC000237581110 1123778711 /nfs/dbraw/zinc/77/87/11/1123778711.db2.gz JXJHZPSVHZBLOJ-CYBMUJFWSA-N 1 0 345.468 3.896 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C(C)(C)CO)cc2[N+](=O)[O-])cc1 ZINC000237775575 1123852084 /nfs/dbraw/zinc/85/20/84/1123852084.db2.gz KZKAUSIRVIWZNI-UHFFFAOYSA-N 1 0 346.452 3.915 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](c1ccnn1C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000615967266 1123919406 /nfs/dbraw/zinc/91/94/06/1123919406.db2.gz YLNQGKUIPOQFEZ-IAGOWNOFSA-N 1 0 330.432 3.809 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cnn(C)c2C(F)(F)F)cc1[N+](=O)[O-] ZINC000181842321 1125058156 /nfs/dbraw/zinc/05/81/56/1125058156.db2.gz FIKMGIJLALGOEA-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC(C[NH+]3CCCC3)CC2)c(Cl)c1 ZINC000182062895 1125140869 /nfs/dbraw/zinc/14/08/69/1125140869.db2.gz KDZFHAFMMJFUPN-UHFFFAOYSA-N 1 0 337.851 3.556 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)c1 ZINC000182566839 1125331863 /nfs/dbraw/zinc/33/18/63/1125331863.db2.gz TXGVSLWQWDGODP-INIZCTEOSA-N 1 0 334.807 3.576 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000182937445 1125406463 /nfs/dbraw/zinc/40/64/63/1125406463.db2.gz NOAPTCRONQZXQE-GFCCVEGCSA-N 1 0 330.388 3.703 20 5 EHBDRO CO[C@H](C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808755 1125410437 /nfs/dbraw/zinc/41/04/37/1125410437.db2.gz ZIJBKBQBJGCBEK-LJQANCHMSA-N 1 0 326.396 3.947 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735493607 1131353639 /nfs/dbraw/zinc/35/36/39/1131353639.db2.gz YRAHKXJKGUYCEQ-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO CCOc1cccc(NC[C@H](c2cccs2)[NH+](C)C)c1[N+](=O)[O-] ZINC000183135192 1125453912 /nfs/dbraw/zinc/45/39/12/1125453912.db2.gz OWEDYPDYULTHII-CYBMUJFWSA-N 1 0 335.429 3.770 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000466418519 1129438179 /nfs/dbraw/zinc/43/81/79/1129438179.db2.gz YKTBXQYEJCQQQJ-YHTSIIMFSA-N 1 0 332.444 3.777 20 5 EHBDRO CCOc1cc(NCc2ccc(CC[NH+](C)C)cc2)ccc1[N+](=O)[O-] ZINC000466442060 1129454289 /nfs/dbraw/zinc/45/42/89/1129454289.db2.gz SFUGEMQYQDLJSG-UHFFFAOYSA-N 1 0 343.427 3.710 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000301972796 1129466016 /nfs/dbraw/zinc/46/60/16/1129466016.db2.gz IQIMZINESXNHAG-ZDUSSCGKSA-N 1 0 339.411 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439706 1129489989 /nfs/dbraw/zinc/48/99/89/1129489989.db2.gz HHOAKQILQQZDBW-HXUWFJFHSA-N 1 0 340.423 3.553 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000922561273 1129571057 /nfs/dbraw/zinc/57/10/57/1129571057.db2.gz OCFPMKPLUZROOC-UHFFFAOYSA-N 1 0 334.803 3.647 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H](C(=O)NC(C)C)C2)cccc1[N+](=O)[O-] ZINC000124776647 1129632751 /nfs/dbraw/zinc/63/27/51/1129632751.db2.gz QKVUGRDRFCSEPD-JYJNAYRXSA-N 1 0 347.459 3.637 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)C2(C[NH+](C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000331118919 1129653097 /nfs/dbraw/zinc/65/30/97/1129653097.db2.gz AGZVBEULARIUAS-OAHLLOKOSA-N 1 0 347.459 3.593 20 5 EHBDRO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000392537339 1129716234 /nfs/dbraw/zinc/71/62/34/1129716234.db2.gz SMLWXNRNXNLYBG-NSHDSACASA-N 1 0 346.353 3.543 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000156672569 1129733715 /nfs/dbraw/zinc/73/37/15/1129733715.db2.gz BDCVBZKXOCGYIK-AWEZNQCLSA-N 1 0 329.400 3.938 20 5 EHBDRO O=[N+]([O-])c1ccsc1N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000302013103 1129763437 /nfs/dbraw/zinc/76/34/37/1129763437.db2.gz ZQZTYSPZFDRXMG-UHFFFAOYSA-N 1 0 345.468 3.801 20 5 EHBDRO C[C@@H]1CCN(c2sccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000302016334 1129763493 /nfs/dbraw/zinc/76/34/93/1129763493.db2.gz LVBGUAKCUYQTLL-CQSZACIVSA-N 1 0 331.441 3.757 20 5 EHBDRO Cc1cc(N2CC[C@@]3(O)CCCC[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302066817 1129766313 /nfs/dbraw/zinc/76/63/13/1129766313.db2.gz FKQBODPHPLSWKL-LIRRHRJNSA-N 1 0 341.411 3.583 20 5 EHBDRO C[C@@H](CCNc1ccc2cc([N+](=O)[O-])ccc2n1)[NH+]1CCCCC1 ZINC000302182839 1129771837 /nfs/dbraw/zinc/77/18/37/1129771837.db2.gz SJMCVEUPVKRJLX-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CN(CCCn1ccnc1)c1c(Cl)cc([N+](=O)[O-])cc1Cl ZINC000302262131 1129774626 /nfs/dbraw/zinc/77/46/26/1129774626.db2.gz DAMPCNHXYIEHNX-UHFFFAOYSA-N 1 0 329.187 3.625 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000056196231 1129805984 /nfs/dbraw/zinc/80/59/84/1129805984.db2.gz QBDOCWXEWJGZFW-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196574 1129806118 /nfs/dbraw/zinc/80/61/18/1129806118.db2.gz TUFCMTDDOWAITG-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000132102587 1129875886 /nfs/dbraw/zinc/87/58/86/1129875886.db2.gz CFBOFYQGOWCHAU-OALUTQOASA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC000766045805 1129935682 /nfs/dbraw/zinc/93/56/82/1129935682.db2.gz VXBJXQCNXVMYRN-PXAZEXFGSA-N 1 0 326.400 3.730 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@@H]21 ZINC000133725272 1129960958 /nfs/dbraw/zinc/96/09/58/1129960958.db2.gz VMMSMZOUGUFLHJ-FZMZJTMJSA-N 1 0 343.349 3.534 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCc1cccc(C[NH+]2CCCC2)c1 ZINC000171277358 1130042232 /nfs/dbraw/zinc/04/22/32/1130042232.db2.gz LHEXLFUAYDWTOB-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328734 1130208045 /nfs/dbraw/zinc/20/80/45/1130208045.db2.gz YVWLGZGODDJRDQ-OLZOCXBDSA-N 1 0 339.395 3.891 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000245553737 1130237649 /nfs/dbraw/zinc/23/76/49/1130237649.db2.gz QSXLGQPTBGGAEI-YEWWUXTCSA-N 1 0 342.443 3.699 20 5 EHBDRO CC[C@@](C)([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000173510440 1130238946 /nfs/dbraw/zinc/23/89/46/1130238946.db2.gz GHAWCBCWCCFFBK-MRXNPFEDSA-N 1 0 335.429 3.735 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000246398423 1130377768 /nfs/dbraw/zinc/37/77/68/1130377768.db2.gz LNVVYNVYKYFIAO-UAGQMJEPSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H]([NH+]3CCCCC3)C2)c(C(F)(F)F)c1 ZINC000730806952 1130741649 /nfs/dbraw/zinc/74/16/49/1130741649.db2.gz PJYVCHBPLMXMLP-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2csc3ccccc23)cc1 ZINC000731678408 1130832537 /nfs/dbraw/zinc/83/25/37/1130832537.db2.gz LYIJFJAFQPWFDF-INIZCTEOSA-N 1 0 328.393 3.633 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1c(F)cccc1F)CC2 ZINC001172896983 1131880422 /nfs/dbraw/zinc/88/04/22/1131880422.db2.gz VLVOATSQAHBVKU-AWEZNQCLSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCc3ccccc3C1)CC2 ZINC001172900866 1131883553 /nfs/dbraw/zinc/88/35/53/1131883553.db2.gz GYLGMTNFLYDWOM-PMACEKPBSA-N 1 0 336.435 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1COCc3ccccc31)CC2 ZINC001172899703 1131883708 /nfs/dbraw/zinc/88/37/08/1131883708.db2.gz FABOIONZOMNHMT-YLJYHZDGSA-N 1 0 338.407 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc3ncoc3c1)CC2 ZINC001172903009 1131884557 /nfs/dbraw/zinc/88/45/57/1131884557.db2.gz OTHHSRGUGNKQEY-INIZCTEOSA-N 1 0 337.379 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccncc1Cl)CC2 ZINC001172902656 1131885551 /nfs/dbraw/zinc/88/55/51/1131885551.db2.gz LMSSMONYJMHZMT-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1Cc3ccc(F)cc3C1)CC2 ZINC001172906756 1131888242 /nfs/dbraw/zinc/88/82/42/1131888242.db2.gz ORHMFRPDMVUNQN-RBUKOAKNSA-N 1 0 340.398 3.738 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCOC3(CCCCC3)C1)CC2 ZINC001172919218 1131903876 /nfs/dbraw/zinc/90/38/76/1131903876.db2.gz FJECSIYOXIKXDK-GOSISDBHSA-N 1 0 344.455 3.877 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC4(CCCC4)C3)c2)cc1 ZINC000743390563 1131909144 /nfs/dbraw/zinc/90/91/44/1131909144.db2.gz GAPXXCZXVIDYNE-UHFFFAOYSA-N 1 0 326.400 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H](c1ccncc1)C1CC1)CC2 ZINC001172912068 1131917654 /nfs/dbraw/zinc/91/76/54/1131917654.db2.gz LNYKRBOBIRZLGD-AZUAARDMSA-N 1 0 337.423 3.978 20 5 EHBDRO CCC(CC)[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015415 1131935304 /nfs/dbraw/zinc/93/53/04/1131935304.db2.gz PLNOAXBNNNICFH-UHFFFAOYSA-N 1 0 341.402 3.962 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2cccc(F)c2)c1F ZINC001173174823 1131991717 /nfs/dbraw/zinc/99/17/17/1131991717.db2.gz DAEAPLSPXDQZAE-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccnc1 ZINC001173187730 1131994309 /nfs/dbraw/zinc/99/43/09/1131994309.db2.gz GHQUYVQTUKQQAQ-IUODEOHRSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1c(F)ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173217100 1132002088 /nfs/dbraw/zinc/00/20/88/1132002088.db2.gz LMVWJHNWMXQMPP-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2cc(F)ccc21 ZINC001173220330 1132003915 /nfs/dbraw/zinc/00/39/15/1132003915.db2.gz YKVCCFYUSBNFOJ-YVEFUNNKSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccnc(F)c1)C1CC1 ZINC001173220671 1132004252 /nfs/dbraw/zinc/00/42/52/1132004252.db2.gz DTWYFUYIJWVLQZ-KPZWWZAWSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223967 1132005287 /nfs/dbraw/zinc/00/52/87/1132005287.db2.gz CKWYELAXGZOPQT-ZKYQVNSYSA-N 1 0 334.313 3.606 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC001173225345 1132006721 /nfs/dbraw/zinc/00/67/21/1132006721.db2.gz JMPZREPYBLQDKL-PXAZEXFGSA-N 1 0 330.815 3.936 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccccn2)CCC1 ZINC001173226659 1132007013 /nfs/dbraw/zinc/00/70/13/1132007013.db2.gz YHMMOCRWBXGNNI-MRXNPFEDSA-N 1 0 339.439 3.923 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173229401 1132008545 /nfs/dbraw/zinc/00/85/45/1132008545.db2.gz UEOARKIPPZGBHD-CQSZACIVSA-N 1 0 326.396 3.593 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)c1cccnn1 ZINC001173231526 1132009314 /nfs/dbraw/zinc/00/93/14/1132009314.db2.gz ZZXJPVKNUUNOIY-YWZLYKJASA-N 1 0 348.406 3.695 20 5 EHBDRO COc1ccc(CC[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173232749 1132010105 /nfs/dbraw/zinc/01/01/05/1132010105.db2.gz HNKHKFZLCJWVHP-OAHLLOKOSA-N 1 0 328.412 3.709 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC/C=C/c1cccnc1 ZINC001173233419 1132010609 /nfs/dbraw/zinc/01/06/09/1132010609.db2.gz WNEIFMGALGZERO-GIZXNFQBSA-N 1 0 325.412 3.956 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1ccc(Cl)cc1 ZINC001173210393 1132013621 /nfs/dbraw/zinc/01/36/21/1132013621.db2.gz KHNHESJRAVQZGV-ZDUSSCGKSA-N 1 0 334.803 3.848 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCCC1)C1CCN(C)CC1 ZINC001173238089 1132027736 /nfs/dbraw/zinc/02/77/36/1132027736.db2.gz MXBKHSMOVKBUDF-MRXNPFEDSA-N 1 0 345.487 3.865 20 5 EHBDRO C[C@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000746076757 1132360926 /nfs/dbraw/zinc/36/09/26/1132360926.db2.gz PNMGMYFHMMPBDV-IJLUTSLNSA-N 1 0 340.807 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+](CCc2ccccc2)C2CC2)cc1 ZINC000746114430 1132377456 /nfs/dbraw/zinc/37/74/56/1132377456.db2.gz HGBNGDPRAZNVLJ-UHFFFAOYSA-N 1 0 326.396 3.681 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC001168976061 1132616890 /nfs/dbraw/zinc/61/68/90/1132616890.db2.gz YXQKYVLSERZMBZ-OALUTQOASA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001168972635 1132623464 /nfs/dbraw/zinc/62/34/64/1132623464.db2.gz NNKSZHARHWLXIB-VHSXEESVSA-N 1 0 336.741 3.894 20 5 EHBDRO Cc1cccc(-n2c3cc(Cl)ccc3nc2CCC[NH3+])c1[N+](=O)[O-] ZINC001168994490 1132626566 /nfs/dbraw/zinc/62/65/66/1132626566.db2.gz STPLVMFNGUFONP-UHFFFAOYSA-N 1 0 344.802 3.787 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccc(C(F)(F)F)cn2)C2CC2)C1 ZINC001168998094 1132627359 /nfs/dbraw/zinc/62/73/59/1132627359.db2.gz ICAZZWRNJNZZTQ-YVLXSGLVSA-N 1 0 343.349 3.587 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168988319 1132635097 /nfs/dbraw/zinc/63/50/97/1132635097.db2.gz QVVVSYMNGGFUEZ-FZMZJTMJSA-N 1 0 341.249 3.719 20 5 EHBDRO CC1(C)OC2(CC[NH+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169040159 1132637809 /nfs/dbraw/zinc/63/78/09/1132637809.db2.gz YKHUPARIRPJWAY-HOTGVXAUSA-N 1 0 344.455 3.688 20 5 EHBDRO C[C@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC001175759555 1132759485 /nfs/dbraw/zinc/75/94/85/1132759485.db2.gz XITDGFOHENTEOR-SNVBAGLBSA-N 1 0 327.222 3.978 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1Nc1cccn(CC2CC2)c1=O ZINC001169451062 1132759540 /nfs/dbraw/zinc/75/95/40/1132759540.db2.gz QXXVJVBRWSIILU-UHFFFAOYSA-N 1 0 326.464 3.598 20 5 EHBDRO CCOc1ccc(CC[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC001176832833 1133004876 /nfs/dbraw/zinc/00/48/76/1133004876.db2.gz KFMBXLFNWRAJQJ-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO C[NH+](C)C1(CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCC1 ZINC001177133521 1133033595 /nfs/dbraw/zinc/03/35/95/1133033595.db2.gz XMYGUZZPPJYUEX-UHFFFAOYSA-N 1 0 343.427 3.819 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CN1CCC[C@@H](C)C1 ZINC001177474814 1133066262 /nfs/dbraw/zinc/06/62/62/1133066262.db2.gz HCKJYVKLBDDKOT-YKOQKNPDSA-N 1 0 331.460 3.708 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000768093618 1133091540 /nfs/dbraw/zinc/09/15/40/1133091540.db2.gz PABCGYAWAFGTPT-LSDHHAIUSA-N 1 0 335.448 3.519 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178304420 1133155209 /nfs/dbraw/zinc/15/52/09/1133155209.db2.gz GYJHXSDVWYRZIU-FZKQIMNGSA-N 1 0 332.375 3.908 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CCCN2CC(F)F)cc1[N+](=O)[O-] ZINC001179160556 1133233547 /nfs/dbraw/zinc/23/35/47/1133233547.db2.gz ZLNIEVHYOSONCK-AWEZNQCLSA-N 1 0 341.402 3.537 20 5 EHBDRO Cc1nn(-c2ccccc2)cc1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001179387069 1133248936 /nfs/dbraw/zinc/24/89/36/1133248936.db2.gz XHXAYSHXXPLSKH-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cnc(-c2ccccc2)nc1)c1ccccc1[N+](=O)[O-] ZINC001179685273 1133270377 /nfs/dbraw/zinc/27/03/77/1133270377.db2.gz IVKBFMUCWNVBKE-HNNXBMFYSA-N 1 0 348.406 3.945 20 5 EHBDRO Cc1cc(CN(C)Cc2ccccc2[N+](=O)[O-])c2c(n1)CCCC2 ZINC001180011596 1133316448 /nfs/dbraw/zinc/31/64/48/1133316448.db2.gz PLBKSBVJNRCHTO-UHFFFAOYSA-N 1 0 325.412 3.809 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954225 1133365729 /nfs/dbraw/zinc/36/57/29/1133365729.db2.gz QJRIHCWEQBEFPK-VLXJIEOASA-N 1 0 344.386 3.775 20 5 EHBDRO Cc1nn(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000770669182 1133457120 /nfs/dbraw/zinc/45/71/20/1133457120.db2.gz BQOZKNXVQIFMKS-CYBMUJFWSA-N 1 0 328.416 3.723 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC1CC1 ZINC000771283681 1133530248 /nfs/dbraw/zinc/53/02/48/1133530248.db2.gz HWHDKSINUNSYOS-UHFFFAOYSA-N 1 0 331.460 3.933 20 5 EHBDRO O=[N+]([O-])c1cc2cnn(C[N@H+](C3CC3)C3CCCC3)c2c(Cl)c1 ZINC000774634402 1133809158 /nfs/dbraw/zinc/80/91/58/1133809158.db2.gz HJQZVXWRPOSAMI-UHFFFAOYSA-N 1 0 334.807 3.962 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1COC2(CCCCC2)O1 ZINC000786821907 1133911164 /nfs/dbraw/zinc/91/11/64/1133911164.db2.gz WIFPPDWACRINMY-QWSHFYNQSA-N 1 0 346.427 3.664 20 5 EHBDRO C[C@@H](OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879804 1133923560 /nfs/dbraw/zinc/92/35/60/1133923560.db2.gz DVQCHOSYMBRABG-DYVFJYSZSA-N 1 0 332.400 3.606 20 5 EHBDRO Cc1cscc1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000786925985 1133929788 /nfs/dbraw/zinc/92/97/88/1133929788.db2.gz JBQQDXPGRAVHEO-UHFFFAOYSA-N 1 0 331.441 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CCc2ccc(O)cc2CC1 ZINC000746666723 1133986480 /nfs/dbraw/zinc/98/64/80/1133986480.db2.gz PPCBXXNUHCDAGK-UHFFFAOYSA-N 1 0 332.787 3.555 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001184873304 1134000354 /nfs/dbraw/zinc/00/03/54/1134000354.db2.gz BBNPOITXZZUSPF-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC001184874887 1134001291 /nfs/dbraw/zinc/00/12/91/1134001291.db2.gz XCXGYCYZCFGVIP-LLVKDONJSA-N 1 0 344.242 3.966 20 5 EHBDRO O=C(O[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120042 1134079516 /nfs/dbraw/zinc/07/95/16/1134079516.db2.gz PQAPPXSIVUFZQG-JSGCOSHPSA-N 1 0 346.408 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000774883952 1134092597 /nfs/dbraw/zinc/09/25/97/1134092597.db2.gz FTCFWZAMIJRFEL-CYBMUJFWSA-N 1 0 345.330 3.632 20 5 EHBDRO C[N@H+](CCOc1cccc(Cl)c1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788471806 1134129480 /nfs/dbraw/zinc/12/94/80/1134129480.db2.gz UDAHJPFBAOMKSI-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788609356 1134145552 /nfs/dbraw/zinc/14/55/52/1134145552.db2.gz HRSGIICIROAYLN-APPDUMDISA-N 1 0 349.818 3.869 20 5 EHBDRO C[C@@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788640405 1134154499 /nfs/dbraw/zinc/15/44/99/1134154499.db2.gz AGJLPDXEBWDKTC-ACJLOTCBSA-N 1 0 325.412 3.849 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688722 1134157772 /nfs/dbraw/zinc/15/77/72/1134157772.db2.gz GTQQPQPTWQVQQF-IUUKEHGRSA-N 1 0 347.390 3.743 20 5 EHBDRO COc1cccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788668256 1134159289 /nfs/dbraw/zinc/15/92/89/1134159289.db2.gz AFDIJDCWUJGKEF-ZDUSSCGKSA-N 1 0 343.427 3.814 20 5 EHBDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000788795631 1134170261 /nfs/dbraw/zinc/17/02/61/1134170261.db2.gz AOYODKVMERTDQM-BKTGTZMESA-N 1 0 343.427 3.586 20 5 EHBDRO C[C@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788780316 1134174844 /nfs/dbraw/zinc/17/48/44/1134174844.db2.gz CTRMGSHPONWQPN-OPFPJEHXSA-N 1 0 335.448 3.811 20 5 EHBDRO C[NH+](C)CCCn1cc(Nc2cccc3nc4ccccc4nc32)cn1 ZINC001187162822 1134299650 /nfs/dbraw/zinc/29/96/50/1134299650.db2.gz ITMBSFVEOLVDTB-UHFFFAOYSA-N 1 0 346.438 3.675 20 5 EHBDRO CC1([NH+]2CCC2)CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC001187799264 1134384044 /nfs/dbraw/zinc/38/40/44/1134384044.db2.gz QYCPLMVOGNXPHL-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc3c(c2)COC(C)(C)O3)cccc1[N+](=O)[O-] ZINC000792184971 1134664396 /nfs/dbraw/zinc/66/43/96/1134664396.db2.gz YINKJKSALUGQMD-UHFFFAOYSA-N 1 0 342.395 3.838 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCc2cccs2)c([N+](=O)[O-])c1 ZINC001170296618 1134737621 /nfs/dbraw/zinc/73/76/21/1134737621.db2.gz GUWIRWBRIFYFEE-ZDUSSCGKSA-N 1 0 334.441 3.818 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC001170297892 1134738103 /nfs/dbraw/zinc/73/81/03/1134738103.db2.gz VEOMCKLMMGAVEX-PPYMECGQSA-N 1 0 326.396 3.837 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3c2cccc3F)c([N+](=O)[O-])c1 ZINC001170305490 1134739515 /nfs/dbraw/zinc/73/95/15/1134739515.db2.gz LRNPNEDMWAFSER-KZULUSFZSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCc3ccncc32)c([N+](=O)[O-])c1 ZINC001170325830 1134748371 /nfs/dbraw/zinc/74/83/71/1134748371.db2.gz AMJKJBIBVHYDRI-ACJLOTCBSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329060 1134749044 /nfs/dbraw/zinc/74/90/44/1134749044.db2.gz NVNNDWBXFAZDSU-KBXCAEBGSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329028 1134749429 /nfs/dbraw/zinc/74/94/29/1134749429.db2.gz NGJAINQNLUDCDD-NHYWBVRUSA-N 1 0 346.349 3.604 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001170364308 1134756493 /nfs/dbraw/zinc/75/64/93/1134756493.db2.gz CEUFCHJGWNYZML-AWEZNQCLSA-N 1 0 341.839 3.991 20 5 EHBDRO CC(C)[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191538674 1134881322 /nfs/dbraw/zinc/88/13/22/1134881322.db2.gz CKZWOWSYDQYTQY-LLVKDONJSA-N 1 0 327.222 3.835 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000793238150 1134885635 /nfs/dbraw/zinc/88/56/35/1134885635.db2.gz OAQYAIVUXXLFTE-PKOBYXMFSA-N 1 0 328.412 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000804564494 1135121864 /nfs/dbraw/zinc/12/18/64/1135121864.db2.gz WWXZAOGNVYCPLP-DOMZBBRYSA-N 1 0 335.835 3.701 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781933 1135199653 /nfs/dbraw/zinc/19/96/53/1135199653.db2.gz LBNHQALBKBOHIH-RYUDHWBXSA-N 1 0 348.359 3.637 20 5 EHBDRO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804814195 1135203137 /nfs/dbraw/zinc/20/31/37/1135203137.db2.gz ZYCKENUMWVHASF-DGCLKSJQSA-N 1 0 343.349 3.677 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCC[NH+](C(C)C)C(C)C)c1 ZINC000747225306 1135225710 /nfs/dbraw/zinc/22/57/10/1135225710.db2.gz DLDAGDXGVMHJFS-UHFFFAOYSA-N 1 0 327.400 3.663 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCCCC2 ZINC001194476959 1135276448 /nfs/dbraw/zinc/27/64/48/1135276448.db2.gz GJINHGCPKJEPKG-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[C@H](c1ccccc1OC)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834348 1135333005 /nfs/dbraw/zinc/33/30/05/1135333005.db2.gz FXIKGSHGOYLJKN-MSOLQXFVSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccc(C)cc1C)CC(C)C ZINC001195413701 1135420846 /nfs/dbraw/zinc/42/08/46/1135420846.db2.gz QTSUAKATQJGOQV-UHFFFAOYSA-N 1 0 344.459 3.875 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC001195842863 1135479976 /nfs/dbraw/zinc/47/99/76/1135479976.db2.gz IKJSFKKMXFPHHX-UHFFFAOYSA-N 1 0 341.411 3.791 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@]1(C)Cc1ccc(C)cc1 ZINC001196595337 1135582297 /nfs/dbraw/zinc/58/22/97/1135582297.db2.gz SBTSZDVGSYZOQJ-IBGZPJMESA-N 1 0 342.443 3.505 20 5 EHBDRO Cc1cc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cnc1Cl ZINC000808452234 1135669821 /nfs/dbraw/zinc/66/98/21/1135669821.db2.gz CYNDPQKWPWRIDN-UHFFFAOYSA-N 1 0 344.802 3.765 20 5 EHBDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761673 1135729460 /nfs/dbraw/zinc/72/94/60/1135729460.db2.gz QHDLGQJFXNWVHT-OALUTQOASA-N 1 0 344.411 3.720 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870917 1135833098 /nfs/dbraw/zinc/83/30/98/1135833098.db2.gz OWKKFTWLKSKOBC-HOCLYGCPSA-N 1 0 326.824 3.932 20 5 EHBDRO Cc1ccc(CNC[C@@H](C(C)C)[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC001199161538 1135884247 /nfs/dbraw/zinc/88/42/47/1135884247.db2.gz JWEAKKMCGHMAMY-IBGZPJMESA-N 1 0 333.476 3.893 20 5 EHBDRO CC(C)S(=O)(=O)CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000809790915 1135893162 /nfs/dbraw/zinc/89/31/62/1135893162.db2.gz RZPHFCPHTHNHJV-UHFFFAOYSA-N 1 0 341.476 3.906 20 5 EHBDRO CC(C)(O)[C@H]1CCCN1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965233 1135904395 /nfs/dbraw/zinc/90/43/95/1135904395.db2.gz FUGYVOLCQFZBPS-GFCCVEGCSA-N 1 0 333.215 3.637 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000776024498 1135928595 /nfs/dbraw/zinc/92/85/95/1135928595.db2.gz QSKHLIKLIQVOBH-OALUTQOASA-N 1 0 342.439 3.974 20 5 EHBDRO CN(C)c1cc[nH+]c(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c1 ZINC001201645570 1136051239 /nfs/dbraw/zinc/05/12/39/1136051239.db2.gz SOGDIXZAVZIAIS-UHFFFAOYSA-N 1 0 338.367 3.928 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473921 1136095584 /nfs/dbraw/zinc/09/55/84/1136095584.db2.gz QTAJEAPOBLEXLW-LLVKDONJSA-N 1 0 346.258 3.723 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H](O)C1CCCCC1 ZINC000811477923 1136096785 /nfs/dbraw/zinc/09/67/85/1136096785.db2.gz ILJNTNNUKXKCAS-AWEZNQCLSA-N 1 0 347.242 3.932 20 5 EHBDRO CCC(CC)[C@H](O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480731 1136097655 /nfs/dbraw/zinc/09/76/55/1136097655.db2.gz DMQQJJHVHFRMJQ-CYBMUJFWSA-N 1 0 335.231 3.788 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)c1 ZINC000776252648 1136101612 /nfs/dbraw/zinc/10/16/12/1136101612.db2.gz VJRKOVPMYLCWCY-FVQBIDKESA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276945 1136130676 /nfs/dbraw/zinc/13/06/76/1136130676.db2.gz LXKCYTDSODXMBI-ZWKOTPCHSA-N 1 0 330.359 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000776279658 1136134615 /nfs/dbraw/zinc/13/46/15/1136134615.db2.gz XDXHXWVNBADCLK-IBGZPJMESA-N 1 0 342.370 3.557 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1nc(Cl)ccc1[N+](=O)[O-] ZINC001170682815 1136231087 /nfs/dbraw/zinc/23/10/87/1136231087.db2.gz UMOOTLICXGZCAW-JTQLQIEISA-N 1 0 343.774 3.516 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000850429000 1136257257 /nfs/dbraw/zinc/25/72/57/1136257257.db2.gz WNHDYTVWHTWLRC-ZIAGYGMSSA-N 1 0 342.395 3.505 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851551 1136261501 /nfs/dbraw/zinc/26/15/01/1136261501.db2.gz SMMDYKIBYGWRCN-SCLBCKFNSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[C@H]1c2ccccc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582928 1136442410 /nfs/dbraw/zinc/44/24/10/1136442410.db2.gz DHHYJAJJTFQEHK-OALUTQOASA-N 1 0 326.396 3.638 20 5 EHBDRO Cc1ccccc1C[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585577 1136448486 /nfs/dbraw/zinc/44/84/86/1136448486.db2.gz XDJNZWMDQFOBOV-PMACEKPBSA-N 1 0 340.423 3.644 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000852446601 1136456503 /nfs/dbraw/zinc/45/65/03/1136456503.db2.gz KPUVLNYUFWGKRN-MSOLQXFVSA-N 1 0 332.375 3.754 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446101 1136456603 /nfs/dbraw/zinc/45/66/03/1136456603.db2.gz DJTQCZWZZCYTOG-MSOLQXFVSA-N 1 0 332.375 3.754 20 5 EHBDRO CCOc1ccccc1[C@@H](CC)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605468 1136473760 /nfs/dbraw/zinc/47/37/60/1136473760.db2.gz KXPJUJBOXLGKSM-QZTJIDSGSA-N 1 0 344.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCCCCC[NH+]3CCCC3)sc2c1 ZINC000814918876 1136529049 /nfs/dbraw/zinc/52/90/49/1136529049.db2.gz CINCKBKMJVPVMX-UHFFFAOYSA-N 1 0 334.445 3.883 20 5 EHBDRO CSc1ccc([C@H](CNc2cc(N)ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000814959664 1136531753 /nfs/dbraw/zinc/53/17/53/1136531753.db2.gz JUAASLNLRSXMQK-KRWDZBQOSA-N 1 0 346.456 3.614 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741650 1136617727 /nfs/dbraw/zinc/61/77/27/1136617727.db2.gz WKBSWZTXHPAWDV-RHSMWYFYSA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815617746 1136619473 /nfs/dbraw/zinc/61/94/73/1136619473.db2.gz UUEOBNMRFGUGSS-IGEOTXOUSA-N 1 0 341.411 3.575 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815627390 1136620907 /nfs/dbraw/zinc/62/09/07/1136620907.db2.gz ZTPPGAJJNSBHIO-URKNILKWSA-N 1 0 341.411 3.748 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)C1 ZINC000339002124 1136838983 /nfs/dbraw/zinc/83/89/83/1136838983.db2.gz HVWVESQJPOBOEC-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)c1 ZINC000544594314 1136864016 /nfs/dbraw/zinc/86/40/16/1136864016.db2.gz KDBBHVUYDDQMTB-WMZOPIPTSA-N 1 0 330.359 3.744 20 5 EHBDRO CCCOc1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000819258298 1136929559 /nfs/dbraw/zinc/92/95/59/1136929559.db2.gz IXAAKBXMCDYRNK-LJQANCHMSA-N 1 0 344.411 3.515 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000819278115 1136930776 /nfs/dbraw/zinc/93/07/76/1136930776.db2.gz AHIWQNLLQPPYPT-ZVZYQTTQSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000819278117 1136930783 /nfs/dbraw/zinc/93/07/83/1136930783.db2.gz AIIUBQARSOWYNU-ZVZYQTTQSA-N 1 0 346.814 3.817 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859585272 1137021231 /nfs/dbraw/zinc/02/12/31/1137021231.db2.gz MMZIJTMMDVNQFC-DNVCBOLYSA-N 1 0 326.396 3.639 20 5 EHBDRO C[C@H](C[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093522 1137043992 /nfs/dbraw/zinc/04/39/92/1137043992.db2.gz CSSSCTKJTPVJBS-CHWSQXEVSA-N 1 0 337.420 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)c1 ZINC000862540694 1137149087 /nfs/dbraw/zinc/14/90/87/1137149087.db2.gz JWBRSHJWBYJPBM-ZDUSSCGKSA-N 1 0 332.787 3.943 20 5 EHBDRO CCc1nc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057479 1137163687 /nfs/dbraw/zinc/16/36/87/1137163687.db2.gz PFEDLNFGUIUIQL-CJNGLKHVSA-N 1 0 329.400 3.646 20 5 EHBDRO [NH3+][C@@H]1CCc2c3ccccc3n(-c3cc(F)cc(F)c3[N+](=O)[O-])c2C1 ZINC001171092791 1137182853 /nfs/dbraw/zinc/18/28/53/1137182853.db2.gz GWJFXGXYPJMPQI-LLVKDONJSA-N 1 0 343.333 3.633 20 5 EHBDRO CCOc1ccc([C@@H](C)NCc2cc([O-])ccc2[N+](=O)[O-])cc1OC ZINC000339065992 1137217373 /nfs/dbraw/zinc/21/73/73/1137217373.db2.gz DIIPLWWPMGGKCH-GFCCVEGCSA-N 1 0 346.383 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)CC2)c(C(F)F)c1 ZINC000865548356 1137294148 /nfs/dbraw/zinc/29/41/48/1137294148.db2.gz FPDBMTHOFAHYBW-ZDUSSCGKSA-N 1 0 339.386 3.987 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1OC ZINC000865759695 1137309341 /nfs/dbraw/zinc/30/93/41/1137309341.db2.gz ZWGUHBLMRCWJAV-MRXNPFEDSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cn(C)nc2C2CCCCC2)cc1[N+](=O)[O-] ZINC000865787134 1137312007 /nfs/dbraw/zinc/31/20/07/1137312007.db2.gz IPEMWVHDJGITOR-UHFFFAOYSA-N 1 0 342.443 3.974 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@](C)(O)c1ccccc1 ZINC000846038774 1137328785 /nfs/dbraw/zinc/32/87/85/1137328785.db2.gz QEZUOPLPEDQWPQ-SJKOYZFVSA-N 1 0 334.803 3.634 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@](C)(O)c1ccccc1 ZINC000846038369 1137328940 /nfs/dbraw/zinc/32/89/40/1137328940.db2.gz PUCOYSKBFSRVIC-GQIGUUNPSA-N 1 0 342.439 3.802 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000866147779 1137331838 /nfs/dbraw/zinc/33/18/38/1137331838.db2.gz XMAHGGJTHMPSDM-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO CCOCCC1(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCC1 ZINC000866305705 1137343869 /nfs/dbraw/zinc/34/38/69/1137343869.db2.gz KIFBXDVNTRGXSD-AWEZNQCLSA-N 1 0 338.423 3.851 20 5 EHBDRO C[C@@H](CCc1cccnc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000866358221 1137349044 /nfs/dbraw/zinc/34/90/44/1137349044.db2.gz IXNRXTUEVXJMCN-AWEZNQCLSA-N 1 0 338.411 3.625 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC(C)(C)c1ccccn1 ZINC000866364206 1137349775 /nfs/dbraw/zinc/34/97/75/1137349775.db2.gz BDTLRMIQMPNVPP-CYBMUJFWSA-N 1 0 331.391 3.627 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1CCC12CCOCC2)C1CC1 ZINC000866529751 1137361600 /nfs/dbraw/zinc/36/16/00/1137361600.db2.gz SABPYSWBBKYHBH-ZWKOTPCHSA-N 1 0 344.455 3.712 20 5 EHBDRO C[C@H]([NH2+]CCSCCC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866542255 1137363387 /nfs/dbraw/zinc/36/33/87/1137363387.db2.gz GVFJOICJGZUAMB-VIFPVBQESA-N 1 0 337.367 3.513 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000846972518 1137377830 /nfs/dbraw/zinc/37/78/30/1137377830.db2.gz GSCPAUGTXOFRKV-CYBMUJFWSA-N 1 0 331.803 3.941 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H](O)c1cccc(F)c1 ZINC000773044542 1137461601 /nfs/dbraw/zinc/46/16/01/1137461601.db2.gz WKBAXMNDAJPAOD-LPMFXHHGSA-N 1 0 346.402 3.767 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@@H]23)cccc1[N+](=O)[O-] ZINC000773140849 1137468487 /nfs/dbraw/zinc/46/84/87/1137468487.db2.gz VPDZPVOPQHKYKT-ZCDTZLGTSA-N 1 0 338.498 3.933 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cccc1[N+](=O)[O-] ZINC000510980121 1137471396 /nfs/dbraw/zinc/47/13/96/1137471396.db2.gz QLRJLKFOGRYOIW-HOCLYGCPSA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123322798 1137511571 /nfs/dbraw/zinc/51/15/71/1137511571.db2.gz LAJMTNKSTQKJKT-CQSZACIVSA-N 1 0 343.383 3.656 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)OCO2 ZINC000872016203 1137564560 /nfs/dbraw/zinc/56/45/60/1137564560.db2.gz GZDDYXZAONUHFJ-LLVKDONJSA-N 1 0 346.408 3.896 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1ccccc1 ZINC000872015993 1137564616 /nfs/dbraw/zinc/56/46/16/1137564616.db2.gz AXVJNURBWLPKFO-WBMJQRKESA-N 1 0 332.425 3.701 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000872059968 1137568742 /nfs/dbraw/zinc/56/87/42/1137568742.db2.gz KZQVHAHEQFWOLI-GDBMZVCRSA-N 1 0 340.851 3.974 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](C2CC2)C1 ZINC000872060805 1137568920 /nfs/dbraw/zinc/56/89/20/1137568920.db2.gz ABDVUMCBDLBNHG-NORZTCDRSA-N 1 0 336.457 3.925 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075219 1137569941 /nfs/dbraw/zinc/56/99/41/1137569941.db2.gz AOQZSALRPKJKOZ-DXCKQFNASA-N 1 0 345.374 3.700 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872281402 1137577861 /nfs/dbraw/zinc/57/78/61/1137577861.db2.gz UXTLGYORBZBFKF-QGZVFWFLSA-N 1 0 334.416 3.527 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(N3CCCCC3)nc2)cccc1[N+](=O)[O-] ZINC000873015140 1137588162 /nfs/dbraw/zinc/58/81/62/1137588162.db2.gz ZMHIPDJSELNDJH-UHFFFAOYSA-N 1 0 340.427 3.578 20 5 EHBDRO COCC(C)(C)CC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000873153121 1137591478 /nfs/dbraw/zinc/59/14/78/1137591478.db2.gz ACGLUBKTYTYDPA-UHFFFAOYSA-N 1 0 349.456 3.871 20 5 EHBDRO [NH3+][C@@H]1C[C@H]1c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000873217527 1137594327 /nfs/dbraw/zinc/59/43/27/1137594327.db2.gz MTIPNXJUGJXQJO-LSDHHAIUSA-N 1 0 349.337 3.623 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(Cl)cc1 ZINC000876922414 1137665364 /nfs/dbraw/zinc/66/53/64/1137665364.db2.gz YHXUPDILYXICCX-ZBCRRDGASA-N 1 0 334.807 3.889 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3c(Cl)cccc3Cl)C2)c1 ZINC000876989166 1137667104 /nfs/dbraw/zinc/66/71/04/1137667104.db2.gz QNJVFUKCLIJMIX-UHFFFAOYSA-N 1 0 341.198 3.591 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CC[C@@H](c4cccc(F)c4)C3)C2)c1 ZINC000877491350 1137678450 /nfs/dbraw/zinc/67/84/50/1137678450.db2.gz JENPXBAWEMCIFC-XNGJBWTFSA-N 1 0 344.390 3.560 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447449 1137716327 /nfs/dbraw/zinc/71/63/27/1137716327.db2.gz MUGSELXQRQAVPK-GXTWGEPZSA-N 1 0 330.388 3.703 20 5 EHBDRO CC1([NH+]2CCCCC2)CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000879947922 1137762944 /nfs/dbraw/zinc/76/29/44/1137762944.db2.gz PCBVWLVLRCZMEY-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO COc1cccc([C@H]2CC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2(C)C)c1 ZINC000880284598 1137773207 /nfs/dbraw/zinc/77/32/07/1137773207.db2.gz AYJWMOSIBCLGBM-OAHLLOKOSA-N 1 0 345.399 3.668 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC(C)([NH+]2CCCCC2)CC1 ZINC000882714125 1137832315 /nfs/dbraw/zinc/83/23/15/1137832315.db2.gz IDTRNVABSXMIHX-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000130271963 1137835714 /nfs/dbraw/zinc/83/57/14/1137835714.db2.gz CSKXPJNVCXATBV-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)C1CC1 ZINC000883356422 1137857189 /nfs/dbraw/zinc/85/71/89/1137857189.db2.gz NLBXLAAKNAOKMR-IRXDYDNUSA-N 1 0 330.428 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CCC4(COC4)CC3)o2)cc1 ZINC000883391925 1137859305 /nfs/dbraw/zinc/85/93/05/1137859305.db2.gz WATKEGPGJSITBO-UHFFFAOYSA-N 1 0 342.395 3.904 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034156 1137929373 /nfs/dbraw/zinc/92/93/73/1137929373.db2.gz ZVOFYHWMPOOBNR-CUDZTTRCSA-N 1 0 332.444 3.917 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC000119296261 1137940252 /nfs/dbraw/zinc/94/02/52/1137940252.db2.gz IDWYZVITYRZBIK-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000120312069 1137948386 /nfs/dbraw/zinc/94/83/86/1137948386.db2.gz BXZBFHOKZKBYNX-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)c1ccc(Cl)cc1)C1CC1 ZINC000135226326 1137964766 /nfs/dbraw/zinc/96/47/66/1137964766.db2.gz FNCXHPUHIQDXAF-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000884719008 1137971188 /nfs/dbraw/zinc/97/11/88/1137971188.db2.gz WDUQTTKADCSBJG-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@@H](CSc2ccccc2)C1 ZINC000886022465 1138032793 /nfs/dbraw/zinc/03/27/93/1138032793.db2.gz CAWSCRNTSBCBHR-CQSZACIVSA-N 1 0 329.425 3.604 20 5 EHBDRO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000886707418 1138120456 /nfs/dbraw/zinc/12/04/56/1138120456.db2.gz HQABYGNAESPKLV-QAPCUYQASA-N 1 0 348.443 3.611 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000075863911 1138129118 /nfs/dbraw/zinc/12/91/18/1138129118.db2.gz QTXAKXKAMYCKCZ-GOSISDBHSA-N 1 0 326.396 3.634 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000087455205 1138191378 /nfs/dbraw/zinc/19/13/78/1138191378.db2.gz JIMPAZAZIFPPCK-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO CCC1(C)CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000263693317 1138344249 /nfs/dbraw/zinc/34/42/49/1138344249.db2.gz KBGUGKDFPOZGNZ-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H]1C[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130638800 1138466186 /nfs/dbraw/zinc/46/61/86/1138466186.db2.gz ORYPXUNXPRKABX-RHSMWYFYSA-N 1 0 343.427 3.769 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCCc1c[nH]c2ccc(F)cc12 ZINC000337315455 1138530140 /nfs/dbraw/zinc/53/01/40/1138530140.db2.gz XYRDWDFNANNNKV-UHFFFAOYSA-N 1 0 327.359 3.938 20 5 EHBDRO C[C@H]([N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C)CC1 ZINC000177254061 1139607992 /nfs/dbraw/zinc/60/79/92/1139607992.db2.gz ZEIQNZJWYHELPT-ZDUSSCGKSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178689245 1139712421 /nfs/dbraw/zinc/71/24/21/1139712421.db2.gz JMNYCNNIRYWATC-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000181370493 1139902891 /nfs/dbraw/zinc/90/28/91/1139902891.db2.gz SBPOWWZMRIOMHJ-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000181833168 1139935320 /nfs/dbraw/zinc/93/53/20/1139935320.db2.gz RDFULKBXYOFDRC-NSHDSACASA-N 1 0 334.397 3.602 20 5 EHBDRO Cc1noc(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182686876 1139986326 /nfs/dbraw/zinc/98/63/26/1139986326.db2.gz JRZKHXGYYBERDY-GFCCVEGCSA-N 1 0 330.388 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C[S@](C)=O)c1ccccc1 ZINC000183176794 1140018624 /nfs/dbraw/zinc/01/86/24/1140018624.db2.gz ZLAKVNTXIXQVGM-NLWZSEAUSA-N 1 0 346.452 3.674 20 5 EHBDRO COc1cc(C[NH2+][C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000184317207 1140096120 /nfs/dbraw/zinc/09/61/20/1140096120.db2.gz YCQCJFIEYAIQKY-SFHVURJKSA-N 1 0 330.359 3.983 20 5 EHBDRO Cc1c(CN[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722997 1140166775 /nfs/dbraw/zinc/16/67/75/1140166775.db2.gz DVMCVPBQPOBQTI-WBVHZDCISA-N 1 0 331.460 3.646 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000187499435 1140257736 /nfs/dbraw/zinc/25/77/36/1140257736.db2.gz LZWLKLQDGWTHEY-UHFFFAOYSA-N 1 0 344.411 3.511 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000192024832 1140498003 /nfs/dbraw/zinc/49/80/03/1140498003.db2.gz JPDQFSMCKZKDQM-NVXWUHKLSA-N 1 0 332.787 3.868 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000266187487 1140653312 /nfs/dbraw/zinc/65/33/12/1140653312.db2.gz XJAKRYRGLMBLSV-TZMCWYRMSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1C[C@H](O)c1cccs1 ZINC000267441946 1140791759 /nfs/dbraw/zinc/79/17/59/1140791759.db2.gz IDZVVRPXWQOADD-HOCLYGCPSA-N 1 0 332.425 3.744 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000269038372 1141052301 /nfs/dbraw/zinc/05/23/01/1141052301.db2.gz SVCCKDVZLWGODC-XJKSGUPXSA-N 1 0 341.411 3.684 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687389 1141135536 /nfs/dbraw/zinc/13/55/36/1141135536.db2.gz TVZMAYBXGOUAOA-ZWKOTPCHSA-N 1 0 330.359 3.604 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cnn(C)c1 ZINC000271185882 1141320710 /nfs/dbraw/zinc/32/07/10/1141320710.db2.gz WPHJDEPBYPZAKI-OCCSQVGLSA-N 1 0 334.445 3.550 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCC2 ZINC000271281793 1141338914 /nfs/dbraw/zinc/33/89/14/1141338914.db2.gz AEETUFWELXUNMV-CYBMUJFWSA-N 1 0 342.399 3.657 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[C@H](C)O ZINC000271496462 1141381250 /nfs/dbraw/zinc/38/12/50/1141381250.db2.gz MODNGYSCTPXXPR-KBPBESRZSA-N 1 0 340.489 3.852 20 5 EHBDRO Cc1nnc([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274240070 1141488538 /nfs/dbraw/zinc/48/85/38/1141488538.db2.gz QNIHOKAUECYERX-WHOFXGATSA-N 1 0 346.456 3.817 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575522 1141521062 /nfs/dbraw/zinc/52/10/62/1141521062.db2.gz VOGCUFNGAHPJMZ-PWSUYJOCSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc[nH]c(=O)c1 ZINC000339450532 1014506768 /nfs/dbraw/zinc/50/67/68/1014506768.db2.gz BLVYDOOBPBZYFZ-LBPRGKRZSA-N 1 0 339.351 3.806 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCCn2ccnc2C)cc1[N+](=O)[O-] ZINC000153972781 1014720604 /nfs/dbraw/zinc/72/06/04/1014720604.db2.gz RZPMTPUPWPVGFK-CQSZACIVSA-N 1 0 346.431 3.629 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000610215038 1015006649 /nfs/dbraw/zinc/00/66/49/1015006649.db2.gz YELKGCHBPYNEKH-MRXNPFEDSA-N 1 0 326.396 3.668 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000430226730 1015123566 /nfs/dbraw/zinc/12/35/66/1015123566.db2.gz NQMFNJVEKFLXMX-KBAYOESNSA-N 1 0 348.443 3.629 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000154258241 1015320947 /nfs/dbraw/zinc/32/09/47/1015320947.db2.gz RSEYKXYFKWIAKM-DPAVQSFQSA-N 1 0 334.416 3.602 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824577 1015438667 /nfs/dbraw/zinc/43/86/67/1015438667.db2.gz KRUQDRPNIAYHFF-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](CO)C3)s2)cc1 ZINC000154589809 1015620204 /nfs/dbraw/zinc/62/02/04/1015620204.db2.gz LPKYKVMQWBASNC-CYBMUJFWSA-N 1 0 332.425 3.528 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091919188 1016080205 /nfs/dbraw/zinc/08/02/05/1016080205.db2.gz YHXBEXIINQZPCJ-AWEZNQCLSA-N 1 0 328.416 3.617 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(CCc2ccccn2)Cc2cccnc2)c1 ZINC000430328409 1016374719 /nfs/dbraw/zinc/37/47/19/1016374719.db2.gz ZQFZZUROVOIKGX-UHFFFAOYSA-N 1 0 348.406 3.630 20 5 EHBDRO Cc1ccc(C[N@H+](CCO)[C@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683108 1032147327 /nfs/dbraw/zinc/14/73/27/1032147327.db2.gz JZBNCHCRKCRQKA-IBGZPJMESA-N 1 0 340.423 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2cccc3c2OCCO3)cc1 ZINC000340184285 1016634622 /nfs/dbraw/zinc/63/46/22/1016634622.db2.gz SRTFLQKGOJYZSD-QGZVFWFLSA-N 1 0 340.379 3.703 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000247187996 1016918375 /nfs/dbraw/zinc/91/83/75/1016918375.db2.gz UHDQDNICDCNOQF-YGZBKVGRSA-N 1 0 338.473 3.634 20 5 EHBDRO COc1ccc(C)cc1CC[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449069497 1032152363 /nfs/dbraw/zinc/15/23/63/1032152363.db2.gz XLJBYFATVAHFTM-OAHLLOKOSA-N 1 0 328.412 3.675 20 5 EHBDRO C[C@@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cccc(Cl)c1 ZINC000376652498 1016953531 /nfs/dbraw/zinc/95/35/31/1016953531.db2.gz QVFSSXCEHUBPOO-ZDUSSCGKSA-N 1 0 348.834 3.885 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc2c(c1)OCCO2 ZINC000449069656 1032157407 /nfs/dbraw/zinc/15/74/07/1032157407.db2.gz XYSNKVAZZAQFNA-KGLIPLIRSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000074742657 1032215080 /nfs/dbraw/zinc/21/50/80/1032215080.db2.gz UCDXUVODZUSWTQ-HOCLYGCPSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1c([C@@H](C)N[C@@H](C[NH+](C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368978 1032251635 /nfs/dbraw/zinc/25/16/35/1032251635.db2.gz PVQVZKDNOAOGGV-KDOFPFPSSA-N 1 0 345.418 3.996 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000538275547 1032265369 /nfs/dbraw/zinc/26/53/69/1032265369.db2.gz GWJCSTNQDHZDEK-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449174621 1032267174 /nfs/dbraw/zinc/26/71/74/1032267174.db2.gz PMPLTBOJYPPPAH-LSDHHAIUSA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000449191549 1032285127 /nfs/dbraw/zinc/28/51/27/1032285127.db2.gz PHYZCUYVESSIGM-WBVHZDCISA-N 1 0 332.444 3.997 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])CCO2 ZINC000449246758 1032385338 /nfs/dbraw/zinc/38/53/38/1032385338.db2.gz DSBOXZMELJADHW-GUYCJALGSA-N 1 0 342.395 3.648 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)cc1Cl ZINC000783652677 1032439696 /nfs/dbraw/zinc/43/96/96/1032439696.db2.gz ODJPTVZOOBXHNM-XBFCOCLRSA-N 1 0 344.889 3.717 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000449347134 1032463159 /nfs/dbraw/zinc/46/31/59/1032463159.db2.gz FQPIQWOZXAGCHZ-UQHVZDHRSA-N 1 0 334.416 3.757 20 5 EHBDRO CO[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC000459777495 1032463740 /nfs/dbraw/zinc/46/37/40/1032463740.db2.gz WBAGSUGENWSUKP-KGLIPLIRSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@H](O)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000278763749 1032471843 /nfs/dbraw/zinc/47/18/43/1032471843.db2.gz XMLJWFNQEKIRKG-NSHDSACASA-N 1 0 338.791 3.759 20 5 EHBDRO C[C@H](CCCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449407164 1032529819 /nfs/dbraw/zinc/52/98/19/1032529819.db2.gz FULJLFGVIDCCMR-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO CCc1cnc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495956 1032665772 /nfs/dbraw/zinc/66/57/72/1032665772.db2.gz FQCKMSDVWBLHTP-AWEZNQCLSA-N 1 0 331.441 3.993 20 5 EHBDRO COc1ccc(C2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)nc1 ZINC000593040581 1032675653 /nfs/dbraw/zinc/67/56/53/1032675653.db2.gz HPRRGILURWWBTC-CQSZACIVSA-N 1 0 341.411 3.939 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc4ccccn34)C2)cc1 ZINC000449501113 1032681103 /nfs/dbraw/zinc/68/11/03/1032681103.db2.gz OWKMUKZDFSLCQP-MRXNPFEDSA-N 1 0 336.395 3.622 20 5 EHBDRO N[C@H](C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842980 1017232526 /nfs/dbraw/zinc/23/25/26/1017232526.db2.gz ZXVIWHXCRVTCEP-QRQLOZEOSA-N 1 0 339.439 3.596 20 5 EHBDRO Cc1c(C[NH+]2CCC3(CC2)C(F)(F)C3(F)F)cccc1[N+](=O)[O-] ZINC000593054462 1032687375 /nfs/dbraw/zinc/68/73/75/1032687375.db2.gz IFNGWCHGYLLOCB-UHFFFAOYSA-N 1 0 332.297 3.770 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc3c(c2)CCCN3)c(Cl)c1 ZINC000414986172 1017372652 /nfs/dbraw/zinc/37/26/52/1017372652.db2.gz XNLYWHAYVBTNBS-UHFFFAOYSA-N 1 0 331.803 3.896 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)c2cc(N)ccc2O1 ZINC000415020483 1017403793 /nfs/dbraw/zinc/40/37/93/1017403793.db2.gz GLOKTVWKJPEAJV-MRXNPFEDSA-N 1 0 327.384 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc3c2CCCN3)c(Cl)c1 ZINC000415036309 1017424939 /nfs/dbraw/zinc/42/49/39/1017424939.db2.gz NLPUBOJOWJPYQV-UHFFFAOYSA-N 1 0 331.803 3.896 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCOC3)C2)o1 ZINC000377237750 1017513270 /nfs/dbraw/zinc/51/32/70/1017513270.db2.gz JFZQRUOEUOTLIW-LSDHHAIUSA-N 1 0 342.395 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)c(F)c1 ZINC000449516938 1032708871 /nfs/dbraw/zinc/70/88/71/1032708871.db2.gz IHLHEZXVZBIIID-WBVHZDCISA-N 1 0 334.391 3.515 20 5 EHBDRO CCC[C@@H](Cc1ccccc1)[N@H+](CCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001167306699 1017728094 /nfs/dbraw/zinc/72/80/94/1017728094.db2.gz IGQYRKRDMGHIGH-SFHVURJKSA-N 1 0 344.459 3.952 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597861017 1032721761 /nfs/dbraw/zinc/72/17/61/1032721761.db2.gz RHLCKHJOSGNXCB-AWEZNQCLSA-N 1 0 347.459 3.568 20 5 EHBDRO Cc1cc(-n2ccnc2)ccc1C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000574104113 1032724061 /nfs/dbraw/zinc/72/40/61/1032724061.db2.gz ULCOYCISDXHXKU-UHFFFAOYSA-N 1 0 348.406 3.647 20 5 EHBDRO CC[C@@H]([NH2+]CCN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000360252242 1017980051 /nfs/dbraw/zinc/98/00/51/1017980051.db2.gz VPEJPQYONKTXOL-LJQANCHMSA-N 1 0 327.428 3.768 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000290331660 1018207780 /nfs/dbraw/zinc/20/77/80/1018207780.db2.gz DUXJSPBPIOTATA-RMKNXTFCSA-N 1 0 342.443 3.779 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214641 1018547230 /nfs/dbraw/zinc/54/72/30/1018547230.db2.gz SDHQLKUHSZJTOA-YPMHNXCESA-N 1 0 335.429 3.842 20 5 EHBDRO C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399496 1018584048 /nfs/dbraw/zinc/58/40/48/1018584048.db2.gz JGULALVSRFBCNA-KBXCAEBGSA-N 1 0 343.427 3.627 20 5 EHBDRO Cc1ccc([C@@H](C)N[C@@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404507 1032776551 /nfs/dbraw/zinc/77/65/51/1032776551.db2.gz ZARRCMMRNNKBKZ-DYVFJYSZSA-N 1 0 332.375 3.817 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000500950632 1018744795 /nfs/dbraw/zinc/74/47/95/1018744795.db2.gz DZUMCVSXEQQFAL-UHFFFAOYSA-N 1 0 344.411 3.559 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221184 1018818826 /nfs/dbraw/zinc/81/88/26/1018818826.db2.gz FFDWYDVQLLAHST-UYAOXDASSA-N 1 0 339.439 3.562 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190853 1018988787 /nfs/dbraw/zinc/98/87/87/1018988787.db2.gz MNHFIYNNJLNKRB-VQIMIIECSA-N 1 0 339.439 3.595 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120590426 1019074851 /nfs/dbraw/zinc/07/48/51/1019074851.db2.gz LJOUMRRAWKOZFI-OLZOCXBDSA-N 1 0 330.432 3.535 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000120616159 1019102296 /nfs/dbraw/zinc/10/22/96/1019102296.db2.gz KADLSLKVOUJDME-DGCLKSJQSA-N 1 0 330.432 3.535 20 5 EHBDRO C[N@@H+]1CC[C@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000729264091 1019252088 /nfs/dbraw/zinc/25/20/88/1019252088.db2.gz VLWZLZMESYOENG-MRVPVSSYSA-N 1 0 337.729 3.631 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000561159514 1019804995 /nfs/dbraw/zinc/80/49/95/1019804995.db2.gz BUCYLSISOFOXTE-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CCOC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602443233 1032893134 /nfs/dbraw/zinc/89/31/34/1032893134.db2.gz BHNKPPABEHFFBH-UHFFFAOYSA-N 1 0 332.322 3.615 20 5 EHBDRO Cc1ccc(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)cc1[N+](=O)[O-] ZINC000345916287 1020590487 /nfs/dbraw/zinc/59/04/87/1020590487.db2.gz VXQKWCNYIOCQGR-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO O=C(CC[N@H+](CC1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000501110123 1020711606 /nfs/dbraw/zinc/71/16/06/1020711606.db2.gz JVTFXFWIKKEPRV-UHFFFAOYSA-N 1 0 345.443 3.968 20 5 EHBDRO CCS(=O)(=O)CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000069173278 1020763331 /nfs/dbraw/zinc/76/33/31/1020763331.db2.gz FYMLWXCJKYCJCZ-UHFFFAOYSA-N 1 0 327.449 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000602521151 1032934640 /nfs/dbraw/zinc/93/46/40/1032934640.db2.gz NCXVDWNKWUUPAC-ICSRJNTNSA-N 1 0 340.423 3.895 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000360870462 1020846873 /nfs/dbraw/zinc/84/68/73/1020846873.db2.gz ILZWXTJIFMIPQM-NVXWUHKLSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1nn(C[N@H+]2CCCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000760409291 1032940250 /nfs/dbraw/zinc/94/02/50/1032940250.db2.gz QNKKLZLJXPWFSX-OAHLLOKOSA-N 1 0 345.447 3.896 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516021 1021175199 /nfs/dbraw/zinc/17/51/99/1021175199.db2.gz VJHPYSSOWHHLOI-ZFWWWQNUSA-N 1 0 331.441 3.979 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000507372146 1021225627 /nfs/dbraw/zinc/22/56/27/1021225627.db2.gz OZDLBYOQXQLRSH-INIZCTEOSA-N 1 0 347.462 3.992 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2cc(C)c(OC)c(C)c2)cc1[N+](=O)[O-] ZINC000507616823 1021402296 /nfs/dbraw/zinc/40/22/96/1021402296.db2.gz QMAOUGQGNUTDLR-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO COc1ccccc1C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)CCC1 ZINC000544941074 1021406331 /nfs/dbraw/zinc/40/63/31/1021406331.db2.gz YSOYIDIFDYOUCB-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO CCC(CC)[C@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590255 1032988223 /nfs/dbraw/zinc/98/82/23/1032988223.db2.gz YGCNKDOCWISTEA-SUMWQHHRSA-N 1 0 347.415 3.809 20 5 EHBDRO C[C@H](CCc1ccco1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000519720498 1021632782 /nfs/dbraw/zinc/63/27/82/1021632782.db2.gz CNKAPNZVPIJINU-CYBMUJFWSA-N 1 0 327.384 3.823 20 5 EHBDRO Cn1cc(-c2ccccc2C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000516784301 1021726428 /nfs/dbraw/zinc/72/64/28/1021726428.db2.gz KOZCXDBKSCSEPO-IBGZPJMESA-N 1 0 348.406 3.772 20 5 EHBDRO CCn1cc(C[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000593677283 1033002842 /nfs/dbraw/zinc/00/28/42/1033002842.db2.gz XCYJMFQFZBOVSN-VQHVLOKHSA-N 1 0 328.416 3.735 20 5 EHBDRO COCCC1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000602621054 1033017256 /nfs/dbraw/zinc/01/72/56/1033017256.db2.gz OXDSNDSITKJVAW-UHFFFAOYSA-N 1 0 347.415 3.813 20 5 EHBDRO CC[NH+]1CCC(CCNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000473901411 1022238221 /nfs/dbraw/zinc/23/82/21/1022238221.db2.gz KWNIPRRIQDHZGK-UHFFFAOYSA-N 1 0 347.459 3.570 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCN(c2ccccc2)C1 ZINC000602652408 1033039376 /nfs/dbraw/zinc/03/93/76/1033039376.db2.gz YLNFYFOVOLVEOJ-QGZVFWFLSA-N 1 0 339.439 3.596 20 5 EHBDRO CCC[C@H](NC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255747 1022325881 /nfs/dbraw/zinc/32/58/81/1022325881.db2.gz QRIDFRMGAQRENN-IBGZPJMESA-N 1 0 331.460 3.900 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562068 1022344705 /nfs/dbraw/zinc/34/47/05/1022344705.db2.gz SEEODPMZTORROK-XQDHMALISA-N 1 0 340.379 3.730 20 5 EHBDRO CC(=O)c1cc(NCCCC[N@H+]2CCCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000341567992 1022346346 /nfs/dbraw/zinc/34/63/46/1022346346.db2.gz UNPQRKXFBCNXTN-AWEZNQCLSA-N 1 0 333.432 3.864 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000550079245 1022362673 /nfs/dbraw/zinc/36/26/73/1022362673.db2.gz KSBMYMARPMGBNT-PBHICJAKSA-N 1 0 345.443 3.742 20 5 EHBDRO CCC[C@]1(CO)CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602672658 1033049110 /nfs/dbraw/zinc/04/91/10/1033049110.db2.gz ZTGIEJXEMAOPMQ-HNNXBMFYSA-N 1 0 346.349 3.598 20 5 EHBDRO C[C@H](C[N+](C)(C)C)Oc1c(F)cc(Br)cc1Cl ZINC001225968156 1022443165 /nfs/dbraw/zinc/44/31/65/1022443165.db2.gz XYOJXSTYNYBHOA-MRVPVSSYSA-N 1 0 325.629 3.715 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000124741784 1022571126 /nfs/dbraw/zinc/57/11/26/1022571126.db2.gz SBLZXIAUWRMBIO-BHYGNILZSA-N 1 0 347.459 3.637 20 5 EHBDRO CC(C)[C@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498573 1022727453 /nfs/dbraw/zinc/72/74/53/1022727453.db2.gz YFWBLTLOKRLXGT-OCCSQVGLSA-N 1 0 330.388 3.684 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CC(OC(C)(C)C)C1 ZINC000602695602 1033076305 /nfs/dbraw/zinc/07/63/05/1033076305.db2.gz BDFNNTUWORYIDB-UHFFFAOYSA-N 1 0 333.388 3.514 20 5 EHBDRO CCO[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000602685391 1033086348 /nfs/dbraw/zinc/08/63/48/1033086348.db2.gz NWZHCOYIIBFXBL-IAQYHMDHSA-N 1 0 346.349 3.861 20 5 EHBDRO Cc1c(C[N@H+](CCCO)[C@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686554 1022887290 /nfs/dbraw/zinc/88/72/90/1022887290.db2.gz QCWRQZGESOCVRQ-FQEVSTJZSA-N 1 0 340.423 3.775 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449717913 1033092678 /nfs/dbraw/zinc/09/26/78/1033092678.db2.gz FIKUEQYMCJRHHQ-ZBFHGGJFSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@]1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO[C@H]1C1CC1 ZINC000519579660 1022944649 /nfs/dbraw/zinc/94/46/49/1022944649.db2.gz COQCWHJCHZFCTI-GBESFXJTSA-N 1 0 330.428 3.767 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC(C)(C(C)C)CC1 ZINC000426746194 1023012518 /nfs/dbraw/zinc/01/25/18/1023012518.db2.gz XMQYBQXBPHJMFH-UHFFFAOYSA-N 1 0 333.432 3.600 20 5 EHBDRO COCCCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000509579597 1023077331 /nfs/dbraw/zinc/07/73/31/1023077331.db2.gz RNLDPNKRCHXYAX-UHFFFAOYSA-N 1 0 343.427 3.879 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000327712685 1023106919 /nfs/dbraw/zinc/10/69/19/1023106919.db2.gz ZUPBHXYEWCOAQH-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449723308 1033113179 /nfs/dbraw/zinc/11/31/79/1033113179.db2.gz LIRDEPZANGWKLD-UHFFFAOYSA-N 1 0 349.456 3.605 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000602731842 1033122809 /nfs/dbraw/zinc/12/28/09/1033122809.db2.gz BYTPOJNPZUGDRM-SOFGYWHQSA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000510982830 1023547131 /nfs/dbraw/zinc/54/71/31/1023547131.db2.gz GPZIZXZDTXNISG-WMLDXEAASA-N 1 0 326.396 3.948 20 5 EHBDRO CCC(CC)([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000602788312 1033162052 /nfs/dbraw/zinc/16/20/52/1033162052.db2.gz PVWFRFGOIPAXGJ-UHFFFAOYSA-N 1 0 336.823 3.787 20 5 EHBDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780082 1024008240 /nfs/dbraw/zinc/00/82/40/1024008240.db2.gz MMRFSTUITBHBJC-XJKSGUPXSA-N 1 0 342.436 3.896 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCC[C@@H](C)C1 ZINC000449769110 1033183685 /nfs/dbraw/zinc/18/36/85/1033183685.db2.gz UKYAOSKGIQBICY-RDBSUJKOSA-N 1 0 334.416 3.766 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@@H]21 ZINC000248425518 1024082795 /nfs/dbraw/zinc/08/27/95/1024082795.db2.gz NZSRKSJTHQZOJM-DAXOMENPSA-N 1 0 342.399 3.655 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]2CCCC[C@H]21 ZINC000248425522 1024089854 /nfs/dbraw/zinc/08/98/54/1024089854.db2.gz NZSRKSJTHQZOJM-UHOFOFEASA-N 1 0 342.399 3.655 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544356827 1024178159 /nfs/dbraw/zinc/17/81/59/1024178159.db2.gz BHWGOPILKABDPG-IFXJQAMLSA-N 1 0 346.427 3.838 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000156680945 1024418768 /nfs/dbraw/zinc/41/87/68/1024418768.db2.gz XZECTZCYCWNJKW-CQSZACIVSA-N 1 0 329.400 3.938 20 5 EHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000071809503 1024441038 /nfs/dbraw/zinc/44/10/38/1024441038.db2.gz WBZKUHYBJCNKNS-QGZVFWFLSA-N 1 0 342.395 3.647 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cc3c(ccc(C)c3C)[nH]2)cc1[N+](=O)[O-] ZINC000472040244 1024443176 /nfs/dbraw/zinc/44/31/76/1024443176.db2.gz AWCOUVSQKKDHIB-UHFFFAOYSA-N 1 0 339.395 3.991 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccc(C)cc1)[NH+](C)C ZINC000474156067 1024447765 /nfs/dbraw/zinc/44/77/65/1024447765.db2.gz XWUBPLGYUMLLTI-IBGZPJMESA-N 1 0 343.427 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3CSC3)o2)c(Cl)c1 ZINC000895422603 1024496679 /nfs/dbraw/zinc/49/66/79/1024496679.db2.gz JCZNYKDTNHSOSN-UHFFFAOYSA-N 1 0 338.816 3.961 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCSC[C@H]23)c(C(F)F)c1 ZINC000895567681 1024623816 /nfs/dbraw/zinc/62/38/16/1024623816.db2.gz GQVFMDOQZNHBDC-ZIAGYGMSSA-N 1 0 343.399 3.524 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000277346223 1024710172 /nfs/dbraw/zinc/71/01/72/1024710172.db2.gz YPXVZEDZTXRNBX-KGLIPLIRSA-N 1 0 344.411 3.981 20 5 EHBDRO C[NH2+]C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435391399 1024877803 /nfs/dbraw/zinc/87/78/03/1024877803.db2.gz WLDFJMYVDDYRHP-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ncccc1[N+](=O)[O-] ZINC000071954895 1024900673 /nfs/dbraw/zinc/90/06/73/1024900673.db2.gz MCKZAEKEUAMFJQ-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346608287 1024947688 /nfs/dbraw/zinc/94/76/88/1024947688.db2.gz PEWDRAOJZHFCDF-CRAIPNDOSA-N 1 0 332.400 3.590 20 5 EHBDRO COCC[C@@H](C)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000414487651 1025159240 /nfs/dbraw/zinc/15/92/40/1025159240.db2.gz VNJGVPHLAHOJKB-CYBMUJFWSA-N 1 0 348.399 3.626 20 5 EHBDRO C[C@@H](CO)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000515332138 1025174314 /nfs/dbraw/zinc/17/43/14/1025174314.db2.gz RMUFPAPFPVZNOB-AWEZNQCLSA-N 1 0 344.411 3.838 20 5 EHBDRO CSc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000281557574 1025229372 /nfs/dbraw/zinc/22/93/72/1025229372.db2.gz XYZVMMJEPKWGLS-PXAZEXFGSA-N 1 0 332.425 3.701 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(CCF)CC1 ZINC000602948269 1033275934 /nfs/dbraw/zinc/27/59/34/1033275934.db2.gz PRHKMAGMPKOKDS-GFCCVEGCSA-N 1 0 348.378 3.777 20 5 EHBDRO CC(=O)c1ccc(NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000515550771 1025344835 /nfs/dbraw/zinc/34/48/35/1025344835.db2.gz ITCHDEQCZDZGEO-HUUCEWRRSA-N 1 0 347.459 3.967 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC([NH2+]C2CCC2)CC1 ZINC000897980984 1033276800 /nfs/dbraw/zinc/27/68/00/1033276800.db2.gz HMYHCNYBUPHXSY-NTCAYCPXSA-N 1 0 329.444 3.605 20 5 EHBDRO COc1ncc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000551785750 1025457942 /nfs/dbraw/zinc/45/79/42/1025457942.db2.gz LBKGWGNPYRKQPF-LLVKDONJSA-N 1 0 335.791 3.545 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000051475903 1025472485 /nfs/dbraw/zinc/47/24/85/1025472485.db2.gz CMOLTTPGWGBLAN-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318940 1025581762 /nfs/dbraw/zinc/58/17/62/1025581762.db2.gz PXQAMXQWYDQGOR-MNOVXSKESA-N 1 0 346.353 3.541 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000185678388 1025586922 /nfs/dbraw/zinc/58/69/22/1025586922.db2.gz XRULGWYPFCLTJP-KRWDZBQOSA-N 1 0 330.384 3.980 20 5 EHBDRO Cc1noc2ncc(C[NH2+][C@@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc12 ZINC000894315846 1025770052 /nfs/dbraw/zinc/77/00/52/1025770052.db2.gz JBFHBQLTFJXFDN-NSHDSACASA-N 1 0 326.356 3.599 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)n1 ZINC000451740299 1025796488 /nfs/dbraw/zinc/79/64/88/1025796488.db2.gz ZWGJAMMQEIBOSY-OAHLLOKOSA-N 1 0 334.807 3.672 20 5 EHBDRO CC[NH+]1CCC(CNc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000522022330 1025892721 /nfs/dbraw/zinc/89/27/21/1025892721.db2.gz HOEBXAAROCMBDX-UHFFFAOYSA-N 1 0 328.416 3.595 20 5 EHBDRO Cc1cccc2c(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3F)c[nH]c21 ZINC000478187194 1026007693 /nfs/dbraw/zinc/00/76/93/1026007693.db2.gz ZPXPWALRAKETOD-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO Cc1cnc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553128 1026105615 /nfs/dbraw/zinc/10/56/15/1026105615.db2.gz XKWYEGNAIJXXGW-GOEBONIOSA-N 1 0 326.400 3.634 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000178570643 1026144183 /nfs/dbraw/zinc/14/41/83/1026144183.db2.gz NQQMGSMVBCGTBV-LJQANCHMSA-N 1 0 326.396 3.508 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCCN(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000451866361 1026358641 /nfs/dbraw/zinc/35/86/41/1026358641.db2.gz JPVWNSGAZMEMMZ-KRWDZBQOSA-N 1 0 325.412 3.964 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000451948918 1026409689 /nfs/dbraw/zinc/40/96/89/1026409689.db2.gz AQRSHWWINGCXBA-OAHLLOKOSA-N 1 0 336.432 3.562 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2SCCc3ccccc32)cc1[N+](=O)[O-] ZINC000530913241 1026415092 /nfs/dbraw/zinc/41/50/92/1026415092.db2.gz DRJGWSRMTUTWCK-SFHVURJKSA-N 1 0 344.436 3.724 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302061812 1026472171 /nfs/dbraw/zinc/47/21/71/1026472171.db2.gz UCGFKJRVXKVLCK-CHWSQXEVSA-N 1 0 348.403 3.568 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000452086732 1026483382 /nfs/dbraw/zinc/48/33/82/1026483382.db2.gz NGATUMRTJUTOSR-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000897239285 1026552295 /nfs/dbraw/zinc/55/22/95/1026552295.db2.gz XWVATDILFLPKDA-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO COC[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000121277467 1026589484 /nfs/dbraw/zinc/58/94/84/1026589484.db2.gz DKXHDGZHCJJBGR-HNNXBMFYSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCCc2ccccc2F)n1 ZINC000479511039 1026661740 /nfs/dbraw/zinc/66/17/40/1026661740.db2.gz FYUWNVSZXPTCFJ-DLBZAZTESA-N 1 0 346.406 3.637 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000531405955 1026886562 /nfs/dbraw/zinc/88/65/62/1026886562.db2.gz OEPLDILRPDAXEX-LJQANCHMSA-N 1 0 328.412 3.614 20 5 EHBDRO CCN(CC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cccc(C)c1 ZINC000520208303 1027109308 /nfs/dbraw/zinc/10/93/08/1027109308.db2.gz DXWGUXQQFOZRRJ-UHFFFAOYSA-N 1 0 343.427 3.528 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000520213271 1027181031 /nfs/dbraw/zinc/18/10/31/1027181031.db2.gz RRADONZBWUKKHB-INIZCTEOSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](CO)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000531696814 1027215587 /nfs/dbraw/zinc/21/55/87/1027215587.db2.gz GWFGURLWGGXKER-ZBFHGGJFSA-N 1 0 346.402 3.544 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000531725934 1027246558 /nfs/dbraw/zinc/24/65/58/1027246558.db2.gz LLNSEAKZWSTOLP-VVRPULACSA-N 1 0 338.473 3.634 20 5 EHBDRO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178647742 1027279342 /nfs/dbraw/zinc/27/93/42/1027279342.db2.gz RDBJKCDMTPBZFG-CQSZACIVSA-N 1 0 347.459 3.673 20 5 EHBDRO CC(C)[C@@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135648477 1027512250 /nfs/dbraw/zinc/51/22/50/1027512250.db2.gz MYINEPUKMZAVND-GFCCVEGCSA-N 1 0 327.222 3.835 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000783592737 1027526191 /nfs/dbraw/zinc/52/61/91/1027526191.db2.gz MUDQPIUZJZPLRQ-INIZCTEOSA-N 1 0 345.830 3.612 20 5 EHBDRO CN(C)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000783592551 1027539582 /nfs/dbraw/zinc/53/95/82/1027539582.db2.gz IMKJYSHHKSHSJV-INIZCTEOSA-N 1 0 347.846 3.511 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178656794 1027612422 /nfs/dbraw/zinc/61/24/22/1027612422.db2.gz HRKWAPPXAAMQAH-WBVHZDCISA-N 1 0 325.412 3.914 20 5 EHBDRO Cc1cc(NC2CCC([NH+](C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000420625697 1027651422 /nfs/dbraw/zinc/65/14/22/1027651422.db2.gz LEOVWDSMQCEBLG-UHFFFAOYSA-N 1 0 328.416 3.736 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000178687191 1027971712 /nfs/dbraw/zinc/97/17/12/1027971712.db2.gz JABCKJXFUBVLMC-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO CC(C)(CCc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444624899 1028097762 /nfs/dbraw/zinc/09/77/62/1028097762.db2.gz GLKACIWZJJLHIV-UHFFFAOYSA-N 1 0 338.411 3.972 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCC[C@@H]1C ZINC000444679070 1028147385 /nfs/dbraw/zinc/14/73/85/1028147385.db2.gz SYBJJNCKUPWGIM-SUMWQHHRSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000444764105 1028248660 /nfs/dbraw/zinc/24/86/60/1028248660.db2.gz AYHXGEMYDBVGJE-CQSZACIVSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000421373206 1028332409 /nfs/dbraw/zinc/33/24/09/1028332409.db2.gz DPRQUGHKONQHEP-GOEBONIOSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000161867678 1028333502 /nfs/dbraw/zinc/33/35/02/1028333502.db2.gz KQUDNKSGYFTPIK-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000421394506 1028374464 /nfs/dbraw/zinc/37/44/64/1028374464.db2.gz XOQZVQDHXKYQLX-ZIAGYGMSSA-N 1 0 330.384 3.902 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2o1 ZINC000472272889 1028390375 /nfs/dbraw/zinc/39/03/75/1028390375.db2.gz FHWPYOGXYCIWAA-UHFFFAOYSA-N 1 0 326.352 3.852 20 5 EHBDRO CCc1ccc([C@H](N[C@@H]2CCC[C@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375033 1028412238 /nfs/dbraw/zinc/41/22/38/1028412238.db2.gz IPIWAEXTGNMUPC-QMTMVMCOSA-N 1 0 343.427 3.699 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCCC[NH+]1CCCCC1 ZINC000421461318 1028435341 /nfs/dbraw/zinc/43/53/41/1028435341.db2.gz RPOIBHHNBMIMMI-UHFFFAOYSA-N 1 0 347.459 3.598 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C)cc(N)c2)cc1[N+](=O)[O-] ZINC000423481276 1028464572 /nfs/dbraw/zinc/46/45/72/1028464572.db2.gz QCUJPLJDORDYOA-CYBMUJFWSA-N 1 0 329.400 3.735 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000162343863 1028624714 /nfs/dbraw/zinc/62/47/14/1028624714.db2.gz JKENJBHNNHVYSI-BBRMVZONSA-N 1 0 329.400 3.961 20 5 EHBDRO O=C(C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000532737525 1028775398 /nfs/dbraw/zinc/77/53/98/1028775398.db2.gz ZGYPVPAJNHYASL-GOSISDBHSA-N 1 0 342.370 3.971 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000909623293 1028885200 /nfs/dbraw/zinc/88/52/00/1028885200.db2.gz AKNCPCAPHLVPNG-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4C[C@H]4C3)o2)c([N+](=O)[O-])c1 ZINC000424204903 1028890513 /nfs/dbraw/zinc/89/05/13/1028890513.db2.gz MXTMFMOMFCRDIT-CLLJXQQHSA-N 1 0 328.368 3.752 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000909624638 1028925788 /nfs/dbraw/zinc/92/57/88/1028925788.db2.gz JKMKZWLTJNOFSD-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CN(C2CC2)C[C@H]1C ZINC000504917993 1029043775 /nfs/dbraw/zinc/04/37/75/1029043775.db2.gz FPQJHFGDIQLHGA-IIAWOOMASA-N 1 0 349.500 3.538 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000504906030 1029049848 /nfs/dbraw/zinc/04/98/48/1029049848.db2.gz RQQSDTYTUNCIDO-QAPCUYQASA-N 1 0 349.475 3.765 20 5 EHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513819865 1029522368 /nfs/dbraw/zinc/52/23/68/1029522368.db2.gz FQBZTOVTQMRKOZ-PCODUJHASA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@@H]1C[N@@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988780 1029575527 /nfs/dbraw/zinc/57/55/27/1029575527.db2.gz JSICUHZRMWEXML-RNCFNFMXSA-N 1 0 329.322 3.508 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428442186 1029623925 /nfs/dbraw/zinc/62/39/25/1029623925.db2.gz SVQRGYCXVJVQES-KEEQEYLASA-N 1 0 340.423 3.957 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000162911646 1029680652 /nfs/dbraw/zinc/68/06/52/1029680652.db2.gz UHDQDNICDCNOQF-OBEAKCLQSA-N 1 0 338.473 3.634 20 5 EHBDRO CCCC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000544414306 1029690894 /nfs/dbraw/zinc/69/08/94/1029690894.db2.gz BHCFKOUDUZSWQC-UKRRQHHQSA-N 1 0 333.432 3.870 20 5 EHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446837582 1029808131 /nfs/dbraw/zinc/80/81/31/1029808131.db2.gz YHCBSHJHIJUNGD-VIFPVBQESA-N 1 0 330.310 3.682 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cn[nH]c1 ZINC000533803629 1029850652 /nfs/dbraw/zinc/85/06/52/1029850652.db2.gz VHGBYLRZIVFFBQ-NSHDSACASA-N 1 0 328.397 3.897 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCCc2occc21 ZINC000152250641 1029867879 /nfs/dbraw/zinc/86/78/79/1029867879.db2.gz NKGFMOUZDSTNGN-LRDDRELGSA-N 1 0 343.383 3.572 20 5 EHBDRO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000531867876 1029941830 /nfs/dbraw/zinc/94/18/30/1029941830.db2.gz KBHBWSGKDKQNPI-OAHLLOKOSA-N 1 0 334.416 3.539 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](CC)COCC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000453258965 1029990816 /nfs/dbraw/zinc/99/08/16/1029990816.db2.gz OLQCGVJUYYOPBC-GXTWGEPZSA-N 1 0 334.338 3.993 20 5 EHBDRO C[C@H](CCCO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453285216 1030027831 /nfs/dbraw/zinc/02/78/31/1030027831.db2.gz WVYKEESVEKHGQE-DNVCBOLYSA-N 1 0 328.412 3.682 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000453307288 1030076317 /nfs/dbraw/zinc/07/63/17/1030076317.db2.gz BWISUICDCKRTIZ-GJZGRUSLSA-N 1 0 348.443 3.993 20 5 EHBDRO CCC[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525781751 1030115290 /nfs/dbraw/zinc/11/52/90/1030115290.db2.gz VRBSGJMLFPIAOL-SFHVURJKSA-N 1 0 334.416 3.864 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC(C)CC1 ZINC000481971112 1030140842 /nfs/dbraw/zinc/14/08/42/1030140842.db2.gz FZJNZOJECPVUPP-APWZRJJASA-N 1 0 345.487 3.626 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCOC1 ZINC000453356783 1030149397 /nfs/dbraw/zinc/14/93/97/1030149397.db2.gz JCHIVNNDXDJVFY-HUUCEWRRSA-N 1 0 338.473 3.872 20 5 EHBDRO CC1(C)C[C@@H]([N@@H+]2CCC[C@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381843 1030162979 /nfs/dbraw/zinc/16/29/79/1030162979.db2.gz RIGNCQNQXOEKMD-MJGOQNOKSA-N 1 0 330.428 3.820 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H]2CCCC[C@H]2O)c2ccccc2)c1 ZINC000453389711 1030170869 /nfs/dbraw/zinc/17/08/69/1030170869.db2.gz XMNBZJCSZPKVEB-SXLOBPIMSA-N 1 0 340.423 3.825 20 5 EHBDRO Cc1ccccc1C[C@@H](C)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447404482 1030172249 /nfs/dbraw/zinc/17/22/49/1030172249.db2.gz JWJYQVYWYUZFHV-CQSZACIVSA-N 1 0 338.411 3.843 20 5 EHBDRO COc1ccccc1CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447506435 1030251880 /nfs/dbraw/zinc/25/18/80/1030251880.db2.gz CNAMROGAZVIVJR-GOSISDBHSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2cccc(Cl)c2)n1 ZINC000447510958 1030258406 /nfs/dbraw/zinc/25/84/06/1030258406.db2.gz REUCWOSPOHWTRB-GJZGRUSLSA-N 1 0 334.807 3.718 20 5 EHBDRO CCc1ccc([C@@H](CO)[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447575021 1030293782 /nfs/dbraw/zinc/29/37/82/1030293782.db2.gz PTEHBWRBHBSBPE-VQTJNVASSA-N 1 0 340.423 3.858 20 5 EHBDRO Cc1ccsc1[C@@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447583755 1030315265 /nfs/dbraw/zinc/31/52/65/1030315265.db2.gz CAXKLVPLOLAQHJ-JKSUJKDBSA-N 1 0 332.425 3.665 20 5 EHBDRO Cc1cc(F)ccc1CC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447578228 1030341865 /nfs/dbraw/zinc/34/18/65/1030341865.db2.gz DMKLSNIXGROQJU-IAGOWNOFSA-N 1 0 346.406 3.555 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@@H+]1C1CC1 ZINC000583666502 1030394887 /nfs/dbraw/zinc/39/48/87/1030394887.db2.gz BXUPSIHINWMCBK-GXTWGEPZSA-N 1 0 333.432 3.809 20 5 EHBDRO C[C@@H](CC(C)(C)C)[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000453606237 1030395059 /nfs/dbraw/zinc/39/50/59/1030395059.db2.gz VKZGLSOVBNMINU-ZDUSSCGKSA-N 1 0 330.432 3.910 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1C[C@H](C)O ZINC000447836901 1030527382 /nfs/dbraw/zinc/52/73/82/1030527382.db2.gz YOVHCEZXVBRMQT-GOEBONIOSA-N 1 0 336.432 3.507 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2nc(C)no2)CC1 ZINC000347363440 1030708848 /nfs/dbraw/zinc/70/88/48/1030708848.db2.gz QIXYCXMYPAVAHQ-RAXLEYEMSA-N 1 0 342.399 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000527326341 1030798809 /nfs/dbraw/zinc/79/88/09/1030798809.db2.gz AZKQJVQQTGAQHB-NWDGAFQWSA-N 1 0 332.322 3.684 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000249213486 1030831037 /nfs/dbraw/zinc/83/10/37/1030831037.db2.gz DFJGXVDATKCAFT-MFKMUULPSA-N 1 0 338.458 3.608 20 5 EHBDRO Cc1ccc2cc(C[NH2+]CCOc3ccc([N+](=O)[O-])cc3)ccc2n1 ZINC000527361550 1030854682 /nfs/dbraw/zinc/85/46/82/1030854682.db2.gz HJECIKVSQKXKSG-UHFFFAOYSA-N 1 0 337.379 3.620 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000483101038 1030952353 /nfs/dbraw/zinc/95/23/53/1030952353.db2.gz OWRUPAWTHTURGU-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CC3CC3)CC3CCC3)n2)cc1 ZINC000483266223 1031078205 /nfs/dbraw/zinc/07/82/05/1031078205.db2.gz VGRDJUNRDIBJQB-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO CCC[C@H]1CCCC[C@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000548160127 1031237202 /nfs/dbraw/zinc/23/72/02/1031237202.db2.gz VIBKWHSLTSCVHG-WMLDXEAASA-N 1 0 333.432 3.506 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC[C@H]2CCC(F)(F)C2)n1 ZINC000903340527 1031344005 /nfs/dbraw/zinc/34/40/05/1031344005.db2.gz JAMQYPDONNEASZ-MGPQQGTHSA-N 1 0 342.390 3.690 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CC[C@H]4CCCC[C@@H]4[NH2+]3)n2)s1 ZINC000904110278 1031734450 /nfs/dbraw/zinc/73/44/50/1031734450.db2.gz QVZGCMQWAYALEB-VWYCJHECSA-N 1 0 334.401 3.690 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475740201 1031737404 /nfs/dbraw/zinc/73/74/04/1031737404.db2.gz AXWZDOUMUIVVDQ-QGZVFWFLSA-N 1 0 348.830 3.938 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1)CC1CC1 ZINC000537823974 1031943118 /nfs/dbraw/zinc/94/31/18/1031943118.db2.gz WVWWTLZSMXVAKN-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000537950704 1032035645 /nfs/dbraw/zinc/03/56/45/1032035645.db2.gz JDKHDIVXJUXJAW-KUHUBIRLSA-N 1 0 325.412 3.741 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000537975069 1032055932 /nfs/dbraw/zinc/05/59/32/1032055932.db2.gz ASCRFJHBVDOMAP-SFHVURJKSA-N 1 0 342.395 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@@H]34)s2)cc1 ZINC000249991023 1033306720 /nfs/dbraw/zinc/30/67/20/1033306720.db2.gz ZUNOSBVKTMFHBL-GVDBMIGSSA-N 1 0 344.436 3.980 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@]12C[C@H]1COC21CCC1 ZINC000898064738 1033309904 /nfs/dbraw/zinc/30/99/04/1033309904.db2.gz KXFWPRVVIXUJPZ-ANVZNTJQSA-N 1 0 328.412 3.547 20 5 EHBDRO COc1nc(C)cc(C)c1CN(C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000598651012 1033365764 /nfs/dbraw/zinc/36/57/64/1033365764.db2.gz ZZJDOPLQBXMCQH-AWEZNQCLSA-N 1 0 329.400 3.808 20 5 EHBDRO Cc1cnc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000594508171 1033392337 /nfs/dbraw/zinc/39/23/37/1033392337.db2.gz BLISCWQNAPXWDI-LJQANCHMSA-N 1 0 339.439 3.760 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCc1ccn(-c2ccccc2)n1 ZINC000594493045 1033393122 /nfs/dbraw/zinc/39/31/22/1033393122.db2.gz DWDFAMOBOJVMTC-LJQANCHMSA-N 1 0 348.406 3.600 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490671 1033394143 /nfs/dbraw/zinc/39/41/43/1033394143.db2.gz PFCFJCIYYQESEE-SCLBCKFNSA-N 1 0 349.394 3.514 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594489569 1033394202 /nfs/dbraw/zinc/39/42/02/1033394202.db2.gz DBLAHPLPVKHPGT-SJKOYZFVSA-N 1 0 342.395 3.950 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCc3cc(C)cc(C)c32)cc1[N+](=O)[O-] ZINC000594493195 1033394318 /nfs/dbraw/zinc/39/43/18/1033394318.db2.gz GMUCFCXRIWWDLR-INIZCTEOSA-N 1 0 326.396 3.997 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CCC(OC(F)F)CC1 ZINC000594505780 1033406396 /nfs/dbraw/zinc/40/63/96/1033406396.db2.gz AINQJDPPPKAUGJ-QIMFLAQGSA-N 1 0 326.343 3.722 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505831 1033406652 /nfs/dbraw/zinc/40/66/52/1033406652.db2.gz BPQJMDDVSWVTON-MFKMUULPSA-N 1 0 332.322 3.529 20 5 EHBDRO Cc1ncccc1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000898249998 1033407488 /nfs/dbraw/zinc/40/74/88/1033407488.db2.gz JLMAWCXRPMKTDS-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO Cc1cc(N2CCC[C@H](OC(F)F)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611931169 1033415237 /nfs/dbraw/zinc/41/52/37/1033415237.db2.gz YMZYCBVAWFYKTP-LBPRGKRZSA-N 1 0 337.326 3.659 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594512883 1033417339 /nfs/dbraw/zinc/41/73/39/1033417339.db2.gz SKUPXPACVHQJSS-AGRHKRQWSA-N 1 0 348.443 3.992 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000441386256 1033477258 /nfs/dbraw/zinc/47/72/58/1033477258.db2.gz UJSBQYMMADZMEE-IBGZPJMESA-N 1 0 346.427 3.805 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(CO)CC1 ZINC000594968740 1033576585 /nfs/dbraw/zinc/57/65/85/1033576585.db2.gz JOHINVUAOLXLGI-GFCCVEGCSA-N 1 0 332.425 3.574 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000595015582 1033606770 /nfs/dbraw/zinc/60/67/70/1033606770.db2.gz ZEVMRHQRCAKKKE-QWHCGFSZSA-N 1 0 330.384 3.591 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000598954355 1033608468 /nfs/dbraw/zinc/60/84/68/1033608468.db2.gz CDBSBDJXVINHIT-GFCCVEGCSA-N 1 0 345.399 3.567 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[C@@H]1CCCC[C@H]1O ZINC000595022309 1033613835 /nfs/dbraw/zinc/61/38/35/1033613835.db2.gz LAISMINQSWSRHQ-GRDNDAEWSA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC000595021430 1033614889 /nfs/dbraw/zinc/61/48/89/1033614889.db2.gz DKVBLDSDPBUXAN-SUMWQHHRSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCc1ccn(C2CCCC2)n1 ZINC000595023838 1033616695 /nfs/dbraw/zinc/61/66/95/1033616695.db2.gz YUGBPVXRBUTCAY-CYBMUJFWSA-N 1 0 344.415 3.766 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282026197 1033621206 /nfs/dbraw/zinc/62/12/06/1033621206.db2.gz KOKQLNTXHFIBEP-GOSISDBHSA-N 1 0 348.443 3.821 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@@H]3CCCOC3)cs2)c1 ZINC000598985020 1033632216 /nfs/dbraw/zinc/63/22/16/1033632216.db2.gz GMRUNOCJLUPRFK-ZDUSSCGKSA-N 1 0 347.440 3.625 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)nn(C)c1C ZINC000595027281 1033648328 /nfs/dbraw/zinc/64/83/28/1033648328.db2.gz RCFNLXUZXYPLGE-BZNIZROVSA-N 1 0 346.431 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2c(Cl)oc3ccccc32)cc1 ZINC000761314157 1033661178 /nfs/dbraw/zinc/66/11/78/1033661178.db2.gz VARNGDGKKUWHEM-HNNXBMFYSA-N 1 0 346.770 3.818 20 5 EHBDRO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000599045944 1033675144 /nfs/dbraw/zinc/67/51/44/1033675144.db2.gz FDOCCCXLLYKHMW-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)[C@H](C)c1ccccc1 ZINC000595099545 1033688619 /nfs/dbraw/zinc/68/86/19/1033688619.db2.gz NPYHBOICVYYVDS-VCBZYWHSSA-N 1 0 328.412 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccc3occc3c2)n1 ZINC000595075809 1033694742 /nfs/dbraw/zinc/69/47/42/1033694742.db2.gz YZXFZNLAQKAOTO-CVEARBPZSA-N 1 0 340.383 3.811 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599055057 1033707148 /nfs/dbraw/zinc/70/71/48/1033707148.db2.gz FWULDFUSGOGESJ-ZIAGYGMSSA-N 1 0 342.321 3.636 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@]3(CCCc4ccccc43)C2)c1[N+](=O)[O-] ZINC000595339399 1033732753 /nfs/dbraw/zinc/73/27/53/1033732753.db2.gz OBOYBBUZYKGAOE-IBGZPJMESA-N 1 0 341.411 3.761 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)ccc2cnccc21 ZINC000599097332 1033733111 /nfs/dbraw/zinc/73/31/11/1033733111.db2.gz BTIBFRCCZYXRKE-DOTOQJQBSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@@H]2Oc2cccc(C)c2)c1[N+](=O)[O-] ZINC000595447678 1033814224 /nfs/dbraw/zinc/81/42/24/1033814224.db2.gz IFYVLKMQTXKTNY-CVEARBPZSA-N 1 0 345.399 3.679 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2ccccc2)C2CC2)c1 ZINC000593020289 1033824940 /nfs/dbraw/zinc/82/49/40/1033824940.db2.gz FTSRIZZNEXRZOF-GOSISDBHSA-N 1 0 340.379 3.622 20 5 EHBDRO C[N@H+](CCc1nsc2ccccc21)CCc1cccc([N+](=O)[O-])c1 ZINC000595478178 1033825027 /nfs/dbraw/zinc/82/50/27/1033825027.db2.gz YPNYTYWYCFTWDY-UHFFFAOYSA-N 1 0 341.436 3.922 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccs1 ZINC000595496245 1033831930 /nfs/dbraw/zinc/83/19/30/1033831930.db2.gz FNRSCGCCXRPHQR-OAHLLOKOSA-N 1 0 338.404 3.645 20 5 EHBDRO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000174282461 1033878823 /nfs/dbraw/zinc/87/88/23/1033878823.db2.gz RYFIPTSNMVECOC-SFHVURJKSA-N 1 0 332.375 3.598 20 5 EHBDRO COc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c(C)c1OC ZINC000575217989 1033895109 /nfs/dbraw/zinc/89/51/09/1033895109.db2.gz LSTUKYHYZARKNX-UHFFFAOYSA-N 1 0 344.411 3.595 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(CN3CCC(C4CCC4)CC3)n2)c1 ZINC000595660494 1033940096 /nfs/dbraw/zinc/94/00/96/1033940096.db2.gz SLCQPIYMUKTXJR-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO CC(C)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000595686137 1033945394 /nfs/dbraw/zinc/94/53/94/1033945394.db2.gz QHMPYUONVQXPSR-SFHVURJKSA-N 1 0 345.374 3.659 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000603867930 1033993821 /nfs/dbraw/zinc/99/38/21/1033993821.db2.gz DGLVQZGLSXWRLT-SFHVURJKSA-N 1 0 330.359 3.950 20 5 EHBDRO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093694 1034078376 /nfs/dbraw/zinc/07/83/76/1034078376.db2.gz DPIRGJCUGCTNFT-RDJZCZTQSA-N 1 0 331.460 3.676 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1F ZINC000599674991 1034080231 /nfs/dbraw/zinc/08/02/31/1034080231.db2.gz FXPLRERLSRGUKH-ZDUSSCGKSA-N 1 0 348.349 3.871 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692814 1034097088 /nfs/dbraw/zinc/09/70/88/1034097088.db2.gz XXSUTATXMWCVRX-PYLYLYNFSA-N 1 0 332.400 3.640 20 5 EHBDRO COc1cc(CN(C)Cc2cc([N+](=O)[O-])ccc2Cl)ccc1O ZINC000177049987 1034224601 /nfs/dbraw/zinc/22/46/01/1034224601.db2.gz UWRAWWIMQULRFA-UHFFFAOYSA-N 1 0 336.775 3.594 20 5 EHBDRO CC(=O)c1cc(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000596481057 1034254204 /nfs/dbraw/zinc/25/42/04/1034254204.db2.gz WPFBSDGTZOGFCI-OAHLLOKOSA-N 1 0 331.416 3.616 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000456272856 1034275145 /nfs/dbraw/zinc/27/51/45/1034275145.db2.gz LOSZVOKQGABBEE-GOSISDBHSA-N 1 0 339.395 3.704 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000456272857 1034275307 /nfs/dbraw/zinc/27/53/07/1034275307.db2.gz LOSZVOKQGABBEE-SFHVURJKSA-N 1 0 339.395 3.704 20 5 EHBDRO CCOc1cc(NC[C@H]2CCC[N@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596570736 1034292972 /nfs/dbraw/zinc/29/29/72/1034292972.db2.gz NEFSGXSKHWQAEY-OAHLLOKOSA-N 1 0 333.432 3.527 20 5 EHBDRO CC[C@H](CCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152668740 1034351466 /nfs/dbraw/zinc/35/14/66/1034351466.db2.gz BWHYFNRSDPOGOS-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000612174606 1034379817 /nfs/dbraw/zinc/37/98/17/1034379817.db2.gz PAXKWOZKTIINHY-QGZVFWFLSA-N 1 0 330.359 3.696 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000120106061 1034433781 /nfs/dbraw/zinc/43/37/81/1034433781.db2.gz NPFLQXSMLUGRKU-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)O1 ZINC000597224728 1034625009 /nfs/dbraw/zinc/62/50/09/1034625009.db2.gz IUBLXGBDIFWFKS-KGLIPLIRSA-N 1 0 330.384 3.854 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000177148068 1034697211 /nfs/dbraw/zinc/69/72/11/1034697211.db2.gz ABBLYWBAWVSBJK-GOSISDBHSA-N 1 0 344.386 3.568 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000450855969 1034899034 /nfs/dbraw/zinc/89/90/34/1034899034.db2.gz HVIKTAVNEREGBC-NUEKZKHPSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)n1 ZINC000365504135 1035368723 /nfs/dbraw/zinc/36/87/23/1035368723.db2.gz BDCGSZFJWJANKZ-UHFFFAOYSA-N 1 0 336.342 3.566 20 5 EHBDRO CN(C(=O)C[NH2+][C@H]1CCCCC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000463449468 1035515990 /nfs/dbraw/zinc/51/59/90/1035515990.db2.gz PPDKAAYCWVNRCU-KRWDZBQOSA-N 1 0 345.443 3.650 20 5 EHBDRO COc1cc(N2CCC(CCC[NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000443905271 1035605859 /nfs/dbraw/zinc/60/58/59/1035605859.db2.gz OPEHXAUBAVFCKX-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271988930 1035634806 /nfs/dbraw/zinc/63/48/06/1035634806.db2.gz FWHBJLUDBDXCLB-RBUKOAKNSA-N 1 0 326.396 3.678 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CC[C@H](CO)CC2)s1 ZINC000153142097 1035683579 /nfs/dbraw/zinc/68/35/79/1035683579.db2.gz PZDHYGBWAJGKDC-OKILXGFUSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534837242 1035684296 /nfs/dbraw/zinc/68/42/96/1035684296.db2.gz KEYOGYYFQKTUPF-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO O=[N+]([O-])c1sccc1N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000588072501 1035700506 /nfs/dbraw/zinc/70/05/06/1035700506.db2.gz RXUHBDIRTIXGRB-GOSISDBHSA-N 1 0 343.452 3.759 20 5 EHBDRO C[C@@H]1C[C@H](c2cccnc2)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204723 1035823068 /nfs/dbraw/zinc/82/30/68/1035823068.db2.gz ASUXXYDDVNSMKR-DNVCBOLYSA-N 1 0 341.411 3.842 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H](OC)C23CCC3)cc1[N+](=O)[O-] ZINC000414188427 1035956294 /nfs/dbraw/zinc/95/62/94/1035956294.db2.gz QGHPNFFBJXXYNY-ZLIFDBKOSA-N 1 0 334.416 3.602 20 5 EHBDRO COC1CCC([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000414191594 1035975796 /nfs/dbraw/zinc/97/57/96/1035975796.db2.gz UJXRXDHENSJHAZ-IWCVFHTOSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCC[NH+]1CCCCCC1 ZINC000463970708 1036017548 /nfs/dbraw/zinc/01/75/48/1036017548.db2.gz HGEBHVIVAGRBBT-UHFFFAOYSA-N 1 0 348.447 3.599 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000588928738 1036188703 /nfs/dbraw/zinc/18/87/03/1036188703.db2.gz OOVFUNJCDMWZMW-LLCTXKFZSA-N 1 0 346.814 3.627 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1-n1ccnc1 ZINC000152241714 1036203599 /nfs/dbraw/zinc/20/35/99/1036203599.db2.gz LPWIBCFNBDYASN-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@@H](CO)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000535369500 1036405109 /nfs/dbraw/zinc/40/51/09/1036405109.db2.gz DAGZYPKVSPUMIT-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO CSC1(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCC1 ZINC000589501755 1036440755 /nfs/dbraw/zinc/44/07/55/1036440755.db2.gz DBLZMGNHHOFBLT-UHFFFAOYSA-N 1 0 336.457 3.724 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H](C)C[C@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541568375 1036458816 /nfs/dbraw/zinc/45/88/16/1036458816.db2.gz OUOXKAPMNARPOI-ZJNRKIDTSA-N 1 0 332.400 3.589 20 5 EHBDRO Cc1ccc(SCC[N@@H+]2CCc3ncc([N+](=O)[O-])cc3C2)cc1C ZINC000541620081 1036526045 /nfs/dbraw/zinc/52/60/45/1036526045.db2.gz BNDQVXDHRWYYRW-UHFFFAOYSA-N 1 0 343.452 3.757 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(NC(N)=O)cc1 ZINC000165433810 1036558024 /nfs/dbraw/zinc/55/80/24/1036558024.db2.gz PRTXGXBNCBKYFA-QWHCGFSZSA-N 1 0 342.399 3.806 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000152750714 1036631521 /nfs/dbraw/zinc/63/15/21/1036631521.db2.gz GGOFEIYYJQXRFE-STQMWFEESA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NCC[NH+]3Cc4ccccc4C3)ccnc21 ZINC000590079709 1036733387 /nfs/dbraw/zinc/73/33/87/1036733387.db2.gz UBZSEPIIOFOJPD-UHFFFAOYSA-N 1 0 334.379 3.571 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000064114363 1036846549 /nfs/dbraw/zinc/84/65/49/1036846549.db2.gz WBIQPSQVSLVLHN-KRWDZBQOSA-N 1 0 345.399 3.885 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000414350214 1036883545 /nfs/dbraw/zinc/88/35/45/1036883545.db2.gz QGHJLRJELNHNGK-XJKSGUPXSA-N 1 0 329.375 3.663 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCCc4n[nH]cc4C3)o2)cc1 ZINC000597257597 1036899649 /nfs/dbraw/zinc/89/96/49/1036899649.db2.gz HBJIGPOQFVIALS-UHFFFAOYSA-N 1 0 338.367 3.526 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000311034427 1036946008 /nfs/dbraw/zinc/94/60/08/1036946008.db2.gz QUDOHZYEGGSBQN-CQSZACIVSA-N 1 0 347.365 3.807 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@@H](CC)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000152851885 1036999458 /nfs/dbraw/zinc/99/94/58/1036999458.db2.gz BNFYZLXCVRCXAT-GOEBONIOSA-N 1 0 335.448 3.519 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519671 1037097221 /nfs/dbraw/zinc/09/72/21/1037097221.db2.gz DCCJNQQFGNSJIF-BETUJISGSA-N 1 0 325.840 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2ccc(F)c(F)c2)cc1Cl ZINC000761520233 1037098854 /nfs/dbraw/zinc/09/88/54/1037098854.db2.gz MXIGJHRRNDEHFE-UHFFFAOYSA-N 1 0 342.729 3.695 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769557 1037166936 /nfs/dbraw/zinc/16/69/36/1037166936.db2.gz XBMRNMHBUNKGDR-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO CC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000472607884 1037254828 /nfs/dbraw/zinc/25/48/28/1037254828.db2.gz DTGKJZNQAPAHBH-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CC[NH2+]C4(CCC4)C3)o2)c1 ZINC000591282634 1037319567 /nfs/dbraw/zinc/31/95/67/1037319567.db2.gz IMLVUKFKPLEQSQ-OAHLLOKOSA-N 1 0 341.411 3.619 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2(c3ccc(F)cc3)CCOCC2)cc1 ZINC000170971922 1037395436 /nfs/dbraw/zinc/39/54/36/1037395436.db2.gz PXNPATUOVMKTFS-UHFFFAOYSA-N 1 0 344.386 3.572 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CC[C@@H](O)C2)s1 ZINC000188843236 1037435525 /nfs/dbraw/zinc/43/55/25/1037435525.db2.gz BFANAEYBYIIMHF-CHWSQXEVSA-N 1 0 332.425 3.574 20 5 EHBDRO CC(C)[NH2+]CCC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000573367040 1037459160 /nfs/dbraw/zinc/45/91/60/1037459160.db2.gz CVHKAYHAGDQNIO-UHFFFAOYSA-N 1 0 343.383 3.714 20 5 EHBDRO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790589 1037531017 /nfs/dbraw/zinc/53/10/17/1037531017.db2.gz PFZNVOGXPLJXBL-LBTNJELSSA-N 1 0 344.411 3.836 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@@H]2CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000493714457 1037575271 /nfs/dbraw/zinc/57/52/71/1037575271.db2.gz YUZRIMURXWZZDK-GDBMZVCRSA-N 1 0 336.432 3.631 20 5 EHBDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168432 1037636244 /nfs/dbraw/zinc/63/62/44/1037636244.db2.gz INQXQPQMNAEEFW-GOSISDBHSA-N 1 0 342.395 3.786 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540173949 1037641873 /nfs/dbraw/zinc/64/18/73/1037641873.db2.gz NLMBMVKLTCKRAJ-ZMZPIMSZSA-N 1 0 330.359 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)CCC[C@H]1C ZINC000532571286 1037672231 /nfs/dbraw/zinc/67/22/31/1037672231.db2.gz LWZWJXVAISYVKV-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cnc(Nc2ccc(CC[NH+]3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC000463052355 1037700379 /nfs/dbraw/zinc/70/03/79/1037700379.db2.gz BYBZIHVJALGWRX-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO C[C@H]([NH2+]CCCOCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000480912651 1037709773 /nfs/dbraw/zinc/70/97/73/1037709773.db2.gz QQRQPEIAZLTALG-INIZCTEOSA-N 1 0 328.412 3.895 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2)[C@@H](CO)C2CCC2)cs1 ZINC000592139214 1037856477 /nfs/dbraw/zinc/85/64/77/1037856477.db2.gz OLCVWMITWCDCMN-KRWDZBQOSA-N 1 0 346.452 3.820 20 5 EHBDRO Cc1nc2ccccc2nc1C[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897465574 1037875920 /nfs/dbraw/zinc/87/59/20/1037875920.db2.gz XNUOXRYTJSYXNW-ZDUSSCGKSA-N 1 0 336.395 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@@H]2CSc3ccccc3O2)cc1 ZINC000592373052 1037922945 /nfs/dbraw/zinc/92/29/45/1037922945.db2.gz SAXYJEYCEDPZDZ-OAHLLOKOSA-N 1 0 330.409 3.628 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1csc(C)c1 ZINC000592189441 1037926124 /nfs/dbraw/zinc/92/61/24/1037926124.db2.gz UWLYARMRSPBPNO-CYBMUJFWSA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@H]1SCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592380678 1037950447 /nfs/dbraw/zinc/95/04/47/1037950447.db2.gz PAUVZNUEVRNFBN-QMTHXVAHSA-N 1 0 335.454 3.702 20 5 EHBDRO CC(C)(C)OC(=O)[C@@H]1CC[C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000592378502 1037951065 /nfs/dbraw/zinc/95/10/65/1037951065.db2.gz BDHFZSNLIKDHCI-ICFKLAHKSA-N 1 0 346.427 3.708 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117029 1038151575 /nfs/dbraw/zinc/15/15/75/1038151575.db2.gz QFPHWJQJMOTNLO-SWLSCSKDSA-N 1 0 344.415 3.949 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCO1 ZINC000511540507 1038362104 /nfs/dbraw/zinc/36/21/04/1038362104.db2.gz HZQZSCOMOVGRDH-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H](C(C)C)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479941017 1038916781 /nfs/dbraw/zinc/91/67/81/1038916781.db2.gz NBEVOAINADMBDE-QGZVFWFLSA-N 1 0 333.432 3.720 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@](C)(CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000477861707 1038972583 /nfs/dbraw/zinc/97/25/83/1038972583.db2.gz NDTWNOJKLIIYPE-UZLBHIALSA-N 1 0 342.439 3.795 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1cccc2[nH]ccc21 ZINC000500569050 1039009345 /nfs/dbraw/zinc/00/93/45/1039009345.db2.gz IVUWAZDBQAGFHY-UHFFFAOYSA-N 1 0 339.395 3.807 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCc1ccccc1F)C1CC1 ZINC000480085124 1039132345 /nfs/dbraw/zinc/13/23/45/1039132345.db2.gz CNXFXYCIBIKANL-GOSISDBHSA-N 1 0 328.387 3.887 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000026850582 1039177725 /nfs/dbraw/zinc/17/77/25/1039177725.db2.gz OPGIFOKSAKMBHA-KRWDZBQOSA-N 1 0 339.439 3.782 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1)Oc1cc(F)cc(F)c1 ZINC000512496267 1039514295 /nfs/dbraw/zinc/51/42/95/1039514295.db2.gz IMTQHVKRMZDEEP-UHFFFAOYSA-N 1 0 336.338 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCOC[C@@H]1CCCO1)CCCC2 ZINC000417309999 1039663353 /nfs/dbraw/zinc/66/33/53/1039663353.db2.gz GSSCNKWTKADRGR-PKOBYXMFSA-N 1 0 348.443 3.538 20 5 EHBDRO Cc1cnccc1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417313017 1039668769 /nfs/dbraw/zinc/66/87/69/1039668769.db2.gz UNTPAXWQCCVEPQ-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340923 1039704520 /nfs/dbraw/zinc/70/45/20/1039704520.db2.gz AXNCEQHAGFIKLE-GUYCJALGSA-N 1 0 342.395 3.916 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cc(Cl)cc2c1OCC2 ZINC000566474826 1039768271 /nfs/dbraw/zinc/76/82/71/1039768271.db2.gz SWLXBHRLEVOLEW-INIZCTEOSA-N 1 0 344.798 3.960 20 5 EHBDRO COc1cccc2c1CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000489435712 1039974356 /nfs/dbraw/zinc/97/43/56/1039974356.db2.gz XKYQLTLEDHRXOG-UHFFFAOYSA-N 1 0 326.396 3.513 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331059 1039978616 /nfs/dbraw/zinc/97/86/16/1039978616.db2.gz RZPZBRPFCIUQGS-HZSPNIEDSA-N 1 0 333.432 3.576 20 5 EHBDRO CC[N@H+](C)CCNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000236870412 1040077829 /nfs/dbraw/zinc/07/78/29/1040077829.db2.gz KIJDVNJAGQDDPV-UHFFFAOYSA-N 1 0 347.390 3.568 20 5 EHBDRO CC(C)CC[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000053363724 1040242833 /nfs/dbraw/zinc/24/28/33/1040242833.db2.gz LMIYYZOFAIEHBZ-LLVKDONJSA-N 1 0 327.812 3.553 20 5 EHBDRO COc1ccc(CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000490027796 1040295853 /nfs/dbraw/zinc/29/58/53/1040295853.db2.gz RQMYZFFNFZFIKE-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490034538 1040302415 /nfs/dbraw/zinc/30/24/15/1040302415.db2.gz AJAUVHUTJVDMAT-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000479528421 1040324833 /nfs/dbraw/zinc/32/48/33/1040324833.db2.gz QRGOWKLVFZUNFO-DZGCQCFKSA-N 1 0 338.448 3.831 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@H]2CCCCC2(C)C)cccc1[N+](=O)[O-] ZINC000481178651 1040436925 /nfs/dbraw/zinc/43/69/25/1040436925.db2.gz SQLLASVWHKLWQI-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481207348 1040491001 /nfs/dbraw/zinc/49/10/01/1040491001.db2.gz QDFFRUNFHANJFK-AAEUAGOBSA-N 1 0 339.823 3.745 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@H](C)CCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453284389 1040618836 /nfs/dbraw/zinc/61/88/36/1040618836.db2.gz WBJHFFPPFASJSN-LIRRHRJNSA-N 1 0 346.427 3.838 20 5 EHBDRO CC[C@@H](C)[C@@H](O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236867841 1040731052 /nfs/dbraw/zinc/73/10/52/1040731052.db2.gz DWBHLENVKLYQRD-WBMJQRKESA-N 1 0 334.441 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cccc4n[nH]cc43)C2)cc1 ZINC000600167739 1040752868 /nfs/dbraw/zinc/75/28/68/1040752868.db2.gz CEMXOFUBOHXIDC-OAHLLOKOSA-N 1 0 336.395 3.851 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]Cc2cccc(CO)c2)c2ccccc2)c1 ZINC000491031214 1040875780 /nfs/dbraw/zinc/87/57/80/1040875780.db2.gz MNQPJECGOCBRCU-OAQYLSRUSA-N 1 0 348.402 3.966 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000150062319 1041107530 /nfs/dbraw/zinc/10/75/30/1041107530.db2.gz JWLLRKCIHRMHHF-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433235845 1041111386 /nfs/dbraw/zinc/11/13/86/1041111386.db2.gz WWQMXQZUSBXGBQ-SJORKVTESA-N 1 0 332.444 3.704 20 5 EHBDRO CCC[C@@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000512873896 1041159188 /nfs/dbraw/zinc/15/91/88/1041159188.db2.gz HDZPNQFSGRVGRL-GOSISDBHSA-N 1 0 330.384 3.904 20 5 EHBDRO CC(=O)c1cc(N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344415 1041215249 /nfs/dbraw/zinc/21/52/49/1041215249.db2.gz GSORBMUCFBLZHM-VBQJREDUSA-N 1 0 345.443 3.639 20 5 EHBDRO Cc1cc([C@@](C)(O)C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000164181845 1041220165 /nfs/dbraw/zinc/22/01/65/1041220165.db2.gz VICPYIUKRXCTIM-YJYMSZOUSA-N 1 0 346.427 3.623 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854375 1041236946 /nfs/dbraw/zinc/23/69/46/1041236946.db2.gz QGJTZXQMKBQXIR-OAHLLOKOSA-N 1 0 341.411 3.577 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000481701961 1041268859 /nfs/dbraw/zinc/26/88/59/1041268859.db2.gz NALNOZWLKVODES-INIZCTEOSA-N 1 0 342.823 3.706 20 5 EHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000511668799 1041456925 /nfs/dbraw/zinc/45/69/25/1041456925.db2.gz VSILLLZNSGRWBA-ZGBFETHSSA-N 1 0 338.407 3.854 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cscc1Br ZINC000511761249 1041569739 /nfs/dbraw/zinc/56/97/39/1041569739.db2.gz ZXWSWZVVZHESQV-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000432118976 1041614733 /nfs/dbraw/zinc/61/47/33/1041614733.db2.gz ZHFRTPGDZNOINU-GFCCVEGCSA-N 1 0 327.400 3.665 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@](C)(O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181794911 1042213059 /nfs/dbraw/zinc/21/30/59/1042213059.db2.gz UZBDFNIUTCSXNF-QZTJIDSGSA-N 1 0 332.375 3.682 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000112658926 1042416689 /nfs/dbraw/zinc/41/66/89/1042416689.db2.gz HXZYOALUNSERSP-LJQANCHMSA-N 1 0 328.412 3.614 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000112659799 1042419223 /nfs/dbraw/zinc/41/92/23/1042419223.db2.gz PGAAIYTWYOHQAP-LJQANCHMSA-N 1 0 328.412 3.614 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@@H](c2ccccc2)O1 ZINC000063587621 1042706952 /nfs/dbraw/zinc/70/69/52/1042706952.db2.gz MPJBPNWFVWZQRR-KXBFYZLASA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135432 1042864895 /nfs/dbraw/zinc/86/48/95/1042864895.db2.gz CNMRHKJZMPPCFJ-WMLDXEAASA-N 1 0 329.400 3.676 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432327146 1042908082 /nfs/dbraw/zinc/90/80/82/1042908082.db2.gz FNHZWIWNBDOPJJ-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)cc1 ZINC000041840394 1043015288 /nfs/dbraw/zinc/01/52/88/1043015288.db2.gz QFAIBFRKTCBSQB-LJQANCHMSA-N 1 0 326.396 3.540 20 5 EHBDRO Cc1n[nH]cc1CCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279226047 1043602881 /nfs/dbraw/zinc/60/28/81/1043602881.db2.gz ZLUAIPGEGJSDRN-QGZVFWFLSA-N 1 0 328.416 3.571 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000344342320 1043693583 /nfs/dbraw/zinc/69/35/83/1043693583.db2.gz CWRAQAABAOESNC-VNHYZAJKSA-N 1 0 334.416 3.670 20 5 EHBDRO CO[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000344725567 1044343105 /nfs/dbraw/zinc/34/31/05/1044343105.db2.gz GWICIMZUFCDBQI-CYBMUJFWSA-N 1 0 326.805 3.787 20 5 EHBDRO CC[C@H](O)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000344916507 1044681778 /nfs/dbraw/zinc/68/17/78/1044681778.db2.gz JOYGLQBNBJDHQJ-KRWDZBQOSA-N 1 0 343.427 3.613 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N1C[C@@H](C)S[C@@H](C)C1 ZINC000072770471 1126877622 /nfs/dbraw/zinc/87/76/22/1126877622.db2.gz BWYPBOUOZIRMAH-TUAOUCFPSA-N 1 0 348.428 3.532 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000552060069 1127552391 /nfs/dbraw/zinc/55/23/91/1127552391.db2.gz GZYXQOLVDLAXFR-KRWDZBQOSA-N 1 0 326.396 3.887 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1COc2ccccc2C1 ZINC000765330922 1127598316 /nfs/dbraw/zinc/59/83/16/1127598316.db2.gz BYKOQORFEQLLHY-CABCVRRESA-N 1 0 326.396 3.805 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000765335161 1127599413 /nfs/dbraw/zinc/59/94/13/1127599413.db2.gz RFXOLMYAGWNUEQ-LSDHHAIUSA-N 1 0 326.396 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CC[NH+](C4CCCCC4)CC3)sc2c1 ZINC000765574671 1127679239 /nfs/dbraw/zinc/67/92/39/1127679239.db2.gz CIUKADWWTPPIIN-UHFFFAOYSA-N 1 0 346.456 3.659 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@H](c2cccs2)[NH+](C)C)c1 ZINC000301325879 1127737946 /nfs/dbraw/zinc/73/79/46/1127737946.db2.gz ARYJCNHEAHWYQJ-CYBMUJFWSA-N 1 0 339.392 3.519 20 5 EHBDRO COc1cc(NC[C@H](C)[N@@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301340985 1127738300 /nfs/dbraw/zinc/73/83/00/1127738300.db2.gz FQLRPFOXRQGIQL-LBPRGKRZSA-N 1 0 347.440 3.524 20 5 EHBDRO COc1cc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301381713 1127740987 /nfs/dbraw/zinc/74/09/87/1127740987.db2.gz ZPUOIWGMWODGGH-SFHVURJKSA-N 1 0 341.411 3.852 20 5 EHBDRO COc1cc(NC2CC[NH+](CC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301407851 1127741889 /nfs/dbraw/zinc/74/18/89/1127741889.db2.gz MZFQEGACYVSUTH-UHFFFAOYSA-N 1 0 333.432 3.670 20 5 EHBDRO C[C@H](C[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438415 1127744080 /nfs/dbraw/zinc/74/40/80/1127744080.db2.gz HRVTZKZLNKTKDS-CHWSQXEVSA-N 1 0 337.420 3.501 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000265689952 1128002636 /nfs/dbraw/zinc/00/26/36/1128002636.db2.gz FYCZSNFLAOMWQX-UHFFFAOYSA-N 1 0 341.411 3.573 20 5 EHBDRO Cc1cnc(NC2CC[NH+](CC3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000301457055 1128349230 /nfs/dbraw/zinc/34/92/30/1128349230.db2.gz SLLYSDSPSRSSCJ-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ncnc2sc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000553277089 1128405101 /nfs/dbraw/zinc/40/51/01/1128405101.db2.gz ZKUWTMFKYJCTIA-ZDUSSCGKSA-N 1 0 349.460 3.522 20 5 EHBDRO C[N@H+](CCCNc1ncnc2sc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000326697589 1128433016 /nfs/dbraw/zinc/43/30/16/1128433016.db2.gz TWCAOGYZDZXBHD-UHFFFAOYSA-N 1 0 349.460 3.666 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000301465442 1128433257 /nfs/dbraw/zinc/43/32/57/1128433257.db2.gz HKIDVHRBDQEEOT-UHFFFAOYSA-N 1 0 348.403 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000553679281 1128494089 /nfs/dbraw/zinc/49/40/89/1128494089.db2.gz ZFLZVMPLQROSIK-FQEVSTJZSA-N 1 0 337.423 3.697 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cs1 ZINC000273377224 1128515962 /nfs/dbraw/zinc/51/59/62/1128515962.db2.gz GBNQZVRYAARVNC-CABCVRRESA-N 1 0 336.388 3.805 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)Nc1ccc([N+](=O)[O-])c(C)n1)[NH+](C)C ZINC000553706713 1128516685 /nfs/dbraw/zinc/51/66/85/1128516685.db2.gz YVCRVVBTKWNSQI-KDOFPFPSSA-N 1 0 328.416 3.710 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765844783 1128547413 /nfs/dbraw/zinc/54/74/13/1128547413.db2.gz JIFDQOJVDGGCCS-QQGDVQBRSA-N 1 0 344.386 3.681 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542703453 1128548849 /nfs/dbraw/zinc/54/88/49/1128548849.db2.gz NREBROWZIHKNCX-QZTJIDSGSA-N 1 0 345.487 3.990 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000765849489 1128569989 /nfs/dbraw/zinc/56/99/89/1128569989.db2.gz QLYHEOVJSSFVTD-CVEARBPZSA-N 1 0 348.399 3.594 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)Nc2ccc(C[NH3+])cc2)cc1[N+](=O)[O-] ZINC000131713110 1128650353 /nfs/dbraw/zinc/65/03/53/1128650353.db2.gz PGUQOQMQWZHPCV-UHFFFAOYSA-N 1 0 327.384 3.603 20 5 EHBDRO CCc1nc2c(s1)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000123229574 1128703092 /nfs/dbraw/zinc/70/30/92/1128703092.db2.gz NAHCAPPWECHFFG-CQSZACIVSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1nc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301657772 1128848559 /nfs/dbraw/zinc/84/85/59/1128848559.db2.gz SNPDLFASDHJCJY-INIZCTEOSA-N 1 0 326.400 3.547 20 5 EHBDRO O=[N+]([O-])c1sc(CN2CCC[C@H]2C2CC2)cc1Br ZINC001658936311 1120103622 /nfs/dbraw/zinc/10/36/22/1120103622.db2.gz RSQWREVAJXAJIN-NSHDSACASA-N 1 0 331.235 3.793 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673403 1128901375 /nfs/dbraw/zinc/90/13/75/1128901375.db2.gz RJWAONUPVYSHLT-RHSMWYFYSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1c(C[NH2+]CC(C)(C)c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC001648956643 1120269800 /nfs/dbraw/zinc/26/98/00/1120269800.db2.gz QRSKQZFSYXNECV-UHFFFAOYSA-N 1 0 342.395 3.699 20 5 EHBDRO C[C@@H](NCc1csc([N+](=O)[O-])c1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245300 1121131898 /nfs/dbraw/zinc/13/18/98/1121131898.db2.gz XDIIOAJLVWRAAS-PBHICJAKSA-N 1 0 345.468 3.657 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1C[C@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000311001843 1128975403 /nfs/dbraw/zinc/97/54/03/1128975403.db2.gz INDGZJRTCYIUPE-QZTJIDSGSA-N 1 0 337.423 3.553 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000311034425 1128977148 /nfs/dbraw/zinc/97/71/48/1128977148.db2.gz QUDOHZYEGGSBQN-AWEZNQCLSA-N 1 0 347.365 3.807 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@H]21 ZINC000301716087 1128981212 /nfs/dbraw/zinc/98/12/12/1128981212.db2.gz NDFLOTNZLVAZKD-SMDDNHRTSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000762616351 1121383776 /nfs/dbraw/zinc/38/37/76/1121383776.db2.gz SAARJDZHKLXKCW-XDHHUUJGSA-N 1 0 336.482 3.577 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000542977380 1128982063 /nfs/dbraw/zinc/98/20/63/1128982063.db2.gz FSJCNUHSBLNQES-YEWWUXTCSA-N 1 0 345.443 3.742 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000495744928 1121396058 /nfs/dbraw/zinc/39/60/58/1121396058.db2.gz IWGSYAVMHCGDNK-GFCCVEGCSA-N 1 0 329.356 3.624 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CCN(C2CCCC2)C1)C1CC1 ZINC000153682307 1121581208 /nfs/dbraw/zinc/58/12/08/1121581208.db2.gz OPGAJSYCQGAFOS-HKUYNNGSSA-N 1 0 343.471 3.522 20 5 EHBDRO C[C@@H]1C[N@@H+](CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301737021 1129010718 /nfs/dbraw/zinc/01/07/18/1129010718.db2.gz VOPYQHSCVAQMPJ-BETUJISGSA-N 1 0 341.839 3.550 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1NCc1ccc(F)c(Cl)c1F)C[NH2+]C2 ZINC001168506182 1121886819 /nfs/dbraw/zinc/88/68/19/1121886819.db2.gz VORRYMPRROUFNT-UHFFFAOYSA-N 1 0 339.729 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000301747294 1129023485 /nfs/dbraw/zinc/02/34/85/1129023485.db2.gz QWHBTCKDHOILBS-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000077468323 1129033606 /nfs/dbraw/zinc/03/36/06/1129033606.db2.gz USYSLMYISKFYIT-GOSISDBHSA-N 1 0 328.412 3.932 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301163739 1122218986 /nfs/dbraw/zinc/21/89/86/1122218986.db2.gz CEDFAIJMMKEYQD-MRXNPFEDSA-N 1 0 343.402 3.710 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CCN(c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090801273 1122230381 /nfs/dbraw/zinc/23/03/81/1122230381.db2.gz CBMLIIQJNYBVLZ-WMZOPIPTSA-N 1 0 340.427 3.700 20 5 EHBDRO C[C@H](CCCO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000154131755 1122254718 /nfs/dbraw/zinc/25/47/18/1122254718.db2.gz SMYPDTLGADPZHS-CYBMUJFWSA-N 1 0 348.374 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000301184216 1122298982 /nfs/dbraw/zinc/29/89/82/1122298982.db2.gz IYYSHDYKRGIEFF-KRWDZBQOSA-N 1 0 325.412 3.571 20 5 EHBDRO CN1CC[NH2+]C[C@@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212224464 1122513378 /nfs/dbraw/zinc/51/33/78/1122513378.db2.gz MXMKPDQWEXKKBC-LJQANCHMSA-N 1 0 344.418 3.619 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775455 1129060460 /nfs/dbraw/zinc/06/04/60/1129060460.db2.gz LCIRCOFLJCIHFP-BLLLJJGKSA-N 1 0 335.835 3.701 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2c(F)cc([N+](=O)[O-])cc2F)c1 ZINC000301776542 1129061669 /nfs/dbraw/zinc/06/16/69/1129061669.db2.gz HSGWRHCXMWUAFW-UHFFFAOYSA-N 1 0 335.354 3.937 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000154523703 1122684379 /nfs/dbraw/zinc/68/43/79/1122684379.db2.gz YUPFFDOWCOLJII-RBUKOAKNSA-N 1 0 344.386 3.898 20 5 EHBDRO CC(=O)c1ccc(N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000919722097 1123133370 /nfs/dbraw/zinc/13/33/70/1123133370.db2.gz WSPKVKMDFILQAF-ZQIUZPCESA-N 1 0 345.443 3.639 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2c1cccc2O ZINC000130687710 1123178390 /nfs/dbraw/zinc/17/83/90/1123178390.db2.gz CFCCYPOJOJQQPR-DYVFJYSZSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NC2CC[NH+](C3CCCC3)CC2)c(F)c1 ZINC000301803571 1129106747 /nfs/dbraw/zinc/10/67/47/1129106747.db2.gz UZCBMACDRCIXEM-UHFFFAOYSA-N 1 0 325.359 3.692 20 5 EHBDRO CC[C@H](COC)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610009963 1123712885 /nfs/dbraw/zinc/71/28/85/1123712885.db2.gz LAZMHRQJOIHMOZ-MRXNPFEDSA-N 1 0 343.427 3.877 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000615837608 1123885191 /nfs/dbraw/zinc/88/51/91/1123885191.db2.gz LAPDJOXDGHTNGX-JQVXPOPVSA-N 1 0 326.343 3.702 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c2c(c1)COCO2 ZINC000114495128 1129152238 /nfs/dbraw/zinc/15/22/38/1129152238.db2.gz HYQAVVSNOJZACN-IBGZPJMESA-N 1 0 344.411 3.784 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCOCC2CC2)s1 ZINC000237955038 1123925204 /nfs/dbraw/zinc/92/52/04/1123925204.db2.gz BUGPPSUDNXTLTR-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000180626374 1124037465 /nfs/dbraw/zinc/03/74/65/1124037465.db2.gz IGLKNYFGLHRHDL-OAHLLOKOSA-N 1 0 346.358 3.746 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837156 1129173491 /nfs/dbraw/zinc/17/34/91/1129173491.db2.gz MKASNDFHOUXTGE-ZFWWWQNUSA-N 1 0 332.791 3.501 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](C)c1ccsc1 ZINC000619782817 1125404182 /nfs/dbraw/zinc/40/41/82/1125404182.db2.gz KUQSYBPGRSUMKZ-LBPRGKRZSA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000078704603 1129185066 /nfs/dbraw/zinc/18/50/66/1129185066.db2.gz WRRBBFCFKMLGID-FUHWJXTLSA-N 1 0 331.460 3.681 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000080347283 1129348216 /nfs/dbraw/zinc/34/82/16/1129348216.db2.gz CWNJMOYBHNAFTA-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938961 1129393359 /nfs/dbraw/zinc/39/33/59/1129393359.db2.gz XQZDCIBXUHPQOP-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO CSc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+](C)C)cc1 ZINC000338833954 1129395759 /nfs/dbraw/zinc/39/57/59/1129395759.db2.gz CHOUUHFWYJUCGL-MRXNPFEDSA-N 1 0 346.456 3.735 20 5 EHBDRO Cc1nc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000716229537 1131372208 /nfs/dbraw/zinc/37/22/08/1131372208.db2.gz NMPVILUDZPTSDS-YOEHRIQHSA-N 1 0 340.427 3.621 20 5 EHBDRO CC(C)C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301972131 1129465803 /nfs/dbraw/zinc/46/58/03/1129465803.db2.gz HHWGDOSVLYSOAV-OAHLLOKOSA-N 1 0 342.443 3.923 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301975766 1129465863 /nfs/dbraw/zinc/46/58/63/1129465863.db2.gz CZDZOVGKMUDGAQ-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](O)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000543416597 1129476466 /nfs/dbraw/zinc/47/64/66/1129476466.db2.gz PORGCHPBPDBBLC-NVXWUHKLSA-N 1 0 328.412 3.548 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000301989612 1129485971 /nfs/dbraw/zinc/48/59/71/1129485971.db2.gz ONAIKAYHNDNOCD-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000543458653 1129501315 /nfs/dbraw/zinc/50/13/15/1129501315.db2.gz IYJTZFSDBQKRET-GUYCJALGSA-N 1 0 334.416 3.757 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000328113001 1129548289 /nfs/dbraw/zinc/54/82/89/1129548289.db2.gz UYTPKRJJDIVYOW-LZLYRXPVSA-N 1 0 348.443 3.509 20 5 EHBDRO Cc1ccc2nc(C[NH2+][C@@H](C)CCc3ccccc3[N+](=O)[O-])cn2c1 ZINC000555122566 1129552974 /nfs/dbraw/zinc/55/29/74/1129552974.db2.gz WIXOVGNWUNYMQX-HNNXBMFYSA-N 1 0 338.411 3.662 20 5 EHBDRO C[C@H](O)CC[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000093481655 1129590512 /nfs/dbraw/zinc/59/05/12/1129590512.db2.gz WQZOHBGGYQFGQC-ZDUSSCGKSA-N 1 0 348.374 3.729 20 5 EHBDRO CC[C@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000124326723 1129598407 /nfs/dbraw/zinc/59/84/07/1129598407.db2.gz CMMHPEIWLMWQFB-LBPRGKRZSA-N 1 0 338.791 3.759 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684040 1129599858 /nfs/dbraw/zinc/59/98/58/1129599858.db2.gz ZIKOPFBZNSIWJH-IBGZPJMESA-N 1 0 340.423 3.942 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(CC[NH+](C)C)C1CCCC1 ZINC000331068910 1129652007 /nfs/dbraw/zinc/65/20/07/1129652007.db2.gz RYQCWNADVCAHOO-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO CC(C)[C@@H](C)NC(=O)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000331276510 1129658751 /nfs/dbraw/zinc/65/87/51/1129658751.db2.gz QXOVRYXMMYBKEP-CABCVRRESA-N 1 0 347.459 3.529 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235130 1129672552 /nfs/dbraw/zinc/67/25/52/1129672552.db2.gz QCRDQFUORISOLM-OLZOCXBDSA-N 1 0 330.388 3.655 20 5 EHBDRO CCC[C@H]([NH2+]CCCn1nc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000156378886 1129713352 /nfs/dbraw/zinc/71/33/52/1129713352.db2.gz BXRZBGQNKWHQRV-SFHVURJKSA-N 1 0 330.432 3.929 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+]([C@@H]2C[C@H]2C)C[C@H](C)C1 ZINC000429033017 1129714463 /nfs/dbraw/zinc/71/44/63/1129714463.db2.gz YZWPIRXXCCQZSJ-JNNRSPCRSA-N 1 0 331.460 3.626 20 5 EHBDRO Cc1cc(NC[C@@](C)(O)c2ccccc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302129754 1129768795 /nfs/dbraw/zinc/76/87/95/1129768795.db2.gz BMUYZAALSOBUIC-LJQANCHMSA-N 1 0 337.379 3.771 20 5 EHBDRO CC(C)COC1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000055905868 1129789616 /nfs/dbraw/zinc/78/96/16/1129789616.db2.gz GYLMSKYYQIBIDA-UHFFFAOYSA-N 1 0 336.432 3.501 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000131409663 1129793522 /nfs/dbraw/zinc/79/35/22/1129793522.db2.gz DBLQHSMRPDNLFB-ICSRJNTNSA-N 1 0 340.423 3.893 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056197051 1129806256 /nfs/dbraw/zinc/80/62/56/1129806256.db2.gz NIERJRYGWWOUAO-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196861 1129806334 /nfs/dbraw/zinc/80/63/34/1129806334.db2.gz FCTRYDTZNDVFSN-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000132102235 1129875924 /nfs/dbraw/zinc/87/59/24/1129875924.db2.gz CFBOFYQGOWCHAU-MOPGFXCFSA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[NH+](C(C)C)C(C)C ZINC000163126719 1129920362 /nfs/dbraw/zinc/92/03/62/1129920362.db2.gz KUEAFORUXZEGKR-UHFFFAOYSA-N 1 0 336.436 3.534 20 5 EHBDRO CC(C)Cn1ccnc1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164757526 1129991210 /nfs/dbraw/zinc/99/12/10/1129991210.db2.gz WKAZAIHGGVTHHX-QGZVFWFLSA-N 1 0 342.443 3.558 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414165 1130055101 /nfs/dbraw/zinc/05/51/01/1130055101.db2.gz QCLLMALIXMXFJB-TYNCELHUSA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880051 1130181365 /nfs/dbraw/zinc/18/13/65/1130181365.db2.gz UYPJRTDGDDNNFP-STQMWFEESA-N 1 0 337.420 3.501 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173349620 1130214086 /nfs/dbraw/zinc/21/40/86/1130214086.db2.gz OVBJWZXNLIPIMY-GJZGRUSLSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@H](O)CC(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174464445 1130360497 /nfs/dbraw/zinc/36/04/97/1130360497.db2.gz AKFVXSHQKICFFV-LBPRGKRZSA-N 1 0 349.456 3.605 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3cccc(C(F)F)c3)C2)nc1 ZINC000348061575 1131145947 /nfs/dbraw/zinc/14/59/47/1131145947.db2.gz TYYXWDPXRVDKHY-AWEZNQCLSA-N 1 0 348.353 3.614 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2C[NH+](Cc3ccccc3)C2)c2ccncc21 ZINC000716297685 1131496977 /nfs/dbraw/zinc/49/69/77/1131496977.db2.gz JDUATAKKQFMAOV-UHFFFAOYSA-N 1 0 348.406 3.687 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1c(F)cccc1F)CC2 ZINC001172896984 1131880183 /nfs/dbraw/zinc/88/01/83/1131880183.db2.gz VLVOATSQAHBVKU-CQSZACIVSA-N 1 0 332.350 3.910 20 5 EHBDRO COc1cccc(CC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172899312 1131882167 /nfs/dbraw/zinc/88/21/67/1131882167.db2.gz WJIAMNUFWOWYJE-SFHVURJKSA-N 1 0 340.423 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCSCc1ccco1)CC2 ZINC001172899586 1131882569 /nfs/dbraw/zinc/88/25/69/1131882569.db2.gz OJMCVBCTQMNHCP-INIZCTEOSA-N 1 0 346.452 3.958 20 5 EHBDRO [NH3+]Cc1cccc2ncn([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c21 ZINC001172902662 1131884904 /nfs/dbraw/zinc/88/49/04/1131884904.db2.gz LQTDTEGCROPJME-MRXNPFEDSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCCc3cnccc31)CC2 ZINC001172905358 1131886127 /nfs/dbraw/zinc/88/61/27/1131886127.db2.gz JEZNNWKHHHKGRD-PXNSSMCTSA-N 1 0 337.423 3.904 20 5 EHBDRO CC(C)([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172904617 1131886641 /nfs/dbraw/zinc/88/66/41/1131886641.db2.gz YVYKCIWQEURQFY-MRXNPFEDSA-N 1 0 325.412 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(C4CCCC4)CC3)c2c1 ZINC000743378725 1131913980 /nfs/dbraw/zinc/91/39/80/1131913980.db2.gz ZLMMZGGMHSRVPI-UHFFFAOYSA-N 1 0 328.416 3.804 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381104 1131914389 /nfs/dbraw/zinc/91/43/89/1131914389.db2.gz VZVFOFQIPWOCED-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1ccc(F)c(F)c1)CC2 ZINC001172912752 1131917568 /nfs/dbraw/zinc/91/75/68/1131917568.db2.gz PAPBAYLAWHVBGL-MRXNPFEDSA-N 1 0 346.377 3.953 20 5 EHBDRO C[N@H+](CCOc1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911054 1131917576 /nfs/dbraw/zinc/91/75/76/1131917576.db2.gz QUTATJCOBUZRAS-GOSISDBHSA-N 1 0 340.423 3.853 20 5 EHBDRO CC[N@H+](Cc1ccccn1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912539 1131918221 /nfs/dbraw/zinc/91/82/21/1131918221.db2.gz BKWVBLVMJIHTSB-SFHVURJKSA-N 1 0 325.412 3.759 20 5 EHBDRO C[C@@H](CN1CCC(C)CC1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913498 1131918792 /nfs/dbraw/zinc/91/87/92/1131918792.db2.gz WJEOTRIREBCRGR-QFBILLFUSA-N 1 0 345.487 3.552 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1F ZINC001173187395 1131994423 /nfs/dbraw/zinc/99/44/23/1131994423.db2.gz FEJPJSABGBFMBO-MNOVXSKESA-N 1 0 346.349 3.841 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1cccc(Cl)c1 ZINC001173215579 1132000606 /nfs/dbraw/zinc/00/06/06/1132000606.db2.gz WXVWOOJUGUFYGK-CYBMUJFWSA-N 1 0 334.803 3.848 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(-n2cccn2)c1 ZINC001173215567 1132001137 /nfs/dbraw/zinc/00/11/37/1132001137.db2.gz WTAJGRKLYMKTDX-OAHLLOKOSA-N 1 0 336.395 3.501 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173219557 1132003098 /nfs/dbraw/zinc/00/30/98/1132003098.db2.gz NWHXJLCVVJMUAG-YJYMSZOUSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2cc(O)ccc21 ZINC001173219084 1132003635 /nfs/dbraw/zinc/00/36/35/1132003635.db2.gz WVBRFXYUMBJPCW-ZDUSSCGKSA-N 1 0 339.395 3.560 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)C1(O)CCC1 ZINC001173222294 1132004336 /nfs/dbraw/zinc/00/43/36/1132004336.db2.gz WAUOIXKZRWPRIX-KXBFYZLASA-N 1 0 340.423 3.772 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220207 1132004763 /nfs/dbraw/zinc/00/47/63/1132004763.db2.gz VWKUCHHAZYCAJV-HUUCEWRRSA-N 1 0 328.412 3.842 20 5 EHBDRO COc1ccccc1CC1([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223687 1132005670 /nfs/dbraw/zinc/00/56/70/1132005670.db2.gz KWEWFEKHNVAZRM-OAHLLOKOSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccc(F)cc2C1 ZINC001173222923 1132005870 /nfs/dbraw/zinc/00/58/70/1132005870.db2.gz GBBXNGNCQFNVAG-SCLBCKFNSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OC2CCC2)n1 ZINC001173223280 1132005935 /nfs/dbraw/zinc/00/59/35/1132005935.db2.gz HNRFDFAKRYDINO-CQSZACIVSA-N 1 0 341.411 3.642 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173229400 1132007812 /nfs/dbraw/zinc/00/78/12/1132007812.db2.gz UEOARKIPPZGBHD-AWEZNQCLSA-N 1 0 326.396 3.593 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC(=O)CC2)CC1 ZINC001173233217 1132010154 /nfs/dbraw/zinc/01/01/54/1132010154.db2.gz USOSYTZOSSAKBW-HNNXBMFYSA-N 1 0 330.428 3.751 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001173235997 1132010935 /nfs/dbraw/zinc/01/09/35/1132010935.db2.gz DJHVRJQVJVSTOQ-GQIGUUNPSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1Cl ZINC000744448184 1132101934 /nfs/dbraw/zinc/10/19/34/1132101934.db2.gz PGKYKERJFNQIJK-XLKFXECMSA-N 1 0 344.795 3.661 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746070666 1132365553 /nfs/dbraw/zinc/36/55/53/1132365553.db2.gz UVNMYQONPWHGFK-UHFFFAOYSA-N 1 0 330.413 3.528 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000766444067 1132546077 /nfs/dbraw/zinc/54/60/77/1132546077.db2.gz YHVIDUQVBAEENS-UHFFFAOYSA-N 1 0 348.472 3.763 20 5 EHBDRO CC[C@H]1c2ccccc2CC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738240913 1132551765 /nfs/dbraw/zinc/55/17/65/1132551765.db2.gz DTURCMOOENIOMF-SFHVURJKSA-N 1 0 336.395 3.911 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001168978154 1132618325 /nfs/dbraw/zinc/61/83/25/1132618325.db2.gz OXOJHUDHNUKMPT-ZFWWWQNUSA-N 1 0 330.350 3.673 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(OC(F)(F)F)cc1 ZINC001168986675 1132633866 /nfs/dbraw/zinc/63/38/66/1132633866.db2.gz YGHBOMBLAWUNNW-NQBHXWOUSA-N 1 0 332.322 3.681 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168988320 1132634798 /nfs/dbraw/zinc/63/47/98/1132634798.db2.gz QVVVSYMNGGFUEZ-RISCZKNCSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001168986782 1132634821 /nfs/dbraw/zinc/63/48/21/1132634821.db2.gz ZLANGDHMMZOHRH-BXUZGUMPSA-N 1 0 328.334 3.730 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C1CCCCCC1 ZINC001169137887 1132667538 /nfs/dbraw/zinc/66/75/38/1132667538.db2.gz XRHJOTLLTRWIRD-KDOFPFPSSA-N 1 0 345.443 3.649 20 5 EHBDRO COc1cc(C)c([N+](=O)[O-])cc1N[C@@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001169147725 1132676636 /nfs/dbraw/zinc/67/66/36/1132676636.db2.gz UTIPMHMPHASZCU-FZKQIMNGSA-N 1 0 335.448 3.867 20 5 EHBDRO O=[N+]([O-])c1ccc(F)c(Nc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001175736624 1132749454 /nfs/dbraw/zinc/74/94/54/1132749454.db2.gz DEPFUTUSLARGDG-UHFFFAOYSA-N 1 0 345.374 3.952 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C(C)(C)C1 ZINC001175759554 1132759625 /nfs/dbraw/zinc/75/96/25/1132759625.db2.gz XITDGFOHENTEOR-JTQLQIEISA-N 1 0 327.222 3.978 20 5 EHBDRO [NH3+]Cc1ccc2c(n1)N(c1ncnc3cc4ccccc4cc31)CCC2 ZINC001169591587 1132791159 /nfs/dbraw/zinc/79/11/59/1132791159.db2.gz XJNJMNQJUJZKHT-UHFFFAOYSA-N 1 0 341.418 3.721 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001175991592 1132808968 /nfs/dbraw/zinc/80/89/68/1132808968.db2.gz GMGXTXFECAQKHM-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO CN(C)c1ncc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cn1 ZINC001176332363 1132901381 /nfs/dbraw/zinc/90/13/81/1132901381.db2.gz OMJMUTSFOSTPKO-UHFFFAOYSA-N 1 0 330.395 3.570 20 5 EHBDRO CCC[N@H+](CCc1cccs1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000766932705 1132916160 /nfs/dbraw/zinc/91/61/60/1132916160.db2.gz RXKYHUBKFZGONE-KRWDZBQOSA-N 1 0 334.441 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c1 ZINC000773705259 1133094821 /nfs/dbraw/zinc/09/48/21/1133094821.db2.gz UQUJVVMDMQUHKX-ZIAGYGMSSA-N 1 0 338.835 3.887 20 5 EHBDRO NC(=O)[C@H]1CC[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000768138673 1133101321 /nfs/dbraw/zinc/10/13/21/1133101321.db2.gz QAXZFORQVFKEQN-ZDUSSCGKSA-N 1 0 338.838 3.954 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2ccccc2C1 ZINC001178295688 1133153667 /nfs/dbraw/zinc/15/36/67/1133153667.db2.gz VMXPCDOJWHMEGH-QGZVFWFLSA-N 1 0 326.396 3.641 20 5 EHBDRO C[C@@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001178944020 1133215384 /nfs/dbraw/zinc/21/53/84/1133215384.db2.gz ALSZVMYSTWEWTR-ZDUSSCGKSA-N 1 0 341.386 3.946 20 5 EHBDRO CO[C@@]1(C)C[C@H]1[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001179210248 1133235756 /nfs/dbraw/zinc/23/57/56/1133235756.db2.gz DCABXPGFQMYJFC-MSOLQXFVSA-N 1 0 346.358 3.793 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)[C@@H](CCO)c1ccccc1 ZINC001179950537 1133305005 /nfs/dbraw/zinc/30/50/05/1133305005.db2.gz DXJNCYMNZRBBBL-IBGZPJMESA-N 1 0 328.412 3.767 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC001180306064 1133355209 /nfs/dbraw/zinc/35/52/09/1133355209.db2.gz RYKVQZHNPVUSDG-GJZGRUSLSA-N 1 0 341.411 3.971 20 5 EHBDRO CC(C)O[C@@H](CN(CC[NH3+])c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001181465155 1133490855 /nfs/dbraw/zinc/49/08/55/1133490855.db2.gz VFGIAJVNWIBOPQ-IBGZPJMESA-N 1 0 343.427 3.526 20 5 EHBDRO COc1cncc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878491 1133545396 /nfs/dbraw/zinc/54/53/96/1133545396.db2.gz BCJVVKRWLAEECG-MRXNPFEDSA-N 1 0 341.411 3.686 20 5 EHBDRO Cc1ccncc1[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000771387330 1133551695 /nfs/dbraw/zinc/55/16/95/1133551695.db2.gz JDSZBLYFVIRDMY-HNNXBMFYSA-N 1 0 340.427 3.618 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774204206 1133633354 /nfs/dbraw/zinc/63/33/54/1133633354.db2.gz QGGNVUOCWKYDSV-MJGOQNOKSA-N 1 0 338.411 3.738 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774210659 1133634526 /nfs/dbraw/zinc/63/45/26/1133634526.db2.gz GONNZKHYPPDXIX-JKSUJKDBSA-N 1 0 332.379 3.512 20 5 EHBDRO Cc1cccc(C)c1C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774258239 1133647726 /nfs/dbraw/zinc/64/77/26/1133647726.db2.gz QMVKODFQOIAQFZ-IRXDYDNUSA-N 1 0 328.416 3.682 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H](O)c1cc(F)cc(Cl)c1 ZINC000785617297 1133732993 /nfs/dbraw/zinc/73/29/93/1133732993.db2.gz YKBGQKLCOIWYJO-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO CN(c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1)C(C)(C)C[NH3+] ZINC001170059252 1133862840 /nfs/dbraw/zinc/86/28/40/1133862840.db2.gz RAOYBAFCKAVVAY-UHFFFAOYSA-N 1 0 331.441 3.920 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC001183972751 1133883564 /nfs/dbraw/zinc/88/35/64/1133883564.db2.gz XZDJFWANUYONMA-LLVKDONJSA-N 1 0 335.231 3.910 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C(C)(C)O1 ZINC001183981799 1133885948 /nfs/dbraw/zinc/88/59/48/1133885948.db2.gz RSNPWRUTCIYKJS-LBPRGKRZSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC001184056393 1133891493 /nfs/dbraw/zinc/89/14/93/1133891493.db2.gz POGKVHYCZSAZBK-OCCSQVGLSA-N 1 0 345.226 3.949 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000786813972 1133910287 /nfs/dbraw/zinc/91/02/87/1133910287.db2.gz NZRODZZDFJBHFY-SDNWHVSQSA-N 1 0 341.367 3.739 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](CCO)c1cccs1 ZINC000786816013 1133910612 /nfs/dbraw/zinc/91/06/12/1133910612.db2.gz VEQWRPPVOMSCPU-IVOILVROSA-N 1 0 332.425 3.773 20 5 EHBDRO C[C@H](OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879806 1133923690 /nfs/dbraw/zinc/92/36/90/1133923690.db2.gz DVQCHOSYMBRABG-GUYCJALGSA-N 1 0 332.400 3.606 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001185080639 1134033434 /nfs/dbraw/zinc/03/34/34/1134033434.db2.gz AUTXDVJUZGGVHW-UHFFFAOYSA-N 1 0 345.365 3.924 20 5 EHBDRO CC(C)[C@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccnn1C ZINC000788077486 1134076743 /nfs/dbraw/zinc/07/67/43/1134076743.db2.gz VSZLZBLDSBFPSM-AWEZNQCLSA-N 1 0 336.823 3.511 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907255 1134116088 /nfs/dbraw/zinc/11/60/88/1134116088.db2.gz GHVBJHIXGZQUFS-DYVFJYSZSA-N 1 0 341.367 3.881 20 5 EHBDRO CSc1ccc(F)cc1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788609062 1134145714 /nfs/dbraw/zinc/14/57/14/1134145714.db2.gz HVWWXFHTUANORZ-SNVBAGLBSA-N 1 0 335.404 3.889 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000788576376 1134146889 /nfs/dbraw/zinc/14/68/89/1134146889.db2.gz ZJAZAJNQHNTTTO-GUYCJALGSA-N 1 0 346.431 3.504 20 5 EHBDRO C[C@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788600990 1134149773 /nfs/dbraw/zinc/14/97/73/1134149773.db2.gz GULFYXSYRDFLAG-LBPRGKRZSA-N 1 0 329.375 3.699 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788749547 1134164536 /nfs/dbraw/zinc/16/45/36/1134164536.db2.gz GUCJDFJFEZNJCR-CRFBAAHOSA-N 1 0 341.411 3.748 20 5 EHBDRO C[NH+](C)[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C12CCC2 ZINC001187025452 1134283623 /nfs/dbraw/zinc/28/36/23/1134283623.db2.gz PVGAHOHRINWYND-KGLIPLIRSA-N 1 0 325.359 3.817 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000792184385 1134665668 /nfs/dbraw/zinc/66/56/68/1134665668.db2.gz VMXZGONCYHABIN-CQSZACIVSA-N 1 0 348.834 3.673 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170296616 1134737373 /nfs/dbraw/zinc/73/73/73/1134737373.db2.gz GSWSBGREVBRCPL-ZIAGYGMSSA-N 1 0 346.402 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001170299275 1134738243 /nfs/dbraw/zinc/73/82/43/1134738243.db2.gz UNPWERXIEAXQPY-INIZCTEOSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170327229 1134749499 /nfs/dbraw/zinc/74/94/99/1134749499.db2.gz GAWUIBVZNFDMTF-OAHLLOKOSA-N 1 0 328.412 3.709 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340095 1134758122 /nfs/dbraw/zinc/75/81/22/1134758122.db2.gz DKJSTUQVEMFDHN-YPMHNXCESA-N 1 0 346.349 3.809 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H](Cc2ccccc2)C1 ZINC001190846194 1134758999 /nfs/dbraw/zinc/75/89/99/1134758999.db2.gz JLCWVZBAZGVQQF-GOSISDBHSA-N 1 0 340.423 3.928 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000792878186 1134811520 /nfs/dbraw/zinc/81/15/20/1134811520.db2.gz YMZXYCGOYZFCTL-OLZOCXBDSA-N 1 0 329.356 3.785 20 5 EHBDRO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202047 1134814675 /nfs/dbraw/zinc/81/46/75/1134814675.db2.gz DVWWPENSWUUDDL-ZBFHGGJFSA-N 1 0 326.824 3.884 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000747100695 1134848592 /nfs/dbraw/zinc/84/85/92/1134848592.db2.gz NWQHJAYUWVFRGU-HNNXBMFYSA-N 1 0 334.803 3.596 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443598 1134867570 /nfs/dbraw/zinc/86/75/70/1134867570.db2.gz CQSRDUZQAXIRIM-BEFAXECRSA-N 1 0 326.396 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(OC(F)F)c2)cc1Cl ZINC000793626321 1134974978 /nfs/dbraw/zinc/97/49/78/1134974978.db2.gz YPVYZZMWTFZVHG-UHFFFAOYSA-N 1 0 343.717 3.534 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617517 1135041104 /nfs/dbraw/zinc/04/11/04/1135041104.db2.gz UPOSFOPNHBMSFY-ROUUACIJSA-N 1 0 348.349 3.647 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C)c(C(=O)OC)c1)c1cccc([N+](=O)[O-])c1 ZINC001192800707 1135056033 /nfs/dbraw/zinc/05/60/33/1135056033.db2.gz BRYQJURWDAARGR-SFHVURJKSA-N 1 0 342.395 3.931 20 5 EHBDRO CCCN(CCOc1cccc([N+](=O)[O-])c1)CC[NH+]1CCCCCC1 ZINC001194772904 1135321100 /nfs/dbraw/zinc/32/11/00/1135321100.db2.gz UGJHYKGWSQSKIM-UHFFFAOYSA-N 1 0 349.475 3.562 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1F ZINC001195622182 1135443851 /nfs/dbraw/zinc/44/38/51/1135443851.db2.gz IFZSBQRMRYXVON-MRXNPFEDSA-N 1 0 348.374 3.862 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613093 1135589232 /nfs/dbraw/zinc/58/92/32/1135589232.db2.gz HTUWVHRXYYYZRL-VQTKUKTRSA-N 1 0 332.400 3.560 20 5 EHBDRO Cc1cccc(C)c1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001198194771 1135786831 /nfs/dbraw/zinc/78/68/31/1135786831.db2.gz JNLSHGOXTDCVKW-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO [NH3+]CCN(Cc1cccc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000809734860 1135874462 /nfs/dbraw/zinc/87/44/62/1135874462.db2.gz MITKFQGFQAQWHS-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000809991877 1135909611 /nfs/dbraw/zinc/90/96/11/1135909611.db2.gz OYIZJKBZQZESHH-QGZVFWFLSA-N 1 0 332.375 3.583 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000810002388 1135912576 /nfs/dbraw/zinc/91/25/76/1135912576.db2.gz VPCAOZMCPHSALZ-STQMWFEESA-N 1 0 333.215 3.949 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000810178226 1135934590 /nfs/dbraw/zinc/93/45/90/1135934590.db2.gz LTEJPMXLVLYWDG-OAHLLOKOSA-N 1 0 332.787 3.650 20 5 EHBDRO C[C@@H](C[C@@H]1CCOC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001201380830 1136014337 /nfs/dbraw/zinc/01/43/37/1136014337.db2.gz VZGGCVUVFCZDMO-KBPBESRZSA-N 1 0 330.384 3.760 20 5 EHBDRO CC(C)(CC[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776277407 1136126373 /nfs/dbraw/zinc/12/63/73/1136126373.db2.gz OSEHCSBGLMRLJO-GOSISDBHSA-N 1 0 328.412 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCCCc3ccccc32)cc1 ZINC000747815217 1136247743 /nfs/dbraw/zinc/24/77/43/1136247743.db2.gz KJNVNUYBCRZIPY-OALUTQOASA-N 1 0 326.396 3.686 20 5 EHBDRO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000851791487 1136407554 /nfs/dbraw/zinc/40/75/54/1136407554.db2.gz BZBMFAYHEFXLBV-SFHVURJKSA-N 1 0 332.375 3.598 20 5 EHBDRO C[C@@]1(c2ccccc2)CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584566 1136442432 /nfs/dbraw/zinc/44/24/32/1136442432.db2.gz MYFGNYYSFWLFEQ-VQTJNVASSA-N 1 0 340.423 3.682 20 5 EHBDRO CC(C)C[N@H+](CCc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579925 1136444808 /nfs/dbraw/zinc/44/48/08/1136444808.db2.gz PQVCIFLWYALVNW-HXUWFJFHSA-N 1 0 342.439 3.829 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000776591065 1136451130 /nfs/dbraw/zinc/45/11/30/1136451130.db2.gz GIIUWOLGLOPWRV-ZNZDAUKMSA-N 1 0 344.386 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cc1 ZINC000852427123 1136455186 /nfs/dbraw/zinc/45/51/86/1136455186.db2.gz STCNJWMFCBFGOL-AEFFLSMTSA-N 1 0 342.395 3.839 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCCO2 ZINC000852782405 1136486342 /nfs/dbraw/zinc/48/63/42/1136486342.db2.gz PECSITJEPGEJAW-LBPRGKRZSA-N 1 0 330.359 3.910 20 5 EHBDRO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCC[C@H](C)C1 ZINC000111193292 1136520519 /nfs/dbraw/zinc/52/05/19/1136520519.db2.gz PYRIPQLZTJNOGG-RYUDHWBXSA-N 1 0 334.445 3.737 20 5 EHBDRO Cn1ncc(CCC[NH2+]Cc2c3ccccc3cc3ccccc32)n1 ZINC000815144923 1136561836 /nfs/dbraw/zinc/56/18/36/1136561836.db2.gz SAMHSLBMLPAHBQ-UHFFFAOYSA-N 1 0 330.435 3.844 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000815595998 1136616470 /nfs/dbraw/zinc/61/64/70/1136616470.db2.gz HWBZHHOMXHHHDF-GNWWPAOBSA-N 1 0 341.411 3.781 20 5 EHBDRO C[C@@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815597989 1136616863 /nfs/dbraw/zinc/61/68/63/1136616863.db2.gz KJTAIEHBGZTFEY-GFCCVEGCSA-N 1 0 349.818 3.698 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(NC2=[NH+]CCC2)cc1 ZINC001135679013 1136749313 /nfs/dbraw/zinc/74/93/13/1136749313.db2.gz IXJOJEAPLCRRTG-UHFFFAOYSA-N 1 0 338.367 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000819008614 1136900021 /nfs/dbraw/zinc/90/00/21/1136900021.db2.gz VMUYLUDTAFUYQM-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819079431 1136911680 /nfs/dbraw/zinc/91/16/80/1136911680.db2.gz ACCGJGDJUBLPNO-WMZOPIPTSA-N 1 0 348.830 3.893 20 5 EHBDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819079427 1136911986 /nfs/dbraw/zinc/91/19/86/1136911986.db2.gz ACCGJGDJUBLPNO-FUHWJXTLSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819151028 1136913965 /nfs/dbraw/zinc/91/39/65/1136913965.db2.gz VQHJCJSTSDXEOP-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)cc1 ZINC000819333766 1136932248 /nfs/dbraw/zinc/93/22/48/1136932248.db2.gz ROOWDICFPQSVLW-ROUUACIJSA-N 1 0 348.349 3.574 20 5 EHBDRO CC[N@@H+](c1ccc(NC[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000819398575 1136936071 /nfs/dbraw/zinc/93/60/71/1136936071.db2.gz OGANWGQVKRCZPG-LJQANCHMSA-N 1 0 343.427 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC[C@@H]3CC=CCC3)CC2)cc1 ZINC000858515786 1136975750 /nfs/dbraw/zinc/97/57/50/1136975750.db2.gz UBKGXLBCZVHXKX-MRXNPFEDSA-N 1 0 329.444 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1F ZINC000823659935 1137108518 /nfs/dbraw/zinc/10/85/18/1137108518.db2.gz AFCHYEZJBOCGSD-KRWDZBQOSA-N 1 0 334.391 3.515 20 5 EHBDRO CO[C@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000824589485 1137144297 /nfs/dbraw/zinc/14/42/97/1137144297.db2.gz FIFMVMVVUPZMBU-INIZCTEOSA-N 1 0 334.803 3.596 20 5 EHBDRO Cc1csc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000824750253 1137151994 /nfs/dbraw/zinc/15/19/94/1137151994.db2.gz FXOIXWNTBONIGE-UHFFFAOYSA-N 1 0 331.441 3.723 20 5 EHBDRO Cc1cc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])ccc1C[NH+](C)C ZINC000843907599 1137187990 /nfs/dbraw/zinc/18/79/90/1137187990.db2.gz WDLTZWSURNCKTA-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO C[C@H]([NH2+]CCCN(C)C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120286025 1137252766 /nfs/dbraw/zinc/25/27/66/1137252766.db2.gz LRFGZLUKZBKPRX-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO C[C@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000844925529 1137263117 /nfs/dbraw/zinc/26/31/17/1137263117.db2.gz QZAVDOHYRDNRPG-XJKSGUPXSA-N 1 0 340.427 3.645 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000866148873 1137332091 /nfs/dbraw/zinc/33/20/91/1137332091.db2.gz YCCRGRCVUFBSEW-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CCOCC2 ZINC000866353242 1137348470 /nfs/dbraw/zinc/34/84/70/1137348470.db2.gz FCRGBBLKSQFHPZ-DYVFJYSZSA-N 1 0 336.407 3.604 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cc3c([nH]c2=O)CCCC3)cccc1[N+](=O)[O-] ZINC000866640702 1137372012 /nfs/dbraw/zinc/37/20/12/1137372012.db2.gz KPSIXBDOZVUUKK-ZDUSSCGKSA-N 1 0 341.411 3.733 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1cccc(F)n1 ZINC000773092191 1137464814 /nfs/dbraw/zinc/46/48/14/1137464814.db2.gz ZMUOVSBHWZSAFF-XJKSGUPXSA-N 1 0 329.375 3.630 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCCC[C@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC001171752310 1137508415 /nfs/dbraw/zinc/50/84/15/1137508415.db2.gz RPNQPBZMXFDXFL-INIZCTEOSA-N 1 0 334.416 3.637 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1ccccc1 ZINC000872015990 1137564645 /nfs/dbraw/zinc/56/46/45/1137564645.db2.gz AXVJNURBWLPKFO-BLLLJJGKSA-N 1 0 332.425 3.701 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOCC(F)(F)F ZINC000872027120 1137566047 /nfs/dbraw/zinc/56/60/47/1137566047.db2.gz HNWCIETYYLIERA-VIFPVBQESA-N 1 0 338.351 3.546 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000872027537 1137566104 /nfs/dbraw/zinc/56/61/04/1137566104.db2.gz DYRVSNPVZSMBNW-ZDUSSCGKSA-N 1 0 349.500 3.984 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034225 1137566630 /nfs/dbraw/zinc/56/66/30/1137566630.db2.gz MOZPHXNHKWGBJP-LLVKDONJSA-N 1 0 333.319 3.535 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccccc1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042380 1137567170 /nfs/dbraw/zinc/56/71/70/1137567170.db2.gz BZSVAPIEGCCEGA-IIYDPXPESA-N 1 0 332.375 3.897 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1c2ccccc2C[C@@H]1O ZINC000872043013 1137567265 /nfs/dbraw/zinc/56/72/65/1137567265.db2.gz VBRLAHITHNETHM-PBQZTSCYSA-N 1 0 344.436 3.626 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccncc1C ZINC000872052139 1137568095 /nfs/dbraw/zinc/56/80/95/1137568095.db2.gz PVYMTMAMHSVASI-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064417 1137569221 /nfs/dbraw/zinc/56/92/21/1137569221.db2.gz GNWYGNZHBOYHNH-CHWSQXEVSA-N 1 0 334.395 3.558 20 5 EHBDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872071395 1137569595 /nfs/dbraw/zinc/56/95/95/1137569595.db2.gz OLXMXHOWNFZBJX-SNUQEOBHSA-N 1 0 332.375 3.815 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000872129506 1137573133 /nfs/dbraw/zinc/57/31/33/1137573133.db2.gz FLWYICUGCOJWNH-RFIQDPTOSA-N 1 0 332.425 3.744 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)CCO2 ZINC000873106553 1137590184 /nfs/dbraw/zinc/59/01/84/1137590184.db2.gz RMJIEFCKMQFMPO-KRWDZBQOSA-N 1 0 342.395 3.834 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000873183291 1137592976 /nfs/dbraw/zinc/59/29/76/1137592976.db2.gz BRWLVYKUOJPECC-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])ccc1OC ZINC000873184526 1137593001 /nfs/dbraw/zinc/59/30/01/1137593001.db2.gz RHEGLQHGLWONKD-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000876964486 1137666433 /nfs/dbraw/zinc/66/64/33/1137666433.db2.gz GXTAGIYQSPEZGN-CYBMUJFWSA-N 1 0 346.456 3.679 20 5 EHBDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876989823 1137667129 /nfs/dbraw/zinc/66/71/29/1137667129.db2.gz HJDHZZKDHPJNIF-ODIFPOPNSA-N 1 0 342.443 3.841 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H](c3ccc(F)cc3)C3CCC3)C2)c1 ZINC000877011645 1137667588 /nfs/dbraw/zinc/66/75/88/1137667588.db2.gz FRCCRHHAXKQBKB-LEOMRAHMSA-N 1 0 344.390 3.765 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000877541898 1137680482 /nfs/dbraw/zinc/68/04/82/1137680482.db2.gz JGURWMNOPAXJTD-CQSZACIVSA-N 1 0 334.807 3.509 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000877557370 1137681226 /nfs/dbraw/zinc/68/12/26/1137681226.db2.gz LCOLIIUWMBLGGM-UTWWPYJBSA-N 1 0 328.349 3.968 20 5 EHBDRO CC(C)[NH+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000878341177 1137711528 /nfs/dbraw/zinc/71/15/28/1137711528.db2.gz YVTXYRLRPWHVQD-UHFFFAOYSA-N 1 0 338.795 3.917 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@]12C[C@H]1CCCC2 ZINC000879266286 1137742928 /nfs/dbraw/zinc/74/29/28/1137742928.db2.gz UETVGXRGSFFMCO-WRSAYESZSA-N 1 0 342.399 3.703 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000882963175 1137839904 /nfs/dbraw/zinc/83/99/04/1137839904.db2.gz QPDBLJBNKVODCX-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000883352159 1137856963 /nfs/dbraw/zinc/85/69/63/1137856963.db2.gz USLMFKYTBLYQMH-BPUTZDHNSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](Cn1ccnc1)c1ccccc1 ZINC000883387721 1137859079 /nfs/dbraw/zinc/85/90/79/1137859079.db2.gz CUTYDKJKPWUWIJ-MOPGFXCFSA-N 1 0 348.406 3.810 20 5 EHBDRO CCC(CC)[C@@H](O)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113341554 1137912791 /nfs/dbraw/zinc/91/27/91/1137912791.db2.gz JXSMMWBHMBMELD-INIZCTEOSA-N 1 0 349.456 3.605 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)CCC2 ZINC000331675293 1137916758 /nfs/dbraw/zinc/91/67/58/1137916758.db2.gz PQBPXXIKWUNCAJ-LZQZEXGQSA-N 1 0 332.444 3.893 20 5 EHBDRO C[C@@H]1SCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000118417383 1137933705 /nfs/dbraw/zinc/93/37/05/1137933705.db2.gz XCGZTMJVADXCBW-STQMWFEESA-N 1 0 347.440 3.618 20 5 EHBDRO C[C@@H]1C[C@@H](C)CC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119245220 1137939570 /nfs/dbraw/zinc/93/95/70/1137939570.db2.gz GXQJTLBXQIGZSW-YWPYICTPSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000332323344 1137939881 /nfs/dbraw/zinc/93/98/81/1137939881.db2.gz NYZKVZSQMMVONP-LSDHHAIUSA-N 1 0 328.416 3.577 20 5 EHBDRO CCC[NH+]1CCC(N(C)C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000120202472 1137947295 /nfs/dbraw/zinc/94/72/95/1137947295.db2.gz MFRYLKAIOBTUSF-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1ccccc1C ZINC000120514984 1137950486 /nfs/dbraw/zinc/95/04/86/1137950486.db2.gz IFTZIQLNKZDUBO-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO COCC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282917919 1137955717 /nfs/dbraw/zinc/95/57/17/1137955717.db2.gz XSXUDWDXCVXYPH-WFASDCNBSA-N 1 0 326.824 3.586 20 5 EHBDRO C[N@@H+](Cc1csc2ccccc12)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940665 1138044298 /nfs/dbraw/zinc/04/42/98/1138044298.db2.gz DUHZAHACEOHTIE-KRWDZBQOSA-N 1 0 342.420 3.975 20 5 EHBDRO COCCCC[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886181507 1138056649 /nfs/dbraw/zinc/05/66/49/1138056649.db2.gz MZZYRUMOXCHYOM-KRWDZBQOSA-N 1 0 329.400 3.637 20 5 EHBDRO COc1ccc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000886612505 1138102068 /nfs/dbraw/zinc/10/20/68/1138102068.db2.gz MRNMDZFSQADIMZ-WFASDCNBSA-N 1 0 344.333 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000093563704 1138238507 /nfs/dbraw/zinc/23/85/07/1138238507.db2.gz IDEGDDWVSWEWHK-MOTZXUDYSA-N 1 0 329.444 3.558 20 5 EHBDRO COCCC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000122957063 1138264395 /nfs/dbraw/zinc/26/43/95/1138264395.db2.gz DHSWBBKENQDTLX-KRWDZBQOSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000127298046 1138352678 /nfs/dbraw/zinc/35/26/78/1138352678.db2.gz WJOPNVDKCULQMF-DOTOQJQBSA-N 1 0 332.444 3.997 20 5 EHBDRO O=c1cc(C[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)c2c(ccc3ccccc32)o1 ZINC000151136291 1139011030 /nfs/dbraw/zinc/01/10/30/1139011030.db2.gz UQYFHDQTWLIEMA-GUDVDZBRSA-N 1 0 349.430 3.993 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3C[C@@H]4CCC[C@@H]4C3)o2)c1 ZINC000153288459 1139130437 /nfs/dbraw/zinc/13/04/37/1139130437.db2.gz QSONWKMQLUSOQA-GASCZTMLSA-N 1 0 327.384 3.524 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000178331904 1139687834 /nfs/dbraw/zinc/68/78/34/1139687834.db2.gz PKXXTRZGILAMGH-FFBQQKEYSA-N 1 0 338.473 3.715 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)c1cccc(F)c1 ZINC000179572127 1139766187 /nfs/dbraw/zinc/76/61/87/1139766187.db2.gz JZBPCZNPHWKZMB-UHFFFAOYSA-N 1 0 345.374 3.506 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186841743 1140224897 /nfs/dbraw/zinc/22/48/97/1140224897.db2.gz VCGIJHWYDLYQTO-CQSZACIVSA-N 1 0 336.457 3.562 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(N(C)C(C)C)nc2)cc1[N+](=O)[O-] ZINC000191290623 1140451302 /nfs/dbraw/zinc/45/13/02/1140451302.db2.gz RUFRMFUCCUHWKL-HNNXBMFYSA-N 1 0 342.443 3.994 20 5 EHBDRO C[C@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000192190780 1140509313 /nfs/dbraw/zinc/50/93/13/1140509313.db2.gz RDCANXHLQMLPHH-ZDUSSCGKSA-N 1 0 347.440 3.620 20 5 EHBDRO COCc1cccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192678560 1140543819 /nfs/dbraw/zinc/54/38/19/1140543819.db2.gz LXWPLRADDPXRPJ-IBGZPJMESA-N 1 0 326.396 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCO[C@]3(CCSC3)C1)CCC2 ZINC000193030994 1140561100 /nfs/dbraw/zinc/56/11/00/1140561100.db2.gz PILMHKXSNSXJHL-JCGIZDLHSA-N 1 0 348.468 3.617 20 5 EHBDRO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813207 1140725406 /nfs/dbraw/zinc/72/54/06/1140725406.db2.gz WTCNAEHHAMCVKG-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000266991806 1140747236 /nfs/dbraw/zinc/74/72/36/1140747236.db2.gz VKYBJVQWAPXMBC-UHFFFAOYSA-N 1 0 331.338 3.580 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625583 1141128605 /nfs/dbraw/zinc/12/86/05/1141128605.db2.gz CJVFZWRAJVFQOA-IUODEOHRSA-N 1 0 349.456 3.649 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000271129502 1141312472 /nfs/dbraw/zinc/31/24/72/1141312472.db2.gz LLILJUMXISVDLZ-IFXJQAMLSA-N 1 0 344.411 3.552 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cccnc1 ZINC000271154645 1141314846 /nfs/dbraw/zinc/31/48/46/1141314846.db2.gz QYTHUTOFLBFTRS-OAHLLOKOSA-N 1 0 331.441 3.693 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000271255224 1141335596 /nfs/dbraw/zinc/33/55/96/1141335596.db2.gz LLBCNVOHMDPWBH-JSGCOSHPSA-N 1 0 332.425 3.980 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000271372707 1141353233 /nfs/dbraw/zinc/35/32/33/1141353233.db2.gz GYWIGXLFIAWLKY-JCKWVBRZSA-N 1 0 336.432 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH+]3CCCCC3)CC2)c2ncccc12 ZINC000271383528 1141355384 /nfs/dbraw/zinc/35/53/84/1141355384.db2.gz XUVJZILHYKILKD-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CCC[C@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271512443 1141384457 /nfs/dbraw/zinc/38/44/57/1141384457.db2.gz STPOZRGGFBOENV-ZWKOTPCHSA-N 1 0 332.375 3.898 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000271515344 1141385811 /nfs/dbraw/zinc/38/58/11/1141385811.db2.gz OPZBABKBORKYRR-UKRRQHHQSA-N 1 0 334.416 3.746 20 5 EHBDRO CC(C)(CCCO)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000271584792 1141402299 /nfs/dbraw/zinc/40/22/99/1141402299.db2.gz RZTCLQGMEAXHGO-DOTOQJQBSA-N 1 0 334.460 3.694 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000537986720 1032064166 /nfs/dbraw/zinc/06/41/66/1032064166.db2.gz IWFCUTYTSMQZEY-BBRMVZONSA-N 1 0 336.432 3.585 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000126837166 1014373679 /nfs/dbraw/zinc/37/36/79/1014373679.db2.gz HMDLASQRQKZDHS-OAHLLOKOSA-N 1 0 342.443 3.995 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(OC)cc1 ZINC000430223208 1015100296 /nfs/dbraw/zinc/10/02/96/1015100296.db2.gz UOUBPTZXQLGUTQ-QGZVFWFLSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1cccc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000120436942 1015165005 /nfs/dbraw/zinc/16/50/05/1015165005.db2.gz HVIJMELRQWRRJP-UHFFFAOYSA-N 1 0 325.412 3.662 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000449065956 1032111956 /nfs/dbraw/zinc/11/19/56/1032111956.db2.gz XTLQZAKZLUIORB-CRAIPNDOSA-N 1 0 343.427 3.546 20 5 EHBDRO CC1=C[C@H](C)C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430273575 1015691027 /nfs/dbraw/zinc/69/10/27/1015691027.db2.gz BBBOWWIAFRGCBM-ZDUSSCGKSA-N 1 0 327.384 3.690 20 5 EHBDRO CC(C)[C@@](C)(O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528206 1015974586 /nfs/dbraw/zinc/97/45/86/1015974586.db2.gz KDLNFJOAUYJPJO-OALUTQOASA-N 1 0 328.412 3.681 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC001167122480 1016177029 /nfs/dbraw/zinc/17/70/29/1016177029.db2.gz IPOXKASFUYCFFY-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2ccc(Cl)cc2)n1 ZINC000447518591 1016322104 /nfs/dbraw/zinc/32/21/04/1016322104.db2.gz OBXPBFHSRWQPSL-HZPDHXFCSA-N 1 0 348.834 3.761 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177575783 1016386185 /nfs/dbraw/zinc/38/61/85/1016386185.db2.gz HONQGCBRCMILFQ-YUELXQCFSA-N 1 0 342.399 3.828 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccccc1C[NH+]1CCCC1 ZINC000178833159 1016792073 /nfs/dbraw/zinc/79/20/73/1016792073.db2.gz GHOHWMIWTXDBFH-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cc(C)cc([N+](=O)[O-])c2)c1 ZINC000340335193 1016958887 /nfs/dbraw/zinc/95/88/87/1016958887.db2.gz UWVJDYQJIQCWCM-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000414593701 1017002386 /nfs/dbraw/zinc/00/23/86/1017002386.db2.gz RCHOYPCIJBPWTM-NJELEJDNSA-N 1 0 341.386 3.616 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000414593700 1017002538 /nfs/dbraw/zinc/00/25/38/1017002538.db2.gz RCHOYPCIJBPWTM-MAVJXHJTSA-N 1 0 341.386 3.616 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000181832171 1017010146 /nfs/dbraw/zinc/01/01/46/1017010146.db2.gz SXYRUIKAPXEBLE-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000449079625 1032171480 /nfs/dbraw/zinc/17/14/80/1032171480.db2.gz PGYAGNIEYRGLIN-OAHLLOKOSA-N 1 0 342.443 3.557 20 5 EHBDRO COc1cccc(CCC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449136114 1032230529 /nfs/dbraw/zinc/23/05/29/1032230529.db2.gz UILLVRBFWQWPNO-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000449138991 1032241850 /nfs/dbraw/zinc/24/18/50/1032241850.db2.gz FDGZXMBVBSVQGJ-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)cc1F ZINC000278746242 1032290914 /nfs/dbraw/zinc/29/09/14/1032290914.db2.gz WTGCZHRXNOOWDM-MAUKXSAKSA-N 1 0 344.386 3.991 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000449179180 1032292821 /nfs/dbraw/zinc/29/28/21/1032292821.db2.gz ZEKFRZKSUDQAMF-YGONEPDPSA-N 1 0 344.415 3.533 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000538389966 1032334984 /nfs/dbraw/zinc/33/49/84/1032334984.db2.gz MQUCVIYYIVLOCV-CYBMUJFWSA-N 1 0 327.812 3.601 20 5 EHBDRO C[C@H]1c2cc(F)cc(F)c2CCN1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157753 1032336939 /nfs/dbraw/zinc/33/69/39/1032336939.db2.gz ZBYHMKAHFXCVDO-LBPRGKRZSA-N 1 0 348.349 3.871 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459792959 1032477245 /nfs/dbraw/zinc/47/72/45/1032477245.db2.gz KJYBPYFXGWNXQW-MDASCCDHSA-N 1 0 332.444 3.837 20 5 EHBDRO CC[N@H+](Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000340592636 1032520607 /nfs/dbraw/zinc/52/06/07/1032520607.db2.gz BXMXEIDAWMVGEV-UHFFFAOYSA-N 1 0 327.428 3.679 20 5 EHBDRO COc1cccc([C@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])OC)c1 ZINC000598986457 1017313861 /nfs/dbraw/zinc/31/38/61/1017313861.db2.gz AGIPPNRHAXPGSX-AIADIJKESA-N 1 0 342.395 3.594 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000449455721 1032572391 /nfs/dbraw/zinc/57/23/91/1032572391.db2.gz AYGAGOZIRAVEET-LMMKCTJWSA-N 1 0 332.444 3.844 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2csc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000573253470 1032604695 /nfs/dbraw/zinc/60/46/95/1032604695.db2.gz PAUMFAWSEIFHGA-KRWDZBQOSA-N 1 0 332.425 3.624 20 5 EHBDRO COc1ncc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000449461808 1032610486 /nfs/dbraw/zinc/61/04/86/1032610486.db2.gz RQZNDLWOVCNFNM-GFCCVEGCSA-N 1 0 349.818 3.763 20 5 EHBDRO CO[C@](C)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449484538 1032635057 /nfs/dbraw/zinc/63/50/57/1032635057.db2.gz MTGPUWAZPZPPKZ-IBHIWXBSSA-N 1 0 326.396 3.759 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000449494203 1032658255 /nfs/dbraw/zinc/65/82/55/1032658255.db2.gz GFXIFHWQHFFRBN-SUMWQHHRSA-N 1 0 330.384 3.712 20 5 EHBDRO C[C@H]1CCC[N@@H+]1Cc1ccc(-c2cc(CO)cc([N+](=O)[O-])c2)cc1 ZINC000592987200 1032658482 /nfs/dbraw/zinc/65/84/82/1032658482.db2.gz WVGJLIYLYFYLQI-AWEZNQCLSA-N 1 0 326.396 3.738 20 5 EHBDRO CCc1cnc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495958 1032665337 /nfs/dbraw/zinc/66/53/37/1032665337.db2.gz FQCKMSDVWBLHTP-CQSZACIVSA-N 1 0 331.441 3.993 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656696 1017107694 /nfs/dbraw/zinc/10/76/94/1017107694.db2.gz IZXJBBZCULKIES-UONOGXRCSA-N 1 0 345.468 3.883 20 5 EHBDRO CCCn1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505387 1032688654 /nfs/dbraw/zinc/68/86/54/1032688654.db2.gz XGDAWPCRAJUYET-QGZVFWFLSA-N 1 0 328.416 3.581 20 5 EHBDRO C[C@@H]([NH3+])[C@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014163 1017408444 /nfs/dbraw/zinc/40/84/44/1017408444.db2.gz LOHVRPDQLHDFHK-NEPJUHHUSA-N 1 0 349.818 3.866 20 5 EHBDRO CC1(C)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000127128314 1017446903 /nfs/dbraw/zinc/44/69/03/1017446903.db2.gz XOEIJDWEZGHSFY-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH+]2CCC(c3c[nH]c4ncccc34)CC2)cs1 ZINC000118838057 1017644049 /nfs/dbraw/zinc/64/40/49/1017644049.db2.gz YNSABOJUKWAONW-UHFFFAOYSA-N 1 0 342.424 3.912 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000177479505 1017679599 /nfs/dbraw/zinc/67/95/99/1017679599.db2.gz YSCUYAHJWPQHCF-KKUMJFAQSA-N 1 0 341.411 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000593461360 1032718814 /nfs/dbraw/zinc/71/88/14/1032718814.db2.gz KQVCTBAYWRRUGT-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[N@H+](CCCOc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083168525 1017747138 /nfs/dbraw/zinc/74/71/38/1017747138.db2.gz DWTIWOHLWFMKEZ-UHFFFAOYSA-N 1 0 341.367 3.637 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]([C@@H](C)c1ccccc1Cl)C1CC1 ZINC001167325507 1018070562 /nfs/dbraw/zinc/07/05/62/1018070562.db2.gz CGGSZXVYORIEAA-LBPRGKRZSA-N 1 0 348.834 3.979 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701343 1018412267 /nfs/dbraw/zinc/41/22/67/1018412267.db2.gz NYZJDRWXYNBZSV-SWLSCSKDSA-N 1 0 348.447 3.626 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCn2ccnc2)s1 ZINC000102419184 1018525161 /nfs/dbraw/zinc/52/51/61/1018525161.db2.gz RTOGGQRKBSZRPJ-UHFFFAOYSA-N 1 0 342.424 3.700 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000322473397 1019119704 /nfs/dbraw/zinc/11/97/04/1019119704.db2.gz PFBGZDFNODWRKA-SRCQZFHVSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2C2CC2)cc1OC(F)F ZINC000433817117 1019655968 /nfs/dbraw/zinc/65/59/68/1019655968.db2.gz CIQGSHXPFIKJKU-ZDUSSCGKSA-N 1 0 341.358 3.625 20 5 EHBDRO C[NH2+][C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261921083 1019717201 /nfs/dbraw/zinc/71/72/01/1019717201.db2.gz BOWVMZNZGRNNNH-LBPRGKRZSA-N 1 0 349.818 3.692 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](C)O ZINC000513668449 1019919927 /nfs/dbraw/zinc/91/99/27/1019919927.db2.gz YUJNXLDWFCVOPX-CYBMUJFWSA-N 1 0 334.441 3.915 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@H]1CCCC12CC2 ZINC000706777224 1020244038 /nfs/dbraw/zinc/24/40/38/1020244038.db2.gz XVEHHGKEBQTTBX-ZDUSSCGKSA-N 1 0 325.206 3.780 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2C)cc1[N+](=O)[O-] ZINC000276089601 1020600297 /nfs/dbraw/zinc/60/02/97/1020600297.db2.gz ANODQHUQYFZNNJ-LBPRGKRZSA-N 1 0 332.404 3.540 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CC[N@@H+](C4CCCC4)C3)c2c1 ZINC000413129975 1020729239 /nfs/dbraw/zinc/72/92/39/1020729239.db2.gz QCVDMNXULMWJCX-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO CC(C)[NH+]1CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602504878 1032939238 /nfs/dbraw/zinc/93/92/38/1032939238.db2.gz WNHZJPOMARPHMU-UHFFFAOYSA-N 1 0 345.365 3.576 20 5 EHBDRO COc1ccc(COCC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000537936260 1021008818 /nfs/dbraw/zinc/00/88/18/1021008818.db2.gz ITJIPGWBJOEXJI-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@H]([NH2+]CC1CCN(C(=O)C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000187419878 1021092707 /nfs/dbraw/zinc/09/27/07/1021092707.db2.gz OZUOXSHZSFEBIM-AWEZNQCLSA-N 1 0 347.459 3.530 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1F ZINC000126609181 1021106881 /nfs/dbraw/zinc/10/68/81/1021106881.db2.gz GTEIRUPTYTUALY-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000090843861 1021214282 /nfs/dbraw/zinc/21/42/82/1021214282.db2.gz WVMPODGBMSDPQC-KSSFIOAISA-N 1 0 328.412 3.850 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)COC ZINC000426336013 1021314844 /nfs/dbraw/zinc/31/48/44/1021314844.db2.gz RTVXXSQQALFYNL-CYBMUJFWSA-N 1 0 326.462 3.728 20 5 EHBDRO CC(C)([NH2+]Cc1cccc2c1NCCC2)c1ccccc1[N+](=O)[O-] ZINC000894847659 1021370352 /nfs/dbraw/zinc/37/03/52/1021370352.db2.gz FOKIKEGTAOZHMT-UHFFFAOYSA-N 1 0 325.412 3.978 20 5 EHBDRO CCC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCCC1 ZINC000602564628 1032974984 /nfs/dbraw/zinc/97/49/84/1032974984.db2.gz AWNUWCVDVFWSNF-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000439458283 1021446117 /nfs/dbraw/zinc/44/61/17/1021446117.db2.gz BUTKUYVCDTXYPC-HNNXBMFYSA-N 1 0 349.475 3.959 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCCOCc1ccccc1 ZINC000439486420 1021476504 /nfs/dbraw/zinc/47/65/04/1021476504.db2.gz LYGXYHGNHLRFDV-UHFFFAOYSA-N 1 0 344.411 3.642 20 5 EHBDRO CCC[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000120885877 1021480809 /nfs/dbraw/zinc/48/08/09/1021480809.db2.gz WWPJEWGVDOSQGA-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO Cc1ccc(F)c(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000337419358 1021527945 /nfs/dbraw/zinc/52/79/45/1021527945.db2.gz OZPKSUOSUUYMRE-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO C[C@@H]1CC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000602577343 1032995529 /nfs/dbraw/zinc/99/55/29/1032995529.db2.gz HKGUFJXFTNUBME-NXEZZACHSA-N 1 0 332.322 3.659 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)c2cc([N+](=O)[O-])ccc21 ZINC000519861142 1021735560 /nfs/dbraw/zinc/73/55/60/1021735560.db2.gz IOHLRIHRTFBUPX-NKGKWGDASA-N 1 0 330.428 3.864 20 5 EHBDRO COc1cccc2c1CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000426505042 1021744866 /nfs/dbraw/zinc/74/48/66/1021744866.db2.gz RWTYQTUCTZVUEK-UHFFFAOYSA-N 1 0 326.396 3.513 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000287053579 1021754422 /nfs/dbraw/zinc/75/44/22/1021754422.db2.gz RZVUARHNHUVSKG-NSHDSACASA-N 1 0 337.449 3.522 20 5 EHBDRO CCCCC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C(C)C ZINC000172895871 1033004304 /nfs/dbraw/zinc/00/43/04/1033004304.db2.gz PZNBFNTTYNIMHY-UHFFFAOYSA-N 1 0 331.420 3.711 20 5 EHBDRO CSc1ccc(C(=O)Nc2ccc(C[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000023898638 1021884283 /nfs/dbraw/zinc/88/42/83/1021884283.db2.gz GMHNHODEGLTPIA-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)Oc1ccccc1 ZINC000561589156 1021940098 /nfs/dbraw/zinc/94/00/98/1021940098.db2.gz BFEFPPYEVSYDAB-UHFFFAOYSA-N 1 0 344.411 3.941 20 5 EHBDRO Cc1c(NC(=O)CC[NH+]2CCC3(CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000517059388 1021986906 /nfs/dbraw/zinc/98/69/06/1021986906.db2.gz VJPLDVCGSVDLOA-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO C[C@H](CC(F)(F)F)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602612448 1033026848 /nfs/dbraw/zinc/02/68/48/1033026848.db2.gz RSUHSXQZAKXTJK-RXMQYKEDSA-N 1 0 347.156 3.849 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441240831 1022076639 /nfs/dbraw/zinc/07/66/39/1022076639.db2.gz CLZSYKUHLIPYGY-KRWDZBQOSA-N 1 0 342.395 3.819 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)C12CCC2 ZINC000581967307 1022573293 /nfs/dbraw/zinc/57/32/93/1022573293.db2.gz NDQWVNBNLWZVCO-MSOLQXFVSA-N 1 0 343.427 3.556 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000894656468 1022672943 /nfs/dbraw/zinc/67/29/43/1022672943.db2.gz CHINNEXXDQPNQW-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO CCN(CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CCC(F)(F)F ZINC000426035098 1022719348 /nfs/dbraw/zinc/71/93/48/1022719348.db2.gz IDLLVSPKLSLDKV-GFCCVEGCSA-N 1 0 333.354 3.520 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000430828658 1022746118 /nfs/dbraw/zinc/74/61/18/1022746118.db2.gz CABBDKZTFJCNOH-RDJZCZTQSA-N 1 0 347.459 3.534 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000602707368 1033092495 /nfs/dbraw/zinc/09/24/95/1033092495.db2.gz UOAQMHQGZZTLHE-LLVKDONJSA-N 1 0 339.317 3.902 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCO[C@H]1CCCC[C@H]1C ZINC000509585632 1023092810 /nfs/dbraw/zinc/09/28/10/1023092810.db2.gz KLDMDWKBFHKNNP-PBHICJAKSA-N 1 0 336.432 3.678 20 5 EHBDRO Cc1ccc(CNC[C@H](C(C)C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000518268018 1023178623 /nfs/dbraw/zinc/17/86/23/1023178623.db2.gz CIIZNVRQVZJMJB-LJQANCHMSA-N 1 0 333.476 3.749 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(C)C)C(C)(C)O ZINC000477865813 1023322597 /nfs/dbraw/zinc/32/25/97/1023322597.db2.gz XHHBYEUZRVVESS-BBRMVZONSA-N 1 0 340.489 3.851 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H](C)c1cc2ccccc2o1 ZINC000602758775 1033130111 /nfs/dbraw/zinc/13/01/11/1033130111.db2.gz NQUTWOXSYPWKHH-GFCCVEGCSA-N 1 0 328.372 3.539 20 5 EHBDRO Cc1ccc(NC(=O)N(C)CCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000602757950 1033130838 /nfs/dbraw/zinc/13/08/38/1033130838.db2.gz WJYYADJRKCSRHI-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000610773962 1023495005 /nfs/dbraw/zinc/49/50/05/1023495005.db2.gz YWZYYXNQFOUNCE-INIZCTEOSA-N 1 0 342.395 3.647 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C2CCN(C(=O)C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000610799316 1023682179 /nfs/dbraw/zinc/68/21/79/1023682179.db2.gz RVNNSQKPCSLAJK-AWEZNQCLSA-N 1 0 347.459 3.591 20 5 EHBDRO CCCc1ccc([C@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)C)cc1 ZINC000602786937 1033161212 /nfs/dbraw/zinc/16/12/12/1033161212.db2.gz XOKCSCPBFGHTOP-QGZVFWFLSA-N 1 0 330.432 3.768 20 5 EHBDRO CC[C@H](C)C[N@H+](C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000247728900 1023906029 /nfs/dbraw/zinc/90/60/29/1023906029.db2.gz UADYPSSSQNFBNO-WDEREUQCSA-N 1 0 327.812 3.553 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+][C@@H]3CCC[C@H]3Cc3ccccc3[N+](=O)[O-])C2)CO1 ZINC000897779290 1033171747 /nfs/dbraw/zinc/17/17/47/1033171747.db2.gz OXWFYWMPZCJWDB-BGGRFHAHSA-N 1 0 344.455 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)cc1 ZINC000449764584 1033177698 /nfs/dbraw/zinc/17/76/98/1033177698.db2.gz CGPHVRUUAKDWPI-INIZCTEOSA-N 1 0 332.425 3.650 20 5 EHBDRO CC(C)Cc1ccc([C@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C2CC2)cc1 ZINC000602803534 1033175363 /nfs/dbraw/zinc/17/53/63/1033175363.db2.gz CNPYDJONOMFQGS-SFHVURJKSA-N 1 0 342.443 3.768 20 5 EHBDRO CCOC[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000474097932 1024164263 /nfs/dbraw/zinc/16/42/63/1024164263.db2.gz SXNHWDHDNUPQLN-JQHSSLGASA-N 1 0 334.460 3.957 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1OC(F)F)C(C)(C)C[NH+](C)C ZINC000544845722 1024329572 /nfs/dbraw/zinc/32/95/72/1024329572.db2.gz JFUVTZQIUPYXGF-SNVBAGLBSA-N 1 0 331.363 3.584 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCc1cn(C)c2cc(F)ccc12 ZINC000472050241 1024486879 /nfs/dbraw/zinc/48/68/79/1024486879.db2.gz WIYQDBXQEZDAEF-UHFFFAOYSA-N 1 0 341.386 3.866 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000425246236 1024503587 /nfs/dbraw/zinc/50/35/87/1024503587.db2.gz XZQZSDSYDMJXFN-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO O=C(NCCC[NH+]1CCCCC1)c1cc2ccccc2c2cccnc12 ZINC000514512311 1024519255 /nfs/dbraw/zinc/51/92/55/1024519255.db2.gz CGWRKOOOAAJJDK-UHFFFAOYSA-N 1 0 347.462 3.994 20 5 EHBDRO CC[C@](C)([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000895693564 1024729388 /nfs/dbraw/zinc/72/93/88/1024729388.db2.gz GTOLQNXSYJHEQX-SFHVURJKSA-N 1 0 348.374 3.863 20 5 EHBDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000383552213 1024772378 /nfs/dbraw/zinc/77/23/78/1024772378.db2.gz XLBPNVTTZOQZLF-CVEARBPZSA-N 1 0 327.428 3.766 20 5 EHBDRO CCC1([NH+](C)C)CCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000602882091 1033235000 /nfs/dbraw/zinc/23/50/00/1033235000.db2.gz JMKAZNRUOLSUQL-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC000071943355 1024815197 /nfs/dbraw/zinc/81/51/97/1024815197.db2.gz VTAWKQWRRBAWQG-UHFFFAOYSA-N 1 0 348.447 3.571 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372448 1024855797 /nfs/dbraw/zinc/85/57/97/1024855797.db2.gz RHEHSJHGXYMHCN-NWDGAFQWSA-N 1 0 349.818 3.677 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H]([NH+]2CCCC2)C[C@@H]1C ZINC000514890651 1024857973 /nfs/dbraw/zinc/85/79/73/1024857973.db2.gz LMFSDXZJNWWRAV-SCAUPEPPSA-N 1 0 329.444 3.557 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000427883238 1024861420 /nfs/dbraw/zinc/86/14/20/1024861420.db2.gz BPXMOPZZBUMRMR-CYBMUJFWSA-N 1 0 332.375 3.853 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC[NH2+]CC1 ZINC000435390753 1024874934 /nfs/dbraw/zinc/87/49/34/1024874934.db2.gz TYVKOUSPMVTISK-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395021 1024882332 /nfs/dbraw/zinc/88/23/32/1024882332.db2.gz NUSAJONQPWLZPL-BZNIZROVSA-N 1 0 349.818 3.677 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425373055 1024901443 /nfs/dbraw/zinc/90/14/43/1024901443.db2.gz PGLCYOMVBYFQCY-SFHVURJKSA-N 1 0 330.428 3.684 20 5 EHBDRO Cc1cc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310352392 1025131192 /nfs/dbraw/zinc/13/11/92/1025131192.db2.gz HFQOPBUEDMJJFX-QGZVFWFLSA-N 1 0 325.412 3.837 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510212 1025305411 /nfs/dbraw/zinc/30/54/11/1025305411.db2.gz HLSZEEKUGVNTGR-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@H]1CSCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000934303745 1025347709 /nfs/dbraw/zinc/34/77/09/1025347709.db2.gz KWTQFRAHZMRUMH-LBPRGKRZSA-N 1 0 333.413 3.577 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119920038 1025423355 /nfs/dbraw/zinc/42/33/55/1025423355.db2.gz JXAUIRWWCNOUFT-AWEZNQCLSA-N 1 0 339.395 3.572 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057564 1025480740 /nfs/dbraw/zinc/48/07/40/1025480740.db2.gz UBQJIRRJWXGPFN-KSSFIOAISA-N 1 0 328.412 3.584 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000442807779 1025484987 /nfs/dbraw/zinc/48/49/87/1025484987.db2.gz FQBZTOVTQMRKOZ-NWGLXNPWSA-N 1 0 332.444 3.853 20 5 EHBDRO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1c[nH]c2ccccc12 ZINC000442889457 1025573634 /nfs/dbraw/zinc/57/36/34/1025573634.db2.gz KJRAQHRTRNAYEJ-UHFFFAOYSA-N 1 0 339.395 3.977 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1)N(C)C ZINC000443008631 1025659220 /nfs/dbraw/zinc/65/92/20/1025659220.db2.gz GZNMZXXGYBGRAL-DNVCBOLYSA-N 1 0 327.428 3.684 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(OCC)CCCC2)cc1[N+](=O)[O-] ZINC000559890439 1025959775 /nfs/dbraw/zinc/95/97/75/1025959775.db2.gz AKRWVGBBWNOOQI-AWEZNQCLSA-N 1 0 336.432 3.993 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2ccc(F)cc2C)c1[N+](=O)[O-] ZINC000896801023 1026043065 /nfs/dbraw/zinc/04/30/65/1026043065.db2.gz KSUQOAZBKYJUTG-LLVKDONJSA-N 1 0 334.347 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCCCn3cccn3)C2)cc1 ZINC000451550143 1026101261 /nfs/dbraw/zinc/10/12/61/1026101261.db2.gz RHBUAXUIUJXKOE-SFHVURJKSA-N 1 0 342.443 3.841 20 5 EHBDRO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553130 1026105178 /nfs/dbraw/zinc/10/51/78/1026105178.db2.gz XKWYEGNAIJXXGW-ZBFHGGJFSA-N 1 0 326.400 3.634 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCSC4(CCC4)C3)nc2c1 ZINC000896951489 1026150113 /nfs/dbraw/zinc/15/01/13/1026150113.db2.gz PJNPHFFJKNAOHE-LLVKDONJSA-N 1 0 333.413 3.644 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000127628868 1026195416 /nfs/dbraw/zinc/19/54/16/1026195416.db2.gz PCGLAMAUFUXONZ-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000475144051 1026249454 /nfs/dbraw/zinc/24/94/54/1026249454.db2.gz LAMWTEOTAJOCFO-NVXWUHKLSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000338999666 1026333371 /nfs/dbraw/zinc/33/33/71/1026333371.db2.gz ISLHUAMZGWXMMO-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO CCOC[C@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000475197888 1026375766 /nfs/dbraw/zinc/37/57/66/1026375766.db2.gz ZEMZRSKYHAVLEH-DOMZBBRYSA-N 1 0 346.349 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCN(c3ccccc3)CC2)cc1 ZINC000475293177 1026437002 /nfs/dbraw/zinc/43/70/02/1026437002.db2.gz BAGAEGJZNJPSIM-UHFFFAOYSA-N 1 0 325.412 3.601 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1CCN(c2ccccc2)CC1 ZINC000475286749 1026443093 /nfs/dbraw/zinc/44/30/93/1026443093.db2.gz LSNCPJISWCRWRV-UHFFFAOYSA-N 1 0 339.439 3.909 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000452080047 1026479415 /nfs/dbraw/zinc/47/94/15/1026479415.db2.gz GXSIIQOQCFRQJA-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cnn(CC3CCC3)c2)cc1[N+](=O)[O-] ZINC000934562820 1026816775 /nfs/dbraw/zinc/81/67/75/1026816775.db2.gz PLYYLPLCPCHDPL-AWEZNQCLSA-N 1 0 328.416 3.751 20 5 EHBDRO CC(C)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCCC1 ZINC000479852697 1026863781 /nfs/dbraw/zinc/86/37/81/1026863781.db2.gz NTYGRRPIIFADKI-SFHVURJKSA-N 1 0 345.487 3.770 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642386 1026998444 /nfs/dbraw/zinc/99/84/44/1026998444.db2.gz IHQRABPFXINXCM-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000248745999 1027035598 /nfs/dbraw/zinc/03/55/98/1027035598.db2.gz FLPBSXYHGHUNQB-XLWVJDPXSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cccc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000475455171 1027052025 /nfs/dbraw/zinc/05/20/25/1027052025.db2.gz XJUNYQYFIUETJM-QGZVFWFLSA-N 1 0 341.411 3.852 20 5 EHBDRO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000472247764 1027072822 /nfs/dbraw/zinc/07/28/22/1027072822.db2.gz SVVPBZSVMSVMJH-GOSISDBHSA-N 1 0 348.422 3.520 20 5 EHBDRO CCCn1nccc1C1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000501550025 1027346230 /nfs/dbraw/zinc/34/62/30/1027346230.db2.gz KJISTOGUTYKBNA-UHFFFAOYSA-N 1 0 342.443 3.889 20 5 EHBDRO C[C@H](C[NH+]1CCCCC1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000320863367 1027372010 /nfs/dbraw/zinc/37/20/10/1027372010.db2.gz QJPJCZKTAUUSTE-LLVKDONJSA-N 1 0 331.338 3.900 20 5 EHBDRO CC[NH2+]CC1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000420218853 1027405433 /nfs/dbraw/zinc/40/54/33/1027405433.db2.gz WYBKPYFNRYIVKQ-UHFFFAOYSA-N 1 0 332.231 3.728 20 5 EHBDRO COc1cc(CN2CCCC3(CC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000186612809 1027660148 /nfs/dbraw/zinc/66/01/48/1027660148.db2.gz QWBHYVIYQMDIJC-UHFFFAOYSA-N 1 0 342.342 3.581 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000129754429 1027753261 /nfs/dbraw/zinc/75/32/61/1027753261.db2.gz JOGKGMZHKRLOCG-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000366701810 1027757598 /nfs/dbraw/zinc/75/75/98/1027757598.db2.gz ZLTCBUYUWHETKZ-KBXCAEBGSA-N 1 0 325.412 3.741 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCC(C)(C)CC1 ZINC000533438725 1027846981 /nfs/dbraw/zinc/84/69/81/1027846981.db2.gz NAEUZNILCFWRRJ-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](C)[C@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000300421470 1027967260 /nfs/dbraw/zinc/96/72/60/1027967260.db2.gz FAUQPZUEACTAGG-MNOVXSKESA-N 1 0 342.237 3.560 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](CC(F)F)c2ccccc2)cc1 ZINC000421001442 1027982565 /nfs/dbraw/zinc/98/25/65/1027982565.db2.gz WUXNZTOWQRTZRH-MRXNPFEDSA-N 1 0 336.338 3.960 20 5 EHBDRO CC[C@@](C)(COc1ncccc1Cl)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000533534471 1028031529 /nfs/dbraw/zinc/03/15/29/1028031529.db2.gz RUZVIVCXNVUBIM-KRWDZBQOSA-N 1 0 349.818 3.981 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178702058 1028121984 /nfs/dbraw/zinc/12/19/84/1028121984.db2.gz JZHKCVMIRSYDRO-KBXCAEBGSA-N 1 0 330.432 3.867 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCC[C@@H]1C ZINC000444676939 1028144898 /nfs/dbraw/zinc/14/48/98/1028144898.db2.gz OUDUGSSSDXMYDO-SUMWQHHRSA-N 1 0 334.416 3.862 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680971 1028152151 /nfs/dbraw/zinc/15/21/51/1028152151.db2.gz XWJDRIGGGIGOOL-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO COC(=O)c1cc([C@@H](C)N[C@@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375320 1028196904 /nfs/dbraw/zinc/19/69/04/1028196904.db2.gz GVHMPKIVRJBYOK-WDEREUQCSA-N 1 0 332.356 3.695 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCC[C@H]1OC(F)F)CCC2 ZINC000503937743 1028242114 /nfs/dbraw/zinc/24/21/14/1028242114.db2.gz ORVNUGWTISKETG-RRFJBIMHSA-N 1 0 326.343 3.722 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]1OC(F)F ZINC000503944000 1028248724 /nfs/dbraw/zinc/24/87/24/1028248724.db2.gz YAMLWDRBEJJSNY-UXIGCNINSA-N 1 0 328.359 3.666 20 5 EHBDRO C[C@@H](N[C@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284197 1028322127 /nfs/dbraw/zinc/32/21/27/1028322127.db2.gz WPNATHNSKKNLCX-BXUZGUMPSA-N 1 0 331.441 3.711 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000178730258 1028379535 /nfs/dbraw/zinc/37/95/35/1028379535.db2.gz UOMPMURVWLCADU-GOSISDBHSA-N 1 0 342.395 3.779 20 5 EHBDRO CCc1ccc([C@H](NCCC[NH2+]C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423551677 1028514490 /nfs/dbraw/zinc/51/44/90/1028514490.db2.gz JJHMXTMFANUBTQ-LJQANCHMSA-N 1 0 343.427 3.571 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000063482847 1028583938 /nfs/dbraw/zinc/58/39/38/1028583938.db2.gz GARMWXDKGGPYHJ-OAHLLOKOSA-N 1 0 341.411 3.925 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838648 1028602362 /nfs/dbraw/zinc/60/23/62/1028602362.db2.gz SZOSBIKPZFXMPN-SJORKVTESA-N 1 0 328.416 3.837 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838646 1028602728 /nfs/dbraw/zinc/60/27/28/1028602728.db2.gz SZOSBIKPZFXMPN-IRXDYDNUSA-N 1 0 328.416 3.837 20 5 EHBDRO COc1ccc(NC(=O)CC[C@H]([NH3+])CC2CCCCC2)cc1[N+](=O)[O-] ZINC000424200405 1028885170 /nfs/dbraw/zinc/88/51/70/1028885170.db2.gz ZLCPOKZUMVHGJZ-AWEZNQCLSA-N 1 0 349.431 3.620 20 5 EHBDRO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424340327 1029017213 /nfs/dbraw/zinc/01/72/13/1029017213.db2.gz GDRSAKBMOOTYPC-AWEZNQCLSA-N 1 0 344.415 3.832 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000504906035 1029049295 /nfs/dbraw/zinc/04/92/95/1029049295.db2.gz RRQHKZPMPPCUKC-ZDUSSCGKSA-N 1 0 348.374 3.862 20 5 EHBDRO CCCCNC(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000440885664 1029243532 /nfs/dbraw/zinc/24/35/32/1029243532.db2.gz JBFHHBIMXHPEGC-UHFFFAOYSA-N 1 0 347.459 3.612 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000583244053 1029379887 /nfs/dbraw/zinc/37/98/87/1029379887.db2.gz UCVGGDBCYXQODI-UHFFFAOYSA-N 1 0 348.443 3.834 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(CNc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000343137954 1029417144 /nfs/dbraw/zinc/41/71/44/1029417144.db2.gz FYRRSSDTMAFGBU-UHFFFAOYSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cn1 ZINC000513829356 1029528405 /nfs/dbraw/zinc/52/84/05/1029528405.db2.gz ARXPWZJOOOGCDH-SUMWQHHRSA-N 1 0 329.375 3.630 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+][C@H](C)CCO)cc2[N+](=O)[O-])cc1 ZINC000237473183 1029562053 /nfs/dbraw/zinc/56/20/53/1029562053.db2.gz HQDGSBNJDKQVTF-CQSZACIVSA-N 1 0 346.452 3.915 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000162864468 1029618015 /nfs/dbraw/zinc/61/80/15/1029618015.db2.gz RHNOKFIFZRGXLC-OAHLLOKOSA-N 1 0 328.416 3.841 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccc(F)cc1F)C1CC1 ZINC000481720385 1029891640 /nfs/dbraw/zinc/89/16/40/1029891640.db2.gz SNRCBXBJPIRGGZ-KRWDZBQOSA-N 1 0 332.350 3.984 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccccn3)CC2)c(Cl)c1 ZINC000052407450 1030021203 /nfs/dbraw/zinc/02/12/03/1030021203.db2.gz CIINFZWXLLBGGG-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO CC(C)[C@H](CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525695927 1030029197 /nfs/dbraw/zinc/02/91/97/1030029197.db2.gz PCUZAWPTYZEASQ-HNNXBMFYSA-N 1 0 334.441 3.820 20 5 EHBDRO Cc1cc(-c2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299255 1030048406 /nfs/dbraw/zinc/04/84/06/1030048406.db2.gz WZUKBQZBRLIXAJ-XQQFMLRXSA-N 1 0 330.388 3.887 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453308364 1030079225 /nfs/dbraw/zinc/07/92/25/1030079225.db2.gz LLKAGHSYDYAKOI-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@@H](n2ccnc2)C1 ZINC000245515285 1030109125 /nfs/dbraw/zinc/10/91/25/1030109125.db2.gz DJQBSAGIKSFGQZ-MPGHIAIKSA-N 1 0 328.416 3.744 20 5 EHBDRO CC1(C)C[C@@H]([N@@H+]2CCC[C@@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381841 1030163093 /nfs/dbraw/zinc/16/30/93/1030163093.db2.gz RIGNCQNQXOEKMD-IEBWSBKVSA-N 1 0 330.428 3.820 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC000453387606 1030168702 /nfs/dbraw/zinc/16/87/02/1030168702.db2.gz WGBRHJZEDLGOIX-QMTMVMCOSA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1cc(C)c(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000453372054 1030193510 /nfs/dbraw/zinc/19/35/10/1030193510.db2.gz RYXSHJNVQLNTLX-GOSISDBHSA-N 1 0 325.412 3.718 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])nc1 ZINC000453413610 1030227544 /nfs/dbraw/zinc/22/75/44/1030227544.db2.gz HZWQMSZAHPOVFG-VQIMIIECSA-N 1 0 339.439 3.842 20 5 EHBDRO COc1ccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000447544178 1030278815 /nfs/dbraw/zinc/27/88/15/1030278815.db2.gz UOQKHEQNPKGNBR-SFHVURJKSA-N 1 0 344.386 3.952 20 5 EHBDRO CC1(C)C[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453430617 1030285741 /nfs/dbraw/zinc/28/57/41/1030285741.db2.gz RBDGSESQOJRZIX-PBHICJAKSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CN(Cc1ccc(OC(F)F)cc1)CC2 ZINC000532038816 1030303458 /nfs/dbraw/zinc/30/34/58/1030303458.db2.gz JLKUGPADRVVUKC-UHFFFAOYSA-N 1 0 334.322 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3CCO[C@@H]3C13CCCC3)CCC2 ZINC000447604894 1030360048 /nfs/dbraw/zinc/36/00/48/1030360048.db2.gz DSFURRBDRLNHPM-OWYHZJEWSA-N 1 0 342.439 3.910 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000482524035 1030504570 /nfs/dbraw/zinc/50/45/70/1030504570.db2.gz GHEIGLOJJYPWHU-ZDUSSCGKSA-N 1 0 332.375 3.944 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000532289534 1030525780 /nfs/dbraw/zinc/52/57/80/1030525780.db2.gz WRZVUEBOUKZPPT-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683453 1030638455 /nfs/dbraw/zinc/63/84/55/1030638455.db2.gz YHPIYHGQCKDBTM-HNNXBMFYSA-N 1 0 338.411 3.924 20 5 EHBDRO Cc1nccnc1CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000550895075 1030778349 /nfs/dbraw/zinc/77/83/49/1030778349.db2.gz LLQLKZWMSDBBNK-FQEVSTJZSA-N 1 0 348.406 3.615 20 5 EHBDRO COc1cc(F)c(CN[C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000583816991 1030829550 /nfs/dbraw/zinc/82/95/50/1030829550.db2.gz SAWMDPPDCIMJDQ-NSHDSACASA-N 1 0 334.347 3.602 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[N@H+](C)[C@H](Cc2ccccc2)C1 ZINC000585756374 1030916871 /nfs/dbraw/zinc/91/68/71/1030916871.db2.gz GZTONAHSDYSATH-OXJNMPFZSA-N 1 0 339.439 3.515 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCS2 ZINC000343466084 1031006678 /nfs/dbraw/zinc/00/66/78/1031006678.db2.gz QLLBLAJRHBJUJR-INIZCTEOSA-N 1 0 344.436 3.973 20 5 EHBDRO CCC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000548160125 1031231411 /nfs/dbraw/zinc/23/14/11/1031231411.db2.gz VIBKWHSLTSCVHG-PBHICJAKSA-N 1 0 333.432 3.506 20 5 EHBDRO CC(C)Cc1ccc([C@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C2CC2)cc1 ZINC000343559384 1031396722 /nfs/dbraw/zinc/39/67/22/1031396722.db2.gz CZPIFIWXBBMIEU-SFHVURJKSA-N 1 0 342.443 3.768 20 5 EHBDRO COc1ccc([C@H](C[NH+]2CCCC2)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000302030551 1031406104 /nfs/dbraw/zinc/40/61/04/1031406104.db2.gz BSWCGORKYGBGTI-SFHVURJKSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)C[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000475741219 1031719937 /nfs/dbraw/zinc/71/99/37/1031719937.db2.gz WHJUIDMUBJQCLR-VNHYZAJKSA-N 1 0 333.432 3.598 20 5 EHBDRO CCC(CC)Nc1cc[nH+]cc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000584200014 1031928527 /nfs/dbraw/zinc/92/85/27/1031928527.db2.gz IWKYDJWWGSJFFU-UHFFFAOYSA-N 1 0 342.399 3.573 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)N(C)Cc1ccccc1 ZINC000007340046 1031975096 /nfs/dbraw/zinc/97/50/96/1031975096.db2.gz YEUSUVBNAMTLDM-ZDUSSCGKSA-N 1 0 338.367 3.838 20 5 EHBDRO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173422218 1033313513 /nfs/dbraw/zinc/31/35/13/1033313513.db2.gz HGABEKULIADHPE-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CS1 ZINC000594499437 1033402418 /nfs/dbraw/zinc/40/24/18/1033402418.db2.gz GWVUUBJEIMOQAA-CABZTGNLSA-N 1 0 334.363 3.987 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C1CC1)C1CCCCC1 ZINC000063497913 1033406397 /nfs/dbraw/zinc/40/63/97/1033406397.db2.gz UOYCJRSSJYTBNG-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO CCC[NH2+]Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000061003461 1033412025 /nfs/dbraw/zinc/41/20/25/1033412025.db2.gz VISVDNIUYZKNCL-UHFFFAOYSA-N 1 0 330.384 3.682 20 5 EHBDRO Cc1cc(NC[C@H]2C[C@@H]([NH+](C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000594592612 1033442021 /nfs/dbraw/zinc/44/20/21/1033442021.db2.gz TTYLGQCTLPMJQJ-PHIMTYICSA-N 1 0 331.338 3.674 20 5 EHBDRO CCC(=O)c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594597638 1033444286 /nfs/dbraw/zinc/44/42/86/1033444286.db2.gz DGOHZZQYLWFVPN-GOEBONIOSA-N 1 0 331.416 3.616 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925207 1033546678 /nfs/dbraw/zinc/54/66/78/1033546678.db2.gz MQHKISIOULAGEG-HUUCEWRRSA-N 1 0 344.411 3.859 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC000595021427 1033613555 /nfs/dbraw/zinc/61/35/55/1033613555.db2.gz DKVBLDSDPBUXAN-DYVFJYSZSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC1CC1 ZINC000598978934 1033627469 /nfs/dbraw/zinc/62/74/69/1033627469.db2.gz XIMQZCXEIWTYEB-UHFFFAOYSA-N 1 0 342.395 3.743 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@@H]([S@](C)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000595061445 1033640231 /nfs/dbraw/zinc/64/02/31/1033640231.db2.gz KZFGMRYJRFBBSB-JPXDGAFASA-N 1 0 338.473 3.715 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCN1C1CCCCC1 ZINC000598992027 1033644850 /nfs/dbraw/zinc/64/48/50/1033644850.db2.gz JQPCZTQHQCRJDA-POZKEBTKSA-N 1 0 329.444 3.605 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCSCC(F)(F)F ZINC000595027272 1033648537 /nfs/dbraw/zinc/64/85/37/1033648537.db2.gz QTGWBLPGAQCDRA-SECBINFHSA-N 1 0 338.351 3.550 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCO[C@H](CC(C)C)C1 ZINC000595027088 1033648787 /nfs/dbraw/zinc/64/87/87/1033648787.db2.gz MJGPWYFPHIQCCX-SQWLQELKSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000595032289 1033653611 /nfs/dbraw/zinc/65/36/11/1033653611.db2.gz MCIYFACWUPUEPL-HUUCEWRRSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C)c1ncc(C)s1 ZINC000595034326 1033654868 /nfs/dbraw/zinc/65/48/68/1033654868.db2.gz VGFYUMZYGMYGBS-PWSUYJOCSA-N 1 0 335.429 3.823 20 5 EHBDRO O=[N+]([O-])c1c2ccncc2ccc1N1CCC([NH+]2CCCCC2)CC1 ZINC000599025460 1033655062 /nfs/dbraw/zinc/65/50/62/1033655062.db2.gz ONNPEKLREOEHGU-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COC1([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000595037645 1033657455 /nfs/dbraw/zinc/65/74/55/1033657455.db2.gz BBGWIAVKEPMMHH-SNVBAGLBSA-N 1 0 332.322 3.661 20 5 EHBDRO CCOC1CCC([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000595052733 1033667399 /nfs/dbraw/zinc/66/73/99/1033667399.db2.gz UVHMVYMHXYNGBF-UHFFFAOYSA-N 1 0 331.416 3.556 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595049777 1033667740 /nfs/dbraw/zinc/66/77/40/1033667740.db2.gz OOKIDOZVLLJRFO-ZIAGYGMSSA-N 1 0 329.400 3.843 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599020521 1033668226 /nfs/dbraw/zinc/66/82/26/1033668226.db2.gz SFRICCOJKBQVMT-OQBYNLHGSA-N 1 0 339.395 3.753 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000595102447 1033692256 /nfs/dbraw/zinc/69/22/56/1033692256.db2.gz IAGDEMLFJQFDGW-IQUTYRLHSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](n2cccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000599058418 1033697313 /nfs/dbraw/zinc/69/73/13/1033697313.db2.gz UKRDONKAWZSWKS-FZMZJTMJSA-N 1 0 342.321 3.554 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000595084077 1033697772 /nfs/dbraw/zinc/69/77/72/1033697772.db2.gz FHNVKHGAXWHFHT-ZVZYQTTQSA-N 1 0 342.443 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@@H](O)C23CCC3)c2ccccc2)c1 ZINC000595088858 1033698710 /nfs/dbraw/zinc/69/87/10/1033698710.db2.gz DYDPPYUBRFPYHZ-GUDVDZBRSA-N 1 0 338.407 3.577 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595092578 1033701339 /nfs/dbraw/zinc/70/13/39/1033701339.db2.gz LEBDJAFMXQIWAW-IINYFYTJSA-N 1 0 328.359 3.935 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061199 1033701424 /nfs/dbraw/zinc/70/14/24/1033701424.db2.gz LDFZZNHRJRCCIY-SCLBCKFNSA-N 1 0 330.384 3.642 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000599077306 1033719708 /nfs/dbraw/zinc/71/97/08/1033719708.db2.gz BRISSAWCAWHISA-CHWSQXEVSA-N 1 0 344.406 3.936 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599092083 1033730703 /nfs/dbraw/zinc/73/07/03/1033730703.db2.gz FDRSMOMPYOGJJB-SGTLLEGYSA-N 1 0 327.384 3.800 20 5 EHBDRO Cc1noc(CN2CCC(c3ccc(F)cc3C)CC2)c1[N+](=O)[O-] ZINC000595501614 1033831210 /nfs/dbraw/zinc/83/12/10/1033831210.db2.gz WVIWJPDXTASEHU-UHFFFAOYSA-N 1 0 333.363 3.718 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC([NH2+]Cc2ccccc2)CC1 ZINC000595512690 1033835987 /nfs/dbraw/zinc/83/59/87/1033835987.db2.gz ZQXZUJWONZAZGV-INIZCTEOSA-N 1 0 339.439 3.910 20 5 EHBDRO CCOC(=O)CC(C)(C)CC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC001168307607 1033836717 /nfs/dbraw/zinc/83/67/17/1033836717.db2.gz CZHAXZWQXDNEAM-UHFFFAOYSA-N 1 0 348.443 3.929 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000593716720 1033838677 /nfs/dbraw/zinc/83/86/77/1033838677.db2.gz RUVJDUOJTPKOOL-DJJJIMSYSA-N 1 0 348.443 3.849 20 5 EHBDRO CC[C@@H](CNc1ccc(Br)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000608855959 1033933495 /nfs/dbraw/zinc/93/34/95/1033933495.db2.gz VIDPACPUDCHSNU-LBPRGKRZSA-N 1 0 342.237 3.644 20 5 EHBDRO COc1ccc(C[N@H+](CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000603838750 1033950755 /nfs/dbraw/zinc/95/07/55/1033950755.db2.gz GSXMYCWWGBNKIR-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO COc1ccc([C@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603837514 1033962933 /nfs/dbraw/zinc/96/29/33/1033962933.db2.gz PHFFMGJDQHARGS-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO COCCC1CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000599506691 1033966066 /nfs/dbraw/zinc/96/60/66/1033966066.db2.gz FYSNNHTWDQMVBR-UHFFFAOYSA-N 1 0 336.432 3.631 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450286724 1034024180 /nfs/dbraw/zinc/02/41/80/1034024180.db2.gz IUFLTFUQNVZLCX-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO C[N@H+](CCSc1c(Cl)cncc1[N+](=O)[O-])Cc1ccccc1 ZINC000596215126 1034122238 /nfs/dbraw/zinc/12/22/38/1034122238.db2.gz QEQSVOPKGDJUAX-UHFFFAOYSA-N 1 0 337.832 3.867 20 5 EHBDRO CO[C@]1(C(F)(F)F)CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141112 1034145218 /nfs/dbraw/zinc/14/52/18/1034145218.db2.gz BKZIGRNOIQSMRG-IJVDHGTGSA-N 1 0 344.333 3.651 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000596296321 1034147602 /nfs/dbraw/zinc/14/76/02/1034147602.db2.gz HAVCDQYUSYMCRZ-TZMCWYRMSA-N 1 0 325.359 3.961 20 5 EHBDRO CCC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOCC1 ZINC000534173911 1034208502 /nfs/dbraw/zinc/20/85/02/1034208502.db2.gz VKFJTSQTKMDDEO-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000179375537 1034257142 /nfs/dbraw/zinc/25/71/42/1034257142.db2.gz GTKIOQYBLLGLSL-NEPJUHHUSA-N 1 0 347.440 3.951 20 5 EHBDRO CC1(C)CN(CCCOc2ccc([N+](=O)[O-])cc2)[C@H]1c1cccnc1 ZINC000596591120 1034306636 /nfs/dbraw/zinc/30/66/36/1034306636.db2.gz GRSPEXQDPKVTJR-SFHVURJKSA-N 1 0 341.411 3.842 20 5 EHBDRO C[C@H]1CCC[N@@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CO)c1 ZINC000596634287 1034338900 /nfs/dbraw/zinc/33/89/00/1034338900.db2.gz IIXYFJAZHUAKRP-AWEZNQCLSA-N 1 0 326.396 3.738 20 5 EHBDRO COC(=O)c1cc([N+](=O)[O-])cc(-c2ccc(F)c(C[NH+](C)C)c2)c1C ZINC000596645658 1034344224 /nfs/dbraw/zinc/34/42/24/1034344224.db2.gz HBDLXAMUMLCMQN-UHFFFAOYSA-N 1 0 346.358 3.558 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC(CCC[NH+]3CCCC3)CC2)cs1 ZINC000122096198 1034355711 /nfs/dbraw/zinc/35/57/11/1034355711.db2.gz AWDPDEZMUOGOON-UHFFFAOYSA-N 1 0 337.489 3.744 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](CCC(C)C)C1CC1 ZINC000604435089 1034377787 /nfs/dbraw/zinc/37/77/87/1034377787.db2.gz MAZUIPOYUAYUOK-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000450855933 1034899143 /nfs/dbraw/zinc/89/91/43/1034899143.db2.gz HRVJMHHUWWDRGR-LYRGGWFBSA-N 1 0 336.819 3.686 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612419778 1034909894 /nfs/dbraw/zinc/90/98/94/1034909894.db2.gz REYWNMPBCVUWDN-CXAGYDPISA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612419782 1034910036 /nfs/dbraw/zinc/91/00/36/1034910036.db2.gz REYWNMPBCVUWDN-DYVFJYSZSA-N 1 0 326.396 3.812 20 5 EHBDRO CO[C@@](C)([C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948128 1035080884 /nfs/dbraw/zinc/08/08/84/1035080884.db2.gz MWOMOEYRNTZWPY-UGSOOPFHSA-N 1 0 336.432 3.675 20 5 EHBDRO Cc1cc(N(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)c2cccc([N+](=O)[O-])c2n1 ZINC000376235098 1035488027 /nfs/dbraw/zinc/48/80/27/1035488027.db2.gz NZLRSQXBMJGPBN-YIONKMFJSA-N 1 0 340.427 3.513 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CSc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000571761248 1035623313 /nfs/dbraw/zinc/62/33/13/1035623313.db2.gz CNTHVQUVMYBDLJ-SWLSCSKDSA-N 1 0 330.409 3.799 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCCO1 ZINC000271984690 1035636032 /nfs/dbraw/zinc/63/60/32/1035636032.db2.gz KMMXGIUVCSRALF-MLGOLLRUSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000582201759 1035712727 /nfs/dbraw/zinc/71/27/27/1035712727.db2.gz GXVLFHPKKWPXPT-UPTPFMHGSA-N 1 0 331.460 3.852 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000588232399 1035832709 /nfs/dbraw/zinc/83/27/09/1035832709.db2.gz DFBNJBUEYFRTNI-WFASDCNBSA-N 1 0 334.803 3.675 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCOc2ccccc2F)ccc1[N+](=O)[O-] ZINC000492484045 1035857408 /nfs/dbraw/zinc/85/74/08/1035857408.db2.gz LULVURAZWZBGTI-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1Cc2cccc(OC)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000414191925 1035977248 /nfs/dbraw/zinc/97/72/48/1035977248.db2.gz SDVDIRBGXOGOJK-QAPCUYQASA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201445 1036139183 /nfs/dbraw/zinc/13/91/83/1036139183.db2.gz YIDIYSPAUDJCND-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cnc(Nc2ccc(CC[NH+]3CCCCC3)cc2)s1 ZINC000443518079 1036219991 /nfs/dbraw/zinc/21/99/91/1036219991.db2.gz KDNVCEYVGYOPNZ-UHFFFAOYSA-N 1 0 332.429 3.823 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H](O)C(F)(F)F ZINC000498356653 1036278935 /nfs/dbraw/zinc/27/89/35/1036278935.db2.gz ZVZRRRLASKOMQL-JSGCOSHPSA-N 1 0 334.338 3.510 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200173 1036305508 /nfs/dbraw/zinc/30/55/08/1036305508.db2.gz VQUVAWFZZFZSGV-MWRSBEEJSA-N 1 0 330.428 3.747 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[NH+]1CCCCCC1 ZINC000589374956 1036361690 /nfs/dbraw/zinc/36/16/90/1036361690.db2.gz CZXTXGOTKZYSBA-UHFFFAOYSA-N 1 0 348.447 3.545 20 5 EHBDRO CC[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000414268862 1036376226 /nfs/dbraw/zinc/37/62/26/1036376226.db2.gz UBUPDGFOCWQVDP-AVGNSLFASA-N 1 0 348.369 3.843 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC[C@@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541566282 1036438926 /nfs/dbraw/zinc/43/89/26/1036438926.db2.gz SDEWGTFOCFBBQX-QFBILLFUSA-N 1 0 346.427 3.980 20 5 EHBDRO CCC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C[C@@H]1CCCCO1 ZINC000464676753 1036652160 /nfs/dbraw/zinc/65/21/60/1036652160.db2.gz JFXGEYJVTZAOPJ-AWEZNQCLSA-N 1 0 340.395 3.524 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCS[C@H](C(C)C)C1 ZINC000464768906 1036759186 /nfs/dbraw/zinc/75/91/86/1036759186.db2.gz CKODGWTZWSKJFR-KRWDZBQOSA-N 1 0 338.473 3.955 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCc2ccccc2OC(F)(F)F)c1 ZINC000237718021 1036875084 /nfs/dbraw/zinc/87/50/84/1036875084.db2.gz WPJADUUTENLIOK-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO COc1cc(NC[C@@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])cc1C ZINC000590570292 1036954376 /nfs/dbraw/zinc/95/43/76/1036954376.db2.gz YJYDEPFWFKWLQZ-INIZCTEOSA-N 1 0 345.399 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)cn1 ZINC000590690507 1037010251 /nfs/dbraw/zinc/01/02/51/1037010251.db2.gz LGTDBUUJNCSXQV-QGZVFWFLSA-N 1 0 326.400 3.629 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000173895157 1037070173 /nfs/dbraw/zinc/07/01/73/1037070173.db2.gz CBFNYVDKCTXXDZ-IGCXYCKISA-N 1 0 332.400 3.614 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2c(F)cccc2F)cc1Cl ZINC000761521421 1037097285 /nfs/dbraw/zinc/09/72/85/1037097285.db2.gz GVGKYBYSPKYVKM-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO CC(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524376 1037098187 /nfs/dbraw/zinc/09/81/87/1037098187.db2.gz BXKCSXHPPRQLTB-CZUORRHYSA-N 1 0 326.824 3.789 20 5 EHBDRO Cc1c(Cc2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211331 1037149237 /nfs/dbraw/zinc/14/92/37/1037149237.db2.gz DNHIBTPKYBEHNG-BZPMIXESSA-N 1 0 344.415 3.811 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C ZINC000493282109 1037215030 /nfs/dbraw/zinc/21/50/30/1037215030.db2.gz SDXYCQBBINWWBQ-CHWSQXEVSA-N 1 0 325.840 3.553 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@]1(C)CCCc2ccccc21 ZINC000539807755 1037219601 /nfs/dbraw/zinc/21/96/01/1037219601.db2.gz HUMIMNOWZWIHDE-LJQANCHMSA-N 1 0 326.396 3.945 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCOC2)s1 ZINC000542301088 1037258777 /nfs/dbraw/zinc/25/87/77/1037258777.db2.gz RZYUJIXBSICJOZ-CYBMUJFWSA-N 1 0 332.425 3.840 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000325952725 1037292389 /nfs/dbraw/zinc/29/23/89/1037292389.db2.gz NXFMFSNATWURID-NSHDSACASA-N 1 0 348.369 3.931 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccc(CO)cc1)CCCC2 ZINC000591348292 1037368107 /nfs/dbraw/zinc/36/81/07/1037368107.db2.gz MVYVZXBXKSRUMQ-FQEVSTJZSA-N 1 0 340.423 3.687 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163411041 1037380795 /nfs/dbraw/zinc/38/07/95/1037380795.db2.gz XTSAZFUQMBCSMZ-IUODEOHRSA-N 1 0 330.388 3.703 20 5 EHBDRO CCOc1cccc(NC[C@H](c2cccc(F)c2)[NH+](C)C)c1[N+](=O)[O-] ZINC000542467870 1037399663 /nfs/dbraw/zinc/39/96/63/1037399663.db2.gz BTCINVQZLZJRJZ-MRXNPFEDSA-N 1 0 347.390 3.847 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000129725065 1037426635 /nfs/dbraw/zinc/42/66/35/1037426635.db2.gz DJACYBGSVWNCES-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO CCc1ccc([C@H](CNc2ccc([N+](=O)[O-])c(OC)c2)[NH+](C)C)cc1 ZINC000462916018 1037544960 /nfs/dbraw/zinc/54/49/60/1037544960.db2.gz AUQNMSUZFWASGV-SFHVURJKSA-N 1 0 343.427 3.881 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc(C)oc1C ZINC000540084398 1037550355 /nfs/dbraw/zinc/55/03/55/1037550355.db2.gz BNPIMGTZYJXFTQ-CQSZACIVSA-N 1 0 349.456 3.903 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000532546649 1037580116 /nfs/dbraw/zinc/58/01/16/1037580116.db2.gz JEDCPWLHRZNSGY-UHFFFAOYSA-N 1 0 341.839 3.991 20 5 EHBDRO CC[N@H+](CCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1)CC(C)C ZINC000540204427 1037681076 /nfs/dbraw/zinc/68/10/76/1037681076.db2.gz CNSSOFGYNVPVMX-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO C[C@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[NH+]1[C@H](C)CC[C@H]1C ZINC000741021672 1037689552 /nfs/dbraw/zinc/68/95/52/1037689552.db2.gz FOXUNYQISOMGJG-IJLUTSLNSA-N 1 0 340.807 3.553 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)N[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000415944037 1037692619 /nfs/dbraw/zinc/69/26/19/1037692619.db2.gz NMWHNRLDGDUFTC-CYBMUJFWSA-N 1 0 342.399 3.587 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc2[nH]ccc21 ZINC000494051146 1037795967 /nfs/dbraw/zinc/79/59/67/1037795967.db2.gz TXLXIGLHDDNNPP-UHFFFAOYSA-N 1 0 336.351 3.849 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000463198568 1037864116 /nfs/dbraw/zinc/86/41/16/1037864116.db2.gz NKMMWJVLBOQQFG-JZXOWHBKSA-N 1 0 348.443 3.509 20 5 EHBDRO C[C@@H](C[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1[N+](=O)[O-] ZINC000897465281 1037872281 /nfs/dbraw/zinc/87/22/81/1037872281.db2.gz VDQWEGONPSYVIE-UONOGXRCSA-N 1 0 335.407 3.937 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475100 1037889839 /nfs/dbraw/zinc/88/98/39/1037889839.db2.gz PVAGFZCISSCSPP-RDTXWAMCSA-N 1 0 332.400 3.590 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000492039872 1037913890 /nfs/dbraw/zinc/91/38/90/1037913890.db2.gz DEMYBWITHUHYAB-BIENSFFJSA-N 1 0 341.386 3.616 20 5 EHBDRO O=C(CC[N@@H+]1CCCC[C@@H]1C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000592199119 1037945176 /nfs/dbraw/zinc/94/51/76/1037945176.db2.gz XABHQHLEECZCAS-MRXNPFEDSA-N 1 0 331.416 3.578 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@H](c1ccccc1)[NH+](C)C ZINC000416120632 1038171520 /nfs/dbraw/zinc/17/15/20/1038171520.db2.gz DRQNBRVOVHSLNF-GOSISDBHSA-N 1 0 341.411 3.843 20 5 EHBDRO Cc1c(NC(=O)C[C@@H](c2ccccc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000416124179 1038195360 /nfs/dbraw/zinc/19/53/60/1038195360.db2.gz NIRVHJHIXISXKF-KRWDZBQOSA-N 1 0 327.384 3.535 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc2ccc(Cl)cn12 ZINC000549408251 1038324783 /nfs/dbraw/zinc/32/47/83/1038324783.db2.gz LVJHXGXMNLDHRB-UHFFFAOYSA-N 1 0 344.802 3.570 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H](CO)C(C)(C)C ZINC000538761416 1038527337 /nfs/dbraw/zinc/52/73/37/1038527337.db2.gz CKRRLLBQEGUPER-KRWDZBQOSA-N 1 0 332.400 3.694 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCC[C@@H]1O ZINC000538812486 1038548371 /nfs/dbraw/zinc/54/83/71/1038548371.db2.gz RSVXKRXWDSVLFW-GUYCJALGSA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788568 1038610724 /nfs/dbraw/zinc/61/07/24/1038610724.db2.gz XRQODSBVBBMGEA-VXGBXAGGSA-N 1 0 343.349 3.961 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000181597295 1038638550 /nfs/dbraw/zinc/63/85/50/1038638550.db2.gz ZEMPTVMGAAMVKI-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@H](O)Cc1ccccc1 ZINC000539050223 1038654003 /nfs/dbraw/zinc/65/40/03/1038654003.db2.gz HKVCNBDAQXMGNB-QMTMVMCOSA-N 1 0 328.412 3.546 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ncccc2[N+](=O)[O-])CC1)CC(C)C ZINC000539105460 1038689447 /nfs/dbraw/zinc/68/94/47/1038689447.db2.gz BSOYLFIBEUOVKN-UHFFFAOYSA-N 1 0 334.464 3.574 20 5 EHBDRO Cc1cccc(C(C)(C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000539316406 1038770268 /nfs/dbraw/zinc/77/02/68/1038770268.db2.gz VJRFCKSRYXNEPS-UHFFFAOYSA-N 1 0 341.411 3.675 20 5 EHBDRO CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870453 1038811877 /nfs/dbraw/zinc/81/18/77/1038811877.db2.gz AGNUAAQMNGELGX-FQEVSTJZSA-N 1 0 339.439 3.595 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000479865982 1038841821 /nfs/dbraw/zinc/84/18/21/1038841821.db2.gz XJJAJVHHFMFDAE-QFBILLFUSA-N 1 0 341.455 3.727 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000552137792 1038998352 /nfs/dbraw/zinc/99/83/52/1038998352.db2.gz NAHXLJCRUSDESP-OUQXZNHLSA-N 1 0 332.444 3.729 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485473039 1039136525 /nfs/dbraw/zinc/13/65/25/1039136525.db2.gz HMALGUOIWVHCKB-WMLDXEAASA-N 1 0 326.396 3.981 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@H]1C ZINC000478209357 1039291263 /nfs/dbraw/zinc/29/12/63/1039291263.db2.gz QJXRUOQAJHUSFM-SOZUMNATSA-N 1 0 330.359 3.777 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1cc(F)cc(F)c1)C1CC1 ZINC000480278247 1039386909 /nfs/dbraw/zinc/38/69/09/1039386909.db2.gz ZXNRPEARIFXBSG-KRWDZBQOSA-N 1 0 332.350 3.984 20 5 EHBDRO COc1cc(C[NH2+]C(C)(C)COCc2ccccc2)ccc1[N+](=O)[O-] ZINC000500816786 1039529571 /nfs/dbraw/zinc/52/95/71/1039529571.db2.gz PGVICFURJOEVRY-UHFFFAOYSA-N 1 0 344.411 3.688 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485796081 1039548371 /nfs/dbraw/zinc/54/83/71/1039548371.db2.gz UIUDOLKYZPUJMM-QGZVFWFLSA-N 1 0 342.395 3.949 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC1 ZINC000480535607 1039655397 /nfs/dbraw/zinc/65/53/97/1039655397.db2.gz KWTUTTHXVYZFLU-QUCCMNQESA-N 1 0 345.487 3.626 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCc1ccccn1)CCCC2 ZINC000417306458 1039658286 /nfs/dbraw/zinc/65/82/86/1039658286.db2.gz CYJGVJIUZLOAPZ-IBGZPJMESA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCCCC2)cn1 ZINC000554753755 1039675938 /nfs/dbraw/zinc/67/59/38/1039675938.db2.gz RUVWLSOINIWLJI-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO CC[NH+](CC)Cc1ccc(CNCc2csc([N+](=O)[O-])c2)cc1 ZINC000236920759 1039765933 /nfs/dbraw/zinc/76/59/33/1039765933.db2.gz FUYGSXWUCGGWTI-UHFFFAOYSA-N 1 0 333.457 3.788 20 5 EHBDRO CCN(CC[NH+]1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000480769390 1039990703 /nfs/dbraw/zinc/99/07/03/1039990703.db2.gz YSOSDXMVDPTSQU-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@@H]34)o2)c1 ZINC000249458181 1040046176 /nfs/dbraw/zinc/04/61/76/1040046176.db2.gz DXBYHNXONLILHJ-JZXOWHBKSA-N 1 0 328.368 3.512 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])cn1 ZINC000486566416 1040251977 /nfs/dbraw/zinc/25/19/77/1040251977.db2.gz NTDGWSOYQMPOFA-VURMDHGXSA-N 1 0 341.411 3.970 20 5 EHBDRO C[C@H](CCc1ccco1)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000500060912 1040406139 /nfs/dbraw/zinc/40/61/39/1040406139.db2.gz FCHUXLKDFNTTHJ-KGLIPLIRSA-N 1 0 345.399 3.516 20 5 EHBDRO COc1cc(CSCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000433022855 1040481932 /nfs/dbraw/zinc/48/19/32/1040481932.db2.gz MFVSOISVMNRDNW-UHFFFAOYSA-N 1 0 346.452 3.969 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)cc1 ZINC000566572275 1040547033 /nfs/dbraw/zinc/54/70/33/1040547033.db2.gz CKRWDTPZOAEFBF-DOTOQJQBSA-N 1 0 341.411 3.685 20 5 EHBDRO C[C@H]([C@H]1Cc2ccccc2O1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593282 1040621187 /nfs/dbraw/zinc/62/11/87/1040621187.db2.gz VJJPCHYUCBINMU-KZULUSFZSA-N 1 0 330.359 3.558 20 5 EHBDRO COC(=O)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000490799453 1040749009 /nfs/dbraw/zinc/74/90/09/1040749009.db2.gz DRFZPCZXNGZRMS-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000614227378 1040764360 /nfs/dbraw/zinc/76/43/60/1040764360.db2.gz CBHODICLKBAHAL-MSOLQXFVSA-N 1 0 336.432 3.547 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022889 1040869035 /nfs/dbraw/zinc/86/90/35/1040869035.db2.gz QDAMCVZUECETNM-XLIONFOSSA-N 1 0 337.423 3.511 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cs1 ZINC000491061030 1040897192 /nfs/dbraw/zinc/89/71/92/1040897192.db2.gz LZJOPZCDLSYRMP-OAHLLOKOSA-N 1 0 337.489 3.744 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000433189501 1041025491 /nfs/dbraw/zinc/02/54/91/1041025491.db2.gz FPCKIIVXEYHSHG-GOSISDBHSA-N 1 0 339.439 3.909 20 5 EHBDRO Cc1ccc(C[NH2+]CC2(CO)CC(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000433200438 1041051359 /nfs/dbraw/zinc/05/13/59/1041051359.db2.gz QCEFONUYCXROPM-UHFFFAOYSA-N 1 0 340.423 3.549 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453430621 1041103145 /nfs/dbraw/zinc/10/31/45/1041103145.db2.gz RBDGSESQOJRZIX-YOEHRIQHSA-N 1 0 332.444 3.711 20 5 EHBDRO CCC[C@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOC1 ZINC000512873897 1041158728 /nfs/dbraw/zinc/15/87/28/1041158728.db2.gz HDZPNQFSGRVGRL-SFHVURJKSA-N 1 0 330.384 3.904 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCOc2ncccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000433300674 1041238844 /nfs/dbraw/zinc/23/88/44/1041238844.db2.gz UBGQAYWGQHWPSX-INIZCTEOSA-N 1 0 345.374 3.520 20 5 EHBDRO CC[N@H+](Cc1ccoc1)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092935765 1041569704 /nfs/dbraw/zinc/56/97/04/1041569704.db2.gz ZLKWXHHLZVXQIQ-UHFFFAOYSA-N 1 0 340.383 3.610 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@H](O)c1ccc(F)cc1 ZINC000124438975 1041712456 /nfs/dbraw/zinc/71/24/56/1041712456.db2.gz WVORTLDORGJWNP-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CCc2cccc(Br)c2)cc1 ZINC000313742982 1042179865 /nfs/dbraw/zinc/17/98/65/1042179865.db2.gz QVPRITPQFDQJMK-UHFFFAOYSA-N 1 0 349.228 3.732 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000047903886 1042268920 /nfs/dbraw/zinc/26/89/20/1042268920.db2.gz JRCVSLYTPFJBTJ-UHFFFAOYSA-N 1 0 327.384 3.689 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120316052 1042391493 /nfs/dbraw/zinc/39/14/93/1042391493.db2.gz HXSFQSJUXLYBPP-CRAIPNDOSA-N 1 0 343.427 3.984 20 5 EHBDRO CC[NH+](CC)[C@H](CNCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000236898791 1042600550 /nfs/dbraw/zinc/60/05/50/1042600550.db2.gz YTKPJLHYFGVAHY-MRXNPFEDSA-N 1 0 333.457 3.829 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000121344573 1042765088 /nfs/dbraw/zinc/76/50/88/1042765088.db2.gz MYITZVFQDUVVPG-HNNXBMFYSA-N 1 0 340.427 3.618 20 5 EHBDRO CCC[NH+]1CCC(CNC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000473186888 1042780252 /nfs/dbraw/zinc/78/02/52/1042780252.db2.gz PPYLLTYSMBFPOF-UHFFFAOYSA-N 1 0 347.459 3.570 20 5 EHBDRO CCn1nccc1C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278901063 1042881231 /nfs/dbraw/zinc/88/12/31/1042881231.db2.gz PJLNVCIMARMSBV-CQSZACIVSA-N 1 0 328.416 3.752 20 5 EHBDRO Cc1ccc(Br)cc1C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000190297258 1042911667 /nfs/dbraw/zinc/91/16/67/1042911667.db2.gz ANIRPMNELDDSLT-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO CCOC(CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)OCC ZINC000279010569 1043186750 /nfs/dbraw/zinc/18/67/50/1043186750.db2.gz GXKPKEYQUHJZNB-INIZCTEOSA-N 1 0 336.432 3.696 20 5 EHBDRO COc1c(O)ccc(C[NH2+]Cc2cccc(C(C)C)c2)c1[N+](=O)[O-] ZINC000893676226 1043810646 /nfs/dbraw/zinc/81/06/46/1043810646.db2.gz QPMDGDNNHLVGGS-UHFFFAOYSA-N 1 0 330.384 3.722 20 5 EHBDRO CC1CC[NH+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)CC1 ZINC000190314100 1043896378 /nfs/dbraw/zinc/89/63/78/1043896378.db2.gz QTNYRNUTQRIOAU-UHFFFAOYSA-N 1 0 346.456 3.895 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000344418985 1043985084 /nfs/dbraw/zinc/98/50/84/1043985084.db2.gz LAOMKXXIJAHJIA-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000584757306 1044074003 /nfs/dbraw/zinc/07/40/03/1044074003.db2.gz JEFDLHMZDOBYIK-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1c(F)ccc(O)c1F ZINC000512218916 1044204147 /nfs/dbraw/zinc/20/41/47/1044204147.db2.gz MUTGDEPOUZZSMV-UHFFFAOYSA-N 1 0 342.729 3.564 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000279673961 1044394568 /nfs/dbraw/zinc/39/45/68/1044394568.db2.gz NQQZHBAYXHDIHD-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCOC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000344879057 1044642062 /nfs/dbraw/zinc/64/20/62/1044642062.db2.gz JWEJFMFRMFQYMR-INIZCTEOSA-N 1 0 348.443 3.536 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879382 1127081965 /nfs/dbraw/zinc/08/19/65/1127081965.db2.gz MQYGOFPBLUKSJB-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039957 1127568655 /nfs/dbraw/zinc/56/86/55/1127568655.db2.gz USRGYCZPIAHOLJ-UKRRQHHQSA-N 1 0 348.472 3.816 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000301280860 1127729303 /nfs/dbraw/zinc/72/93/03/1127729303.db2.gz ODWABDAHJNTDDM-GFCCVEGCSA-N 1 0 326.828 3.567 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc(C)cc1[N+](=O)[O-])[NH+](C)C ZINC000301434296 1127888991 /nfs/dbraw/zinc/88/89/91/1127888991.db2.gz ILAYJTQNDAOOOV-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477795 1131242511 /nfs/dbraw/zinc/24/25/11/1131242511.db2.gz UMDLYFQDCXRZKI-RHSMWYFYSA-N 1 0 336.395 3.780 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(OC(C)C)cc1N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168602692 1128281039 /nfs/dbraw/zinc/28/10/39/1128281039.db2.gz VNBSBCWKYBLUDK-HOCLYGCPSA-N 1 0 335.448 3.975 20 5 EHBDRO Cc1cnc(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000301457269 1128344701 /nfs/dbraw/zinc/34/47/01/1128344701.db2.gz CLBAWNVVTGCBEO-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000153551831 1128448612 /nfs/dbraw/zinc/44/86/12/1128448612.db2.gz AXFMABNPLLVJSM-CXAGYDPISA-N 1 0 336.432 3.585 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC1CC[NH+](C2CCCCC2)CC1 ZINC000301480975 1128472302 /nfs/dbraw/zinc/47/23/02/1128472302.db2.gz SCSXULZTFHMOPR-UHFFFAOYSA-N 1 0 347.459 3.950 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765849801 1128581644 /nfs/dbraw/zinc/58/16/44/1128581644.db2.gz QYQCRXXKFBDQMK-MSOLQXFVSA-N 1 0 326.396 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)cc1 ZINC000273690879 1128653879 /nfs/dbraw/zinc/65/38/79/1128653879.db2.gz HSBLJUKVVWTFNS-UHFFFAOYSA-N 1 0 326.396 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCN2Cc2ccccc2)c(Cl)c1 ZINC000715646808 1128654091 /nfs/dbraw/zinc/65/40/91/1128654091.db2.gz GJCLYGOBKBGZMW-HNNXBMFYSA-N 1 0 331.803 3.935 20 5 EHBDRO Cc1cc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)ncc1[N+](=O)[O-] ZINC000301650589 1128845345 /nfs/dbraw/zinc/84/53/45/1128845345.db2.gz GHWWXSUNMNQIAG-MRXNPFEDSA-N 1 0 346.475 3.779 20 5 EHBDRO C[C@@H]1CCN(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000525800609 1120294988 /nfs/dbraw/zinc/29/49/88/1120294988.db2.gz KWJYKQFJMVFPOR-CQSZACIVSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@@H]([C@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000542533554 1120933242 /nfs/dbraw/zinc/93/32/42/1120933242.db2.gz UDHXTSOXLREZJZ-KBPBESRZSA-N 1 0 333.432 3.728 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccco1 ZINC000301055993 1121197259 /nfs/dbraw/zinc/19/72/59/1121197259.db2.gz IREGUTUSOIJIOC-CYBMUJFWSA-N 1 0 343.305 3.921 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000495460725 1121217313 /nfs/dbraw/zinc/21/73/13/1121217313.db2.gz LPHNDXLBKPWGHE-QGZVFWFLSA-N 1 0 326.396 3.585 20 5 EHBDRO CCCC[NH+](CCCC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000915204018 1121246820 /nfs/dbraw/zinc/24/68/20/1121246820.db2.gz CVQAPAAYMSVSKW-UHFFFAOYSA-N 1 0 331.420 3.713 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@@H]2C1 ZINC000311001848 1128975644 /nfs/dbraw/zinc/97/56/44/1128975644.db2.gz INDGZJRTCYIUPE-ZWKOTPCHSA-N 1 0 337.423 3.553 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(c2cnn(C)c2)CC1 ZINC000272272237 1121509786 /nfs/dbraw/zinc/50/97/86/1121509786.db2.gz DJLQEPNXPHKXGB-AWEZNQCLSA-N 1 0 328.416 3.577 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000193836370 1121720961 /nfs/dbraw/zinc/72/09/61/1121720961.db2.gz VRZWAADHATUFCH-UHFFFAOYSA-N 1 0 344.411 3.595 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000390707005 1129017554 /nfs/dbraw/zinc/01/75/54/1129017554.db2.gz RQSNQXTXBUBVME-INIZCTEOSA-N 1 0 329.375 3.810 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000301104694 1121919978 /nfs/dbraw/zinc/91/99/78/1121919978.db2.gz VMIAJXLYRFLMSP-OLZOCXBDSA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2ccco2)[NH+]2CCCCC2)c(F)c1 ZINC000301112627 1121949949 /nfs/dbraw/zinc/94/99/49/1121949949.db2.gz ZCMSAHNIOPNVBZ-MRXNPFEDSA-N 1 0 333.363 3.966 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000488070309 1122016435 /nfs/dbraw/zinc/01/64/35/1122016435.db2.gz VOZJIVNFZFSQLO-KRWDZBQOSA-N 1 0 339.439 3.516 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000301121530 1122040866 /nfs/dbraw/zinc/04/08/66/1122040866.db2.gz QXGQXLVYXKBFRA-AWEZNQCLSA-N 1 0 331.441 3.980 20 5 EHBDRO Cc1c(C[NH2+]CCCOCCc2ccccc2)cccc1[N+](=O)[O-] ZINC000917138004 1122530655 /nfs/dbraw/zinc/53/06/55/1122530655.db2.gz MLNVCQQEEGBSHR-UHFFFAOYSA-N 1 0 328.412 3.642 20 5 EHBDRO Cc1ccc(N2CCC[N@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000917212512 1122557565 /nfs/dbraw/zinc/55/75/65/1122557565.db2.gz ZKIPUWJSYVTSMO-UHFFFAOYSA-N 1 0 339.439 3.658 20 5 EHBDRO COc1ccc(C[NH2+]CCCc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000609287629 1122937102 /nfs/dbraw/zinc/93/71/02/1122937102.db2.gz GGQFXHJYRLYZAK-UHFFFAOYSA-N 1 0 328.412 3.943 20 5 EHBDRO CCC(CC)[C@@H](CNCc1ccc(OC)c([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000609287662 1122939722 /nfs/dbraw/zinc/93/97/22/1122939722.db2.gz LYXBWUTYUGJQQO-GOSISDBHSA-N 1 0 349.475 3.594 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)OCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000919558341 1123081779 /nfs/dbraw/zinc/08/17/79/1123081779.db2.gz MRBOUJUVWGIFSE-UHFFFAOYSA-N 1 0 334.416 3.535 20 5 EHBDRO C[C@@H]([N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406105 1123364569 /nfs/dbraw/zinc/36/45/69/1123364569.db2.gz JHNZYJSYRPUWBC-SNVBAGLBSA-N 1 0 327.812 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800495 1123664183 /nfs/dbraw/zinc/66/41/83/1123664183.db2.gz JYPGPRHONUBLLT-SFHVURJKSA-N 1 0 328.437 3.927 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916174 1123691665 /nfs/dbraw/zinc/69/16/65/1123691665.db2.gz DAXPKVNPBPKQIV-INIZCTEOSA-N 1 0 344.386 3.807 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@@H+]1C1CC1 ZINC000301820949 1129140424 /nfs/dbraw/zinc/14/04/24/1129140424.db2.gz JRTZWJMBDCHHID-KOLCDFICSA-N 1 0 329.322 3.651 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000615834447 1123883966 /nfs/dbraw/zinc/88/39/66/1123883966.db2.gz VBABGCYVUULLML-BXBOZWQASA-N 1 0 326.400 3.532 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000615837607 1123884972 /nfs/dbraw/zinc/88/49/72/1123884972.db2.gz LAPDJOXDGHTNGX-INDWDQIESA-N 1 0 326.343 3.702 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1ccnn1C)C(C)C ZINC000615967166 1123919568 /nfs/dbraw/zinc/91/95/68/1123919568.db2.gz PYKSNDOANDHORR-PBHICJAKSA-N 1 0 330.432 3.727 20 5 EHBDRO Cc1c(C[N@H+](Cc2ccccc2)CC(C)(C)O)cccc1[N+](=O)[O-] ZINC000180234284 1123967073 /nfs/dbraw/zinc/96/70/73/1123967073.db2.gz RUYZYVYPFBHLJP-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO CC[NH+](CC)Cc1cccc(CNc2cc(C)c([N+](=O)[O-])cn2)c1 ZINC000080598845 1124612740 /nfs/dbraw/zinc/61/27/40/1124612740.db2.gz SCBXCONJCBPOKY-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H](C)[C@H]1OC ZINC000617549838 1124648727 /nfs/dbraw/zinc/64/87/27/1124648727.db2.gz NKVAACKMBDSRIP-YMRXKLBXSA-N 1 0 347.415 3.665 20 5 EHBDRO CO[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000453212473 1129181180 /nfs/dbraw/zinc/18/11/80/1129181180.db2.gz HYINARBATSVLEE-KGLIPLIRSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@@H+]1C1CC1 ZINC000301846024 1129185218 /nfs/dbraw/zinc/18/52/18/1129185218.db2.gz ALBPLEWMCWDQED-DZGCQCFKSA-N 1 0 338.411 3.694 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)c1 ZINC000115557423 1129274350 /nfs/dbraw/zinc/27/43/50/1129274350.db2.gz ZDHFJCRTZXYEDB-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891195 1129289566 /nfs/dbraw/zinc/28/95/66/1129289566.db2.gz UNHCMNHRBYCPRR-PBHICJAKSA-N 1 0 346.818 3.809 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H](Nc2ccccc2)C1 ZINC000116276248 1129348991 /nfs/dbraw/zinc/34/89/91/1129348991.db2.gz DLYLVDMAYDLYKL-MRXNPFEDSA-N 1 0 331.803 3.935 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301926144 1129370996 /nfs/dbraw/zinc/37/09/96/1129370996.db2.gz MSIFEGSSYBTSRX-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO CSc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+](C)C)cc1 ZINC000338837394 1129413377 /nfs/dbraw/zinc/41/33/77/1129413377.db2.gz OAINQKPXRPZTKB-INIZCTEOSA-N 1 0 346.456 3.735 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)CC1CCCC1 ZINC000466418516 1129438333 /nfs/dbraw/zinc/43/83/33/1129438333.db2.gz YKTBXQYEJCQQQJ-DWCFMXGVSA-N 1 0 332.444 3.777 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000301978679 1129465359 /nfs/dbraw/zinc/46/53/59/1129465359.db2.gz AARHFXSPNOSSMT-HNNXBMFYSA-N 1 0 340.427 3.516 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000154158274 1129536107 /nfs/dbraw/zinc/53/61/07/1129536107.db2.gz UMMDFEYUONECJT-CQSZACIVSA-N 1 0 344.415 3.541 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000922455793 1129537740 /nfs/dbraw/zinc/53/77/40/1129537740.db2.gz XITPHFANFXJIFN-XSNQJSSTSA-N 1 0 344.333 3.698 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCCCO)C2CC2)o1 ZINC000093383154 1129586620 /nfs/dbraw/zinc/58/66/20/1129586620.db2.gz UABRDGNHXQESST-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO CSCC[C@@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093559009 1129594395 /nfs/dbraw/zinc/59/43/95/1129594395.db2.gz OBAUSMZEIHRUAX-SNVBAGLBSA-N 1 0 334.388 3.770 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@]3(CCOC3)C2)s1 ZINC000093820299 1129604898 /nfs/dbraw/zinc/60/48/98/1129604898.db2.gz VVBIOZISVNKEJQ-SFHVURJKSA-N 1 0 344.436 3.936 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)cccc1[N+](=O)[O-] ZINC000155070553 1129610727 /nfs/dbraw/zinc/61/07/27/1129610727.db2.gz CESJTZRVXGBWEH-XJKSGUPXSA-N 1 0 333.457 3.918 20 5 EHBDRO COc1cc(NC[C@H](C)[N@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000390668992 1129628664 /nfs/dbraw/zinc/62/86/64/1129628664.db2.gz XNNOQZMXLADPOI-ZDUSSCGKSA-N 1 0 347.390 3.675 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000156672708 1129733872 /nfs/dbraw/zinc/73/38/72/1129733872.db2.gz BDCVBZKXOCGYIK-CQSZACIVSA-N 1 0 329.400 3.938 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H]3C3CCCC3)n2)c1 ZINC000055927422 1129790669 /nfs/dbraw/zinc/79/06/69/1129790669.db2.gz OVLWPJLRCGIEKS-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@@H](O)c2ccc(F)cc2)CC1 ZINC000304007735 1129875847 /nfs/dbraw/zinc/87/58/47/1129875847.db2.gz UAKFOGJXERLAPL-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2cccs2)c([N+](=O)[O-])c1 ZINC000543506569 1129906864 /nfs/dbraw/zinc/90/68/64/1129906864.db2.gz YEERVBCJWRUWJO-UHFFFAOYSA-N 1 0 336.413 3.569 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000132855774 1129920233 /nfs/dbraw/zinc/92/02/33/1129920233.db2.gz FNJBOKMRBJJETI-CQSZACIVSA-N 1 0 345.468 3.674 20 5 EHBDRO Cn1cc2c(n1)CCC[C@@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000282480956 1129927757 /nfs/dbraw/zinc/92/77/57/1129927757.db2.gz QEQNPZGYILVDSL-WMZOPIPTSA-N 1 0 340.427 3.718 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(N2CCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000133335003 1129943949 /nfs/dbraw/zinc/94/39/49/1129943949.db2.gz BPMRCGQVSIOOJE-UHFFFAOYSA-N 1 0 340.427 3.615 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000543542251 1129953378 /nfs/dbraw/zinc/95/33/78/1129953378.db2.gz ITJBVRWROMDGQW-IQUTYRLHSA-N 1 0 326.396 3.946 20 5 EHBDRO C[C@H]([NH2+]Cc1cncc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000163922947 1129953904 /nfs/dbraw/zinc/95/39/04/1129953904.db2.gz XDORSMWZEGKPFQ-JTQLQIEISA-N 1 0 336.189 3.603 20 5 EHBDRO C[C@H]1C[N@@H+](Cc2ccc([N+](=O)[O-])cc2Br)CC[C@@H]1C ZINC001307590581 1130099450 /nfs/dbraw/zinc/09/94/50/1130099450.db2.gz WDZVJQAAZWTGDU-QWRGUYRKSA-N 1 0 327.222 3.835 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363632 1130219080 /nfs/dbraw/zinc/21/90/80/1130219080.db2.gz MYYMDQJYYMCLPG-PBHICJAKSA-N 1 0 331.416 3.922 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000245900140 1130328551 /nfs/dbraw/zinc/32/85/51/1130328551.db2.gz RYFVWQPMPRDWLG-XDNAFOTISA-N 1 0 330.428 3.983 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3c2cccc3C)cc1[N+](=O)[O-] ZINC000174447260 1130359588 /nfs/dbraw/zinc/35/95/88/1130359588.db2.gz IWUUFMZMESRMOS-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO COC(=O)C1CCC([NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000730107670 1130673398 /nfs/dbraw/zinc/67/33/98/1130673398.db2.gz SJBJTUSWWMTIGN-UHFFFAOYSA-N 1 0 334.416 3.540 20 5 EHBDRO CC1(C)CCc2cc(C[NH2+]Cc3ccccc3[N+](=O)[O-])ccc2O1 ZINC000731676539 1130831016 /nfs/dbraw/zinc/83/10/16/1130831016.db2.gz APSFFVJTWQHYCA-UHFFFAOYSA-N 1 0 326.396 3.988 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCc1ccc(Cl)cc1 ZINC000733313492 1131022336 /nfs/dbraw/zinc/02/23/36/1131022336.db2.gz UOOGGKAVNGYSME-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059334 1131462308 /nfs/dbraw/zinc/46/23/08/1131462308.db2.gz XKSQBTZGXBOLFE-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057455 1131462335 /nfs/dbraw/zinc/46/23/35/1131462335.db2.gz RJVNCKDXBOWOOH-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(N)c1 ZINC001172901025 1131883774 /nfs/dbraw/zinc/88/37/74/1131883774.db2.gz FPIHSXCJOGHPQF-UGSOOPFHSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ncccc1Cl)CC2 ZINC001172901370 1131883796 /nfs/dbraw/zinc/88/37/96/1131883796.db2.gz MLPBLDDETKZIMQ-CQSZACIVSA-N 1 0 331.803 3.680 20 5 EHBDRO Cc1cccc(OCC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172901206 1131883827 /nfs/dbraw/zinc/88/38/27/1131883827.db2.gz LBYPIKXGKPRYCB-GOSISDBHSA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1ccc(F)cc1F)CC2 ZINC001172901684 1131884882 /nfs/dbraw/zinc/88/48/82/1131884882.db2.gz JFAJYTNLUKPLDN-KRWDZBQOSA-N 1 0 346.377 3.953 20 5 EHBDRO COC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172903406 1131886765 /nfs/dbraw/zinc/88/67/65/1131886765.db2.gz QYEPVTNXSTVULY-ICSRJNTNSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1Cc3ccc(F)cc3C1)CC2 ZINC001172906751 1131887933 /nfs/dbraw/zinc/88/79/33/1131887933.db2.gz ORHMFRPDMVUNQN-MOPGFXCFSA-N 1 0 340.398 3.738 20 5 EHBDRO COC(C)(C)[C@H]1CCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916387 1131904289 /nfs/dbraw/zinc/90/42/89/1131904289.db2.gz RLUIHQJUOXOBOH-SJLPKXTDSA-N 1 0 332.444 3.732 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911614 1131917521 /nfs/dbraw/zinc/91/75/21/1131917521.db2.gz CZWUHGHGSLBFPT-GOSISDBHSA-N 1 0 325.412 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](c3ccncc3)C1)CC2 ZINC001172911309 1131917947 /nfs/dbraw/zinc/91/79/47/1131917947.db2.gz SECGJTKBRZQOTF-RTBURBONSA-N 1 0 337.423 3.727 20 5 EHBDRO [NH3+]Cc1cccc2c1cnn2[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913507 1131918781 /nfs/dbraw/zinc/91/87/81/1131918781.db2.gz WNOIIUVKJUEFGY-INIZCTEOSA-N 1 0 336.395 3.523 20 5 EHBDRO CC(C)([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1CC1 ZINC001173006411 1131934935 /nfs/dbraw/zinc/93/49/35/1131934935.db2.gz USTZTRNGIPZYLA-UHFFFAOYSA-N 1 0 339.386 3.620 20 5 EHBDRO CC[N@H+](C(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013715 1131935140 /nfs/dbraw/zinc/93/51/40/1131935140.db2.gz CZGZQBURXPWUQO-UHFFFAOYSA-N 1 0 327.375 3.572 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CCC(F)(F)CC2)c1F ZINC001173174658 1131990651 /nfs/dbraw/zinc/99/06/51/1131990651.db2.gz AESMKYCRFVTIJB-SNVBAGLBSA-N 1 0 346.349 3.841 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCCC(F)(F)F)c1F ZINC001173183213 1131993651 /nfs/dbraw/zinc/99/36/51/1131993651.db2.gz LNTRXVYPWDGNBL-SECBINFHSA-N 1 0 338.301 3.606 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1COc2cc(Cl)ccc21 ZINC001173218146 1132002122 /nfs/dbraw/zinc/00/21/22/1132002122.db2.gz BPYGMKORNOLFNJ-BDJLRTHQSA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC001173218611 1132003542 /nfs/dbraw/zinc/00/35/42/1132003542.db2.gz KYELPQIVWLGAMQ-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccc(F)cn1)C1CC1 ZINC001173226640 1132006754 /nfs/dbraw/zinc/00/67/54/1132006754.db2.gz YHCSFAMQBSRJMW-KPZWWZAWSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(Cc2ccccn2)CCC1 ZINC001173225599 1132006890 /nfs/dbraw/zinc/00/68/90/1132006890.db2.gz SPEIGYBEPTUSDG-OAHLLOKOSA-N 1 0 325.412 3.676 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](CCN(C)C)Cc1ccccc1 ZINC001173226173 1132006965 /nfs/dbraw/zinc/00/69/65/1132006965.db2.gz LDXOOCLNIHAOTD-QGZVFWFLSA-N 1 0 341.455 3.590 20 5 EHBDRO COc1cccc([C@H](C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173230012 1132007657 /nfs/dbraw/zinc/00/76/57/1132007657.db2.gz PWKWXFNXBFIDOH-CABCVRRESA-N 1 0 328.412 3.928 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1cccc(N(C)C)c1 ZINC001173229697 1132007932 /nfs/dbraw/zinc/00/79/32/1132007932.db2.gz PFKMCSZHRJHXSY-GJZGRUSLSA-N 1 0 327.428 3.943 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001173231069 1132009572 /nfs/dbraw/zinc/00/95/72/1132009572.db2.gz JGKGABKPWVFJSP-KXBFYZLASA-N 1 0 332.444 3.807 20 5 EHBDRO C[C@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000746076756 1132360464 /nfs/dbraw/zinc/36/04/64/1132360464.db2.gz PNMGMYFHMMPBDV-GRYCIOLGSA-N 1 0 340.807 3.553 20 5 EHBDRO COc1ccccc1OCC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000509394497 1132487248 /nfs/dbraw/zinc/48/72/48/1132487248.db2.gz XZWVTWRHAXYBKN-CLFYSBASSA-N 1 0 342.395 3.627 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC001168812314 1132567434 /nfs/dbraw/zinc/56/74/34/1132567434.db2.gz IVOSZAOUNZRYCQ-OAHLLOKOSA-N 1 0 328.412 3.930 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]C2(c3ccccc3C(F)(F)F)CC2)C1 ZINC001168977421 1132617343 /nfs/dbraw/zinc/61/73/43/1132617343.db2.gz JQGFSHUEVMVSAU-VXGBXAGGSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(Oc3ccc(Cl)cc3)CC2)C1 ZINC001169014414 1132632554 /nfs/dbraw/zinc/63/25/54/1132632554.db2.gz ZLICRSIWJAYVBF-DZGCQCFKSA-N 1 0 338.835 3.629 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1Br ZINC001168990034 1132635063 /nfs/dbraw/zinc/63/50/63/1132635063.db2.gz AXRBPRCFKVUTJJ-JBLDHEPKSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(c3noc4ccc(F)cc43)CC2)C1 ZINC001169038587 1132637879 /nfs/dbraw/zinc/63/78/79/1132637879.db2.gz ZTJHJHFURARBRN-SWLSCSKDSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041696 1132638672 /nfs/dbraw/zinc/63/86/72/1132638672.db2.gz CBNJSOPBCHCETQ-AEFFLSMTSA-N 1 0 334.485 3.830 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H]1CCc2ccccc2[C@H]1O ZINC001169619501 1132808200 /nfs/dbraw/zinc/80/82/00/1132808200.db2.gz ISTZFBUCEKRVAL-NHCUHLMSSA-N 1 0 325.476 3.743 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1 ZINC000773667095 1133062194 /nfs/dbraw/zinc/06/21/94/1133062194.db2.gz SKLPJNSNFMZVFV-UHFFFAOYSA-N 1 0 343.814 3.975 20 5 EHBDRO CO[C@H](C)C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001181458221 1133489389 /nfs/dbraw/zinc/48/93/89/1133489389.db2.gz WJQDWEBGFPYZEH-LLVKDONJSA-N 1 0 347.374 3.539 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001181880667 1133546172 /nfs/dbraw/zinc/54/61/72/1133546172.db2.gz YETXRPVHPOQYFK-WBMJQRKESA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](O)c1c(F)cccc1F)CCC2 ZINC000774249567 1133643375 /nfs/dbraw/zinc/64/33/75/1133643375.db2.gz BUIJDVPDHDRKSJ-IRXDYDNUSA-N 1 0 348.349 3.574 20 5 EHBDRO Cc1cccc(C)c1C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774258237 1133647626 /nfs/dbraw/zinc/64/76/26/1133647626.db2.gz QMVKODFQOIAQFZ-IAGOWNOFSA-N 1 0 328.416 3.682 20 5 EHBDRO Cc1ccc([C@@H]2C[C@H](C)[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126794 1133810413 /nfs/dbraw/zinc/81/04/13/1133810413.db2.gz UHWRNXWMLPYYCO-CVAIRZPRSA-N 1 0 340.423 3.815 20 5 EHBDRO CC1(C)C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C(C)(C)O1 ZINC001183981797 1133885708 /nfs/dbraw/zinc/88/57/08/1133885708.db2.gz RSNPWRUTCIYKJS-GFCCVEGCSA-N 1 0 326.824 3.932 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1cccc(C)c1 ZINC000786815934 1133910607 /nfs/dbraw/zinc/91/06/07/1133910607.db2.gz OTQMEARQUJESOZ-POUQMFDLSA-N 1 0 326.396 3.630 20 5 EHBDRO C[C@@H](C[C@H]1CCOC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786925047 1133929804 /nfs/dbraw/zinc/92/98/04/1133929804.db2.gz FVPSCFRHKJRKKO-WDEREUQCSA-N 1 0 332.322 3.518 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1CCCC[C@H]1C ZINC001184856779 1133999561 /nfs/dbraw/zinc/99/95/61/1133999561.db2.gz LQXLJTGQOXGAQO-MNOVXSKESA-N 1 0 346.353 3.683 20 5 EHBDRO Cc1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc(C)c1O ZINC000787425239 1134002287 /nfs/dbraw/zinc/00/22/87/1134002287.db2.gz UOOIYXSESPYZKL-UHFFFAOYSA-N 1 0 334.803 3.903 20 5 EHBDRO Cc1ccc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC001185252208 1134057589 /nfs/dbraw/zinc/05/75/89/1134057589.db2.gz CZWHYMIGCNYOFT-QGZVFWFLSA-N 1 0 331.460 3.996 20 5 EHBDRO CC[N@@H+]1CCCC[C@@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001185339678 1134074531 /nfs/dbraw/zinc/07/45/31/1134074531.db2.gz SQSSKCRABSEJSV-GFCCVEGCSA-N 1 0 331.338 3.900 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479729 1134130117 /nfs/dbraw/zinc/13/01/17/1134130117.db2.gz AAOQNCBNVAVBAF-WBVHZDCISA-N 1 0 349.450 3.820 20 5 EHBDRO CCN(CCC[NH+](CC)CC)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000788538225 1134138921 /nfs/dbraw/zinc/13/89/21/1134138921.db2.gz BSQMQTZNMBBRCP-NXVVXOECSA-N 1 0 347.459 3.579 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000788541923 1134139818 /nfs/dbraw/zinc/13/98/18/1134139818.db2.gz ZGKDXYIATDDOKQ-MYPZJPOHSA-N 1 0 340.423 3.956 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C12CCCC2 ZINC000788608986 1134145738 /nfs/dbraw/zinc/14/57/38/1134145738.db2.gz HMUQSLISTCORTG-AFAVFJNCSA-N 1 0 333.432 3.565 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H]2CSCCS2)c2cc([N+](=O)[O-])ccc21 ZINC000788584566 1134148138 /nfs/dbraw/zinc/14/81/38/1134148138.db2.gz KGSRLCOBPLUXDX-DOMZBBRYSA-N 1 0 338.498 3.755 20 5 EHBDRO C[C@H](NC[C@H]1CCC[N@@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804149 1134171021 /nfs/dbraw/zinc/17/10/21/1134171021.db2.gz VBTXNANVUQWXDV-WMLDXEAASA-N 1 0 346.475 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC[C@@H]2[C@H]2CCOC2)c1 ZINC000788984034 1134200563 /nfs/dbraw/zinc/20/05/63/1134200563.db2.gz MILATKUZXTVXES-XGWLTEMNSA-N 1 0 338.835 3.933 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)cc1 ZINC000775061518 1134273789 /nfs/dbraw/zinc/27/37/89/1134273789.db2.gz WQWWSMKJFDFJSZ-HNNXBMFYSA-N 1 0 341.367 3.801 20 5 EHBDRO C[NH+](C)[C@@H]1C[C@H](Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])C12CCC2 ZINC001187025875 1134284143 /nfs/dbraw/zinc/28/41/43/1134284143.db2.gz UFUHEDJEEXWDJU-QWHCGFSZSA-N 1 0 343.349 3.898 20 5 EHBDRO CN(CCCC[NH+]1CCCCC1)c1ccc([N+](=O)[O-])cc1Cl ZINC001187430361 1134338758 /nfs/dbraw/zinc/33/87/58/1134338758.db2.gz IUCGEESBVUHRCU-UHFFFAOYSA-N 1 0 325.840 3.951 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000792355345 1134680771 /nfs/dbraw/zinc/68/07/71/1134680771.db2.gz RIZRZAOKKHZSNG-UONOGXRCSA-N 1 0 346.349 3.539 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170294585 1134736670 /nfs/dbraw/zinc/73/66/70/1134736670.db2.gz BNCQYDXVDORTMH-LLVKDONJSA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170298374 1134738066 /nfs/dbraw/zinc/73/80/66/1134738066.db2.gz KKJIDWRBHKDBMQ-OAHLLOKOSA-N 1 0 328.412 3.675 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170321850 1134747375 /nfs/dbraw/zinc/74/73/75/1134747375.db2.gz CPKZKUAMMCAXIJ-OLZOCXBDSA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170329559 1134749485 /nfs/dbraw/zinc/74/94/85/1134749485.db2.gz RJAHVCMLLZLVEU-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CCC(OC3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001170334497 1134751354 /nfs/dbraw/zinc/75/13/54/1134751354.db2.gz FPQYDHKQZDHAFM-CQSZACIVSA-N 1 0 348.443 3.568 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CC2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170306700 1134752177 /nfs/dbraw/zinc/75/21/77/1134752177.db2.gz AFOGWRGOGNFNRJ-LBPRGKRZSA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170335115 1134752385 /nfs/dbraw/zinc/75/23/85/1134752385.db2.gz KVWXKVKYILGQGQ-FPMFFAJLSA-N 1 0 340.370 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170306571 1134752465 /nfs/dbraw/zinc/75/24/65/1134752465.db2.gz XRQKWBSCTSNVDU-KDOFPFPSSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170336495 1134752654 /nfs/dbraw/zinc/75/26/54/1134752654.db2.gz XVYRRFBXXGNDET-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3cc(F)ccc3C2)c([N+](=O)[O-])c1 ZINC001170352309 1134753960 /nfs/dbraw/zinc/75/39/60/1134753960.db2.gz LTNWDSCRFBZQNA-ZDUSSCGKSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344939 1134758769 /nfs/dbraw/zinc/75/87/69/1134758769.db2.gz FSOCCLMTBDCXFX-AAEUAGOBSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345843 1134759587 /nfs/dbraw/zinc/75/95/87/1134759587.db2.gz MXANIWHQPWSNIJ-KSSFIOAISA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170347631 1134759797 /nfs/dbraw/zinc/75/97/97/1134759797.db2.gz SOEYYEWWNAGYMY-OAHLLOKOSA-N 1 0 344.411 3.545 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2ccc3c([N+](=O)[O-])c[nH]c3n2)CC1(C)C ZINC001170453595 1135098127 /nfs/dbraw/zinc/09/81/27/1135098127.db2.gz PCSKYIAZAVXYAP-UHFFFAOYSA-N 1 0 331.420 3.534 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCC[C@H](C)C2)c1 ZINC000747207771 1135164419 /nfs/dbraw/zinc/16/44/19/1135164419.db2.gz NTSRSLJIJMDENS-ZDUSSCGKSA-N 1 0 339.411 3.667 20 5 EHBDRO C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287110 1135407238 /nfs/dbraw/zinc/40/72/38/1135407238.db2.gz APXAMQVWRIXMFT-HOCLYGCPSA-N 1 0 348.443 3.580 20 5 EHBDRO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC001170571898 1135788310 /nfs/dbraw/zinc/78/83/10/1135788310.db2.gz JWAJGJDYQMXHQU-OAHLLOKOSA-N 1 0 341.411 3.671 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870915 1135833455 /nfs/dbraw/zinc/83/34/55/1135833455.db2.gz OWKKFTWLKSKOBC-GDBMZVCRSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H](Cc1ccccc1Cl)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809732343 1135873756 /nfs/dbraw/zinc/87/37/56/1135873756.db2.gz BZQCJFGINLBMGJ-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO CC(C)[C@@H](C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776274501 1136129466 /nfs/dbraw/zinc/12/94/66/1136129466.db2.gz DMQNEWCOWRLMOS-MOPGFXCFSA-N 1 0 328.412 3.658 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411566 1136252723 /nfs/dbraw/zinc/25/27/23/1136252723.db2.gz FPXNOEVYJQMOJB-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC000850426982 1136256802 /nfs/dbraw/zinc/25/68/02/1136256802.db2.gz JHUHGMUYAYWTPT-STQMWFEESA-N 1 0 330.384 3.508 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851552 1136261340 /nfs/dbraw/zinc/26/13/40/1136261340.db2.gz SMMDYKIBYGWRCN-UGSOOPFHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccsc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000852310940 1136447223 /nfs/dbraw/zinc/44/72/23/1136447223.db2.gz BNWJBOBNIGQLQI-MRXNPFEDSA-N 1 0 334.441 3.990 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587822 1136447246 /nfs/dbraw/zinc/44/72/46/1136447246.db2.gz OVMJBAXDFKHCDC-IFXJQAMLSA-N 1 0 326.396 3.854 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccccc2F)CC2CC2)c1 ZINC000852563281 1136466603 /nfs/dbraw/zinc/46/66/03/1136466603.db2.gz BEEPYDBKLBOSJR-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccn2)cc1 ZINC000852567113 1136467353 /nfs/dbraw/zinc/46/73/53/1136467353.db2.gz MPJZVHPROPNRIO-LPHOPBHVSA-N 1 0 325.412 3.533 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852781095 1136485923 /nfs/dbraw/zinc/48/59/23/1136485923.db2.gz COZHTBMETQHFLX-LBPRGKRZSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000853362801 1136528505 /nfs/dbraw/zinc/52/85/05/1136528505.db2.gz YWTNZSWWGIOLCX-AWEZNQCLSA-N 1 0 339.386 3.987 20 5 EHBDRO C[NH+]1CCC([C@@H]2CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])C2)CC1 ZINC000853457766 1136533879 /nfs/dbraw/zinc/53/38/79/1136533879.db2.gz LZEKRUVEASBPJG-CQSZACIVSA-N 1 0 339.386 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H](CO)C2CCCCC2)c1 ZINC000815151296 1136557293 /nfs/dbraw/zinc/55/72/93/1136557293.db2.gz WQVVNSLHOYKRIF-CQSZACIVSA-N 1 0 326.824 3.527 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000815577293 1136613258 /nfs/dbraw/zinc/61/32/58/1136613258.db2.gz MAVAFKMOAPDNSM-RDTXWAMCSA-N 1 0 342.443 3.964 20 5 EHBDRO Cc1ccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815583516 1136614135 /nfs/dbraw/zinc/61/41/35/1136614135.db2.gz HWEAKEUAUDPGPF-KGLIPLIRSA-N 1 0 329.400 3.604 20 5 EHBDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591952 1136616035 /nfs/dbraw/zinc/61/60/35/1136616035.db2.gz VGTRAOUEDWLBCM-BLLLJJGKSA-N 1 0 327.384 3.578 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@@H]1C ZINC000815595999 1136616417 /nfs/dbraw/zinc/61/64/17/1136616417.db2.gz HWBZHHOMXHHHDF-NSAWSLCGSA-N 1 0 341.411 3.781 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000218478076 1136819115 /nfs/dbraw/zinc/81/91/15/1136819115.db2.gz RBZUSPGXTIJVAZ-IVMMDQJWSA-N 1 0 333.432 3.646 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857080574 1136842788 /nfs/dbraw/zinc/84/27/88/1136842788.db2.gz IHIZPOOUYKEXPR-UWVGGRQHSA-N 1 0 333.215 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CCCCCc2ccccc2)c1 ZINC000819011078 1136900506 /nfs/dbraw/zinc/90/05/06/1136900506.db2.gz LEJRNZGQTAQJET-LJQANCHMSA-N 1 0 328.412 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(Sc3ccccc3)CC2)c1 ZINC000819047778 1136901914 /nfs/dbraw/zinc/90/19/14/1136901914.db2.gz ZXCFHPQTCJONDC-KRWDZBQOSA-N 1 0 344.436 3.543 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819196334 1136922144 /nfs/dbraw/zinc/92/21/44/1136922144.db2.gz AARYUUGPHAEKEB-ZNOIYHFQSA-N 1 0 326.396 3.541 20 5 EHBDRO CC(F)(F)c1ccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819331048 1136931781 /nfs/dbraw/zinc/93/17/81/1136931781.db2.gz IQIFUJXHBZRJAC-INIZCTEOSA-N 1 0 336.338 3.530 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040796 1136934402 /nfs/dbraw/zinc/93/44/02/1136934402.db2.gz QGEJQCXSUFLQPN-NVXWUHKLSA-N 1 0 341.411 3.821 20 5 EHBDRO CC[N@@H+](c1ccc(NC[C@H](O)c2cccc([N+](=O)[O-])c2)cc1)C(C)C ZINC000819398572 1136935957 /nfs/dbraw/zinc/93/59/57/1136935957.db2.gz OGANWGQVKRCZPG-IBGZPJMESA-N 1 0 343.427 3.975 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000819922837 1136966524 /nfs/dbraw/zinc/96/65/24/1136966524.db2.gz MNFLSZODOXNIOC-CYBMUJFWSA-N 1 0 344.390 3.766 20 5 EHBDRO C[C@@H]([NH2+]CCC1CN(C(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000859236442 1137009182 /nfs/dbraw/zinc/00/91/82/1137009182.db2.gz FOCSAYOKQGYWDM-CYBMUJFWSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc(C2C[C@H]3CCC[C@@H](C2)C3[NH3+])n1 ZINC000822807991 1137075301 /nfs/dbraw/zinc/07/53/01/1137075301.db2.gz MZQVARTWDHFOIU-ZAQWFSBCSA-N 1 0 342.399 3.574 20 5 EHBDRO O=C(O[C@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738641 1137075874 /nfs/dbraw/zinc/07/58/74/1137075874.db2.gz CGGKGMVJLWTJDV-HOCLYGCPSA-N 1 0 340.379 3.532 20 5 EHBDRO Cc1cc(-c2noc(C3C[C@H]4CCC[C@@H](C3)C4[NH3+])n2)cc([N+](=O)[O-])c1 ZINC000823269543 1137092433 /nfs/dbraw/zinc/09/24/33/1137092433.db2.gz IGZUAPXLARUWNO-FFMGESDNSA-N 1 0 342.399 3.574 20 5 EHBDRO CSC[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339025018 1137099002 /nfs/dbraw/zinc/09/90/02/1137099002.db2.gz YZSJCXOPLOYQKO-LBPRGKRZSA-N 1 0 334.363 3.941 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483470 1137146652 /nfs/dbraw/zinc/14/66/52/1137146652.db2.gz UPRYHHFOWAQTDM-QKWWCAPFSA-N 1 0 338.407 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c1 ZINC000824696056 1137148707 /nfs/dbraw/zinc/14/87/07/1137148707.db2.gz GWWMZPCYPOIPOE-OIISXLGYSA-N 1 0 338.835 3.764 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000824764598 1137150810 /nfs/dbraw/zinc/15/08/10/1137150810.db2.gz CAAMCWUASWSEFR-ZDUSSCGKSA-N 1 0 333.215 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@]3(CCSC3)C2)c1 ZINC000825214889 1137169021 /nfs/dbraw/zinc/16/90/21/1137169021.db2.gz ABTKUSHICKWATE-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000844255942 1137208231 /nfs/dbraw/zinc/20/82/31/1137208231.db2.gz RESOZOCLSASLNR-AWEZNQCLSA-N 1 0 339.395 3.543 20 5 EHBDRO COc1cccc(-n2cc(C[C@H](C)[NH3+])c3ccc(C)cc32)c1[N+](=O)[O-] ZINC001171169684 1137280392 /nfs/dbraw/zinc/28/03/92/1137280392.db2.gz QYBGLOPSIHKNTP-ZDUSSCGKSA-N 1 0 339.395 3.745 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(c2ccc(C(C)=O)cc2[N+](=O)[O-])CC1 ZINC000866022648 1137325040 /nfs/dbraw/zinc/32/50/40/1137325040.db2.gz BFENYKAHZCOGPS-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@](C)(O)c1ccccc1 ZINC000846038373 1137328893 /nfs/dbraw/zinc/32/88/93/1137328893.db2.gz PUCOYSKBFSRVIC-JXXFODFXSA-N 1 0 342.439 3.802 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@](C)(O)c1ccccc1 ZINC000846038777 1137328930 /nfs/dbraw/zinc/32/89/30/1137328930.db2.gz QEZUOPLPEDQWPQ-YVEFUNNKSA-N 1 0 334.803 3.634 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339074436 1137346452 /nfs/dbraw/zinc/34/64/52/1137346452.db2.gz LHMHEYGRKJCKHR-VQIMIIECSA-N 1 0 340.423 3.895 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000866510050 1137359984 /nfs/dbraw/zinc/35/99/84/1137359984.db2.gz IQYOFOHDUPQQBX-URKNILKWSA-N 1 0 348.443 3.849 20 5 EHBDRO C[C@@H]([NH2+]CCSCCC(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866542253 1137363408 /nfs/dbraw/zinc/36/34/08/1137363408.db2.gz GVFJOICJGZUAMB-SECBINFHSA-N 1 0 337.367 3.513 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023197 1137565383 /nfs/dbraw/zinc/56/53/83/1137565383.db2.gz CZRCRVJCVPEKQF-UONOGXRCSA-N 1 0 337.489 3.699 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1ccncc1 ZINC000872041698 1137567196 /nfs/dbraw/zinc/56/71/96/1137567196.db2.gz KEZSFFSMZBWTDY-CHWSQXEVSA-N 1 0 331.441 3.994 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cnc(C)s1 ZINC000872050885 1137567922 /nfs/dbraw/zinc/56/79/22/1137567922.db2.gz DIQHSWFMJXOSBM-JTQLQIEISA-N 1 0 337.470 3.975 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)C[C@H](C)O ZINC000872050226 1137567961 /nfs/dbraw/zinc/56/79/61/1137567961.db2.gz XMUJDNJEAXBTDP-RYUDHWBXSA-N 1 0 326.462 3.764 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064419 1137569208 /nfs/dbraw/zinc/56/92/08/1137569208.db2.gz GNWYGNZHBOYHNH-OLZOCXBDSA-N 1 0 334.395 3.558 20 5 EHBDRO C[C@@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086664 1137570659 /nfs/dbraw/zinc/57/06/59/1137570659.db2.gz BNHWWAMYWLCMDV-HIFRSBDPSA-N 1 0 335.423 3.507 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000872132549 1137573215 /nfs/dbraw/zinc/57/32/15/1137573215.db2.gz IPLUKQGJPCMHKG-HNJNHCNJSA-N 1 0 332.375 3.897 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872262104 1137576812 /nfs/dbraw/zinc/57/68/12/1137576812.db2.gz PNIOXVMNJKSEOZ-MRXNPFEDSA-N 1 0 334.416 3.527 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](C[C@@H](C)O)c1ccccc1 ZINC000873079574 1137589546 /nfs/dbraw/zinc/58/95/46/1137589546.db2.gz VZDUDXXYZPPKPF-QAPCUYQASA-N 1 0 342.439 3.856 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)C[C@@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000873096945 1137590092 /nfs/dbraw/zinc/59/00/92/1137590092.db2.gz BLURANRJZWIGRV-KZULUSFZSA-N 1 0 332.375 3.644 20 5 EHBDRO CC(C)(C)c1ccc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876987587 1137667081 /nfs/dbraw/zinc/66/70/81/1137667081.db2.gz BRDRBIAQEJWZNO-UHFFFAOYSA-N 1 0 328.416 3.582 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000877541896 1137680424 /nfs/dbraw/zinc/68/04/24/1137680424.db2.gz JGURWMNOPAXJTD-AWEZNQCLSA-N 1 0 334.807 3.509 20 5 EHBDRO CC(C)CC[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877976069 1137697903 /nfs/dbraw/zinc/69/79/03/1137697903.db2.gz SBEXAOLHXSBEKY-UHFFFAOYSA-N 1 0 338.795 3.776 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020299 1137699787 /nfs/dbraw/zinc/69/97/87/1137699787.db2.gz NDCPKSFNIAWJOI-CYBMUJFWSA-N 1 0 330.388 3.655 20 5 EHBDRO CCC[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)C ZINC000878843943 1137729809 /nfs/dbraw/zinc/72/98/09/1137729809.db2.gz NJGJERVIKKBUKV-UHFFFAOYSA-N 1 0 338.795 3.919 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000880075642 1137767417 /nfs/dbraw/zinc/76/74/17/1137767417.db2.gz DSIIPYNTHOUHII-LBPRGKRZSA-N 1 0 332.404 3.759 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(C)(C)CC(F)F ZINC000883258981 1137851043 /nfs/dbraw/zinc/85/10/43/1137851043.db2.gz XJIUSWZFMHLURD-NSHDSACASA-N 1 0 343.374 3.583 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)F ZINC000883259589 1137851078 /nfs/dbraw/zinc/85/10/78/1137851078.db2.gz RHDHQCBQOPYYMK-VXGBXAGGSA-N 1 0 330.379 3.546 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)cc1[N+](=O)[O-] ZINC000883356837 1137857208 /nfs/dbraw/zinc/85/72/08/1137857208.db2.gz XCDLCXAKZQTJGS-HIFRSBDPSA-N 1 0 334.416 3.746 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C1CCC2(COC2)CC1 ZINC000883379561 1137858220 /nfs/dbraw/zinc/85/82/20/1137858220.db2.gz FXJCJBFEXLYRAV-YJBOKZPZSA-N 1 0 344.455 3.855 20 5 EHBDRO CC(C)c1csc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000331573832 1137913094 /nfs/dbraw/zinc/91/30/94/1137913094.db2.gz IXJZROJOVMQUDJ-JSGCOSHPSA-N 1 0 349.460 3.645 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034163 1137929391 /nfs/dbraw/zinc/92/93/91/1137929391.db2.gz ZVOFYHWMPOOBNR-WTWWFLFCSA-N 1 0 332.444 3.917 20 5 EHBDRO COCC1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000119299782 1137940175 /nfs/dbraw/zinc/94/01/75/1137940175.db2.gz CUBVQENWIVATIZ-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCOC1 ZINC000119740462 1137944224 /nfs/dbraw/zinc/94/42/24/1137944224.db2.gz RSLBQMHZIVOLNM-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCOC1 ZINC000119753468 1137944328 /nfs/dbraw/zinc/94/43/28/1137944328.db2.gz GFEYTGFMVBCBDA-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO CCC(=O)c1ccc(N2CCC(CC)([NH+]3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000884717978 1137970943 /nfs/dbraw/zinc/97/09/43/1137970943.db2.gz ROXBEQNELCLNCD-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO CO[C@@H]1CCC[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000886119138 1138048688 /nfs/dbraw/zinc/04/86/88/1138048688.db2.gz YTXNUZGTDFJLFD-GDBMZVCRSA-N 1 0 331.416 3.556 20 5 EHBDRO C[C@@]1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886344756 1138069591 /nfs/dbraw/zinc/06/95/91/1138069591.db2.gz KXQANSUCGAFSQQ-WEBJUUICSA-N 1 0 330.428 3.937 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1cc(C2CC2)no1 ZINC000886684277 1138114617 /nfs/dbraw/zinc/11/46/17/1138114617.db2.gz IUXZWCPFLNOGOW-RHSMWYFYSA-N 1 0 341.411 3.961 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cc(C2CC2)no1 ZINC000886684276 1138114793 /nfs/dbraw/zinc/11/47/93/1138114793.db2.gz IUXZWCPFLNOGOW-PBHICJAKSA-N 1 0 341.411 3.961 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000886714486 1138123757 /nfs/dbraw/zinc/12/37/57/1138123757.db2.gz LXHOGRHYHUVKSF-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@]1(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886776480 1138138750 /nfs/dbraw/zinc/13/87/50/1138138750.db2.gz HRXCAVJSRVSVPK-WMZOPIPTSA-N 1 0 330.428 3.911 20 5 EHBDRO CC[C@@H](CSC)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091097771 1138216055 /nfs/dbraw/zinc/21/60/55/1138216055.db2.gz JIJYNMQIDYHUPF-AWEZNQCLSA-N 1 0 335.429 3.823 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123245843 1138268169 /nfs/dbraw/zinc/26/81/69/1138268169.db2.gz GKIOWLYRMGFCMK-ZDUSSCGKSA-N 1 0 330.432 3.748 20 5 EHBDRO CC(C)Oc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000125516637 1138311069 /nfs/dbraw/zinc/31/10/69/1138311069.db2.gz IQKPIYYNIPLXTH-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000263737562 1138353242 /nfs/dbraw/zinc/35/32/42/1138353242.db2.gz ZRMSYGNZRVQAOK-QGZVFWFLSA-N 1 0 328.368 3.702 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000129721768 1138419336 /nfs/dbraw/zinc/41/93/36/1138419336.db2.gz KVVBBJBNAKBJKK-NEPJUHHUSA-N 1 0 332.322 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@H]1OC(F)F)CCC2 ZINC000337551466 1138603010 /nfs/dbraw/zinc/60/30/10/1138603010.db2.gz ORVNUGWTISKETG-RBSFLKMASA-N 1 0 326.343 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)CC2)c2ccncc21 ZINC000150879580 1138989467 /nfs/dbraw/zinc/98/94/67/1138989467.db2.gz KXCKIQILCYTNEC-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000178205820 1139679077 /nfs/dbraw/zinc/67/90/77/1139679077.db2.gz LFYMIPKFVTTWKQ-NSHDSACASA-N 1 0 333.413 3.562 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000178643643 1139709336 /nfs/dbraw/zinc/70/93/36/1139709336.db2.gz MTXMXMSZELCOFC-LLVKDONJSA-N 1 0 348.786 3.870 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000178686180 1139711878 /nfs/dbraw/zinc/71/18/78/1139711878.db2.gz ABTVUTXBCLRPPT-XCMOZONUSA-N 1 0 332.425 3.744 20 5 EHBDRO COCCc1nc(C)c([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000181392452 1139903563 /nfs/dbraw/zinc/90/35/63/1139903563.db2.gz IYPCUJFIDMAOEI-NWDGAFQWSA-N 1 0 349.456 3.960 20 5 EHBDRO Cc1cnn(CCCCC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181818946 1139933649 /nfs/dbraw/zinc/93/36/49/1139933649.db2.gz IKDOJHGUNXMGAP-INIZCTEOSA-N 1 0 330.432 3.929 20 5 EHBDRO CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736942 1139989246 /nfs/dbraw/zinc/98/92/46/1139989246.db2.gz ZFPVKUUNPBDOFW-HOTGVXAUSA-N 1 0 347.459 3.593 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@H]1CCCCO1)C1CC1 ZINC000183998854 1140072936 /nfs/dbraw/zinc/07/29/36/1140072936.db2.gz ZQJMVYYHFJEWMM-MSOLQXFVSA-N 1 0 332.444 3.855 20 5 EHBDRO Cc1c(CN[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722980 1140166208 /nfs/dbraw/zinc/16/62/08/1140166208.db2.gz DVMCVPBQPOBQTI-RDJZCZTQSA-N 1 0 331.460 3.646 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000268872557 1141014699 /nfs/dbraw/zinc/01/46/99/1141014699.db2.gz GMEOEYBRQKQORE-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000270621363 1141247148 /nfs/dbraw/zinc/24/71/48/1141247148.db2.gz FRGWDYVMUSYYKQ-YOEHRIQHSA-N 1 0 336.432 3.677 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000270649531 1141250270 /nfs/dbraw/zinc/25/02/70/1141250270.db2.gz LRAQIMPFZIQLSA-HIFRSBDPSA-N 1 0 326.824 3.932 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cnn(C)c1C ZINC000271142851 1141313302 /nfs/dbraw/zinc/31/33/02/1141313302.db2.gz OTXOZOPXXPHJPB-JSGCOSHPSA-N 1 0 348.472 3.858 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(CC)CCOCC2)cc1[N+](=O)[O-] ZINC000271195491 1141322023 /nfs/dbraw/zinc/32/20/23/1141322023.db2.gz YIMCZJCSLYWTRG-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000271225745 1141328895 /nfs/dbraw/zinc/32/88/95/1141328895.db2.gz AMLZDCNJGAVITK-NVXWUHKLSA-N 1 0 330.384 3.584 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)Cc1cc(C)n[nH]1 ZINC000271482969 1141378258 /nfs/dbraw/zinc/37/82/58/1141378258.db2.gz JFHSMLHENLXTFT-OCCSQVGLSA-N 1 0 348.472 3.718 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000271565771 1141398291 /nfs/dbraw/zinc/39/82/91/1141398291.db2.gz XQTXKYVTAMGYOC-UKRRQHHQSA-N 1 0 336.457 3.690 20 5 EHBDRO C[C@@H](CO)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CCC1 ZINC000339144510 1141509604 /nfs/dbraw/zinc/50/96/04/1141509604.db2.gz HFIFWBONYLYJSG-NSHDSACASA-N 1 0 346.349 3.597 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1ccccc1 ZINC000348666658 1141564001 /nfs/dbraw/zinc/56/40/01/1141564001.db2.gz BNRHRCHISGURJL-UHFFFAOYSA-N 1 0 336.395 3.659 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccnc(OC)c2)cc1[N+](=O)[O-] ZINC000348677039 1141565861 /nfs/dbraw/zinc/56/58/61/1141565861.db2.gz DXPHLDMAWUZCQV-QWHCGFSZSA-N 1 0 345.399 3.809 20 5 EHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cn2ccccc2n1 ZINC000568304508 370704792 /nfs/dbraw/zinc/70/47/92/370704792.db2.gz RXGYUNJTMCFDQT-OAHLLOKOSA-N 1 0 338.411 3.916 20 5 EHBDRO Cc1cc(NC(=O)CSc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000183263227 1125484277 /nfs/dbraw/zinc/48/42/77/1125484277.db2.gz RQQUKSAMMIUBGX-UHFFFAOYSA-N 1 0 337.788 3.682 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449061042 1032104746 /nfs/dbraw/zinc/10/47/46/1032104746.db2.gz HISJTNMNDPEJCA-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1OC ZINC000430218739 1015074150 /nfs/dbraw/zinc/07/41/50/1015074150.db2.gz KXHVCLKCXYLBML-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223788 1015099391 /nfs/dbraw/zinc/09/93/91/1015099391.db2.gz VTTHHIFAUUVUNQ-CQSZACIVSA-N 1 0 342.395 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000127056348 1015209888 /nfs/dbraw/zinc/20/98/88/1015209888.db2.gz YYBMOSIRVNHLHH-UHFFFAOYSA-N 1 0 340.379 3.531 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000120480652 1015267945 /nfs/dbraw/zinc/26/79/45/1015267945.db2.gz YPXZMERCPGVOHX-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(C2CC2)c1 ZINC000340250457 1016786959 /nfs/dbraw/zinc/78/69/59/1016786959.db2.gz GOUJQAUHFKBCRH-ZDUSSCGKSA-N 1 0 339.395 3.762 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCc1ccccn1)C1CC1 ZINC000181487846 1016846894 /nfs/dbraw/zinc/84/68/94/1016846894.db2.gz NWSPXLMYFLCHGM-GOSISDBHSA-N 1 0 325.412 3.533 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)c1cccnc1 ZINC000414554369 1016971900 /nfs/dbraw/zinc/97/19/00/1016971900.db2.gz GZGALAKNIOGOJA-XNTDXEJSSA-N 1 0 325.412 3.961 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@@H](CO)C2)s1 ZINC000414565014 1016973859 /nfs/dbraw/zinc/97/38/59/1016973859.db2.gz DPRUIMIXJSCWLJ-ZIAGYGMSSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1cccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c1 ZINC000414560572 1016974955 /nfs/dbraw/zinc/97/49/55/1016974955.db2.gz WXAAICFUECLMRL-YOEHRIQHSA-N 1 0 330.359 3.636 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1OC(F)F ZINC000449068960 1032155585 /nfs/dbraw/zinc/15/55/85/1032155585.db2.gz DEWDERLDPVDZQU-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1cccc2cccnc21 ZINC000449075841 1032164147 /nfs/dbraw/zinc/16/41/47/1032164147.db2.gz SEMBOUDMQWNKRX-HNNXBMFYSA-N 1 0 335.407 3.906 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000538160756 1032181528 /nfs/dbraw/zinc/18/15/28/1032181528.db2.gz POQNLLVTQWPWCN-INIZCTEOSA-N 1 0 341.411 3.891 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000449090059 1032193592 /nfs/dbraw/zinc/19/35/92/1032193592.db2.gz MELZVDNOQITTKB-CQSZACIVSA-N 1 0 342.395 3.997 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000449094277 1032201669 /nfs/dbraw/zinc/20/16/69/1032201669.db2.gz YTIIOEPWTHGLDB-AUUYWEPGSA-N 1 0 345.418 3.557 20 5 EHBDRO Cc1csc(CCCC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC000449116027 1032207798 /nfs/dbraw/zinc/20/77/98/1032207798.db2.gz JTGFAJNPYIVFCP-CYBMUJFWSA-N 1 0 333.457 3.903 20 5 EHBDRO CCN(C(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000538277867 1032265794 /nfs/dbraw/zinc/26/57/94/1032265794.db2.gz YREQWRBILUFUKL-OAHLLOKOSA-N 1 0 347.459 3.735 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449188184 1032284059 /nfs/dbraw/zinc/28/40/59/1032284059.db2.gz NOXGTUICMSMXSI-CXAGYDPISA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609978 1032325964 /nfs/dbraw/zinc/32/59/64/1032325964.db2.gz KAEMWYLJRDKTIT-PXAZEXFGSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000449201840 1032326821 /nfs/dbraw/zinc/32/68/21/1032326821.db2.gz HOGPUSUSTRTBSV-BPAFIMBUSA-N 1 0 339.439 3.561 20 5 EHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615510 1032352344 /nfs/dbraw/zinc/35/23/44/1032352344.db2.gz PEABAZIOVPVEOP-PXAZEXFGSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CSCCc3ccccc32)cc1 ZINC000536866879 1032366720 /nfs/dbraw/zinc/36/67/20/1032366720.db2.gz APFSCUNQGSWZDP-SFHVURJKSA-N 1 0 344.436 3.594 20 5 EHBDRO COC1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000459666764 1032394713 /nfs/dbraw/zinc/39/47/13/1032394713.db2.gz AALFPCUNRRDKPA-UHFFFAOYSA-N 1 0 330.384 3.902 20 5 EHBDRO CCO[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449287714 1032405099 /nfs/dbraw/zinc/40/50/99/1032405099.db2.gz LCOHCPGAIHTMTO-KXBFYZLASA-N 1 0 328.412 3.893 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000449308263 1032427200 /nfs/dbraw/zinc/42/72/00/1032427200.db2.gz VVAOZKGQVVEDMO-NJZAAPMLSA-N 1 0 328.359 3.666 20 5 EHBDRO Cc1ccc(CN(CC[NH+](C)C)Cc2ccsc2)cc1[N+](=O)[O-] ZINC000459742339 1032457661 /nfs/dbraw/zinc/45/76/61/1032457661.db2.gz KXRUMHHLKHAQII-UHFFFAOYSA-N 1 0 333.457 3.529 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC1 ZINC000459807928 1032484362 /nfs/dbraw/zinc/48/43/62/1032484362.db2.gz RPQVSKZHRHIDIE-OAHLLOKOSA-N 1 0 330.388 3.703 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000459813960 1032485744 /nfs/dbraw/zinc/48/57/44/1032485744.db2.gz WYFYLFBUHHASED-CQSZACIVSA-N 1 0 339.823 3.745 20 5 EHBDRO CC[C@H](C)[C@@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449403235 1032525587 /nfs/dbraw/zinc/52/55/87/1032525587.db2.gz VLMVMGRRFQDXCF-BLLLJJGKSA-N 1 0 349.456 3.869 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000449432963 1032549752 /nfs/dbraw/zinc/54/97/52/1032549752.db2.gz KEGVHMDELQWCKD-KYJSFNMBSA-N 1 0 342.443 3.834 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000537294350 1032602942 /nfs/dbraw/zinc/60/29/42/1032602942.db2.gz BYGGQXXMFWMQOL-VOCYLRNQSA-N 1 0 343.427 3.874 20 5 EHBDRO Cc1nn(C[N@@H+]2CCC[C@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066796074 1018174728 /nfs/dbraw/zinc/17/47/28/1018174728.db2.gz FTCDEIKYYZJRFQ-KRWDZBQOSA-N 1 0 328.416 3.635 20 5 EHBDRO C[C@]1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO[C@@H]1C1CC1 ZINC000468046421 1018192910 /nfs/dbraw/zinc/19/29/10/1018192910.db2.gz CJZGNJDQRPLJFQ-DFQSSKMNSA-N 1 0 344.455 3.711 20 5 EHBDRO C[C@@H](Cn1cccn1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517538019 1018294305 /nfs/dbraw/zinc/29/43/05/1018294305.db2.gz DDCDWWCHSWLPJB-ZDUSSCGKSA-N 1 0 342.424 3.698 20 5 EHBDRO Cc1nccc([C@H]2CCC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368002 1018535883 /nfs/dbraw/zinc/53/58/83/1018535883.db2.gz AQKGNPWQJAHLQC-HIFRSBDPSA-N 1 0 326.400 3.634 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000560814815 1018589085 /nfs/dbraw/zinc/58/90/85/1018589085.db2.gz CCWXVMTVKTZRDL-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO COc1cccc([N+](=O)[O-])c1NC[C@H](c1cccs1)[NH+]1CCCC1 ZINC000580242726 1018845866 /nfs/dbraw/zinc/84/58/66/1018845866.db2.gz OFDIAYQIXQXMHN-CQSZACIVSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@@H]([NH2+]CCc1cn[nH]c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000576389889 1018918905 /nfs/dbraw/zinc/91/89/05/1018918905.db2.gz HMXMNJQNHJIKEU-GFCCVEGCSA-N 1 0 342.424 3.940 20 5 EHBDRO COc1ccc(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000610410633 1018932763 /nfs/dbraw/zinc/93/27/63/1018932763.db2.gz RDSBFUBNSSDQDZ-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000513138932 1019082112 /nfs/dbraw/zinc/08/21/12/1019082112.db2.gz LDXNARWXKAHGRD-CQSZACIVSA-N 1 0 345.468 3.849 20 5 EHBDRO Cc1cc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000610430988 1019084709 /nfs/dbraw/zinc/08/47/09/1019084709.db2.gz VDDVJXJIOBELDD-QGZVFWFLSA-N 1 0 340.427 3.937 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433425 1019090893 /nfs/dbraw/zinc/09/08/93/1019090893.db2.gz JJJRSIYDRNRWIZ-AEFFLSMTSA-N 1 0 339.439 3.862 20 5 EHBDRO CC[C@H](CSC)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000576571701 1019275210 /nfs/dbraw/zinc/27/52/10/1019275210.db2.gz XBHOVMKLOAHZEK-CQSZACIVSA-N 1 0 326.462 3.955 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556404 1032821252 /nfs/dbraw/zinc/82/12/52/1032821252.db2.gz NVGITNDEMYXRMG-GDBMZVCRSA-N 1 0 343.402 3.914 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000024252957 1032825840 /nfs/dbraw/zinc/82/58/40/1032825840.db2.gz ZXRCCZZGFLADMJ-CQSZACIVSA-N 1 0 347.802 3.928 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](Oc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001225505381 1019454076 /nfs/dbraw/zinc/45/40/76/1019454076.db2.gz KSYIMZUPVAVYDS-LBPRGKRZSA-N 1 0 343.221 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2[C@H]3Cc4ccccc4[C@@H]23)c1 ZINC000580676925 1019830200 /nfs/dbraw/zinc/83/02/00/1019830200.db2.gz FWWBKDXYKUMXIE-USXIJHARSA-N 1 0 346.333 3.624 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](C)O ZINC000513668450 1019919637 /nfs/dbraw/zinc/91/96/37/1019919637.db2.gz YUJNXLDWFCVOPX-ZDUSSCGKSA-N 1 0 334.441 3.915 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1N1CCC(CCCn2ccnc2)CC1 ZINC000340794783 1020005432 /nfs/dbraw/zinc/00/54/32/1020005432.db2.gz IZYDPIQGXIAIOP-UHFFFAOYSA-N 1 0 349.822 3.537 20 5 EHBDRO Cc1ncc([C@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000602439161 1032890056 /nfs/dbraw/zinc/89/00/56/1032890056.db2.gz IGXXBXGPQQPUGD-AWEZNQCLSA-N 1 0 328.416 3.973 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000610476501 1020415140 /nfs/dbraw/zinc/41/51/40/1020415140.db2.gz WIKVCDAYICLDAS-UAGQMJEPSA-N 1 0 336.407 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CC3CC3)CC3CCC3)o2)cc1 ZINC000280750141 1020633201 /nfs/dbraw/zinc/63/32/01/1020633201.db2.gz NGNUEOZCBPDBSD-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090770662 1020915538 /nfs/dbraw/zinc/91/55/38/1020915538.db2.gz WZBVLHODUZRSMB-KBXCAEBGSA-N 1 0 326.396 3.759 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1[N+](=O)[O-] ZINC000276328790 1021042809 /nfs/dbraw/zinc/04/28/09/1021042809.db2.gz QPYFGOPTQCDYTN-NSHDSACASA-N 1 0 333.319 3.801 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261149 1021286524 /nfs/dbraw/zinc/28/65/24/1021286524.db2.gz QKVDIVRMHFPURT-LJQANCHMSA-N 1 0 328.412 3.758 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000322943100 1021475489 /nfs/dbraw/zinc/47/54/89/1021475489.db2.gz MUOVGBZQCTTXOG-XGWLTEMNSA-N 1 0 338.835 3.764 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000120885719 1021480950 /nfs/dbraw/zinc/48/09/50/1021480950.db2.gz WWPJEWGVDOSQGA-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1F ZINC000519675035 1021602239 /nfs/dbraw/zinc/60/22/39/1021602239.db2.gz YYKITUYSZRJLDA-UHFFFAOYSA-N 1 0 332.375 3.807 20 5 EHBDRO COc1cccc2c1CCC[C@@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000519682862 1021619873 /nfs/dbraw/zinc/61/98/73/1021619873.db2.gz KWFXCTYXIYOQPT-KRWDZBQOSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510460227 1021668055 /nfs/dbraw/zinc/66/80/55/1021668055.db2.gz WIEMZZUXFZYIKD-NRXRCSFJSA-N 1 0 343.471 3.945 20 5 EHBDRO CCC(CC)[C@H](CC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)OC ZINC000602581254 1032998106 /nfs/dbraw/zinc/99/81/06/1032998106.db2.gz JCCHWFMUALMBCQ-HNNXBMFYSA-N 1 0 335.404 3.667 20 5 EHBDRO CC(C)C[C@@H](CO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519847229 1021723878 /nfs/dbraw/zinc/72/38/78/1021723878.db2.gz KMIYZZZEVSHFLP-INIZCTEOSA-N 1 0 332.400 3.694 20 5 EHBDRO COC[C@H]1CCN1Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000516874743 1021805366 /nfs/dbraw/zinc/80/53/66/1021805366.db2.gz BZBORDVFVNCDPH-OAHLLOKOSA-N 1 0 346.358 3.747 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000610538828 1021808374 /nfs/dbraw/zinc/80/83/74/1021808374.db2.gz FGPSVDJXPRLJQG-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000602614905 1033010905 /nfs/dbraw/zinc/01/09/05/1033010905.db2.gz AVTPYTYVZCYRDS-MJGOQNOKSA-N 1 0 326.396 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](C3CC3)C2)cc1C(F)(F)F ZINC000319812613 1021885681 /nfs/dbraw/zinc/88/56/81/1021885681.db2.gz PLIOLKAPZLNPNY-JTQLQIEISA-N 1 0 329.322 3.510 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000441346944 1022183057 /nfs/dbraw/zinc/18/30/57/1022183057.db2.gz BRNRPOWJYGURFH-KRWDZBQOSA-N 1 0 349.475 3.688 20 5 EHBDRO CCC(O)(CC)CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000471787802 1022204809 /nfs/dbraw/zinc/20/48/09/1022204809.db2.gz NPSKPUHRTPJYGS-DOTOQJQBSA-N 1 0 334.460 3.837 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@@H](OC)C3)o2)c([N+](=O)[O-])c1 ZINC000471819815 1022400949 /nfs/dbraw/zinc/40/09/49/1022400949.db2.gz DOLXHLMIUARDPE-CHWSQXEVSA-N 1 0 346.383 3.521 20 5 EHBDRO COCC(C)(C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517551917 1022439401 /nfs/dbraw/zinc/43/94/01/1022439401.db2.gz WLGOVXHYFUTSRQ-UHFFFAOYSA-N 1 0 343.427 3.877 20 5 EHBDRO C[C@H]1[C@@H](CO)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989789 1022591068 /nfs/dbraw/zinc/59/10/68/1022591068.db2.gz UPMAWLYMMKCBOQ-GXTWGEPZSA-N 1 0 332.425 3.526 20 5 EHBDRO COc1cc(CN2CCC[C@H]2c2cccc(C)n2)c([N+](=O)[O-])cc1F ZINC000184237895 1022605132 /nfs/dbraw/zinc/60/51/32/1022605132.db2.gz WDLBTQRSIZCYDN-INIZCTEOSA-N 1 0 345.374 3.783 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602695071 1033076247 /nfs/dbraw/zinc/07/62/47/1033076247.db2.gz WGVJKGKGWLJMLT-IAGOWNOFSA-N 1 0 346.475 3.763 20 5 EHBDRO C[C@]1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO[C@@H]1C1CC1 ZINC000519579682 1022945715 /nfs/dbraw/zinc/94/57/15/1022945715.db2.gz COQCWHJCHZFCTI-GUDVDZBRSA-N 1 0 330.428 3.767 20 5 EHBDRO C[C@@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944937 1022958101 /nfs/dbraw/zinc/95/81/01/1022958101.db2.gz HRKYYBAYAJVPBA-NEPJUHHUSA-N 1 0 349.818 3.738 20 5 EHBDRO CC(C)(F)CC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602712024 1033100703 /nfs/dbraw/zinc/10/07/03/1033100703.db2.gz VBKZOUNRXJYOQI-UHFFFAOYSA-N 1 0 325.203 3.647 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000414958943 1023062620 /nfs/dbraw/zinc/06/26/20/1023062620.db2.gz DZSOJMHRHVKCCZ-QFBILLFUSA-N 1 0 339.439 3.986 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)N(C)c1ccccc1 ZINC000509573967 1023072398 /nfs/dbraw/zinc/07/23/98/1023072398.db2.gz WNUIIDVDAKTBIK-HNNXBMFYSA-N 1 0 343.427 3.608 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000131 1023211983 /nfs/dbraw/zinc/21/19/83/1023211983.db2.gz WDUWNJURNCTRCJ-NMLACTOBSA-N 1 0 346.471 3.789 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000610707622 1023281061 /nfs/dbraw/zinc/28/10/61/1023281061.db2.gz OKBMJADMTFFZCD-ZDTYVGOBSA-N 1 0 330.771 3.985 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C(C)C)C(C)(C)O ZINC000477865814 1023318402 /nfs/dbraw/zinc/31/84/02/1023318402.db2.gz XHHBYEUZRVVESS-CJNGLKHVSA-N 1 0 340.489 3.851 20 5 EHBDRO O=C(C[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000610720141 1023352010 /nfs/dbraw/zinc/35/20/10/1023352010.db2.gz WWGQFDNZVLIQDW-IBGZPJMESA-N 1 0 338.407 3.875 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548486539 1023494819 /nfs/dbraw/zinc/49/48/19/1023494819.db2.gz PVMQKAXYMRJARI-LRDDRELGSA-N 1 0 334.416 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818800 1023782653 /nfs/dbraw/zinc/78/26/53/1023782653.db2.gz SJTBIYJDLPQPAP-VXGBXAGGSA-N 1 0 340.383 3.897 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818771 1023782923 /nfs/dbraw/zinc/78/29/23/1023782923.db2.gz ANXJIQKRIDBXGR-RYUDHWBXSA-N 1 0 340.383 3.897 20 5 EHBDRO COc1cccc2c1OCC[C@H]2NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895227699 1024013231 /nfs/dbraw/zinc/01/32/31/1024013231.db2.gz QDLSIPHFEBAKQU-CQSZACIVSA-N 1 0 348.786 3.870 20 5 EHBDRO C[C@H](CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000475021391 1024023262 /nfs/dbraw/zinc/02/32/62/1024023262.db2.gz BSSARDGNFJLFJH-MRXNPFEDSA-N 1 0 340.423 3.948 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1CC(C)(C)C ZINC000141505673 1024104808 /nfs/dbraw/zinc/10/48/08/1024104808.db2.gz AKCUIXDACWJACH-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCc1cc(Br)no1 ZINC001167498612 1024196213 /nfs/dbraw/zinc/19/62/13/1024196213.db2.gz FBGPGUSRNAEGJC-UHFFFAOYSA-N 1 0 339.257 3.646 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)CC(C)(C)O2 ZINC000237201722 1024212211 /nfs/dbraw/zinc/21/22/11/1024212211.db2.gz BXBPVMMSBYQIKZ-UHFFFAOYSA-N 1 0 342.395 3.607 20 5 EHBDRO COc1ccccc1C(C)(C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000507787836 1024263049 /nfs/dbraw/zinc/26/30/49/1024263049.db2.gz VCYJICMNHZBNFE-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H](C)CO ZINC000430098101 1024362042 /nfs/dbraw/zinc/36/20/42/1024362042.db2.gz RWQOWPAJMNUDKQ-LLVKDONJSA-N 1 0 338.791 3.711 20 5 EHBDRO CCOc1cc(N[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000380731440 1024461259 /nfs/dbraw/zinc/46/12/59/1024461259.db2.gz INBDJGVYWVZIIW-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000514626287 1024617870 /nfs/dbraw/zinc/61/78/70/1024617870.db2.gz IRIOUENAPBCGMR-SFHVURJKSA-N 1 0 329.375 3.983 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000025358675 1024703719 /nfs/dbraw/zinc/70/37/19/1024703719.db2.gz AJSALENWOUKFEH-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000520785198 1024792016 /nfs/dbraw/zinc/79/20/16/1024792016.db2.gz BJMXUPVBGVEIJB-QGZVFWFLSA-N 1 0 344.386 3.820 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000895828459 1024870262 /nfs/dbraw/zinc/87/02/62/1024870262.db2.gz UBJQHXUMUMKVCJ-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCc3cc(F)c(OC)cc32)cc1[N+](=O)[O-] ZINC000281310027 1024875185 /nfs/dbraw/zinc/87/51/85/1024875185.db2.gz RUOCFMLUYXZWOZ-HNNXBMFYSA-N 1 0 346.358 3.528 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC2(CCO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427976891 1024919230 /nfs/dbraw/zinc/91/92/30/1024919230.db2.gz KGOJCVWHIQXHOR-SFHVURJKSA-N 1 0 344.411 3.592 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000474469844 1025000739 /nfs/dbraw/zinc/00/07/39/1025000739.db2.gz IDBSKZNUJIJDNX-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(C)C[NH+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC(C)C ZINC000071969724 1025023046 /nfs/dbraw/zinc/02/30/46/1025023046.db2.gz WFQABADCVBMJOS-UHFFFAOYSA-N 1 0 332.404 3.759 20 5 EHBDRO Cc1c(CN2CCC(C(=O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051379371 1025034578 /nfs/dbraw/zinc/03/45/78/1025034578.db2.gz IAWNWYCVGZGEOW-UHFFFAOYSA-N 1 0 338.407 3.998 20 5 EHBDRO CC(C)c1nccn1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000895987846 1025044217 /nfs/dbraw/zinc/04/42/17/1025044217.db2.gz JFOFSSQZMPUSGX-UHFFFAOYSA-N 1 0 325.372 3.575 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000515208173 1025091998 /nfs/dbraw/zinc/09/19/98/1025091998.db2.gz RMCHPEHTYIKOCA-SPYBWZPUSA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036466 1025183411 /nfs/dbraw/zinc/18/34/11/1025183411.db2.gz KXFXPUSGZAADQS-QAPCUYQASA-N 1 0 328.416 3.573 20 5 EHBDRO Cc1ccccc1[C@H](O)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163185174 1025195717 /nfs/dbraw/zinc/19/57/17/1025195717.db2.gz ZWHLUTOXWQKDPT-UYAOXDASSA-N 1 0 340.423 3.548 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC2(C(F)(F)F)CCC2)n1 ZINC000353963560 1025339741 /nfs/dbraw/zinc/33/97/41/1025339741.db2.gz XQFIHNZWAOLFDI-VXGBXAGGSA-N 1 0 346.353 3.597 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2[C@@H]2CCCO2)o1 ZINC000551826586 1025476192 /nfs/dbraw/zinc/47/61/92/1025476192.db2.gz NTAARYCJMYRPON-HKUYNNGSSA-N 1 0 342.395 3.998 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1CC[C@@H](C(=O)OCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000436311833 1025574376 /nfs/dbraw/zinc/57/43/76/1025574376.db2.gz ISTSACOSZZYPHM-HLLBOEOZSA-N 1 0 334.416 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896180 1025649930 /nfs/dbraw/zinc/64/99/30/1025649930.db2.gz BEHOEPNUEIXAFU-MRXNPFEDSA-N 1 0 340.427 3.507 20 5 EHBDRO C[C@@H]1CC(C)(C)C[C@](CO)([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000564405697 1025676172 /nfs/dbraw/zinc/67/61/72/1025676172.db2.gz GISSSHUCPZSKSX-ZUWQMALMSA-N 1 0 332.444 3.775 20 5 EHBDRO COc1cc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1SC ZINC000511096149 1025726278 /nfs/dbraw/zinc/72/62/78/1025726278.db2.gz NQXGWHYCBHJHRS-UHFFFAOYSA-N 1 0 346.452 4.000 20 5 EHBDRO Cc1noc2ncc(C[NH2+][C@H](C)c3ccc(C)c([N+](=O)[O-])c3)cc12 ZINC000894315844 1025768219 /nfs/dbraw/zinc/76/82/19/1025768219.db2.gz JBFHBQLTFJXFDN-LLVKDONJSA-N 1 0 326.356 3.599 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@H]2CCCO[C@H]2C1(C)C ZINC000451480216 1025997397 /nfs/dbraw/zinc/99/73/97/1025997397.db2.gz PQUIVNNTUQBODP-KBAYOESNSA-N 1 0 348.443 3.675 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)CC(=O)Nc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478491407 1026126803 /nfs/dbraw/zinc/12/68/03/1026126803.db2.gz ONPSPNYDIXLSGO-LBPRGKRZSA-N 1 0 345.374 3.549 20 5 EHBDRO C[C@H](NCc1cc(COC(C)(C)C)on1)c1ccc([N+](=O)[O-])cc1 ZINC000186063266 1026206238 /nfs/dbraw/zinc/20/62/38/1026206238.db2.gz LLXNAFGAXWACSN-LBPRGKRZSA-N 1 0 333.388 3.749 20 5 EHBDRO CC(C)(CO)C(C)(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000530729320 1026234380 /nfs/dbraw/zinc/23/43/80/1026234380.db2.gz QOGBQQSXKOKHOI-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000475140877 1026235306 /nfs/dbraw/zinc/23/53/06/1026235306.db2.gz UASADMPOSBIHFW-SFHVURJKSA-N 1 0 328.412 3.593 20 5 EHBDRO COCC[C@@H](c1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124145 1026257656 /nfs/dbraw/zinc/25/76/56/1026257656.db2.gz KPOXRQNHZLVJDH-SFHVURJKSA-N 1 0 328.412 3.847 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000523005623 1026276239 /nfs/dbraw/zinc/27/62/39/1026276239.db2.gz DNRGMWFHSYSYMC-MRXNPFEDSA-N 1 0 344.386 3.677 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCCC[C@H]1C ZINC000530855959 1026354829 /nfs/dbraw/zinc/35/48/29/1026354829.db2.gz XNTOVWNKPHESMM-KGLIPLIRSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCCN(C)c3ccccc32)cccc1[N+](=O)[O-] ZINC000451866365 1026358702 /nfs/dbraw/zinc/35/87/02/1026358702.db2.gz JPVWNSGAZMEMMZ-QGZVFWFLSA-N 1 0 325.412 3.964 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000530974894 1026449305 /nfs/dbraw/zinc/44/93/05/1026449305.db2.gz KWUWBEAFNYNQDY-QUJCMNEKSA-N 1 0 342.395 3.646 20 5 EHBDRO CCN(CC)[C@H](C)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335966 1026490082 /nfs/dbraw/zinc/49/00/82/1026490082.db2.gz NNDGMKYYZYGJOB-RYRKJORJSA-N 1 0 333.476 3.626 20 5 EHBDRO COc1cccc(N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354944 1026509453 /nfs/dbraw/zinc/50/94/53/1026509453.db2.gz SYEYGSMTLNSUBY-GDBMZVCRSA-N 1 0 341.411 3.851 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)c1cc[nH]c(=O)c1 ZINC000339450531 1026565142 /nfs/dbraw/zinc/56/51/42/1026565142.db2.gz BLVYDOOBPBZYFZ-GFCCVEGCSA-N 1 0 339.351 3.806 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000531443668 1026926662 /nfs/dbraw/zinc/92/66/62/1026926662.db2.gz IGGZLBLMOAQKAK-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)C2)cc1OC ZINC001167602806 1027009317 /nfs/dbraw/zinc/00/93/17/1027009317.db2.gz QFMDWKXLGQLWAC-KBPBESRZSA-N 1 0 336.432 3.870 20 5 EHBDRO Cc1ccc(OC(F)F)c(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000531789234 1027384372 /nfs/dbraw/zinc/38/43/72/1027384372.db2.gz JBPPZAWIWDJULJ-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCC[NH2+]C1CCCCC1 ZINC000475556323 1027597468 /nfs/dbraw/zinc/59/74/68/1027597468.db2.gz PNCFKNQXTRZMMQ-UHFFFAOYSA-N 1 0 348.447 3.646 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000178653548 1027603205 /nfs/dbraw/zinc/60/32/05/1027603205.db2.gz GEQPJBLDPGWWCP-ZDUSSCGKSA-N 1 0 328.368 3.607 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178659962 1027620302 /nfs/dbraw/zinc/62/03/02/1027620302.db2.gz MSNKTSJDGQUXLL-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])nc2)[C@@H]1c1cccs1 ZINC000078338383 1027686922 /nfs/dbraw/zinc/68/69/22/1027686922.db2.gz GYEKCLVOWOOUOJ-BLLLJJGKSA-N 1 0 332.429 3.546 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000475584106 1027709465 /nfs/dbraw/zinc/70/94/65/1027709465.db2.gz RJSKKUXSMLDICM-UHFFFAOYSA-N 1 0 348.447 3.642 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(Cc2cccs2)[C@H]2C=C[C@@H](CO)C2)c1 ZINC000347330983 1027709915 /nfs/dbraw/zinc/70/99/15/1027709915.db2.gz HXZWHAHNRKNKHR-CVEARBPZSA-N 1 0 344.436 3.596 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCC3(CC[NH2+]3)CC2)s1 ZINC000422559699 1027790153 /nfs/dbraw/zinc/79/01/53/1027790153.db2.gz DYUBLTTVPMQXLN-UHFFFAOYSA-N 1 0 343.452 3.651 20 5 EHBDRO CC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435388 1027874557 /nfs/dbraw/zinc/87/45/57/1027874557.db2.gz WJKGYXCQRINMJF-CABCVRRESA-N 1 0 333.432 3.742 20 5 EHBDRO CCOC(=O)C1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000237159421 1028027887 /nfs/dbraw/zinc/02/78/87/1028027887.db2.gz WRCOMWUIBQACHA-HLIUYOAVSA-N 1 0 334.416 3.676 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCOC1 ZINC000503926255 1028219204 /nfs/dbraw/zinc/21/92/04/1028219204.db2.gz IZSNRIGTQFFNOT-UKRRQHHQSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)cc1 ZINC000366853178 1028232184 /nfs/dbraw/zinc/23/21/84/1028232184.db2.gz BAGMJQZHYCSPEH-UHFFFAOYSA-N 1 0 343.349 3.812 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@]23CCOC3)s1 ZINC000421393516 1028369817 /nfs/dbraw/zinc/36/98/17/1028369817.db2.gz DZJXNUKYUKJEPB-KRWDZBQOSA-N 1 0 330.409 3.688 20 5 EHBDRO [NH3+][C@@H]1CCC[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374184 1028379471 /nfs/dbraw/zinc/37/94/71/1028379471.db2.gz HZADJUBNGGCULX-LMMKCTJWSA-N 1 0 325.412 3.544 20 5 EHBDRO CCc1ccc([C@H](NCC[C@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423376691 1028411782 /nfs/dbraw/zinc/41/17/82/1028411782.db2.gz YLLUTTLCDNJYOW-DNVCBOLYSA-N 1 0 343.427 3.571 20 5 EHBDRO C[C@@H](O)C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000077425801 1028483412 /nfs/dbraw/zinc/48/34/12/1028483412.db2.gz RYYMVUVQCGRQEI-QWHCGFSZSA-N 1 0 334.441 3.820 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000237247084 1028615968 /nfs/dbraw/zinc/61/59/68/1028615968.db2.gz IRRSHKOWVAIJFK-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO CC(C)(C)OC(=O)C(C)(C)CC[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000424190568 1028878003 /nfs/dbraw/zinc/87/80/03/1028878003.db2.gz PSAYLILHJVZAAJ-UHFFFAOYSA-N 1 0 328.434 3.504 20 5 EHBDRO CC(C)Oc1cc(-c2nc(C3([NH3+])CCCCC3)no2)ccc1[N+](=O)[O-] ZINC000424345988 1029024460 /nfs/dbraw/zinc/02/44/60/1029024460.db2.gz HVQZFMSWRQVMAQ-UHFFFAOYSA-N 1 0 346.387 3.550 20 5 EHBDRO C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424347809 1029026800 /nfs/dbraw/zinc/02/68/00/1029026800.db2.gz SJYWYDICCBNUEA-VAWYXSNFSA-N 1 0 328.372 3.656 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CN(C2CC2)C[C@H]1C ZINC000504917992 1029046012 /nfs/dbraw/zinc/04/60/12/1029046012.db2.gz FPQJHFGDIQLHGA-FMKPAKJESA-N 1 0 349.500 3.538 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739812 1029048458 /nfs/dbraw/zinc/04/84/58/1029048458.db2.gz JHNRTGOLNAWXPN-NEPJUHHUSA-N 1 0 336.823 3.606 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532918391 1029070366 /nfs/dbraw/zinc/07/03/66/1029070366.db2.gz TVWJNQJALFDRQG-XCRHUMRWSA-N 1 0 345.443 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(CCN2CCC[N@H+](CC3CCCCC3)CC2)cc1 ZINC000524425147 1029156939 /nfs/dbraw/zinc/15/69/39/1029156939.db2.gz TVTMUGJVMRSZML-UHFFFAOYSA-N 1 0 345.487 3.725 20 5 EHBDRO CCC[NH+](CCC)CCCc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000505066050 1029170316 /nfs/dbraw/zinc/17/03/16/1029170316.db2.gz VEUBTWDLCUQMBH-UHFFFAOYSA-N 1 0 332.404 3.699 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445850966 1029185920 /nfs/dbraw/zinc/18/59/20/1029185920.db2.gz XQDMPDSNEJVYQN-HNNXBMFYSA-N 1 0 345.443 3.886 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCCC(C)(C)C1 ZINC000446079147 1029393013 /nfs/dbraw/zinc/39/30/13/1029393013.db2.gz OHQYYDXGGKKTEV-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCC1CCOCC1 ZINC000513822445 1029523553 /nfs/dbraw/zinc/52/35/53/1029523553.db2.gz CDPCXAMUGQYHHI-WMZOPIPTSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3ccc(O)cc3)CC2)cc1 ZINC000533358996 1029640261 /nfs/dbraw/zinc/64/02/61/1029640261.db2.gz RWGQHZISDHJKGK-UHFFFAOYSA-N 1 0 342.395 3.559 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H](OC)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000525289941 1029782080 /nfs/dbraw/zinc/78/20/80/1029782080.db2.gz DVZDSHSEZPQLSY-SFHVURJKSA-N 1 0 348.399 3.624 20 5 EHBDRO CCOc1cc(N[C@@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536022777 1029820275 /nfs/dbraw/zinc/82/02/75/1029820275.db2.gz JLYMZWOPOWYNAF-MRXNPFEDSA-N 1 0 327.384 3.592 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)n1 ZINC000441173636 1029866870 /nfs/dbraw/zinc/86/68/70/1029866870.db2.gz CNLLEDBNAKUUBN-RXQFDZFGSA-N 1 0 340.427 3.749 20 5 EHBDRO CC[C@H](O)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000525697435 1030031564 /nfs/dbraw/zinc/03/15/64/1030031564.db2.gz ZTKHFEBAIINLRK-HNNXBMFYSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000531944951 1030066439 /nfs/dbraw/zinc/06/64/39/1030066439.db2.gz KOAKNHSSJODQMT-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2ccco2)N2CCCC2)cccc1[N+](=O)[O-] ZINC000152277599 1030073840 /nfs/dbraw/zinc/07/38/40/1030073840.db2.gz CLTOJRGWZOFTBU-MAUKXSAKSA-N 1 0 343.427 3.984 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2ccccc2F)c([N+](=O)[O-])c1 ZINC000441234416 1030087374 /nfs/dbraw/zinc/08/73/74/1030087374.db2.gz NTPIAGPVRRGXNB-ZDUSSCGKSA-N 1 0 348.374 3.814 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000531948103 1030118583 /nfs/dbraw/zinc/11/85/83/1030118583.db2.gz AJGCZOVUFRRYHC-BEFAXECRSA-N 1 0 327.428 3.857 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cnc(C)cc2C)cc1[N+](=O)[O-] ZINC000453379457 1030203866 /nfs/dbraw/zinc/20/38/66/1030203866.db2.gz WIKGFJBEQSDYIC-CQSZACIVSA-N 1 0 329.400 3.856 20 5 EHBDRO C[C@H](CC(C)(C)C)[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453407260 1030217177 /nfs/dbraw/zinc/21/71/77/1030217177.db2.gz DMEXAXLOFJADDH-CJNGLKHVSA-N 1 0 330.432 3.832 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccccc2Cl)n1 ZINC000447522967 1030244023 /nfs/dbraw/zinc/24/40/23/1030244023.db2.gz ROJVTWQVKILMPV-HUUCEWRRSA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2cccc(Cl)c2)n1 ZINC000447510960 1030258101 /nfs/dbraw/zinc/25/81/01/1030258101.db2.gz REUCWOSPOHWTRB-LSDHHAIUSA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1ccccc1F)CCC2 ZINC000447513326 1030260615 /nfs/dbraw/zinc/26/06/15/1030260615.db2.gz VHHGYEOGEJHRED-QGZVFWFLSA-N 1 0 330.359 3.780 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H]3CCCS3)o2)c([N+](=O)[O-])c1 ZINC000532046152 1030316558 /nfs/dbraw/zinc/31/65/58/1030316558.db2.gz IYCJWSPQRABUFX-CQSZACIVSA-N 1 0 348.424 3.849 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1CCCCN1C1CC1)C1CC1 ZINC000447592414 1030327643 /nfs/dbraw/zinc/32/76/43/1030327643.db2.gz LJEWLIJSKMNBDD-RTBURBONSA-N 1 0 343.471 3.522 20 5 EHBDRO C[NH+](C)Cc1ccc(-c2noc(-c3ccc(F)cc3[N+](=O)[O-])n2)cc1 ZINC000532065992 1030327798 /nfs/dbraw/zinc/32/77/98/1030327798.db2.gz OYLHBHGNGCZHCN-UHFFFAOYSA-N 1 0 342.330 3.513 20 5 EHBDRO CC(C)[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128667729 1030400297 /nfs/dbraw/zinc/40/02/97/1030400297.db2.gz UQXHYZLPGKUNHX-INIZCTEOSA-N 1 0 337.395 3.573 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cccc(OC)c1OC)c1cccc([N+](=O)[O-])c1 ZINC000532212139 1030481972 /nfs/dbraw/zinc/48/19/72/1030481972.db2.gz VUCLGLMWXRQNDY-QGZVFWFLSA-N 1 0 344.411 3.895 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](Cc1ccccc1)C[C@@H](C)O ZINC000527304337 1030768480 /nfs/dbraw/zinc/76/84/80/1030768480.db2.gz AQYOAMXUWBKYFF-ZFOVBUMHSA-N 1 0 340.423 3.881 20 5 EHBDRO Cc1c([C@@H](C)NC2CC[NH+](C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160481529 1030788014 /nfs/dbraw/zinc/78/80/14/1030788014.db2.gz IRSXAKWDBWUFPS-OAHLLOKOSA-N 1 0 331.460 3.961 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000160516237 1030807408 /nfs/dbraw/zinc/80/74/08/1030807408.db2.gz OXVVGTZQGCCFEM-ZDUSSCGKSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361711 1030983509 /nfs/dbraw/zinc/98/35/09/1030983509.db2.gz YCOTULQTZAPZBW-GDBMZVCRSA-N 1 0 344.411 3.980 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251362 1031064681 /nfs/dbraw/zinc/06/46/81/1031064681.db2.gz CZBJTNZDQRDWAD-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000536183626 1031352045 /nfs/dbraw/zinc/35/20/45/1031352045.db2.gz SQSBDIFZYDRUFS-ZBFHGGJFSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000536183624 1031352138 /nfs/dbraw/zinc/35/21/38/1031352138.db2.gz SQSBDIFZYDRUFS-GOEBONIOSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1cccc(F)c1 ZINC000026223904 1031385790 /nfs/dbraw/zinc/38/57/90/1031385790.db2.gz HGDFNQZXLJLJQS-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@H]3CCCO3)o2)c1 ZINC000551586964 1031475114 /nfs/dbraw/zinc/47/51/14/1031475114.db2.gz SOZGVPJBAWIZNS-PKOBYXMFSA-N 1 0 342.395 3.998 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468944 1031587584 /nfs/dbraw/zinc/58/75/84/1031587584.db2.gz BWONYPJNWXYMHT-CABZTGNLSA-N 1 0 342.367 3.600 20 5 EHBDRO CC(C)(C)OC(=O)CCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000343601580 1031594056 /nfs/dbraw/zinc/59/40/56/1031594056.db2.gz GZDWDZWKUIHESX-UHFFFAOYSA-N 1 0 334.416 3.681 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000484776409 1031949548 /nfs/dbraw/zinc/94/95/48/1031949548.db2.gz OBHVSRHTKWQSPZ-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000248577247 1032001726 /nfs/dbraw/zinc/00/17/26/1032001726.db2.gz UHBSGQKSPGHLDT-SUNKGSAMSA-N 1 0 339.823 3.601 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000537974564 1032052673 /nfs/dbraw/zinc/05/26/73/1032052673.db2.gz GYRFLTBACXSRBF-LJQANCHMSA-N 1 0 342.395 3.649 20 5 EHBDRO CC(=O)c1ccc(NCCCC[N@H+]2CCCC[C@H]2C)c([N+](=O)[O-])c1 ZINC000076795344 1033332298 /nfs/dbraw/zinc/33/22/98/1033332298.db2.gz FNCRYHGHMMUQMJ-CQSZACIVSA-N 1 0 333.432 3.864 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](CCCO)c1ccccc1 ZINC000594495261 1033397750 /nfs/dbraw/zinc/39/77/50/1033397750.db2.gz PGAZEJVJZSRJQS-MSOLQXFVSA-N 1 0 326.396 3.686 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC2(COC)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000594511906 1033415922 /nfs/dbraw/zinc/41/59/22/1033415922.db2.gz RSJYSPMHKHPADK-SFHVURJKSA-N 1 0 344.411 3.856 20 5 EHBDRO Cc1cc(N2CCC[C@H](OC3CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000594595380 1033444580 /nfs/dbraw/zinc/44/45/80/1033444580.db2.gz WUHTVNUTHPIPOZ-INIZCTEOSA-N 1 0 341.411 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(CNc2ccc([C@H]3C[NH2+]CCO3)cc2)c(Cl)c1 ZINC000594740330 1033510373 /nfs/dbraw/zinc/51/03/73/1033510373.db2.gz VTNSADYPWNMNKJ-QGZVFWFLSA-N 1 0 347.802 3.521 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000059393793 1033583617 /nfs/dbraw/zinc/58/36/17/1033583617.db2.gz FIXPAIYKHIJFDF-UHFFFAOYSA-N 1 0 347.365 3.950 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000594939259 1033589508 /nfs/dbraw/zinc/58/95/08/1033589508.db2.gz UDEUNZKXHKIRDB-CQSZACIVSA-N 1 0 344.411 3.607 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCN(c3ccccc3Cl)C2)c1 ZINC000594956874 1033598805 /nfs/dbraw/zinc/59/88/05/1033598805.db2.gz WCCNVLRWNHWARC-OAHLLOKOSA-N 1 0 345.830 3.864 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)cc1[N+](=O)[O-] ZINC000598989936 1033616947 /nfs/dbraw/zinc/61/69/47/1033616947.db2.gz WODLADYAPNQREC-BMGDILEWSA-N 1 0 344.798 3.685 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594994079 1033624070 /nfs/dbraw/zinc/62/40/70/1033624070.db2.gz DWWAMJDYEGISJW-CYBMUJFWSA-N 1 0 347.440 3.623 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599023067 1033652407 /nfs/dbraw/zinc/65/24/07/1033652407.db2.gz ASEIJYZIMYBDIW-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000595035692 1033655015 /nfs/dbraw/zinc/65/50/15/1033655015.db2.gz LCQJPOOKKPIQDM-OGHNNQOOSA-N 1 0 336.432 3.848 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073935 1033716437 /nfs/dbraw/zinc/71/64/37/1033716437.db2.gz NDPCZMGQGRPLNZ-RHSMWYFYSA-N 1 0 347.459 3.661 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc2cnccc21 ZINC000599097335 1033732184 /nfs/dbraw/zinc/73/21/84/1033732184.db2.gz BTIBFRCCZYXRKE-WBVHZDCISA-N 1 0 326.400 3.572 20 5 EHBDRO CC[C@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000603629431 1033814569 /nfs/dbraw/zinc/81/45/69/1033814569.db2.gz SHBUKYAEGNBAQC-GFCCVEGCSA-N 1 0 331.338 3.900 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000595467666 1033821040 /nfs/dbraw/zinc/82/10/40/1033821040.db2.gz SPTZADJTEBLXAR-NUJGCVRESA-N 1 0 336.407 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520808 1033837905 /nfs/dbraw/zinc/83/79/05/1033837905.db2.gz FEWPTOIXMKXSEP-INIZCTEOSA-N 1 0 348.406 3.918 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000612049437 1033958033 /nfs/dbraw/zinc/95/80/33/1033958033.db2.gz PNANRNDTLCLMIV-SUMWQHHRSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000603840155 1033985171 /nfs/dbraw/zinc/98/51/71/1033985171.db2.gz KVPQUEDEIDXNBL-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000596097822 1034061951 /nfs/dbraw/zinc/06/19/51/1034061951.db2.gz GTCHGERUKSMBBS-NSHDSACASA-N 1 0 331.338 3.580 20 5 EHBDRO COc1cc(NC2CC[NH+](CC(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596067632 1034069231 /nfs/dbraw/zinc/06/92/31/1034069231.db2.gz OUDJQJPKZAXKIP-UHFFFAOYSA-N 1 0 341.839 3.789 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC2)CC1 ZINC000599672176 1034080924 /nfs/dbraw/zinc/08/09/24/1034080924.db2.gz BXCKGCQLPWALNM-ZDUSSCGKSA-N 1 0 342.399 3.972 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692815 1034097649 /nfs/dbraw/zinc/09/76/49/1034097649.db2.gz XXSUTATXMWCVRX-SFAKSCPVSA-N 1 0 332.400 3.640 20 5 EHBDRO COc1cc(NC2CCC(C[NH+](C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596172003 1034118116 /nfs/dbraw/zinc/11/81/16/1034118116.db2.gz SBMCRFNCUSUHSC-UHFFFAOYSA-N 1 0 341.839 3.789 20 5 EHBDRO C[NH+](C)C1CCC2(CC1)CCN(c1ccc(F)cc1[N+](=O)[O-])CC2 ZINC000596255112 1034150890 /nfs/dbraw/zinc/15/08/90/1034150890.db2.gz JYFLKCXCXDVHJL-UHFFFAOYSA-N 1 0 335.423 3.825 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596570436 1034293727 /nfs/dbraw/zinc/29/37/27/1034293727.db2.gz KZESNYDUKJOFJP-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])nc2)[C@@H]1c1ccc(Cl)cc1 ZINC000450413162 1034299134 /nfs/dbraw/zinc/29/91/34/1034299134.db2.gz SNTUGSTUYGHHCY-HOCLYGCPSA-N 1 0 332.791 3.501 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](c2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000892467033 1034431654 /nfs/dbraw/zinc/43/16/54/1034431654.db2.gz DOFRPYVXOYNEAX-INIZCTEOSA-N 1 0 348.374 3.935 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@H]2CCc3ccccc3N2)c(F)c1 ZINC000593318902 1034655270 /nfs/dbraw/zinc/65/52/70/1034655270.db2.gz SADJYTVSSXSSTR-OAHLLOKOSA-N 1 0 329.375 3.641 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000450675295 1034701537 /nfs/dbraw/zinc/70/15/37/1034701537.db2.gz CRZRAQQPLWHZBE-DOXZYTNZSA-N 1 0 328.412 3.718 20 5 EHBDRO CCc1nnc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146947 1034819967 /nfs/dbraw/zinc/81/99/67/1034819967.db2.gz LAWHCQLDBXUCMU-JSGCOSHPSA-N 1 0 346.456 3.510 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C(C)C)C1CCCC1 ZINC000411367625 1034869274 /nfs/dbraw/zinc/86/92/74/1034869274.db2.gz SHIAIQMAMSBRCU-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO COc1cc(C[N@H+](C(C)C)C2CC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179937546 1035061056 /nfs/dbraw/zinc/06/10/56/1035061056.db2.gz TZUQMPQWTJVDOU-UHFFFAOYSA-N 1 0 344.358 3.620 20 5 EHBDRO COCc1ccccc1/C=C(/C)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000511367118 1035183546 /nfs/dbraw/zinc/18/35/46/1035183546.db2.gz MMXOEJCEAITZJC-SSZFMOIBSA-N 1 0 340.423 3.977 20 5 EHBDRO CC(C)C[C@@H](CO)[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580129033 1035414626 /nfs/dbraw/zinc/41/46/26/1035414626.db2.gz INKSPUQPYNGCRV-INIZCTEOSA-N 1 0 332.400 3.694 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000580340934 1035429087 /nfs/dbraw/zinc/42/90/87/1035429087.db2.gz FQZUOTBNLRXZQK-DEICHXMPSA-N 1 0 342.443 3.832 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000188625014 1035442900 /nfs/dbraw/zinc/44/29/00/1035442900.db2.gz RPMZEGXHOQCSJL-WHOFXGATSA-N 1 0 346.349 3.729 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCO1 ZINC000581085214 1035472543 /nfs/dbraw/zinc/47/25/43/1035472543.db2.gz OYDJXRVYOKSGKH-KGLIPLIRSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1Cc2ccccc2O1)C1CC1 ZINC000540766985 1035661463 /nfs/dbraw/zinc/66/14/63/1035661463.db2.gz LVYCGEZHKXEZOP-ROUUACIJSA-N 1 0 338.407 3.509 20 5 EHBDRO Cc1cnccc1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582178741 1035722313 /nfs/dbraw/zinc/72/23/13/1035722313.db2.gz QPYHKUXFIZJWCI-GOSISDBHSA-N 1 0 325.412 3.720 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347455 1035922752 /nfs/dbraw/zinc/92/27/52/1035922752.db2.gz COJYULJOMAEZBW-GJZGRUSLSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000443958080 1035951297 /nfs/dbraw/zinc/95/12/97/1035951297.db2.gz LNHWZFBNSZXQEK-ZIAGYGMSSA-N 1 0 348.447 3.596 20 5 EHBDRO C[N@H+](CCOC(C)(C)C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000689902160 1036044883 /nfs/dbraw/zinc/04/48/83/1036044883.db2.gz APPVOCMPBFDPDN-UHFFFAOYSA-N 1 0 345.237 3.604 20 5 EHBDRO CCNC(=O)N1CC[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000760708323 1036058186 /nfs/dbraw/zinc/05/81/86/1036058186.db2.gz ZAKVEJSVTZXWHP-SFHVURJKSA-N 1 0 347.462 3.886 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492790616 1036297051 /nfs/dbraw/zinc/29/70/51/1036297051.db2.gz PWBFRBCHCJQKQF-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCO[C@@H]2C2CC2)s1 ZINC000535541153 1036618839 /nfs/dbraw/zinc/61/88/39/1036618839.db2.gz CFRYFTVMGSDDKX-CRAIPNDOSA-N 1 0 344.436 3.980 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000892622069 1036738694 /nfs/dbraw/zinc/73/86/94/1036738694.db2.gz NMLYBOHFZMHVTA-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1[C@H](C)CC[C@H]1C ZINC000783775822 1036809862 /nfs/dbraw/zinc/80/98/62/1036809862.db2.gz IULOMQVTLBHQSY-UTUOFQBUSA-N 1 0 340.807 3.553 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000180446243 1036840008 /nfs/dbraw/zinc/84/00/08/1036840008.db2.gz GAZTWLLZVJYIKC-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCOC2(CCSCC2)C1 ZINC000539524261 1036859380 /nfs/dbraw/zinc/85/93/80/1036859380.db2.gz FVHFUUPMNVBXEU-OICCZTGUSA-N 1 0 348.468 3.642 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCC[C@H](CO)C2)c2ccccc2)c1 ZINC000414349933 1036879210 /nfs/dbraw/zinc/87/92/10/1036879210.db2.gz YMSJVTQQTLLYKO-QKYXUNIQSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3C[C@@H]4CCCC[C@H]4C3)co2)cc1 ZINC000089908695 1036934461 /nfs/dbraw/zinc/93/44/61/1036934461.db2.gz TUXGHSBGBSZVLJ-GJZGRUSLSA-N 1 0 327.384 3.872 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220740 1036951107 /nfs/dbraw/zinc/95/11/07/1036951107.db2.gz QUERRIOMIHKXKL-KOSHJBKYSA-N 1 0 346.452 3.963 20 5 EHBDRO CC(C)([NH3+])[C@@H](N)c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212164843 1036957538 /nfs/dbraw/zinc/95/75/38/1036957538.db2.gz MBNJQXCFHAHJFE-KRWDZBQOSA-N 1 0 332.407 3.780 20 5 EHBDRO C[C@](CO)([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000542000359 1036963823 /nfs/dbraw/zinc/96/38/23/1036963823.db2.gz QQAAPLLRVDZNHW-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCO[C@@H](CC(C)C)C1 ZINC000539615752 1036981959 /nfs/dbraw/zinc/98/19/59/1036981959.db2.gz JEUVXCKRADOIPW-WBVHZDCISA-N 1 0 336.432 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3nc4c(s3)CCC4)C2)cc1 ZINC000590659582 1036995757 /nfs/dbraw/zinc/99/57/57/1036995757.db2.gz JUMNDNOVBOZRCR-AWEZNQCLSA-N 1 0 343.452 3.920 20 5 EHBDRO Cc1nn(C[N@H+]2C[C@@H](c3ccccc3C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537209 1037022671 /nfs/dbraw/zinc/02/26/71/1037022671.db2.gz IDKLLCCPWLDPFB-BBRMVZONSA-N 1 0 328.416 3.552 20 5 EHBDRO CN(C)C[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522963 1037089946 /nfs/dbraw/zinc/08/99/46/1037089946.db2.gz OCYDFFYHBAYBCI-INIZCTEOSA-N 1 0 347.846 3.511 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@H]2/C=C/c2cccs2)n1 ZINC000542131640 1037108244 /nfs/dbraw/zinc/10/82/44/1037108244.db2.gz NKZDUSHJMZKCTR-KIUWMYQTSA-N 1 0 346.456 3.811 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000542185224 1037146638 /nfs/dbraw/zinc/14/66/38/1037146638.db2.gz OCGKOWQRNATKOL-QEJZJMRPSA-N 1 0 334.416 3.623 20 5 EHBDRO CO[C@@H](C)C[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000573018215 1037159513 /nfs/dbraw/zinc/15/95/13/1037159513.db2.gz DTOBMFDDQWCNMZ-ZDUSSCGKSA-N 1 0 348.374 3.993 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769554 1037169966 /nfs/dbraw/zinc/16/99/66/1037169966.db2.gz XBMRNMHBUNKGDR-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000151583254 1037413241 /nfs/dbraw/zinc/41/32/41/1037413241.db2.gz BQGQLPRYISIBTK-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C=Cc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000462819377 1037441848 /nfs/dbraw/zinc/44/18/48/1037441848.db2.gz LVYWFZAXJVFUBL-QZTJIDSGSA-N 1 0 340.427 3.750 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000462862130 1037486157 /nfs/dbraw/zinc/48/61/57/1037486157.db2.gz LMAQECXBLITDOQ-WCQYABFASA-N 1 0 345.365 3.780 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2ccccc2C)c([N+](=O)[O-])c1 ZINC000549869458 1037501836 /nfs/dbraw/zinc/50/18/36/1037501836.db2.gz NVPNVPYNIZOCGC-UHFFFAOYSA-N 1 0 344.411 3.816 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1C[C@H](F)CN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591581106 1037518488 /nfs/dbraw/zinc/51/84/88/1037518488.db2.gz KTFBRVDYZWRVPY-AVGNSLFASA-N 1 0 349.431 3.674 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F ZINC000532483137 1037521006 /nfs/dbraw/zinc/52/10/06/1037521006.db2.gz PLOFHSDKLHZVOU-ZDUSSCGKSA-N 1 0 332.375 3.944 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCCC[C@@H]1C ZINC000462925657 1037554430 /nfs/dbraw/zinc/55/44/30/1037554430.db2.gz CMUKFZHEYVCLEP-NWDGAFQWSA-N 1 0 343.374 3.871 20 5 EHBDRO C[C@@H](O)[C@@](C)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000188904413 1037557720 /nfs/dbraw/zinc/55/77/20/1037557720.db2.gz BOHZMKUVXSHKGZ-RZQQEMMASA-N 1 0 342.439 3.875 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532547502 1037567131 /nfs/dbraw/zinc/56/71/31/1037567131.db2.gz VLFQJQOZSSRCIN-WBVHZDCISA-N 1 0 328.412 3.812 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@H]2CCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000493714460 1037574495 /nfs/dbraw/zinc/57/44/95/1037574495.db2.gz YUZRIMURXWZZDK-ZBFHGGJFSA-N 1 0 336.432 3.631 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000463080536 1037727470 /nfs/dbraw/zinc/72/74/70/1037727470.db2.gz ZNOAWBRTYTWJPJ-GFCCVEGCSA-N 1 0 343.374 3.507 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000897460712 1037847953 /nfs/dbraw/zinc/84/79/53/1037847953.db2.gz VCEZSLGTLBEKLY-SUMWQHHRSA-N 1 0 343.431 3.728 20 5 EHBDRO CC(=O)c1cc(NCCC[N@@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000341367004 1038024811 /nfs/dbraw/zinc/02/48/11/1038024811.db2.gz JVAVVNCMMVJVSO-UHFFFAOYSA-N 1 0 341.411 3.731 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCc2occc21 ZINC000341439290 1038265617 /nfs/dbraw/zinc/26/56/17/1038265617.db2.gz HPNQJNXOZOUWKA-WBMJQRKESA-N 1 0 343.383 3.572 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CN(C)Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000539049350 1038654044 /nfs/dbraw/zinc/65/40/44/1038654044.db2.gz OXFMZCLTSOHXGH-RTBURBONSA-N 1 0 325.412 3.822 20 5 EHBDRO CC[C@H](C)[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000539317353 1038770860 /nfs/dbraw/zinc/77/08/60/1038770860.db2.gz WFQPXCLKLUPCGT-LRDDRELGSA-N 1 0 336.823 3.822 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(n2cc(Cl)cn2)CC1 ZINC000363891678 1038796327 /nfs/dbraw/zinc/79/63/27/1038796327.db2.gz UKRYNZMLDXJNEC-UHFFFAOYSA-N 1 0 334.807 3.590 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N(C)C)cccc1[N+](=O)[O-] ZINC000479847020 1038801531 /nfs/dbraw/zinc/80/15/31/1038801531.db2.gz AHMUPHWJWZGIAD-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCn3c(cc4ccccc43)C2)cc1 ZINC000554305231 1039201324 /nfs/dbraw/zinc/20/13/24/1039201324.db2.gz HAMXWZJEMCKKRZ-UHFFFAOYSA-N 1 0 335.407 3.998 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000090217617 1039374122 /nfs/dbraw/zinc/37/41/22/1039374122.db2.gz BAVOPJCYRLVKJO-CYBMUJFWSA-N 1 0 346.456 3.679 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440167 1039549460 /nfs/dbraw/zinc/54/94/60/1039549460.db2.gz AIJXJZIAWXBZLI-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccc3c[nH]nc3c1)CCC2 ZINC000342816031 1039551722 /nfs/dbraw/zinc/55/17/22/1039551722.db2.gz SLIYTDFDKDCMDZ-SFHVURJKSA-N 1 0 336.395 3.681 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000480503523 1039614415 /nfs/dbraw/zinc/61/44/15/1039614415.db2.gz YNPWDQVEZYSQQI-LSSBLYJVSA-N 1 0 332.444 3.919 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000552924225 1039621838 /nfs/dbraw/zinc/62/18/38/1039621838.db2.gz BEBYVFOQAHJUFA-POZUXBRTSA-N 1 0 325.412 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC[C@@H](CO)C1)CCCC2 ZINC000417353591 1039710578 /nfs/dbraw/zinc/71/05/78/1039710578.db2.gz XOBQTFDJFCOVDK-QMTMVMCOSA-N 1 0 332.444 3.751 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000584757308 1039715065 /nfs/dbraw/zinc/71/50/65/1039715065.db2.gz JEFDLHMZDOBYIK-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO C[C@H](CN1CCCCCC1)[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000480660228 1039824567 /nfs/dbraw/zinc/82/45/67/1039824567.db2.gz FJIVVIBNADVIOX-DLBZAZTESA-N 1 0 333.476 3.770 20 5 EHBDRO C[C@H]([N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000027132905 1039937857 /nfs/dbraw/zinc/93/78/57/1039937857.db2.gz NEJSCMALINTLCJ-JTQLQIEISA-N 1 0 327.812 3.553 20 5 EHBDRO C[C@@H]([N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000027132774 1039939305 /nfs/dbraw/zinc/93/93/05/1039939305.db2.gz YQPXAALNJPQEOL-SNVBAGLBSA-N 1 0 327.812 3.553 20 5 EHBDRO COC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000573410021 1040092979 /nfs/dbraw/zinc/09/29/79/1040092979.db2.gz ZVLLAAHYZLSJCI-KRWDZBQOSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000192954478 1040177963 /nfs/dbraw/zinc/17/79/63/1040177963.db2.gz QEIDECPBAWAJNH-CQSZACIVSA-N 1 0 346.818 3.577 20 5 EHBDRO COC(=O)c1ccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000489980366 1040284791 /nfs/dbraw/zinc/28/47/91/1040284791.db2.gz RESXXDJQWBXAJY-CQSZACIVSA-N 1 0 342.395 3.883 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000584498733 1040286810 /nfs/dbraw/zinc/28/68/10/1040286810.db2.gz CTXWLLOZSAYRQE-IBGZPJMESA-N 1 0 326.396 3.563 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000481166760 1040422611 /nfs/dbraw/zinc/42/26/11/1040422611.db2.gz GHAAAJNZKIYTBJ-GZBFAFLISA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000481187501 1040451857 /nfs/dbraw/zinc/45/18/57/1040451857.db2.gz HAOBFCYEESGPKT-XJKCOSOUSA-N 1 0 333.432 3.646 20 5 EHBDRO COc1cc(C[N@H+](C)CC2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000512667968 1040465325 /nfs/dbraw/zinc/46/53/25/1040465325.db2.gz HVVIIIORUIMZEK-UHFFFAOYSA-N 1 0 344.358 3.827 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1CCCN(c2ccccc2)C1 ZINC000490366272 1040515837 /nfs/dbraw/zinc/51/58/37/1040515837.db2.gz KMBOUHGWJJVUCQ-GOSISDBHSA-N 1 0 343.402 3.835 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192847115 1040576634 /nfs/dbraw/zinc/57/66/34/1040576634.db2.gz BBPDWWNWHKGRLP-INIZCTEOSA-N 1 0 331.441 3.878 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000433067322 1040622635 /nfs/dbraw/zinc/62/26/35/1040622635.db2.gz MYYXLHGWOWYTHE-INIZCTEOSA-N 1 0 331.441 3.914 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600198326 1040820855 /nfs/dbraw/zinc/82/08/55/1040820855.db2.gz WMOWPLBDTPRTQR-HOCLYGCPSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078766 1040885599 /nfs/dbraw/zinc/88/55/99/1040885599.db2.gz QATRPIVWONYKFH-JKSUJKDBSA-N 1 0 349.450 3.820 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)C2)CC1 ZINC000491082034 1040888117 /nfs/dbraw/zinc/88/81/17/1040888117.db2.gz ZJGWCSSBLSKPTQ-MRXNPFEDSA-N 1 0 349.450 3.678 20 5 EHBDRO Cc1cnc(C2CC[NH+](CCOc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000433148773 1040909735 /nfs/dbraw/zinc/90/97/35/1040909735.db2.gz RUKQRBLINMUOEN-UHFFFAOYSA-N 1 0 347.440 3.618 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000433157846 1040939986 /nfs/dbraw/zinc/93/99/86/1040939986.db2.gz NVXBQRSEEVIWMN-IRXDYDNUSA-N 1 0 343.427 3.803 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)nc12 ZINC000156319769 1040977932 /nfs/dbraw/zinc/97/79/32/1040977932.db2.gz XRTHKVGQKDBSLJ-OAHLLOKOSA-N 1 0 338.411 3.753 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(CO)CC2(CCC2)C1 ZINC000433188789 1041030600 /nfs/dbraw/zinc/03/06/00/1041030600.db2.gz RATGJPOESOSAHY-NVNXTCNLSA-N 1 0 330.428 3.531 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433280783 1041193857 /nfs/dbraw/zinc/19/38/57/1041193857.db2.gz FHJKDPPLJPTQPI-ACJLOTCBSA-N 1 0 325.412 3.933 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](CO)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433283863 1041232951 /nfs/dbraw/zinc/23/29/51/1041232951.db2.gz PQDKSPIUFLRMMF-QZTJIDSGSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000302829742 1041294522 /nfs/dbraw/zinc/29/45/22/1041294522.db2.gz JZJQZONPDRCAIM-CQSZACIVSA-N 1 0 332.448 3.629 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccco1 ZINC000111221279 1042250904 /nfs/dbraw/zinc/25/09/04/1042250904.db2.gz VFDDZNJJSSHIOW-CYBMUJFWSA-N 1 0 343.305 3.921 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000549576371 1042356037 /nfs/dbraw/zinc/35/60/37/1042356037.db2.gz MCQYETKJPYOVQI-OAHLLOKOSA-N 1 0 344.242 3.824 20 5 EHBDRO Cc1ccc(NC(=O)/C=C/c2ccccc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000072840903 1042603918 /nfs/dbraw/zinc/60/39/18/1042603918.db2.gz VANZXQXZSRHDCF-PKNBQFBNSA-N 1 0 339.395 3.617 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165435251 1042814426 /nfs/dbraw/zinc/81/44/26/1042814426.db2.gz SEUBGSDNDNVAGX-OLZOCXBDSA-N 1 0 342.399 3.806 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)CCc1ccccc1)CCC2 ZINC000568954420 1042915236 /nfs/dbraw/zinc/91/52/36/1042915236.db2.gz SMQQYIRYDQJQRJ-ICSRJNTNSA-N 1 0 340.423 3.556 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CC=CCC1 ZINC000344030523 1043124317 /nfs/dbraw/zinc/12/43/17/1043124317.db2.gz BUJRFLLTAWBUPM-UONOGXRCSA-N 1 0 342.399 3.994 20 5 EHBDRO C[C@@H]1CCSCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279259952 1043667389 /nfs/dbraw/zinc/66/73/89/1043667389.db2.gz MAQMXLSQKHEHSX-GFCCVEGCSA-N 1 0 333.413 3.577 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728900056 1043813825 /nfs/dbraw/zinc/81/38/25/1043813825.db2.gz BBYLZYDCFCLLQK-SFHVURJKSA-N 1 0 328.416 3.926 20 5 EHBDRO CCC[NH+]1CCC(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279444173 1044090789 /nfs/dbraw/zinc/09/07/89/1044090789.db2.gz HSTYRCWEVBQLJL-UHFFFAOYSA-N 1 0 345.365 3.578 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210002 1044160899 /nfs/dbraw/zinc/16/08/99/1044160899.db2.gz BQBYPBXYTWTOGL-WMZOPIPTSA-N 1 0 331.460 3.681 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000183491128 1125575328 /nfs/dbraw/zinc/57/53/28/1125575328.db2.gz LBXRRRCEOOPOQG-CYBMUJFWSA-N 1 0 330.432 3.537 20 5 EHBDRO COc1ccccc1CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154546376 1125728601 /nfs/dbraw/zinc/72/86/01/1125728601.db2.gz OLRKODYXCMCNRT-SFHVURJKSA-N 1 0 340.423 3.757 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185876079 1127181426 /nfs/dbraw/zinc/18/14/26/1127181426.db2.gz PNRKMSQTMGYSIX-AWEZNQCLSA-N 1 0 330.388 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(CN3CCCc4sccc4C3)nc2c1 ZINC000083171057 1127225028 /nfs/dbraw/zinc/22/50/28/1127225028.db2.gz GIOPEHKTCNKWNP-UHFFFAOYSA-N 1 0 329.381 3.746 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(OCC2CC2)nc1 ZINC000131339268 1127629523 /nfs/dbraw/zinc/62/95/23/1127629523.db2.gz RVVPSNPZYWFNJB-AWEZNQCLSA-N 1 0 341.411 3.938 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000172171396 1127798858 /nfs/dbraw/zinc/79/88/58/1127798858.db2.gz UHIUAKVAROPBOS-NEPJUHHUSA-N 1 0 330.388 3.874 20 5 EHBDRO CNC(=O)[C@H]1CCC[C@H]1[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000765798015 1128380338 /nfs/dbraw/zinc/38/03/38/1128380338.db2.gz UFYBVNIKSQIHOM-PZJWPPBQSA-N 1 0 332.447 3.997 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301477187 1128467142 /nfs/dbraw/zinc/46/71/42/1128467142.db2.gz PBOLRGWQDHXHFW-LBPRGKRZSA-N 1 0 331.338 3.534 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301477186 1128468165 /nfs/dbraw/zinc/46/81/65/1128468165.db2.gz PBOLRGWQDHXHFW-GFCCVEGCSA-N 1 0 331.338 3.534 20 5 EHBDRO COc1cc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)ccc1[N+](=O)[O-] ZINC000301568748 1128497377 /nfs/dbraw/zinc/49/73/77/1128497377.db2.gz XEMCVUWMSJTRLK-INIZCTEOSA-N 1 0 347.459 3.696 20 5 EHBDRO C[C@H](C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000553935455 1128590072 /nfs/dbraw/zinc/59/00/72/1128590072.db2.gz CMEBPWFANGUMAT-CVEARBPZSA-N 1 0 328.412 3.581 20 5 EHBDRO COC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000554374777 1128638430 /nfs/dbraw/zinc/63/84/30/1128638430.db2.gz ZRGNCKYNOCTHBK-INIZCTEOSA-N 1 0 334.803 3.768 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000123146307 1128654620 /nfs/dbraw/zinc/65/46/20/1128654620.db2.gz YTZAUBMTSKRPOU-GOSISDBHSA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]C2(c3ccc(F)cc3)CCC2)cc1 ZINC000609194395 1120543479 /nfs/dbraw/zinc/54/34/79/1120543479.db2.gz YMKUJKAKHVTTMJ-UHFFFAOYSA-N 1 0 330.359 3.782 20 5 EHBDRO C[C@H](CO)CCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494956156 1120914345 /nfs/dbraw/zinc/91/43/45/1120914345.db2.gz UHCZUWMOCCCTMC-HNAYVOBHSA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1nc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000301692002 1128958535 /nfs/dbraw/zinc/95/85/35/1128958535.db2.gz XYGKZANBBDIXJU-HNNXBMFYSA-N 1 0 346.475 3.779 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]2CCCO[C@@H]21 ZINC000495440383 1121204915 /nfs/dbraw/zinc/20/49/15/1121204915.db2.gz RRSJVAIXWPKYTK-IMJJTQAJSA-N 1 0 338.835 3.584 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C\c1ccc([N+](=O)[O-])cc1 ZINC000254964514 1128971532 /nfs/dbraw/zinc/97/15/32/1128971532.db2.gz ZIEXWGQQUGEBKB-FLIBITNWSA-N 1 0 339.395 3.617 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@H]2CC[N@@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663271 1121561258 /nfs/dbraw/zinc/56/12/58/1121561258.db2.gz PXQLMBNSJXFWRQ-ZBFHGGJFSA-N 1 0 347.459 3.661 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@H]21 ZINC000301726915 1128998836 /nfs/dbraw/zinc/99/88/36/1128998836.db2.gz VMMSMZOUGUFLHJ-BXUZGUMPSA-N 1 0 343.349 3.534 20 5 EHBDRO C[C@@H](C[C@@H]1CCCO1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333103 1129002315 /nfs/dbraw/zinc/00/23/15/1129002315.db2.gz WGRUHMROZABVMO-LRDDRELGSA-N 1 0 347.440 3.766 20 5 EHBDRO COCC[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272619777 1121787368 /nfs/dbraw/zinc/78/73/68/1121787368.db2.gz XWJAHJIFWSVMNB-GDBMZVCRSA-N 1 0 332.400 3.876 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000301737762 1129013886 /nfs/dbraw/zinc/01/38/86/1129013886.db2.gz IPRLWUZLOQZDCD-OAHLLOKOSA-N 1 0 346.818 3.892 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000488085275 1122088173 /nfs/dbraw/zinc/08/81/73/1122088173.db2.gz RWLWORAGHBYNDN-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc(F)cc2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000301137418 1122098005 /nfs/dbraw/zinc/09/80/05/1122098005.db2.gz CFLDSGHSZXXJTJ-INIZCTEOSA-N 1 0 333.363 3.884 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301193507 1122459809 /nfs/dbraw/zinc/45/98/09/1122459809.db2.gz SRTZPHWGHWHIJE-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCCC[C@@H]([NH+]3CCCC3)C2)c2ccncc21 ZINC000301212260 1122921488 /nfs/dbraw/zinc/92/14/88/1122921488.db2.gz XNCBSBBVENOWPY-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO CCC[N@H+](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609771662 1123659923 /nfs/dbraw/zinc/65/99/23/1123659923.db2.gz VMCCMJNPYPJYHR-UHFFFAOYSA-N 1 0 343.383 3.667 20 5 EHBDRO CC(C)[N@H+](C)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762367 1123662969 /nfs/dbraw/zinc/66/29/69/1123662969.db2.gz DVMHYGMAWIADFP-UHFFFAOYSA-N 1 0 343.383 3.666 20 5 EHBDRO CC[C@@H](C[NH+]1CCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000609839904 1123678232 /nfs/dbraw/zinc/67/82/32/1123678232.db2.gz IIUWLWPAPLQZIN-LBPRGKRZSA-N 1 0 342.237 3.644 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000130782641 1123731058 /nfs/dbraw/zinc/73/10/58/1123731058.db2.gz AIIBYIGRSPLDBX-KXBFYZLASA-N 1 0 328.412 3.548 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000610133755 1123738869 /nfs/dbraw/zinc/73/88/69/1123738869.db2.gz SUFGRGRJXAHMFI-DGCLKSJQSA-N 1 0 345.365 3.923 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccnc1OC(C)C ZINC000615722615 1123863656 /nfs/dbraw/zinc/86/36/56/1123863656.db2.gz QRQAXWRDOZECMI-XNTDXEJSSA-N 1 0 341.411 3.970 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836027 1123884309 /nfs/dbraw/zinc/88/43/09/1123884309.db2.gz HCDDJXOIXIMFDU-SCOADAFUSA-N 1 0 326.400 3.601 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](OC(F)F)C1 ZINC000615837610 1123885314 /nfs/dbraw/zinc/88/53/14/1123885314.db2.gz LAPDJOXDGHTNGX-PINLSGDHSA-N 1 0 326.343 3.702 20 5 EHBDRO CC[NH+](CC)[C@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000617727993 1124753748 /nfs/dbraw/zinc/75/37/48/1124753748.db2.gz QOEGEVASXWYMSV-YJBOKZPZSA-N 1 0 349.475 3.571 20 5 EHBDRO C[C@H](C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000735077183 1131307816 /nfs/dbraw/zinc/30/78/16/1131307816.db2.gz GZNGZIZNYXLWQS-MRXNPFEDSA-N 1 0 325.412 3.521 20 5 EHBDRO CN1Cc2ccccc2[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000618572319 1125115116 /nfs/dbraw/zinc/11/51/16/1125115116.db2.gz TVPRCJXFFRPEMN-UXHICEINSA-N 1 0 337.423 3.749 20 5 EHBDRO CC[C@H](Cc1cccs1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618618680 1125135770 /nfs/dbraw/zinc/13/57/70/1125135770.db2.gz KOUDFPHRHVEHQG-LLVKDONJSA-N 1 0 330.413 3.644 20 5 EHBDRO Cc1ccc(C(=O)Nc2ccccc2Nc2cc[nH+]cc2)cc1[N+](=O)[O-] ZINC000619582098 1125367716 /nfs/dbraw/zinc/36/77/16/1125367716.db2.gz XKJWDOLEOHEVKJ-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO Cc1cc(C(=O)Nc2ccccc2Nc2cc[nH+]cc2)cc([N+](=O)[O-])c1 ZINC000619581878 1125368093 /nfs/dbraw/zinc/36/80/93/1125368093.db2.gz UBSAVWBBTMNWSL-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H](C)c1ccsc1 ZINC000619754269 1125395360 /nfs/dbraw/zinc/39/53/60/1125395360.db2.gz FJORAUWNBPPQAM-NEPJUHHUSA-N 1 0 333.413 3.724 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C\c1cccc([N+](=O)[O-])c1 ZINC000255710186 1129184733 /nfs/dbraw/zinc/18/47/33/1129184733.db2.gz KOOPBSYVKSBUEZ-KTKRTIGZSA-N 1 0 339.395 3.617 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000079724074 1129289976 /nfs/dbraw/zinc/28/99/76/1129289976.db2.gz KXGBNCQBUTUPKU-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@H]21 ZINC000301901922 1129310584 /nfs/dbraw/zinc/31/05/84/1129310584.db2.gz NUTKGGYHIPRQAZ-GOEBONIOSA-N 1 0 347.459 3.693 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@@H]1C1CC1 ZINC000543242304 1129365887 /nfs/dbraw/zinc/36/58/87/1129365887.db2.gz JYRCIKWWZPTKFE-MOPGFXCFSA-N 1 0 342.395 3.902 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC001168722146 1129449614 /nfs/dbraw/zinc/44/96/14/1129449614.db2.gz CLODHVSCRHTEQJ-OAHLLOKOSA-N 1 0 344.411 3.950 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ccco2)c2ccccc2)cc1 ZINC000543423500 1129480445 /nfs/dbraw/zinc/48/04/45/1129480445.db2.gz XATUBPPPVIWHJN-LJQANCHMSA-N 1 0 338.363 3.946 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000543427514 1129483052 /nfs/dbraw/zinc/48/30/52/1129483052.db2.gz BHVFJDDAZVMMES-CABCVRRESA-N 1 0 332.400 3.795 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000301996914 1129507104 /nfs/dbraw/zinc/50/71/04/1129507104.db2.gz HWJWMIYDVZQDFV-OAHLLOKOSA-N 1 0 331.441 3.615 20 5 EHBDRO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884139 1129547749 /nfs/dbraw/zinc/54/77/49/1129547749.db2.gz RAWDOSCMDNCLJR-SWLSCSKDSA-N 1 0 326.824 3.764 20 5 EHBDRO Cn1cc(C[N@H+](C)Cc2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154464339 1129560939 /nfs/dbraw/zinc/56/09/39/1129560939.db2.gz DGVNCGPBGWZBOE-UHFFFAOYSA-N 1 0 336.395 3.627 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000092785565 1129561084 /nfs/dbraw/zinc/56/10/84/1129561084.db2.gz PDGVPFBDGGNBAQ-KOEDOTQGSA-N 1 0 329.444 3.558 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3C[C@@H]4CCC[C@H]4C3)cs2)c1 ZINC000093442937 1129588349 /nfs/dbraw/zinc/58/83/49/1129588349.db2.gz XLQLIOQXVGIDJG-KBPBESRZSA-N 1 0 329.425 3.950 20 5 EHBDRO CC(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1ccc(F)cc1 ZINC000735872694 1131384437 /nfs/dbraw/zinc/38/44/37/1131384437.db2.gz QKEPYWBOEBLFCQ-LJQANCHMSA-N 1 0 346.402 3.926 20 5 EHBDRO COCc1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000124375243 1129601966 /nfs/dbraw/zinc/60/19/66/1129601966.db2.gz YEYNQAKNFXBGKY-LJQANCHMSA-N 1 0 340.423 3.852 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154970907 1129602511 /nfs/dbraw/zinc/60/25/11/1129602511.db2.gz IINMUZQPCFBYAV-UGSOOPFHSA-N 1 0 331.391 3.687 20 5 EHBDRO COc1cc(CN2C[C@@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000093867490 1129606092 /nfs/dbraw/zinc/60/60/92/1129606092.db2.gz LETJSUZTAXLHLD-YJYMSZOUSA-N 1 0 342.395 3.805 20 5 EHBDRO CCC[C@@H]([NH2+]CCCN1CCCCCC1=O)c1cccc([N+](=O)[O-])c1 ZINC000155522875 1129645376 /nfs/dbraw/zinc/64/53/76/1129645376.db2.gz ZASDVCQPQKSOFX-GOSISDBHSA-N 1 0 347.459 3.818 20 5 EHBDRO C[C@@H]([NH2+]CCn1ccnc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000155630413 1129653911 /nfs/dbraw/zinc/65/39/11/1129653911.db2.gz KSTSISSNHNADKS-CYBMUJFWSA-N 1 0 342.424 3.871 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304729 1129660242 /nfs/dbraw/zinc/66/02/42/1129660242.db2.gz UJLAKCPTEFGDAT-HUUCEWRRSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(OC2CCCCC2)CC1 ZINC000125431268 1129691280 /nfs/dbraw/zinc/69/12/80/1129691280.db2.gz ANWYDAOSAHQCKF-UHFFFAOYSA-N 1 0 348.443 3.787 20 5 EHBDRO Cc1cc(N2CCOC3(CCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302064139 1129766422 /nfs/dbraw/zinc/76/64/22/1129766422.db2.gz DMEFZAUDPODFAZ-UHFFFAOYSA-N 1 0 327.384 3.601 20 5 EHBDRO Cc1cc(NC2CC[NH+](C(C)C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302129840 1129768916 /nfs/dbraw/zinc/76/89/16/1129768916.db2.gz BQXSJYJTODDREI-UHFFFAOYSA-N 1 0 328.416 3.736 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000302164690 1129771354 /nfs/dbraw/zinc/77/13/54/1129771354.db2.gz QTXATGNMVGQZKL-UHFFFAOYSA-N 1 0 343.374 3.871 20 5 EHBDRO Cc1cc(NCc2cccc3c2OCO3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302186434 1129772491 /nfs/dbraw/zinc/77/24/91/1129772491.db2.gz PLCJARIUAJBFOA-UHFFFAOYSA-N 1 0 337.335 3.792 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1F ZINC000056197018 1129806054 /nfs/dbraw/zinc/80/60/54/1129806054.db2.gz XPPKPPRQHOSSCX-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCCSCc1ccccc1)CC2 ZINC000347801495 1129824568 /nfs/dbraw/zinc/82/45/68/1129824568.db2.gz UOPKFDUZFKAJQA-UHFFFAOYSA-N 1 0 343.452 3.671 20 5 EHBDRO O=[N+]([O-])c1cnc(NCc2ccccc2C[NH+]2CCCC2)c(Cl)c1 ZINC000172408330 1130131370 /nfs/dbraw/zinc/13/13/70/1130131370.db2.gz JSVVQALBGKBSAO-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245446193 1130208381 /nfs/dbraw/zinc/20/83/81/1130208381.db2.gz ZOENFVFMFGQBDH-QWQRMKEZSA-N 1 0 339.395 3.615 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173418584 1130228274 /nfs/dbraw/zinc/22/82/74/1130228274.db2.gz HQDQPLPGHUAJFS-RDJZCZTQSA-N 1 0 325.412 3.914 20 5 EHBDRO CCCCNC(=O)[C@@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245521615 1130230820 /nfs/dbraw/zinc/23/08/20/1130230820.db2.gz LAWUPBSGLNPYMT-HZPDHXFCSA-N 1 0 347.459 3.593 20 5 EHBDRO CC[C@](C)([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000173936696 1130325591 /nfs/dbraw/zinc/32/55/91/1130325591.db2.gz HFWHAWLXRGIYSA-INIZCTEOSA-N 1 0 335.429 3.654 20 5 EHBDRO CCc1ccc(C(=O)Nc2ccc(C)cc2C[NH+](C)C)cc1[N+](=O)[O-] ZINC000174238282 1130342662 /nfs/dbraw/zinc/34/26/62/1130342662.db2.gz RXWRDFLDAAEYDR-UHFFFAOYSA-N 1 0 341.411 3.780 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCO[C@@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000246559409 1130391752 /nfs/dbraw/zinc/39/17/52/1130391752.db2.gz XCCWITFNBDFPRB-XIRDDKMYSA-N 1 0 336.457 3.690 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(Nc3cnn(-c4cc[nH+]cc4)c3)sc2c1 ZINC000731210072 1130776915 /nfs/dbraw/zinc/77/69/15/1130776915.db2.gz MFMUWTKXNIRHCE-UHFFFAOYSA-N 1 0 338.352 3.529 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731206959 1130778690 /nfs/dbraw/zinc/77/86/90/1130778690.db2.gz XHQWGCZLQHHGMI-UHFFFAOYSA-N 1 0 348.472 3.761 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766193679 1131159293 /nfs/dbraw/zinc/15/92/93/1131159293.db2.gz OKJPVGATYSTPIE-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](Cn2cccn2)c2ccccc2)cc1[N+](=O)[O-] ZINC000741259381 1131591312 /nfs/dbraw/zinc/59/13/12/1131591312.db2.gz XFNDROUAAUDXRZ-GOSISDBHSA-N 1 0 336.395 3.631 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(Cl)nc1)CC2 ZINC001172896951 1131881165 /nfs/dbraw/zinc/88/11/65/1131881165.db2.gz UVCXRLMGYSJELU-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO C[C@@H](Cc1cccc(O)c1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898450 1131882413 /nfs/dbraw/zinc/88/24/13/1131882413.db2.gz AYNONCFHJKZZHH-KSSFIOAISA-N 1 0 340.423 3.769 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)ccc1F ZINC001172899552 1131882433 /nfs/dbraw/zinc/88/24/33/1131882433.db2.gz CNJQAJPYDLMWPF-INIZCTEOSA-N 1 0 344.386 3.780 20 5 EHBDRO Cc1csc([C@@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172898997 1131882513 /nfs/dbraw/zinc/88/25/13/1131882513.db2.gz KJIWLGTUXOCGCO-IUODEOHRSA-N 1 0 331.441 3.958 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172901173 1131883543 /nfs/dbraw/zinc/88/35/43/1131883543.db2.gz KIZOVSIVXMSBFK-WMZOPIPTSA-N 1 0 325.412 3.978 20 5 EHBDRO [NH2+]=C(N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cc(F)cc(F)c1 ZINC001172900658 1131884059 /nfs/dbraw/zinc/88/40/59/1131884059.db2.gz XQHLOINGTJXYPD-MRXNPFEDSA-N 1 0 345.349 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCc3c(O)cccc3C1)CC2 ZINC001172908247 1131888191 /nfs/dbraw/zinc/88/81/91/1131888191.db2.gz LEXIJFRXLPLXAW-QGZVFWFLSA-N 1 0 338.407 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](COCC3CC3)C1)CC2 ZINC001172919273 1131904058 /nfs/dbraw/zinc/90/40/58/1131904058.db2.gz FLKBJKLQVMIMJE-APWZRJJASA-N 1 0 344.455 3.591 20 5 EHBDRO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922645 1131906415 /nfs/dbraw/zinc/90/64/15/1131906415.db2.gz ZWOMGAINXXJFRZ-XJKSGUPXSA-N 1 0 348.443 3.504 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]C3CCCCC3)CC2)c(F)c1 ZINC001173007508 1131933977 /nfs/dbraw/zinc/93/39/77/1131933977.db2.gz RXFCJPDDQQWJRB-UHFFFAOYSA-N 1 0 339.386 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]CC3CCCC3)CC2)c(F)c1 ZINC001173005184 1131934330 /nfs/dbraw/zinc/93/43/30/1131934330.db2.gz DKLOSPNDEFEOAL-UHFFFAOYSA-N 1 0 339.386 3.622 20 5 EHBDRO C[N@H+](CCC1CC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015595 1131935415 /nfs/dbraw/zinc/93/54/15/1131935415.db2.gz SSFTXQIVHDWMTL-UHFFFAOYSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2cccc(C)n2)c1F ZINC001173188034 1131993574 /nfs/dbraw/zinc/99/35/74/1131993574.db2.gz HYLOYPCRNVIIBO-CHWSQXEVSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC3(C2)CCCCC3)c1F ZINC001173197225 1131997124 /nfs/dbraw/zinc/99/71/24/1131997124.db2.gz RMMBNXGPNYSVGY-CYBMUJFWSA-N 1 0 336.407 3.940 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(=O)c1ccc(Cl)cc1 ZINC001173215786 1132002025 /nfs/dbraw/zinc/00/20/25/1132002025.db2.gz ZSRRVXZMLBSQOP-GFCCVEGCSA-N 1 0 332.787 3.652 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Br)o1 ZINC001173219328 1132003120 /nfs/dbraw/zinc/00/31/20/1132003120.db2.gz AXOVZLBDAVIZLS-JTQLQIEISA-N 1 0 339.189 3.671 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCN(CC2CCCCC2)C1 ZINC001173219499 1132003224 /nfs/dbraw/zinc/00/32/24/1132003224.db2.gz COJWEAUVNCFSFX-LPHOPBHVSA-N 1 0 345.487 3.770 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221259 1132004341 /nfs/dbraw/zinc/00/43/41/1132004341.db2.gz GSEJDXUPRPRGAE-RISCZKNCSA-N 1 0 334.313 3.750 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccnc(F)c1)C1CC1 ZINC001173220686 1132004508 /nfs/dbraw/zinc/00/45/08/1132004508.db2.gz DTWYFUYIJWVLQZ-XIKOKIGWSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-c2ncccn2)cc1 ZINC001173224967 1132005466 /nfs/dbraw/zinc/00/54/66/1132005466.db2.gz PYKSKTRXBSTCQE-HNNXBMFYSA-N 1 0 348.406 3.773 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001173225940 1132006639 /nfs/dbraw/zinc/00/66/39/1132006639.db2.gz GTJQWEGJIAHDJY-UZLBHIALSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCO2 ZINC001173226854 1132007031 /nfs/dbraw/zinc/00/70/31/1132007031.db2.gz CGPFDXXHRDRACB-UONOGXRCSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1cccc([C@H](C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173230015 1132008228 /nfs/dbraw/zinc/00/82/28/1132008228.db2.gz PWKWXFNXBFIDOH-HUUCEWRRSA-N 1 0 328.412 3.928 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-c2ncco2)cc1 ZINC001173231414 1132009202 /nfs/dbraw/zinc/00/92/02/1132009202.db2.gz ZAXVKAUIGKGXRO-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001173230952 1132009266 /nfs/dbraw/zinc/00/92/66/1132009266.db2.gz WSRNGQJXCAMGPY-ACJLOTCBSA-N 1 0 328.387 3.812 20 5 EHBDRO Cc1ccccc1OC[C@@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232741 1132010240 /nfs/dbraw/zinc/01/02/40/1132010240.db2.gz FUUTUUXRWMWPIU-HZPDHXFCSA-N 1 0 328.412 3.891 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1N1CCCC1 ZINC001173212573 1132014385 /nfs/dbraw/zinc/01/43/85/1132014385.db2.gz AZZBFAXXTLRZHE-INIZCTEOSA-N 1 0 339.439 3.916 20 5 EHBDRO COc1ccc(CCC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173213819 1132015036 /nfs/dbraw/zinc/01/50/36/1132015036.db2.gz KYGBNLOBCXESEZ-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(C)(C)N(O)C(C)(C)C1 ZINC001173214656 1132015480 /nfs/dbraw/zinc/01/54/80/1132015480.db2.gz DJEHFMGNPOEGCM-CYBMUJFWSA-N 1 0 335.448 3.526 20 5 EHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H](O)c1c(F)cccc1Cl ZINC000744448183 1132102441 /nfs/dbraw/zinc/10/24/41/1132102441.db2.gz PGKYKERJFNQIJK-RTHLEPHNSA-N 1 0 344.795 3.661 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001168965926 1132621257 /nfs/dbraw/zinc/62/12/57/1132621257.db2.gz DMZWPERZBNKMRU-MNOVXSKESA-N 1 0 336.741 3.894 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168967626 1132622315 /nfs/dbraw/zinc/62/23/15/1132622315.db2.gz RKTAZUJKQVXJMP-FZMZJTMJSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC001168970171 1132622544 /nfs/dbraw/zinc/62/25/44/1132622544.db2.gz GUJNUFAWTACHMM-VXGBXAGGSA-N 1 0 334.363 3.834 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1 ZINC001168972682 1132623633 /nfs/dbraw/zinc/62/36/33/1132623633.db2.gz ASNOPXWTWRJFRY-FZMZJTMJSA-N 1 0 331.243 3.961 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168973382 1132625034 /nfs/dbraw/zinc/62/50/34/1132625034.db2.gz ONVGLUOKKVESIN-SUNKGSAMSA-N 1 0 327.222 3.545 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001169005899 1132630607 /nfs/dbraw/zinc/63/06/07/1132630607.db2.gz VQQPYZZNIBOFRD-NILFDRSVSA-N 1 0 341.249 3.935 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035320 1132636617 /nfs/dbraw/zinc/63/66/17/1132636617.db2.gz KGZRHNQMIXRWNC-ABAIWWIYSA-N 1 0 328.334 3.509 20 5 EHBDRO CC(=O)Nc1ccc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169151473 1132679114 /nfs/dbraw/zinc/67/91/14/1132679114.db2.gz KDHTYRIVZSCKHF-KSSFIOAISA-N 1 0 348.447 3.509 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[C@@H](c2ccccc2)O1 ZINC001169667939 1132814635 /nfs/dbraw/zinc/81/46/35/1132814635.db2.gz YFFZMRHXIDAXRE-PMACEKPBSA-N 1 0 340.423 3.989 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCc3cnn(C(C)C)c32)cc1[N+](=O)[O-] ZINC001178430541 1133162710 /nfs/dbraw/zinc/16/27/10/1133162710.db2.gz IBVWJYBTNHDCIF-MRXNPFEDSA-N 1 0 328.416 3.848 20 5 EHBDRO COCC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCCC1 ZINC001179142750 1133228673 /nfs/dbraw/zinc/22/86/73/1133228673.db2.gz MBQOHQKRPUOGIH-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO CCOc1ccc([C@@H]2C[C@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001179169352 1133234112 /nfs/dbraw/zinc/23/41/12/1133234112.db2.gz YNBLBOYOSKTJLK-ZWKOTPCHSA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001179621184 1133268738 /nfs/dbraw/zinc/26/87/38/1133268738.db2.gz LXZCIIBAWRDZNS-HGGPSHQYSA-N 1 0 329.425 3.852 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCCO1 ZINC001179700038 1133272123 /nfs/dbraw/zinc/27/21/23/1133272123.db2.gz MLQHPUCZGNUKTB-SFHVURJKSA-N 1 0 330.384 3.904 20 5 EHBDRO CCC[C@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001179701681 1133274405 /nfs/dbraw/zinc/27/44/05/1133274405.db2.gz VRWCXPPHQBDGDN-HNNXBMFYSA-N 1 0 334.441 3.964 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000772278754 1133672603 /nfs/dbraw/zinc/67/26/03/1133672603.db2.gz QRRHGUPQDGZRFM-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO CC(C)c1ccc(C(=O)NCCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC001182887890 1133744623 /nfs/dbraw/zinc/74/46/23/1133744623.db2.gz XSVCTHXLNJPVPT-UHFFFAOYSA-N 1 0 349.475 3.957 20 5 EHBDRO O=C(OCc1cccc([N+](=O)[O-])c1)c1cccc(C[NH+]2CCCC2)c1 ZINC000785714933 1133747044 /nfs/dbraw/zinc/74/70/44/1133747044.db2.gz PVFIWJIAGMCUNI-UHFFFAOYSA-N 1 0 340.379 3.548 20 5 EHBDRO CCOC(=O)C(CC)(CC)C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001183197211 1133778692 /nfs/dbraw/zinc/77/86/92/1133778692.db2.gz PYUUXEUHWMRNQK-UHFFFAOYSA-N 1 0 342.823 3.707 20 5 EHBDRO C[C@@H](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)[NH+](C)C ZINC001203270812 1133900056 /nfs/dbraw/zinc/90/00/56/1133900056.db2.gz OZHYQBVAOMWFHJ-ZDUSSCGKSA-N 1 0 333.457 3.753 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCc2nc(C)ncc21 ZINC000786810888 1133909512 /nfs/dbraw/zinc/90/95/12/1133909512.db2.gz BPVIFJGZFDXWCO-FHLIRTJZSA-N 1 0 338.411 3.764 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccccc1C ZINC000786816712 1133910916 /nfs/dbraw/zinc/91/09/16/1133910916.db2.gz WBKYSJQJQBPDIT-NRJHKNTJSA-N 1 0 326.396 3.630 20 5 EHBDRO Cc1ccccc1OCCC[N@@H+](C)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788477732 1134129716 /nfs/dbraw/zinc/12/97/16/1134129716.db2.gz FIBLCMZQRCWEAI-UHFFFAOYSA-N 1 0 332.375 3.943 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000788537322 1134138940 /nfs/dbraw/zinc/13/89/40/1134138940.db2.gz JHXSKLJVBLQITR-MSOLQXFVSA-N 1 0 332.375 3.582 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000788541921 1134139605 /nfs/dbraw/zinc/13/96/05/1134139605.db2.gz ZGKDXYIATDDOKQ-IDVICZFGSA-N 1 0 340.423 3.956 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000788664787 1134158902 /nfs/dbraw/zinc/15/89/02/1134158902.db2.gz KSYZHWXBJLBLKA-WDEREUQCSA-N 1 0 333.363 3.737 20 5 EHBDRO CC(C)Oc1nc(NC[C@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187064507 1134291365 /nfs/dbraw/zinc/29/13/65/1134291365.db2.gz WTYZBRMIEBYKDW-OAHLLOKOSA-N 1 0 348.447 3.596 20 5 EHBDRO C[NH+](C)CCCn1cc(Nc2cc3cccnc3c3ncccc23)cn1 ZINC001187162727 1134299818 /nfs/dbraw/zinc/29/98/18/1134299818.db2.gz DBCYUSPPGCHGFS-UHFFFAOYSA-N 1 0 346.438 3.675 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604446 1134581763 /nfs/dbraw/zinc/58/17/63/1134581763.db2.gz JPRXSFICEPHISE-PXNSSMCTSA-N 1 0 340.423 3.735 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)c([N+](=O)[O-])c1 ZINC001170296250 1134737179 /nfs/dbraw/zinc/73/71/79/1134737179.db2.gz FWDPGYIUNVKZJN-OLZOCXBDSA-N 1 0 330.384 3.591 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170304712 1134739055 /nfs/dbraw/zinc/73/90/55/1134739055.db2.gz GDMDZPIDSDDJLY-DOPJRALCSA-N 1 0 326.396 3.680 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170305767 1134739728 /nfs/dbraw/zinc/73/97/28/1134739728.db2.gz PKQUBQXBADMEFM-LIRRHRJNSA-N 1 0 343.427 3.916 20 5 EHBDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386077 1134762112 /nfs/dbraw/zinc/76/21/12/1134762112.db2.gz MJQXZTJMKUYTKS-LSDHHAIUSA-N 1 0 326.824 3.930 20 5 EHBDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386072 1134762637 /nfs/dbraw/zinc/76/26/37/1134762637.db2.gz MJQXZTJMKUYTKS-CABCVRRESA-N 1 0 326.824 3.930 20 5 EHBDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879229 1134810924 /nfs/dbraw/zinc/81/09/24/1134810924.db2.gz GPKSEPOWJBUJNU-ZFWWWQNUSA-N 1 0 339.417 3.657 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000775549866 1135060894 /nfs/dbraw/zinc/06/08/94/1135060894.db2.gz QKEJCUVAGAGOHR-ACJLOTCBSA-N 1 0 332.375 3.735 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001193808055 1135187105 /nfs/dbraw/zinc/18/71/05/1135187105.db2.gz QKKIGXFNEZGWBH-CQSZACIVSA-N 1 0 333.432 3.682 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC001194221996 1135245850 /nfs/dbraw/zinc/24/58/50/1135245850.db2.gz PAHFZACZBJKRNW-UHFFFAOYSA-N 1 0 349.475 3.690 20 5 EHBDRO CO[C@@H]1[C@@H](C)[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC001194458719 1135270186 /nfs/dbraw/zinc/27/01/86/1135270186.db2.gz TULWHEYSGKDACG-CUOATXAZSA-N 1 0 346.349 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@]3(CCSC3)C2)cc1 ZINC001195093187 1135369000 /nfs/dbraw/zinc/36/90/00/1135369000.db2.gz IABQWOUUZVTZJY-KRWDZBQOSA-N 1 0 336.457 3.583 20 5 EHBDRO Cc1ccc(CC(C)(C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC001195280529 1135404535 /nfs/dbraw/zinc/40/45/35/1135404535.db2.gz VJFFDMNFMAJDOV-UHFFFAOYSA-N 1 0 328.412 3.893 20 5 EHBDRO Cc1c(C[N@H+]2CC[C@H](C)[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495923 1135434266 /nfs/dbraw/zinc/43/42/66/1135434266.db2.gz AZTAXIBMQFYEQG-XJKSGUPXSA-N 1 0 348.443 3.703 20 5 EHBDRO CN(CCC[NH+](C)C)c1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000775681596 1135505161 /nfs/dbraw/zinc/50/51/61/1135505161.db2.gz DSOBOKWWVFYTBJ-UHFFFAOYSA-N 1 0 339.745 3.655 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1cc([N+](=O)[O-])ccc1C(C)=O)c1ccco1 ZINC000807944486 1135594327 /nfs/dbraw/zinc/59/43/27/1135594327.db2.gz CRFQORFYHLVXJG-KRWDZBQOSA-N 1 0 345.399 3.885 20 5 EHBDRO C[C@@H](Cc1cccc(F)c1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000808727403 1135723480 /nfs/dbraw/zinc/72/34/80/1135723480.db2.gz DPEAZJWFNUAWPD-ZDUSSCGKSA-N 1 0 341.386 3.979 20 5 EHBDRO CN(CCC[NH+]1CCCC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000810002060 1135912665 /nfs/dbraw/zinc/91/26/65/1135912665.db2.gz ROQSISOXFLVNAA-UHFFFAOYSA-N 1 0 346.258 3.819 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006295 1135913069 /nfs/dbraw/zinc/91/30/69/1135913069.db2.gz IONOOZLGSUXEGB-WMZOPIPTSA-N 1 0 345.830 3.783 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000776024501 1135928427 /nfs/dbraw/zinc/92/84/27/1135928427.db2.gz QSKHLIKLIQVOBH-RTBURBONSA-N 1 0 342.439 3.974 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000776024500 1135928430 /nfs/dbraw/zinc/92/84/30/1135928430.db2.gz QSKHLIKLIQVOBH-RBUKOAKNSA-N 1 0 342.439 3.974 20 5 EHBDRO C[NH+]1CCC(c2ccc(Nc3cc(O)cc([N+](=O)[O-])c3)cc2)CC1 ZINC001201221426 1136000017 /nfs/dbraw/zinc/00/00/17/1136000017.db2.gz BJPYNEZDRKHHDY-UHFFFAOYSA-N 1 0 327.384 3.853 20 5 EHBDRO COc1ccc([C@H](OC)[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001201704132 1136054072 /nfs/dbraw/zinc/05/40/72/1136054072.db2.gz MEJGGIOMYRQDKY-IFXJQAMLSA-N 1 0 344.411 3.778 20 5 EHBDRO CC[C@@H](C)[N@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811477082 1136096540 /nfs/dbraw/zinc/09/65/40/1136096540.db2.gz DKXMSMVWPGSGIR-SNVBAGLBSA-N 1 0 334.247 3.722 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccc(F)c2cccnc12 ZINC001202227563 1136113504 /nfs/dbraw/zinc/11/35/04/1136113504.db2.gz MSEYJTIPLBNYNB-UHFFFAOYSA-N 1 0 325.343 3.614 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCc1ccccc1F ZINC001202241592 1136119057 /nfs/dbraw/zinc/11/90/57/1136119057.db2.gz DXMCECKTPXGOLS-UHFFFAOYSA-N 1 0 332.375 3.855 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279698 1136134626 /nfs/dbraw/zinc/13/46/26/1136134626.db2.gz XENNFJNEXIYUNE-QZTJIDSGSA-N 1 0 330.359 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776279694 1136134808 /nfs/dbraw/zinc/13/48/08/1136134808.db2.gz XENNFJNEXIYUNE-MSOLQXFVSA-N 1 0 330.359 3.604 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1c(Cl)nccc1[N+](=O)[O-] ZINC001170679976 1136219363 /nfs/dbraw/zinc/21/93/63/1136219363.db2.gz OHMINGUBWQBBRY-JTQLQIEISA-N 1 0 343.774 3.516 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000812772945 1136244730 /nfs/dbraw/zinc/24/47/30/1136244730.db2.gz SXDZGPROOBCXOI-AWEZNQCLSA-N 1 0 333.215 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc2c(c1)CCCO2 ZINC000850431900 1136257488 /nfs/dbraw/zinc/25/74/88/1136257488.db2.gz MSEJNWIWDDCPLU-CYBMUJFWSA-N 1 0 342.395 3.779 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000850437084 1136258772 /nfs/dbraw/zinc/25/87/72/1136258772.db2.gz ZCJWUWGRTRDVRM-OAVHHTNSSA-N 1 0 348.374 3.515 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812851221 1136261461 /nfs/dbraw/zinc/26/14/61/1136261461.db2.gz QOSAXEJOFLIJFB-HNAYVOBHSA-N 1 0 328.412 3.847 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCc1nsc3ccccc31)C2 ZINC000851869366 1136414638 /nfs/dbraw/zinc/41/46/38/1136414638.db2.gz FNWJLFNRUKFTCH-UHFFFAOYSA-N 1 0 339.420 3.805 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](c1ccccc1)C1CCOCC1 ZINC000851901008 1136417923 /nfs/dbraw/zinc/41/79/23/1136417923.db2.gz BZCHTGNNYROCQO-LJQANCHMSA-N 1 0 344.386 3.991 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccsc1)[C@H]1CC[C@H](O)CC1 ZINC000852205379 1136440072 /nfs/dbraw/zinc/44/00/72/1136440072.db2.gz ZCHPHBYWCDUNMS-QAQDUYKDSA-N 1 0 346.452 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@@H]2Cc2ccccc2)cc1 ZINC000776581263 1136444518 /nfs/dbraw/zinc/44/45/18/1136444518.db2.gz GEQAPSOUFLUXIZ-WOJBJXKFSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H](c2ccccc2)C2CCC2)cc1 ZINC000776591787 1136453127 /nfs/dbraw/zinc/45/31/27/1136453127.db2.gz HDXLLIQWLBYVTD-RTBURBONSA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000814641828 1136488541 /nfs/dbraw/zinc/48/85/41/1136488541.db2.gz LLGDTLVAUICKSI-MJGOQNOKSA-N 1 0 326.396 3.508 20 5 EHBDRO COc1ccccc1[C@H](O)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000853092877 1136507891 /nfs/dbraw/zinc/50/78/91/1136507891.db2.gz RLEXKCPTRDKSIL-GOSISDBHSA-N 1 0 344.411 3.550 20 5 EHBDRO Cc1cccc2c1CCC[C@@H]2[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000853126135 1136512385 /nfs/dbraw/zinc/51/23/85/1136512385.db2.gz BXHDUDWFAPKGGD-OALUTQOASA-N 1 0 326.396 3.604 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000814909704 1136523512 /nfs/dbraw/zinc/52/35/12/1136523512.db2.gz PJALSZQRMZKFCN-OAHLLOKOSA-N 1 0 344.242 3.824 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556081 1136610143 /nfs/dbraw/zinc/61/01/43/1136610143.db2.gz NPIVZIJAADQLTF-OLZOCXBDSA-N 1 0 329.400 3.988 20 5 EHBDRO Cc1ccc(OCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)c1 ZINC000815567496 1136611844 /nfs/dbraw/zinc/61/18/44/1136611844.db2.gz BCSXUHJMIJIFKD-CQSZACIVSA-N 1 0 329.400 3.523 20 5 EHBDRO Cc1ccc2c(c1C)OC[C@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591954 1136615892 /nfs/dbraw/zinc/61/58/92/1136615892.db2.gz VGTRAOUEDWLBCM-MLGOLLRUSA-N 1 0 327.384 3.578 20 5 EHBDRO CCCCCn1cc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)n1 ZINC000815600096 1136617035 /nfs/dbraw/zinc/61/70/35/1136617035.db2.gz LLTWEZYCMFMONY-ZDUSSCGKSA-N 1 0 345.447 3.723 20 5 EHBDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCO1 ZINC000815614705 1136618790 /nfs/dbraw/zinc/61/87/90/1136618790.db2.gz ZBQGPGFZFQCPTH-PNPHSEOMSA-N 1 0 335.448 3.811 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCC[C@@H](C)[C@@H]1C ZINC000218478794 1136819303 /nfs/dbraw/zinc/81/93/03/1136819303.db2.gz YQKXGEKHLKTQKS-HACGYAERSA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)(C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000818984444 1136896738 /nfs/dbraw/zinc/89/67/38/1136896738.db2.gz HSUJIPYWVCSXKU-KRWDZBQOSA-N 1 0 348.830 3.849 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CCCc2ccc(Cl)cc2)c1 ZINC000818990900 1136897771 /nfs/dbraw/zinc/89/77/71/1136897771.db2.gz RPYKNPOPWAIHJG-QGZVFWFLSA-N 1 0 334.803 3.504 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000173368064 1136898145 /nfs/dbraw/zinc/89/81/45/1136898145.db2.gz AZKJZZMZXIAPQX-CYBMUJFWSA-N 1 0 327.384 3.629 20 5 EHBDRO Cc1ccc(SC[C@@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819238626 1136923458 /nfs/dbraw/zinc/92/34/58/1136923458.db2.gz LBAGTXNWNKOSTL-KDOFPFPSSA-N 1 0 346.452 3.707 20 5 EHBDRO Cc1ccc(SC[C@@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819238628 1136923477 /nfs/dbraw/zinc/92/34/77/1136923477.db2.gz LBAGTXNWNKOSTL-RDTXWAMCSA-N 1 0 346.452 3.707 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000819251888 1136924531 /nfs/dbraw/zinc/92/45/31/1136924531.db2.gz VWJRAYKADMIHRJ-IMFGXOCKSA-N 1 0 340.423 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000819282479 1136927653 /nfs/dbraw/zinc/92/76/53/1136927653.db2.gz GJVCCLNPNRFLPL-QGPMSJSTSA-N 1 0 346.814 3.817 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000819261320 1136929679 /nfs/dbraw/zinc/92/96/79/1136929679.db2.gz JIIQRLNMUITVNP-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000819274213 1136930635 /nfs/dbraw/zinc/93/06/35/1136930635.db2.gz FSGBDJAFJODHSH-LSBZLQRGSA-N 1 0 344.386 3.693 20 5 EHBDRO CCSc1cccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000819328019 1136931379 /nfs/dbraw/zinc/93/13/79/1136931379.db2.gz KVODQPFVAZDJFT-QGZVFWFLSA-N 1 0 332.425 3.530 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858015371 1136931984 /nfs/dbraw/zinc/93/19/84/1136931984.db2.gz UOQQFCFJZKUTIU-SFHVURJKSA-N 1 0 339.395 3.521 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000819338984 1136932718 /nfs/dbraw/zinc/93/27/18/1136932718.db2.gz FMUKDXVDKJTRGJ-MISYRCLQSA-N 1 0 340.423 3.802 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1F ZINC000860104070 1137044441 /nfs/dbraw/zinc/04/44/41/1137044441.db2.gz GJEOFTLXMCNVKW-AWEZNQCLSA-N 1 0 348.349 3.871 20 5 EHBDRO Cc1c(-c2noc([C@@H]3C[C@H]4CCCC[C@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000823269644 1137092415 /nfs/dbraw/zinc/09/24/15/1137092415.db2.gz JSFHXQQXXAWJIX-BNOWGMLFSA-N 1 0 328.372 3.546 20 5 EHBDRO CC(C)C[NH+]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC001649164287 1137110434 /nfs/dbraw/zinc/11/04/34/1137110434.db2.gz SEMSQBRCPRQVHU-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CC[C@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000824661327 1137147109 /nfs/dbraw/zinc/14/71/09/1137147109.db2.gz VTKZQMWBGXLCCE-TUPIDYKKSA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000862541564 1137149456 /nfs/dbraw/zinc/14/94/56/1137149456.db2.gz WIKLBYKXPVPKCK-ZDUSSCGKSA-N 1 0 332.787 3.943 20 5 EHBDRO CC[C@H](CCc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000863572002 1137192329 /nfs/dbraw/zinc/19/23/29/1137192329.db2.gz IIYLIVJEZJGWJE-IEBWSBKVSA-N 1 0 328.412 3.629 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(F)cc1OCc1ccc2c(c1)C[NH2+]CC2 ZINC000844301332 1137210420 /nfs/dbraw/zinc/21/04/20/1137210420.db2.gz SKASXNUQGBRXAS-UHFFFAOYSA-N 1 0 336.750 3.612 20 5 EHBDRO OCCN1CCCC[C@@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513958 1137236719 /nfs/dbraw/zinc/23/67/19/1137236719.db2.gz SGMVAOWKJWJCRT-HXUWFJFHSA-N 1 0 348.490 3.929 20 5 EHBDRO CC[NH+](CC)[C@H](CNC(=O)c1c(C)ccc([N+](=O)[O-])c1C)CC(C)C ZINC001144198257 1137250192 /nfs/dbraw/zinc/25/01/92/1137250192.db2.gz ZUKZUSXOJRITJR-INIZCTEOSA-N 1 0 349.475 3.698 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000865783063 1137311518 /nfs/dbraw/zinc/31/15/18/1137311518.db2.gz FWRLPAOZBUGVQB-TZRMAHHFSA-N 1 0 330.428 3.650 20 5 EHBDRO C[NH+]1CCC2(CC1)CN(c1ccsc1[N+](=O)[O-])Cc1ccccc12 ZINC000866016626 1137324562 /nfs/dbraw/zinc/32/45/62/1137324562.db2.gz QKWAMUOLRNRQKP-UHFFFAOYSA-N 1 0 343.452 3.640 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866309507 1137344370 /nfs/dbraw/zinc/34/43/70/1137344370.db2.gz PKRSJWQCDFUTHW-MNOVXSKESA-N 1 0 335.379 3.663 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1 ZINC000866348118 1137347929 /nfs/dbraw/zinc/34/79/29/1137347929.db2.gz ZPZRNBNTWHUNBJ-TUAOUCFPSA-N 1 0 349.410 3.647 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)c1c(F)cncc1F ZINC000866356299 1137348830 /nfs/dbraw/zinc/34/88/30/1137348830.db2.gz CKFSMWCKXZILDQ-ZJUUUORDSA-N 1 0 339.317 3.689 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000772984053 1137412459 /nfs/dbraw/zinc/41/24/59/1137412459.db2.gz MHOFTNVWXAFVCJ-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1c(F)cccc1F ZINC000773016430 1137459663 /nfs/dbraw/zinc/45/96/63/1137459663.db2.gz YKEBDFVJJNEROT-BZNIZROVSA-N 1 0 336.338 3.566 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000773121149 1137466745 /nfs/dbraw/zinc/46/67/45/1137466745.db2.gz UTQRTHGHUOHTPB-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccncc1[N+](=O)[O-])c1ccccc1Cl ZINC001649159668 1137479213 /nfs/dbraw/zinc/47/92/13/1137479213.db2.gz NFZPOHZEUCKNRJ-MRXNPFEDSA-N 1 0 348.834 3.560 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000123225922 1137502301 /nfs/dbraw/zinc/50/23/01/1137502301.db2.gz AEUSTWARFCEZPT-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO C[C@H](NCc1cccc(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020635 1137565033 /nfs/dbraw/zinc/56/50/33/1137565033.db2.gz JNBMRRLXXUCOMU-ZDUSSCGKSA-N 1 0 331.391 3.646 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000872022238 1137565163 /nfs/dbraw/zinc/56/51/63/1137565163.db2.gz IHPGXFXMNTWRCD-APHBMKBZSA-N 1 0 335.473 3.594 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000872130749 1137573161 /nfs/dbraw/zinc/57/31/61/1137573161.db2.gz QLOMZECIFYVOHZ-UONOGXRCSA-N 1 0 327.384 3.663 20 5 EHBDRO CC(C)Oc1cccc([C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c1 ZINC000876936643 1137665804 /nfs/dbraw/zinc/66/58/04/1137665804.db2.gz XFGYEPOXYIGNLH-IUDNXUCKSA-N 1 0 344.415 3.633 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)(C)c1ccccc1 ZINC000877061226 1137669060 /nfs/dbraw/zinc/66/90/60/1137669060.db2.gz AOIGOTRWSKOREX-LEOMRAHMSA-N 1 0 342.443 3.841 20 5 EHBDRO CC(C)[C@@H](C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000877467039 1137677117 /nfs/dbraw/zinc/67/71/17/1137677117.db2.gz WARVPQAOTNZNPL-WWDZGPRUSA-N 1 0 342.443 3.599 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CC2(Cl)Cl)cc(C(F)(F)F)c1 ZINC000877482586 1137677883 /nfs/dbraw/zinc/67/78/83/1137677883.db2.gz DAOZGKFCOHUVHF-VIFPVBQESA-N 1 0 343.132 3.897 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000877656181 1137684500 /nfs/dbraw/zinc/68/45/00/1137684500.db2.gz ZNOZDNXNWVPEQZ-IJWHBOBBSA-N 1 0 340.427 3.969 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000877730293 1137687021 /nfs/dbraw/zinc/68/70/21/1137687021.db2.gz USMMKZLNCUGPNI-WHEQGISXSA-N 1 0 328.349 3.716 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1C ZINC000878165122 1137705351 /nfs/dbraw/zinc/70/53/51/1137705351.db2.gz RPXACHOXKHZGFK-UWVGGRQHSA-N 1 0 336.779 3.529 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)o1 ZINC000879008773 1137735233 /nfs/dbraw/zinc/73/52/33/1137735233.db2.gz JTKZNOYLLHCKCH-ZFWWWQNUSA-N 1 0 342.399 3.799 20 5 EHBDRO CC(C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCCO1 ZINC000879405753 1137746765 /nfs/dbraw/zinc/74/67/65/1137746765.db2.gz HJBWGVNMZLFKPX-MRXNPFEDSA-N 1 0 345.399 3.687 20 5 EHBDRO Cc1c(C[N@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000331948609 1137926652 /nfs/dbraw/zinc/92/66/52/1137926652.db2.gz PAGXPESNAQDAPZ-PTKHLAPESA-N 1 0 332.444 3.665 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000119819303 1137944535 /nfs/dbraw/zinc/94/45/35/1137944535.db2.gz MZLDCUQMVJTIIJ-HNNXBMFYSA-N 1 0 348.447 3.550 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000120102854 1137946590 /nfs/dbraw/zinc/94/65/90/1137946590.db2.gz VQKNPWVWOKFUSO-ZDUSSCGKSA-N 1 0 339.395 3.794 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H]2C[C@H](c3ccccc3)CO2)cccc1[N+](=O)[O-] ZINC001203149028 1137949181 /nfs/dbraw/zinc/94/91/81/1137949181.db2.gz AZLHJMYYSMWNPK-ROUUACIJSA-N 1 0 326.396 3.566 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc1Cl ZINC000134892049 1137961451 /nfs/dbraw/zinc/96/14/51/1137961451.db2.gz JOBLPSPGMZNVMU-RHSMWYFYSA-N 1 0 349.862 3.697 20 5 EHBDRO CC(C)[C@H]1CC[N@H+](Cc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC000135648520 1137977680 /nfs/dbraw/zinc/97/76/80/1137977680.db2.gz MYINEPUKMZAVND-LBPRGKRZSA-N 1 0 327.222 3.835 20 5 EHBDRO COCCCC[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])c1ccccc1 ZINC000886181508 1138056630 /nfs/dbraw/zinc/05/66/30/1138056630.db2.gz MZZYRUMOXCHYOM-QGZVFWFLSA-N 1 0 329.400 3.637 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C(=O)OC(C)C)CC1 ZINC000886728660 1138127176 /nfs/dbraw/zinc/12/71/76/1138127176.db2.gz CCCHVPCNPINWRJ-AWEZNQCLSA-N 1 0 334.416 3.628 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)C2)O1)c1cccc([N+](=O)[O-])c1 ZINC000886761905 1138134047 /nfs/dbraw/zinc/13/40/47/1138134047.db2.gz MZYXBBVEIJDQEN-QZHFEQFPSA-N 1 0 348.443 3.752 20 5 EHBDRO C[C@H](O)C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000078410253 1138149179 /nfs/dbraw/zinc/14/91/79/1138149179.db2.gz NSGRTNJVWWUZJD-NSHDSACASA-N 1 0 336.775 3.511 20 5 EHBDRO CCC[C@H](CCO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000080524355 1138163031 /nfs/dbraw/zinc/16/30/31/1138163031.db2.gz UADUISCVNFAMLS-CYBMUJFWSA-N 1 0 349.456 3.607 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000131130873 1138497848 /nfs/dbraw/zinc/49/78/48/1138497848.db2.gz CCDBFGWVJDRDRE-QGZVFWFLSA-N 1 0 330.384 3.980 20 5 EHBDRO Cc1ccc(C)n1C1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000337678783 1138641622 /nfs/dbraw/zinc/64/16/22/1138641622.db2.gz MNOXFYSFASNNPV-UHFFFAOYSA-N 1 0 343.427 3.729 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc2c(c1)OCCO2 ZINC000283032473 1138934618 /nfs/dbraw/zinc/93/46/18/1138934618.db2.gz HRIYSOLCYIELKL-OAHLLOKOSA-N 1 0 346.358 3.746 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCn2nc(C)cc2C)cc1[N+](=O)[O-] ZINC000152597454 1139099403 /nfs/dbraw/zinc/09/94/03/1139099403.db2.gz OASWTTVLSVSBGM-OAHLLOKOSA-N 1 0 346.431 3.548 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180399667 1139831966 /nfs/dbraw/zinc/83/19/66/1139831966.db2.gz LPJCEUUHWPFWAF-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO COCCc1nc(C)c([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000181392521 1139903397 /nfs/dbraw/zinc/90/33/97/1139903397.db2.gz IYPCUJFIDMAOEI-NEPJUHHUSA-N 1 0 349.456 3.960 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000181809200 1139932947 /nfs/dbraw/zinc/93/29/47/1139932947.db2.gz YWOJLRMOXDHMAD-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000182022461 1139946087 /nfs/dbraw/zinc/94/60/87/1139946087.db2.gz JPKDIWXYFGARRG-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946553 1140003367 /nfs/dbraw/zinc/00/33/67/1140003367.db2.gz QBFLQGLEWRYDBW-VXGBXAGGSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419773 1140255022 /nfs/dbraw/zinc/25/50/22/1140255022.db2.gz VKNPKYQIIMLSQJ-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000188359295 1140293633 /nfs/dbraw/zinc/29/36/33/1140293633.db2.gz LCBYVBYNJFKPCL-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO CC[C@@H]([NH2+]CCOCC(F)(F)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000189860104 1140368141 /nfs/dbraw/zinc/36/81/41/1140368141.db2.gz HWJLBKVDGTXOHW-GFCCVEGCSA-N 1 0 338.301 3.553 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCS2 ZINC000191528744 1140470569 /nfs/dbraw/zinc/47/05/69/1140470569.db2.gz LSGWOMNKBXTSEK-OAHLLOKOSA-N 1 0 330.409 3.930 20 5 EHBDRO C[C@@H]1C[C@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000193466540 1140577021 /nfs/dbraw/zinc/57/70/21/1140577021.db2.gz QSFUNHPZOXRQHC-RHSMWYFYSA-N 1 0 340.427 3.642 20 5 EHBDRO C[C@@H](CCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000266153068 1140648517 /nfs/dbraw/zinc/64/85/17/1140648517.db2.gz LCCIBZPCTWXTAJ-NSHDSACASA-N 1 0 338.791 3.616 20 5 EHBDRO COc1cccc(N2CC[C@@H]([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000266851046 1140729617 /nfs/dbraw/zinc/72/96/17/1140729617.db2.gz IWGLTNNEVBNLQB-GDBMZVCRSA-N 1 0 341.411 3.533 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)nc21 ZINC000267453762 1140792780 /nfs/dbraw/zinc/79/27/80/1140792780.db2.gz SFISIGVRZVJYTA-CYBMUJFWSA-N 1 0 325.368 3.938 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(N(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268766367 1140986857 /nfs/dbraw/zinc/98/68/57/1140986857.db2.gz NVMBYBQDVVTINK-QGZVFWFLSA-N 1 0 328.416 3.687 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CSCCc3ccccc32)cc1[N+](=O)[O-] ZINC000268842529 1141006024 /nfs/dbraw/zinc/00/60/24/1141006024.db2.gz RBYTWIRABWQYQC-INIZCTEOSA-N 1 0 344.436 3.724 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c1 ZINC000270365187 1141212621 /nfs/dbraw/zinc/21/26/21/1141212621.db2.gz HUQDWTHDFGYOKB-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000271485012 1141378282 /nfs/dbraw/zinc/37/82/82/1141378282.db2.gz IQMJEVTXGXXHPD-ZBEGNZNMSA-N 1 0 336.413 3.531 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518376 1141386241 /nfs/dbraw/zinc/38/62/41/1141386241.db2.gz PWECTCXBUYORTC-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000271563637 1141398954 /nfs/dbraw/zinc/39/89/54/1141398954.db2.gz OVAYCZZXRTYRLV-XLMAVXFVSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@H]1C[N@H+](C)[C@@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643638 719205439 /nfs/dbraw/zinc/20/54/39/719205439.db2.gz ZVADVIGMJFPKTK-STQMWFEESA-N 1 0 340.858 3.965 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000430160271 1014484577 /nfs/dbraw/zinc/48/45/77/1014484577.db2.gz FWIYKJFUIJRHTA-QWSHFYNQSA-N 1 0 330.428 3.747 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc[nH]c(=O)c1 ZINC000339453253 1014511726 /nfs/dbraw/zinc/51/17/26/1014511726.db2.gz FQSIINXQYQJVII-GFCCVEGCSA-N 1 0 339.351 3.806 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc[nH]c(=O)c1 ZINC000339457975 1014521597 /nfs/dbraw/zinc/52/15/97/1014521597.db2.gz JTJGRLKUUKYZNW-GFCCVEGCSA-N 1 0 339.351 3.806 20 5 EHBDRO CSC[C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189060 1014696405 /nfs/dbraw/zinc/69/64/05/1014696405.db2.gz CTHXVZABDBZQIX-LLVKDONJSA-N 1 0 346.399 3.771 20 5 EHBDRO COc1ccc(CN(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)cc1O ZINC000153987524 1014750171 /nfs/dbraw/zinc/75/01/71/1014750171.db2.gz QLUSPWYIUKIEMM-UHFFFAOYSA-N 1 0 336.775 3.594 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)n1 ZINC000187097602 1014844298 /nfs/dbraw/zinc/84/42/98/1014844298.db2.gz NSRVCHYSSYWNCN-UHFFFAOYSA-N 1 0 341.411 3.650 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000120524375 1015404217 /nfs/dbraw/zinc/40/42/17/1015404217.db2.gz YCHZNQKXWBZIJV-FZKQIMNGSA-N 1 0 348.830 3.893 20 5 EHBDRO CC[C@@](C)(CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000134469298 1015546538 /nfs/dbraw/zinc/54/65/38/1015546538.db2.gz QSDPZRSCRJESGJ-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO C[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCOCC1 ZINC000134478527 1015557745 /nfs/dbraw/zinc/55/77/45/1015557745.db2.gz NLJIGBQCHHVBLV-LBPRGKRZSA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895406 1015909176 /nfs/dbraw/zinc/90/91/76/1015909176.db2.gz GWIYINRSQQWNND-XLIONFOSSA-N 1 0 348.406 3.554 20 5 EHBDRO C[NH2+]Cc1cn(-c2ncnc3cccc([N+](=O)[O-])c32)c2ccc(C)cc12 ZINC001167123027 1016182836 /nfs/dbraw/zinc/18/28/36/1016182836.db2.gz RUEXHIXBIUTJOK-UHFFFAOYSA-N 1 0 347.378 3.510 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)O1 ZINC000414517058 1016948279 /nfs/dbraw/zinc/94/82/79/1016948279.db2.gz QCTAZMJFNZNBMN-YRGRVCCFSA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000449076958 1032167744 /nfs/dbraw/zinc/16/77/44/1032167744.db2.gz VGGXZZYRFXFRQO-OLZOCXBDSA-N 1 0 328.368 3.605 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(c2ccccc2)CC1 ZINC000449091195 1032196524 /nfs/dbraw/zinc/19/65/24/1032196524.db2.gz IWIXJRIMXFDFHD-INIZCTEOSA-N 1 0 339.439 3.784 20 5 EHBDRO CCOc1cccc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449203948 1032308518 /nfs/dbraw/zinc/30/85/18/1032308518.db2.gz HUNJZLMNGAHONL-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO Cn1cc(C[NH+]2CC(C3CCCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459617533 1032329036 /nfs/dbraw/zinc/32/90/36/1032329036.db2.gz QXWDZZRLRZPKJY-UHFFFAOYSA-N 1 0 340.427 3.617 20 5 EHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459620312 1032333135 /nfs/dbraw/zinc/33/31/35/1032333135.db2.gz VORGGMARBNDKMV-BDJLRTHQSA-N 1 0 339.823 3.745 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000536855684 1032352607 /nfs/dbraw/zinc/35/26/07/1032352607.db2.gz AVKDSFNBQKCLLU-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO Cn1cc([C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430305 1032359012 /nfs/dbraw/zinc/35/90/12/1032359012.db2.gz VALJVPTZZLATLY-KMDWOBIYSA-N 1 0 328.416 3.719 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCC(O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000536908446 1032422064 /nfs/dbraw/zinc/42/20/64/1032422064.db2.gz FPUDPGAMWTVEEH-NUYPLMSZSA-N 1 0 346.349 3.790 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)C2 ZINC000459732181 1032436391 /nfs/dbraw/zinc/43/63/91/1032436391.db2.gz RHIYNSVHUMMTPR-CRPZLVSXSA-N 1 0 338.407 3.764 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCc3c(F)cccc32)c([N+](=O)[O-])cc1O ZINC000449347387 1032463192 /nfs/dbraw/zinc/46/31/92/1032463192.db2.gz CEQYLESLSHUODF-HNNXBMFYSA-N 1 0 346.358 3.615 20 5 EHBDRO CCC[C@@H]([NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459811949 1032473244 /nfs/dbraw/zinc/47/32/44/1032473244.db2.gz VJUHDPQPHROLQO-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449433208 1032549251 /nfs/dbraw/zinc/54/92/51/1032549251.db2.gz LEKSDSYLYWPJLW-QGPMSJSTSA-N 1 0 342.443 3.834 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000537307301 1032613253 /nfs/dbraw/zinc/61/32/53/1032613253.db2.gz PJNGFFZFRSMZQY-SUMDDJOVSA-N 1 0 346.471 3.693 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC(C)(C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000449486756 1032639952 /nfs/dbraw/zinc/63/99/52/1032639952.db2.gz VFIJMKGDIPZMIA-KRWDZBQOSA-N 1 0 342.443 3.834 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cccc4nccn43)C2)cc1 ZINC000449497631 1032668638 /nfs/dbraw/zinc/66/86/38/1032668638.db2.gz ISNPWGZRWUEOGL-INIZCTEOSA-N 1 0 336.395 3.622 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000181533329 1017119339 /nfs/dbraw/zinc/11/93/39/1017119339.db2.gz BOHNFPCEUCZYCK-GJZGRUSLSA-N 1 0 341.411 3.624 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(CSCC2CC[NH2+]CC2)c1 ZINC000574079168 1032691663 /nfs/dbraw/zinc/69/16/63/1032691663.db2.gz DAZDBZIKYMDXHJ-UHFFFAOYSA-N 1 0 334.363 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCCC[NH2+]C3)s2)cc1 ZINC000415064679 1017484360 /nfs/dbraw/zinc/48/43/60/1017484360.db2.gz DKRZTBMSGUVSSB-AWEZNQCLSA-N 1 0 331.441 3.555 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000247233594 1017537646 /nfs/dbraw/zinc/53/76/46/1017537646.db2.gz WKYNLOMPHWPJDJ-LPRVLWEOSA-N 1 0 341.455 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000415295485 1017834829 /nfs/dbraw/zinc/83/48/29/1017834829.db2.gz LOISKGIEEAEZJK-CYBMUJFWSA-N 1 0 342.399 3.553 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc(NC(C)=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000155470329 1017849980 /nfs/dbraw/zinc/84/99/80/1017849980.db2.gz DDQPSBZJKQTWCY-GOSISDBHSA-N 1 0 327.384 3.794 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCC[N@@H+]3C3CCCC3)n2)cc1 ZINC000275643003 1017874442 /nfs/dbraw/zinc/87/44/42/1017874442.db2.gz ORTIKRVOXRALMZ-HNNXBMFYSA-N 1 0 328.372 3.724 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCC(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000592399039 1032752678 /nfs/dbraw/zinc/75/26/78/1032752678.db2.gz MEXQELXGJQMAQQ-PGEKIEPBSA-N 1 0 346.406 3.536 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000090843863 1018271191 /nfs/dbraw/zinc/27/11/91/1018271191.db2.gz WVMPODGBMSDPQC-KDOFPFPSSA-N 1 0 328.412 3.850 20 5 EHBDRO COc1ccc(COCC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000091741007 1018555182 /nfs/dbraw/zinc/55/51/82/1018555182.db2.gz MUJOEPCSLYGEIR-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000592404656 1032776335 /nfs/dbraw/zinc/77/63/35/1032776335.db2.gz VQQYKBMYYYSHDZ-VHDGCEQUSA-N 1 0 334.416 3.756 20 5 EHBDRO COc1ccc(CN(C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000610389646 1018706817 /nfs/dbraw/zinc/70/68/17/1018706817.db2.gz UUOLEEYDQHBSAM-ZDUSSCGKSA-N 1 0 330.384 3.805 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2cn3c(cccc3C)n2)cc1[N+](=O)[O-] ZINC000592403016 1032798844 /nfs/dbraw/zinc/79/88/44/1032798844.db2.gz KJYVIDYVHHPLDR-HNNXBMFYSA-N 1 0 338.411 3.753 20 5 EHBDRO COc1cccc(N[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111390 1018972264 /nfs/dbraw/zinc/97/22/64/1018972264.db2.gz DFSMWKCWEXNGRC-HOCLYGCPSA-N 1 0 341.411 3.678 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000120602993 1019087468 /nfs/dbraw/zinc/08/74/68/1019087468.db2.gz ODPPNYVUBAOZQJ-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@@H](CO)C1 ZINC000579628284 1019329623 /nfs/dbraw/zinc/32/96/23/1019329623.db2.gz MLLFPJVMIRFMDO-FAJBIJEISA-N 1 0 346.471 3.694 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000119263724 1019822969 /nfs/dbraw/zinc/82/29/69/1019822969.db2.gz TXQCNFDPAYHBMP-ZDUSSCGKSA-N 1 0 344.390 3.766 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000126054633 1020213883 /nfs/dbraw/zinc/21/38/83/1020213883.db2.gz GTPIXTQKTBFPFP-ZDUSSCGKSA-N 1 0 330.384 3.601 20 5 EHBDRO OC[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)[C@@H]1CCOC1 ZINC000280363616 1020324737 /nfs/dbraw/zinc/32/47/37/1020324737.db2.gz UBORJXVNZCJESA-RTBURBONSA-N 1 0 335.447 3.728 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103330 1020432722 /nfs/dbraw/zinc/43/27/22/1020432722.db2.gz OJSMVNKARAUKBC-HXUWFJFHSA-N 1 0 338.407 3.873 20 5 EHBDRO CCc1nc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000157052975 1020665026 /nfs/dbraw/zinc/66/50/26/1020665026.db2.gz OKTNIHHXPKWFCV-INIZCTEOSA-N 1 0 345.468 3.767 20 5 EHBDRO C[C@H]1COC[C@H](c2ccccc2)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038371 1020674997 /nfs/dbraw/zinc/67/49/97/1020674997.db2.gz JFAJFLWKWHLHFY-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000426308139 1021227732 /nfs/dbraw/zinc/22/77/32/1021227732.db2.gz UVHWLXQKYWGESB-GDBMZVCRSA-N 1 0 343.402 3.972 20 5 EHBDRO CC(C)c1ccc(C(=O)NCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000439242373 1021277680 /nfs/dbraw/zinc/27/76/80/1021277680.db2.gz AIHUCMAVWKKKNC-UHFFFAOYSA-N 1 0 335.448 3.567 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000426403203 1021504576 /nfs/dbraw/zinc/50/45/76/1021504576.db2.gz FNOFYLPSKBNPGD-UONOGXRCSA-N 1 0 344.411 3.981 20 5 EHBDRO CCC(CC)[C@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590243 1032988070 /nfs/dbraw/zinc/98/80/70/1032988070.db2.gz YGCNKDOCWISTEA-CXAGYDPISA-N 1 0 347.415 3.809 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000519751503 1021658088 /nfs/dbraw/zinc/65/80/88/1021658088.db2.gz XOJUQFPOLQUWNW-ZFWWWQNUSA-N 1 0 326.396 3.730 20 5 EHBDRO CCC1(O)CCC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602580805 1033000999 /nfs/dbraw/zinc/00/09/99/1033000999.db2.gz HKGRWAHIHCWOAR-UHFFFAOYSA-N 1 0 346.349 3.787 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000090910181 1021685955 /nfs/dbraw/zinc/68/59/55/1021685955.db2.gz WKUQHDNZVNBUFY-YLJYHZDGSA-N 1 0 340.423 3.895 20 5 EHBDRO COCC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506011780 1021695760 /nfs/dbraw/zinc/69/57/60/1021695760.db2.gz GZDWMPDYQICSDX-DAXSKMNVSA-N 1 0 332.425 3.818 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000129426581 1021752610 /nfs/dbraw/zinc/75/26/10/1021752610.db2.gz NLNXYOITLQYXRN-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCO[C@H](C2CC2)C1 ZINC000602617027 1033010533 /nfs/dbraw/zinc/01/05/33/1033010533.db2.gz MYFBZVSDBZIPHS-HIFRSBDPSA-N 1 0 344.333 3.661 20 5 EHBDRO Cc1ccc(CN2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467895 1021879466 /nfs/dbraw/zinc/87/94/66/1021879466.db2.gz UEEZFDTZUUCHJV-SOLBZPMBSA-N 1 0 331.460 3.740 20 5 EHBDRO Cc1ccc(CN2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467893 1021880863 /nfs/dbraw/zinc/88/08/63/1021880863.db2.gz UEEZFDTZUUCHJV-JZXOWHBKSA-N 1 0 331.460 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCC3=CCCCCC3)CC2)cn1 ZINC000602613439 1033029327 /nfs/dbraw/zinc/02/93/27/1033029327.db2.gz ZVXTXZCJTNCGBM-UHFFFAOYSA-N 1 0 344.459 3.829 20 5 EHBDRO COCc1cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])ccc1F ZINC000581893800 1022182582 /nfs/dbraw/zinc/18/25/82/1022182582.db2.gz ATBRINMBFSNEAV-QGZVFWFLSA-N 1 0 330.359 3.657 20 5 EHBDRO CCC(O)(CC)CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000471787806 1022202874 /nfs/dbraw/zinc/20/28/74/1022202874.db2.gz NPSKPUHRTPJYGS-WBVHZDCISA-N 1 0 334.460 3.837 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000414920343 1022337634 /nfs/dbraw/zinc/33/76/34/1022337634.db2.gz XKHHNEKLWKQPSB-GOSISDBHSA-N 1 0 341.411 3.743 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1Cl ZINC000425965874 1022496704 /nfs/dbraw/zinc/49/67/04/1022496704.db2.gz JYETXBOBAFOOLS-UHFFFAOYSA-N 1 0 334.807 3.590 20 5 EHBDRO COc1cc(N[C@H](C)C[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000310106537 1022584607 /nfs/dbraw/zinc/58/46/07/1022584607.db2.gz AQAHDRLNVDOVIE-CQSZACIVSA-N 1 0 329.400 3.536 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C(C)(C)c2ccccc2C)c1[N+](=O)[O-] ZINC000894625570 1022637746 /nfs/dbraw/zinc/63/77/46/1022637746.db2.gz GDOYFAPICFMELW-UHFFFAOYSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCCc3c(F)cccc32)c1[N+](=O)[O-] ZINC000894659303 1022690857 /nfs/dbraw/zinc/69/08/57/1022690857.db2.gz QTKOOAJOSMHQRF-HNNXBMFYSA-N 1 0 346.358 3.615 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000430821238 1022726672 /nfs/dbraw/zinc/72/66/72/1022726672.db2.gz HVVNMSOFCHQJPE-WBVHZDCISA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)cc1 ZINC000602681543 1033080803 /nfs/dbraw/zinc/08/08/03/1033080803.db2.gz BQEJCSFOCVLVOJ-GDBMZVCRSA-N 1 0 332.425 3.709 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000894737281 1022817384 /nfs/dbraw/zinc/81/73/84/1022817384.db2.gz UIFMBOXBDSSYCS-NVXWUHKLSA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000310150835 1022911027 /nfs/dbraw/zinc/91/10/27/1022911027.db2.gz FSYIJOOXLWQPLW-MAUKXSAKSA-N 1 0 325.412 3.520 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CC[NH+](CC2CCCCC2)CC1 ZINC000506338097 1022951128 /nfs/dbraw/zinc/95/11/28/1022951128.db2.gz AJZFCAJQJDPLOL-UXBLZVDNSA-N 1 0 343.471 3.806 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)nc1 ZINC000602725057 1033113223 /nfs/dbraw/zinc/11/32/23/1033113223.db2.gz WKACISCMPFXAED-UHFFFAOYSA-N 1 0 340.383 3.507 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1COc2c1cccc2Cl ZINC000610707619 1023281008 /nfs/dbraw/zinc/28/10/08/1023281008.db2.gz OKBMJADMTFFZCD-CSPWOOARSA-N 1 0 330.771 3.985 20 5 EHBDRO C[C@H](C[C@H]1CCOC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740639 1023404019 /nfs/dbraw/zinc/40/40/19/1023404019.db2.gz XERKNQOIYCNJKG-CHWSQXEVSA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2C[C@H]3CC[C@@H](C2)S3)c1 ZINC000897748865 1033148869 /nfs/dbraw/zinc/14/88/69/1033148869.db2.gz IOTJDHKEDJNFNT-VGPLMAKISA-N 1 0 344.383 3.712 20 5 EHBDRO CCOc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000610811059 1023711007 /nfs/dbraw/zinc/71/10/07/1023711007.db2.gz FBVZINBBBRKWMV-SFHVURJKSA-N 1 0 342.395 3.649 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818769 1023782666 /nfs/dbraw/zinc/78/26/66/1023782666.db2.gz ANXJIQKRIDBXGR-NEPJUHHUSA-N 1 0 340.383 3.897 20 5 EHBDRO CC(C)c1ccc(CN2C[C@]3(CCCO3)[C@@H]2C2CC2)cc1[N+](=O)[O-] ZINC000520600163 1024211847 /nfs/dbraw/zinc/21/18/47/1024211847.db2.gz GMWQQZNNNBJHNE-RBUKOAKNSA-N 1 0 330.428 3.862 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H]2CC[C@@H](O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000474105950 1024227296 /nfs/dbraw/zinc/22/72/96/1024227296.db2.gz MFKNMYFWSRVABI-VVFCZOMOSA-N 1 0 344.411 3.590 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000520621947 1024268893 /nfs/dbraw/zinc/26/88/93/1024268893.db2.gz LSFJDKVBLDIORM-OAHLLOKOSA-N 1 0 335.451 3.848 20 5 EHBDRO Cn1cc(C[NH2+]CCCC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000538414401 1024345997 /nfs/dbraw/zinc/34/59/97/1024345997.db2.gz ILCNHGUDYZSQGI-UHFFFAOYSA-N 1 0 330.432 3.911 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1ccns1 ZINC000895529654 1024585742 /nfs/dbraw/zinc/58/57/42/1024585742.db2.gz UZRQGTMNXCDMBV-UHFFFAOYSA-N 1 0 332.212 3.690 20 5 EHBDRO Cc1cc(NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748267 1024610525 /nfs/dbraw/zinc/61/05/25/1024610525.db2.gz GSGFYDULYOGLPX-OAHLLOKOSA-N 1 0 325.412 3.762 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](Cc1ccc(C(C)C)cc1)C1CC1 ZINC000611566617 1024681906 /nfs/dbraw/zinc/68/19/06/1024681906.db2.gz LYEPDTPBKUJNQZ-UHFFFAOYSA-N 1 0 342.443 3.888 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(C)([NH+]2CCC2)CC1 ZINC000895672075 1024717221 /nfs/dbraw/zinc/71/72/21/1024717221.db2.gz VSZULTRGEBUHEI-SSZFMOIBSA-N 1 0 329.444 3.558 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](CCCO)C3)s2)cc1 ZINC000449791154 1033234059 /nfs/dbraw/zinc/23/40/59/1033234059.db2.gz NVEOUPQJHBLZKD-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1ccccc1Cl ZINC000507933711 1024781334 /nfs/dbraw/zinc/78/13/34/1024781334.db2.gz SUKGZGKCQRGLNO-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO O[C@@]1(C[NH2+]Cc2c3ccccc3c(Cl)c3ccccc32)CCOC1 ZINC000179021823 1024811295 /nfs/dbraw/zinc/81/12/95/1024811295.db2.gz GBWZBDPDQNLLAC-HXUWFJFHSA-N 1 0 341.838 3.887 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372449 1024857662 /nfs/dbraw/zinc/85/76/62/1024857662.db2.gz RHEHSJHGXYMHCN-RYUDHWBXSA-N 1 0 349.818 3.677 20 5 EHBDRO COc1cc(N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185526 1024899466 /nfs/dbraw/zinc/89/94/66/1024899466.db2.gz DYBSKHLKUGOSBA-RHSMWYFYSA-N 1 0 341.411 3.851 20 5 EHBDRO C[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)c2ccccc21 ZINC000185393594 1024925453 /nfs/dbraw/zinc/92/54/53/1024925453.db2.gz AIGNBTGQOMUEJL-GFCCVEGCSA-N 1 0 344.802 3.949 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](CCOC)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000346810066 1025132858 /nfs/dbraw/zinc/13/28/58/1025132858.db2.gz QOTOFKVAIZUWIM-MAUKXSAKSA-N 1 0 332.400 3.876 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCOC1 ZINC000119772942 1025179666 /nfs/dbraw/zinc/17/96/66/1025179666.db2.gz QNVZBFUFISIMCK-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000119796080 1025219933 /nfs/dbraw/zinc/21/99/33/1025219933.db2.gz DOAFZFYLOVCCMU-CQSZACIVSA-N 1 0 339.823 3.745 20 5 EHBDRO Cc1c(CN2CCC[N@H+](CC3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000515509387 1025303956 /nfs/dbraw/zinc/30/39/56/1025303956.db2.gz ZOHVCXYHIYSYIO-UHFFFAOYSA-N 1 0 345.487 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@@H]2CCC(F)(F)C2)c1 ZINC000281647647 1025327745 /nfs/dbraw/zinc/32/77/45/1025327745.db2.gz MSOHDRSDLFDKKW-SECBINFHSA-N 1 0 336.285 3.721 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(CCF)CC1 ZINC000602948272 1033275596 /nfs/dbraw/zinc/27/55/96/1033275596.db2.gz PRHKMAGMPKOKDS-LBPRGKRZSA-N 1 0 348.378 3.777 20 5 EHBDRO COC(=O)[C@@H](CC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461758 1025366999 /nfs/dbraw/zinc/36/69/99/1025366999.db2.gz SJOQELMWSYLMHX-YOEHRIQHSA-N 1 0 342.395 3.592 20 5 EHBDRO Cc1cc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433138 1025460315 /nfs/dbraw/zinc/46/03/15/1025460315.db2.gz IARGFXJEXFMPGI-NVXWUHKLSA-N 1 0 340.427 3.621 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000474865729 1025717896 /nfs/dbraw/zinc/71/78/96/1025717896.db2.gz BAPKEVDHLXDMGE-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)[NH+](C)C ZINC000439126864 1025793231 /nfs/dbraw/zinc/79/32/31/1025793231.db2.gz FXXNPQCHZPERPX-IAQYHMDHSA-N 1 0 334.807 3.747 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000237247213 1025987832 /nfs/dbraw/zinc/98/78/32/1025987832.db2.gz CZFMHHMKXVQWHX-OWNNVSBGSA-N 1 0 342.395 3.976 20 5 EHBDRO COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000478352780 1026078714 /nfs/dbraw/zinc/07/87/14/1026078714.db2.gz LECJWEURXDILLX-SGTLLEGYSA-N 1 0 348.374 3.608 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000475140876 1026234487 /nfs/dbraw/zinc/23/44/87/1026234487.db2.gz UASADMPOSBIHFW-GOSISDBHSA-N 1 0 328.412 3.593 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC3(C(F)F)CC3)cs2)c1 ZINC000475215733 1026394124 /nfs/dbraw/zinc/39/41/24/1026394124.db2.gz QZGRCWIPJZCODG-UHFFFAOYSA-N 1 0 339.367 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](OCCCc3ccccc3)C2)c1 ZINC000530972510 1026449480 /nfs/dbraw/zinc/44/94/80/1026449480.db2.gz SBTIILVQOPBQOE-HXUWFJFHSA-N 1 0 340.423 3.819 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000023744713 1026540362 /nfs/dbraw/zinc/54/03/62/1026540362.db2.gz MMLZFKIHXFXDLM-HNNXBMFYSA-N 1 0 333.413 3.574 20 5 EHBDRO C[C@H]1CCN(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000540803556 1026646247 /nfs/dbraw/zinc/64/62/47/1026646247.db2.gz DURBKDBQIBOHNS-AWEZNQCLSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782370 1026713978 /nfs/dbraw/zinc/71/39/78/1026713978.db2.gz GLRDWIAFUSYIBO-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCc1ccc(F)cc1)C1CC1 ZINC000479858622 1026862300 /nfs/dbraw/zinc/86/23/00/1026862300.db2.gz KIXVZEULLMEQCI-GOSISDBHSA-N 1 0 328.387 3.887 20 5 EHBDRO CN(Cc1ccccc1)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000479870454 1026867037 /nfs/dbraw/zinc/86/70/37/1026867037.db2.gz AGNUAAQMNGELGX-HXUWFJFHSA-N 1 0 339.439 3.595 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N3CCC[N@@H+](C4CCCC4)CC3)c2c1 ZINC000413153774 1027136449 /nfs/dbraw/zinc/13/64/49/1027136449.db2.gz LYBWEWIABLRKEE-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413215342 1027293896 /nfs/dbraw/zinc/29/38/96/1027293896.db2.gz AENNGKYXHUTGLD-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC(=O)c1ccc(NCCCC[N@H+]2CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000076795441 1027324860 /nfs/dbraw/zinc/32/48/60/1027324860.db2.gz PGLAFOHJCRRWLA-CQSZACIVSA-N 1 0 333.432 3.721 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@@H](c2ccccc2F)[C@H]([NH3+])C1 ZINC000420386863 1027505190 /nfs/dbraw/zinc/50/51/90/1027505190.db2.gz JGBZZTTXAAYQBD-SOVGHPHASA-N 1 0 343.402 3.530 20 5 EHBDRO C[C@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916578 1027517942 /nfs/dbraw/zinc/51/79/42/1027517942.db2.gz YCTABOITTRVVHU-HOCLYGCPSA-N 1 0 344.386 3.991 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000475556004 1027596564 /nfs/dbraw/zinc/59/65/64/1027596564.db2.gz ZRJJDNKSXBPNMV-HUUCEWRRSA-N 1 0 348.447 3.596 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000475561405 1027626201 /nfs/dbraw/zinc/62/62/01/1027626201.db2.gz YRNOIXNUVMCDAF-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000420633997 1027658782 /nfs/dbraw/zinc/65/87/82/1027658782.db2.gz YYXGYSSJQHBZFW-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(Cc2cccs2)[C@@H]2C=C[C@H](CO)C2)c1 ZINC000347330986 1027711502 /nfs/dbraw/zinc/71/15/02/1027711502.db2.gz HXZWHAHNRKNKHR-JKSUJKDBSA-N 1 0 344.436 3.596 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)N(C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000178681936 1027872264 /nfs/dbraw/zinc/87/22/64/1027872264.db2.gz DMZTVNLMJGKQPM-GJZGRUSLSA-N 1 0 335.448 3.588 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503584014 1027945219 /nfs/dbraw/zinc/94/52/19/1027945219.db2.gz YLQLJEHWJBCETK-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO COc1cc(C[N@H+](CC2CC2)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000533495708 1027958906 /nfs/dbraw/zinc/95/89/06/1027958906.db2.gz YDWPHBIDPFHQOO-UHFFFAOYSA-N 1 0 344.358 3.825 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000237815953 1028068652 /nfs/dbraw/zinc/06/86/52/1028068652.db2.gz BLRKRXONHJRBAI-LJQANCHMSA-N 1 0 339.439 3.657 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CCCN(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407728 1028073462 /nfs/dbraw/zinc/07/34/62/1028073462.db2.gz ZFDRGSCLYMENOR-DNVCBOLYSA-N 1 0 343.427 3.523 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)CCc1cccc([N+](=O)[O-])c1 ZINC000909607239 1028134699 /nfs/dbraw/zinc/13/46/99/1028134699.db2.gz WTSXAPXIAZHDRW-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC1CCC1)C(C)C ZINC000444779436 1028240978 /nfs/dbraw/zinc/24/09/78/1028240978.db2.gz YKGNIGDZDGEXMC-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCC2(CC1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161775280 1028273138 /nfs/dbraw/zinc/27/31/38/1028273138.db2.gz GKFOKLGPBFUVNS-QGZVFWFLSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCC3(O)CCC3)o2)cc1 ZINC000421365324 1028320075 /nfs/dbraw/zinc/32/00/75/1028320075.db2.gz BIOBNEBGSQXBJM-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccccc3)CCOCC2)c(F)c1 ZINC000532708896 1028401516 /nfs/dbraw/zinc/40/15/16/1028401516.db2.gz LDUSHSLJQARSCH-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccccc1CC[NH+](C)C ZINC000421500111 1028483344 /nfs/dbraw/zinc/48/33/44/1028483344.db2.gz CSBSTYVQKXHYGD-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000749694683 1028521660 /nfs/dbraw/zinc/52/16/60/1028521660.db2.gz XYQPBLYJLNIXMM-DLBZAZTESA-N 1 0 332.787 3.559 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1CN2CCC[C@@H]2CO1 ZINC000729684804 1028553304 /nfs/dbraw/zinc/55/33/04/1028553304.db2.gz WWXALVNUZANNJU-WOJBJXKFSA-N 1 0 346.474 3.946 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613179305 1028579288 /nfs/dbraw/zinc/57/92/88/1028579288.db2.gz SLKYQLLHTDNKSB-RDJZCZTQSA-N 1 0 325.412 3.924 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC([NH+]2CCCCC2)CC1 ZINC000523840116 1028666707 /nfs/dbraw/zinc/66/67/07/1028666707.db2.gz UYNSTDVHAFUUBQ-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2csc(-c3ccco3)n2)cc1 ZINC000105448065 1028679665 /nfs/dbraw/zinc/67/96/65/1028679665.db2.gz XQJXZEAULMLIHW-UHFFFAOYSA-N 1 0 329.381 3.644 20 5 EHBDRO CC(C)[C@@H](CO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514829352 1028712416 /nfs/dbraw/zinc/71/24/16/1028712416.db2.gz AQCIIMXFNJKWSS-CYBMUJFWSA-N 1 0 334.441 3.677 20 5 EHBDRO Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)cc2C)cc1[N+](=O)[O-] ZINC000909622843 1028898469 /nfs/dbraw/zinc/89/84/69/1028898469.db2.gz YDAKYMCSLFHNMR-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccccc2OC)cc1[N+](=O)[O-] ZINC000504899962 1029027880 /nfs/dbraw/zinc/02/78/80/1029027880.db2.gz OWNLXKKTWGOCLR-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CN(C2CC2)C[C@@H]1C ZINC000504917994 1029043891 /nfs/dbraw/zinc/04/38/91/1029043891.db2.gz FPQJHFGDIQLHGA-LZWOXQAQSA-N 1 0 349.500 3.538 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccsc1 ZINC000079871783 1029361522 /nfs/dbraw/zinc/36/15/22/1029361522.db2.gz JHJAFZXCRMAUDT-INIZCTEOSA-N 1 0 342.424 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCO)C2CCCC2)o1 ZINC000505282911 1029434806 /nfs/dbraw/zinc/43/48/06/1029434806.db2.gz GZFKMFHHUODPOZ-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2ccc(C(F)(F)F)cc2)cc1 ZINC000237844809 1029459001 /nfs/dbraw/zinc/45/90/01/1029459001.db2.gz MYMQJKYCWOERIY-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262051 1029541783 /nfs/dbraw/zinc/54/17/83/1029541783.db2.gz WTPZFAQEKCRRIG-LSDHHAIUSA-N 1 0 341.411 3.657 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000248266771 1029607891 /nfs/dbraw/zinc/60/78/91/1029607891.db2.gz SVXNFINRJBGNDA-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO CC[NH+]1CCC(CNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000044526334 1029666698 /nfs/dbraw/zinc/66/66/98/1029666698.db2.gz PEECTKRSUQFENO-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO CCCC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000544414304 1029689761 /nfs/dbraw/zinc/68/97/61/1029689761.db2.gz BHCFKOUDUZSWQC-DZGCQCFKSA-N 1 0 333.432 3.870 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000525121300 1029693141 /nfs/dbraw/zinc/69/31/41/1029693141.db2.gz FYBMBCMPMYTQHM-QGZVFWFLSA-N 1 0 326.396 3.538 20 5 EHBDRO COC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000446887858 1029847843 /nfs/dbraw/zinc/84/78/43/1029847843.db2.gz ZGAWNZFWFPFKKP-HNNXBMFYSA-N 1 0 326.824 3.586 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000385119474 1029859719 /nfs/dbraw/zinc/85/97/19/1029859719.db2.gz CKCBDJQYNWBZLV-QFBILLFUSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1c(-c2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246162 1029973310 /nfs/dbraw/zinc/97/33/10/1029973310.db2.gz CRVLYZWHKXJQBY-NTZNESFSSA-N 1 0 330.388 3.887 20 5 EHBDRO CC[NH+](CC)Cc1ccc(-c2nc(-c3ccc([N+](=O)[O-])o3)no2)cc1 ZINC000453254064 1029986825 /nfs/dbraw/zinc/98/68/25/1029986825.db2.gz QRJDTVBFZXZNKY-UHFFFAOYSA-N 1 0 342.355 3.747 20 5 EHBDRO CC[C@@H](O)CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525697484 1030027661 /nfs/dbraw/zinc/02/76/61/1030027661.db2.gz LMASIIXDLOLGAA-CYBMUJFWSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000453330949 1030066694 /nfs/dbraw/zinc/06/66/94/1030066694.db2.gz BSSLTFDLXSTDGA-POZUXBRTSA-N 1 0 341.411 3.869 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CC(C)(C)O ZINC000453320118 1030100558 /nfs/dbraw/zinc/10/05/58/1030100558.db2.gz NEAHLVLENUZGGF-OLZOCXBDSA-N 1 0 326.462 3.605 20 5 EHBDRO Cc1ccccc1C[C@H](C)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000447404481 1030172410 /nfs/dbraw/zinc/17/24/10/1030172410.db2.gz JWJYQVYWYUZFHV-AWEZNQCLSA-N 1 0 338.411 3.843 20 5 EHBDRO CCOc1ccc([C@@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365343 1030180641 /nfs/dbraw/zinc/18/06/41/1030180641.db2.gz LVARIAAIFKWXAN-KDOFPFPSSA-N 1 0 334.416 3.557 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCC1 ZINC000583604378 1030267152 /nfs/dbraw/zinc/26/71/52/1030267152.db2.gz MWXQUWDIQZVKFA-MOPGFXCFSA-N 1 0 331.460 3.682 20 5 EHBDRO CCc1ccccc1C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447540983 1030275604 /nfs/dbraw/zinc/27/56/04/1030275604.db2.gz LCALGUCJVOYPCC-IAGOWNOFSA-N 1 0 328.416 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1cccc(F)c1)CCC2 ZINC000447540037 1030276274 /nfs/dbraw/zinc/27/62/74/1030276274.db2.gz IMXRBUFQCLZYTF-GOSISDBHSA-N 1 0 330.359 3.780 20 5 EHBDRO Cc1cc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)ccc1F ZINC000447542964 1030278535 /nfs/dbraw/zinc/27/85/35/1030278535.db2.gz QDKJSHINROOMMG-HZPDHXFCSA-N 1 0 332.379 3.512 20 5 EHBDRO Cc1cccc(C)c1CC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447587231 1030323968 /nfs/dbraw/zinc/32/39/68/1030323968.db2.gz QNJSDEWREJIVPC-MSOLQXFVSA-N 1 0 342.443 3.724 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000447594504 1030331867 /nfs/dbraw/zinc/33/18/67/1030331867.db2.gz ZHZQKXUOYBHFRW-YOEHRIQHSA-N 1 0 347.459 3.661 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)C[NH+]1CCCCC1 ZINC000052488787 1030363530 /nfs/dbraw/zinc/36/35/30/1030363530.db2.gz BYGSAOHHMCLMBT-CQSZACIVSA-N 1 0 328.416 3.677 20 5 EHBDRO C[C@H](CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729484 1030441195 /nfs/dbraw/zinc/44/11/95/1030441195.db2.gz NWROGQFDYQHODM-WBVHZDCISA-N 1 0 340.427 3.670 20 5 EHBDRO C[C@H]([NH2+]CC1(O)CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000482886860 1030782829 /nfs/dbraw/zinc/78/28/29/1030782829.db2.gz HSTHXFOYEJNTQY-LBPRGKRZSA-N 1 0 332.425 3.889 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881640 1030787038 /nfs/dbraw/zinc/78/70/38/1030787038.db2.gz DQYMNIKSRBDWAP-NSHDSACASA-N 1 0 327.812 3.555 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000483104655 1030959919 /nfs/dbraw/zinc/95/99/19/1030959919.db2.gz WFNIHZOTBLRRRZ-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCCc2nc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000160788513 1031023735 /nfs/dbraw/zinc/02/37/35/1031023735.db2.gz UZDYCZVGPXDUBB-ZDUSSCGKSA-N 1 0 332.404 3.693 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483226983 1031040188 /nfs/dbraw/zinc/04/01/88/1031040188.db2.gz JGSULRNQKXRNSW-AWEZNQCLSA-N 1 0 333.432 3.600 20 5 EHBDRO CCC[N@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000161193191 1031388597 /nfs/dbraw/zinc/38/85/97/1031388597.db2.gz BCCADCHDJAMCSB-UHFFFAOYSA-N 1 0 338.791 3.713 20 5 EHBDRO O=[N+]([O-])c1ccccc1Cc1noc([C@@H]2CC[C@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000904080169 1031712076 /nfs/dbraw/zinc/71/20/76/1031712076.db2.gz YPIAASJUTOYSIB-SNPRPXQTSA-N 1 0 342.399 3.552 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)C[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000475741218 1031720336 /nfs/dbraw/zinc/72/03/36/1031720336.db2.gz WHJUIDMUBJQCLR-UMVBOHGHSA-N 1 0 333.432 3.598 20 5 EHBDRO C[C@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000537771231 1031906898 /nfs/dbraw/zinc/90/68/98/1031906898.db2.gz HSDXGJFPZTUPLC-UONOGXRCSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000248552672 1031939642 /nfs/dbraw/zinc/93/96/42/1031939642.db2.gz JDODQEOSTWJJNY-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(C)(C)OC(=O)CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000343707088 1032029981 /nfs/dbraw/zinc/02/99/81/1032029981.db2.gz BDAVEUUHCMOLAM-UHFFFAOYSA-N 1 0 334.416 3.681 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CCOCC1 ZINC000537955783 1032041204 /nfs/dbraw/zinc/04/12/04/1032041204.db2.gz LCGZEIXEZNGHGO-CQSZACIVSA-N 1 0 338.473 3.872 20 5 EHBDRO CCOc1ccccc1[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537966561 1032052186 /nfs/dbraw/zinc/05/21/86/1032052186.db2.gz ROOGKMMOOOFYCS-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C1CCC(C)CC1 ZINC000063482943 1033391015 /nfs/dbraw/zinc/39/10/15/1033391015.db2.gz VFIOWLNGBBEQOF-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594496548 1033399101 /nfs/dbraw/zinc/39/91/01/1033399101.db2.gz NEUCNGRPPBDALG-IAGOWNOFSA-N 1 0 340.379 3.704 20 5 EHBDRO CC(C)(C)OC(=O)[C@@H]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])C1 ZINC000594507409 1033409167 /nfs/dbraw/zinc/40/91/67/1033409167.db2.gz MANHOJXYDUTPAJ-WWGRRREGSA-N 1 0 346.427 3.682 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000594514907 1033420484 /nfs/dbraw/zinc/42/04/84/1033420484.db2.gz MDILYZXCSPBCNZ-AUUYWEPGSA-N 1 0 325.412 3.978 20 5 EHBDRO CCC(=O)c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594597640 1033444326 /nfs/dbraw/zinc/44/43/26/1033444326.db2.gz DGOHZZQYLWFVPN-HOCLYGCPSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ccncc21 ZINC000594596691 1033444687 /nfs/dbraw/zinc/44/46/87/1033444687.db2.gz BEDQPNFWQPHNQO-AEFFLSMTSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H](OC2CCCC2)C(F)(F)F)c1 ZINC000594966363 1033603350 /nfs/dbraw/zinc/60/33/50/1033603350.db2.gz HVPQOFOBJZYAAM-CQSZACIVSA-N 1 0 332.322 3.575 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1OCCc2ccccc21 ZINC000595020173 1033612770 /nfs/dbraw/zinc/61/27/70/1033612770.db2.gz VJRHPSRTIHJJPJ-ORAYPTAESA-N 1 0 342.395 3.568 20 5 EHBDRO C/C=C/C[NH2+]Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000599005728 1033641071 /nfs/dbraw/zinc/64/10/71/1033641071.db2.gz PRUHWFVGXPJXQD-ONEGZZNKSA-N 1 0 342.395 3.848 20 5 EHBDRO COC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cccc(OC)c1 ZINC000595066513 1033644174 /nfs/dbraw/zinc/64/41/74/1033644174.db2.gz ICASTSIRBLXQOK-ROUUACIJSA-N 1 0 342.395 3.568 20 5 EHBDRO COC(=O)CC(C)(C)C[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000595025849 1033649563 /nfs/dbraw/zinc/64/95/63/1033649563.db2.gz IZUIWUKGYWHGPD-ZIAGYGMSSA-N 1 0 336.432 3.922 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000595029142 1033650302 /nfs/dbraw/zinc/65/03/02/1033650302.db2.gz HSTKJNZWZGSJOZ-XFHKCVFHSA-N 1 0 346.427 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000595038538 1033657411 /nfs/dbraw/zinc/65/74/11/1033657411.db2.gz LGFZDNPJFSEKDU-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)CCCCC1 ZINC000595104395 1033691016 /nfs/dbraw/zinc/69/10/16/1033691016.db2.gz PSTYKIAZHGFXNT-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO COc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1C ZINC000595101056 1033691150 /nfs/dbraw/zinc/69/11/50/1033691150.db2.gz AQTQSLARXYHULP-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CC[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595093990 1033701265 /nfs/dbraw/zinc/70/12/65/1033701265.db2.gz RLXASLKVSCVVNU-CQSZACIVSA-N 1 0 328.359 3.576 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061197 1033701561 /nfs/dbraw/zinc/70/15/61/1033701561.db2.gz LDFZZNHRJRCCIY-ACJLOTCBSA-N 1 0 330.384 3.642 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000599073561 1033715444 /nfs/dbraw/zinc/71/54/44/1033715444.db2.gz KDKIHOYVMLLXSO-QAPCUYQASA-N 1 0 331.460 3.522 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCc3ccc(C)cc32)c([N+](=O)[O-])cc1OC ZINC000593675670 1033727169 /nfs/dbraw/zinc/72/71/69/1033727169.db2.gz AZZRSSZMJQEZFP-MRXNPFEDSA-N 1 0 342.395 3.698 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599092082 1033730246 /nfs/dbraw/zinc/73/02/46/1033730246.db2.gz FDRSMOMPYOGJJB-KZULUSFZSA-N 1 0 327.384 3.800 20 5 EHBDRO C[C@@H](COCC1CC1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000593682502 1033752234 /nfs/dbraw/zinc/75/22/34/1033752234.db2.gz QSSMKXCVBZNDSI-ZDUSSCGKSA-N 1 0 330.384 3.760 20 5 EHBDRO CC1(C)Cc2cccc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)c2O1 ZINC000533921402 1033753899 /nfs/dbraw/zinc/75/38/99/1033753899.db2.gz OODAFUAHKDBEJM-UHFFFAOYSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](c1ccccc1)C1(CO)CCC1 ZINC000595502844 1033834547 /nfs/dbraw/zinc/83/45/47/1033834547.db2.gz WYSJWORVOQCELK-GOSISDBHSA-N 1 0 344.386 3.727 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccccc2F)C2CC2)c1 ZINC000603661629 1033840195 /nfs/dbraw/zinc/84/01/95/1033840195.db2.gz JIAYFJCLKSIFJE-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566251 1033843991 /nfs/dbraw/zinc/84/39/91/1033843991.db2.gz NANYGQCVGMNVCQ-WHOFXGATSA-N 1 0 328.372 3.580 20 5 EHBDRO CC(C)C[C@@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[NH+](C)C ZINC000608835785 1033909185 /nfs/dbraw/zinc/90/91/85/1033909185.db2.gz QNRLKZIUBMCGNZ-HNNXBMFYSA-N 1 0 345.443 3.921 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000064029487 1033943656 /nfs/dbraw/zinc/94/36/56/1033943656.db2.gz YBTZWUBHBJVQQC-UHFFFAOYSA-N 1 0 331.441 3.677 20 5 EHBDRO Cc1cc(N2CCC[N@H+](Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000603844875 1033969456 /nfs/dbraw/zinc/96/94/56/1033969456.db2.gz BQIBMXLQQAHNOA-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO CCOc1cc(C[N@H+]2C[C@@H](C)C(F)(F)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000599516181 1033977323 /nfs/dbraw/zinc/97/73/23/1033977323.db2.gz XGPWQNWTESXQBS-TXEJJXNPSA-N 1 0 328.359 3.717 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccccc2C)cc1[N+](=O)[O-] ZINC000603869881 1033997385 /nfs/dbraw/zinc/99/73/85/1033997385.db2.gz VOPNQOPVHDFRQG-UHFFFAOYSA-N 1 0 344.411 3.813 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080910 1034074129 /nfs/dbraw/zinc/07/41/29/1034074129.db2.gz PMGOPXZSZYGHPK-ZDUSSCGKSA-N 1 0 342.399 3.813 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000534102375 1034132247 /nfs/dbraw/zinc/13/22/47/1034132247.db2.gz DMRMEDMGGCUORY-UHFFFAOYSA-N 1 0 326.396 3.513 20 5 EHBDRO CC(C)c1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000169212489 1034150977 /nfs/dbraw/zinc/15/09/77/1034150977.db2.gz UREIRAXHOQAOSX-KRWDZBQOSA-N 1 0 329.400 3.817 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)ccc1[N+](=O)[O-] ZINC000456268842 1034268862 /nfs/dbraw/zinc/26/88/62/1034268862.db2.gz SREIEFNPHHUTHX-GOSISDBHSA-N 1 0 339.395 3.704 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])ccc21 ZINC000456282644 1034302167 /nfs/dbraw/zinc/30/21/67/1034302167.db2.gz SGDZINADHLFNEO-MRXNPFEDSA-N 1 0 343.358 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598340 1034313794 /nfs/dbraw/zinc/31/37/94/1034313794.db2.gz LTKVHVUFAPNFPF-CQSZACIVSA-N 1 0 342.443 3.782 20 5 EHBDRO CC(C)(C)OC(=O)CCCC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000612188648 1034438576 /nfs/dbraw/zinc/43/85/76/1034438576.db2.gz FSOJVRLDUUMJQM-UHFFFAOYSA-N 1 0 342.823 3.850 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000534656231 1034774006 /nfs/dbraw/zinc/77/40/06/1034774006.db2.gz GJXKOVSQRXOWKV-UHFFFAOYSA-N 1 0 345.443 3.910 20 5 EHBDRO CC[C@@H]([NH2+]CCn1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000601964776 1034850972 /nfs/dbraw/zinc/85/09/72/1034850972.db2.gz UJELKCDOCCFBFG-CYBMUJFWSA-N 1 0 342.321 3.551 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000167501380 1034939584 /nfs/dbraw/zinc/93/95/84/1034939584.db2.gz KGDZGDHGYZQDTE-JSGCOSHPSA-N 1 0 347.365 3.803 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@@H]1C ZINC000612530865 1035035914 /nfs/dbraw/zinc/03/59/14/1035035914.db2.gz ZBFSZOHKGMNFCC-OAVHHTNSSA-N 1 0 330.359 3.777 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000411888067 1035070057 /nfs/dbraw/zinc/07/00/57/1035070057.db2.gz ABDQCNDGMWUSJB-BKTGTZMESA-N 1 0 326.396 3.866 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1C[C@@H](O)C[C@H]1c1ccccc1 ZINC000411928038 1035078414 /nfs/dbraw/zinc/07/84/14/1035078414.db2.gz UDQKYXPRLWHCSM-GUYCJALGSA-N 1 0 332.787 3.556 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCc2ccccn2)c2ccccc2)c1 ZINC000179966977 1035095029 /nfs/dbraw/zinc/09/50/29/1035095029.db2.gz DTSPELOIYVHPOY-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN[C@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000548991601 1035405508 /nfs/dbraw/zinc/40/55/08/1035405508.db2.gz KFOLMEAFDBFBQY-GOSISDBHSA-N 1 0 347.846 3.949 20 5 EHBDRO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595427883 1035683504 /nfs/dbraw/zinc/68/35/04/1035683504.db2.gz UFZUXOQNKPIBSC-KRWDZBQOSA-N 1 0 332.375 3.507 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@@H](c1ccccc1C)[NH+](C)C ZINC000340918892 1035771359 /nfs/dbraw/zinc/77/13/59/1035771359.db2.gz OXJKDMBPJNLDIN-CJNGLKHVSA-N 1 0 345.447 3.531 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(Nc2ccccn2)CC1 ZINC000540911791 1035789805 /nfs/dbraw/zinc/78/98/05/1035789805.db2.gz NLYBIIVDAIHLSH-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@@H]([N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000535085160 1035980486 /nfs/dbraw/zinc/98/04/86/1035980486.db2.gz KWUFRDWYTVQKBE-CYBMUJFWSA-N 1 0 330.432 3.862 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)c1 ZINC000780396958 1035994798 /nfs/dbraw/zinc/99/47/98/1035994798.db2.gz GRGGMFHENBNMTN-WIMDODNTSA-N 1 0 338.407 3.806 20 5 EHBDRO COCC[C@@H](C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000414213296 1036091315 /nfs/dbraw/zinc/09/13/15/1036091315.db2.gz XXFWZPAZKPUZFZ-BEFAXECRSA-N 1 0 328.412 3.946 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687380 1036243075 /nfs/dbraw/zinc/24/30/75/1036243075.db2.gz JCIPZARFMLWMOV-BEFAXECRSA-N 1 0 328.412 3.938 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000492788764 1036292570 /nfs/dbraw/zinc/29/25/70/1036292570.db2.gz JSJPVKUBHRQZLY-NVXWUHKLSA-N 1 0 336.457 3.854 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000492790615 1036296694 /nfs/dbraw/zinc/29/66/94/1036296694.db2.gz PWBFRBCHCJQKQF-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@@H](C)O1 ZINC000414252620 1036301215 /nfs/dbraw/zinc/30/12/15/1036301215.db2.gz ATJBXVQHPCVSRN-PGZVSCLCSA-N 1 0 332.444 3.709 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000589327541 1036346417 /nfs/dbraw/zinc/34/64/17/1036346417.db2.gz QZGOVYIUSRIUJO-CQSZACIVSA-N 1 0 332.787 3.650 20 5 EHBDRO CC[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000414268863 1036375654 /nfs/dbraw/zinc/37/56/54/1036375654.db2.gz UBUPDGFOCWQVDP-RWMBFGLXSA-N 1 0 348.369 3.843 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCSCC(F)(F)F)c(Cl)c1 ZINC000541555581 1036449155 /nfs/dbraw/zinc/44/91/55/1036449155.db2.gz GYTHCAVZYPYSAC-UHFFFAOYSA-N 1 0 328.743 3.633 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000572804023 1036501860 /nfs/dbraw/zinc/50/18/60/1036501860.db2.gz MXCOGPZLTQRZQP-CVEARBPZSA-N 1 0 336.819 3.782 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000541685001 1036572083 /nfs/dbraw/zinc/57/20/83/1036572083.db2.gz JMLOCNBYQGEDKJ-VLXJIEOASA-N 1 0 342.395 3.646 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(Cl)cc1 ZINC000089808618 1036660227 /nfs/dbraw/zinc/66/02/27/1036660227.db2.gz CBNAYZFDAQSXLQ-ROUUACIJSA-N 1 0 345.830 3.783 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736838 1036695174 /nfs/dbraw/zinc/69/51/74/1036695174.db2.gz LTXPSCIYHXSGDB-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCO[C@H]21 ZINC000539507466 1036828467 /nfs/dbraw/zinc/82/84/67/1036828467.db2.gz CLVCBCBZOWLMCV-RCCFBDPRSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453811 1036864005 /nfs/dbraw/zinc/86/40/05/1036864005.db2.gz JERVWGFHVKLXLF-ZDUSSCGKSA-N 1 0 345.355 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccccc2OC(F)(F)F)cc1 ZINC000237717972 1036875423 /nfs/dbraw/zinc/87/54/23/1036875423.db2.gz FSNJIURLHRIZOI-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCC[C@H](CO)C2)c2ccccc2)c1 ZINC000414349938 1036878685 /nfs/dbraw/zinc/87/86/85/1036878685.db2.gz YMSJVTQQTLLYKO-ZAAXVRCTSA-N 1 0 340.423 3.825 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000376448374 1036887439 /nfs/dbraw/zinc/88/74/39/1036887439.db2.gz MNAMAXKBEJQBJW-YVEFUNNKSA-N 1 0 346.456 3.734 20 5 EHBDRO C[C@@H]1C[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233797 1036957965 /nfs/dbraw/zinc/95/79/65/1036957965.db2.gz UYHZXTBHFAACFG-ZTNFWEORSA-N 1 0 339.439 3.757 20 5 EHBDRO CN(C)c1cccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761514350 1037093346 /nfs/dbraw/zinc/09/33/46/1037093346.db2.gz HQRIOKMJDOUCTP-UHFFFAOYSA-N 1 0 333.819 3.946 20 5 EHBDRO CC(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524370 1037095399 /nfs/dbraw/zinc/09/53/99/1037095399.db2.gz BXKCSXHPPRQLTB-BBRMVZONSA-N 1 0 326.824 3.789 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000542185221 1037145235 /nfs/dbraw/zinc/14/52/35/1037145235.db2.gz OCGKOWQRNATKOL-CFVMTHIKSA-N 1 0 334.416 3.623 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595035773 1037191064 /nfs/dbraw/zinc/19/10/64/1037191064.db2.gz MJTOVSCKRZTIND-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1cnccc1[C@H](C)[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000188769363 1037213532 /nfs/dbraw/zinc/21/35/32/1037213532.db2.gz NOSWATYGOOUMNB-KBPBESRZSA-N 1 0 329.400 3.670 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC[C@H]3C3CC3)s2)cc1 ZINC000539818354 1037239505 /nfs/dbraw/zinc/23/95/05/1037239505.db2.gz XEPAFFHOCNSBKM-KRWDZBQOSA-N 1 0 344.436 3.934 20 5 EHBDRO Cc1cc(N2CC[NH+]([C@@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000462694774 1037287679 /nfs/dbraw/zinc/28/76/79/1037287679.db2.gz HDHBXFYMQLKKHW-AWEZNQCLSA-N 1 0 331.441 3.848 20 5 EHBDRO Cc1cnc(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311041765 1037292096 /nfs/dbraw/zinc/29/20/96/1037292096.db2.gz SCHXWTPJEFZMGQ-KRWDZBQOSA-N 1 0 340.427 3.622 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899995 1037340888 /nfs/dbraw/zinc/34/08/88/1037340888.db2.gz MFHWOCCRKNSHRX-IAGOWNOFSA-N 1 0 332.444 3.967 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)s1 ZINC000171127828 1037468342 /nfs/dbraw/zinc/46/83/42/1037468342.db2.gz QASPOCQRZCGPHT-LLVKDONJSA-N 1 0 348.424 3.990 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]([C@@H](C)CO)C1CCCC1 ZINC000472619544 1037543570 /nfs/dbraw/zinc/54/35/70/1037543570.db2.gz RAQJWKFKECLYKC-AWEZNQCLSA-N 1 0 336.432 3.507 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000532549795 1037591020 /nfs/dbraw/zinc/59/10/20/1037591020.db2.gz YPTPHKGLMZYRHC-MRXNPFEDSA-N 1 0 336.338 3.993 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000532551552 1037602270 /nfs/dbraw/zinc/60/22/70/1037602270.db2.gz VTCIVONPLRXUSE-YJBOKZPZSA-N 1 0 328.412 3.812 20 5 EHBDRO CSc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)ccn1 ZINC000540136325 1037608442 /nfs/dbraw/zinc/60/84/42/1037608442.db2.gz NJXMKDPIPZAESW-INIZCTEOSA-N 1 0 343.452 3.823 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000468638674 1037609253 /nfs/dbraw/zinc/60/92/53/1037609253.db2.gz OYYSMPQKRBASAW-VBKFSLOCSA-N 1 0 348.406 3.974 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCOc2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000540160407 1037617498 /nfs/dbraw/zinc/61/74/98/1037617498.db2.gz KBXONIIXQOHBPF-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000491822861 1037691541 /nfs/dbraw/zinc/69/15/41/1037691541.db2.gz YAEQLTOPMBTXQJ-CABCVRRESA-N 1 0 333.432 3.790 20 5 EHBDRO COCc1cccc(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468641825 1037719293 /nfs/dbraw/zinc/71/92/93/1037719293.db2.gz MVANKDCLXUSWDH-DHDCSXOGSA-N 1 0 326.396 3.934 20 5 EHBDRO C[NH2+]Cc1ccc(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000415970085 1037757404 /nfs/dbraw/zinc/75/74/04/1037757404.db2.gz GZHUPSMSCKGROJ-ZDUSSCGKSA-N 1 0 342.399 3.505 20 5 EHBDRO O=C(N[C@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc2ccccc2c2cccnc12 ZINC000058299830 1037782360 /nfs/dbraw/zinc/78/23/60/1037782360.db2.gz WCDDTPNNRMXCRJ-PMACEKPBSA-N 1 0 345.446 3.745 20 5 EHBDRO CC(C)c1ccc([C@H]([NH2+]CCn2cc([N+](=O)[O-])cn2)C(C)C)cc1 ZINC000540341859 1037843032 /nfs/dbraw/zinc/84/30/32/1037843032.db2.gz ZUOCMTWIYGFPPF-GOSISDBHSA-N 1 0 330.432 3.902 20 5 EHBDRO C[C@H]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001225 1037852835 /nfs/dbraw/zinc/85/28/35/1037852835.db2.gz QDUSPZLMJZAXGZ-BLLLJJGKSA-N 1 0 334.807 3.528 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000540446160 1037946351 /nfs/dbraw/zinc/94/63/51/1037946351.db2.gz PBJNYYHDIRJOME-OAHLLOKOSA-N 1 0 336.338 3.993 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CC2CCC(F)CC2)c1 ZINC000592377377 1037949026 /nfs/dbraw/zinc/94/90/26/1037949026.db2.gz RCZGHJXFTIESJZ-UHFFFAOYSA-N 1 0 332.322 3.814 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000540589774 1038117242 /nfs/dbraw/zinc/11/72/42/1038117242.db2.gz KHZTWIRIZCOFCT-LJQANCHMSA-N 1 0 339.395 3.583 20 5 EHBDRO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(Cl)s1 ZINC000058563104 1038123317 /nfs/dbraw/zinc/12/33/17/1038123317.db2.gz FZYSHGPDJQHTKU-UHFFFAOYSA-N 1 0 326.805 3.821 20 5 EHBDRO CC(C)(C)C1CCC(O)(C[NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000236817454 1038135124 /nfs/dbraw/zinc/13/51/24/1038135124.db2.gz YGMYNWCIIVEQRG-UHFFFAOYSA-N 1 0 326.462 3.713 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000897469705 1038135447 /nfs/dbraw/zinc/13/54/47/1038135447.db2.gz PBPXWTVPLZMLDS-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661370 1038440696 /nfs/dbraw/zinc/44/06/96/1038440696.db2.gz SMXRCLODSAKXLU-ZIAGYGMSSA-N 1 0 329.400 3.770 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000538760041 1038509448 /nfs/dbraw/zinc/50/94/48/1038509448.db2.gz NPJDZVPOWSSHTC-CABCVRRESA-N 1 0 347.459 3.513 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000538760043 1038509862 /nfs/dbraw/zinc/50/98/62/1038509862.db2.gz NPJDZVPOWSSHTC-HUUCEWRRSA-N 1 0 347.459 3.513 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H](CO)C(C)(C)C ZINC000538761417 1038527740 /nfs/dbraw/zinc/52/77/40/1038527740.db2.gz CKRRLLBQEGUPER-QGZVFWFLSA-N 1 0 332.400 3.694 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000539079139 1038674179 /nfs/dbraw/zinc/67/41/79/1038674179.db2.gz ITCVGSZCXMNHMW-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000552034826 1038755168 /nfs/dbraw/zinc/75/51/68/1038755168.db2.gz BXLLHLFXMMBMCA-QGZVFWFLSA-N 1 0 344.415 3.608 20 5 EHBDRO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036465 1039139953 /nfs/dbraw/zinc/13/99/53/1039139953.db2.gz KXFXPUSGZAADQS-MAUKXSAKSA-N 1 0 328.416 3.573 20 5 EHBDRO CC(C)[C@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CS1 ZINC000488518027 1039253846 /nfs/dbraw/zinc/25/38/46/1039253846.db2.gz PLXXNMOXESPCHV-DZGCQCFKSA-N 1 0 328.865 3.910 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)cc1[N+](=O)[O-] ZINC000480276680 1039374216 /nfs/dbraw/zinc/37/42/16/1039374216.db2.gz HUXATSLBNYDUIL-SUMWQHHRSA-N 1 0 333.457 3.918 20 5 EHBDRO CC(C)CC[C@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001167905015 1039379938 /nfs/dbraw/zinc/37/99/38/1039379938.db2.gz PUNSRPWNFBMKGH-QGZVFWFLSA-N 1 0 347.459 3.848 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+]C(C)(C)C)cc([N+](=O)[O-])cc1C(F)(F)F ZINC000906406075 1039528617 /nfs/dbraw/zinc/52/86/17/1039528617.db2.gz XIBZZEXVDYEVHU-UHFFFAOYSA-N 1 0 347.337 3.639 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417314617 1039668545 /nfs/dbraw/zinc/66/85/45/1039668545.db2.gz RNOWDYYCMFOVGL-BYCMXARLSA-N 1 0 332.425 3.947 20 5 EHBDRO Cc1cc(C)n(CCC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417326285 1039685122 /nfs/dbraw/zinc/68/51/22/1039685122.db2.gz RPKZONIRBBNKFI-IBGZPJMESA-N 1 0 342.443 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3ccsc3)CC2)cc1 ZINC000485990993 1039762770 /nfs/dbraw/zinc/76/27/70/1039762770.db2.gz PARPAJGQEUUMJX-UHFFFAOYSA-N 1 0 332.425 3.915 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000554945284 1039968485 /nfs/dbraw/zinc/96/84/85/1039968485.db2.gz GQADKLUSSFVRDP-DOTOQJQBSA-N 1 0 337.423 3.793 20 5 EHBDRO CC(=O)c1cc(N[C@@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331062 1039979520 /nfs/dbraw/zinc/97/95/20/1039979520.db2.gz RZPZBRPFCIUQGS-MJBXVCDLSA-N 1 0 333.432 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCN3CCCCC3)s2)cc1 ZINC000555196659 1040271863 /nfs/dbraw/zinc/27/18/63/1040271863.db2.gz RXNBCJZBSUSHRJ-UHFFFAOYSA-N 1 0 345.468 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000490561519 1040609749 /nfs/dbraw/zinc/60/97/49/1040609749.db2.gz CWMUWJBJNFWWQQ-SFHVURJKSA-N 1 0 344.386 3.568 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H](C)CCCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453281103 1040621810 /nfs/dbraw/zinc/62/18/10/1040621810.db2.gz HEVGHDZUDWIOKE-KUHUBIRLSA-N 1 0 346.427 3.980 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(SC)CC1 ZINC000433069096 1040628478 /nfs/dbraw/zinc/62/84/78/1040628478.db2.gz RBJODVPZYUPJPN-LBPRGKRZSA-N 1 0 326.487 3.951 20 5 EHBDRO COc1ccc(OC)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000027602550 1040712825 /nfs/dbraw/zinc/71/28/25/1040712825.db2.gz ZOGHKBKVFDJTQE-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117771 1040795150 /nfs/dbraw/zinc/79/51/50/1040795150.db2.gz VHERSKVWRWYSJO-INIZCTEOSA-N 1 0 331.416 3.639 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433163702 1040948790 /nfs/dbraw/zinc/94/87/90/1040948790.db2.gz CLLKUZIWXSMBEM-APWZRJJASA-N 1 0 340.423 3.510 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(CO)CC2(CCC2)C1 ZINC000433188790 1041029379 /nfs/dbraw/zinc/02/93/79/1041029379.db2.gz RATGJPOESOSAHY-OVCLIPMQSA-N 1 0 330.428 3.531 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CC1(CO)CC(c2ccccc2)C1 ZINC000433204608 1041057719 /nfs/dbraw/zinc/05/77/19/1041057719.db2.gz BSVOGKLTRAHBAL-UHFFFAOYSA-N 1 0 340.423 3.549 20 5 EHBDRO Cc1cnc(N[C@H](C[NH+]2CCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000078629161 1041126454 /nfs/dbraw/zinc/12/64/54/1041126454.db2.gz VVNPBBGNMGFJIC-MRXNPFEDSA-N 1 0 326.400 3.547 20 5 EHBDRO Cc1cnc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000078629158 1041134143 /nfs/dbraw/zinc/13/41/43/1041134143.db2.gz VVNPBBGNMGFJIC-INIZCTEOSA-N 1 0 326.400 3.547 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCCNc2ccccn2)c2cc([N+](=O)[O-])ccc21 ZINC000433284638 1041232575 /nfs/dbraw/zinc/23/25/75/1041232575.db2.gz FEYYLVCXOOXZEI-KRWDZBQOSA-N 1 0 340.427 3.804 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000481720078 1041284359 /nfs/dbraw/zinc/28/43/59/1041284359.db2.gz SIHCGSRDQXVBRZ-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCCO1 ZINC000511662217 1041372268 /nfs/dbraw/zinc/37/22/68/1041372268.db2.gz ANWYRJLWUGDZLD-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710998 1041473856 /nfs/dbraw/zinc/47/38/56/1041473856.db2.gz CHYNDCFCJONRGN-MELADBBJSA-N 1 0 333.432 3.576 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCOCC1 ZINC000123973278 1042072947 /nfs/dbraw/zinc/07/29/47/1042072947.db2.gz PMTXZYYIBKTRQM-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCC([NH+]4CCCCC4)CC3)ccnc21 ZINC000432332021 1042955350 /nfs/dbraw/zinc/95/53/50/1042955350.db2.gz SGRUTACPZDGATJ-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000106466038 1042986118 /nfs/dbraw/zinc/98/61/18/1042986118.db2.gz ITZVZBMVGCWEJG-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCCOc2ccc(F)cc21 ZINC000344093953 1043243402 /nfs/dbraw/zinc/24/34/02/1043243402.db2.gz QDEQARQUIXQFMT-INIZCTEOSA-N 1 0 330.359 3.780 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2ccc(F)cc21 ZINC000344103137 1043253580 /nfs/dbraw/zinc/25/35/80/1043253580.db2.gz NYAHVOVPXYVYRX-QGZVFWFLSA-N 1 0 330.359 3.910 20 5 EHBDRO Cn1ncc2c1CCC[C@@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279105191 1043353280 /nfs/dbraw/zinc/35/32/80/1043353280.db2.gz OTHDYAPVPSNGAP-DLBZAZTESA-N 1 0 340.427 3.718 20 5 EHBDRO CO[C@H](CC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000344799251 1044433837 /nfs/dbraw/zinc/43/38/37/1044433837.db2.gz SNXMOYNUZFBUHQ-BMGYJQCNSA-N 1 0 332.322 3.555 20 5 EHBDRO CC[C@H]1c2ccsc2CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930164 1044512720 /nfs/dbraw/zinc/51/27/20/1044512720.db2.gz RYHYJPWCHHMWNE-HOTGVXAUSA-N 1 0 332.425 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCN3CCCC3)s2)cc1 ZINC000500460426 1044872982 /nfs/dbraw/zinc/87/29/82/1044872982.db2.gz JNMXHIFJTYRQAD-UHFFFAOYSA-N 1 0 331.441 3.509 20 5 EHBDRO O=C(C[NH2+]C1(c2ccccc2)CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000183538118 1125591649 /nfs/dbraw/zinc/59/16/49/1125591649.db2.gz HYLWLKJKSOQKDV-UHFFFAOYSA-N 1 0 339.395 3.592 20 5 EHBDRO C[N@H+](CCc1ccncc1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000183758036 1125773273 /nfs/dbraw/zinc/77/32/73/1125773273.db2.gz JGBRYDDEJPPGSR-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO Cc1cnc([C@@H]([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000185302925 1126856397 /nfs/dbraw/zinc/85/63/97/1126856397.db2.gz QEYOSIKAKMOLOP-INIZCTEOSA-N 1 0 347.440 3.870 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4ccccc4F)C3)nc2c1 ZINC000083171048 1127220537 /nfs/dbraw/zinc/22/05/37/1127220537.db2.gz XTQUCXWIULSMCC-GFCCVEGCSA-N 1 0 341.342 3.865 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ccc(F)cc2F)C2CC2)cc1 ZINC001168541067 1127615555 /nfs/dbraw/zinc/61/55/55/1127615555.db2.gz FVSWUSMJWJACQR-GOSISDBHSA-N 1 0 348.349 3.993 20 5 EHBDRO C[C@H](C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438417 1127744039 /nfs/dbraw/zinc/74/40/39/1127744039.db2.gz HRVTZKZLNKTKDS-OLZOCXBDSA-N 1 0 337.420 3.501 20 5 EHBDRO Cc1cc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000301427760 1127873740 /nfs/dbraw/zinc/87/37/40/1127873740.db2.gz IHNLBXWKZGOINZ-CXAGYDPISA-N 1 0 346.456 3.855 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571444 1128104989 /nfs/dbraw/zinc/10/49/89/1128104989.db2.gz REQQJRMIDGTPNJ-GHMZBOCLSA-N 1 0 344.358 3.683 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478250 1131242257 /nfs/dbraw/zinc/24/22/57/1131242257.db2.gz XXRKYODHZIPQDE-YOEHRIQHSA-N 1 0 336.395 3.780 20 5 EHBDRO C[NH+](C)CC1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000553298677 1128406571 /nfs/dbraw/zinc/40/65/71/1128406571.db2.gz GYFANJBVAJERNU-UHFFFAOYSA-N 1 0 332.231 3.680 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCSC(C)(C)C1 ZINC000903280810 1128465361 /nfs/dbraw/zinc/46/53/61/1128465361.db2.gz DHOKAAJUBWHWLV-FZMZJTMJSA-N 1 0 326.437 3.929 20 5 EHBDRO COCC[C@H](NCc1cc([N+](=O)[O-])ccc1OC(C)C)c1ccco1 ZINC000273305468 1128481879 /nfs/dbraw/zinc/48/18/79/1128481879.db2.gz SLKHNMQHCYOENJ-INIZCTEOSA-N 1 0 348.399 3.842 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301572545 1128499270 /nfs/dbraw/zinc/49/92/70/1128499270.db2.gz YSJKTOHZIMEZHZ-WBVHZDCISA-N 1 0 340.427 3.763 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846230 1128550149 /nfs/dbraw/zinc/55/01/49/1128550149.db2.gz WKNYNNZKOFQCNA-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000273535798 1128584588 /nfs/dbraw/zinc/58/45/88/1128584588.db2.gz WFFRCXXCXMZRMG-SJLPKXTDSA-N 1 0 330.359 3.744 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCCCN2CC)cc1[N+](=O)[O-] ZINC000153723462 1128655114 /nfs/dbraw/zinc/65/51/14/1128655114.db2.gz JAKUJWWHJAJSBM-GOEBONIOSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1nc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651013 1128845883 /nfs/dbraw/zinc/84/58/83/1128845883.db2.gz JUODLXGCXRDQAN-SUMWQHHRSA-N 1 0 346.456 3.855 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCOC1 ZINC000494449504 1120561931 /nfs/dbraw/zinc/56/19/31/1120561931.db2.gz YMDIRVKLBWDJIC-RISCZKNCSA-N 1 0 332.322 3.518 20 5 EHBDRO COC[C@@H](CC(C)C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494516369 1120576889 /nfs/dbraw/zinc/57/68/89/1120576889.db2.gz TYOMGBYIUUWDRB-CYBMUJFWSA-N 1 0 334.338 3.764 20 5 EHBDRO CC(C)C[N@H+](Cn1cc(Br)c([N+](=O)[O-])n1)CC(C)(C)C ZINC000761831761 1120975849 /nfs/dbraw/zinc/97/58/49/1120975849.db2.gz OIWBQUZXZLZIMY-UHFFFAOYSA-N 1 0 347.257 3.515 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957921 1128959522 /nfs/dbraw/zinc/95/95/22/1128959522.db2.gz GEXGWCMCZKGRGG-SJLPKXTDSA-N 1 0 345.830 3.783 20 5 EHBDRO CC(C)C[C@H](CNc1ccc([N+](=O)[O-])cn1)[NH2+][C@H](C)c1ccccc1 ZINC000495320173 1121073868 /nfs/dbraw/zinc/07/38/68/1121073868.db2.gz YSVQTOKDVFMIEL-NVXWUHKLSA-N 1 0 342.443 3.589 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000064808224 1128964895 /nfs/dbraw/zinc/96/48/95/1128964895.db2.gz FHEJZPQPHJFNCB-QWHCGFSZSA-N 1 0 334.416 3.860 20 5 EHBDRO C[C@H](CCSc1ccccc1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000495475336 1121226178 /nfs/dbraw/zinc/22/61/78/1121226178.db2.gz JQKYMYIMASFFAX-CQSZACIVSA-N 1 0 343.452 3.919 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000495690201 1121358722 /nfs/dbraw/zinc/35/87/22/1121358722.db2.gz LHVNGPVBXDOFKJ-ZDUSSCGKSA-N 1 0 343.383 3.932 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCO[C@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000090540832 1121479836 /nfs/dbraw/zinc/47/98/36/1121479836.db2.gz ZUSRWJPZZBESAI-GRDNDAEWSA-N 1 0 336.457 3.609 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000193630270 1121514282 /nfs/dbraw/zinc/51/42/82/1121514282.db2.gz OFUDUTQNCVINGX-HNNXBMFYSA-N 1 0 327.384 3.664 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CCC(C[NH+]2CCCCCC2)CC1 ZINC000915714994 1121602794 /nfs/dbraw/zinc/60/27/94/1121602794.db2.gz SULGAKDLDLZIMC-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCCOc2cccc3cccnc32)c1 ZINC000113342962 1129003392 /nfs/dbraw/zinc/00/33/92/1129003392.db2.gz DGLLRFVTYOHKIC-UHFFFAOYSA-N 1 0 337.379 3.702 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)C[NH+]1CCCCC1 ZINC000301103018 1121704799 /nfs/dbraw/zinc/70/47/99/1121704799.db2.gz RCACLLRTYUXJQK-AWEZNQCLSA-N 1 0 328.416 3.677 20 5 EHBDRO CC(C)CCOC1CC[NH+](CCOc2ccccc2[N+](=O)[O-])CC1 ZINC000193862108 1121721997 /nfs/dbraw/zinc/72/19/97/1121721997.db2.gz VPMWZEGDUDDPPR-UHFFFAOYSA-N 1 0 336.432 3.501 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000194059431 1121764673 /nfs/dbraw/zinc/76/46/73/1121764673.db2.gz VYBNMYCDHLEGAO-CABCVRRESA-N 1 0 347.459 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ccccc2)c2ccccn2)cc1 ZINC000326435871 1121942181 /nfs/dbraw/zinc/94/21/81/1121942181.db2.gz XSBDVODAGNDQSK-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NCC1([NH+]2CCSCC2)CCCC1 ZINC000301115383 1121950077 /nfs/dbraw/zinc/95/00/77/1121950077.db2.gz VFCHZMYGKBEMMM-UHFFFAOYSA-N 1 0 339.436 3.507 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000917073205 1122478165 /nfs/dbraw/zinc/47/81/65/1122478165.db2.gz ITROXJYTLRLKGM-CYBMUJFWSA-N 1 0 336.392 3.570 20 5 EHBDRO CCCC[NH+](CCCC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917431217 1122607130 /nfs/dbraw/zinc/60/71/30/1122607130.db2.gz NSYJODMLVHAUSE-UHFFFAOYSA-N 1 0 331.420 3.713 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H](C)CSC)o2)c([N+](=O)[O-])c1 ZINC000130702673 1123255069 /nfs/dbraw/zinc/25/50/69/1123255069.db2.gz AEFPCGQUVHZHKG-NSHDSACASA-N 1 0 336.413 3.705 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000609571595 1123611350 /nfs/dbraw/zinc/61/13/50/1123611350.db2.gz URRCIBQSEWSZKQ-GOSISDBHSA-N 1 0 348.399 3.504 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672479 1123636731 /nfs/dbraw/zinc/63/67/31/1123636731.db2.gz CGFYWZZDTLYOOJ-WBVHZDCISA-N 1 0 326.396 3.852 20 5 EHBDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090809974 1123789486 /nfs/dbraw/zinc/78/94/86/1123789486.db2.gz AULIWBRBFQQTJP-SJLPKXTDSA-N 1 0 334.460 3.549 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000090810265 1123790742 /nfs/dbraw/zinc/79/07/42/1123790742.db2.gz ZEKQJEUXODOYLG-CXAGYDPISA-N 1 0 338.448 3.687 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2F)c1 ZINC000054762783 1123839428 /nfs/dbraw/zinc/83/94/28/1123839428.db2.gz VHNRVIKKVWLOOX-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO C[C@H](O)C[C@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000543063781 1129175497 /nfs/dbraw/zinc/17/54/97/1129175497.db2.gz OZFWUVGHQFHNPH-GJZGRUSLSA-N 1 0 343.427 3.612 20 5 EHBDRO Cc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2Cl)[NH+](C)C)cc1 ZINC000301255410 1124952743 /nfs/dbraw/zinc/95/27/43/1124952743.db2.gz DDNFMPJTAPOFRN-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000069752207 1125037528 /nfs/dbraw/zinc/03/75/28/1125037528.db2.gz XZLKKCYSQYRWDF-OLZOCXBDSA-N 1 0 342.395 3.778 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC000181828146 1125054004 /nfs/dbraw/zinc/05/40/04/1125054004.db2.gz VLLBBYUZBIANGR-UHFFFAOYSA-N 1 0 334.464 3.637 20 5 EHBDRO CCC[C@@]1(COC)CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550628 1125106535 /nfs/dbraw/zinc/10/65/35/1125106535.db2.gz LPNFHXVSOTUMAN-KRWDZBQOSA-N 1 0 333.388 3.517 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618568531 1125113689 /nfs/dbraw/zinc/11/36/89/1125113689.db2.gz FANMGMVXCQQQKY-SFHVURJKSA-N 1 0 341.411 3.782 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571685 1125120510 /nfs/dbraw/zinc/12/05/10/1125120510.db2.gz LAQVIQHTMXWDJK-UAOJZALGSA-N 1 0 340.423 3.726 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1ccsc1 ZINC000619754102 1125395480 /nfs/dbraw/zinc/39/54/80/1125395480.db2.gz CHUQBCSSMZUQEO-NEPJUHHUSA-N 1 0 333.413 3.724 20 5 EHBDRO CCCN1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3C)c2C1 ZINC000066514146 1129179245 /nfs/dbraw/zinc/17/92/45/1129179245.db2.gz WTRUWLMHBGNFAC-UHFFFAOYSA-N 1 0 339.395 3.881 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000301912720 1129347064 /nfs/dbraw/zinc/34/70/64/1129347064.db2.gz HEKHWQAJDNRVDZ-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@H]1C1CC1 ZINC000543242305 1129365829 /nfs/dbraw/zinc/36/58/29/1129365829.db2.gz JYRCIKWWZPTKFE-OALUTQOASA-N 1 0 342.395 3.902 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCC(C)(C)[NH2+][C@H](C)c1ccccc1 ZINC000301950045 1129401461 /nfs/dbraw/zinc/40/14/61/1129401461.db2.gz GHBTVVFWCMLLOS-CQSZACIVSA-N 1 0 328.416 3.840 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000027869624 1129401612 /nfs/dbraw/zinc/40/16/12/1129401612.db2.gz OOPULCKCDHMXOO-UHFFFAOYSA-N 1 0 325.412 3.714 20 5 EHBDRO C[C@H]([NH2+][C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674604 1129451362 /nfs/dbraw/zinc/45/13/62/1129451362.db2.gz PCHGDBFDYKENHJ-UGSOOPFHSA-N 1 0 339.395 3.663 20 5 EHBDRO C[C@@H]([NH2+][C@@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674613 1129451397 /nfs/dbraw/zinc/45/13/97/1129451397.db2.gz PCHGDBFDYKENHJ-ACJLOTCBSA-N 1 0 339.395 3.663 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@](C)(O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402055 1129462429 /nfs/dbraw/zinc/46/24/29/1129462429.db2.gz CQRNSIXWRXWOBL-ZWKOTPCHSA-N 1 0 332.400 3.590 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000466488076 1129489587 /nfs/dbraw/zinc/48/95/87/1129489587.db2.gz GOVSWUWMHVMYIY-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(Nc2cccc(C[NH+]3CCSCC3)c2)cc1 ZINC000301998142 1129505568 /nfs/dbraw/zinc/50/55/68/1129505568.db2.gz UMWXUNSMBSUTJS-UHFFFAOYSA-N 1 0 329.425 3.887 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000092586113 1129552875 /nfs/dbraw/zinc/55/28/75/1129552875.db2.gz FUCPPIXUMHSNHS-AWEZNQCLSA-N 1 0 328.416 3.617 20 5 EHBDRO C[C@H]([NH2+]CC1CCN(C(=O)C(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000331095467 1129652852 /nfs/dbraw/zinc/65/28/52/1129652852.db2.gz LILXSJLYLNIKCB-AWEZNQCLSA-N 1 0 347.459 3.530 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000125235815 1129672610 /nfs/dbraw/zinc/67/26/10/1129672610.db2.gz QCRDQFUORISOLM-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433875 1129691751 /nfs/dbraw/zinc/69/17/51/1129691751.db2.gz FOXKSGOKCFWXCY-STQMWFEESA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)cnn1C ZINC000156537536 1129722976 /nfs/dbraw/zinc/72/29/76/1129722976.db2.gz UFZOGBUVCYGFMK-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO Cc1cc(NC2CC[NH+](CC(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302041125 1129764757 /nfs/dbraw/zinc/76/47/57/1129764757.db2.gz WLZCMXXKDZDSGC-UHFFFAOYSA-N 1 0 342.443 3.984 20 5 EHBDRO Cc1cc(N2CC[C@H](OCC(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302081970 1129767071 /nfs/dbraw/zinc/76/70/71/1129767071.db2.gz LVHJRYWNMWBDJB-HNNXBMFYSA-N 1 0 329.400 3.703 20 5 EHBDRO CC(C)C[NH+]1CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000131161467 1129772239 /nfs/dbraw/zinc/77/22/39/1129772239.db2.gz PQOMULFKNAERLX-LJQANCHMSA-N 1 0 345.487 3.626 20 5 EHBDRO Cc1cc(NC[C@@H](C)C[NH+]2CCCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302679084 1129785252 /nfs/dbraw/zinc/78/52/52/1129785252.db2.gz RFICASOGNQRHSP-CYBMUJFWSA-N 1 0 328.416 3.595 20 5 EHBDRO Cc1ccc([C@@H](CNc2c3c(ccc2[N+](=O)[O-])NCC3)[NH+](C)C)cc1 ZINC000302882444 1129797272 /nfs/dbraw/zinc/79/72/72/1129797272.db2.gz JYTISDFPXRSFBF-GOSISDBHSA-N 1 0 340.427 3.586 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196366 1129805790 /nfs/dbraw/zinc/80/57/90/1129805790.db2.gz FOXLQVNSTPQZSJ-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196345 1129806321 /nfs/dbraw/zinc/80/63/21/1129806321.db2.gz NSKJMSZBBOGRFI-QWHCGFSZSA-N 1 0 345.374 3.720 20 5 EHBDRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196399 1129806354 /nfs/dbraw/zinc/80/63/54/1129806354.db2.gz RDKZWRFTCILAKT-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148174 1129854277 /nfs/dbraw/zinc/85/42/77/1129854277.db2.gz AQAATKKWPNKYRV-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO CCC[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)C ZINC000604492914 1129931318 /nfs/dbraw/zinc/93/13/18/1129931318.db2.gz VCSWSPYUDYYVKP-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880040 1130177940 /nfs/dbraw/zinc/17/79/40/1130177940.db2.gz UYPJRTDGDDNNFP-CHWSQXEVSA-N 1 0 337.420 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(Br)c2)cc1 ZINC000040675851 1130242803 /nfs/dbraw/zinc/24/28/03/1130242803.db2.gz MYLDEUHQMKWACG-UHFFFAOYSA-N 1 0 335.201 3.690 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000174035567 1130331922 /nfs/dbraw/zinc/33/19/22/1130331922.db2.gz VWUMAMSIEOMUAZ-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)O[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000728167594 1130642468 /nfs/dbraw/zinc/64/24/68/1130642468.db2.gz PQFNBZCHYMCJCP-ZDUSSCGKSA-N 1 0 346.383 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000732050196 1130883879 /nfs/dbraw/zinc/88/38/79/1130883879.db2.gz MGJBBQCUDMHCAQ-UHFFFAOYSA-N 1 0 336.392 3.571 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000348085969 1131151229 /nfs/dbraw/zinc/15/12/29/1131151229.db2.gz NEQJQSRSCRNUCG-SFHVURJKSA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000741260332 1131590933 /nfs/dbraw/zinc/59/09/33/1131590933.db2.gz HDJWVBPLUHWRGS-MRXNPFEDSA-N 1 0 342.351 3.579 20 5 EHBDRO Cc1ncc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)n1-c1ccccc1 ZINC000742709298 1131772139 /nfs/dbraw/zinc/77/21/39/1131772139.db2.gz DJOLOIMYNHYDCM-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172899311 1131882557 /nfs/dbraw/zinc/88/25/57/1131882557.db2.gz WJIAMNUFWOWYJE-GOSISDBHSA-N 1 0 340.423 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ncc(Cl)s1)CC2 ZINC001172903747 1131886370 /nfs/dbraw/zinc/88/63/70/1131886370.db2.gz SXRXAKZGHBCERM-LBPRGKRZSA-N 1 0 337.832 3.742 20 5 EHBDRO Cc1cc2c(cn1)[C@@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172903765 1131886969 /nfs/dbraw/zinc/88/69/69/1131886969.db2.gz IEQQJRXLHRKYNX-PXNSSMCTSA-N 1 0 337.423 3.823 20 5 EHBDRO O=C1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@H]12 ZINC001172908403 1131887967 /nfs/dbraw/zinc/88/79/67/1131887967.db2.gz MDOITLZGSHBJDY-NZSAHSFTSA-N 1 0 342.439 3.676 20 5 EHBDRO COC(=O)CCCCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895623 1131901408 /nfs/dbraw/zinc/90/14/08/1131901408.db2.gz GNRJHZDMDBGXOU-QGZVFWFLSA-N 1 0 348.443 3.555 20 5 EHBDRO CCCCCN1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172916523 1131903983 /nfs/dbraw/zinc/90/39/83/1131903983.db2.gz TWIYJNDBZKITQD-LJQANCHMSA-N 1 0 345.487 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCOC3(CCCCC3)C1)CC2 ZINC001172919222 1131904391 /nfs/dbraw/zinc/90/43/91/1131904391.db2.gz FJECSIYOXIKXDK-SFHVURJKSA-N 1 0 344.455 3.877 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1COc3ccc(F)cc31)CC2 ZINC001172912094 1131917861 /nfs/dbraw/zinc/91/78/61/1131917861.db2.gz LUNZOAYNQZYMAM-CRAIPNDOSA-N 1 0 342.370 3.705 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)c1F ZINC001173174915 1131991043 /nfs/dbraw/zinc/99/10/43/1131991043.db2.gz GBZBTGFVACZBJZ-IJLUTSLNSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)Cc2ccc(C)nc2)c1F ZINC001173191200 1131995044 /nfs/dbraw/zinc/99/50/44/1131995044.db2.gz BACCWDNJIGCXIZ-CYBMUJFWSA-N 1 0 347.390 3.509 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC001173218443 1132003448 /nfs/dbraw/zinc/00/34/48/1132003448.db2.gz AUXOYWDLJZYAKW-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO Cc1ncccc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173218377 1132003461 /nfs/dbraw/zinc/00/34/61/1132003461.db2.gz ANOMXACYSIRVLM-ORAYPTAESA-N 1 0 325.412 3.970 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173227327 1132007230 /nfs/dbraw/zinc/00/72/30/1132007230.db2.gz PUSWDKZEMUHNAO-OAHLLOKOSA-N 1 0 348.443 3.581 20 5 EHBDRO COc1cncc([C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229227 1132007518 /nfs/dbraw/zinc/00/75/18/1132007518.db2.gz RTMSLRRHGJLSQP-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC001173228360 1132008165 /nfs/dbraw/zinc/00/81/65/1132008165.db2.gz VJHBAQMLCJXIRD-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO CC(=O)c1ccc2c(c1)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173231868 1132008916 /nfs/dbraw/zinc/00/89/16/1132008916.db2.gz OGESFUWMELSUMT-CQSZACIVSA-N 1 0 338.407 3.787 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1nc2ccccc2o1 ZINC001173231720 1132009494 /nfs/dbraw/zinc/00/94/94/1132009494.db2.gz CMKYGZACFCBLNC-CYBMUJFWSA-N 1 0 325.368 3.799 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)c1ccccc1 ZINC001173233723 1132010707 /nfs/dbraw/zinc/01/07/07/1132010707.db2.gz MRTTYXRRNXWJFX-HNNXBMFYSA-N 1 0 326.396 3.731 20 5 EHBDRO COc1ccc2c(C[NH3+])cn([C@H](C)Cc3ccc([N+](=O)[O-])cc3)c2c1 ZINC001173235890 1132010721 /nfs/dbraw/zinc/01/07/21/1132010721.db2.gz VRFUQCGEEYLHAN-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173233668 1132010858 /nfs/dbraw/zinc/01/08/58/1132010858.db2.gz XWPUUVUEXUNBAF-OAHLLOKOSA-N 1 0 340.423 3.983 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1-n1cccn1 ZINC001173236112 1132011157 /nfs/dbraw/zinc/01/11/57/1132011157.db2.gz WWVQOONWVAOBEX-OAHLLOKOSA-N 1 0 336.395 3.501 20 5 EHBDRO CCOc1ccc(CC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173213589 1132015476 /nfs/dbraw/zinc/01/54/76/1132015476.db2.gz IXMAJCXIGCOSDC-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccncc1C ZINC001174540193 1132389436 /nfs/dbraw/zinc/38/94/36/1132389436.db2.gz XMHYGXZKFVNXDQ-UHFFFAOYSA-N 1 0 344.418 3.947 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCOc2ccc(-c3ccccc3)cc2)C1 ZINC001168977451 1132616883 /nfs/dbraw/zinc/61/68/83/1132616883.db2.gz JXMBIHGTYVZNSF-LPHOPBHVSA-N 1 0 340.423 3.767 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC001168977448 1132617234 /nfs/dbraw/zinc/61/72/34/1132617234.db2.gz JXKSUMCIPSFVQT-MJGOQNOKSA-N 1 0 340.423 3.801 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168967628 1132622615 /nfs/dbraw/zinc/62/26/15/1132622615.db2.gz RKTAZUJKQVXJMP-SMDDNHRTSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@H]2CCOc3cc(C(F)(F)F)ccc32)C1 ZINC001168999476 1132627708 /nfs/dbraw/zinc/62/77/08/1132627708.db2.gz UFTUXQRBLLOFSD-SUHUHFCYSA-N 1 0 344.333 3.564 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2cncc(C(F)(F)F)c2)C2CC2)C1 ZINC001168999789 1132627798 /nfs/dbraw/zinc/62/77/98/1132627798.db2.gz VTGPUVKMMMXEMB-KMUNFCNLSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009705 1132631408 /nfs/dbraw/zinc/63/14/08/1132631408.db2.gz XHOMEXLSPXELQL-RTBURBONSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@]3(CCc4c3cccc4F)C2)C1 ZINC001169051290 1132643263 /nfs/dbraw/zinc/64/32/63/1132643263.db2.gz CTWPQZDOQGJCSE-SPYBWZPUSA-N 1 0 332.419 3.551 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1cnc(Cl)cc1[N+](=O)[O-] ZINC001169683883 1132818202 /nfs/dbraw/zinc/81/82/02/1132818202.db2.gz DXNOSFQLGCKFKG-LBPRGKRZSA-N 1 0 332.791 3.883 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1c(Cl)nccc1[N+](=O)[O-] ZINC001169684180 1132818935 /nfs/dbraw/zinc/81/89/35/1132818935.db2.gz HBUKPAKVVDQPKP-GFCCVEGCSA-N 1 0 332.791 3.883 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC001176036947 1132825616 /nfs/dbraw/zinc/82/56/16/1132825616.db2.gz QMHFEMLXULYDLN-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967249 1132924426 /nfs/dbraw/zinc/92/44/26/1132924426.db2.gz IGQNOMCBQIYNBI-BLLLJJGKSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H](CCO)C1CCCC1 ZINC001176505148 1132952760 /nfs/dbraw/zinc/95/27/60/1132952760.db2.gz LIMNPDORHYZZGK-CQSZACIVSA-N 1 0 347.242 3.932 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCOCC(F)(F)F)o2)c1 ZINC001177170856 1133032883 /nfs/dbraw/zinc/03/28/83/1133032883.db2.gz OKDCPISWDWTWII-UHFFFAOYSA-N 1 0 344.289 3.523 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762597 1133048965 /nfs/dbraw/zinc/04/89/65/1133048965.db2.gz IZLCKWBJZUCAEW-MLGOLLRUSA-N 1 0 331.420 3.506 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765173 1133050611 /nfs/dbraw/zinc/05/06/11/1133050611.db2.gz KHOHLPBIUORPEB-ZBFHGGJFSA-N 1 0 343.431 3.711 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC001177337173 1133055851 /nfs/dbraw/zinc/05/58/51/1133055851.db2.gz AEUNFEIZGFEBIP-IBGZPJMESA-N 1 0 345.418 3.743 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940065 1133073777 /nfs/dbraw/zinc/07/37/77/1133073777.db2.gz DHCLZEZKMKUSKX-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1Cl ZINC000773700957 1133090510 /nfs/dbraw/zinc/09/05/10/1133090510.db2.gz LGFDFAWLESGVEF-ZFWWWQNUSA-N 1 0 338.835 3.887 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178304419 1133155479 /nfs/dbraw/zinc/15/54/79/1133155479.db2.gz GYJHXSDVWYRZIU-ACJLOTCBSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1c(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC001178326270 1133159875 /nfs/dbraw/zinc/15/98/75/1133159875.db2.gz HHKJVAPZBJAMLJ-UHFFFAOYSA-N 1 0 349.774 3.797 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1([C@H]2CCCCO2)CCC1 ZINC001179274801 1133242354 /nfs/dbraw/zinc/24/23/54/1133242354.db2.gz RFILULZOCXRUHY-GOSISDBHSA-N 1 0 348.443 3.823 20 5 EHBDRO Cc1ccc(CN2CC[C@@H]([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC001179405524 1133247088 /nfs/dbraw/zinc/24/70/88/1133247088.db2.gz DJPUVFYYCXZJIH-LJQANCHMSA-N 1 0 339.439 3.576 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@]1(C)CCOC2(CCC2)C1 ZINC001179622641 1133268214 /nfs/dbraw/zinc/26/82/14/1133268214.db2.gz ZIAKQERWRHKINK-GOSISDBHSA-N 1 0 348.443 3.823 20 5 EHBDRO Cc1cc([C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000774408220 1133673129 /nfs/dbraw/zinc/67/31/29/1133673129.db2.gz GBNNORLFGDLCMQ-RBUKOAKNSA-N 1 0 344.386 3.817 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H](O)C1CCCC1 ZINC001183427911 1133805015 /nfs/dbraw/zinc/80/50/15/1133805015.db2.gz DGIKHXRVMAPZEJ-XKGZKEIXSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@H](O)C1CCCC1 ZINC001183427906 1133805225 /nfs/dbraw/zinc/80/52/25/1133805225.db2.gz DGIKHXRVMAPZEJ-HQRMLTQVSA-N 1 0 346.471 3.837 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC000786810892 1133909250 /nfs/dbraw/zinc/90/92/50/1133909250.db2.gz BPVIFJGZFDXWCO-GWCFYCIZSA-N 1 0 338.411 3.764 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000786815966 1133909939 /nfs/dbraw/zinc/90/99/39/1133909939.db2.gz UQPVFLACUUUXLE-MSGBMKDASA-N 1 0 332.425 3.557 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])CC(C)C ZINC001184740948 1133985918 /nfs/dbraw/zinc/98/59/18/1133985918.db2.gz XWCYSJFSJCQPJF-ZDUSSCGKSA-N 1 0 338.408 3.671 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1C)Cc1ccccc1 ZINC001184802368 1133992361 /nfs/dbraw/zinc/99/23/61/1133992361.db2.gz IAJOFMWIIMWVBV-QGZVFWFLSA-N 1 0 342.443 3.663 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@@H+]1CCCC[C@H]1C ZINC001184856825 1133999151 /nfs/dbraw/zinc/99/91/51/1133999151.db2.gz MTYGYMMSRLNJFS-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1cc(N2CC[NH+](C3CCC(C(C)C)CC3)CC2)ncc1[N+](=O)[O-] ZINC001185611793 1134113818 /nfs/dbraw/zinc/11/38/18/1134113818.db2.gz NPVGALWKDACOTD-UHFFFAOYSA-N 1 0 346.475 3.635 20 5 EHBDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774909427 1134116640 /nfs/dbraw/zinc/11/66/40/1134116640.db2.gz PZNCGOMEIYOVGD-GOSISDBHSA-N 1 0 341.367 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1F ZINC000788482741 1134138013 /nfs/dbraw/zinc/13/80/13/1134138013.db2.gz NGJZQTRRJQKTIF-KRWDZBQOSA-N 1 0 349.450 3.822 20 5 EHBDRO CCN(CCC[NH+](CC)CC)C(=O)/C=C(/C)c1ccc([N+](=O)[O-])cc1 ZINC000788535193 1134144939 /nfs/dbraw/zinc/14/49/39/1134144939.db2.gz ADPNEXIKZGHGRX-NXVVXOECSA-N 1 0 347.459 3.579 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000788664784 1134159301 /nfs/dbraw/zinc/15/93/01/1134159301.db2.gz KSYZHWXBJLBLKA-MNOVXSKESA-N 1 0 333.363 3.737 20 5 EHBDRO Cc1cc(N(C)CCCC[NH+](C)C)c([N+](=O)[O-])cc1C(F)(F)F ZINC001187496552 1134343354 /nfs/dbraw/zinc/34/33/54/1134343354.db2.gz GYTCWMDZVOTIBU-UHFFFAOYSA-N 1 0 333.354 3.700 20 5 EHBDRO C[C@@H]1C[NH+](CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000791412127 1134547761 /nfs/dbraw/zinc/54/77/61/1134547761.db2.gz BRMQVSUTVWYIKW-CHWSQXEVSA-N 1 0 341.839 3.550 20 5 EHBDRO CC[C@@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000775389520 1134705102 /nfs/dbraw/zinc/70/51/02/1134705102.db2.gz GNOPUDKIGQKCPN-LJQANCHMSA-N 1 0 341.411 3.757 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC001170296627 1134737168 /nfs/dbraw/zinc/73/71/68/1134737168.db2.gz HCESNVXMKAARDY-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170297827 1134737932 /nfs/dbraw/zinc/73/79/32/1134737932.db2.gz SWGXZHYUDPJZBH-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc(C[C@@H](C)n2ccc3c2cccc3C[NH3+])c([N+](=O)[O-])c1 ZINC001170300104 1134739256 /nfs/dbraw/zinc/73/92/56/1134739256.db2.gz XACALSNODFFTOO-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](c2cccnc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170318945 1134746391 /nfs/dbraw/zinc/74/63/91/1134746391.db2.gz SYCITEZXIIWNRJ-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352938 1134754236 /nfs/dbraw/zinc/75/42/36/1134754236.db2.gz UXLQYHAPMPFGMH-LBPRGKRZSA-N 1 0 349.818 3.715 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000792877257 1134810897 /nfs/dbraw/zinc/81/08/97/1134810897.db2.gz RPBBQVNEJUZWCH-KRWDZBQOSA-N 1 0 341.367 3.614 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000793617790 1134973683 /nfs/dbraw/zinc/97/36/83/1134973683.db2.gz SJJYBPHZGGRKIO-UONOGXRCSA-N 1 0 329.227 3.919 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199955 1134978586 /nfs/dbraw/zinc/97/85/86/1134978586.db2.gz PXVCSAZDSWHBLK-HOTGVXAUSA-N 1 0 347.459 3.988 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC1CC[NH+](C2CCCC2)CC1 ZINC000804535097 1135114658 /nfs/dbraw/zinc/11/46/58/1135114658.db2.gz ZXDACCJSAPAQNG-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H]2CCC(C)(C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001193660447 1135168269 /nfs/dbraw/zinc/16/82/69/1135168269.db2.gz DJWGTQLVNJAUCD-DZGCQCFKSA-N 1 0 336.432 3.787 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCCCCCCC1 ZINC001194401208 1135264201 /nfs/dbraw/zinc/26/42/01/1135264201.db2.gz QCWNTDKFOYPCJG-UHFFFAOYSA-N 1 0 349.431 3.588 20 5 EHBDRO Cc1cccc(C)c1C[N@@H+](CCn1ccc([N+](=O)[O-])n1)CC(C)C ZINC001195428779 1135428246 /nfs/dbraw/zinc/42/82/46/1135428246.db2.gz YUIRZDYXTUIXBK-UHFFFAOYSA-N 1 0 330.432 3.566 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000808445339 1135668504 /nfs/dbraw/zinc/66/85/04/1135668504.db2.gz OMRFWMDYXNYAEL-IFXJQAMLSA-N 1 0 328.412 3.930 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC001197284443 1135672831 /nfs/dbraw/zinc/67/28/31/1135672831.db2.gz JGTZNBHWWQEXDY-GOSISDBHSA-N 1 0 332.444 3.932 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C)cc1 ZINC001197506163 1135701031 /nfs/dbraw/zinc/70/10/31/1135701031.db2.gz FLRDCWPJNYJOQR-WMLDXEAASA-N 1 0 341.411 3.971 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1 ZINC001197661013 1135717760 /nfs/dbraw/zinc/71/77/60/1135717760.db2.gz SHQSGYWIWRNVEL-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO CCC(CC)[C@@H](C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)N(C)C ZINC001199170656 1135884771 /nfs/dbraw/zinc/88/47/71/1135884771.db2.gz LZCHRVRIPWXFKP-ILCZHQDMSA-N 1 0 333.476 3.954 20 5 EHBDRO CCOC(=O)[C@@H](C)[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809976454 1135908255 /nfs/dbraw/zinc/90/82/55/1135908255.db2.gz DTGYSXYXYBWTOF-DTWKUNHWSA-N 1 0 349.214 3.579 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC3(CCC3)[C@H]2[C@@H]2CCCO2)ccc1Cl ZINC000810093567 1135920301 /nfs/dbraw/zinc/92/03/01/1135920301.db2.gz OCYLLNWFZZDZNT-JKSUJKDBSA-N 1 0 336.819 3.782 20 5 EHBDRO CCCOc1ccc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC001201823213 1136067695 /nfs/dbraw/zinc/06/76/95/1136067695.db2.gz XCPPDCSEBWQMAW-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCC[C@H](O)C1 ZINC000811481534 1136091387 /nfs/dbraw/zinc/09/13/87/1136091387.db2.gz FDWSICKOMNCOQE-SKDRFNHKSA-N 1 0 333.215 3.542 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H](O)c1ccsc1 ZINC000811480751 1136097732 /nfs/dbraw/zinc/09/77/32/1136097732.db2.gz DYEGVOSQHSBWFX-GFCCVEGCSA-N 1 0 347.223 3.786 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776275877 1136130166 /nfs/dbraw/zinc/13/01/66/1136130166.db2.gz IAZNQQSXXNZVRR-SFHVURJKSA-N 1 0 344.411 3.595 20 5 EHBDRO CC1(c2ccccc2)CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776280254 1136135577 /nfs/dbraw/zinc/13/55/77/1136135577.db2.gz YZKTUWSYJYNMCY-IBGZPJMESA-N 1 0 340.423 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCCCc3ccccc32)cc1 ZINC000747815215 1136247891 /nfs/dbraw/zinc/24/78/91/1136247891.db2.gz KJNVNUYBCRZIPY-MOPGFXCFSA-N 1 0 326.396 3.686 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000812854328 1136262929 /nfs/dbraw/zinc/26/29/29/1136262929.db2.gz XEZHGCFAYGZBHH-UGSOOPFHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000812854326 1136262963 /nfs/dbraw/zinc/26/29/63/1136262963.db2.gz XEZHGCFAYGZBHH-FZKQIMNGSA-N 1 0 332.375 3.678 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](O)c1cc(C)cc(C)c1 ZINC000850467731 1136265351 /nfs/dbraw/zinc/26/53/51/1136265351.db2.gz SDVRDHLYEJMZIW-KDOFPFPSSA-N 1 0 344.411 3.604 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850524899 1136277254 /nfs/dbraw/zinc/27/72/54/1136277254.db2.gz JNMJQAIXKVQGLC-BHYGNILZSA-N 1 0 330.428 3.607 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000851832827 1136411851 /nfs/dbraw/zinc/41/18/51/1136411851.db2.gz DXRBVBHQSGKEDX-MJGOQNOKSA-N 1 0 344.386 3.822 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586087 1136445441 /nfs/dbraw/zinc/44/54/41/1136445441.db2.gz JLVZGAKNDBVMJS-UYAOXDASSA-N 1 0 342.439 3.971 20 5 EHBDRO CC1(C)C[C@]1([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000852772705 1136484981 /nfs/dbraw/zinc/48/49/81/1136484981.db2.gz QAHNOMXCYZZGJW-HKUYNNGSSA-N 1 0 326.396 3.543 20 5 EHBDRO Cc1cc(N2CCC[C@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000814836279 1136513496 /nfs/dbraw/zinc/51/34/96/1136513496.db2.gz MUBZWCYETRHFBH-GFCCVEGCSA-N 1 0 345.365 3.700 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000815081812 1136548568 /nfs/dbraw/zinc/54/85/68/1136548568.db2.gz PMHKHYFFSCTDQV-JTQLQIEISA-N 1 0 336.189 3.603 20 5 EHBDRO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000853618899 1136549745 /nfs/dbraw/zinc/54/97/45/1136549745.db2.gz OQWZVURJABSUPL-DGCLKSJQSA-N 1 0 325.359 3.595 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556080 1136610222 /nfs/dbraw/zinc/61/02/22/1136610222.db2.gz NPIVZIJAADQLTF-CHWSQXEVSA-N 1 0 329.400 3.988 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556082 1136610347 /nfs/dbraw/zinc/61/03/47/1136610347.db2.gz NPIVZIJAADQLTF-QWHCGFSZSA-N 1 0 329.400 3.988 20 5 EHBDRO C[C@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815576993 1136613169 /nfs/dbraw/zinc/61/31/69/1136613169.db2.gz DIFFHBWKHVKTHF-NSHDSACASA-N 1 0 348.472 3.824 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000815589085 1136615471 /nfs/dbraw/zinc/61/54/71/1136615471.db2.gz IGPDAVHZNSNFNK-NSHDSACASA-N 1 0 349.818 3.732 20 5 EHBDRO Cc1cccc2[nH]cc(CC[NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)c21 ZINC000815574932 1136618367 /nfs/dbraw/zinc/61/83/67/1136618367.db2.gz GUVLRGBJOVQXBU-CYBMUJFWSA-N 1 0 338.411 3.860 20 5 EHBDRO COc1cc(CC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)ccc1Cl ZINC000815658043 1136622803 /nfs/dbraw/zinc/62/28/03/1136622803.db2.gz QUMUBADNRALHFI-NSHDSACASA-N 1 0 349.818 3.732 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819151030 1136914079 /nfs/dbraw/zinc/91/40/79/1136914079.db2.gz VQHJCJSTSDXEOP-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000819262740 1136930052 /nfs/dbraw/zinc/93/00/52/1136930052.db2.gz OBZLSYDBNXJGFB-IMFGXOCKSA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000819340210 1136932703 /nfs/dbraw/zinc/93/27/03/1136932703.db2.gz SXMNPHMNWVZHPT-MISYRCLQSA-N 1 0 340.423 3.802 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030880 1136933801 /nfs/dbraw/zinc/93/38/01/1136933801.db2.gz BZNAVAYJTYHFIJ-YOEHRIQHSA-N 1 0 327.384 3.513 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000860093524 1137044119 /nfs/dbraw/zinc/04/41/19/1137044119.db2.gz CSSSCTKJTPVJBS-QWHCGFSZSA-N 1 0 337.420 3.501 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000824799034 1137152823 /nfs/dbraw/zinc/15/28/23/1137152823.db2.gz JKIXDWQAUKMERW-MLGOLLRUSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000863591454 1137193194 /nfs/dbraw/zinc/19/31/94/1137193194.db2.gz ZBWHYIORTOGUJC-MSOLQXFVSA-N 1 0 346.814 3.949 20 5 EHBDRO Cc1ccccc1C1([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000844351007 1137214230 /nfs/dbraw/zinc/21/42/30/1137214230.db2.gz KCLAJVIYUXQGDH-GOSISDBHSA-N 1 0 326.396 3.606 20 5 EHBDRO CC1CCC([N@H+](Cn2c(=O)oc3cccc([N+](=O)[O-])c32)C2CC2)CC1 ZINC000794621822 1137221401 /nfs/dbraw/zinc/22/14/01/1137221401.db2.gz YTXKQPGTYQDGQX-UHFFFAOYSA-N 1 0 345.399 3.503 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])cc1C(F)F)CC2 ZINC000865656143 1137302273 /nfs/dbraw/zinc/30/22/73/1137302273.db2.gz LMMSQNMVHUQGBT-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000866147737 1137331867 /nfs/dbraw/zinc/33/18/67/1137331867.db2.gz WUOZBLJSLYXRCD-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000866244770 1137338649 /nfs/dbraw/zinc/33/86/49/1137338649.db2.gz UIYRJBRZOJEVMI-CHWSQXEVSA-N 1 0 332.375 3.508 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259739 1137340029 /nfs/dbraw/zinc/34/00/29/1137340029.db2.gz PHUCROUBHGXIQC-OLZOCXBDSA-N 1 0 332.375 3.591 20 5 EHBDRO CC(C)n1cc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cn1 ZINC000866265578 1137340593 /nfs/dbraw/zinc/34/05/93/1137340593.db2.gz NVRRDDJOGDEPRN-QWHCGFSZSA-N 1 0 334.395 3.793 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@](C)(O)c1ccccc1 ZINC000846191803 1137341113 /nfs/dbraw/zinc/34/11/13/1137341113.db2.gz ZGZPNLMXKPDQDD-DOXZYTNZSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000866343145 1137347441 /nfs/dbraw/zinc/34/74/41/1137347441.db2.gz XHLUYEGTFGUGDL-ZDUSSCGKSA-N 1 0 346.402 3.682 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000866353240 1137348565 /nfs/dbraw/zinc/34/85/65/1137348565.db2.gz FCRGBBLKSQFHPZ-CXAGYDPISA-N 1 0 336.407 3.604 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866541078 1137363275 /nfs/dbraw/zinc/36/32/75/1137363275.db2.gz VVOXQYOJJOEOFA-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)C(C)(F)F ZINC000866544689 1137363704 /nfs/dbraw/zinc/36/37/04/1137363704.db2.gz ZGWJKJRWDATRKB-NEPJUHHUSA-N 1 0 330.379 3.546 20 5 EHBDRO Cn1cc([C@@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000846933896 1137376253 /nfs/dbraw/zinc/37/62/53/1137376253.db2.gz XZIOEUMSLZXKQW-AWEZNQCLSA-N 1 0 348.834 3.607 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12 ZINC000773133444 1137467572 /nfs/dbraw/zinc/46/75/72/1137467572.db2.gz FYEGVYSDFQPWHP-AEAUEXCSSA-N 1 0 338.498 3.933 20 5 EHBDRO C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[NH2+]3)no1 ZINC000871797680 1137558595 /nfs/dbraw/zinc/55/85/95/1137558595.db2.gz ZIJSOBANECWGGN-FMJKMSLOSA-N 1 0 340.383 3.536 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC[NH+](C2CCC2)CC1 ZINC000872027535 1137566050 /nfs/dbraw/zinc/56/60/50/1137566050.db2.gz DYRVSNPVZSMBNW-CYBMUJFWSA-N 1 0 349.500 3.984 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067615 1137569522 /nfs/dbraw/zinc/56/95/22/1137569522.db2.gz ZSUOUTRZRMOIPS-GXTWGEPZSA-N 1 0 346.406 3.719 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872074742 1137569894 /nfs/dbraw/zinc/56/98/94/1137569894.db2.gz HAVVDNAFEARCRB-NXEZZACHSA-N 1 0 338.301 3.742 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075573 1137569980 /nfs/dbraw/zinc/56/99/80/1137569980.db2.gz DUPCUFBTPUFACD-RVSPLBMKSA-N 1 0 345.374 3.700 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(CF)CCOCC1 ZINC000872077136 1137570068 /nfs/dbraw/zinc/57/00/68/1137570068.db2.gz ZKABCLANZQBDGX-LBPRGKRZSA-N 1 0 342.436 3.734 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@H]3O2)cc1[N+](=O)[O-] ZINC000872109782 1137571820 /nfs/dbraw/zinc/57/18/20/1137571820.db2.gz RFQMPAKGIWVDKY-PWXKEOIMSA-N 1 0 334.416 3.602 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2ccccc2)[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000873028437 1137588421 /nfs/dbraw/zinc/58/84/21/1137588421.db2.gz MGCBEJVKDQHJFV-RBUKOAKNSA-N 1 0 326.396 3.913 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877077455 1137669648 /nfs/dbraw/zinc/66/96/48/1137669648.db2.gz IQSFYMHCWGBETM-LIVFGMFJSA-N 1 0 344.390 3.547 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130844 1137671062 /nfs/dbraw/zinc/67/10/62/1137671062.db2.gz OQNCLXKJNSNZEU-VJBOLBCHSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc2ccccc2o1 ZINC000877464178 1137677073 /nfs/dbraw/zinc/67/70/73/1137677073.db2.gz HRJPGJLQKNBORX-XGNXJENSSA-N 1 0 326.356 3.592 20 5 EHBDRO CCC1(CC)CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878184449 1137706103 /nfs/dbraw/zinc/70/61/03/1137706103.db2.gz WGAJJUINSAAAHN-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878188206 1137706257 /nfs/dbraw/zinc/70/62/57/1137706257.db2.gz MBQNFXHBVWSJNH-NXEZZACHSA-N 1 0 336.779 3.671 20 5 EHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878954049 1137733511 /nfs/dbraw/zinc/73/35/11/1137733511.db2.gz PZEQHQUHUZVELU-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000880469017 1137779608 /nfs/dbraw/zinc/77/96/08/1137779608.db2.gz HOPXTISAXDIUCI-XHDPSFHLSA-N 1 0 346.349 3.908 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H]2C[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000883272055 1137851727 /nfs/dbraw/zinc/85/17/27/1137851727.db2.gz CEMMSDQRMNFUDB-OMWUSAIZSA-N 1 0 344.411 3.854 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000883352161 1137856994 /nfs/dbraw/zinc/85/69/94/1137856994.db2.gz USLMFKYTBLYQMH-IMJJTQAJSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107070306 1137885389 /nfs/dbraw/zinc/88/53/89/1137885389.db2.gz WIEMDAXVWDXFQZ-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C[C@@H]1CCCSC1 ZINC001202618674 1137887429 /nfs/dbraw/zinc/88/74/29/1137887429.db2.gz KYDDRIBJTCJNKP-JTQLQIEISA-N 1 0 345.262 3.590 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000884717069 1137970966 /nfs/dbraw/zinc/97/09/66/1137970966.db2.gz QYSFHEWQFDSGAL-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccccc2OCC(F)F)cccc1[N+](=O)[O-] ZINC000886087127 1138039126 /nfs/dbraw/zinc/03/91/26/1138039126.db2.gz QHXSMPYIDZZHIG-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO CO[C@@H]1CCC[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000886119139 1138048637 /nfs/dbraw/zinc/04/86/37/1138048637.db2.gz YTXNUZGTDFJLFD-GOEBONIOSA-N 1 0 331.416 3.556 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)C3)O2)cc1[N+](=O)[O-] ZINC000886333429 1138068593 /nfs/dbraw/zinc/06/85/93/1138068593.db2.gz IJHZSSOPARUFMP-ALKREAHSSA-N 1 0 348.443 3.534 20 5 EHBDRO CC(C)C[NH+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)C ZINC000078633358 1138150952 /nfs/dbraw/zinc/15/09/52/1138150952.db2.gz ODSZEEWDJSXUEC-UHFFFAOYSA-N 1 0 332.404 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]3C3CCCC3)o2)cc1 ZINC000079393821 1138155704 /nfs/dbraw/zinc/15/57/04/1138155704.db2.gz VQRIOEBHDTUPQW-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000091957889 1138223429 /nfs/dbraw/zinc/22/34/29/1138223429.db2.gz VRBOJDGOILLOBB-BMTPJICMSA-N 1 0 342.395 3.789 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000122375809 1138257570 /nfs/dbraw/zinc/25/75/70/1138257570.db2.gz IEOWELXYNVHARK-LJQANCHMSA-N 1 0 342.395 3.853 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C1(c2ccccc2)CC1 ZINC000264024800 1138407685 /nfs/dbraw/zinc/40/76/85/1138407685.db2.gz XUDAARUPGIEJRE-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300683 1138467790 /nfs/dbraw/zinc/46/77/90/1138467790.db2.gz VLPWEPZQMFZOPV-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OCC3CC3)nc2)cc1[N+](=O)[O-] ZINC000131322270 1138509638 /nfs/dbraw/zinc/50/96/38/1138509638.db2.gz DWUQBQNVXPPAPZ-CQSZACIVSA-N 1 0 341.411 3.938 20 5 EHBDRO CC1CCC([N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000337344139 1138539630 /nfs/dbraw/zinc/53/96/30/1138539630.db2.gz YPHWSCZUTWERQF-UHFFFAOYSA-N 1 0 345.443 3.967 20 5 EHBDRO CCCn1nccc1C1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000337355968 1138542401 /nfs/dbraw/zinc/54/24/01/1138542401.db2.gz DZXWFCUPGWWDFQ-UHFFFAOYSA-N 1 0 334.445 3.642 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000152619237 1139100869 /nfs/dbraw/zinc/10/08/69/1139100869.db2.gz USHMVXQUTAWYJS-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256385 1139128513 /nfs/dbraw/zinc/12/85/13/1139128513.db2.gz FOXYEKUQOTVUPI-PXAZEXFGSA-N 1 0 348.374 3.517 20 5 EHBDRO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000178647729 1139708876 /nfs/dbraw/zinc/70/88/76/1139708876.db2.gz RDBJKCDMTPBZFG-AWEZNQCLSA-N 1 0 347.459 3.673 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178648717 1139708957 /nfs/dbraw/zinc/70/89/57/1139708957.db2.gz PIWPKPIARFUJNT-CRAIPNDOSA-N 1 0 328.412 3.720 20 5 EHBDRO CCOc1ccc([C@@H](C)NC2CC[NH+](CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000179397948 1139754528 /nfs/dbraw/zinc/75/45/28/1139754528.db2.gz SHNKMKSFWUYOMM-OAHLLOKOSA-N 1 0 349.475 3.765 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181810948 1139932576 /nfs/dbraw/zinc/93/25/76/1139932576.db2.gz KCWCRHZLQRZONC-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(F)cc2)CCOCC1 ZINC000183476897 1140041034 /nfs/dbraw/zinc/04/10/34/1140041034.db2.gz WGSSIIQTDCPKIW-UHFFFAOYSA-N 1 0 344.386 3.838 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000184299039 1140093763 /nfs/dbraw/zinc/09/37/63/1140093763.db2.gz HZYLYGLNEWWEGO-INIZCTEOSA-N 1 0 348.374 3.992 20 5 EHBDRO CC(C)C1(C)CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000186201991 1140192238 /nfs/dbraw/zinc/19/22/38/1140192238.db2.gz JLQPFBCPPTUNPH-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000191338611 1140455690 /nfs/dbraw/zinc/45/56/90/1140455690.db2.gz ANPRCCNNVHZLTA-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](CCO)c1ccccc1)CCC2 ZINC000192889874 1140553595 /nfs/dbraw/zinc/55/35/95/1140553595.db2.gz ZYBKDRGJLNGLGA-FXAWDEMLSA-N 1 0 340.423 3.728 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000192891057 1140554144 /nfs/dbraw/zinc/55/41/44/1140554144.db2.gz GUWNVZMLPILSBB-SJORKVTESA-N 1 0 332.425 3.531 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552518 1140701568 /nfs/dbraw/zinc/70/15/68/1140701568.db2.gz UYUQMSWONFHLRB-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000268789376 1140992329 /nfs/dbraw/zinc/99/23/29/1140992329.db2.gz FLVRRTGMFBRZCF-OAHLLOKOSA-N 1 0 341.411 3.607 20 5 EHBDRO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000270680343 1141255819 /nfs/dbraw/zinc/25/58/19/1141255819.db2.gz YJBOWCWPIHSVPM-VFVRVIDISA-N 1 0 332.375 3.897 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC4(C3)CCOCC4)o2)c1 ZINC000271192389 1141322115 /nfs/dbraw/zinc/32/21/15/1141322115.db2.gz GKHYYYQBWDRVLT-UHFFFAOYSA-N 1 0 342.395 3.857 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271525778 1141388014 /nfs/dbraw/zinc/38/80/14/1141388014.db2.gz QELNQHPSGUEEQR-RRQGHBQHSA-N 1 0 340.427 3.696 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000271570755 1141399200 /nfs/dbraw/zinc/39/92/00/1141399200.db2.gz PPVIKYURCIGDQZ-LNLFQRSKSA-N 1 0 332.444 3.709 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000052244791 214122728 /nfs/dbraw/zinc/12/27/28/214122728.db2.gz OPIZTFNMWWDMJT-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000537967839 1032066459 /nfs/dbraw/zinc/06/64/59/1032066459.db2.gz CPFBLPKNXFSFPR-MRXNPFEDSA-N 1 0 348.399 3.939 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000183226796 1125477298 /nfs/dbraw/zinc/47/72/98/1125477298.db2.gz RYFVWQPMPRDWLG-FJIDUMEYSA-N 1 0 330.428 3.983 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(C)Cc1ccc(Br)o1 ZINC000183257262 1125484477 /nfs/dbraw/zinc/48/44/77/1125484477.db2.gz MJNZXMKDVACKEW-UHFFFAOYSA-N 1 0 339.189 3.891 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CSc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 ZINC000579712000 1014248757 /nfs/dbraw/zinc/24/87/57/1014248757.db2.gz LNTPFDMAMBXQGY-WFASDCNBSA-N 1 0 330.409 3.799 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000154258164 1015320157 /nfs/dbraw/zinc/32/01/57/1015320157.db2.gz RSEYKXYFKWIAKM-DNNBLBMLSA-N 1 0 334.416 3.602 20 5 EHBDRO CC(C)(C)n1cc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000154273643 1015332179 /nfs/dbraw/zinc/33/21/79/1015332179.db2.gz HQSDCCFTYVZUJC-UHFFFAOYSA-N 1 0 328.416 3.711 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000120614640 1015709017 /nfs/dbraw/zinc/70/90/17/1015709017.db2.gz RDNIXPKNXFWRFW-QWHCGFSZSA-N 1 0 330.432 3.535 20 5 EHBDRO CC(C)(O)C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000189945513 1016792833 /nfs/dbraw/zinc/79/28/33/1016792833.db2.gz XSFQYNVIBVUZMF-UHFFFAOYSA-N 1 0 330.384 3.590 20 5 EHBDRO C[N@@H+]1CC[C@H](NCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283538 1016857861 /nfs/dbraw/zinc/85/78/61/1016857861.db2.gz YTWMDWGSDRCURK-PKOBYXMFSA-N 1 0 325.412 3.520 20 5 EHBDRO CCOCc1ccccc1C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449068215 1032152235 /nfs/dbraw/zinc/15/22/35/1032152235.db2.gz AOPHNJLOXVBBQI-HNNXBMFYSA-N 1 0 328.412 3.852 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)c1ccc(F)cc1 ZINC000414526126 1016953687 /nfs/dbraw/zinc/95/36/87/1016953687.db2.gz KOHRHRNZCQJVBF-CRPZLVSXSA-N 1 0 344.386 3.503 20 5 EHBDRO CC(C)[C@@H]1[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527940 1016953846 /nfs/dbraw/zinc/95/38/46/1016953846.db2.gz NJYBVTZHILJHEM-FZMUQLTDSA-N 1 0 330.428 3.745 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](O)C(C)C ZINC000414536823 1016963684 /nfs/dbraw/zinc/96/36/84/1016963684.db2.gz YHLZVAIECMNOHV-HOTGVXAUSA-N 1 0 349.456 3.603 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCO[C@H]1C(C)(C)C ZINC000449146225 1032248372 /nfs/dbraw/zinc/24/83/72/1032248372.db2.gz BJCKMUYYTHITTR-QGPMSJSTSA-N 1 0 334.460 3.957 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccc1)C1(CO)CCCC1 ZINC000459533654 1032251749 /nfs/dbraw/zinc/25/17/49/1032251749.db2.gz PMSAXSLIOFZGEO-LJQANCHMSA-N 1 0 340.423 3.978 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccc([S@](C)=O)cc1 ZINC000449202800 1032327956 /nfs/dbraw/zinc/32/79/56/1032327956.db2.gz GRBCIRBDSKUREC-ICBMNTSNSA-N 1 0 346.452 3.614 20 5 EHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622521 1032335239 /nfs/dbraw/zinc/33/52/39/1032335239.db2.gz YKHNGMOLPDLXTB-YVEFUNNKSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459651216 1032375686 /nfs/dbraw/zinc/37/56/86/1032375686.db2.gz OWOFNCQZZAXCHM-SMYYYNMVSA-N 1 0 329.425 3.904 20 5 EHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cccc(CO)c1 ZINC000538457723 1032384921 /nfs/dbraw/zinc/38/49/21/1032384921.db2.gz DIWJSPUPRUHBMB-HNNXBMFYSA-N 1 0 328.412 3.761 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000536883241 1032388393 /nfs/dbraw/zinc/38/83/93/1032388393.db2.gz UTFFSYDUVNCISI-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000449288420 1032405827 /nfs/dbraw/zinc/40/58/27/1032405827.db2.gz ZUHNWHBRFYTESK-YNEHKIRRSA-N 1 0 331.420 3.508 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000449402005 1032525124 /nfs/dbraw/zinc/52/51/24/1032525124.db2.gz OZVJWNKRITYFAH-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000449446090 1032563748 /nfs/dbraw/zinc/56/37/48/1032563748.db2.gz OEPCUQWCBJLGPA-KRWDZBQOSA-N 1 0 334.803 3.722 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC[C@H]2CSc3ccccc3O2)cs1 ZINC000592372659 1032672935 /nfs/dbraw/zinc/67/29/35/1032672935.db2.gz IGLQXLFWTSOMDW-LBPRGKRZSA-N 1 0 336.438 3.689 20 5 EHBDRO C[NH2+]C[C@@H]1CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414659957 1017110174 /nfs/dbraw/zinc/11/01/74/1017110174.db2.gz LXFCVZOVFQQBMN-HNNXBMFYSA-N 1 0 331.441 3.507 20 5 EHBDRO Cc1ccc(NC(=O)N[C@@H](CCC[NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000414666456 1017115060 /nfs/dbraw/zinc/11/50/60/1017115060.db2.gz WLMYBPQHQNLOMF-INIZCTEOSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@H]2/C=C\c2cccs2)c1 ZINC000543990652 1017119255 /nfs/dbraw/zinc/11/92/55/1017119255.db2.gz PLWRAYHAXWYARI-LZNQSLFOSA-N 1 0 346.456 3.811 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCC(F)(F)F)o2)c([N+](=O)[O-])c1 ZINC000610272432 1017161539 /nfs/dbraw/zinc/16/15/39/1017161539.db2.gz SNHNMUGLYGMIPN-UHFFFAOYSA-N 1 0 344.289 3.905 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000449509980 1032696686 /nfs/dbraw/zinc/69/66/86/1032696686.db2.gz WZTLOCVPCRFTSB-WBMJQRKESA-N 1 0 347.440 3.575 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000449509978 1032697066 /nfs/dbraw/zinc/69/70/66/1032697066.db2.gz WZTLOCVPCRFTSB-LRDDRELGSA-N 1 0 347.440 3.575 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCC1(c2ccccc2)COC1 ZINC001167295066 1017419101 /nfs/dbraw/zinc/41/91/01/1017419101.db2.gz RVOQNSDHPFMESN-UHFFFAOYSA-N 1 0 325.476 3.663 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCCC[NH2+]C3)o2)c(Cl)c1 ZINC000415065927 1017486716 /nfs/dbraw/zinc/48/67/16/1017486716.db2.gz HWXAOFPBGDPCSY-LBPRGKRZSA-N 1 0 349.818 3.740 20 5 EHBDRO CC(C)[NH+](CCNc1ccc([N+](=O)[O-])cc1Br)C(C)C ZINC000043596421 1017490031 /nfs/dbraw/zinc/49/00/31/1017490031.db2.gz LXOPOACMGMXUMF-UHFFFAOYSA-N 1 0 344.253 3.888 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000468035649 1017601049 /nfs/dbraw/zinc/60/10/49/1017601049.db2.gz ABGPYLOLQNXERV-HNNXBMFYSA-N 1 0 346.814 3.904 20 5 EHBDRO O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000289927949 1032717671 /nfs/dbraw/zinc/71/76/71/1032717671.db2.gz WEXMSZIGGOCMNV-ZDUSSCGKSA-N 1 0 333.775 3.516 20 5 EHBDRO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351918 1017971378 /nfs/dbraw/zinc/97/13/78/1017971378.db2.gz ADDQDXSPZZGJQF-GXTWGEPZSA-N 1 0 326.824 3.764 20 5 EHBDRO C[C@@H](CCCC[NH3+])NC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701368 1018412838 /nfs/dbraw/zinc/41/28/38/1018412838.db2.gz OCSZKIRGTOSCSV-LBPRGKRZSA-N 1 0 336.436 3.531 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1N(C)C ZINC000468637031 1018605456 /nfs/dbraw/zinc/60/54/56/1018605456.db2.gz CWXCHRVTZLOQKR-RVDMUPIBSA-N 1 0 325.412 3.854 20 5 EHBDRO CCc1ccc([C@@H](NC2CC[NH+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542478107 1018735410 /nfs/dbraw/zinc/73/54/10/1018735410.db2.gz PMWQDXNJPJFQEG-IBGZPJMESA-N 1 0 343.427 3.523 20 5 EHBDRO C[C@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610422094 1019029863 /nfs/dbraw/zinc/02/98/63/1019029863.db2.gz YRUHTUPVMLEHFU-KXBFYZLASA-N 1 0 336.395 3.883 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000322407056 1019084385 /nfs/dbraw/zinc/08/43/85/1019084385.db2.gz XMEBHTCUMLYYBG-NEPJUHHUSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433428 1019093489 /nfs/dbraw/zinc/09/34/89/1019093489.db2.gz JJJRSIYDRNRWIZ-FUHWJXTLSA-N 1 0 339.439 3.862 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1CO ZINC000536624362 1019203528 /nfs/dbraw/zinc/20/35/28/1019203528.db2.gz LHMGFNLYPPAUPT-INIZCTEOSA-N 1 0 346.452 3.748 20 5 EHBDRO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CCCC[NH+]1CCCC1 ZINC000729339252 1019299347 /nfs/dbraw/zinc/29/93/47/1019299347.db2.gz SJNCSDCTFSEZLZ-UHFFFAOYSA-N 1 0 347.459 3.598 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](Cc1ccccc1)C(C)C ZINC000052877112 1019301241 /nfs/dbraw/zinc/30/12/41/1019301241.db2.gz NLAWONCNRXMTLT-UHFFFAOYSA-N 1 0 341.411 3.752 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)cn1 ZINC000513168178 1019360633 /nfs/dbraw/zinc/36/06/33/1019360633.db2.gz XVSHDEZTVOEYMM-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO C[NH2+][C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000262022128 1019865791 /nfs/dbraw/zinc/86/57/91/1019865791.db2.gz NGAUOMYJJHHJHS-CYBMUJFWSA-N 1 0 331.441 3.507 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCC1CCOCC1 ZINC000120687612 1019945217 /nfs/dbraw/zinc/94/52/17/1019945217.db2.gz AFWOAXTZIFLYRP-UHFFFAOYSA-N 1 0 336.432 3.631 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602435863 1032886612 /nfs/dbraw/zinc/88/66/12/1032886612.db2.gz LNZVPCABJUAERY-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO CC(C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000336995341 1020379840 /nfs/dbraw/zinc/37/98/40/1020379840.db2.gz NTQPDJROZPQZFV-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO COC1(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC1 ZINC000581324271 1020687949 /nfs/dbraw/zinc/68/79/49/1020687949.db2.gz VICUBXZPYOSROS-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000360870458 1020846226 /nfs/dbraw/zinc/84/62/26/1020846226.db2.gz ILZWXTJIFMIPQM-DOTOQJQBSA-N 1 0 340.427 3.763 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602511488 1032945710 /nfs/dbraw/zinc/94/57/10/1032945710.db2.gz SYENWQFOTKZEIP-WMLDXEAASA-N 1 0 332.448 3.517 20 5 EHBDRO Cc1cnc(CC[N@@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000157319706 1021163178 /nfs/dbraw/zinc/16/31/78/1021163178.db2.gz LYUYZFNCWHLBQJ-UHFFFAOYSA-N 1 0 325.821 3.688 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC000894846478 1021353989 /nfs/dbraw/zinc/35/39/89/1021353989.db2.gz XOQVSWHGHDOKMI-UHFFFAOYSA-N 1 0 348.834 3.717 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](CO)Cc1cccc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000467410716 1021454942 /nfs/dbraw/zinc/45/49/42/1021454942.db2.gz JUKADGWYVKSDLC-UYAOXDASSA-N 1 0 342.439 3.938 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2Cc3ccccc3N(C)C2)cccc1[N+](=O)[O-] ZINC000437080630 1021533275 /nfs/dbraw/zinc/53/32/75/1021533275.db2.gz UGFPQWMDSSMTDG-JKSUJKDBSA-N 1 0 339.439 3.863 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCN(C)c1ccccc1 ZINC000509603133 1021548194 /nfs/dbraw/zinc/54/81/94/1021548194.db2.gz QPBYTWAFOOLYKN-UHFFFAOYSA-N 1 0 343.427 3.610 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000510460225 1021669180 /nfs/dbraw/zinc/66/91/80/1021669180.db2.gz WIEMZZUXFZYIKD-HFCFLMTESA-N 1 0 343.471 3.945 20 5 EHBDRO C[C@H]1C[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602580794 1033001541 /nfs/dbraw/zinc/00/15/41/1033001541.db2.gz HBQNNVNIJZWIEC-WDEREUQCSA-N 1 0 332.322 3.518 20 5 EHBDRO COCc1cc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC000090910090 1021689971 /nfs/dbraw/zinc/68/99/71/1021689971.db2.gz LFEVSJPQEJZAIY-CQSZACIVSA-N 1 0 344.411 3.643 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)Cc1ccc(OC)cc1OC ZINC000519906086 1021757603 /nfs/dbraw/zinc/75/76/03/1021757603.db2.gz HMKYSUVIZVTMOQ-UHFFFAOYSA-N 1 0 344.411 3.943 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1c(Cl)n[nH]c1C1CC1 ZINC000894390829 1021812881 /nfs/dbraw/zinc/81/28/81/1021812881.db2.gz KQSDFVUXTDJGQE-UHFFFAOYSA-N 1 0 334.807 3.523 20 5 EHBDRO COc1ccc(OCC[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1 ZINC000506054773 1021872360 /nfs/dbraw/zinc/87/23/60/1021872360.db2.gz BMVNAQKSVJJBAJ-ALCCZGGFSA-N 1 0 342.395 3.627 20 5 EHBDRO CN1CC[C@H](Nc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(F)c(F)c1 ZINC000302012150 1022051901 /nfs/dbraw/zinc/05/19/01/1022051901.db2.gz ZFBPAWKQQFNWOL-IRXDYDNUSA-N 1 0 333.338 3.730 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCCc3ccc([N+](=O)[O-])cc3)cccc21 ZINC000602639278 1033029340 /nfs/dbraw/zinc/02/93/40/1033029340.db2.gz IRUNABPLUJURDA-SFHVURJKSA-N 1 0 341.411 3.635 20 5 EHBDRO CC(C)(C)OC1CC(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602634990 1033046615 /nfs/dbraw/zinc/04/66/15/1033046615.db2.gz VPGDEZGJZIULMH-UHFFFAOYSA-N 1 0 347.415 3.809 20 5 EHBDRO CCO[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000602637158 1033046812 /nfs/dbraw/zinc/04/68/12/1033046812.db2.gz LDGQOVPKKBIANW-QGZVFWFLSA-N 1 0 341.367 3.603 20 5 EHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H]1CCOC(C)(C)C1 ZINC000602671157 1033050271 /nfs/dbraw/zinc/05/02/71/1033050271.db2.gz RDORHKOVWYPUJG-ZDUSSCGKSA-N 1 0 333.388 3.516 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cnc(C2CC2)o1 ZINC000449703164 1033067844 /nfs/dbraw/zinc/06/78/44/1033067844.db2.gz FNCJFKBSKLQGER-PBHICJAKSA-N 1 0 341.411 3.961 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(Cc3ccc(F)cc3)CCOCC2)c1 ZINC000550178690 1022659584 /nfs/dbraw/zinc/65/95/84/1022659584.db2.gz MTQXAQXOGGWPHW-UHFFFAOYSA-N 1 0 344.386 3.615 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000477727131 1022717880 /nfs/dbraw/zinc/71/78/80/1022717880.db2.gz WSAQRPMUIXZKJY-AWEZNQCLSA-N 1 0 341.411 3.719 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000430821822 1022736953 /nfs/dbraw/zinc/73/69/53/1022736953.db2.gz OKJHNQTXJQWZGZ-CRAIPNDOSA-N 1 0 347.459 3.534 20 5 EHBDRO C[N@@H+]1C[C@@H]2CCN(C(=O)c3c4ccccc4cc4ccccc43)[C@@H]2C1 ZINC001270376394 1022920119 /nfs/dbraw/zinc/92/01/19/1022920119.db2.gz CUTJOYFMVUCUIH-FXAWDEMLSA-N 1 0 330.431 3.769 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000507007819 1023074210 /nfs/dbraw/zinc/07/42/10/1023074210.db2.gz QJQGRMXYQGBGPK-BBRMVZONSA-N 1 0 329.375 3.981 20 5 EHBDRO CSC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602727409 1033115032 /nfs/dbraw/zinc/11/50/32/1033115032.db2.gz RBDCYCPHAOOEBZ-UHFFFAOYSA-N 1 0 334.363 3.941 20 5 EHBDRO O=[N+]([O-])c1sccc1NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000063265387 1033135600 /nfs/dbraw/zinc/13/56/00/1033135600.db2.gz DYIONJWEIHHAKX-UHFFFAOYSA-N 1 0 331.441 3.980 20 5 EHBDRO O=C(Nc1ccc([N+](=O)[O-])cc1)c1ccc(C[NH+]2CCCCC2)cc1 ZINC000342021542 1023761545 /nfs/dbraw/zinc/76/15/45/1023761545.db2.gz MXUDHKDEIIPUDL-UHFFFAOYSA-N 1 0 339.395 3.833 20 5 EHBDRO O=C(C[NH2+][C@@H](CC1CC1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610831070 1023781263 /nfs/dbraw/zinc/78/12/63/1023781263.db2.gz LZACGELWXJJKGE-KRWDZBQOSA-N 1 0 339.395 3.664 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCCC[C@@H]1CCO ZINC000342055167 1023807118 /nfs/dbraw/zinc/80/71/18/1023807118.db2.gz YXYCIDMTOBYPLY-MRXNPFEDSA-N 1 0 336.432 3.509 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC000895226023 1024010534 /nfs/dbraw/zinc/01/05/34/1024010534.db2.gz QYDDDBYVVXUNOM-JTQLQIEISA-N 1 0 344.358 3.613 20 5 EHBDRO Cn1cc(C[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)c([N+](=O)[O-])n1 ZINC000602808813 1033184036 /nfs/dbraw/zinc/18/40/36/1033184036.db2.gz ZRFZPQFSQQGBNY-OAHLLOKOSA-N 1 0 334.807 3.613 20 5 EHBDRO Cc1ccc(NCc2ccc(OCCC[NH+](C)C)cc2)c([N+](=O)[O-])c1 ZINC000514172096 1024196832 /nfs/dbraw/zinc/19/68/32/1024196832.db2.gz LLKCSLPSCHHPOS-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO CCN(Cc1cccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000119467510 1024287591 /nfs/dbraw/zinc/28/75/91/1024287591.db2.gz MZKHQXOWBUIZSC-CYBMUJFWSA-N 1 0 347.440 3.814 20 5 EHBDRO CC[N@H+](Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000430099506 1024362710 /nfs/dbraw/zinc/36/27/10/1024362710.db2.gz LSYIIJYESZMDEM-OAHLLOKOSA-N 1 0 343.427 3.565 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(NC[C@H]2CC[N@@H+](C3CC3)C2)c(Cl)c1 ZINC000228842372 1033209231 /nfs/dbraw/zinc/20/92/31/1033209231.db2.gz JKLOAGYBQVEZJV-SECBINFHSA-N 1 0 330.215 3.798 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000280899668 1024410890 /nfs/dbraw/zinc/41/08/90/1024410890.db2.gz DSUPKIIDKRLVOC-MAUKXSAKSA-N 1 0 341.411 3.650 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000380677272 1024435672 /nfs/dbraw/zinc/43/56/72/1024435672.db2.gz OUUNGGKQDFMRRA-YRNRMSPPSA-N 1 0 339.439 3.908 20 5 EHBDRO COc1ccccc1CCC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000505568203 1024501837 /nfs/dbraw/zinc/50/18/37/1024501837.db2.gz HKEHYJGMHAECHF-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO CCOc1ccccc1[C@H](CC(C)C)[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000342245291 1024536760 /nfs/dbraw/zinc/53/67/60/1024536760.db2.gz QQFJUNNBPXHFOO-INIZCTEOSA-N 1 0 346.431 3.567 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCO1 ZINC000119657044 1024658274 /nfs/dbraw/zinc/65/82/74/1024658274.db2.gz WYAVDWSOZGHXDA-HZPDHXFCSA-N 1 0 347.440 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCOCC3CCC3)o2)c1 ZINC000514765805 1024726379 /nfs/dbraw/zinc/72/63/79/1024726379.db2.gz TZLTYQDBSWLMGD-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO O[C@]1(C[NH2+]Cc2c3ccccc3c(Cl)c3ccccc32)CCOC1 ZINC000179021832 1024811569 /nfs/dbraw/zinc/81/15/69/1024811569.db2.gz GBWZBDPDQNLLAC-FQEVSTJZSA-N 1 0 341.838 3.887 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc(OC)c1 ZINC000508029311 1024841053 /nfs/dbraw/zinc/84/10/53/1024841053.db2.gz XHGLYGOMBWQFRR-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC000897969859 1033242411 /nfs/dbraw/zinc/24/24/11/1033242411.db2.gz BZSQYMLTFQOCTE-VGOFMYFVSA-N 1 0 330.428 3.935 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539224495 1024968715 /nfs/dbraw/zinc/96/87/15/1024968715.db2.gz AAFVTUXCPWNJQP-SUMWQHHRSA-N 1 0 330.384 3.760 20 5 EHBDRO COC1(OC)CC2(C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)[C@H]2C(C)C)C1 ZINC000895994869 1025061641 /nfs/dbraw/zinc/06/16/41/1025061641.db2.gz HKEPFCOXWGIQQG-KRWDZBQOSA-N 1 0 348.443 3.513 20 5 EHBDRO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000346782358 1025093204 /nfs/dbraw/zinc/09/32/04/1025093204.db2.gz YFRBDNSSSVLVKL-JKSUJKDBSA-N 1 0 347.462 3.943 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](CC1CC1)C1CCCCC1 ZINC000436090058 1025363863 /nfs/dbraw/zinc/36/38/63/1025363863.db2.gz DSUUPVSNVPKZCQ-UHFFFAOYSA-N 1 0 345.443 3.886 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000442807784 1025483889 /nfs/dbraw/zinc/48/38/89/1025483889.db2.gz FQBZTOVTQMRKOZ-XPYUAMARSA-N 1 0 332.444 3.853 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896493846 1025496041 /nfs/dbraw/zinc/49/60/41/1025496041.db2.gz WOBMZGKROULLQA-GSPCDJLXSA-N 1 0 340.427 3.611 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1)N(C)C ZINC000442997121 1025639383 /nfs/dbraw/zinc/63/93/83/1025639383.db2.gz YZNSVQYINLHLBN-DNVCBOLYSA-N 1 0 327.428 3.684 20 5 EHBDRO C[C@H](C[N+](C)(C)C)Oc1c(F)cc(Cl)cc1Br ZINC001227171300 1025679470 /nfs/dbraw/zinc/67/94/70/1025679470.db2.gz AEESEALIEXSULG-MRVPVSSYSA-N 1 0 325.629 3.715 20 5 EHBDRO CC[NH+]1CCC(CCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436401619 1025682466 /nfs/dbraw/zinc/68/24/66/1025682466.db2.gz WNGYHKKKHZYRMB-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000443067263 1025684311 /nfs/dbraw/zinc/68/43/11/1025684311.db2.gz FHGZWFYMPSLDEI-UONOGXRCSA-N 1 0 330.384 3.854 20 5 EHBDRO Cn1cc(CC[NH2+]Cc2csc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000185745939 1025747951 /nfs/dbraw/zinc/74/79/51/1025747951.db2.gz GFGJVXOTFXHNRJ-UHFFFAOYSA-N 1 0 333.388 3.619 20 5 EHBDRO C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000439130072 1025785533 /nfs/dbraw/zinc/78/55/33/1025785533.db2.gz RTBBPLUDRQJGBJ-NHYWBVRUSA-N 1 0 334.807 3.747 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451354534 1025861206 /nfs/dbraw/zinc/86/12/06/1025861206.db2.gz RZDMZDBNCRMFSJ-RGIVZKHGSA-N 1 0 332.444 3.980 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC4(CCCC4)CC3)o2)cc1 ZINC000158392299 1025908957 /nfs/dbraw/zinc/90/89/57/1025908957.db2.gz VLYNQVIVAZQTIV-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCC[C@@H]3O)s2)cc1 ZINC000074371291 1025918052 /nfs/dbraw/zinc/91/80/52/1025918052.db2.gz HQRDEGUYIDLUPK-HOTGVXAUSA-N 1 0 332.425 3.716 20 5 EHBDRO C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000530494591 1025942810 /nfs/dbraw/zinc/94/28/10/1025942810.db2.gz PFQAFVRUIUNXEE-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000463067718 1025955765 /nfs/dbraw/zinc/95/57/65/1025955765.db2.gz FDPPWRCIDPICEK-MRXNPFEDSA-N 1 0 343.402 3.692 20 5 EHBDRO CCc1noc(C)c1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550428 1026101823 /nfs/dbraw/zinc/10/18/23/1026101823.db2.gz RQWHVYXUCHHVBT-OAHLLOKOSA-N 1 0 329.400 3.833 20 5 EHBDRO Cc1noc(C)c1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549174 1026102805 /nfs/dbraw/zinc/10/28/05/1026102805.db2.gz PBXUIDSHUPSOQH-MRXNPFEDSA-N 1 0 329.400 3.622 20 5 EHBDRO CCN(CCC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000475132458 1026236460 /nfs/dbraw/zinc/23/64/60/1026236460.db2.gz XRXCLZVTDICZMW-LBPRGKRZSA-N 1 0 333.354 3.520 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000475144050 1026248447 /nfs/dbraw/zinc/24/84/47/1026248447.db2.gz LAMWTEOTAJOCFO-DOTOQJQBSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(-c3ccccn3)c2)cc1 ZINC000127681226 1026292944 /nfs/dbraw/zinc/29/29/44/1026292944.db2.gz ORWQZQYSBQQRMU-UHFFFAOYSA-N 1 0 333.391 3.989 20 5 EHBDRO C[C@H](NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000452182647 1026551541 /nfs/dbraw/zinc/55/15/41/1026551541.db2.gz HZKJIBHPCCQYRY-KBXCAEBGSA-N 1 0 345.443 3.569 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+]C2(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000077378619 1026869640 /nfs/dbraw/zinc/86/96/40/1026869640.db2.gz BXSVUYDDCBUKQH-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000128075819 1026932938 /nfs/dbraw/zinc/93/29/38/1026932938.db2.gz QASLUSYRPBQQHS-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC001299197153 1027251154 /nfs/dbraw/zinc/25/11/54/1027251154.db2.gz XGZSPQOKRXHQJY-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC000187800875 1027277614 /nfs/dbraw/zinc/27/76/14/1027277614.db2.gz KLZABSOQGHUWGG-CYBMUJFWSA-N 1 0 347.440 3.548 20 5 EHBDRO C[C@@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127719039 1027346814 /nfs/dbraw/zinc/34/68/14/1027346814.db2.gz PXQYOAHJBFLIAI-UKRRQHHQSA-N 1 0 330.384 3.590 20 5 EHBDRO C[C@H]1CCCC[C@H]1OCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597565 1027591653 /nfs/dbraw/zinc/59/16/53/1027591653.db2.gz TWHRJGOLANLOIW-BLLLJJGKSA-N 1 0 326.824 3.933 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000475567985 1027646174 /nfs/dbraw/zinc/64/61/74/1027646174.db2.gz FILFLYNCUKPIIL-GASCZTMLSA-N 1 0 348.447 3.596 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])nc2)[C@@H]1c1cccs1 ZINC000078338381 1027687520 /nfs/dbraw/zinc/68/75/20/1027687520.db2.gz GYEKCLVOWOOUOJ-MLGOLLRUSA-N 1 0 332.429 3.546 20 5 EHBDRO COc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000130738194 1027699783 /nfs/dbraw/zinc/69/97/83/1027699783.db2.gz CSHNXPHWPMATJL-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO Cc1cc(Nc2ncccc2[N+](=O)[O-])cnc1N1CCCC[C@H]1C ZINC000503276366 1027699898 /nfs/dbraw/zinc/69/98/98/1027699898.db2.gz NWDRTGPKDGWYBC-CYBMUJFWSA-N 1 0 327.388 3.816 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC1CCCC1 ZINC000533398449 1027770111 /nfs/dbraw/zinc/77/01/11/1027770111.db2.gz QIVBLYKMLMNCBN-NSHDSACASA-N 1 0 339.823 3.697 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1C ZINC000562413365 1027865612 /nfs/dbraw/zinc/86/56/12/1027865612.db2.gz VFVRJTHRZMMVQA-SFHVURJKSA-N 1 0 342.443 3.940 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503584015 1027944899 /nfs/dbraw/zinc/94/48/99/1027944899.db2.gz YLQLJEHWJBCETK-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1c(CN2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512144 1027997082 /nfs/dbraw/zinc/99/70/82/1027997082.db2.gz MNPPQENNCPBYRU-RVKKMQEKSA-N 1 0 331.460 3.740 20 5 EHBDRO COc1cc(C)c(C[C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000502252493 1028025346 /nfs/dbraw/zinc/02/53/46/1028025346.db2.gz KUJVJDZYSUTONR-CQSZACIVSA-N 1 0 344.411 3.641 20 5 EHBDRO CN1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000237169137 1028115819 /nfs/dbraw/zinc/11/58/19/1028115819.db2.gz CKZJSMZULFJDFI-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO Cc1ccc(CN(Cc2cc([N+](=O)[O-])cc3c2OCOC3)C2CC2)o1 ZINC000051966847 1028122306 /nfs/dbraw/zinc/12/23/06/1028122306.db2.gz DATAKCZBSKXPAL-UHFFFAOYSA-N 1 0 344.367 3.527 20 5 EHBDRO CC(C)[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000532692535 1028150078 /nfs/dbraw/zinc/15/00/78/1028150078.db2.gz QEGNJEDJESOSNW-UHFFFAOYSA-N 1 0 333.432 3.601 20 5 EHBDRO COCC1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000502373279 1028171491 /nfs/dbraw/zinc/17/14/91/1028171491.db2.gz LZTVJYQZZRGWST-WBVHZDCISA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCOC1 ZINC000503953259 1028260673 /nfs/dbraw/zinc/26/06/73/1028260673.db2.gz RSRHIROHDRJAEM-ZIAGYGMSSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](O)CC23CCC3)o1 ZINC000421374434 1028335284 /nfs/dbraw/zinc/33/52/84/1028335284.db2.gz OVIMUFAWPGFSMK-AWEZNQCLSA-N 1 0 342.395 3.734 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903859 1028831761 /nfs/dbraw/zinc/83/17/61/1028831761.db2.gz TWJLSMGOTFYMHD-INIZCTEOSA-N 1 0 333.432 3.864 20 5 EHBDRO C[C@H]1CC[C@@H]([N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592997 1028884216 /nfs/dbraw/zinc/88/42/16/1028884216.db2.gz RHUGFYJFCTXPGQ-DZGCQCFKSA-N 1 0 329.400 3.913 20 5 EHBDRO CO[C@H]1C[C@H]2C[C@H]([NH2+]CCCCc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC000424307723 1028988448 /nfs/dbraw/zinc/98/84/48/1028988448.db2.gz YCZNFASKDSYMDJ-NFEGKLMCSA-N 1 0 332.444 3.711 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCSC1 ZINC000504900072 1029026497 /nfs/dbraw/zinc/02/64/97/1029026497.db2.gz QTGAXAVQQNQULG-CHWSQXEVSA-N 1 0 326.487 3.951 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(CO)c1 ZINC000504899077 1029027061 /nfs/dbraw/zinc/02/70/61/1029027061.db2.gz AILUCGMEPZTRJH-INIZCTEOSA-N 1 0 346.452 3.748 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H]1CCC[C@@H]1c1ccccc1 ZINC000446002925 1029319570 /nfs/dbraw/zinc/31/95/70/1029319570.db2.gz OGVJPFSYRMWMMC-IAGOWNOFSA-N 1 0 326.396 3.900 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000533248715 1029526536 /nfs/dbraw/zinc/52/65/36/1029526536.db2.gz MLFHECFMTIZLJF-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000319682550 1029552916 /nfs/dbraw/zinc/55/29/16/1029552916.db2.gz JTYCGTSJQWTSEO-SNVBAGLBSA-N 1 0 331.338 3.756 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285233 1029574044 /nfs/dbraw/zinc/57/40/44/1029574044.db2.gz XUAKTXAIKNBLPT-TZMCWYRMSA-N 1 0 333.432 3.741 20 5 EHBDRO COc1cc(C[N@H+](C)CCC(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000052246212 1029598590 /nfs/dbraw/zinc/59/85/90/1029598590.db2.gz UQPINWWJAPDXMU-UHFFFAOYSA-N 1 0 332.347 3.683 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCCCNc2ccccn2)cccc1[N+](=O)[O-] ZINC000162874518 1029645058 /nfs/dbraw/zinc/64/50/58/1029645058.db2.gz SJQSCOSQCZLKCE-HNNXBMFYSA-N 1 0 328.416 3.841 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H]2CCC[C@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000154141318 1029731055 /nfs/dbraw/zinc/73/10/55/1029731055.db2.gz SMTSRYDHQNRPOY-BPUTZDHNSA-N 1 0 335.448 3.517 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC1CCC([NH+]2CCCCC2)CC1 ZINC000080247726 1029752564 /nfs/dbraw/zinc/75/25/64/1029752564.db2.gz VHRJESGGFKEEBK-UHFFFAOYSA-N 1 0 347.459 3.950 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C3CC(F)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000428648122 1029842746 /nfs/dbraw/zinc/84/27/46/1029842746.db2.gz PMYMEUWNKUVYGQ-UHFFFAOYSA-N 1 0 338.310 3.751 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000441189705 1029896940 /nfs/dbraw/zinc/89/69/40/1029896940.db2.gz PRTCXMUPKCZAAI-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO CCCN(CC[NH+]1CCCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000520279970 1029912169 /nfs/dbraw/zinc/91/21/69/1029912169.db2.gz GAUGCHQQRSPZCX-UHFFFAOYSA-N 1 0 348.447 3.715 20 5 EHBDRO CC[C@H](O)CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525697485 1030028630 /nfs/dbraw/zinc/02/86/30/1030028630.db2.gz LMASIIXDLOLGAA-ZDUSSCGKSA-N 1 0 334.441 3.964 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239834 1030218903 /nfs/dbraw/zinc/21/89/03/1030218903.db2.gz GKSFSNBNEKGUKY-WFASDCNBSA-N 1 0 330.388 3.703 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447507437 1030254232 /nfs/dbraw/zinc/25/42/32/1030254232.db2.gz HUDCPBKXAHSIMJ-UXHICEINSA-N 1 0 339.439 3.865 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)N1C[C@H](C)C[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000245831735 1030269440 /nfs/dbraw/zinc/26/94/40/1030269440.db2.gz ACOMFFROJININW-ADAWSYLGSA-N 1 0 347.459 3.529 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447537332 1030273387 /nfs/dbraw/zinc/27/33/87/1030273387.db2.gz VANHMOLEEKTGSM-MSOLQXFVSA-N 1 0 342.443 3.724 20 5 EHBDRO Cc1ccsc1[C@@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447583754 1030315646 /nfs/dbraw/zinc/31/56/46/1030315646.db2.gz CAXKLVPLOLAQHJ-HZPDHXFCSA-N 1 0 332.425 3.665 20 5 EHBDRO CCC(CC)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(=O)OC ZINC000447593574 1030330293 /nfs/dbraw/zinc/33/02/93/1030330293.db2.gz SZKIDYCCALEWCR-INIZCTEOSA-N 1 0 334.416 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3CCO[C@H]3C13CCCC3)CCC2 ZINC000447604893 1030360201 /nfs/dbraw/zinc/36/02/01/1030360201.db2.gz DSFURRBDRLNHPM-NXWXRZEISA-N 1 0 342.439 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@@H]3C13CCCC3)CCC2 ZINC000447604891 1030361391 /nfs/dbraw/zinc/36/13/91/1030361391.db2.gz DSFURRBDRLNHPM-AITUJVMLSA-N 1 0 342.439 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)C2(CO)CCCC2)cc1 ZINC000453609604 1030399557 /nfs/dbraw/zinc/39/95/57/1030399557.db2.gz GIYMBUOBPMZENW-LJQANCHMSA-N 1 0 340.423 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3O)o2)c(Cl)c1 ZINC000453615138 1030405486 /nfs/dbraw/zinc/40/54/86/1030405486.db2.gz OEEISDSDWAKXML-HUUCEWRRSA-N 1 0 336.775 3.511 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]([C@@H]2CCOC2)C1 ZINC000441295807 1030534449 /nfs/dbraw/zinc/53/44/49/1030534449.db2.gz UATQVSYPTUBEPB-HZPDHXFCSA-N 1 0 348.443 3.631 20 5 EHBDRO CC(C)Oc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000192682411 1031125085 /nfs/dbraw/zinc/12/50/85/1031125085.db2.gz XXWVRJSWMHVGNA-SFHVURJKSA-N 1 0 341.411 3.944 20 5 EHBDRO CC[C@@H](N[C@H]1CC[N@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807241 1031343198 /nfs/dbraw/zinc/34/31/98/1031343198.db2.gz LZSWMABKDKUVPZ-PKOBYXMFSA-N 1 0 331.460 3.900 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000568531596 1031668843 /nfs/dbraw/zinc/66/88/43/1031668843.db2.gz HTKQQXQUPOZWCK-PKOBYXMFSA-N 1 0 343.402 3.614 20 5 EHBDRO C[N@@H+]1CC[C@H](Cc2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000904132215 1031770496 /nfs/dbraw/zinc/77/04/96/1031770496.db2.gz UQACGJSBJWXRBV-CQSZACIVSA-N 1 0 344.418 3.932 20 5 EHBDRO C[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000537771216 1031907255 /nfs/dbraw/zinc/90/72/55/1031907255.db2.gz HSDXGJFPZTUPLC-KBPBESRZSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594520872 1033427757 /nfs/dbraw/zinc/42/77/57/1033427757.db2.gz QQQJTYBNWIRYOJ-YSVLISHTSA-N 1 0 336.432 3.992 20 5 EHBDRO CCc1cnccc1[C@H](C)[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611941290 1033458908 /nfs/dbraw/zinc/45/89/08/1033458908.db2.gz NZWJYTOXJSOZLQ-AWEZNQCLSA-N 1 0 329.400 3.672 20 5 EHBDRO COCCC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CCCC1 ZINC000595011629 1033605578 /nfs/dbraw/zinc/60/55/78/1033605578.db2.gz CMTSZRJMMUNINX-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO CN(C(=O)C[N@H+](CC1CCCCC1)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000059409402 1033611350 /nfs/dbraw/zinc/61/13/50/1033611350.db2.gz ITHYYFMXJXPWKX-UHFFFAOYSA-N 1 0 345.443 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CCOc2ccccc21 ZINC000595021012 1033613850 /nfs/dbraw/zinc/61/38/50/1033613850.db2.gz WIGLJFOYVGJDML-ZIAGYGMSSA-N 1 0 342.395 3.820 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023873 1033615478 /nfs/dbraw/zinc/61/54/78/1033615478.db2.gz ZDYMKGXOENHQBS-HOTGVXAUSA-N 1 0 349.475 3.622 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCc1ccn(C2CCCC2)n1 ZINC000595023839 1033617123 /nfs/dbraw/zinc/61/71/23/1033617123.db2.gz YUGBPVXRBUTCAY-ZDUSSCGKSA-N 1 0 344.415 3.766 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)c1ccc(C)cn1 ZINC000598991548 1033617275 /nfs/dbraw/zinc/61/72/75/1033617275.db2.gz OKURHEDAECTQDA-UHFFFAOYSA-N 1 0 343.427 3.764 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000595003906 1033629119 /nfs/dbraw/zinc/62/91/19/1033629119.db2.gz NBMOZFUBBVJREZ-RYUDHWBXSA-N 1 0 344.367 3.744 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](c2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000595009655 1033633276 /nfs/dbraw/zinc/63/32/76/1033633276.db2.gz ZDZLOLRTBIZGMZ-KUHUBIRLSA-N 1 0 328.412 3.930 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccnc2N2CCCC2)cc1[N+](=O)[O-] ZINC000595063004 1033641487 /nfs/dbraw/zinc/64/14/87/1033641487.db2.gz BSNRUTGMHHVENJ-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO C[C@@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072776 1033645881 /nfs/dbraw/zinc/64/58/81/1033645881.db2.gz QOPVEJWVYZVXLI-RYUDHWBXSA-N 1 0 336.338 3.991 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595073566 1033649545 /nfs/dbraw/zinc/64/95/45/1033649545.db2.gz NKJXZUQIOQCOQS-QFBILLFUSA-N 1 0 339.439 3.842 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027128 1033650725 /nfs/dbraw/zinc/65/07/25/1033650725.db2.gz PZEJMXUMYVIQNR-OAUYIBNBSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCC(OC(C)C)CC1 ZINC000595036626 1033655880 /nfs/dbraw/zinc/65/58/80/1033655880.db2.gz TYRAFXHDKZSWOD-VQCLRJIVSA-N 1 0 336.432 3.990 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000595040268 1033660600 /nfs/dbraw/zinc/66/06/00/1033660600.db2.gz FUZXKXGKHPWZDU-JJRVBVJISA-N 1 0 336.432 3.705 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599055054 1033706972 /nfs/dbraw/zinc/70/69/72/1033706972.db2.gz FWULDFUSGOGESJ-KGLIPLIRSA-N 1 0 342.321 3.636 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](n1cccn1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599055053 1033708401 /nfs/dbraw/zinc/70/84/01/1033708401.db2.gz FWULDFUSGOGESJ-KBPBESRZSA-N 1 0 342.321 3.636 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccnc1C ZINC000599074426 1033716846 /nfs/dbraw/zinc/71/68/46/1033716846.db2.gz RHHWGMIAKALWRW-HNNXBMFYSA-N 1 0 331.441 3.959 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595414493 1033791050 /nfs/dbraw/zinc/79/10/50/1033791050.db2.gz KQQHEKPPDHSGOR-HUUCEWRRSA-N 1 0 347.459 3.530 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000595418032 1033792246 /nfs/dbraw/zinc/79/22/46/1033792246.db2.gz NHOLPJJANCZFDK-YJBOKZPZSA-N 1 0 330.359 3.601 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C2CC2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000593716722 1033838807 /nfs/dbraw/zinc/83/88/07/1033838807.db2.gz RUVJDUOJTPKOOL-YJYMSZOUSA-N 1 0 348.443 3.849 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000593716721 1033839319 /nfs/dbraw/zinc/83/93/19/1033839319.db2.gz RUVJDUOJTPKOOL-ORAYPTAESA-N 1 0 348.443 3.849 20 5 EHBDRO O=[N+]([O-])c1ncccc1NCc1ccccc1C[NH+]1CCCCC1 ZINC000603844293 1033966663 /nfs/dbraw/zinc/96/66/63/1033966663.db2.gz KVKVZHLMGCEXIP-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000595765103 1033970606 /nfs/dbraw/zinc/97/06/06/1033970606.db2.gz HAPBIONMMDYVRV-GFCCVEGCSA-N 1 0 344.358 3.526 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(C)c2)CC1 ZINC000603851030 1033977353 /nfs/dbraw/zinc/97/73/53/1033977353.db2.gz ZZOKANZMALHESG-UHFFFAOYSA-N 1 0 339.439 3.924 20 5 EHBDRO C[C@H]1C[C@H](C)C[NH+](CCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000603859677 1033985151 /nfs/dbraw/zinc/98/51/51/1033985151.db2.gz QXBZWTKINNHOER-GJZGRUSLSA-N 1 0 342.443 3.923 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2ccc(C)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000064114239 1033996904 /nfs/dbraw/zinc/99/69/04/1033996904.db2.gz ZUJKSNFTJRQQAG-IBGZPJMESA-N 1 0 341.411 3.821 20 5 EHBDRO C[C@H]1CC[N@H+](CCN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610447 1034070111 /nfs/dbraw/zinc/07/01/11/1034070111.db2.gz MAWXHWOMPSNDJR-JXFKEZNVSA-N 1 0 339.439 3.616 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NC1CC[NH+](CC2CC2)CC1 ZINC000596088029 1034076095 /nfs/dbraw/zinc/07/60/95/1034076095.db2.gz LAHPIPSUMPPRCQ-UHFFFAOYSA-N 1 0 325.359 3.819 20 5 EHBDRO COc1cc(NC2CC[NH+](CC3CC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596089028 1034076128 /nfs/dbraw/zinc/07/61/28/1034076128.db2.gz VJWMPKXXJNBAQR-UHFFFAOYSA-N 1 0 339.823 3.543 20 5 EHBDRO Cc1cc(NCc2ccccc2OCC[NH+](C)C)c([N+](=O)[O-])s1 ZINC000596118046 1034081118 /nfs/dbraw/zinc/08/11/18/1034081118.db2.gz MUYWHJRWUUJYOE-UHFFFAOYSA-N 1 0 335.429 3.517 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599676918 1034082665 /nfs/dbraw/zinc/08/26/65/1034082665.db2.gz FTUCXCFPFOQAFZ-INIZCTEOSA-N 1 0 344.386 3.775 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691143 1034094012 /nfs/dbraw/zinc/09/40/12/1034094012.db2.gz QSLZBPZLRWGHBB-HSWBROFVSA-N 1 0 342.399 3.823 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000179394950 1034277199 /nfs/dbraw/zinc/27/71/99/1034277199.db2.gz WZHXLBPFUMNNSY-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](CC3CC3)CC2)c2ncccc12 ZINC000596562390 1034290383 /nfs/dbraw/zinc/29/03/83/1034290383.db2.gz MLXHDNDKOSFUAO-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(C)cc1 ZINC000892438690 1034295026 /nfs/dbraw/zinc/29/50/26/1034295026.db2.gz LYDBGYYOQRPFNE-OAHLLOKOSA-N 1 0 330.384 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000179442157 1034306712 /nfs/dbraw/zinc/30/67/12/1034306712.db2.gz PXYPYLHOKIKYRB-LJQANCHMSA-N 1 0 344.386 3.507 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000179455485 1034308663 /nfs/dbraw/zinc/30/86/63/1034308663.db2.gz MHFRTAIIKKYCBX-HNNXBMFYSA-N 1 0 349.475 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@H]3CCC(F)(F)C3)CC2)cc1 ZINC000450461726 1034342254 /nfs/dbraw/zinc/34/22/54/1034342254.db2.gz XCAJRWWKCOWJRV-ZDUSSCGKSA-N 1 0 340.370 3.873 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000604417869 1034370814 /nfs/dbraw/zinc/37/08/14/1034370814.db2.gz FYBOPJRBGZMJTJ-UHFFFAOYSA-N 1 0 341.455 3.940 20 5 EHBDRO COCCC1C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000597183582 1034587212 /nfs/dbraw/zinc/58/72/12/1034587212.db2.gz MEPQFIYLSFSXQZ-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1=CCCOC1 ZINC000597205017 1034609027 /nfs/dbraw/zinc/60/90/27/1034609027.db2.gz BZNXCJCKHAMUMN-UHFFFAOYSA-N 1 0 328.368 3.633 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000597225034 1034625071 /nfs/dbraw/zinc/62/50/71/1034625071.db2.gz LXIGQLRSVOSRPP-JZJRWUJFSA-N 1 0 330.428 3.889 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CNc2ccccc2C1)C1CC1 ZINC000593319686 1034658103 /nfs/dbraw/zinc/65/81/03/1034658103.db2.gz OLJIRYDTIMSCIM-MJGOQNOKSA-N 1 0 337.423 3.542 20 5 EHBDRO C[N@H+](CCCC(=O)c1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000450933514 1034957325 /nfs/dbraw/zinc/95/73/25/1034957325.db2.gz DRXZXUNXSUPWHB-UHFFFAOYSA-N 1 0 326.396 3.732 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccc(OC(F)F)c1 ZINC000548934053 1034998540 /nfs/dbraw/zinc/99/85/40/1034998540.db2.gz OPRNETJVSQFAET-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C2CCC(O)CC2)c2ccccc2)c1 ZINC000179966327 1035094956 /nfs/dbraw/zinc/09/49/56/1035094956.db2.gz AGISXRQMLBWLBP-NKELODKYSA-N 1 0 326.396 3.577 20 5 EHBDRO CC1(C)C[C@H](N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390421 1035434278 /nfs/dbraw/zinc/43/42/78/1035434278.db2.gz XJCHAXOGYFCURI-SQNIBIBYSA-N 1 0 329.444 3.534 20 5 EHBDRO CC(C)CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000044898421 1035510303 /nfs/dbraw/zinc/51/03/03/1035510303.db2.gz REDMFEGBESOPBH-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO CC(C)CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000044898443 1035510743 /nfs/dbraw/zinc/51/07/43/1035510743.db2.gz QPUFCGMFZZLLPY-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000571580722 1035541275 /nfs/dbraw/zinc/54/12/75/1035541275.db2.gz ASAJBERRFHDOMN-DNVCBOLYSA-N 1 0 337.423 3.698 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554128 1035666407 /nfs/dbraw/zinc/66/64/07/1035666407.db2.gz CQQVUZMRQVZUCV-GDBMZVCRSA-N 1 0 349.431 3.645 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](COC(F)F)C2)cc1[N+](=O)[O-] ZINC000582030516 1035683008 /nfs/dbraw/zinc/68/30/08/1035683008.db2.gz VBEKYWITMFJQMT-CYBMUJFWSA-N 1 0 328.359 3.779 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCOc2ccccc2)ccc1[N+](=O)[O-] ZINC000492356901 1035698698 /nfs/dbraw/zinc/69/86/98/1035698698.db2.gz LQMNRJMRDWTDIL-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000272015259 1035767049 /nfs/dbraw/zinc/76/70/49/1035767049.db2.gz QWTDCRFWHGJNQE-GJZGRUSLSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1cc2c(cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C)O[C@@H](C)C2 ZINC000327858924 1035825895 /nfs/dbraw/zinc/82/58/95/1035825895.db2.gz OFDZPAZTQBXCAD-LBPRGKRZSA-N 1 0 342.395 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000588232658 1035832862 /nfs/dbraw/zinc/83/28/62/1035832862.db2.gz VBGFLRNHXHGODM-HIFRSBDPSA-N 1 0 348.830 3.983 20 5 EHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000535068399 1035985668 /nfs/dbraw/zinc/98/56/68/1035985668.db2.gz MSYYFJOYLZZKQJ-GQCTYLIASA-N 1 0 340.379 3.511 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@H]2CCCOC2)c2ccccc2)c1 ZINC000180182385 1036048032 /nfs/dbraw/zinc/04/80/32/1036048032.db2.gz KKBXUPMMQIBPMO-BEFAXECRSA-N 1 0 326.396 3.700 20 5 EHBDRO COC1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000180199241 1036172138 /nfs/dbraw/zinc/17/21/38/1036172138.db2.gz VVFMXEZUOULVHW-GOSISDBHSA-N 1 0 326.396 3.843 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000541326121 1036200653 /nfs/dbraw/zinc/20/06/53/1036200653.db2.gz UNFIPJRQLZXUNK-CYBMUJFWSA-N 1 0 333.432 3.600 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1)c1ccco1 ZINC000589103583 1036235656 /nfs/dbraw/zinc/23/56/56/1036235656.db2.gz NQFMRHBGMXBQJV-ZDUSSCGKSA-N 1 0 343.305 3.921 20 5 EHBDRO CCOC(=O)c1ccc(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)o1 ZINC000589197465 1036303580 /nfs/dbraw/zinc/30/35/80/1036303580.db2.gz KNEKCFDIJCVQDQ-LCYFTJDESA-N 1 0 344.367 3.558 20 5 EHBDRO CCCC[C@H]1CCC[C@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000492818134 1036335812 /nfs/dbraw/zinc/33/58/12/1036335812.db2.gz MPZORQWWSWKODL-GOEBONIOSA-N 1 0 333.432 3.790 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000589284648 1036340017 /nfs/dbraw/zinc/34/00/17/1036340017.db2.gz NZQLJZIQCOKGDL-AEFFLSMTSA-N 1 0 345.830 3.783 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000165264835 1036352224 /nfs/dbraw/zinc/35/22/24/1036352224.db2.gz YMWYAQLXUIJUPY-INIZCTEOSA-N 1 0 345.443 3.886 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC[C@@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541566281 1036437484 /nfs/dbraw/zinc/43/74/84/1036437484.db2.gz SDEWGTFOCFBBQX-LPHOPBHVSA-N 1 0 346.427 3.980 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000541566577 1036441060 /nfs/dbraw/zinc/44/10/60/1036441060.db2.gz PTSCUFHSINONSD-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO Cc1cc(NCCSCC(F)(F)F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000572675882 1036453805 /nfs/dbraw/zinc/45/38/05/1036453805.db2.gz BYQOWZJTDCOHOI-UHFFFAOYSA-N 1 0 345.346 3.581 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H](C)C[C@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541568372 1036458276 /nfs/dbraw/zinc/45/82/76/1036458276.db2.gz OUOXKAPMNARPOI-FHSNZYRGSA-N 1 0 332.400 3.589 20 5 EHBDRO COc1cc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000464494185 1036496779 /nfs/dbraw/zinc/49/67/79/1036496779.db2.gz PAAABVPITJKJCU-KRWDZBQOSA-N 1 0 344.386 3.853 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(C[NH+](CC)CC)o1 ZINC000589807894 1036629385 /nfs/dbraw/zinc/62/93/85/1036629385.db2.gz DOSIQDJDVACQLC-UHFFFAOYSA-N 1 0 345.399 3.844 20 5 EHBDRO CC(C)([NH2+]C[C@@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000590053316 1036740423 /nfs/dbraw/zinc/74/04/23/1036740423.db2.gz HKSDLMAUSUMSLE-AWEZNQCLSA-N 1 0 326.396 3.986 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000414335549 1036750187 /nfs/dbraw/zinc/75/01/87/1036750187.db2.gz OLMBLCUDXJKQHO-SFHVURJKSA-N 1 0 325.412 3.935 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000539500870 1036819961 /nfs/dbraw/zinc/81/99/61/1036819961.db2.gz CEELBBSXGQXKCK-SAZUREKKSA-N 1 0 328.416 3.664 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519660 1037097479 /nfs/dbraw/zinc/09/74/79/1037097479.db2.gz CYQXVXHRORRXDG-AWEZNQCLSA-N 1 0 325.840 3.602 20 5 EHBDRO C[NH+](C)CC[C@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525444 1037109379 /nfs/dbraw/zinc/10/93/79/1037109379.db2.gz KATZRSDCGYJXIR-HNNXBMFYSA-N 1 0 327.856 3.704 20 5 EHBDRO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761525341 1037109861 /nfs/dbraw/zinc/10/98/61/1037109861.db2.gz GYASZXFPNOEPHO-OAHLLOKOSA-N 1 0 348.786 3.870 20 5 EHBDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761525340 1037110513 /nfs/dbraw/zinc/11/05/13/1037110513.db2.gz GYASZXFPNOEPHO-HNNXBMFYSA-N 1 0 348.786 3.870 20 5 EHBDRO C[C@@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740691 1037134035 /nfs/dbraw/zinc/13/40/35/1037134035.db2.gz CCZXNUSHEVDOAS-OALUTQOASA-N 1 0 326.396 3.843 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539820978 1037243031 /nfs/dbraw/zinc/24/30/31/1037243031.db2.gz TZVWITFZARBKCS-CQSZACIVSA-N 1 0 330.432 3.863 20 5 EHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829599 1037255683 /nfs/dbraw/zinc/25/56/83/1037255683.db2.gz REKKBSJDDNWHES-CZUORRHYSA-N 1 0 328.416 3.616 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000311066172 1037308177 /nfs/dbraw/zinc/30/81/77/1037308177.db2.gz YDKDFSJKEDCVDQ-QGZVFWFLSA-N 1 0 340.427 3.622 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899996 1037341427 /nfs/dbraw/zinc/34/14/27/1037341427.db2.gz MFHWOCCRKNSHRX-IRXDYDNUSA-N 1 0 332.444 3.967 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@@H](OCC)C12CCCC2 ZINC000462756710 1037372703 /nfs/dbraw/zinc/37/27/03/1037372703.db2.gz OXUOOZRISIISOS-ZWKOTPCHSA-N 1 0 348.443 3.821 20 5 EHBDRO COc1cccc(COCC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540139592 1037612789 /nfs/dbraw/zinc/61/27/89/1037612789.db2.gz CEAATRKWEDJQJO-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@H]([NH2+]C1CCN(CCC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463081528 1037730215 /nfs/dbraw/zinc/73/02/15/1037730215.db2.gz FFNOWPRVELSGRP-LBPRGKRZSA-N 1 0 345.365 3.662 20 5 EHBDRO C[C@H]1CCN(c2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000463070789 1037735583 /nfs/dbraw/zinc/73/55/83/1037735583.db2.gz PDDLTDAQBYCWOS-INIZCTEOSA-N 1 0 325.412 3.696 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000573858775 1037785884 /nfs/dbraw/zinc/78/58/84/1037785884.db2.gz YTZHYSXTRZZFFW-DZGCQCFKSA-N 1 0 342.395 3.820 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2(CCO)CCC2)c2ccccc2)c1 ZINC000494030009 1037786705 /nfs/dbraw/zinc/78/67/05/1037786705.db2.gz SKRICZFRBVMTJG-LJQANCHMSA-N 1 0 340.423 3.827 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000157658809 1037795115 /nfs/dbraw/zinc/79/51/15/1037795115.db2.gz CCTQZLLSPLHGJU-MSOLQXFVSA-N 1 0 332.375 3.898 20 5 EHBDRO COC(=O)CC(C)(C)C[C@H](C)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897459513 1037837256 /nfs/dbraw/zinc/83/72/56/1037837256.db2.gz ACURGCGITCJUFW-KBPBESRZSA-N 1 0 336.432 3.656 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@]3(C)CCCO3)o2)c([N+](=O)[O-])c1 ZINC000152936846 1037863855 /nfs/dbraw/zinc/86/38/55/1037863855.db2.gz OMJXIYYRNOIAGB-GOSISDBHSA-N 1 0 346.383 3.522 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410484 1037908038 /nfs/dbraw/zinc/90/80/38/1037908038.db2.gz ZNLCJWYWDFNHES-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058452116 1037918982 /nfs/dbraw/zinc/91/89/82/1037918982.db2.gz OUVUTAFDCXTQLD-GFCCVEGCSA-N 1 0 344.358 3.969 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000540479661 1037988890 /nfs/dbraw/zinc/98/88/90/1037988890.db2.gz SLDORBLCEAGQJY-UKPHBRMFSA-N 1 0 347.459 3.591 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000058563181 1038121938 /nfs/dbraw/zinc/12/19/38/1038121938.db2.gz LORZGUITBMJYNN-KRWDZBQOSA-N 1 0 326.396 3.681 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058563587 1038123957 /nfs/dbraw/zinc/12/39/57/1038123957.db2.gz DSXAIBRWYADHOH-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2C[C@@H](C)CC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000544108701 1038606634 /nfs/dbraw/zinc/60/66/34/1038606634.db2.gz DEIHHKVBHUMMJR-GXTWGEPZSA-N 1 0 333.432 3.598 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000539069133 1038669184 /nfs/dbraw/zinc/66/91/84/1038669184.db2.gz PGVQASGVKDHAEL-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CN(Cc1ccccc1)[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871577 1038817167 /nfs/dbraw/zinc/81/71/67/1038817167.db2.gz GVHSJWNKVYSZRJ-HXUWFJFHSA-N 1 0 339.439 3.595 20 5 EHBDRO O=[N+]([O-])c1cnc2ccccc2c1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000488053345 1038826208 /nfs/dbraw/zinc/82/62/08/1038826208.db2.gz DXKLANFOPXBBEO-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2c[nH]c3cc(F)ccc23)c(F)c1 ZINC000479929109 1038903988 /nfs/dbraw/zinc/90/39/88/1038903988.db2.gz UGHLICHYOUFPGS-UHFFFAOYSA-N 1 0 331.322 3.687 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000552274209 1039144038 /nfs/dbraw/zinc/14/40/38/1039144038.db2.gz HBRJOOGAUSKDQN-KRWDZBQOSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852589 1039157103 /nfs/dbraw/zinc/15/71/03/1039157103.db2.gz JJMBAOCXCFRZDT-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000905854371 1039160898 /nfs/dbraw/zinc/16/08/98/1039160898.db2.gz VVPBGFHJKDBMGI-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](Cc1ccc(F)cc1)C(C)C ZINC000478049292 1039169876 /nfs/dbraw/zinc/16/98/76/1039169876.db2.gz WFZNUDOBLIHASS-KRWDZBQOSA-N 1 0 348.422 3.520 20 5 EHBDRO CO[C@@H](c1ccccc1F)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478249928 1039322537 /nfs/dbraw/zinc/32/25/37/1039322537.db2.gz HKSKRTPDQGZFCK-APPDUMDISA-N 1 0 336.338 3.739 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000512470055 1039326492 /nfs/dbraw/zinc/32/64/92/1039326492.db2.gz VKJNWCDQHPPZQM-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCO[C@H](C(F)(F)F)C2)cc1 ZINC000584856300 1039352578 /nfs/dbraw/zinc/35/25/78/1039352578.db2.gz OMKYXWTUZQPQKI-ZFWWWQNUSA-N 1 0 346.349 3.617 20 5 EHBDRO CC(C)c1ccc(CN2CCc3ccc(O)cc3C2)cc1[N+](=O)[O-] ZINC000509534989 1039432140 /nfs/dbraw/zinc/43/21/40/1039432140.db2.gz ZEQNGROOWNLTRD-UHFFFAOYSA-N 1 0 326.396 3.982 20 5 EHBDRO O=C(C[NH2+][C@@H]1CCCCC12CCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000584669437 1039443810 /nfs/dbraw/zinc/44/38/10/1039443810.db2.gz WLHKIGPAZLOSIJ-MRXNPFEDSA-N 1 0 331.416 3.626 20 5 EHBDRO Cc1nn(C)c(C)c1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417344586 1039708728 /nfs/dbraw/zinc/70/87/28/1039708728.db2.gz SIMHVUKUNQPYGV-SFHVURJKSA-N 1 0 328.416 3.502 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COCc2ccccc21 ZINC000417355449 1039713707 /nfs/dbraw/zinc/71/37/07/1039713707.db2.gz DJCIIKRFWDSVQR-KSSFIOAISA-N 1 0 326.396 3.777 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000549808076 1039925227 /nfs/dbraw/zinc/92/52/27/1039925227.db2.gz IOUJIBWDMPUUFM-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CC(=O)c1cc(NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553297683 1039944908 /nfs/dbraw/zinc/94/49/08/1039944908.db2.gz HIAUHYGASVKTMT-KBPBESRZSA-N 1 0 333.432 3.577 20 5 EHBDRO COC(=O)C(C)(C)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000512547789 1040076571 /nfs/dbraw/zinc/07/65/71/1040076571.db2.gz SHBFJTDKBMZIOX-UHFFFAOYSA-N 1 0 346.383 3.534 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1F ZINC000573624405 1040177370 /nfs/dbraw/zinc/17/73/70/1040177370.db2.gz LUKVFDPJIXGHGB-INIZCTEOSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1 ZINC000490029781 1040298959 /nfs/dbraw/zinc/29/89/59/1040298959.db2.gz YABIYBTYDKJJQW-QGZVFWFLSA-N 1 0 341.411 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2c(F)cccc2N2CCCC2)cc1 ZINC000105448316 1040317655 /nfs/dbraw/zinc/31/76/55/1040317655.db2.gz WSTLXQPPTNXDHY-UHFFFAOYSA-N 1 0 343.402 3.666 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000481163578 1040414895 /nfs/dbraw/zinc/41/48/95/1040414895.db2.gz AFHIHBQLYDFIMG-XLIONFOSSA-N 1 0 342.439 3.877 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075413 1040435383 /nfs/dbraw/zinc/43/53/83/1040435383.db2.gz PLUASMGBLMDSKW-IJEWVQPXSA-N 1 0 331.416 3.576 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H]1CCC(C)C ZINC000486783620 1040441456 /nfs/dbraw/zinc/44/14/56/1040441456.db2.gz ZKLFLDZONMPAIZ-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481184752 1040447929 /nfs/dbraw/zinc/44/79/29/1040447929.db2.gz TVVOPVFLNODLGR-GDBMZVCRSA-N 1 0 333.432 3.790 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486813414 1040466246 /nfs/dbraw/zinc/46/62/46/1040466246.db2.gz UXQAOUTWWIDHHB-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCOCC1 ZINC000555422198 1040559820 /nfs/dbraw/zinc/55/98/20/1040559820.db2.gz MTRLNXRDZOBRCK-HNNXBMFYSA-N 1 0 346.349 3.908 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(CO)CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000433061651 1040585123 /nfs/dbraw/zinc/58/51/23/1040585123.db2.gz QAQUDKFTVYZYJB-AWEZNQCLSA-N 1 0 348.443 3.587 20 5 EHBDRO C[C@@]1(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCS1 ZINC000600125990 1040687680 /nfs/dbraw/zinc/68/76/80/1040687680.db2.gz SJPUXTAYTKWCBU-KRWDZBQOSA-N 1 0 336.457 3.724 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000249525163 1040722146 /nfs/dbraw/zinc/72/21/46/1040722146.db2.gz SBMNUXNMSWTDAZ-SUNKGSAMSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc([C@H](C)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000600155873 1040744553 /nfs/dbraw/zinc/74/45/53/1040744553.db2.gz JRIZPYXSLJJTMU-OAHLLOKOSA-N 1 0 328.416 3.540 20 5 EHBDRO COC(=O)c1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000490801923 1040747903 /nfs/dbraw/zinc/74/79/03/1040747903.db2.gz MIKGXXYHOVUXSK-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO CC1(C)C[C@H](N[C@H]2CC[N@@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114680 1040765417 /nfs/dbraw/zinc/76/54/17/1040765417.db2.gz GTIKIRFAQFDIBV-LIRRHRJNSA-N 1 0 343.471 3.924 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487200448 1040785939 /nfs/dbraw/zinc/78/59/39/1040785939.db2.gz PPYTYQPJSFPUNB-AWEZNQCLSA-N 1 0 335.448 3.550 20 5 EHBDRO CC[C@@H]1COCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798612 1040839441 /nfs/dbraw/zinc/83/94/41/1040839441.db2.gz INORURFVFMOSIY-CQSZACIVSA-N 1 0 332.425 3.934 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@@H]21 ZINC000555721021 1041043750 /nfs/dbraw/zinc/04/37/50/1041043750.db2.gz FJQLBDLEXLWSPX-GJZGRUSLSA-N 1 0 342.399 3.655 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@@H]21 ZINC000555721466 1041059605 /nfs/dbraw/zinc/05/96/05/1041059605.db2.gz REJPPJATMIELLI-LSDHHAIUSA-N 1 0 342.399 3.655 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000249370355 1041130401 /nfs/dbraw/zinc/13/04/01/1041130401.db2.gz AOTOWFIEKIJMBT-XUJVJEKNSA-N 1 0 330.388 3.559 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000120292091 1041211635 /nfs/dbraw/zinc/21/16/35/1041211635.db2.gz OPHLENNXXTYIGS-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744388 1041256357 /nfs/dbraw/zinc/25/63/57/1041256357.db2.gz CGVCBAUCRFLLRF-AWEZNQCLSA-N 1 0 330.388 3.799 20 5 EHBDRO C[C@@H](O)CC(C)(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290779982 1041341437 /nfs/dbraw/zinc/34/14/37/1041341437.db2.gz CEWPQDMTNAYBNT-SECBINFHSA-N 1 0 335.231 3.788 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(F)(F)F)c1ccco1 ZINC000111221277 1042251381 /nfs/dbraw/zinc/25/13/81/1042251381.db2.gz VFDDZNJJSSHIOW-ZDUSSCGKSA-N 1 0 343.305 3.921 20 5 EHBDRO CCC1CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000104675359 1042280657 /nfs/dbraw/zinc/28/06/57/1042280657.db2.gz OXAUPKXHQOCYLQ-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@H](C)C1 ZINC000248557224 1042526993 /nfs/dbraw/zinc/52/69/93/1042526993.db2.gz LJGJAQVSCLQIHB-QWHCGFSZSA-N 1 0 330.388 3.828 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181835900 1042549445 /nfs/dbraw/zinc/54/94/45/1042549445.db2.gz MZCUZFDHLMAMKD-LSDHHAIUSA-N 1 0 347.459 3.733 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000120359686 1042647412 /nfs/dbraw/zinc/64/74/12/1042647412.db2.gz OFFZRTWSXOHCNJ-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000070696045 1042849838 /nfs/dbraw/zinc/84/98/38/1042849838.db2.gz MPJBPNWFVWZQRR-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)c1 ZINC000122127135 1042862799 /nfs/dbraw/zinc/86/27/99/1042862799.db2.gz PXORFWZJNQVXQJ-IFXJQAMLSA-N 1 0 343.427 3.557 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135644 1042864376 /nfs/dbraw/zinc/86/43/76/1042864376.db2.gz CNMRHKJZMPPCFJ-RHSMWYFYSA-N 1 0 329.400 3.676 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432330318 1042931712 /nfs/dbraw/zinc/93/17/12/1042931712.db2.gz ZSXYKEGFZYVUGR-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C2CCC3(CC2)OCCO3)c2cc([N+](=O)[O-])ccc21 ZINC000278979974 1043122826 /nfs/dbraw/zinc/12/28/26/1043122826.db2.gz CWPDQWJNMBKJBY-KRWDZBQOSA-N 1 0 346.427 3.593 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCCO2 ZINC000344050417 1043169580 /nfs/dbraw/zinc/16/95/80/1043169580.db2.gz QFQFCQUHMOVMLW-QGZVFWFLSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000344097764 1043239056 /nfs/dbraw/zinc/23/90/56/1043239056.db2.gz VWZZYAQWGJPKQV-MRXNPFEDSA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792085 1043461276 /nfs/dbraw/zinc/46/12/76/1043461276.db2.gz XTQLEUGSPOEJPM-CGTJXYLNSA-N 1 0 336.407 3.640 20 5 EHBDRO CC[N@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000051924188 1044600850 /nfs/dbraw/zinc/60/08/50/1044600850.db2.gz GEBBAWQUVJRFRP-UHFFFAOYSA-N 1 0 342.395 3.526 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCn1ccnc1C ZINC000344892315 1044658313 /nfs/dbraw/zinc/65/83/13/1044658313.db2.gz XRSFXAJTZFKMDM-NTCAYCPXSA-N 1 0 328.416 3.573 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000572402184 1044710521 /nfs/dbraw/zinc/71/05/21/1044710521.db2.gz YMOWEGUVYWWFAF-MLGOLLRUSA-N 1 0 330.359 3.697 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000072597909 1126793752 /nfs/dbraw/zinc/79/37/52/1126793752.db2.gz RVLZOBDLRYCXMO-AUUYWEPGSA-N 1 0 326.396 3.902 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000083170489 1127221457 /nfs/dbraw/zinc/22/14/57/1127221457.db2.gz CAKPTOIUDWLGCA-CYBMUJFWSA-N 1 0 325.368 3.972 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1COc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000765330376 1127598292 /nfs/dbraw/zinc/59/82/92/1127598292.db2.gz BEFIWOWWFRYWPU-KSSFIOAISA-N 1 0 326.396 3.887 20 5 EHBDRO Cc1cc(Nc2ccc(CC[NH+]3CCCC3)cc2)ncc1[N+](=O)[O-] ZINC000301417837 1127742399 /nfs/dbraw/zinc/74/23/99/1127742399.db2.gz CSTPBJJFKDZJMP-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@H](C)NC(=O)OC(C)(C)C ZINC000785438418 1127744124 /nfs/dbraw/zinc/74/41/24/1127744124.db2.gz HRVTZKZLNKTKDS-QWHCGFSZSA-N 1 0 337.420 3.501 20 5 EHBDRO C=Cc1ccc(CNc2ccc([N+](=O)[O-])c(OCC[NH+](C)C)c2)cc1 ZINC001168577753 1127981427 /nfs/dbraw/zinc/98/14/27/1127981427.db2.gz IUWHZVPFVJKTLC-UHFFFAOYSA-N 1 0 341.411 3.790 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1cc(OC)ccc1[N+](=O)[O-])c1ccco1 ZINC000338654305 1127998468 /nfs/dbraw/zinc/99/84/68/1127998468.db2.gz IPDWVTCYCHVPRM-MRXNPFEDSA-N 1 0 333.388 3.691 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000552924227 1128060733 /nfs/dbraw/zinc/06/07/33/1128060733.db2.gz BEBYVFOQAHJUFA-YJLNNSPDSA-N 1 0 325.412 3.691 20 5 EHBDRO Cc1cnc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000301458494 1128367475 /nfs/dbraw/zinc/36/74/75/1128367475.db2.gz SWDNJQQDXFLCME-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063155 1128438716 /nfs/dbraw/zinc/43/87/16/1128438716.db2.gz MVAURWNQFASBPI-SWLSCSKDSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000273291612 1128476650 /nfs/dbraw/zinc/47/66/50/1128476650.db2.gz SINBBXJGHXTPLJ-ILXRZTDVSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000273377237 1128516594 /nfs/dbraw/zinc/51/65/94/1128516594.db2.gz GBNQZVRYAARVNC-LSDHHAIUSA-N 1 0 336.388 3.805 20 5 EHBDRO COC1CCC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542685969 1128537181 /nfs/dbraw/zinc/53/71/81/1128537181.db2.gz OESYOQGEEVCOMR-UHFFFAOYSA-N 1 0 326.824 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2CCC(c3ccccc3)CC2)cc1 ZINC000765844387 1128543587 /nfs/dbraw/zinc/54/35/87/1128543587.db2.gz GNRAQNSMCUHAHC-OUNSHVDWSA-N 1 0 340.423 3.944 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccc1)C(C)(C)CO ZINC000554867368 1128738286 /nfs/dbraw/zinc/73/82/86/1128738286.db2.gz OCHLLROXDHDDEN-GOSISDBHSA-N 1 0 328.412 3.753 20 5 EHBDRO C[C@H](Cn1ccnc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338716739 1128745415 /nfs/dbraw/zinc/74/54/15/1128745415.db2.gz RHOOSXANEGYPTL-CYBMUJFWSA-N 1 0 342.424 3.698 20 5 EHBDRO C[C@H](c1ccccn1)N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091702457 1128820893 /nfs/dbraw/zinc/82/08/93/1128820893.db2.gz UCBVIIROXFCOIZ-CYBMUJFWSA-N 1 0 338.367 3.838 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC000554936998 1128898933 /nfs/dbraw/zinc/89/89/33/1128898933.db2.gz DSVRQZKMUKTOGZ-KBPBESRZSA-N 1 0 336.432 3.677 20 5 EHBDRO COc1cc(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000302157003 1120273065 /nfs/dbraw/zinc/27/30/65/1120273065.db2.gz FJQLFBDRRHYVJO-WMLDXEAASA-N 1 0 341.411 3.536 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H](C)C1 ZINC000765955592 1128915712 /nfs/dbraw/zinc/91/57/12/1128915712.db2.gz AAHPZVQJWPXIDZ-CLCXKQKWSA-N 1 0 331.460 3.978 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957919 1128947923 /nfs/dbraw/zinc/94/79/23/1128947923.db2.gz GEXGWCMCZKGRGG-AEFFLSMTSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000542539533 1120965194 /nfs/dbraw/zinc/96/51/94/1120965194.db2.gz SLSMBTWPTDMUJB-GJZGRUSLSA-N 1 0 341.411 3.705 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193234556 1120995659 /nfs/dbraw/zinc/99/56/59/1120995659.db2.gz GPSGCVFDLDCBBI-STQMWFEESA-N 1 0 327.384 3.965 20 5 EHBDRO Cc1nc([C@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000272260961 1121139447 /nfs/dbraw/zinc/13/94/47/1121139447.db2.gz AOISXRYGJHQVDH-VIFPVBQESA-N 1 0 325.821 3.906 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000495373677 1121145260 /nfs/dbraw/zinc/14/52/60/1121145260.db2.gz HGVBSARCUBIXLM-CVEARBPZSA-N 1 0 338.835 3.728 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@@H]2CCCC[C@H]12 ZINC000915210188 1121254782 /nfs/dbraw/zinc/25/47/82/1121254782.db2.gz WUHGRNYEGJIRFI-MZMPZRCHSA-N 1 0 328.416 3.803 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000301065912 1121298306 /nfs/dbraw/zinc/29/83/06/1121298306.db2.gz DFDUEBAQERVPTQ-HNNXBMFYSA-N 1 0 333.363 3.966 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNc2ncccc2[N+](=O)[O-])cc1 ZINC000301069432 1121312607 /nfs/dbraw/zinc/31/26/07/1121312607.db2.gz COPYRWMGQPJMGW-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO Cc1cnc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039577 1128977600 /nfs/dbraw/zinc/97/76/00/1128977600.db2.gz DWZQUFWAEDXCEL-NVXWUHKLSA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000762632411 1121389141 /nfs/dbraw/zinc/38/91/41/1121389141.db2.gz ISOBYQUINFZCMX-MOPGFXCFSA-N 1 0 326.396 3.855 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000090654291 1121669391 /nfs/dbraw/zinc/66/93/91/1121669391.db2.gz YUFQCASTCFSPRM-YZVOILCLSA-N 1 0 328.412 3.546 20 5 EHBDRO CCC[C@H]([NH2+]Cc1cccc2c1OCO2)c1cccc([N+](=O)[O-])c1 ZINC000194401438 1121873695 /nfs/dbraw/zinc/87/36/95/1121873695.db2.gz HHKZSSIIPDFURV-INIZCTEOSA-N 1 0 328.368 3.955 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCC[C@H]1O ZINC000497157476 1122354850 /nfs/dbraw/zinc/35/48/50/1122354850.db2.gz AFRLKOUSTVCDGC-MAUKXSAKSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000154311039 1122552564 /nfs/dbraw/zinc/55/25/64/1122552564.db2.gz BLSAAPSXYBFRKY-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775457 1129063444 /nfs/dbraw/zinc/06/34/44/1129063444.db2.gz LCIRCOFLJCIHFP-MLGOLLRUSA-N 1 0 335.835 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(CCC[NH+]3CCCC3)CC2)c(F)c1 ZINC000301788609 1129074357 /nfs/dbraw/zinc/07/43/57/1129074357.db2.gz MGUMDCKVZMCTGC-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC(C)C(C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000556892176 1123176849 /nfs/dbraw/zinc/17/68/49/1123176849.db2.gz IPEOHBDNHBHVJW-GOSISDBHSA-N 1 0 344.459 3.936 20 5 EHBDRO CC(C)[N@@H+](Cc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000919957232 1123245938 /nfs/dbraw/zinc/24/59/38/1123245938.db2.gz VAXFEDNMMKRLBS-UHFFFAOYSA-N 1 0 330.413 3.874 20 5 EHBDRO Cc1ccc(NC(=O)NCCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000347684701 1129112332 /nfs/dbraw/zinc/11/23/32/1129112332.db2.gz AAQFNCQGSSTWSB-UHFFFAOYSA-N 1 0 336.436 3.534 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@H+](CC2CC2)C1 ZINC000609384339 1123567691 /nfs/dbraw/zinc/56/76/91/1123567691.db2.gz LGFHUMPQVQTTAS-GFCCVEGCSA-N 1 0 329.322 3.510 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672692 1123641568 /nfs/dbraw/zinc/64/15/68/1123641568.db2.gz XXCWCCCRXYAPRV-DOTOQJQBSA-N 1 0 326.396 3.852 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCS[C@@H](c3ccccc3)C2)c1 ZINC000609800858 1123664292 /nfs/dbraw/zinc/66/42/92/1123664292.db2.gz UEWFCXMFKFFGKZ-GOSISDBHSA-N 1 0 344.436 3.764 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(-n3cccn3)cc2)C2CC2)c1 ZINC000195677120 1123734352 /nfs/dbraw/zinc/73/43/52/1123734352.db2.gz YKDCIWITGMIWHU-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000615720661 1123863631 /nfs/dbraw/zinc/86/36/31/1123863631.db2.gz HTPPVWNAEIPWBT-MDWZMJQESA-N 1 0 341.411 3.808 20 5 EHBDRO COc1cc(CC[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)ccc1O ZINC000615724128 1123864635 /nfs/dbraw/zinc/86/46/35/1123864635.db2.gz MDAUTBZYALZLQA-UVTDQMKNSA-N 1 0 342.395 3.545 20 5 EHBDRO CC(C)CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000078536770 1129159499 /nfs/dbraw/zinc/15/94/99/1129159499.db2.gz JAFDUJQKLWVZOI-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539663 1129160292 /nfs/dbraw/zinc/16/02/92/1129160292.db2.gz DNJUPBFKECSJOH-IUODEOHRSA-N 1 0 330.388 3.655 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216827 1124100365 /nfs/dbraw/zinc/10/03/65/1124100365.db2.gz ZQJWZVYOHHMWIH-RDJZCZTQSA-N 1 0 348.443 3.632 20 5 EHBDRO Cc1ccccc1[C@H](CO)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984938 1125256956 /nfs/dbraw/zinc/25/69/56/1125256956.db2.gz MMBJKJBZAKRLHT-OALUTQOASA-N 1 0 340.423 3.949 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)c1 ZINC000182566822 1125331849 /nfs/dbraw/zinc/33/18/49/1125331849.db2.gz TXGVSLWQWDGODP-MRXNPFEDSA-N 1 0 334.807 3.576 20 5 EHBDRO CCC1(CC)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CCS1 ZINC001307663092 1125369069 /nfs/dbraw/zinc/36/90/69/1125369069.db2.gz YPILCMNHDAIEBQ-UHFFFAOYSA-N 1 0 338.473 3.971 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491939 1131352797 /nfs/dbraw/zinc/35/27/97/1131352797.db2.gz LZLIJMWUGCMYAB-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602937 1129278214 /nfs/dbraw/zinc/27/82/14/1129278214.db2.gz OOZBPHORPQZRLD-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894152 1129292363 /nfs/dbraw/zinc/29/23/63/1129292363.db2.gz WWEOAMCRNSXCSQ-PBHICJAKSA-N 1 0 346.818 3.809 20 5 EHBDRO CC[NH+]1CCC(CCNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301955943 1129412990 /nfs/dbraw/zinc/41/29/90/1129412990.db2.gz LVHJEXMWLJHVTP-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO Cc1csc(C2([NH2+]CCOc3ccccc3[N+](=O)[O-])CCCC2)n1 ZINC000081595402 1129431272 /nfs/dbraw/zinc/43/12/72/1129431272.db2.gz FTASLBOXWOSADN-UHFFFAOYSA-N 1 0 347.440 3.798 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922455787 1129537916 /nfs/dbraw/zinc/53/79/16/1129537916.db2.gz XITPHFANFXJIFN-GYZFRLQBSA-N 1 0 344.333 3.698 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390557282 1129623072 /nfs/dbraw/zinc/62/30/72/1129623072.db2.gz IRQRZBLFGBWBLE-HOTGVXAUSA-N 1 0 327.428 3.766 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N(C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390571404 1129624286 /nfs/dbraw/zinc/62/42/86/1129624286.db2.gz TZIJQQDDUYCUOL-HOTGVXAUSA-N 1 0 327.428 3.766 20 5 EHBDRO CC1CCC([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000302600449 1129783075 /nfs/dbraw/zinc/78/30/75/1129783075.db2.gz YTXNUHFYZPJAEE-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]3C3CCCC3)n2)cc1 ZINC000055927279 1129790606 /nfs/dbraw/zinc/79/06/06/1129790606.db2.gz ZTKOZVOKWGNXQT-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCC[N@@H+]3CCc4ccccc4C3)ccc2c1 ZINC000302958405 1129802121 /nfs/dbraw/zinc/80/21/21/1129802121.db2.gz PRWJUZOVGCNQJH-UHFFFAOYSA-N 1 0 348.406 3.613 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(-n2cccn2)c1 ZINC001168749501 1129927292 /nfs/dbraw/zinc/92/72/92/1129927292.db2.gz GLYIBSVERJKFIB-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO CC(C)[N@H+](CCOC1CCSCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000929337181 1129991989 /nfs/dbraw/zinc/99/19/89/1129991989.db2.gz CAQXDJHWRITOPR-UHFFFAOYSA-N 1 0 338.473 3.717 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000700734074 1130066733 /nfs/dbraw/zinc/06/67/33/1130066733.db2.gz ITOVCXDBKCVAQP-DVOMOZLQSA-N 1 0 349.431 3.643 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)on1 ZINC000171765759 1130086074 /nfs/dbraw/zinc/08/60/74/1130086074.db2.gz PTHNJCCFAGNRFN-UHFFFAOYSA-N 1 0 329.381 3.910 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000173306253 1130204772 /nfs/dbraw/zinc/20/47/72/1130204772.db2.gz NOCZQMWYWQILOU-KGLIPLIRSA-N 1 0 345.468 3.754 20 5 EHBDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C1(C)C ZINC000766090460 1130255766 /nfs/dbraw/zinc/25/57/66/1130255766.db2.gz SZKPBENVBGJPGO-HUUCEWRRSA-N 1 0 326.824 3.930 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731208706 1130779017 /nfs/dbraw/zinc/77/90/17/1130779017.db2.gz GCNWWYWTPDPLHO-GFCCVEGCSA-N 1 0 334.445 3.737 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[C@H]([NH+]4CCCC4)CC3)sc2c1 ZINC000737413415 1131572500 /nfs/dbraw/zinc/57/25/00/1131572500.db2.gz BLDUYVREYBEGIB-ZDUSSCGKSA-N 1 0 346.456 3.659 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCC(F)(F)[C@@H](F)C1)CC2 ZINC001172902665 1131884944 /nfs/dbraw/zinc/88/49/44/1131884944.db2.gz BNIHHPWTUTVLRW-HIFRSBDPSA-N 1 0 328.334 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccncc1Cl)CC2 ZINC001172902655 1131885658 /nfs/dbraw/zinc/88/56/58/1131885658.db2.gz LMSSMONYJMHZMT-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc3ocnc3c1)CC2 ZINC001172904035 1131886829 /nfs/dbraw/zinc/88/68/29/1131886829.db2.gz VKDHAUBCDVJUJP-INIZCTEOSA-N 1 0 337.379 3.773 20 5 EHBDRO Cc1nc2c(s1)C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172914834 1131902363 /nfs/dbraw/zinc/90/23/63/1131902363.db2.gz JTUPKBDAYNEGCL-OAHLLOKOSA-N 1 0 343.452 3.665 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCOc3ccccc3C1)CC2 ZINC001172916411 1131904425 /nfs/dbraw/zinc/90/44/25/1131904425.db2.gz RMOBNOSBEUGUGA-SFHVURJKSA-N 1 0 338.407 3.737 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381103 1131914939 /nfs/dbraw/zinc/91/49/39/1131914939.db2.gz VZVFOFQIPWOCED-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO CC(C)(C)OC(=O)CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910739 1131918268 /nfs/dbraw/zinc/91/82/68/1131918268.db2.gz CFWSSGVAFNOCDK-MRXNPFEDSA-N 1 0 348.443 3.554 20 5 EHBDRO CC[C@@H]1CC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173019980 1131936330 /nfs/dbraw/zinc/93/63/30/1131936330.db2.gz NQVJJPMWUUHYPV-GFCCVEGCSA-N 1 0 339.386 3.574 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000743855408 1131988026 /nfs/dbraw/zinc/98/80/26/1131988026.db2.gz OGNLWGNAOBSDNU-CQSZACIVSA-N 1 0 325.840 3.554 20 5 EHBDRO C[NH2+]Cc1ccc(N[C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])cc1 ZINC001173190470 1131995071 /nfs/dbraw/zinc/99/50/71/1131995071.db2.gz SZDQUTYFOREEFN-GFCCVEGCSA-N 1 0 347.390 3.505 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC001173223488 1132005584 /nfs/dbraw/zinc/00/55/84/1132005584.db2.gz ANFJYUGABFRLNS-UZLBHIALSA-N 1 0 339.439 3.515 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173232043 1132009225 /nfs/dbraw/zinc/00/92/25/1132009225.db2.gz CKUCCYLVGBVPKA-KUHUBIRLSA-N 1 0 325.412 3.970 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173212996 1132014368 /nfs/dbraw/zinc/01/43/68/1132014368.db2.gz FBNWQUPRDVACSR-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H]([NH2+]Cc1c2ccccc2cc2ccccc21)[C@H]1CN(C)CCO1 ZINC000773403281 1132459997 /nfs/dbraw/zinc/45/99/97/1132459997.db2.gz DBMJKWGTOMSDND-OPAMFIHVSA-N 1 0 334.463 3.802 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCSCc2ccccc2Cl)C1 ZINC001168970206 1132622464 /nfs/dbraw/zinc/62/24/64/1132622464.db2.gz GVFUDVICWSAVJO-GXTWGEPZSA-N 1 0 328.865 3.608 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001168972675 1132623275 /nfs/dbraw/zinc/62/32/75/1132623275.db2.gz NQULLJBABBLTDH-KOLCDFICSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009410 1132631073 /nfs/dbraw/zinc/63/10/73/1132631073.db2.gz WCMXKLXGHJCEBU-PKOBYXMFSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2c3ccc(Cl)cc3c3c2CC[NH2+]C3)C1 ZINC001169030326 1132635425 /nfs/dbraw/zinc/63/54/25/1132635425.db2.gz YSPCZSDYTBSNSB-YPMHNXCESA-N 1 0 333.819 3.558 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3cc(F)ccc32)C1 ZINC001169042835 1132638039 /nfs/dbraw/zinc/63/80/39/1132638039.db2.gz GIZKSRKSXZLNRF-BBRMVZONSA-N 1 0 345.418 3.865 20 5 EHBDRO CC(C)(C)c1ccc(N2CC[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169042072 1132638270 /nfs/dbraw/zinc/63/82/70/1132638270.db2.gz CTPRUWWDCVIAEY-QFBILLFUSA-N 1 0 345.487 3.552 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169395953 1132745909 /nfs/dbraw/zinc/74/59/09/1132745909.db2.gz OLOLBPLGJXMWJA-LJQANCHMSA-N 1 0 346.402 3.897 20 5 EHBDRO Nc1cc2oc3c/c(=[NH+]/C4=CCOCC4)ccc-3nc2c2ccccc12 ZINC001176148196 1132845501 /nfs/dbraw/zinc/84/55/01/1132845501.db2.gz KUJGCGSQJPIPRV-OEAKJJBVSA-N 1 0 343.386 3.873 20 5 EHBDRO C[C@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001177222950 1133042636 /nfs/dbraw/zinc/04/26/36/1133042636.db2.gz WJTIRJYHCXVUTP-OAHLLOKOSA-N 1 0 343.427 3.819 20 5 EHBDRO Cc1nn(C[N@@H+]2CCC[C@H]2CCCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000767763360 1133048367 /nfs/dbraw/zinc/04/83/67/1133048367.db2.gz NYCKIMSULXIYGD-GOSISDBHSA-N 1 0 342.443 3.853 20 5 EHBDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766833 1133050531 /nfs/dbraw/zinc/05/05/31/1133050531.db2.gz XWISEZADOXSUPF-INIZCTEOSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCC[C@H]1C ZINC000768103671 1133094952 /nfs/dbraw/zinc/09/49/52/1133094952.db2.gz VEIGEJQBHMNAKX-HUUCEWRRSA-N 1 0 337.489 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(OC(F)F)cc2F)cc1 ZINC001177736875 1133097484 /nfs/dbraw/zinc/09/74/84/1133097484.db2.gz DDSJPCUUDZFUPU-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO COc1ccc(Cl)cc1CC[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001177843980 1133107607 /nfs/dbraw/zinc/10/76/07/1133107607.db2.gz JBTHJOKXSMZABY-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC001178176202 1133138716 /nfs/dbraw/zinc/13/87/16/1133138716.db2.gz HUZYHNHZWCEBBB-OAHLLOKOSA-N 1 0 346.814 3.904 20 5 EHBDRO CN(C)c1cc[nH+]c(NCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c1 ZINC001178300193 1133154629 /nfs/dbraw/zinc/15/46/29/1133154629.db2.gz LJWFHJWHRGGSGK-UHFFFAOYSA-N 1 0 338.367 3.928 20 5 EHBDRO Cc1nc(C)c(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC001178326901 1133159959 /nfs/dbraw/zinc/15/99/59/1133159959.db2.gz UKWJCVVBGVWUFR-UHFFFAOYSA-N 1 0 325.821 3.654 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1Br ZINC001178393341 1133161687 /nfs/dbraw/zinc/16/16/87/1133161687.db2.gz NIOHABWTVIDDPV-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cc1[N+](=O)[O-] ZINC001179386876 1133249440 /nfs/dbraw/zinc/24/94/40/1133249440.db2.gz VVOGSNJJXMMBNM-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCCCO1 ZINC001180310591 1133355911 /nfs/dbraw/zinc/35/59/11/1133355911.db2.gz LWEKGTPWDKADNP-JQHSSLGASA-N 1 0 332.444 3.855 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774204204 1133632861 /nfs/dbraw/zinc/63/28/61/1133632861.db2.gz QGGNVUOCWKYDSV-IEBWSBKVSA-N 1 0 338.411 3.738 20 5 EHBDRO CCC(CC)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)SC ZINC000774207814 1133634915 /nfs/dbraw/zinc/63/49/15/1133634915.db2.gz GECJHSNUDKAMGR-KBPBESRZSA-N 1 0 340.493 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](O)c1ccccc1Cl)CCC2 ZINC000774256035 1133645412 /nfs/dbraw/zinc/64/54/12/1133645412.db2.gz WGBBGZRFWGNKOD-MSOLQXFVSA-N 1 0 346.814 3.949 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)c1cccc(F)c1 ZINC000774258985 1133647532 /nfs/dbraw/zinc/64/75/32/1133647532.db2.gz PLIQGSZWYIZHLP-YXKWSERDSA-N 1 0 344.386 3.823 20 5 EHBDRO C[N@@H+]1CC[C@@H](CNC(=O)CCc2c3ccccc3cc3ccccc32)C1 ZINC001182413932 1133656454 /nfs/dbraw/zinc/65/64/54/1133656454.db2.gz JNYUEROECXVMQP-KRWDZBQOSA-N 1 0 346.474 3.994 20 5 EHBDRO Cc1cc([C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000774408218 1133673213 /nfs/dbraw/zinc/67/32/13/1133673213.db2.gz GBNNORLFGDLCMQ-OALUTQOASA-N 1 0 344.386 3.817 20 5 EHBDRO Cc1cc([C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000774408221 1133673418 /nfs/dbraw/zinc/67/34/18/1133673418.db2.gz GBNNORLFGDLCMQ-RTBURBONSA-N 1 0 344.386 3.817 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1[N+](=O)[O-] ZINC001184046085 1133891130 /nfs/dbraw/zinc/89/11/30/1133891130.db2.gz TZPXPMJRFIUNDS-NSHDSACASA-N 1 0 333.319 3.535 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000786813485 1133910296 /nfs/dbraw/zinc/91/02/96/1133910296.db2.gz XMVARSFETAJQBE-WJDWOHSUSA-N 1 0 348.406 3.974 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000788582853 1134148047 /nfs/dbraw/zinc/14/80/47/1134148047.db2.gz NRFUHZXHOARHPZ-SJLPKXTDSA-N 1 0 346.452 3.876 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2COCc3cccc(Cl)c32)cc1 ZINC000788590161 1134148730 /nfs/dbraw/zinc/14/87/30/1134148730.db2.gz UTAFRRSNYUFLSB-MRXNPFEDSA-N 1 0 332.787 3.652 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000788664786 1134159036 /nfs/dbraw/zinc/15/90/36/1134159036.db2.gz KSYZHWXBJLBLKA-QWRGUYRKSA-N 1 0 333.363 3.737 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000788754590 1134165020 /nfs/dbraw/zinc/16/50/20/1134165020.db2.gz QLSRDTJRWYCVOD-KSMMKXTCSA-N 1 0 342.443 3.519 20 5 EHBDRO CCC[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000788806968 1134172340 /nfs/dbraw/zinc/17/23/40/1134172340.db2.gz QVLQYCDUYRRGJU-FMEYXAORSA-N 1 0 343.427 3.730 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190978 1134307812 /nfs/dbraw/zinc/30/78/12/1134307812.db2.gz WWCKNDGWGXYITH-OAHLLOKOSA-N 1 0 331.441 3.960 20 5 EHBDRO Nc1cc(CCCCNc2ccc([N+](=O)[O-])cc2C(F)F)cc[nH+]1 ZINC001187739998 1134379222 /nfs/dbraw/zinc/37/92/22/1134379222.db2.gz SHMJLLUJVKLPPT-UHFFFAOYSA-N 1 0 336.342 3.944 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790694757 1134453944 /nfs/dbraw/zinc/45/39/44/1134453944.db2.gz JUNUVSDFXLHJMM-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606105 1134582668 /nfs/dbraw/zinc/58/26/68/1134582668.db2.gz QMDFJUOFNRJTQX-PXNSSMCTSA-N 1 0 340.423 3.735 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000775376253 1134686367 /nfs/dbraw/zinc/68/63/67/1134686367.db2.gz ZMMKTBVURIZBDA-INIZCTEOSA-N 1 0 342.823 3.706 20 5 EHBDRO CC(C)N(CC[N@H+]1C[C@H](C)C[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527810 1134712959 /nfs/dbraw/zinc/71/29/59/1134712959.db2.gz HLMYVPHIOJJBFY-CALCHBBNSA-N 1 0 333.476 3.783 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC001170295224 1134736408 /nfs/dbraw/zinc/73/64/08/1134736408.db2.gz BGEWFZOKNNJLRS-MRXNPFEDSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297963 1134737867 /nfs/dbraw/zinc/73/78/67/1134737867.db2.gz WVCQDKLENOLGFN-UGSOOPFHSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccc(C[C@H](C)n2cc(C[NH3+])c3ccccc32)c([N+](=O)[O-])c1 ZINC001170299098 1134738005 /nfs/dbraw/zinc/73/80/05/1134738005.db2.gz PSPZCKIZBXJHQZ-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(C)cc(F)c2)c([N+](=O)[O-])c1 ZINC001170305791 1134740068 /nfs/dbraw/zinc/74/00/68/1134740068.db2.gz PSNDMRUZJWXGNS-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170314386 1134745331 /nfs/dbraw/zinc/74/53/31/1134745331.db2.gz VAFJQZVOOYVCIS-UYHISHBKSA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C(C)=O)cc2)c([N+](=O)[O-])c1 ZINC001170314018 1134745387 /nfs/dbraw/zinc/74/53/87/1134745387.db2.gz UDXQOGAVEZAZSM-ZDUSSCGKSA-N 1 0 342.395 3.527 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329029 1134748919 /nfs/dbraw/zinc/74/89/19/1134748919.db2.gz NGJAINQNLUDCDD-XHDPSFHLSA-N 1 0 346.349 3.604 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329840 1134749526 /nfs/dbraw/zinc/74/95/26/1134749526.db2.gz VRCMLUXFOADKFF-NEPJUHHUSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cnc(Cl)c(C)c2)c([N+](=O)[O-])c1 ZINC001170306483 1134752184 /nfs/dbraw/zinc/75/21/84/1134752184.db2.gz VZEXKLGKWXPZGH-LBPRGKRZSA-N 1 0 349.818 3.681 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1cccnc1 ZINC001170306521 1134752437 /nfs/dbraw/zinc/75/24/37/1134752437.db2.gz WWEJNFIQUJRWFR-DYVFJYSZSA-N 1 0 329.400 3.670 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ncccc1C ZINC001170309231 1134752863 /nfs/dbraw/zinc/75/28/63/1134752863.db2.gz PNVKGNMETPSSRP-WMLDXEAASA-N 1 0 343.427 3.979 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792878188 1134811556 /nfs/dbraw/zinc/81/15/56/1134811556.db2.gz YMZXYCGOYZFCTL-STQMWFEESA-N 1 0 329.356 3.785 20 5 EHBDRO C[C@]12CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@H]1C2(Cl)Cl ZINC000792916272 1134824428 /nfs/dbraw/zinc/82/44/28/1134824428.db2.gz XDQOEUWFYRKOPG-KGLIPLIRSA-N 1 0 329.227 3.653 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H](c2ccc(F)cc2)CC1 ZINC001192514933 1135025622 /nfs/dbraw/zinc/02/56/22/1135025622.db2.gz JTOYFZANLUKDTF-HNNXBMFYSA-N 1 0 346.406 3.509 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2cnc(Cl)cc2[N+](=O)[O-])CC1(C)C ZINC001170454054 1135100826 /nfs/dbraw/zinc/10/08/26/1135100826.db2.gz RZHRJVZEWABIHW-UHFFFAOYSA-N 1 0 326.828 3.707 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C1(CC)CC ZINC001193663287 1135169204 /nfs/dbraw/zinc/16/92/04/1135169204.db2.gz RMMREZWMSDCPOK-IAGOWNOFSA-N 1 0 336.432 3.547 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784283 1135199681 /nfs/dbraw/zinc/19/96/81/1135199681.db2.gz ZMCVOHGOQVPRDR-RISCZKNCSA-N 1 0 348.359 3.637 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477554 1135276910 /nfs/dbraw/zinc/27/69/10/1135276910.db2.gz MLIQADZJDBLRQC-ZIFCJYIRSA-N 1 0 345.487 3.752 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001195179238 1135378873 /nfs/dbraw/zinc/37/88/73/1135378873.db2.gz MYGITJPJDWZFNP-BARDWOONSA-N 1 0 333.432 3.726 20 5 EHBDRO C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287107 1135407283 /nfs/dbraw/zinc/40/72/83/1135407283.db2.gz APXAMQVWRIXMFT-GOEBONIOSA-N 1 0 348.443 3.580 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001196329780 1135547198 /nfs/dbraw/zinc/54/71/98/1135547198.db2.gz RJTATBCSRKEBNY-LSDHHAIUSA-N 1 0 333.432 3.885 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000808445337 1135668756 /nfs/dbraw/zinc/66/87/56/1135668756.db2.gz OMRFWMDYXNYAEL-AUUYWEPGSA-N 1 0 328.412 3.930 20 5 EHBDRO COC(=O)CC[C@@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468855 1135693483 /nfs/dbraw/zinc/69/34/83/1135693483.db2.gz OMFCEDPZEFFEGA-GJZGRUSLSA-N 1 0 334.416 3.629 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1F ZINC001197661003 1135717240 /nfs/dbraw/zinc/71/72/40/1135717240.db2.gz SDHMOLGPRBPIAH-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700319 1135869036 /nfs/dbraw/zinc/86/90/36/1135869036.db2.gz CPTYFTGQFHIUPE-JSGCOSHPSA-N 1 0 326.824 3.764 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809961534 1135903722 /nfs/dbraw/zinc/90/37/22/1135903722.db2.gz VOPOPDYJDDGZLB-CYBMUJFWSA-N 1 0 346.258 3.864 20 5 EHBDRO C[C@@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000811484367 1136091941 /nfs/dbraw/zinc/09/19/41/1136091941.db2.gz VJUBXPBZFORUOO-SKDRFNHKSA-N 1 0 344.242 3.616 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000811485781 1136092287 /nfs/dbraw/zinc/09/22/87/1136092287.db2.gz AUFPXDPRQORTPH-BZBKMWRSSA-N 1 0 333.215 3.947 20 5 EHBDRO CC1CC[NH+](CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811473736 1136095810 /nfs/dbraw/zinc/09/58/10/1136095810.db2.gz KHOPOLQIYYMAOA-UHFFFAOYSA-N 1 0 346.258 3.723 20 5 EHBDRO C[C@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000811474380 1136095887 /nfs/dbraw/zinc/09/58/87/1136095887.db2.gz HNHAPRZAMLFQSE-LLVKDONJSA-N 1 0 346.258 3.723 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H](O)c1ccsc1 ZINC000811480752 1136097393 /nfs/dbraw/zinc/09/73/93/1136097393.db2.gz DYEGVOSQHSBWFX-LBPRGKRZSA-N 1 0 347.223 3.786 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)s1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273946 1136128514 /nfs/dbraw/zinc/12/85/14/1136128514.db2.gz FNCPWWMGZXSYGZ-AWEZNQCLSA-N 1 0 340.832 3.865 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3ccccc3)CC2)cc1 ZINC000776279731 1136134863 /nfs/dbraw/zinc/13/48/63/1136134863.db2.gz XJDBHXSBWMSTJL-IBGZPJMESA-N 1 0 326.396 3.508 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2COC3(CCC3)C2)o1 ZINC000850367456 1136241804 /nfs/dbraw/zinc/24/18/04/1136241804.db2.gz JUCGPFOXTPKUGG-CYBMUJFWSA-N 1 0 328.368 3.656 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)Nc1ccc(C[NH+](C)C)c(F)c1 ZINC000850456323 1136262515 /nfs/dbraw/zinc/26/25/15/1136262515.db2.gz DIRKPMGRJJTDPJ-LBPRGKRZSA-N 1 0 347.390 3.977 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC1SCCS1 ZINC000850562320 1136286475 /nfs/dbraw/zinc/28/64/75/1136286475.db2.gz ZUMBMAVGWRKNOM-GXTWGEPZSA-N 1 0 338.498 3.702 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1SCCS1 ZINC000850570642 1136288437 /nfs/dbraw/zinc/28/84/37/1136288437.db2.gz KMBJCEKGNLZJEW-GFCCVEGCSA-N 1 0 326.487 3.702 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000851832825 1136412209 /nfs/dbraw/zinc/41/22/09/1136412209.db2.gz DXRBVBHQSGKEDX-HKUYNNGSSA-N 1 0 344.386 3.822 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1(CO)CCC1 ZINC000814169703 1136414971 /nfs/dbraw/zinc/41/49/71/1136414971.db2.gz MEGJEUVESOMRNS-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO CCc1ccc(C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000776579782 1136444702 /nfs/dbraw/zinc/44/47/02/1136444702.db2.gz QFTSAZORRFPJHA-HXUWFJFHSA-N 1 0 340.423 3.855 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585598 1136448571 /nfs/dbraw/zinc/44/85/71/1136448571.db2.gz XLQDYMPCSRELSD-SWLSCSKDSA-N 1 0 349.456 3.649 20 5 EHBDRO CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588695 1136452991 /nfs/dbraw/zinc/45/29/91/1136452991.db2.gz NXTNMRJAGUIMAG-ICSRJNTNSA-N 1 0 342.439 3.890 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000852426870 1136455242 /nfs/dbraw/zinc/45/52/42/1136455242.db2.gz PURCLXDHKAYYCH-AEFFLSMTSA-N 1 0 342.395 3.839 20 5 EHBDRO CC(C)Oc1cccc([C@@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776605495 1136473702 /nfs/dbraw/zinc/47/37/02/1136473702.db2.gz LNEJEFRKJLTJAU-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO CC1(C)C[C@@]1([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000852771738 1136484866 /nfs/dbraw/zinc/48/48/66/1136484866.db2.gz CJUMNAUDOWEHOP-PKOBYXMFSA-N 1 0 326.396 3.543 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000815247651 1136573036 /nfs/dbraw/zinc/57/30/36/1136573036.db2.gz FASYSCSIQFTMDR-CQSZACIVSA-N 1 0 347.242 3.788 20 5 EHBDRO C[C@@H](OCCC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000815554510 1136609920 /nfs/dbraw/zinc/60/99/20/1136609920.db2.gz AXNXQLBBGFINOV-LSDHHAIUSA-N 1 0 343.427 3.996 20 5 EHBDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591953 1136615847 /nfs/dbraw/zinc/61/58/47/1136615847.db2.gz VGTRAOUEDWLBCM-LRDDRELGSA-N 1 0 327.384 3.578 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740096 1136620203 /nfs/dbraw/zinc/62/02/03/1136620203.db2.gz IEXHTURWYJIJHP-VLNFIEOWSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173317013 1136745677 /nfs/dbraw/zinc/74/56/77/1136745677.db2.gz KIVYZPGADGTVRD-HZPDHXFCSA-N 1 0 325.412 3.772 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1COC2(CCCCCC2)O1 ZINC000776958653 1136904444 /nfs/dbraw/zinc/90/44/44/1136904444.db2.gz FACJCYFDVFYDIU-UGAXZCSASA-N 1 0 346.427 3.664 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819196335 1136922291 /nfs/dbraw/zinc/92/22/91/1136922291.db2.gz AARYUUGPHAEKEB-ZNZDAUKMSA-N 1 0 326.396 3.541 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000819328845 1136931913 /nfs/dbraw/zinc/93/19/13/1136931913.db2.gz PIFBMZGEAWDRSV-RTBURBONSA-N 1 0 326.396 3.604 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030875 1136933873 /nfs/dbraw/zinc/93/38/73/1136933873.db2.gz BZNAVAYJTYHFIJ-PBHICJAKSA-N 1 0 327.384 3.513 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858041001 1136934148 /nfs/dbraw/zinc/93/41/48/1136934148.db2.gz QGEJQCXSUFLQPN-WBVHZDCISA-N 1 0 341.411 3.821 20 5 EHBDRO COC(=O)CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000173398704 1136999853 /nfs/dbraw/zinc/99/98/53/1136999853.db2.gz ASSXMSVBOZLZPS-KBXCAEBGSA-N 1 0 342.395 3.940 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2c(cccc2F)n1C)c1cccc([N+](=O)[O-])c1 ZINC000173414341 1137088498 /nfs/dbraw/zinc/08/84/98/1137088498.db2.gz KGBNPHJIYMQEOS-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C ZINC000824287711 1137130710 /nfs/dbraw/zinc/13/07/10/1137130710.db2.gz WOGQWPQWVIXIDB-SSUFTNFISA-N 1 0 349.431 3.501 20 5 EHBDRO CC(=O)c1ccc([C@H](C)Nc2cc3c(cc2[N+](=O)[O-])C[NH2+]C3)cc1 ZINC001171056224 1137138343 /nfs/dbraw/zinc/13/83/43/1137138343.db2.gz LOBQRORQAIRBCL-NSHDSACASA-N 1 0 325.368 3.574 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@]3(CCSC3)C2)ccc1Cl ZINC000825215642 1137169123 /nfs/dbraw/zinc/16/91/23/1137169123.db2.gz UQRYHWTVAUTRPE-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CCSC3)C2)cc1Cl ZINC000825215482 1137169194 /nfs/dbraw/zinc/16/91/94/1137169194.db2.gz PLGIOYFMQGWUKH-OAHLLOKOSA-N 1 0 326.849 3.967 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1 ZINC000863587734 1137192830 /nfs/dbraw/zinc/19/28/30/1137192830.db2.gz SDSDUVPWCZRZAC-IRXDYDNUSA-N 1 0 332.787 3.559 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccc(C)s2)c1 ZINC000844318061 1137212308 /nfs/dbraw/zinc/21/23/08/1137212308.db2.gz LXNHUOZNFMVPGK-NSHDSACASA-N 1 0 334.397 3.602 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc(OCC(F)F)cc2)cc1[N+](=O)[O-] ZINC000865787078 1137311991 /nfs/dbraw/zinc/31/19/91/1137311991.db2.gz GPQWDAZESYVHFM-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)F ZINC000865799917 1137312815 /nfs/dbraw/zinc/31/28/15/1137312815.db2.gz FNUPUSXLAXRHIO-WCQYABFASA-N 1 0 325.359 3.595 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846035344 1137328328 /nfs/dbraw/zinc/32/83/28/1137328328.db2.gz GSQXXGWVKYLMJJ-YVEFUNNKSA-N 1 0 334.803 3.634 20 5 EHBDRO C[C@@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000846215284 1137341896 /nfs/dbraw/zinc/34/18/96/1137341896.db2.gz NQJVBTSHPWNIBV-MWLCHTKSSA-N 1 0 332.231 3.802 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000866278178 1137342097 /nfs/dbraw/zinc/34/20/97/1137342097.db2.gz WHSNQPQCIHHSCV-ABAIWWIYSA-N 1 0 336.363 3.544 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)C[C@H](O)c1ccccc1 ZINC000866288086 1137343118 /nfs/dbraw/zinc/34/31/18/1137343118.db2.gz UCKIRUNZBFNGSQ-TYILLQQXSA-N 1 0 346.402 3.767 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCSCC(F)(F)F ZINC000866312286 1137344398 /nfs/dbraw/zinc/34/43/98/1137344398.db2.gz SBWLTGQMZAEEOD-VIFPVBQESA-N 1 0 340.342 3.550 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCSCC(F)(F)F ZINC000866312285 1137344573 /nfs/dbraw/zinc/34/45/73/1137344573.db2.gz SBWLTGQMZAEEOD-SECBINFHSA-N 1 0 340.342 3.550 20 5 EHBDRO Cc1cccc(CCC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866359265 1137349242 /nfs/dbraw/zinc/34/92/42/1137349242.db2.gz RHIPNEIZWOVZDF-AWEZNQCLSA-N 1 0 331.391 3.591 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000866421158 1137353409 /nfs/dbraw/zinc/35/34/09/1137353409.db2.gz MQEKZGPAYWBGGE-CQSZACIVSA-N 1 0 342.395 3.665 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866480305 1137358110 /nfs/dbraw/zinc/35/81/10/1137358110.db2.gz CCEBFWXTTWYDHX-DYVFJYSZSA-N 1 0 333.432 3.567 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)C1CC1 ZINC000866538570 1137362864 /nfs/dbraw/zinc/36/28/64/1137362864.db2.gz SWCAVXRQTVFMHB-FHWLQOOXSA-N 1 0 344.455 3.568 20 5 EHBDRO COC(=O)c1csc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000866541337 1137363207 /nfs/dbraw/zinc/36/32/07/1137363207.db2.gz YPZPMXKXUUYBMC-LLVKDONJSA-N 1 0 334.397 3.602 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(F)n1 ZINC000773083991 1137463958 /nfs/dbraw/zinc/46/39/58/1137463958.db2.gz AFYYZBHGYAPUHY-GFCCVEGCSA-N 1 0 335.404 3.789 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccncc1[N+](=O)[O-])c1ccccc1Cl ZINC001649159666 1137479200 /nfs/dbraw/zinc/47/92/00/1137479200.db2.gz NFZPOHZEUCKNRJ-INIZCTEOSA-N 1 0 348.834 3.560 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc(CO)c1 ZINC000872033782 1137566580 /nfs/dbraw/zinc/56/65/80/1137566580.db2.gz JKQXQQRLLKURPD-LBPRGKRZSA-N 1 0 332.425 3.660 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1ccc(C)o1 ZINC000872038446 1137566966 /nfs/dbraw/zinc/56/69/66/1137566966.db2.gz NQLHLVJMWZTTFF-BXUZGUMPSA-N 1 0 336.413 3.602 20 5 EHBDRO CCC[C@H](CCO)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041139 1137567125 /nfs/dbraw/zinc/56/71/25/1137567125.db2.gz QCKBXVNUMWQVRY-CHWSQXEVSA-N 1 0 326.462 3.766 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872046287 1137567556 /nfs/dbraw/zinc/56/75/56/1137567556.db2.gz WDSIRNRBANZDAJ-SJCJKPOMSA-N 1 0 330.359 3.699 20 5 EHBDRO C[C@@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086666 1137570557 /nfs/dbraw/zinc/57/05/57/1137570557.db2.gz BNHWWAMYWLCMDV-UKRRQHHQSA-N 1 0 335.423 3.507 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncc(Cl)s1 ZINC000872115431 1137572206 /nfs/dbraw/zinc/57/22/06/1137572206.db2.gz KPUFZCIIECQMJH-SNVBAGLBSA-N 1 0 325.821 3.816 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncc(Cl)s1 ZINC000872115429 1137572217 /nfs/dbraw/zinc/57/22/17/1137572217.db2.gz KPUFZCIIECQMJH-JTQLQIEISA-N 1 0 325.821 3.816 20 5 EHBDRO COC(=O)CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000873045423 1137588823 /nfs/dbraw/zinc/58/88/23/1137588823.db2.gz DYSTXUQWTQIVKX-KRWDZBQOSA-N 1 0 342.395 3.687 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])ccc1OC ZINC000873183932 1137592965 /nfs/dbraw/zinc/59/29/65/1137592965.db2.gz RHEGLQHGLWONKD-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc(OC[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000876986858 1137666925 /nfs/dbraw/zinc/66/69/25/1137666925.db2.gz LZNUSYRCGFFULH-CYBMUJFWSA-N 1 0 341.367 3.602 20 5 EHBDRO Cc1ccc(OC[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000876986859 1137667071 /nfs/dbraw/zinc/66/70/71/1137667071.db2.gz LZNUSYRCGFFULH-ZDUSSCGKSA-N 1 0 341.367 3.602 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C1CC1 ZINC000877029090 1137667962 /nfs/dbraw/zinc/66/79/62/1137667962.db2.gz QFSQESOISKECBL-JTTJXQCZSA-N 1 0 326.400 3.544 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH+]1CCC(CCCO)CC1 ZINC000877194191 1137672644 /nfs/dbraw/zinc/67/26/44/1137672644.db2.gz CUGNXCRUXQDQDK-UHFFFAOYSA-N 1 0 346.349 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000877399190 1137675300 /nfs/dbraw/zinc/67/53/00/1137675300.db2.gz LSGHKIAYAUQZBO-HXUWFJFHSA-N 1 0 338.407 3.843 20 5 EHBDRO CSc1ccccc1[C@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877498294 1137678686 /nfs/dbraw/zinc/67/86/86/1137678686.db2.gz AVJQXBFBQLACKK-HIFPTAJRSA-N 1 0 332.429 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cccc3c2CCOC3)cc1Cl ZINC000877697282 1137686177 /nfs/dbraw/zinc/68/61/77/1137686177.db2.gz DUKDXOWNJQFGPI-UHFFFAOYSA-N 1 0 332.787 3.611 20 5 EHBDRO CC(C)(O)C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000877754041 1137687870 /nfs/dbraw/zinc/68/78/70/1137687870.db2.gz SGMAPHJIFYPVAF-UHFFFAOYSA-N 1 0 344.411 3.838 20 5 EHBDRO CCC[NH+](CCC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877961439 1137697295 /nfs/dbraw/zinc/69/72/95/1137697295.db2.gz PFOUBCHHTSYWHO-UHFFFAOYSA-N 1 0 338.795 3.920 20 5 EHBDRO CC(C)CC[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000877966798 1137697400 /nfs/dbraw/zinc/69/74/00/1137697400.db2.gz WHFVKPKJQJZPDS-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135256 1137704034 /nfs/dbraw/zinc/70/40/34/1137704034.db2.gz VXWHCXYCNFINFV-UMVBOHGHSA-N 1 0 342.399 3.798 20 5 EHBDRO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCOC1 ZINC000880469366 1137779562 /nfs/dbraw/zinc/77/95/62/1137779562.db2.gz KEDDAQTURDFCBJ-YOEHRIQHSA-N 1 0 345.399 3.545 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCc1ccns1 ZINC000883247949 1137850444 /nfs/dbraw/zinc/85/04/44/1137850444.db2.gz CFSGKFRWJPNAGA-CZUORRHYSA-N 1 0 331.441 3.595 20 5 EHBDRO O=[N+]([O-])c1cnc(NC2CC([NH+]3CCCCC3)C2)c2ccccc21 ZINC000884494170 1137961342 /nfs/dbraw/zinc/96/13/42/1137961342.db2.gz LZLLSQLIJZRQPK-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000884718558 1137970972 /nfs/dbraw/zinc/97/09/72/1137970972.db2.gz ITOJYDCUPKSWLK-UHFFFAOYSA-N 1 0 346.456 3.659 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000075866241 1138129161 /nfs/dbraw/zinc/12/91/61/1138129161.db2.gz QUJKZRWZOPFAAZ-QGZVFWFLSA-N 1 0 326.396 3.634 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@@H]2C)O1)c1cccc([N+](=O)[O-])c1 ZINC000886771907 1138137503 /nfs/dbraw/zinc/13/75/03/1138137503.db2.gz PSKYXSHSYBZREI-AQQQZIQISA-N 1 0 348.443 3.608 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@]1(C)CCOC2(CCC2)C1 ZINC000886776449 1138138869 /nfs/dbraw/zinc/13/88/69/1138138869.db2.gz GOTQTPHKZQGABP-KDOFPFPSSA-N 1 0 348.443 3.993 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765528 1138294319 /nfs/dbraw/zinc/29/43/19/1138294319.db2.gz MJVFNPVQPBLENV-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000130521538 1138460043 /nfs/dbraw/zinc/46/00/43/1138460043.db2.gz BEWGPCRDPQMALN-KYJSFNMBSA-N 1 0 332.444 3.711 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000132354978 1138575654 /nfs/dbraw/zinc/57/56/54/1138575654.db2.gz BLWKPADTXHMXLK-UHFFFAOYSA-N 1 0 333.413 3.507 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750007 1139151071 /nfs/dbraw/zinc/15/10/71/1139151071.db2.gz GQFIYOVMVJDOFD-KSSFIOAISA-N 1 0 344.411 3.686 20 5 EHBDRO CC[C@@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000173931719 1139387776 /nfs/dbraw/zinc/38/77/76/1139387776.db2.gz MNWMVYIPUBFKRR-OAHLLOKOSA-N 1 0 347.440 3.620 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000177304706 1139611562 /nfs/dbraw/zinc/61/15/62/1139611562.db2.gz AEVXOMCQNWVKQX-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177882038 1139650513 /nfs/dbraw/zinc/65/05/13/1139650513.db2.gz JFNWUTCNRIJLGJ-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO CNC(=O)C1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000179824042 1139786372 /nfs/dbraw/zinc/78/63/72/1139786372.db2.gz KKSNDGKDBQYITJ-UHFFFAOYSA-N 1 0 332.447 3.951 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H](C)c1ccccc1 ZINC000181358185 1139901490 /nfs/dbraw/zinc/90/14/90/1139901490.db2.gz QQPSDHNIIJXLIK-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004552 1139945066 /nfs/dbraw/zinc/94/50/66/1139945066.db2.gz LVMMPFBQSBWWDZ-STQMWFEESA-N 1 0 327.384 3.965 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1O ZINC000182840913 1139995943 /nfs/dbraw/zinc/99/59/43/1139995943.db2.gz JTQUKYLVEKBBKB-CYBMUJFWSA-N 1 0 330.384 3.810 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2csc([N+](=O)[O-])c2)cc1 ZINC000190532942 1140408604 /nfs/dbraw/zinc/40/86/04/1140408604.db2.gz FYQTWYOVJILRTO-UHFFFAOYSA-N 1 0 333.413 3.750 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000191266978 1140449624 /nfs/dbraw/zinc/44/96/24/1140449624.db2.gz DBIYJCAFZASNQB-CYBMUJFWSA-N 1 0 330.432 3.748 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483079 1140466221 /nfs/dbraw/zinc/46/62/21/1140466221.db2.gz ZHUVLNUQVZBHRJ-HNNXBMFYSA-N 1 0 330.432 3.827 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192460158 1140534339 /nfs/dbraw/zinc/53/43/39/1140534339.db2.gz BFEMBQSIUVIRLB-HIFRSBDPSA-N 1 0 346.456 3.541 20 5 EHBDRO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813210 1140725831 /nfs/dbraw/zinc/72/58/31/1140725831.db2.gz WTCNAEHHAMCVKG-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](O)c1cccc(F)c1 ZINC000267252566 1140772249 /nfs/dbraw/zinc/77/22/49/1140772249.db2.gz ZSSGJPFCSOWWBK-QFYYESIMSA-N 1 0 338.766 3.599 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000267361075 1140782467 /nfs/dbraw/zinc/78/24/67/1140782467.db2.gz IGARZAJOZRCDQQ-RDJZCZTQSA-N 1 0 348.443 3.706 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)c2sccc2C[NH+](C)C)cc1[N+](=O)[O-] ZINC000268183602 1140898610 /nfs/dbraw/zinc/89/86/10/1140898610.db2.gz WLCOKEDRDUBHEE-LBPRGKRZSA-N 1 0 347.440 3.517 20 5 EHBDRO CCc1nc2c(s1)[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC000268856414 1141009520 /nfs/dbraw/zinc/00/95/20/1141009520.db2.gz URUGIYVVPVTZDV-GFCCVEGCSA-N 1 0 347.440 3.790 20 5 EHBDRO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000270602494 1141244040 /nfs/dbraw/zinc/24/40/40/1141244040.db2.gz FXZIRXJVUHLMSG-VBHSOAQHSA-N 1 0 332.375 3.897 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C1CCOCC1 ZINC000271167030 1141316985 /nfs/dbraw/zinc/31/69/85/1141316985.db2.gz SWPQOAPNEPCVSP-UKRRQHHQSA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CCOC2(CCC2)C1)C1CC1 ZINC000271450925 1141370106 /nfs/dbraw/zinc/37/01/06/1141370106.db2.gz DOOFBAJWBPHQJA-SJORKVTESA-N 1 0 330.428 3.607 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1ccc(Br)s1 ZINC000037991390 202383716 /nfs/dbraw/zinc/38/37/16/202383716.db2.gz ADWNDAXHJMVWDK-UHFFFAOYSA-N 1 0 327.203 3.709 20 5 EHBDRO C[NH+](C)CC1CCN(c2ccc3c(ccc(Cl)c3[N+](=O)[O-])n2)CC1 ZINC001165041541 721946287 /nfs/dbraw/zinc/94/62/87/721946287.db2.gz CILRRPKQMYEPDW-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CCOCC1 ZINC000536650253 1032061087 /nfs/dbraw/zinc/06/10/87/1032061087.db2.gz WHLZEFJJAILISP-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537967068 1032070289 /nfs/dbraw/zinc/07/02/89/1032070289.db2.gz RXQPZTJLBCHVHJ-IBGZPJMESA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000339503482 1014600785 /nfs/dbraw/zinc/60/07/85/1014600785.db2.gz BRMDSBXTLIXBTL-JNLAVLDNSA-N 1 0 344.436 3.696 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[N@H+](C)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000536685877 1032126528 /nfs/dbraw/zinc/12/65/28/1032126528.db2.gz PANAJXLVEYRENI-UHFFFAOYSA-N 1 0 343.427 3.565 20 5 EHBDRO Cc1c(NC(=O)NCCCCC[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000609552353 1015778461 /nfs/dbraw/zinc/77/84/61/1015778461.db2.gz QGMMSAWAWJSQDG-UHFFFAOYSA-N 1 0 348.447 3.681 20 5 EHBDRO C[NH2+]Cc1cn(-c2cnc3ccc([N+](=O)[O-])cc3n2)c2ccc(C)cc12 ZINC001167120893 1016148872 /nfs/dbraw/zinc/14/88/72/1016148872.db2.gz CYEFEYJAENCNFT-UHFFFAOYSA-N 1 0 347.378 3.510 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000060208940 1016270573 /nfs/dbraw/zinc/27/05/73/1016270573.db2.gz RIAJUFOFEIOLTR-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1OC(F)F ZINC000449068961 1032155713 /nfs/dbraw/zinc/15/57/13/1032155713.db2.gz DEWDERLDPVDZQU-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO Cc1cnc(Nc2cccc(CC[N@@H+](C)C3CC3)c2)c([N+](=O)[O-])c1 ZINC000538138211 1032160492 /nfs/dbraw/zinc/16/04/92/1032160492.db2.gz NBIKAHOEOXBDPO-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000449103135 1032182023 /nfs/dbraw/zinc/18/20/23/1032182023.db2.gz OTHNFGVLXHSNIT-NSHDSACASA-N 1 0 336.338 3.775 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000449108043 1032188661 /nfs/dbraw/zinc/18/86/61/1032188661.db2.gz SAVWBDGMGFOZQC-CRAIPNDOSA-N 1 0 345.443 3.792 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000449094278 1032201061 /nfs/dbraw/zinc/20/10/61/1032201061.db2.gz YTIIOEPWTHGLDB-IFXJQAMLSA-N 1 0 345.418 3.557 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000538198637 1032213468 /nfs/dbraw/zinc/21/34/68/1032213468.db2.gz RNHZBLYSZYJBIB-CHWSQXEVSA-N 1 0 339.395 3.891 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000449120979 1032214251 /nfs/dbraw/zinc/21/42/51/1032214251.db2.gz GGYISJAGEGNGPO-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000461090187 1032246379 /nfs/dbraw/zinc/24/63/79/1032246379.db2.gz RZTUJVKREQTYDO-LSDHHAIUSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609981 1032326847 /nfs/dbraw/zinc/32/68/47/1032326847.db2.gz KAEMWYLJRDKTIT-YVEFUNNKSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)(C)C ZINC000538389972 1032334209 /nfs/dbraw/zinc/33/42/09/1032334209.db2.gz MQUCVIYYIVLOCV-ZDUSSCGKSA-N 1 0 327.812 3.601 20 5 EHBDRO COCC[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000449228048 1032345781 /nfs/dbraw/zinc/34/57/81/1032345781.db2.gz RSRNOMNZSPFIKB-BBRMVZONSA-N 1 0 332.400 3.795 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000536857606 1032354541 /nfs/dbraw/zinc/35/45/41/1032354541.db2.gz JAGPHNWIGRDAHU-GOSISDBHSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000573219729 1032362146 /nfs/dbraw/zinc/36/21/46/1032362146.db2.gz LOPHAFCHTRRRNZ-JKSUJKDBSA-N 1 0 328.343 3.835 20 5 EHBDRO Cn1cc([C@@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430308 1032359527 /nfs/dbraw/zinc/35/95/27/1032359527.db2.gz VALJVPTZZLATLY-UGAXZCSASA-N 1 0 328.416 3.719 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000449255157 1032362364 /nfs/dbraw/zinc/36/23/64/1032362364.db2.gz BDWNSQDVTRHRKJ-ZDUSSCGKSA-N 1 0 347.415 3.619 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccsc1 ZINC000026719935 1032395716 /nfs/dbraw/zinc/39/57/16/1032395716.db2.gz GDYWCKPMMAWQAH-INIZCTEOSA-N 1 0 342.424 3.919 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000449350546 1032465761 /nfs/dbraw/zinc/46/57/61/1032465761.db2.gz MGCDZHJPSILCHL-INIZCTEOSA-N 1 0 330.359 3.910 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115607 1032526790 /nfs/dbraw/zinc/52/67/90/1032526790.db2.gz JJLYBMYQDDQGJM-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccccc1C1([NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])CCC1 ZINC000593039626 1032676646 /nfs/dbraw/zinc/67/66/46/1032676646.db2.gz NLOPHTMFALCNDD-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CCOc1cncc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000598637237 1017162082 /nfs/dbraw/zinc/16/20/82/1017162082.db2.gz GGIRVJPSUPZMCY-UHFFFAOYSA-N 1 0 329.400 3.501 20 5 EHBDRO CC[C@@H]1C[C@@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503965 1032686390 /nfs/dbraw/zinc/68/63/90/1032686390.db2.gz VGLPYUHZRPUFTF-KVSKMBFKSA-N 1 0 332.444 3.979 20 5 EHBDRO N[C@H](C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842981 1017231823 /nfs/dbraw/zinc/23/18/23/1017231823.db2.gz ZXVIWHXCRVTCEP-QXAKKESOSA-N 1 0 339.439 3.596 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cc(N)ccc2O1 ZINC000415025404 1017414059 /nfs/dbraw/zinc/41/40/59/1017414059.db2.gz PVYVPJOONQOXFT-MRXNPFEDSA-N 1 0 327.384 3.569 20 5 EHBDRO CC1(C)[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415050480 1017460305 /nfs/dbraw/zinc/46/03/05/1017460305.db2.gz YVTDKXMIPKDUCL-MRXNPFEDSA-N 1 0 349.818 3.738 20 5 EHBDRO Cc1cccc(C)c1[C@H](C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000544897161 1017531015 /nfs/dbraw/zinc/53/10/15/1017531015.db2.gz ANNAXRKIWNITNZ-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO COC(=O)[C@H](C)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000177415261 1017665833 /nfs/dbraw/zinc/66/58/33/1017665833.db2.gz DAZLGBNQFLQYAC-RDTXWAMCSA-N 1 0 342.395 3.543 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000177471532 1017678660 /nfs/dbraw/zinc/67/86/60/1017678660.db2.gz QYEKMNVOBFFATJ-KFWWJZLASA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1C[C@H]2CCCC[C@@H]2C1 ZINC000177575819 1017693007 /nfs/dbraw/zinc/69/30/07/1017693007.db2.gz HONQGCBRCMILFQ-BPLDGKMQSA-N 1 0 342.399 3.828 20 5 EHBDRO CC(C)[C@H](CO)[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000118846846 1017965268 /nfs/dbraw/zinc/96/52/68/1017965268.db2.gz SAFLQSGDAWYJIE-INIZCTEOSA-N 1 0 334.441 3.675 20 5 EHBDRO CC[C@](C)([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1 ZINC000892972294 1018009936 /nfs/dbraw/zinc/00/99/36/1018009936.db2.gz IPYHIMDEGRRNFV-SFHVURJKSA-N 1 0 330.384 3.724 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)O ZINC000449545699 1032737286 /nfs/dbraw/zinc/73/72/86/1032737286.db2.gz UCLODQUDXLHCEM-MLGOLLRUSA-N 1 0 348.374 3.775 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](CCO)c1ccccc1 ZINC000122709743 1018570647 /nfs/dbraw/zinc/57/06/47/1018570647.db2.gz QNYMJPRYRJEXMZ-INIZCTEOSA-N 1 0 334.803 3.804 20 5 EHBDRO C[N@H+](CCC(=O)NC(C)(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000548061793 1018637932 /nfs/dbraw/zinc/63/79/32/1018637932.db2.gz XTCWYXDYUMQNCL-UHFFFAOYSA-N 1 0 347.459 3.601 20 5 EHBDRO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])nc1 ZINC000398038050 1018957037 /nfs/dbraw/zinc/95/70/37/1018957037.db2.gz QQMKBLFHUZSJRT-KRWDZBQOSA-N 1 0 328.416 3.558 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000025447889 1018981502 /nfs/dbraw/zinc/98/15/02/1018981502.db2.gz QWVVMFCSNMGONE-ZDUSSCGKSA-N 1 0 330.384 3.805 20 5 EHBDRO C[C@H]1[C@@H](C)[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000419379862 1019009539 /nfs/dbraw/zinc/00/95/39/1019009539.db2.gz XEZWWNMHLYQYCG-MGPQQGTHSA-N 1 0 329.400 3.769 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513656616 1019910667 /nfs/dbraw/zinc/91/06/67/1019910667.db2.gz VZGXZHWDAGMXPE-QGZVFWFLSA-N 1 0 328.416 3.588 20 5 EHBDRO CCC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)COC1 ZINC000449596480 1032866285 /nfs/dbraw/zinc/86/62/85/1032866285.db2.gz BGVOCIOXGDMOHR-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000177965155 1020648514 /nfs/dbraw/zinc/64/85/14/1020648514.db2.gz IXCQRQJIOAEEMN-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000602521153 1032932899 /nfs/dbraw/zinc/93/28/99/1032932899.db2.gz NCXVDWNKWUUPAC-UYAOXDASSA-N 1 0 340.423 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(-n2ccnc2)cc1)C1CC1 ZINC000135221162 1020904033 /nfs/dbraw/zinc/90/40/33/1020904033.db2.gz PXVVHIZDQGODPG-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO Cc1nc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cs1 ZINC000602510717 1032947782 /nfs/dbraw/zinc/94/77/82/1032947782.db2.gz MGYYWJIHVAQVCS-UHFFFAOYSA-N 1 0 345.346 3.711 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000507430730 1021262482 /nfs/dbraw/zinc/26/24/82/1021262482.db2.gz UILNLJHBDMYBEA-CWLKWCNXSA-N 1 0 332.444 3.711 20 5 EHBDRO CC(C)CC(C)(C)C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602571237 1032980852 /nfs/dbraw/zinc/98/08/52/1032980852.db2.gz GJRXSEQGPGAUCX-UHFFFAOYSA-N 1 0 334.464 3.621 20 5 EHBDRO CC[C@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000602804758 1021457639 /nfs/dbraw/zinc/45/76/39/1021457639.db2.gz JURGVHNOUWPYIG-JTQLQIEISA-N 1 0 328.825 3.556 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(N(C)C)CCC1 ZINC000437090978 1021543622 /nfs/dbraw/zinc/54/36/22/1021543622.db2.gz BVKSBEQBIGBGDR-AWEZNQCLSA-N 1 0 337.489 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH2+]C2([C@@H]3CCCCO3)CC2)c1 ZINC000933375682 1021561446 /nfs/dbraw/zinc/56/14/46/1021561446.db2.gz MFSLYEWPJOWNCD-AWEZNQCLSA-N 1 0 344.333 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)c(Cl)c1 ZINC000519673839 1021601925 /nfs/dbraw/zinc/60/19/25/1021601925.db2.gz WWWYECZGVHFEKA-BMFZPTHFSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H]4CCC[C@H]43)o2)c1 ZINC000426485343 1021689426 /nfs/dbraw/zinc/68/94/26/1021689426.db2.gz JDJHGYABTPFXGD-XJKSGUPXSA-N 1 0 327.384 3.667 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090918661 1021692319 /nfs/dbraw/zinc/69/23/19/1021692319.db2.gz UHPOGEPOMNHETI-INIZCTEOSA-N 1 0 346.456 3.761 20 5 EHBDRO Cc1cccc(N2CCC[N@H+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000302491778 1021795183 /nfs/dbraw/zinc/79/51/83/1021795183.db2.gz KGRXHLSBPIDAJM-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000140487316 1021799358 /nfs/dbraw/zinc/79/93/58/1021799358.db2.gz DXPFMKTYUFRFKS-LBPRGKRZSA-N 1 0 344.358 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@](O)(C3CC3)C2)s1 ZINC000426524796 1021810424 /nfs/dbraw/zinc/81/04/24/1021810424.db2.gz PNBDIWNELVQKLY-SFHVURJKSA-N 1 0 344.436 3.670 20 5 EHBDRO CCC[N@H+](CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506772757 1021973544 /nfs/dbraw/zinc/97/35/44/1021973544.db2.gz PMTBVMIWGJOXMR-UHFFFAOYSA-N 1 0 348.374 3.731 20 5 EHBDRO CCC1(CC)CC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438503416 1022100733 /nfs/dbraw/zinc/10/07/33/1022100733.db2.gz RGVKVCOPTSZAPD-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000129490945 1022135687 /nfs/dbraw/zinc/13/56/87/1022135687.db2.gz PWACQEYRPMZILO-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CCC[N@H+](CCc1cccs1)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000184511717 1022426102 /nfs/dbraw/zinc/42/61/02/1022426102.db2.gz ISRUJUMMJMMZBS-UHFFFAOYSA-N 1 0 347.440 3.550 20 5 EHBDRO CCC[C@@]1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000550095653 1022427633 /nfs/dbraw/zinc/42/76/33/1022427633.db2.gz ACDVMZOGDONQIX-CQSZACIVSA-N 1 0 332.322 3.662 20 5 EHBDRO COc1ccc(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000438340972 1022580541 /nfs/dbraw/zinc/58/05/41/1022580541.db2.gz YWHRVRQPEJQKAM-UHFFFAOYSA-N 1 0 332.375 3.853 20 5 EHBDRO C[N@H+](CCc1ccccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000120809030 1022644413 /nfs/dbraw/zinc/64/44/13/1022644413.db2.gz UDOPKGZCQWKBBI-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC3(C2)CCCCC3)c([N+](=O)[O-])c1 ZINC000441434239 1022650435 /nfs/dbraw/zinc/65/04/35/1022650435.db2.gz BEQAYZRVYXEOJT-UHFFFAOYSA-N 1 0 334.416 3.638 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1([NH+](C)C)CCC1 ZINC000438472064 1022684410 /nfs/dbraw/zinc/68/44/10/1022684410.db2.gz WFBVKCDFJXGRBU-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000430821235 1022723809 /nfs/dbraw/zinc/72/38/09/1022723809.db2.gz HVVNMSOFCHQJPE-DOTOQJQBSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]2c2ccccn2)cc1 ZINC000610582240 1022794989 /nfs/dbraw/zinc/79/49/89/1022794989.db2.gz PQYHFEPPXLQIFY-GOSISDBHSA-N 1 0 327.384 3.596 20 5 EHBDRO COc1ccc(OCC[N@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441486310 1023194955 /nfs/dbraw/zinc/19/49/55/1023194955.db2.gz DZMDKTHHIGCLLC-HNNXBMFYSA-N 1 0 344.411 3.718 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475576 1023239506 /nfs/dbraw/zinc/23/95/06/1023239506.db2.gz XZOSWXDIZVTYQY-HZPDHXFCSA-N 1 0 349.450 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CCSC3)C2)c(Cl)c1 ZINC000449733931 1033126751 /nfs/dbraw/zinc/12/67/51/1033126751.db2.gz QMRKNTXXVRCHPC-OAHLLOKOSA-N 1 0 326.849 3.967 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1ccc(C(C)(C)C)cc1 ZINC000610782541 1023506877 /nfs/dbraw/zinc/50/68/77/1023506877.db2.gz QOKZOISHPRZXTC-UHFFFAOYSA-N 1 0 330.432 3.529 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccncc1 ZINC000610830989 1023781471 /nfs/dbraw/zinc/78/14/71/1023781471.db2.gz YZCPGTWOHQOATF-KSSFIOAISA-N 1 0 325.412 3.704 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)c1 ZINC000458289351 1023852166 /nfs/dbraw/zinc/85/21/66/1023852166.db2.gz QIHIOGJTFBNPBT-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1cccc(Cl)c1Cl ZINC000602803769 1033174985 /nfs/dbraw/zinc/17/49/85/1033174985.db2.gz DJXZDOYCAFDMRO-VIFPVBQESA-N 1 0 343.214 3.757 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288626 1024011718 /nfs/dbraw/zinc/01/17/18/1024011718.db2.gz YEGPFBVVNKFQJR-STQMWFEESA-N 1 0 336.823 3.569 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529663 1024039339 /nfs/dbraw/zinc/03/93/39/1024039339.db2.gz AHCIWVCVONQCCL-XHSDSOJGSA-N 1 0 347.459 3.673 20 5 EHBDRO C[N@H+](CCOc1ccccc1Cl)CCc1ccc([N+](=O)[O-])cc1 ZINC000522268256 1024128366 /nfs/dbraw/zinc/12/83/66/1024128366.db2.gz AGTPYNRIRYKJGQ-UHFFFAOYSA-N 1 0 334.803 3.802 20 5 EHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500305 1024242466 /nfs/dbraw/zinc/24/24/66/1024242466.db2.gz SMICETROQZKRJV-MFKMUULPSA-N 1 0 327.222 3.978 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488091 1024398512 /nfs/dbraw/zinc/39/85/12/1024398512.db2.gz OGJSXJXIYMCCTE-UGSOOPFHSA-N 1 0 332.375 3.908 20 5 EHBDRO COCC[N@H+](C)CC[C@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000505585139 1024547738 /nfs/dbraw/zinc/54/77/38/1024547738.db2.gz LJTSTDVQPSBZJL-IBGZPJMESA-N 1 0 343.427 3.716 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538878482 1024571108 /nfs/dbraw/zinc/57/11/08/1024571108.db2.gz ZIZISWLAUDTMMQ-SCLBCKFNSA-N 1 0 332.375 3.908 20 5 EHBDRO O=[N+]([O-])c1cnccc1S[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000425281078 1024623655 /nfs/dbraw/zinc/62/36/55/1024623655.db2.gz LGDSEZZBYMTZSW-OAHLLOKOSA-N 1 0 329.425 3.747 20 5 EHBDRO Cc1c(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235676 1024625905 /nfs/dbraw/zinc/62/59/05/1024625905.db2.gz DIAFLKZVIUYGRT-IBGZPJMESA-N 1 0 339.439 3.610 20 5 EHBDRO COc1ccccc1C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000065535504 1024632284 /nfs/dbraw/zinc/63/22/84/1024632284.db2.gz UEJXZTOVQWIPPG-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)c(F)c1 ZINC000326792087 1024654426 /nfs/dbraw/zinc/65/44/26/1024654426.db2.gz XTQLEUGSPOEJPM-KBAYOESNSA-N 1 0 336.407 3.640 20 5 EHBDRO CC(C)CCOCC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000441813133 1024733836 /nfs/dbraw/zinc/73/38/36/1024733836.db2.gz LMRJOZMMJVULIQ-UHFFFAOYSA-N 1 0 336.432 3.501 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000895827221 1024864300 /nfs/dbraw/zinc/86/43/00/1024864300.db2.gz HPTSUQYWAVQEPP-YVMONPNESA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1c(C[NH2+]Cc2cc(Cl)cc3c2OCC3)cccc1[N+](=O)[O-] ZINC000323082992 1024879241 /nfs/dbraw/zinc/87/92/41/1024879241.db2.gz UXJCZTFYZUJABL-UHFFFAOYSA-N 1 0 332.787 3.781 20 5 EHBDRO COc1cc(NCCCCC[NH+]2CCCCC2)c(F)cc1[N+](=O)[O-] ZINC000508229133 1024975621 /nfs/dbraw/zinc/97/56/21/1024975621.db2.gz BDBQQHGPFWAQOS-UHFFFAOYSA-N 1 0 339.411 3.811 20 5 EHBDRO C[C@@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000119751418 1025105982 /nfs/dbraw/zinc/10/59/82/1025105982.db2.gz RRUSPUSPTJUWBB-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1ccc(CN2CCC[N@H+](Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000435767557 1025129222 /nfs/dbraw/zinc/12/92/22/1025129222.db2.gz IUVXUUIFUSKBBF-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCOc1ccccc1C ZINC000520959622 1025133606 /nfs/dbraw/zinc/13/36/06/1025133606.db2.gz XKCIHXNUDJXSCC-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO C[NH+](C)C[C@H]1CCCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892173109 1025188148 /nfs/dbraw/zinc/18/81/48/1025188148.db2.gz SOSKVECEFCEJCK-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO CSC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000602922232 1033269561 /nfs/dbraw/zinc/26/95/61/1033269561.db2.gz DQJCAHYTPVLLLN-NSHDSACASA-N 1 0 348.428 3.533 20 5 EHBDRO CC1([NH+]2CCC2)CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000896255892 1025287971 /nfs/dbraw/zinc/28/79/71/1025287971.db2.gz ARHRADFHNNRDGB-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237383617 1025325425 /nfs/dbraw/zinc/32/54/25/1025325425.db2.gz JBBUPGYHQQDVBY-ZBFHGGJFSA-N 1 0 342.443 3.911 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000346933792 1025326454 /nfs/dbraw/zinc/32/64/54/1025326454.db2.gz CHCUDDXEEFWGOF-MSOLQXFVSA-N 1 0 348.830 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 ZINC000521372295 1025347927 /nfs/dbraw/zinc/34/79/27/1025347927.db2.gz GTBHNPMEKVBPHV-CQSZACIVSA-N 1 0 347.365 3.950 20 5 EHBDRO COC(=O)[C@@H](CC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461755 1025367402 /nfs/dbraw/zinc/36/74/02/1025367402.db2.gz SJOQELMWSYLMHX-PBHICJAKSA-N 1 0 342.395 3.592 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000521479313 1025403375 /nfs/dbraw/zinc/40/33/75/1025403375.db2.gz QCWVQGOVDWEYIO-IBGZPJMESA-N 1 0 342.395 3.819 20 5 EHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606531 1025456087 /nfs/dbraw/zinc/45/60/87/1025456087.db2.gz CLJFPMMCJQSLOL-CZUORRHYSA-N 1 0 329.400 3.913 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240797 1025489334 /nfs/dbraw/zinc/48/93/34/1025489334.db2.gz RFGPMOAFHOPEDG-GXTWGEPZSA-N 1 0 333.432 3.741 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000896509252 1025491880 /nfs/dbraw/zinc/49/18/80/1025491880.db2.gz CHINNEXXDQPNQW-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@@H]1[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000310399063 1025494671 /nfs/dbraw/zinc/49/46/71/1025494671.db2.gz UBVDILRTWNRYBB-MLGOLLRUSA-N 1 0 346.818 3.718 20 5 EHBDRO CC(C)[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000436273375 1025541457 /nfs/dbraw/zinc/54/14/57/1025541457.db2.gz JXJWAFHVPGCADZ-LBPRGKRZSA-N 1 0 346.353 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC[C@@H]3CCC(F)(F)C3)nc2c1 ZINC000898013714 1033289592 /nfs/dbraw/zinc/28/95/92/1033289592.db2.gz GQLFJHIMHGRHNK-JTQLQIEISA-N 1 0 325.315 3.651 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000451159942 1025620839 /nfs/dbraw/zinc/62/08/39/1025620839.db2.gz CSEPYGALJTUICJ-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478234 1025658843 /nfs/dbraw/zinc/65/88/43/1025658843.db2.gz HEEKVOKEPUDIPW-JSGCOSHPSA-N 1 0 330.388 3.655 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213765 1025682877 /nfs/dbraw/zinc/68/28/77/1025682877.db2.gz WFIMYFNFGPIAOV-KDOFPFPSSA-N 1 0 341.411 3.972 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000451354535 1025859977 /nfs/dbraw/zinc/85/99/77/1025859977.db2.gz RZDMZDBNCRMFSJ-WLWJZTKJSA-N 1 0 332.444 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCC12CCCC2 ZINC000451456908 1026001467 /nfs/dbraw/zinc/00/14/67/1026001467.db2.gz MEJSDTJQMWJBKF-MRXNPFEDSA-N 1 0 331.416 3.544 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(N2CCCC2)n1 ZINC000611591854 1026014181 /nfs/dbraw/zinc/01/41/81/1026014181.db2.gz NQOSKKXVEIQTGA-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO C[C@H](c1ccc(Cl)c(Cl)c1)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478417554 1026096981 /nfs/dbraw/zinc/09/69/81/1026096981.db2.gz NTJAGIRNARRXBM-SNVBAGLBSA-N 1 0 343.214 3.791 20 5 EHBDRO COc1ccc2c(c1)CN([C@@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000451641541 1026197520 /nfs/dbraw/zinc/19/75/20/1026197520.db2.gz IHZRYBABSDRSAS-ZDUSSCGKSA-N 1 0 328.368 3.559 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@H](C)C1 ZINC000452066903 1026461420 /nfs/dbraw/zinc/46/14/20/1026461420.db2.gz LTMLYUNZGAWWTE-YDHLFZDLSA-N 1 0 344.415 3.949 20 5 EHBDRO COCCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000475335354 1026488026 /nfs/dbraw/zinc/48/80/26/1026488026.db2.gz RDMJZHQXYSOBNL-QGZVFWFLSA-N 1 0 346.402 3.861 20 5 EHBDRO CCC(=O)c1ccc(NC2CC[NH+](C(C)(C)C)CC2)c([N+](=O)[O-])c1 ZINC000479378693 1026619526 /nfs/dbraw/zinc/61/95/26/1026619526.db2.gz PKFZRKWZDOHCPC-UHFFFAOYSA-N 1 0 333.432 3.862 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+][C@@H]1CCCCC[C@H]1O ZINC000562108026 1026780566 /nfs/dbraw/zinc/78/05/66/1026780566.db2.gz PHVQNAGBQHAVJW-NOCIGQNYSA-N 1 0 332.444 3.589 20 5 EHBDRO Cc1cccc([C@H]2CCCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000472239341 1026888947 /nfs/dbraw/zinc/88/89/47/1026888947.db2.gz IHTKVTNXNINRMI-GOSISDBHSA-N 1 0 328.416 3.717 20 5 EHBDRO COc1ccc(C[N@@H+]2CCSC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000531429791 1026904104 /nfs/dbraw/zinc/90/41/04/1026904104.db2.gz RGNANPQTTAVXKE-UHFFFAOYSA-N 1 0 336.457 3.855 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000248745996 1027035674 /nfs/dbraw/zinc/03/56/74/1027035674.db2.gz FLPBSXYHGHUNQB-WBHUJUFNSA-N 1 0 334.416 3.602 20 5 EHBDRO CN(C)[C@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000237031365 1027133280 /nfs/dbraw/zinc/13/32/80/1027133280.db2.gz CMHJXHLFOZAYGL-QGZVFWFLSA-N 1 0 345.468 3.753 20 5 EHBDRO CCC[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC(C)(C)O ZINC000513713288 1027240144 /nfs/dbraw/zinc/24/01/44/1027240144.db2.gz NDSSNCNMHIAREP-UHFFFAOYSA-N 1 0 332.400 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000783597396 1027573829 /nfs/dbraw/zinc/57/38/29/1027573829.db2.gz MRGYVHMMRDAZTI-AWEZNQCLSA-N 1 0 331.803 3.708 20 5 EHBDRO C[C@@]1(CCCO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293730630 1027701851 /nfs/dbraw/zinc/70/18/51/1027701851.db2.gz GQOASDHPUHAUGJ-HNNXBMFYSA-N 1 0 346.349 3.741 20 5 EHBDRO CC(C)CC[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000053361044 1027961028 /nfs/dbraw/zinc/96/10/28/1027961028.db2.gz NNITTZVHQGQIRV-LLVKDONJSA-N 1 0 327.812 3.553 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000533511378 1027993591 /nfs/dbraw/zinc/99/35/91/1027993591.db2.gz FADKVYRIQZXYOJ-YYAJDYIMSA-N 1 0 331.460 3.993 20 5 EHBDRO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496898 1028088243 /nfs/dbraw/zinc/08/82/43/1028088243.db2.gz TUFRHUSGOXDCPR-WBVHZDCISA-N 1 0 344.390 3.766 20 5 EHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648907 1028111790 /nfs/dbraw/zinc/11/17/90/1028111790.db2.gz OUZKRECSXAJAKA-BBRMVZONSA-N 1 0 336.395 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCO[C@@]3(CCSC3)C1)CCC2 ZINC000248997111 1028191786 /nfs/dbraw/zinc/19/17/86/1028191786.db2.gz PILMHKXSNSXJHL-QGTPRVQTSA-N 1 0 348.468 3.617 20 5 EHBDRO Cc1c(Cl)c(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nn1C ZINC000421387120 1028360360 /nfs/dbraw/zinc/36/03/60/1028360360.db2.gz SWOMULXEZTYQLA-CQSZACIVSA-N 1 0 348.834 3.670 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]34CCOC4)o2)c(Cl)c1 ZINC000421393937 1028373635 /nfs/dbraw/zinc/37/36/35/1028373635.db2.gz FOQIHNOIRRPWAQ-KRWDZBQOSA-N 1 0 348.786 3.873 20 5 EHBDRO C[C@@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])cc1 ZINC000293735126 1028437881 /nfs/dbraw/zinc/43/78/81/1028437881.db2.gz OTIZEZFTRAXGLK-LLVKDONJSA-N 1 0 339.317 3.902 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)C(C)(C)C ZINC000546307372 1028531678 /nfs/dbraw/zinc/53/16/78/1028531678.db2.gz DQVQYPZPFIMRHE-BBRMVZONSA-N 1 0 340.489 3.852 20 5 EHBDRO C[N@H+](CCOc1cccc(Cl)c1)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701632 1028553997 /nfs/dbraw/zinc/55/39/97/1028553997.db2.gz RLYHTTFPERKGAG-UHFFFAOYSA-N 1 0 334.803 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCN(C3CCCC3)C1)CCC2 ZINC000583064229 1028716404 /nfs/dbraw/zinc/71/64/04/1028716404.db2.gz ISPNGHAGZNTJAO-KXBFYZLASA-N 1 0 329.444 3.579 20 5 EHBDRO C[C@H](NC(=O)CC[C@@H]([NH3+])CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000424103368 1028786241 /nfs/dbraw/zinc/78/62/41/1028786241.db2.gz SHRLHILEYVPKSH-WMLDXEAASA-N 1 0 347.459 3.850 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000524221853 1028993414 /nfs/dbraw/zinc/99/34/14/1028993414.db2.gz NKXUIVQVXQGKEV-NSHDSACASA-N 1 0 342.237 3.644 20 5 EHBDRO Cc1cccn2cc(CN(Cc3ccc([N+](=O)[O-])cc3)C(C)C)nc12 ZINC000138401621 1029092737 /nfs/dbraw/zinc/09/27/37/1029092737.db2.gz PKRGYERPSDDHCP-UHFFFAOYSA-N 1 0 338.411 3.962 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CC(C)C)C1CCCC1 ZINC000533254987 1029534180 /nfs/dbraw/zinc/53/41/80/1029534180.db2.gz BMIJIMRUBYVZQX-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000508679542 1029634129 /nfs/dbraw/zinc/63/41/29/1029634129.db2.gz MNUQIUWUZOOGIZ-OAHLLOKOSA-N 1 0 346.818 3.638 20 5 EHBDRO Cc1csc(N2CCC([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000155786085 1029650788 /nfs/dbraw/zinc/65/07/88/1029650788.db2.gz UXXYKFFYUDUHCS-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO CCC[C@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446842583 1029824502 /nfs/dbraw/zinc/82/45/02/1029824502.db2.gz XGOMDEZEZACVRP-OAHLLOKOSA-N 1 0 338.411 3.972 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000385119465 1029860272 /nfs/dbraw/zinc/86/02/72/1029860272.db2.gz CKCBDJQYNWBZLV-APWZRJJASA-N 1 0 339.439 3.828 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCC2(CC2)CC1 ZINC000446976560 1029870632 /nfs/dbraw/zinc/87/06/32/1029870632.db2.gz WYVQYOWQOMRJHH-CYBMUJFWSA-N 1 0 331.416 3.624 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508579737 1029873142 /nfs/dbraw/zinc/87/31/42/1029873142.db2.gz PWQOCJQOUNYMAE-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000441184013 1029876988 /nfs/dbraw/zinc/87/69/88/1029876988.db2.gz YMSXSAVTKKIQGS-QGZVFWFLSA-N 1 0 342.395 3.602 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(C[NH3+])CCC1 ZINC000414777556 1029961002 /nfs/dbraw/zinc/96/10/02/1029961002.db2.gz FWYGTUMEGWKXIW-UHFFFAOYSA-N 1 0 331.441 3.637 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453255095 1029985964 /nfs/dbraw/zinc/98/59/64/1029985964.db2.gz KLAHAFJFFJMIAM-DOMZBBRYSA-N 1 0 346.349 3.919 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)n1 ZINC000441221583 1030002140 /nfs/dbraw/zinc/00/21/40/1030002140.db2.gz AIBBNIOIHWYCCE-GOSISDBHSA-N 1 0 342.443 3.526 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000453307286 1030076930 /nfs/dbraw/zinc/07/69/30/1030076930.db2.gz BWISUICDCKRTIZ-CABCVRRESA-N 1 0 348.443 3.993 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000572975210 1030098637 /nfs/dbraw/zinc/09/86/37/1030098637.db2.gz OPNVPFILTZFTEL-BPAFIMBUSA-N 1 0 338.407 3.950 20 5 EHBDRO Cc1cnn([C@@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514986 1030110348 /nfs/dbraw/zinc/11/03/48/1030110348.db2.gz CXSDBPBANURGEM-DOTOQJQBSA-N 1 0 328.416 3.806 20 5 EHBDRO C[C@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000525781332 1030115714 /nfs/dbraw/zinc/11/57/14/1030115714.db2.gz CTXZGDOUOZLXMW-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453348332 1030137241 /nfs/dbraw/zinc/13/72/41/1030137241.db2.gz GBMVEUFJEINXHS-DDUZABMNSA-N 1 0 327.384 3.561 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453363893 1030178768 /nfs/dbraw/zinc/17/87/68/1030178768.db2.gz ROEMIINLBHECRJ-QANKJYHBSA-N 1 0 327.384 3.561 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2cccc(Cl)c2)n1 ZINC000447510957 1030257152 /nfs/dbraw/zinc/25/71/52/1030257152.db2.gz REUCWOSPOHWTRB-CABCVRRESA-N 1 0 334.807 3.718 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000520348491 1030328754 /nfs/dbraw/zinc/32/87/54/1030328754.db2.gz XRLWUDHVBYIWQT-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCCCN1C1CC1)CCC2 ZINC000447595668 1030331387 /nfs/dbraw/zinc/33/13/87/1030331387.db2.gz ALUQELBBIJKYJZ-PKOBYXMFSA-N 1 0 329.444 3.579 20 5 EHBDRO CC(C)(CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000447595107 1030334237 /nfs/dbraw/zinc/33/42/37/1030334237.db2.gz LDEUCPOENGMPPT-GOSISDBHSA-N 1 0 331.460 3.684 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447576690 1030337778 /nfs/dbraw/zinc/33/77/78/1030337778.db2.gz ZMHFOQPPQCJCLC-KDOFPFPSSA-N 1 0 332.444 3.751 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000482507803 1030487195 /nfs/dbraw/zinc/48/71/95/1030487195.db2.gz IGYCNRXPJDGQIN-QWHCGFSZSA-N 1 0 333.457 3.924 20 5 EHBDRO CC(C)(c1nc(-c2ccn3c[nH+]cc3c2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000447947406 1030599364 /nfs/dbraw/zinc/59/93/64/1030599364.db2.gz DMZVAEUZNFVAJU-UHFFFAOYSA-N 1 0 349.350 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]2C[NH+]2CCCCC2)c2ccncc21 ZINC000160452117 1030764576 /nfs/dbraw/zinc/76/45/76/1030764576.db2.gz IRGJWUJJYWZSKF-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000527286530 1030770720 /nfs/dbraw/zinc/77/07/20/1030770720.db2.gz NVVPFCRFNIAJMX-XIJQHFHMSA-N 1 0 337.423 3.774 20 5 EHBDRO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CCC(C)(C)C1 ZINC000483103395 1030961158 /nfs/dbraw/zinc/96/11/58/1030961158.db2.gz GIEDQIGYJQUDSH-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361714 1030983901 /nfs/dbraw/zinc/98/39/01/1030983901.db2.gz YCOTULQTZAPZBW-ZBFHGGJFSA-N 1 0 344.411 3.980 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@H](CCCO)c2ccccc2)cc([N+](=O)[O-])c1 ZINC000903099886 1031231412 /nfs/dbraw/zinc/23/14/12/1031231412.db2.gz OHMINPGAPCWHPB-IFXJQAMLSA-N 1 0 344.411 3.768 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@@H]2CCOC3(CCCC3)C2)cc([N+](=O)[O-])c1 ZINC000903127506 1031238610 /nfs/dbraw/zinc/23/86/10/1031238610.db2.gz ZVXXXUDYAJRTPH-DZGCQCFKSA-N 1 0 334.416 3.746 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000477440638 1031568214 /nfs/dbraw/zinc/56/82/14/1031568214.db2.gz SSKAOLAFOYZNOW-KRWDZBQOSA-N 1 0 340.379 3.969 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000063493769 1033403517 /nfs/dbraw/zinc/40/35/17/1033403517.db2.gz ZQFYKKKDPHOZLB-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C1CCN(c2cccs2)CC1 ZINC000594502872 1033404051 /nfs/dbraw/zinc/40/40/51/1033404051.db2.gz RVVFXPZGQXOAFM-MRXNPFEDSA-N 1 0 343.452 3.902 20 5 EHBDRO Cc1cnc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000594510011 1033415190 /nfs/dbraw/zinc/41/51/90/1033415190.db2.gz MSFMPVOWIWDGIV-LJQANCHMSA-N 1 0 325.412 3.816 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCc2ccccc2NC1=O ZINC000594511439 1033416009 /nfs/dbraw/zinc/41/60/09/1033416009.db2.gz NHIABZZVCMTQBF-SCLBCKFNSA-N 1 0 339.395 3.507 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000594517541 1033425117 /nfs/dbraw/zinc/42/51/17/1033425117.db2.gz YGIUYBGAWFPMRI-QYZOEREBSA-N 1 0 338.407 3.565 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)cc1OC(F)F ZINC000594597685 1033443140 /nfs/dbraw/zinc/44/31/40/1033443140.db2.gz DXMKCTXRFCIURB-STQMWFEESA-N 1 0 341.358 3.625 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000594615397 1033480079 /nfs/dbraw/zinc/48/00/79/1033480079.db2.gz OBQFYSBQKXHBCL-GFCCVEGCSA-N 1 0 332.425 3.669 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000594738159 1033510643 /nfs/dbraw/zinc/51/06/43/1033510643.db2.gz BCDHIPREQBYIIF-ACJLOTCBSA-N 1 0 325.412 3.775 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350127 1033530079 /nfs/dbraw/zinc/53/00/79/1033530079.db2.gz UWKZVLKNBSREBN-HZPDHXFCSA-N 1 0 344.415 3.949 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460345170 1033538947 /nfs/dbraw/zinc/53/89/47/1033538947.db2.gz FJPIQWFDCRVACV-ZNMIVQPWSA-N 1 0 333.432 3.726 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923937 1033546544 /nfs/dbraw/zinc/54/65/44/1033546544.db2.gz HADRBSBWYULAQS-KUHUBIRLSA-N 1 0 342.395 3.613 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CO)C2CCC2)s1 ZINC000594957603 1033597337 /nfs/dbraw/zinc/59/73/37/1033597337.db2.gz UVRARZXTROGHCD-HNNXBMFYSA-N 1 0 332.425 3.574 20 5 EHBDRO CC1(C)OC[C@@H]2C[C@@]21[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000598987836 1033613375 /nfs/dbraw/zinc/61/33/75/1033613375.db2.gz MFZPPOJMDURAGN-KPZWWZAWSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccn1 ZINC000595051502 1033666825 /nfs/dbraw/zinc/66/68/25/1033666825.db2.gz VMLWRDRBQBAQMM-KDOFPFPSSA-N 1 0 325.412 3.704 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1noc2ccccc21 ZINC000595050113 1033666974 /nfs/dbraw/zinc/66/69/74/1033666974.db2.gz PLGPHWQBLHQARB-AWEZNQCLSA-N 1 0 339.395 3.889 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000595051808 1033667160 /nfs/dbraw/zinc/66/71/60/1033667160.db2.gz OGYGBWMJQSRXMX-ZDUSSCGKSA-N 1 0 336.432 3.585 20 5 EHBDRO COC1CC(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000595051526 1033668062 /nfs/dbraw/zinc/66/80/62/1033668062.db2.gz VTHXCDHEGYXAJY-NRLXWARBSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](O)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000595100574 1033689607 /nfs/dbraw/zinc/68/96/07/1033689607.db2.gz VPEKNWJLCXMBTA-WTANOLMUSA-N 1 0 328.412 3.718 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000595103624 1033690642 /nfs/dbraw/zinc/69/06/42/1033690642.db2.gz NFWLVERKDCCDOM-BEFAXECRSA-N 1 0 325.412 3.520 20 5 EHBDRO Cc1nccn1-c1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000089512122 1033760864 /nfs/dbraw/zinc/76/08/64/1033760864.db2.gz ILQJQSPNHWITLG-AWEZNQCLSA-N 1 0 336.395 3.940 20 5 EHBDRO CC[C@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000593714897 1033822171 /nfs/dbraw/zinc/82/21/71/1033822171.db2.gz GBKGSKTWQIAMQW-VQTJNVASSA-N 1 0 340.423 3.512 20 5 EHBDRO COc1cc(CN2CCC[C@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500875 1033831847 /nfs/dbraw/zinc/83/18/47/1033831847.db2.gz GFYKFSJRKBQROL-ZDUSSCGKSA-N 1 0 345.374 3.517 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)C1 ZINC000603855873 1033981076 /nfs/dbraw/zinc/98/10/76/1033981076.db2.gz CBQHJWPKTVVVRN-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000603859557 1033984685 /nfs/dbraw/zinc/98/46/85/1033984685.db2.gz JEOOPXBUOBXJLQ-OAHLLOKOSA-N 1 0 342.443 3.631 20 5 EHBDRO COc1cc(NC2CC[NH+](C(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596062882 1034065784 /nfs/dbraw/zinc/06/57/84/1034065784.db2.gz SQPAHGOTSXKREU-UHFFFAOYSA-N 1 0 327.812 3.542 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H]3CCC=CO3)o2)c([N+](=O)[O-])c1 ZINC000780569755 1034135608 /nfs/dbraw/zinc/13/56/08/1034135608.db2.gz IQMCQQBATOEFGP-CQSZACIVSA-N 1 0 344.367 3.646 20 5 EHBDRO COc1cccc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000604012373 1034135761 /nfs/dbraw/zinc/13/57/61/1034135761.db2.gz JQFKILVQXPVJGK-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CO[C@@]1(C(F)(F)F)CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141118 1034146628 /nfs/dbraw/zinc/14/66/28/1034146628.db2.gz BKZIGRNOIQSMRG-SZTZYQKNSA-N 1 0 344.333 3.651 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000596309294 1034165357 /nfs/dbraw/zinc/16/53/57/1034165357.db2.gz XTHSRAQWEGCKGH-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@](C)(O)c1ccccc1 ZINC000179374587 1034260202 /nfs/dbraw/zinc/26/02/02/1034260202.db2.gz JRGZWXDYJYFBNC-KRWDZBQOSA-N 1 0 334.803 3.588 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571728 1034293915 /nfs/dbraw/zinc/29/39/15/1034293915.db2.gz ZEUVPSOXNXQMDG-OAHLLOKOSA-N 1 0 345.443 3.721 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)ccc21 ZINC000456283447 1034303205 /nfs/dbraw/zinc/30/32/05/1034303205.db2.gz SSGGTIUVHHJAOW-QGZVFWFLSA-N 1 0 343.358 3.535 20 5 EHBDRO COCc1csc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000596980364 1034480153 /nfs/dbraw/zinc/48/01/53/1034480153.db2.gz YXDGFUDMDDUYLR-UHFFFAOYSA-N 1 0 332.425 3.967 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000310512215 1034531648 /nfs/dbraw/zinc/53/16/48/1034531648.db2.gz PPYOKZJZQYQYAV-CABCVRRESA-N 1 0 349.431 3.520 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H](C)O1 ZINC000597225651 1034626057 /nfs/dbraw/zinc/62/60/57/1034626057.db2.gz RYHFNJUPGURRBV-KGLIPLIRSA-N 1 0 330.384 3.854 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CNc2ccccc2C1 ZINC000593314730 1034627831 /nfs/dbraw/zinc/62/78/31/1034627831.db2.gz DFYSZVQOQMDPCQ-WMLDXEAASA-N 1 0 325.412 3.542 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(CO)CCC1 ZINC000597256976 1034629796 /nfs/dbraw/zinc/62/97/96/1034629796.db2.gz ZFTSGGPLPYBYKG-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccc3nccnc3c2)cc1 ZINC000602011493 1034857179 /nfs/dbraw/zinc/85/71/79/1034857179.db2.gz NOWHVMDDUQGNPD-UHFFFAOYSA-N 1 0 336.395 3.651 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@@H](C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612408345 1034889839 /nfs/dbraw/zinc/88/98/39/1034889839.db2.gz WXOBGLJJXKKGCJ-ACJLOTCBSA-N 1 0 332.400 3.854 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615966696 1035065859 /nfs/dbraw/zinc/06/58/59/1035065859.db2.gz IDNVRAPCVJGOEF-HOCLYGCPSA-N 1 0 330.432 3.727 20 5 EHBDRO CO[C@@](C)([C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948119 1035078844 /nfs/dbraw/zinc/07/88/44/1035078844.db2.gz MWOMOEYRNTZWPY-ACJLOTCBSA-N 1 0 336.432 3.675 20 5 EHBDRO Cn1cc(C[N@@H+]2CC(C)(C)[C@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655303 1035446782 /nfs/dbraw/zinc/44/67/82/1035446782.db2.gz FFNWWEVGUCISAO-GOSISDBHSA-N 1 0 340.427 3.616 20 5 EHBDRO COCC1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCC1 ZINC000581082373 1035472620 /nfs/dbraw/zinc/47/26/20/1035472620.db2.gz KMHRNWZBUXJNNM-UHFFFAOYSA-N 1 0 347.440 3.767 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129445 1035603399 /nfs/dbraw/zinc/60/33/99/1035603399.db2.gz OKVNABLJFOSDOT-MRXNPFEDSA-N 1 0 339.439 3.910 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936043 1035673821 /nfs/dbraw/zinc/67/38/21/1035673821.db2.gz VDSZQKCASXEWDV-WBVHZDCISA-N 1 0 326.396 3.852 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)nc1C ZINC000414169721 1035868794 /nfs/dbraw/zinc/86/87/94/1035868794.db2.gz RYMIYBVBMYKEDH-GOSISDBHSA-N 1 0 325.412 3.718 20 5 EHBDRO CCCCOC1CC[NH+](Cc2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000492487472 1035886125 /nfs/dbraw/zinc/88/61/25/1035886125.db2.gz RKFBBNIBROIOJS-UHFFFAOYSA-N 1 0 336.432 3.775 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361949 1036023114 /nfs/dbraw/zinc/02/31/14/1036023114.db2.gz JCMTYGUMJAHMCV-CVEARBPZSA-N 1 0 344.415 3.949 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccc(OC)c(F)c2)ccc1[N+](=O)[O-] ZINC000492579534 1036025449 /nfs/dbraw/zinc/02/54/49/1036025449.db2.gz AJOATYUKEOGBER-GFCCVEGCSA-N 1 0 348.374 3.992 20 5 EHBDRO C[N@H+](CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CCCC1 ZINC000582611032 1036036936 /nfs/dbraw/zinc/03/69/36/1036036936.db2.gz JCCWWWWYGGBTFX-OAHLLOKOSA-N 1 0 345.365 3.662 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000588928739 1036188505 /nfs/dbraw/zinc/18/85/05/1036188505.db2.gz OOVFUNJCDMWZMW-OICCZTGUSA-N 1 0 346.814 3.627 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc(C(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000589103916 1036252355 /nfs/dbraw/zinc/25/23/55/1036252355.db2.gz QBVBSXAWOKHCMK-ZDUSSCGKSA-N 1 0 325.315 3.840 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000492788763 1036293422 /nfs/dbraw/zinc/29/34/22/1036293422.db2.gz JSJPVKUBHRQZLY-DOTOQJQBSA-N 1 0 336.457 3.854 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@H](C)O1 ZINC000414252608 1036301910 /nfs/dbraw/zinc/30/19/10/1036301910.db2.gz ATJBXVQHPCVSRN-JAPOXJDPSA-N 1 0 332.444 3.709 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000376366675 1036323684 /nfs/dbraw/zinc/32/36/84/1036323684.db2.gz HYDYLHPFIFUKSZ-CQSZACIVSA-N 1 0 331.803 3.708 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000589281438 1036338869 /nfs/dbraw/zinc/33/88/69/1036338869.db2.gz HFNRDCVUDKWDCV-BEFAXECRSA-N 1 0 337.423 3.793 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC[C@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541566280 1036437340 /nfs/dbraw/zinc/43/73/40/1036437340.db2.gz SDEWGTFOCFBBQX-APWZRJJASA-N 1 0 346.427 3.980 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC[C@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541566284 1036437374 /nfs/dbraw/zinc/43/73/74/1036437374.db2.gz SDEWGTFOCFBBQX-VQIMIIECSA-N 1 0 346.427 3.980 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H](C)C[C@@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541568374 1036459276 /nfs/dbraw/zinc/45/92/76/1036459276.db2.gz OUOXKAPMNARPOI-VEVIJQCQSA-N 1 0 332.400 3.589 20 5 EHBDRO COc1cc[nH+]c(NCc2csc(-c3cccc([N+](=O)[O-])c3)n2)c1 ZINC000089805309 1036658043 /nfs/dbraw/zinc/65/80/43/1036658043.db2.gz DWRTZOYBKWWQKE-UHFFFAOYSA-N 1 0 342.380 3.734 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000589939344 1036687381 /nfs/dbraw/zinc/68/73/81/1036687381.db2.gz PXTOYDVVNBCMFK-FPSANXDJSA-N 1 0 344.436 3.962 20 5 EHBDRO CC(C)([NH2+]C[C@H]1CCOc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000590053319 1036740580 /nfs/dbraw/zinc/74/05/80/1036740580.db2.gz HKSDLMAUSUMSLE-CQSZACIVSA-N 1 0 326.396 3.986 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)n1 ZINC000541935858 1036861448 /nfs/dbraw/zinc/86/14/48/1036861448.db2.gz NAETWWQEKLWUHA-WBVHZDCISA-N 1 0 340.427 3.854 20 5 EHBDRO COc1cc(NC[C@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])cc1C ZINC000590568264 1036951320 /nfs/dbraw/zinc/95/13/20/1036951320.db2.gz AULRBXOTLANFRE-CQSZACIVSA-N 1 0 335.429 3.688 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000191413507 1036960288 /nfs/dbraw/zinc/96/02/88/1036960288.db2.gz HNNRCMCZFAJQDL-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000590779917 1037047289 /nfs/dbraw/zinc/04/72/89/1037047289.db2.gz ZLIXKNWLOAZDRP-GMBSWORKSA-N 1 0 341.411 3.869 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccc(F)cc1 ZINC000761524430 1037092329 /nfs/dbraw/zinc/09/23/29/1037092329.db2.gz CQYRVLCULQGUTR-NSHDSACASA-N 1 0 338.766 3.944 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519662 1037097144 /nfs/dbraw/zinc/09/71/44/1037097144.db2.gz CYQXVXHRORRXDG-CQSZACIVSA-N 1 0 325.840 3.602 20 5 EHBDRO Cc1cnc(NC2CCC([NH+]3CCC(C)CC3)CC2)c([N+](=O)[O-])c1 ZINC000443695095 1037099667 /nfs/dbraw/zinc/09/96/67/1037099667.db2.gz SKLTUYCSKVGIET-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@H]2/C=C\c2cccs2)n1 ZINC000542131641 1037108568 /nfs/dbraw/zinc/10/85/68/1037108568.db2.gz NKZDUSHJMZKCTR-LZNQSLFOSA-N 1 0 346.456 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2cc(F)c(F)c(F)c2)cc1Cl ZINC000761534032 1037108908 /nfs/dbraw/zinc/10/89/08/1037108908.db2.gz YYGQDLCNQJFTQB-UHFFFAOYSA-N 1 0 344.720 3.998 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000386959181 1037113326 /nfs/dbraw/zinc/11/33/26/1037113326.db2.gz YUNYRCHLXIGKTE-INIZCTEOSA-N 1 0 327.428 3.686 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC000591061788 1037223619 /nfs/dbraw/zinc/22/36/19/1037223619.db2.gz IJRZIFUAFMCBLT-IUODEOHRSA-N 1 0 342.399 3.828 20 5 EHBDRO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850255 1037281100 /nfs/dbraw/zinc/28/11/00/1037281100.db2.gz LBHMWFDPMLXVSP-GOSISDBHSA-N 1 0 328.412 3.676 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]([C@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899997 1037342209 /nfs/dbraw/zinc/34/22/09/1037342209.db2.gz MFHWOCCRKNSHRX-SJORKVTESA-N 1 0 332.444 3.967 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cnc(OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000271843986 1037473625 /nfs/dbraw/zinc/47/36/25/1037473625.db2.gz ZYEZUJXMGLRINT-OAHLLOKOSA-N 1 0 335.791 3.893 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl ZINC000271844826 1037481756 /nfs/dbraw/zinc/48/17/56/1037481756.db2.gz WQJSHGWMRMFBFI-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO COC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000573410022 1037507167 /nfs/dbraw/zinc/50/71/67/1037507167.db2.gz ZVLLAAHYZLSJCI-QGZVFWFLSA-N 1 0 334.803 3.768 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCN(c2ccccc2F)C1 ZINC000462915543 1037545964 /nfs/dbraw/zinc/54/59/64/1037545964.db2.gz VVPWGRBIIHRWSM-HNNXBMFYSA-N 1 0 343.402 3.658 20 5 EHBDRO COc1ccccc1C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000540118278 1037582699 /nfs/dbraw/zinc/58/26/99/1037582699.db2.gz SVXLCYWLTKIVJE-KRWDZBQOSA-N 1 0 328.412 3.960 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCOc2ccc(Cl)cn2)cccc1[N+](=O)[O-] ZINC000540160421 1037617227 /nfs/dbraw/zinc/61/72/27/1037617227.db2.gz KBXONIIXQOHBPF-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](c1ccsc1)N(C)C ZINC000468639617 1037656254 /nfs/dbraw/zinc/65/62/54/1037656254.db2.gz GCXWLKFLNPQWDO-GIIHOQTISA-N 1 0 345.468 3.952 20 5 EHBDRO CCCC[NH+]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000058339200 1037823879 /nfs/dbraw/zinc/82/38/79/1037823879.db2.gz VNZMDKUBGFGLIU-UHFFFAOYSA-N 1 0 331.338 3.536 20 5 EHBDRO CC(C)(NCc1cn2cc(Cl)ccc2n1)c1ccccc1[N+](=O)[O-] ZINC000492000811 1037853481 /nfs/dbraw/zinc/85/34/81/1037853481.db2.gz PHXDWAYHLLCPRF-UHFFFAOYSA-N 1 0 344.802 3.921 20 5 EHBDRO CC(C)(C)c1ccc(C(C)(C)[NH2+]CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000540402987 1037900111 /nfs/dbraw/zinc/90/01/11/1037900111.db2.gz DABRSWAAVSALOT-UHFFFAOYSA-N 1 0 330.432 3.614 20 5 EHBDRO COCCOc1cccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000492039045 1037911343 /nfs/dbraw/zinc/91/13/43/1037911343.db2.gz BOIHRDYXGRHLMW-UHFFFAOYSA-N 1 0 344.411 3.645 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000592392993 1037933739 /nfs/dbraw/zinc/93/37/39/1037933739.db2.gz NVUALNBZLNFSMQ-SFHVURJKSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000540479036 1037988730 /nfs/dbraw/zinc/98/87/30/1037988730.db2.gz TUJAUNIQCZFNLK-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO COCCOc1ccccc1C[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897469602 1038108769 /nfs/dbraw/zinc/10/87/69/1038108769.db2.gz NEEHOCXEMVXTSB-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2ccc(F)cc2)C2CC2)c1 ZINC000058562842 1038124169 /nfs/dbraw/zinc/12/41/69/1038124169.db2.gz VZXVOSNHFANPDN-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1cccc([C@@H](O)C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC001167735184 1038444559 /nfs/dbraw/zinc/44/45/59/1038444559.db2.gz UTQFLTWBBXGVSJ-IBGZPJMESA-N 1 0 326.396 3.601 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCSCC(F)(F)F ZINC000539049994 1038654173 /nfs/dbraw/zinc/65/41/73/1038654173.db2.gz UEIRZGAOEYRJOO-LLVKDONJSA-N 1 0 336.379 3.801 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539225114 1038738816 /nfs/dbraw/zinc/73/88/16/1038738816.db2.gz KNFHYHOSAKVFDE-YOEHRIQHSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H]1CC(C)C ZINC000500471383 1038780743 /nfs/dbraw/zinc/78/07/43/1038780743.db2.gz TWVRXSRIOFTUTJ-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H]1CC(C)C ZINC000500471384 1038782195 /nfs/dbraw/zinc/78/21/95/1038782195.db2.gz TWVRXSRIOFTUTJ-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO CCSc1ccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000905410331 1038868725 /nfs/dbraw/zinc/86/87/25/1038868725.db2.gz SFUBQLMFPIOGEN-QGZVFWFLSA-N 1 0 332.425 3.530 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000552582540 1039375637 /nfs/dbraw/zinc/37/56/37/1039375637.db2.gz OUKOTLNFIIGNGD-LRVUVFPRSA-N 1 0 344.415 3.972 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCSC1 ZINC000279934491 1039604018 /nfs/dbraw/zinc/60/40/18/1039604018.db2.gz JAMUPYSOECYOKJ-OLZOCXBDSA-N 1 0 326.487 3.808 20 5 EHBDRO Cc1nn(C)c(C)c1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417323467 1039680490 /nfs/dbraw/zinc/68/04/90/1039680490.db2.gz OJLWKPOABQJZCH-IBGZPJMESA-N 1 0 342.443 3.545 20 5 EHBDRO Cn1cc(Cl)c(CN[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417346930 1039698295 /nfs/dbraw/zinc/69/82/95/1039698295.db2.gz GGYNQVRPVKUYHF-HNNXBMFYSA-N 1 0 334.807 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]4(C3)CCCOC4)o2)cc1 ZINC000342836623 1039702071 /nfs/dbraw/zinc/70/20/71/1039702071.db2.gz KMUXOTBUQOGMCK-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CCOCC34CC4)s2)cc1 ZINC000549847102 1040034959 /nfs/dbraw/zinc/03/49/59/1040034959.db2.gz BFEYTTLDPAJRFJ-UHFFFAOYSA-N 1 0 330.409 3.688 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@@H]34)o2)c1 ZINC000249458184 1040063614 /nfs/dbraw/zinc/06/36/14/1040063614.db2.gz DXBYHNXONLILHJ-LZLYRXPVSA-N 1 0 328.368 3.512 20 5 EHBDRO CCC(C)(C)C[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000432896370 1040088186 /nfs/dbraw/zinc/08/81/86/1040088186.db2.gz GBKFBWJAFRUZTA-UHFFFAOYSA-N 1 0 346.374 3.773 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)c1c(C)cccc1C ZINC000555059630 1040102113 /nfs/dbraw/zinc/10/21/13/1040102113.db2.gz RJYZJGGPUBGQON-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000192954495 1040327191 /nfs/dbraw/zinc/32/71/91/1040327191.db2.gz QEIDECPBAWAJNH-AWEZNQCLSA-N 1 0 346.818 3.577 20 5 EHBDRO CC1(C)CC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC(C)(C)[NH2+]1 ZINC000092584651 1040401992 /nfs/dbraw/zinc/40/19/92/1040401992.db2.gz YENCYURZLKHNBM-UHFFFAOYSA-N 1 0 343.374 3.917 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000481187223 1040451528 /nfs/dbraw/zinc/45/15/28/1040451528.db2.gz FTAMUCVNVSGJSQ-IVMMDQJWSA-N 1 0 333.432 3.646 20 5 EHBDRO CC[C@](C)(CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000152173260 1040501762 /nfs/dbraw/zinc/50/17/62/1040501762.db2.gz YXQMYLCESIEVPF-MRXNPFEDSA-N 1 0 338.791 3.759 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000486936600 1040583892 /nfs/dbraw/zinc/58/38/92/1040583892.db2.gz GDVYCTKKUCJQLI-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000490561512 1040611107 /nfs/dbraw/zinc/61/11/07/1040611107.db2.gz CWMUWJBJNFWWQQ-GOSISDBHSA-N 1 0 344.386 3.568 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433074284 1040641076 /nfs/dbraw/zinc/64/10/76/1040641076.db2.gz HYOVZUYDEAEDIM-KRWDZBQOSA-N 1 0 326.396 3.983 20 5 EHBDRO CC[C@@H]1C[C@H](C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487163791 1040746441 /nfs/dbraw/zinc/74/64/41/1040746441.db2.gz SPOZOAQKHOEQDO-IAQYHMDHSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@]1(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCS1 ZINC000600156518 1040751331 /nfs/dbraw/zinc/75/13/31/1040751331.db2.gz QPMNRJKPVCKYKI-CYBMUJFWSA-N 1 0 334.363 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCOc2ccccc2F)C2CC2)cc1 ZINC000490823402 1040751770 /nfs/dbraw/zinc/75/17/70/1040751770.db2.gz FVXAKBBWKCRBKP-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO COC(=O)[C@@H](C)C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509782844 1040815173 /nfs/dbraw/zinc/81/51/73/1040815173.db2.gz OCLPGSSZLRYUAC-LBPRGKRZSA-N 1 0 348.424 3.564 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2cc(C)ccc2C[C@H]1C ZINC000491026964 1040873240 /nfs/dbraw/zinc/87/32/40/1040873240.db2.gz AAROUCYDRVDZLY-BFUOFWGJSA-N 1 0 326.396 3.935 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491087487 1040908605 /nfs/dbraw/zinc/90/86/05/1040908605.db2.gz JGZDQTNELPJMQD-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433163704 1040949127 /nfs/dbraw/zinc/94/91/27/1040949127.db2.gz CLLKUZIWXSMBEM-QFBILLFUSA-N 1 0 340.423 3.510 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCc2ccccc2O)c2cc([N+](=O)[O-])ccc21 ZINC000433169944 1040964512 /nfs/dbraw/zinc/96/45/12/1040964512.db2.gz UCMDCRRRGMWHDZ-QGZVFWFLSA-N 1 0 326.396 3.855 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cnc(-c3ccco3)s2)c1 ZINC000487575223 1040972778 /nfs/dbraw/zinc/97/27/78/1040972778.db2.gz QZFUEWZHYQNHSO-UHFFFAOYSA-N 1 0 329.381 3.644 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@H](C)c3cc([N+](=O)[O-])ccc3C)nc12 ZINC000156319519 1040975967 /nfs/dbraw/zinc/97/59/67/1040975967.db2.gz WLUXFILLSQVQAV-OAHLLOKOSA-N 1 0 338.411 3.753 20 5 EHBDRO COC(=O)c1cc([C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202497 1041057772 /nfs/dbraw/zinc/05/77/72/1041057772.db2.gz RBTQPBKBJYBRJY-LBPRGKRZSA-N 1 0 346.383 3.518 20 5 EHBDRO Cc1cc([C@](C)(O)C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000164181522 1041219096 /nfs/dbraw/zinc/21/90/96/1041219096.db2.gz VICPYIUKRXCTIM-ORAYPTAESA-N 1 0 346.427 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)cc1 ZINC000481682991 1041231359 /nfs/dbraw/zinc/23/13/59/1041231359.db2.gz BWZIIGNESLIDGG-FQEVSTJZSA-N 1 0 338.407 3.659 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433297134 1041250897 /nfs/dbraw/zinc/25/08/97/1041250897.db2.gz VKIZWILFJHGKLA-QGZVFWFLSA-N 1 0 341.411 3.553 20 5 EHBDRO CN(c1ccccc1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1 ZINC000500392718 1041325041 /nfs/dbraw/zinc/32/50/41/1041325041.db2.gz KHMGHHAKUJOXMS-UHFFFAOYSA-N 1 0 325.412 3.696 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)c1ccccc1C ZINC000120513989 1041391736 /nfs/dbraw/zinc/39/17/36/1041391736.db2.gz GEYPVDQPQIKWLE-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c([N+](=O)[O-])cc1O ZINC000093116141 1041889409 /nfs/dbraw/zinc/88/94/09/1041889409.db2.gz GFLTVRCUXUCJOU-OAHLLOKOSA-N 1 0 346.358 3.615 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH+](C)C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549564598 1042291987 /nfs/dbraw/zinc/29/19/87/1042291987.db2.gz MSRWTANOZSNBOO-LBPRGKRZSA-N 1 0 345.365 3.843 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000125825278 1042804670 /nfs/dbraw/zinc/80/46/70/1042804670.db2.gz STPKWTUTKSXRTQ-DZGCQCFKSA-N 1 0 345.365 3.662 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)CF)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000342201832 1042835152 /nfs/dbraw/zinc/83/51/52/1042835152.db2.gz MESBVBAXKBVTQF-CYBMUJFWSA-N 1 0 348.374 3.630 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](CC1CCCC1)c1ccccc1 ZINC000342229804 1042842648 /nfs/dbraw/zinc/84/26/48/1042842648.db2.gz VMMPQRFMQXYVJB-MRXNPFEDSA-N 1 0 328.416 3.740 20 5 EHBDRO COc1cc(C[NH2+]C2CCCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000181952582 1042903505 /nfs/dbraw/zinc/90/35/05/1042903505.db2.gz SUDDEPKQHNLQFT-UHFFFAOYSA-N 1 0 348.321 3.577 20 5 EHBDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820818 1042906469 /nfs/dbraw/zinc/90/64/69/1042906469.db2.gz WUSMMBICVPLTBQ-SJORKVTESA-N 1 0 336.432 3.716 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000432339478 1042972542 /nfs/dbraw/zinc/97/25/42/1042972542.db2.gz ITYXSOHXACWZBI-WFASDCNBSA-N 1 0 335.835 3.701 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000432339476 1042972605 /nfs/dbraw/zinc/97/26/05/1042972605.db2.gz ITYXSOHXACWZBI-IUODEOHRSA-N 1 0 335.835 3.701 20 5 EHBDRO Cc1noc(C)c1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278964050 1043094706 /nfs/dbraw/zinc/09/47/06/1043094706.db2.gz BNDHQTHUXJWHST-QGZVFWFLSA-N 1 0 329.400 3.754 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cnn1C ZINC000279209478 1043570000 /nfs/dbraw/zinc/57/00/00/1043570000.db2.gz YAJHMCQRQPFBNY-DIFFPNOSSA-N 1 0 328.416 3.710 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H](c1ccco1)N1CCCCC1 ZINC000183422399 1125556408 /nfs/dbraw/zinc/55/64/08/1125556408.db2.gz LEBHYGKXXSRZLY-GOSISDBHSA-N 1 0 343.427 3.813 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1ccco1 ZINC000183455590 1125567616 /nfs/dbraw/zinc/56/76/16/1125567616.db2.gz NKNPWHNLNBRXOU-KRWDZBQOSA-N 1 0 331.416 3.669 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000183592729 1125608410 /nfs/dbraw/zinc/60/84/10/1125608410.db2.gz MWNGFIGFWKGOOZ-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccc(C[NH2+][C@](C)(CO)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC001656293674 1126257202 /nfs/dbraw/zinc/25/72/02/1126257202.db2.gz PSVIBEKLTHVQIR-SFHVURJKSA-N 1 0 348.830 3.640 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552099326 1127578143 /nfs/dbraw/zinc/57/81/43/1127578143.db2.gz FNOIBEHYGLKEQD-XFQXTVEOSA-N 1 0 340.423 3.946 20 5 EHBDRO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@@H]1CCCC[N@@H+]1C ZINC000765525279 1127640211 /nfs/dbraw/zinc/64/02/11/1127640211.db2.gz CJZPAOZZUGFURQ-SJORKVTESA-N 1 0 348.443 3.581 20 5 EHBDRO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@@H]1CCCC[N@@H+]1C ZINC000765525277 1127640311 /nfs/dbraw/zinc/64/03/11/1127640311.db2.gz CJZPAOZZUGFURQ-IRXDYDNUSA-N 1 0 348.443 3.581 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000301293617 1127735521 /nfs/dbraw/zinc/73/55/21/1127735521.db2.gz WEBDZMDMOCAHHJ-CQSZACIVSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000131433197 1127767815 /nfs/dbraw/zinc/76/78/15/1127767815.db2.gz YVRNKMMRSKYMOU-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C3CCSCC3)cs2)c1 ZINC000172119465 1127769204 /nfs/dbraw/zinc/76/92/04/1127769204.db2.gz WVHYJGBXKAGPOO-UHFFFAOYSA-N 1 0 335.454 3.704 20 5 EHBDRO CCC1(Nc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C[NH2+]C1 ZINC001168582934 1128064531 /nfs/dbraw/zinc/06/45/31/1128064531.db2.gz DQABAHIJRWMECZ-UHFFFAOYSA-N 1 0 329.425 3.910 20 5 EHBDRO CSc1ccccc1[C@@H](C)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000282211962 1128084776 /nfs/dbraw/zinc/08/47/76/1128084776.db2.gz YAJSZAADHYBZRL-MLGOLLRUSA-N 1 0 332.425 3.701 20 5 EHBDRO Cc1cnc(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000301457270 1128344304 /nfs/dbraw/zinc/34/43/04/1128344304.db2.gz CLBAWNVVTGCBEO-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000301455311 1128345881 /nfs/dbraw/zinc/34/58/81/1128345881.db2.gz YOQVSVIAXRKXSG-XJKSGUPXSA-N 1 0 346.456 3.855 20 5 EHBDRO CCOc1cc(NCC[N@@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301514983 1128485083 /nfs/dbraw/zinc/48/50/83/1128485083.db2.gz JOVDYFHZGNRTLU-UHFFFAOYSA-N 1 0 347.440 3.525 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000301554963 1128496282 /nfs/dbraw/zinc/49/62/82/1128496282.db2.gz ICXPBAWNVXSAHO-GXSJLCMTSA-N 1 0 329.322 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCSc3c(F)cccc32)cc1 ZINC000765849492 1128569934 /nfs/dbraw/zinc/56/99/34/1128569934.db2.gz QLYHEOVJSSFVTD-JKSUJKDBSA-N 1 0 348.399 3.594 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000734508031 1131243196 /nfs/dbraw/zinc/24/31/96/1131243196.db2.gz BZQDWDJHWJOBGO-ZDUSSCGKSA-N 1 0 330.432 3.767 20 5 EHBDRO Cc1nc(NCc2ccccc2C[N@@H+](C)C(C)C)ccc1[N+](=O)[O-] ZINC000301622589 1128765897 /nfs/dbraw/zinc/76/58/97/1128765897.db2.gz FVFVQDUIIFCIOO-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO Cc1ccc(CCC[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cn1 ZINC000554889300 1128773700 /nfs/dbraw/zinc/77/37/00/1128773700.db2.gz YSHYGPXYAINXLV-UHFFFAOYSA-N 1 0 338.411 3.544 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@@H+]1Cc1ccccc1 ZINC000301636022 1128777226 /nfs/dbraw/zinc/77/72/26/1128777226.db2.gz WRDYUQICNGYRKI-TZMCWYRMSA-N 1 0 346.818 3.718 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673404 1128902643 /nfs/dbraw/zinc/90/26/43/1128902643.db2.gz RJWAONUPVYSHLT-WMLDXEAASA-N 1 0 340.427 3.763 20 5 EHBDRO CCOc1cc(C[NH2+][C@H]2CCCO[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000492874963 1120374182 /nfs/dbraw/zinc/37/41/82/1120374182.db2.gz QXDVDFTUBUNUDV-RDJZCZTQSA-N 1 0 336.432 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC[C@@H]2CCOC2)c2ccccc2)c1 ZINC000542486344 1120607073 /nfs/dbraw/zinc/60/70/73/1120607073.db2.gz FLIBMZTYMWZZPM-BEFAXECRSA-N 1 0 326.396 3.700 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000495024773 1120932764 /nfs/dbraw/zinc/93/27/64/1120932764.db2.gz FQHRYYHYNCUWHZ-LSBZLQRGSA-N 1 0 326.396 3.841 20 5 EHBDRO CC1(C)CC[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)O1 ZINC000495183563 1120981137 /nfs/dbraw/zinc/98/11/37/1120981137.db2.gz YDAUCDOQEMGMCE-AWEZNQCLSA-N 1 0 330.384 3.902 20 5 EHBDRO CC(C)[NH+](CCSCCOc1cccc([N+](=O)[O-])c1)C(C)C ZINC000762203900 1121172674 /nfs/dbraw/zinc/17/26/74/1121172674.db2.gz MGXYFYGNCWYTNS-UHFFFAOYSA-N 1 0 326.462 3.826 20 5 EHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000303753353 1121180670 /nfs/dbraw/zinc/18/06/70/1121180670.db2.gz MJPGDCZXNNXSNW-MRXNPFEDSA-N 1 0 328.412 3.845 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]2CCCO[C@H]21 ZINC000495440384 1121204930 /nfs/dbraw/zinc/20/49/30/1121204930.db2.gz RRSJVAIXWPKYTK-NUEKZKHPSA-N 1 0 338.835 3.584 20 5 EHBDRO Cc1cc(NC[C@H](C)[N@@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301067610 1121302514 /nfs/dbraw/zinc/30/25/14/1121302514.db2.gz CEKKBOPPARSNQY-ZDUSSCGKSA-N 1 0 331.441 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2cccc(Cl)c2)[NH+]2CCCC2)nc1 ZINC000301086239 1121521710 /nfs/dbraw/zinc/52/17/10/1121521710.db2.gz MUFWAQSBSYLRTF-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272573497 1121728818 /nfs/dbraw/zinc/72/88/18/1121728818.db2.gz WNCVFKMTTCYPRS-KRWDZBQOSA-N 1 0 340.427 3.588 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000282119437 1121798100 /nfs/dbraw/zinc/79/81/00/1121798100.db2.gz ARLBJMHYTCUNRL-CJNGLKHVSA-N 1 0 330.384 3.854 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000282119442 1121798320 /nfs/dbraw/zinc/79/83/20/1121798320.db2.gz ARLBJMHYTCUNRL-CZUORRHYSA-N 1 0 330.384 3.854 20 5 EHBDRO COc1ccc(C[N@H+](C)C2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000153798028 1122008783 /nfs/dbraw/zinc/00/87/83/1122008783.db2.gz LIQFIUCBMNMRRP-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000130650726 1122144890 /nfs/dbraw/zinc/14/48/90/1122144890.db2.gz PHGHZZWSUFLRDJ-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@@H](CCc2ccccc2)C1 ZINC000544530203 1122320401 /nfs/dbraw/zinc/32/04/01/1122320401.db2.gz SGMZOVDWBHBDGJ-JXFKEZNVSA-N 1 0 340.423 3.989 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC[N@H+](Cc3ccccc3)CC2)c(F)c1 ZINC000301793476 1129086066 /nfs/dbraw/zinc/08/60/66/1129086066.db2.gz PFJSBCOIUDJTTM-UHFFFAOYSA-N 1 0 347.365 3.585 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cnc3n2CCCC3)c2cc([N+](=O)[O-])ccc21 ZINC000556608188 1123056984 /nfs/dbraw/zinc/05/69/84/1123056984.db2.gz GFCARIVXPRCBPQ-KRWDZBQOSA-N 1 0 340.427 3.640 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3ccc(F)cc3[N+](=O)[O-])cc2)CC1 ZINC000920960287 1123443337 /nfs/dbraw/zinc/44/33/37/1123443337.db2.gz QIXYMXCAERESGD-UHFFFAOYSA-N 1 0 344.390 3.619 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1 ZINC000609323421 1123475245 /nfs/dbraw/zinc/47/52/45/1123475245.db2.gz JDYCDTVLGDZHGX-OAHLLOKOSA-N 1 0 344.386 3.992 20 5 EHBDRO CC[NH+]1CCC(N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301239522 1123641973 /nfs/dbraw/zinc/64/19/73/1123641973.db2.gz FQJRVFBCPKUWRL-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(C)(C)O ZINC000609707305 1123647920 /nfs/dbraw/zinc/64/79/20/1123647920.db2.gz DYTIGFLYCWVUKH-SNVBAGLBSA-N 1 0 338.791 3.757 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC000610003516 1123711640 /nfs/dbraw/zinc/71/16/40/1123711640.db2.gz GUFJCGIUAPDLOV-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301827771 1129143517 /nfs/dbraw/zinc/14/35/17/1129143517.db2.gz FUTNLCPLXOIZSC-NVXWUHKLSA-N 1 0 333.338 3.730 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000615837654 1123885371 /nfs/dbraw/zinc/88/53/71/1123885371.db2.gz SNGNOTOVPMBHPH-QMDZLVRISA-N 1 0 337.423 3.958 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000170872737 1123928924 /nfs/dbraw/zinc/92/89/24/1123928924.db2.gz YWZZPFXVYIPLJY-UHFFFAOYSA-N 1 0 330.331 3.579 20 5 EHBDRO O[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)COCC1CC1 ZINC000238059075 1123963031 /nfs/dbraw/zinc/96/30/31/1123963031.db2.gz QFTKZMJIUSTDGT-IBGZPJMESA-N 1 0 335.447 3.870 20 5 EHBDRO Cc1cc(N2CCC(OC(C)C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543048101 1129162989 /nfs/dbraw/zinc/16/29/89/1129162989.db2.gz RZFHFZCRMPMKBE-UHFFFAOYSA-N 1 0 329.400 3.845 20 5 EHBDRO Cc1csc(C2([NH2+]CCOc3ccc([N+](=O)[O-])cc3)CCCC2)n1 ZINC000083215836 1124101646 /nfs/dbraw/zinc/10/16/46/1124101646.db2.gz FURGKARLYYREEE-UHFFFAOYSA-N 1 0 347.440 3.798 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CC1CC1)C1CCCCC1 ZINC000069079474 1124451810 /nfs/dbraw/zinc/45/18/10/1124451810.db2.gz VNNOFXHVBAUVRD-UHFFFAOYSA-N 1 0 345.443 3.886 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000069472430 1124801830 /nfs/dbraw/zinc/80/18/30/1124801830.db2.gz RHIMLUBFULEGKN-INIZCTEOSA-N 1 0 347.462 3.850 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000181815306 1125047988 /nfs/dbraw/zinc/04/79/88/1125047988.db2.gz ORJFHJBKNJGWIL-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000182001642 1125110719 /nfs/dbraw/zinc/11/07/19/1125110719.db2.gz ZBTFPVGQNAVPHV-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182566882 1125331704 /nfs/dbraw/zinc/33/17/04/1125331704.db2.gz UYMRMJWKYVWDJG-INIZCTEOSA-N 1 0 334.807 3.576 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735491153 1131350062 /nfs/dbraw/zinc/35/00/62/1131350062.db2.gz ASVDIENOEYIEQX-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)c1ccsc1 ZINC000619782816 1125403907 /nfs/dbraw/zinc/40/39/07/1125403907.db2.gz KUQSYBPGRSUMKZ-GFCCVEGCSA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccsc1 ZINC000619782826 1125404140 /nfs/dbraw/zinc/40/41/40/1125404140.db2.gz LKTQVICATSUHAH-SECBINFHSA-N 1 0 339.804 3.599 20 5 EHBDRO C[C@H]1CO[C@@H](c2ccccc2)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851866 1129216483 /nfs/dbraw/zinc/21/64/83/1129216483.db2.gz IFPUYHOMJJFCKJ-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO COc1cc(NC[C@H](c2cccs2)[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC000301870694 1129252019 /nfs/dbraw/zinc/25/20/19/1129252019.db2.gz PEFDJGXKFYZDLQ-CYBMUJFWSA-N 1 0 339.392 3.519 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181737 1129316426 /nfs/dbraw/zinc/31/64/26/1129316426.db2.gz IYXZSELUSQFTLB-CABCVRRESA-N 1 0 331.416 3.518 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H](Nc2ccccc2)C1 ZINC000116276252 1129348882 /nfs/dbraw/zinc/34/88/82/1129348882.db2.gz DLYLVDMAYDLYKL-INIZCTEOSA-N 1 0 331.803 3.935 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000499707720 1129388535 /nfs/dbraw/zinc/38/85/35/1129388535.db2.gz SCZIKZIYUCPGHY-GOSISDBHSA-N 1 0 341.411 3.925 20 5 EHBDRO CSc1ccc([C@H](CNc2nc(C)ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338833959 1129395731 /nfs/dbraw/zinc/39/57/31/1129395731.db2.gz CKFZCHOMLOOADW-INIZCTEOSA-N 1 0 346.456 3.735 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000068838344 1129402700 /nfs/dbraw/zinc/40/27/00/1129402700.db2.gz JQAJMTMZUYPWGM-INIZCTEOSA-N 1 0 333.363 3.966 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1Nc1ccc(CC[NH+]2CCCC2)cc1 ZINC000301950874 1129415824 /nfs/dbraw/zinc/41/58/24/1129415824.db2.gz HDEAODBIUZXYGR-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO Cc1nccn1-c1ccc([C@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000086187637 1129423931 /nfs/dbraw/zinc/42/39/31/1129423931.db2.gz YDYSHVRRMGCQRB-ZDUSSCGKSA-N 1 0 337.383 3.965 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000117345596 1129434971 /nfs/dbraw/zinc/43/49/71/1129434971.db2.gz NDZJMPULANTXPX-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383676 1129504173 /nfs/dbraw/zinc/50/41/73/1129504173.db2.gz CLSQHRJCGPYMRK-CHWSQXEVSA-N 1 0 326.824 3.764 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301995349 1129508809 /nfs/dbraw/zinc/50/88/09/1129508809.db2.gz SJRFABWFGQUODO-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN(Cc1ccco1)C[C@@H]1CCCO1 ZINC000092436350 1129546024 /nfs/dbraw/zinc/54/60/24/1129546024.db2.gz ZZZQJZDQMSEYMZ-JGIVAVPZSA-N 1 0 342.395 3.882 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H]([NH+]3CCCC3)C2)o1 ZINC000092756668 1129559257 /nfs/dbraw/zinc/55/92/57/1129559257.db2.gz LWTVAPMAQJQFNM-OAHLLOKOSA-N 1 0 341.411 3.525 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]([NH+]3CCCC3)C2)o1 ZINC000092756666 1129559268 /nfs/dbraw/zinc/55/92/68/1129559268.db2.gz LWTVAPMAQJQFNM-HNNXBMFYSA-N 1 0 341.411 3.525 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000331075870 1129652560 /nfs/dbraw/zinc/65/25/60/1129652560.db2.gz WDVWGTMYWVFDSU-HUUCEWRRSA-N 1 0 348.447 3.548 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@H](C)c1cccs1 ZINC000096992917 1129753750 /nfs/dbraw/zinc/75/37/50/1129753750.db2.gz VVVDCXKMHBVGSS-GFCCVEGCSA-N 1 0 333.413 3.596 20 5 EHBDRO C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302040821 1129765209 /nfs/dbraw/zinc/76/52/09/1129765209.db2.gz HYTJPRWNDBIZAP-RYUDHWBXSA-N 1 0 339.386 3.938 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@@H]32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092621 1129767713 /nfs/dbraw/zinc/76/77/13/1129767713.db2.gz QIXFPNXJCPLHQS-DDUZABMNSA-N 1 0 327.384 3.821 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1F ZINC000056197020 1129805499 /nfs/dbraw/zinc/80/54/99/1129805499.db2.gz XPPKPPRQHOSSCX-GHMZBOCLSA-N 1 0 349.337 3.551 20 5 EHBDRO CCc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000056197490 1129805512 /nfs/dbraw/zinc/80/55/12/1129805512.db2.gz ZJTMPGSPXXTJMJ-ZIAGYGMSSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000056196234 1129806292 /nfs/dbraw/zinc/80/62/92/1129806292.db2.gz QBDOCWXEWJGZFW-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000163016039 1129915873 /nfs/dbraw/zinc/91/58/73/1129915873.db2.gz JDODQEOSTWJJNY-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])CC(C)C ZINC000058621058 1129952396 /nfs/dbraw/zinc/95/23/96/1129952396.db2.gz NCRCLJWXYQRJIE-INIZCTEOSA-N 1 0 335.448 3.966 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000173321119 1130206190 /nfs/dbraw/zinc/20/61/90/1130206190.db2.gz OPFGIHAZDSFTNJ-AWEZNQCLSA-N 1 0 339.395 3.572 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCC(=O)N2 ZINC000173328747 1130207684 /nfs/dbraw/zinc/20/76/84/1130207684.db2.gz YVWLGZGODDJRDQ-QWHCGFSZSA-N 1 0 339.395 3.891 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173418595 1130228093 /nfs/dbraw/zinc/22/80/93/1130228093.db2.gz HQDQPLPGHUAJFS-WBVHZDCISA-N 1 0 325.412 3.914 20 5 EHBDRO Cc1nc(C[C@@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514441 1130228607 /nfs/dbraw/zinc/22/86/07/1130228607.db2.gz BWLNLPPWYBNUAD-ZFWWWQNUSA-N 1 0 344.415 3.610 20 5 EHBDRO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@H](C)c1cc2ccccc2o1 ZINC000174832765 1130387409 /nfs/dbraw/zinc/38/74/09/1130387409.db2.gz MGOWVQHNRDITBK-CYBMUJFWSA-N 1 0 328.372 3.621 20 5 EHBDRO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@H+](CC1CC1)C1CCCCC1 ZINC000727823336 1130600267 /nfs/dbraw/zinc/60/02/67/1130600267.db2.gz IUKKZWDSVIZYMG-UHFFFAOYSA-N 1 0 345.399 3.505 20 5 EHBDRO CCC(CC)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+](C)C ZINC000731208438 1130779227 /nfs/dbraw/zinc/77/92/27/1130779227.db2.gz GKYRAGKEAWAVPJ-CQSZACIVSA-N 1 0 336.461 3.983 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCC[N@H+](C)Cc2ccccc2)c1 ZINC000741746440 1131638799 /nfs/dbraw/zinc/63/87/99/1131638799.db2.gz JKRPWOCGACHGLF-UHFFFAOYSA-N 1 0 347.390 3.677 20 5 EHBDRO COc1ccccc1C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899314 1131883036 /nfs/dbraw/zinc/88/30/36/1131883036.db2.gz WJQCPHKTMULORU-QGZVFWFLSA-N 1 0 326.396 3.641 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901031 1131883457 /nfs/dbraw/zinc/88/34/57/1131883457.db2.gz FSVBYCSVYQUSPE-RDTXWAMCSA-N 1 0 340.423 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H](CO)CC1CCCCC1)CC2 ZINC001172901342 1131883633 /nfs/dbraw/zinc/88/36/33/1131883633.db2.gz MESWSWICLQAOAC-OALUTQOASA-N 1 0 346.471 3.763 20 5 EHBDRO C[C@@H](CCCC(C)(C)O)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901572 1131885037 /nfs/dbraw/zinc/88/50/37/1131885037.db2.gz NUCLJUYMKDKFNH-WMLDXEAASA-N 1 0 334.460 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1Cc3ccccc3C1)CC2 ZINC001172905183 1131885886 /nfs/dbraw/zinc/88/58/86/1131885886.db2.gz RFPKLVBGFFSTRE-HXUWFJFHSA-N 1 0 336.435 3.847 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172904337 1131885925 /nfs/dbraw/zinc/88/59/25/1131885925.db2.gz XEEMRJNHKKEWRE-KRWDZBQOSA-N 1 0 344.386 3.780 20 5 EHBDRO CCC(CC)N1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903495 1131886003 /nfs/dbraw/zinc/88/60/03/1131886003.db2.gz HBRRSSTVUBMJRE-MSOLQXFVSA-N 1 0 345.487 3.695 20 5 EHBDRO CC[N@H+](Cc1ccncc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172905052 1131886083 /nfs/dbraw/zinc/88/60/83/1131886083.db2.gz BUFMIZWSTBFCNC-SFHVURJKSA-N 1 0 325.412 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1Cc3ccc(F)cc3C1)CC2 ZINC001172906753 1131887345 /nfs/dbraw/zinc/88/73/45/1131887345.db2.gz ORHMFRPDMVUNQN-OALUTQOASA-N 1 0 340.398 3.738 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](F)C(F)(F)CC1)CC2 ZINC001172907903 1131887995 /nfs/dbraw/zinc/88/79/95/1131887995.db2.gz JJPLPXJAMUCTLY-GOEBONIOSA-N 1 0 342.361 3.911 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](c3ccccn3)C1)CC2 ZINC001172914251 1131902291 /nfs/dbraw/zinc/90/22/91/1131902291.db2.gz FSYUFEQUSQZVQT-ZWKOTPCHSA-N 1 0 337.423 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](C(F)(F)F)C1)CC2 ZINC001172914274 1131902671 /nfs/dbraw/zinc/90/26/71/1131902671.db2.gz GFDYQZACDTXDLG-UONOGXRCSA-N 1 0 328.334 3.726 20 5 EHBDRO CCC[N@H+](C1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922586 1131907088 /nfs/dbraw/zinc/90/70/88/1131907088.db2.gz YYFRTNICJWEKKV-KRWDZBQOSA-N 1 0 332.444 3.733 20 5 EHBDRO [NH3+]Cc1cccc2cnn([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c21 ZINC001172912791 1131917419 /nfs/dbraw/zinc/91/74/19/1131917419.db2.gz QBKJJIGLKPAQQJ-KRWDZBQOSA-N 1 0 336.395 3.523 20 5 EHBDRO CC(C)[N@H+](C1CCN(C)CC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911755 1131917804 /nfs/dbraw/zinc/91/78/04/1131917804.db2.gz FRFPFYKIEAZMRD-SFHVURJKSA-N 1 0 345.487 3.647 20 5 EHBDRO C[N@H+](CC1CCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014759 1131935902 /nfs/dbraw/zinc/93/59/02/1131935902.db2.gz AKIWUTJIAKOPEC-UHFFFAOYSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CC23CCCCC3)c1F ZINC001173184177 1131993382 /nfs/dbraw/zinc/99/33/82/1131993382.db2.gz OQBITZFOZKNJLO-MLGOLLRUSA-N 1 0 336.407 3.986 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2C[C@@H]3CCCC[C@H]3C2)c1F ZINC001173183476 1131993836 /nfs/dbraw/zinc/99/38/36/1131993836.db2.gz YTRTVRFUIPNBQQ-IHRRRGAJSA-N 1 0 336.407 3.796 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC001173219313 1132003504 /nfs/dbraw/zinc/00/35/04/1132003504.db2.gz ATMIYKWVIVZBGE-DOTOQJQBSA-N 1 0 331.460 3.522 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC001173227025 1132006354 /nfs/dbraw/zinc/00/63/54/1132006354.db2.gz MEBNCYYYPTXAAE-HFCFLWKCSA-N 1 0 345.487 3.722 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001173228223 1132007977 /nfs/dbraw/zinc/00/79/77/1132007977.db2.gz UQFRABYZHQUGCF-GOEBONIOSA-N 1 0 348.443 3.580 20 5 EHBDRO COc1cccc(CCC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214485 1132014549 /nfs/dbraw/zinc/01/45/49/1132014549.db2.gz NZAYOSLVPZGOAY-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO C[N@H+](CCc1ccc2c(c1)CCO2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000744385369 1132085577 /nfs/dbraw/zinc/08/55/77/1132085577.db2.gz YTFYYYYCRJPRFI-UHFFFAOYSA-N 1 0 346.814 3.858 20 5 EHBDRO CC(C)C[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCCC1 ZINC000746056034 1132358168 /nfs/dbraw/zinc/35/81/68/1132358168.db2.gz PPTMJKNQHLAOTG-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO CC(C)(C)O[C@@H]1C[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001174565691 1132417337 /nfs/dbraw/zinc/41/73/37/1132417337.db2.gz RPLPDEQHZZHFGR-IAGOWNOFSA-N 1 0 348.443 3.690 20 5 EHBDRO [NH3+]Cc1ccc2ncn(-c3ncnc4cc5ccccc5cc43)c2c1 ZINC001168842404 1132578044 /nfs/dbraw/zinc/57/80/44/1132578044.db2.gz UDONOBVDVRHMRT-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO CC(C)(C)c1ccc(N2CC[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169042074 1132638115 /nfs/dbraw/zinc/63/81/15/1132638115.db2.gz CTPRUWWDCVIAEY-VQIMIIECSA-N 1 0 345.487 3.552 20 5 EHBDRO CC1(C)C[C@H](Nc2cnc(Cl)cc2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169149090 1132678093 /nfs/dbraw/zinc/67/80/93/1132678093.db2.gz YWIZOFNPVRBGPH-BONVTDFDSA-N 1 0 326.828 3.599 20 5 EHBDRO CC(=O)Nc1ccc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169151472 1132679024 /nfs/dbraw/zinc/67/90/24/1132679024.db2.gz KDHTYRIVZSCKHF-KDOFPFPSSA-N 1 0 348.447 3.509 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCSC[C@@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001175698487 1132729404 /nfs/dbraw/zinc/72/94/04/1132729404.db2.gz PTBUPLDDVYUNOT-MRXNPFEDSA-N 1 0 338.473 3.957 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ncc(F)c(C)c1[N+](=O)[O-] ZINC001169686222 1132819861 /nfs/dbraw/zinc/81/98/61/1132819861.db2.gz WLGMGYUEEKYXBO-AWEZNQCLSA-N 1 0 330.363 3.677 20 5 EHBDRO O=[N+]([O-])c1cc(NCC23CC[NH+](CC2)CC3)ccc1C(F)(F)F ZINC001169796479 1132862026 /nfs/dbraw/zinc/86/20/26/1132862026.db2.gz OFDOPLDMNHTAQT-UHFFFAOYSA-N 1 0 329.322 3.511 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCc1ccc(N(C)C)cc1 ZINC001177594549 1133085036 /nfs/dbraw/zinc/08/50/36/1133085036.db2.gz KAMCAVSYZUUIRG-UHFFFAOYSA-N 1 0 327.428 3.610 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178304421 1133155308 /nfs/dbraw/zinc/15/53/08/1133155308.db2.gz GYJHXSDVWYRZIU-SCLBCKFNSA-N 1 0 332.375 3.908 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2cccc3c2OCC3)cc1[N+](=O)[O-] ZINC001179658375 1133267322 /nfs/dbraw/zinc/26/73/22/1133267322.db2.gz HAADNWPQQWGVKX-UHFFFAOYSA-N 1 0 326.396 3.943 20 5 EHBDRO COCC1(O)CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000769452591 1133293459 /nfs/dbraw/zinc/29/34/59/1133293459.db2.gz YSYUIXAAQZSACA-UHFFFAOYSA-N 1 0 335.447 3.966 20 5 EHBDRO C[C@H]1COCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455709 1133294441 /nfs/dbraw/zinc/29/44/41/1133294441.db2.gz JLWATHFTVWMJCA-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC001181807816 1133530565 /nfs/dbraw/zinc/53/05/65/1133530565.db2.gz JHGNLJJVBUEQFA-CQSZACIVSA-N 1 0 336.313 3.832 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CCCCC1 ZINC001182160038 1133580778 /nfs/dbraw/zinc/58/07/78/1133580778.db2.gz DVZAOSCJGHRFSI-AWEZNQCLSA-N 1 0 333.432 3.872 20 5 EHBDRO O=[N+]([O-])c1cc2cnn(C[NH+](CC3CC3)CC3CC3)c2c(Cl)c1 ZINC000774637532 1133814019 /nfs/dbraw/zinc/81/40/19/1133814019.db2.gz NYJQDVOQNQZYGZ-UHFFFAOYSA-N 1 0 334.807 3.677 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccccc1[N+](=O)[O-] ZINC001184046084 1133891397 /nfs/dbraw/zinc/89/13/97/1133891397.db2.gz TZPXPMJRFIUNDS-LLVKDONJSA-N 1 0 333.319 3.535 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1cccs1 ZINC000786813208 1133910342 /nfs/dbraw/zinc/91/03/42/1133910342.db2.gz LCEYAWZLYBTPRU-VEMDQMBVSA-N 1 0 332.425 3.557 20 5 EHBDRO CC1CC[NH+](CCNc2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC001184839205 1133996192 /nfs/dbraw/zinc/99/61/92/1133996192.db2.gz DOZUXUPCOUECTL-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1 ZINC001185428577 1134084410 /nfs/dbraw/zinc/08/44/10/1134084410.db2.gz CKHORGORYMHRBW-INIZCTEOSA-N 1 0 325.412 3.696 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907253 1134115643 /nfs/dbraw/zinc/11/56/43/1134115643.db2.gz GHVBJHIXGZQUFS-CXAGYDPISA-N 1 0 341.367 3.881 20 5 EHBDRO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000788469584 1134128995 /nfs/dbraw/zinc/12/89/95/1134128995.db2.gz HBRVTGGXLPWPKP-UHFFFAOYSA-N 1 0 330.359 3.907 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C(C)C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000788541894 1134139596 /nfs/dbraw/zinc/13/95/96/1134139596.db2.gz YSJFKIGVTBQSRK-RTBURBONSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788568888 1134146441 /nfs/dbraw/zinc/14/64/41/1134146441.db2.gz FDZMUIKYTPBUBN-UONOGXRCSA-N 1 0 343.427 3.858 20 5 EHBDRO C[C@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000788581213 1134147013 /nfs/dbraw/zinc/14/70/13/1134147013.db2.gz TWUBPNGSWZNPOG-ICSRJNTNSA-N 1 0 340.423 3.815 20 5 EHBDRO Cc1cccc([C@@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000788592938 1134149106 /nfs/dbraw/zinc/14/91/06/1134149106.db2.gz PLLFGWCJNRSEQY-MOPGFXCFSA-N 1 0 340.423 3.949 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788693994 1134157688 /nfs/dbraw/zinc/15/76/88/1134157688.db2.gz SVWFQPVWEVPMKG-IUUKEHGRSA-N 1 0 347.390 3.743 20 5 EHBDRO CSc1ccc(CC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788802921 1134171108 /nfs/dbraw/zinc/17/11/08/1134171108.db2.gz QSAFGLJHOHRUCN-LBPRGKRZSA-N 1 0 331.441 3.792 20 5 EHBDRO C[C@@H]([NH2+]CCC1Cc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788782451 1134174959 /nfs/dbraw/zinc/17/49/59/1134174959.db2.gz JNEDYRTZRRPBJI-CYBMUJFWSA-N 1 0 325.412 3.633 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c2ccccc21 ZINC001186873536 1134264497 /nfs/dbraw/zinc/26/44/97/1134264497.db2.gz YFNDBCKTUNACBK-HZPDHXFCSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ccccc21 ZINC001186873535 1134264920 /nfs/dbraw/zinc/26/49/20/1134264920.db2.gz YFNDBCKTUNACBK-HOTGVXAUSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390242 1134334618 /nfs/dbraw/zinc/33/46/18/1134334618.db2.gz FMGLOCPSZNTMRQ-HNNXBMFYSA-N 1 0 346.818 3.638 20 5 EHBDRO Cc1cc(N2CC[NH2+][C@H](c3ccc(Cl)cc3)C2)c([N+](=O)[O-])s1 ZINC001187931640 1134402005 /nfs/dbraw/zinc/40/20/05/1134402005.db2.gz LHBNOVHRESVZSJ-ZDUSSCGKSA-N 1 0 337.832 3.769 20 5 EHBDRO Cc1c(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790995672 1134490043 /nfs/dbraw/zinc/49/00/43/1134490043.db2.gz AEKDDVJRFYQQLP-YVMONPNESA-N 1 0 327.340 3.614 20 5 EHBDRO Cc1c(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790995671 1134490248 /nfs/dbraw/zinc/49/02/48/1134490248.db2.gz AEKDDVJRFYQQLP-VMPITWQZSA-N 1 0 327.340 3.614 20 5 EHBDRO CC(C)[N@H+](CCN(C)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527291 1134712751 /nfs/dbraw/zinc/71/27/51/1134712751.db2.gz GWQNMCMTVBAZNS-UHFFFAOYSA-N 1 0 327.428 3.942 20 5 EHBDRO CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](CC)c1ccccc1 ZINC001190581954 1134722290 /nfs/dbraw/zinc/72/22/90/1134722290.db2.gz KYXLKZUADUPMJV-KRWDZBQOSA-N 1 0 330.432 3.963 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170297195 1134737047 /nfs/dbraw/zinc/73/70/47/1134737047.db2.gz LVSLTJLJJGAMNS-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170296613 1134737172 /nfs/dbraw/zinc/73/71/72/1134737172.db2.gz GSWSBGREVBRCPL-KBPBESRZSA-N 1 0 346.402 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170296615 1134737590 /nfs/dbraw/zinc/73/75/90/1134737590.db2.gz GSWSBGREVBRCPL-UONOGXRCSA-N 1 0 346.402 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170329558 1134749329 /nfs/dbraw/zinc/74/93/29/1134749329.db2.gz RJAHVCMLLZLVEU-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO Cc1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826216 1134755890 /nfs/dbraw/zinc/75/58/90/1134755890.db2.gz GGCYZQSSEQGAPI-IBGZPJMESA-N 1 0 345.487 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCS[C@@H]3CCCC[C@H]32)cc1 ZINC001191368239 1134858010 /nfs/dbraw/zinc/85/80/10/1134858010.db2.gz YYKXFLVXSSLJKS-IAGOWNOFSA-N 1 0 336.457 3.724 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](CC(C)C)c1ccccc1C ZINC001192791201 1135060922 /nfs/dbraw/zinc/06/09/22/1135060922.db2.gz HNSDYACLEXGVDW-KRWDZBQOSA-N 1 0 330.432 3.785 20 5 EHBDRO C[C@@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000804606401 1135136122 /nfs/dbraw/zinc/13/61/22/1135136122.db2.gz LPUBJPMEHXKOHB-CHWSQXEVSA-N 1 0 348.403 3.568 20 5 EHBDRO CC[C@@H](C[N@H+](CC)CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001193594111 1135155804 /nfs/dbraw/zinc/15/58/04/1135155804.db2.gz PMYGRNUIPMSJDT-INIZCTEOSA-N 1 0 330.432 3.615 20 5 EHBDRO CN(CCc1ccc([N+](=O)[O-])cc1)C(C)(C)C[NH+]1CCCCCC1 ZINC001193615527 1135159395 /nfs/dbraw/zinc/15/93/95/1135159395.db2.gz BASXYTPZEHYURO-UHFFFAOYSA-N 1 0 333.476 3.724 20 5 EHBDRO CC(C)C1(C)CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC001193616529 1135159424 /nfs/dbraw/zinc/15/94/24/1135159424.db2.gz OHIGVGQCTJMESO-CQSZACIVSA-N 1 0 333.432 3.680 20 5 EHBDRO CC[C@H](c1ccccc1OC)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834349 1135332556 /nfs/dbraw/zinc/33/25/56/1135332556.db2.gz FXIKGSHGOYLJKN-QZTJIDSGSA-N 1 0 344.411 3.720 20 5 EHBDRO CC(C)(C)OC(=O)C[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195798122 1135471498 /nfs/dbraw/zinc/47/14/98/1135471498.db2.gz MZVOZUXUHXOGHP-KRWDZBQOSA-N 1 0 348.443 3.724 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000807926263 1135591600 /nfs/dbraw/zinc/59/16/00/1135591600.db2.gz GDEDVPAIAODRHL-CQSZACIVSA-N 1 0 333.432 3.721 20 5 EHBDRO Cc1c(C[NH2+][C@H](Cn2ccnc2)c2ccccc2)cccc1[N+](=O)[O-] ZINC001197263913 1135667044 /nfs/dbraw/zinc/66/70/44/1135667044.db2.gz GBELDLXNYHIVNF-GOSISDBHSA-N 1 0 336.395 3.631 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1cc(F)ccc1F ZINC001197661004 1135717477 /nfs/dbraw/zinc/71/74/77/1135717477.db2.gz SDHMOLGPRBPIAH-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@H](O)c1ccccc1 ZINC000808720499 1135720668 /nfs/dbraw/zinc/72/06/68/1135720668.db2.gz AASSFSBNYBCCNO-AGRHKRQWSA-N 1 0 326.396 3.684 20 5 EHBDRO CCc1noc(C)c1[C@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000808727431 1135723075 /nfs/dbraw/zinc/72/30/75/1135723075.db2.gz FEFCXYANLQKPKZ-NSHDSACASA-N 1 0 342.399 3.828 20 5 EHBDRO C[C@H](Cc1cccc(F)c1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000808727402 1135723422 /nfs/dbraw/zinc/72/34/22/1135723422.db2.gz DPEAZJWFNUAWPD-CYBMUJFWSA-N 1 0 341.386 3.979 20 5 EHBDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761688 1135729118 /nfs/dbraw/zinc/72/91/18/1135729118.db2.gz QNAMVDLEQMFLHH-OALUTQOASA-N 1 0 344.411 3.720 20 5 EHBDRO C[N@H+](CCc1ccc2c(c1)OCO2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001197826120 1135744368 /nfs/dbraw/zinc/74/43/68/1135744368.db2.gz JOWJLQCZWMWEAP-UHFFFAOYSA-N 1 0 348.786 3.651 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCSC[C@@H]1C1CC1 ZINC001198270907 1135798583 /nfs/dbraw/zinc/79/85/83/1135798583.db2.gz SKZXLKIPADJJKB-OAHLLOKOSA-N 1 0 326.849 3.966 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccccc1 ZINC000809991876 1135909442 /nfs/dbraw/zinc/90/94/42/1135909442.db2.gz OYIZJKBZQZESHH-KRWDZBQOSA-N 1 0 332.375 3.583 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)C[C@H](O)c1ccc(F)cc1 ZINC001201788360 1136066786 /nfs/dbraw/zinc/06/67/86/1136066786.db2.gz YLRVVLMOBXXPTP-YJYMSZOUSA-N 1 0 346.402 3.953 20 5 EHBDRO CC(C)(CC[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776277408 1136126481 /nfs/dbraw/zinc/12/64/81/1136126481.db2.gz OSEHCSBGLMRLJO-SFHVURJKSA-N 1 0 328.412 3.586 20 5 EHBDRO C[N@@H+](Cc1cccc2ccccc21)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278273 1136133771 /nfs/dbraw/zinc/13/37/71/1136133771.db2.gz TTWUJJGIZSTBFB-FQEVSTJZSA-N 1 0 336.391 3.913 20 5 EHBDRO Cc1ccc(C[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)s1 ZINC000776280090 1136135352 /nfs/dbraw/zinc/13/53/52/1136135352.db2.gz ZJULPOUDGYHJKM-QGZVFWFLSA-N 1 0 334.441 3.909 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)c(F)c1 ZINC000747840761 1136306873 /nfs/dbraw/zinc/30/68/73/1136306873.db2.gz SRKSQGUKILHNLQ-RBUKOAKNSA-N 1 0 344.386 3.822 20 5 EHBDRO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000776579582 1136444553 /nfs/dbraw/zinc/44/45/53/1136444553.db2.gz NRNUGIQQOYBPDW-KUHUBIRLSA-N 1 0 344.411 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@H]2Cc2ccccc2)cc1 ZINC000776581262 1136444966 /nfs/dbraw/zinc/44/49/66/1136444966.db2.gz GEQAPSOUFLUXIZ-VQTJNVASSA-N 1 0 340.423 3.725 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585596 1136448521 /nfs/dbraw/zinc/44/85/21/1136448521.db2.gz XLQDYMPCSRELSD-DOMZBBRYSA-N 1 0 349.456 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3ccc(F)cc3)CC2)cc1 ZINC000776591950 1136453040 /nfs/dbraw/zinc/45/30/40/1136453040.db2.gz MEJSCVDMXLZVSK-LJQANCHMSA-N 1 0 344.386 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593022 1136453765 /nfs/dbraw/zinc/45/37/65/1136453765.db2.gz TUKXPSXDBHFJJB-IAGOWNOFSA-N 1 0 332.787 3.729 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)ccc1[N+](=O)[O-] ZINC000852782789 1136486332 /nfs/dbraw/zinc/48/63/32/1136486332.db2.gz WEVKHNLPUGAFTH-CYBMUJFWSA-N 1 0 342.395 3.779 20 5 EHBDRO C[C@H]([NH2+]CCCn1ccc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554436 1136609683 /nfs/dbraw/zinc/60/96/83/1136609683.db2.gz ZKFLEOQPQVGXJT-AWEZNQCLSA-N 1 0 338.411 3.873 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614991 1136618868 /nfs/dbraw/zinc/61/88/68/1136618868.db2.gz FZLIGKXWBWCEJI-RNCFNFMXSA-N 1 0 332.429 3.670 20 5 EHBDRO CCC1(CC)CC[NH+](Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000776772524 1136659115 /nfs/dbraw/zinc/65/91/15/1136659115.db2.gz QLVMXIMTMQWODB-UHFFFAOYSA-N 1 0 331.420 3.508 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000173335436 1136775853 /nfs/dbraw/zinc/77/58/53/1136775853.db2.gz KANVTYPZJXJFLC-CQSZACIVSA-N 1 0 328.416 3.687 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(c3cccc(Cl)c3)CC2)c1 ZINC000819091962 1136907671 /nfs/dbraw/zinc/90/76/71/1136907671.db2.gz OXTUDJRAGGOFQA-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000819280257 1136931134 /nfs/dbraw/zinc/93/11/34/1136931134.db2.gz ZOKISBNTIPDZIO-VDZJLULYSA-N 1 0 344.386 3.693 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)cc1 ZINC000858014451 1136931292 /nfs/dbraw/zinc/93/12/92/1136931292.db2.gz LKFVOUMUNOEPGK-GOSISDBHSA-N 1 0 339.395 3.521 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)nc1 ZINC000858030879 1136933716 /nfs/dbraw/zinc/93/37/16/1136933716.db2.gz BZNAVAYJTYHFIJ-WMLDXEAASA-N 1 0 327.384 3.513 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccs1)[NH+](C)C ZINC000266017725 1136997979 /nfs/dbraw/zinc/99/79/79/1136997979.db2.gz PAFOWMDYAMEWEG-HNNXBMFYSA-N 1 0 335.429 3.518 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2C[C@@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000822807748 1137075071 /nfs/dbraw/zinc/07/50/71/1137075071.db2.gz FYFXULNJYNCFOR-GLQYFDAESA-N 1 0 328.372 3.546 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@](C)(O)c1ccccc1 ZINC000823590558 1137105174 /nfs/dbraw/zinc/10/51/74/1137105174.db2.gz DZJIOROMBNIBRQ-KRWDZBQOSA-N 1 0 334.803 3.588 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000823659960 1137108497 /nfs/dbraw/zinc/10/84/97/1137108497.db2.gz AQTZZBJJYXINDZ-KRWDZBQOSA-N 1 0 334.391 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)cc1Cl ZINC000862540662 1137149460 /nfs/dbraw/zinc/14/94/60/1137149460.db2.gz IYIQTBSQHDEAIX-CQSZACIVSA-N 1 0 332.787 3.943 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000824798236 1137152894 /nfs/dbraw/zinc/15/28/94/1137152894.db2.gz ACBNPYFEJVQBBT-WBMJQRKESA-N 1 0 326.824 3.789 20 5 EHBDRO COc1ccc(C[NH2+]CC[C@@]2(C)CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC000824971677 1137160562 /nfs/dbraw/zinc/16/05/62/1137160562.db2.gz WPTQCLYSRANCDS-ZDUSSCGKSA-N 1 0 333.215 3.667 20 5 EHBDRO CCc1nc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057481 1137163697 /nfs/dbraw/zinc/16/36/97/1137163697.db2.gz PFEDLNFGUIUIQL-XJKSGUPXSA-N 1 0 329.400 3.646 20 5 EHBDRO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000844255943 1137208167 /nfs/dbraw/zinc/20/81/67/1137208167.db2.gz RESOZOCLSASLNR-CQSZACIVSA-N 1 0 339.395 3.543 20 5 EHBDRO C[NH+]1CCC2(CCCN(c3ccc([N+](=O)[O-])cc3C(F)F)C2)CC1 ZINC000865754134 1137308672 /nfs/dbraw/zinc/30/86/72/1137308672.db2.gz SOQHCQJFRMEFFJ-UHFFFAOYSA-N 1 0 339.386 3.845 20 5 EHBDRO Cc1nn(C(C)(C)C)c(C)c1C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000865787122 1137311862 /nfs/dbraw/zinc/31/18/62/1137311862.db2.gz IIGFPUVCRFXDTB-UHFFFAOYSA-N 1 0 330.432 3.761 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866282124 1137342594 /nfs/dbraw/zinc/34/25/94/1137342594.db2.gz XVMUOGYPXLMNCZ-LLVKDONJSA-N 1 0 335.379 3.568 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CCOCC2 ZINC000866353244 1137348483 /nfs/dbraw/zinc/34/84/83/1137348483.db2.gz FCRGBBLKSQFHPZ-GUYCJALGSA-N 1 0 336.407 3.604 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@](C)(O)c1ccccc1 ZINC000866383414 1137350687 /nfs/dbraw/zinc/35/06/87/1137350687.db2.gz LSPDJWYXQBNCKO-BIENJYKASA-N 1 0 346.402 3.551 20 5 EHBDRO Cc1cnc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])c(C)c1 ZINC000866384264 1137350907 /nfs/dbraw/zinc/35/09/07/1137350907.db2.gz JHMRAIMNCFINOT-AWEZNQCLSA-N 1 0 331.391 3.509 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866610985 1137368935 /nfs/dbraw/zinc/36/89/35/1137368935.db2.gz WZNNNRSDGCGVAD-UFGOTCBOSA-N 1 0 329.322 3.725 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1c2ccccc2[C@H]([NH3+])C1(C)C ZINC000867989024 1137392714 /nfs/dbraw/zinc/39/27/14/1137392714.db2.gz ZWTCCYLYYJTSBX-KRWDZBQOSA-N 1 0 339.395 3.650 20 5 EHBDRO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CC[NH2+]CC1 ZINC000868003403 1137393754 /nfs/dbraw/zinc/39/37/54/1137393754.db2.gz DYVJPFUPZGJXIY-CQSZACIVSA-N 1 0 333.435 3.506 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000773011006 1137459185 /nfs/dbraw/zinc/45/91/85/1137459185.db2.gz QQJVHGFYNSZALU-YVEFUNNKSA-N 1 0 334.803 3.941 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1c(F)cccc1F ZINC000773016427 1137459602 /nfs/dbraw/zinc/45/96/02/1137459602.db2.gz YKEBDFVJJNEROT-BDJLRTHQSA-N 1 0 336.338 3.566 20 5 EHBDRO [NH3+]C[C@@H]1COc2ccccc2N1c1cc2ccccc2c([N+](=O)[O-])c1 ZINC001171398772 1137470733 /nfs/dbraw/zinc/47/07/33/1137470733.db2.gz WPUBUDZBWCCBTC-OAHLLOKOSA-N 1 0 335.363 3.606 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@@H+](C2CCC2)C1 ZINC000795122226 1137493109 /nfs/dbraw/zinc/49/31/09/1137493109.db2.gz QUPKPWHXWIJCLP-CYBMUJFWSA-N 1 0 337.851 3.554 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCCCC[NH+]2CCCC2)c1 ZINC000266097491 1137502133 /nfs/dbraw/zinc/50/21/33/1137502133.db2.gz QZNBEJRBCLCPAB-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017904 1137564788 /nfs/dbraw/zinc/56/47/88/1137564788.db2.gz GUWQZFMHHLPXOD-NHYWBVRUSA-N 1 0 337.420 3.749 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000872061537 1137568826 /nfs/dbraw/zinc/56/88/26/1137568826.db2.gz YUEWGYNYYAYFRN-DZGCQCFKSA-N 1 0 326.824 3.586 20 5 EHBDRO C[C@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070709 1137569654 /nfs/dbraw/zinc/56/96/54/1137569654.db2.gz HHMBKSZYOUBVRQ-BLLLJJGKSA-N 1 0 349.381 3.827 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000872129537 1137573112 /nfs/dbraw/zinc/57/31/12/1137573112.db2.gz KNPALFQYKYCGHW-LJISPDSOSA-N 1 0 334.416 3.613 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)C[C@@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000873096944 1137590029 /nfs/dbraw/zinc/59/00/29/1137590029.db2.gz BLURANRJZWIGRV-KPZWWZAWSA-N 1 0 332.375 3.644 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCc2cnn(C(C)C)c2C1 ZINC000873113774 1137590277 /nfs/dbraw/zinc/59/02/77/1137590277.db2.gz KKZPZMZJHAMWBG-INIZCTEOSA-N 1 0 342.443 3.636 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000125441225 1137634531 /nfs/dbraw/zinc/63/45/31/1137634531.db2.gz PIXRFKBFQPJWCE-MOPGFXCFSA-N 1 0 344.411 3.768 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[C@@]12C[C@@H]1CCCC2 ZINC000877686705 1137685872 /nfs/dbraw/zinc/68/58/72/1137685872.db2.gz UYJZXCNCQIZNEM-YZVOILCLSA-N 1 0 344.459 3.517 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000877730292 1137687074 /nfs/dbraw/zinc/68/70/74/1137687074.db2.gz USMMKZLNCUGPNI-MCMMXHMISA-N 1 0 328.349 3.716 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877936029 1137696244 /nfs/dbraw/zinc/69/62/44/1137696244.db2.gz QLYJIGUVYYNEDL-SNVBAGLBSA-N 1 0 336.779 3.673 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054897 1137700905 /nfs/dbraw/zinc/70/09/05/1137700905.db2.gz NAHCIYHOLCLRLE-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO Cn1cc(C[NH2+][C@H](c2ccccc2)C2CCCCC2)c([N+](=O)[O-])n1 ZINC000878327023 1137711166 /nfs/dbraw/zinc/71/11/66/1137711166.db2.gz XJANHTTVJIFZLQ-QGZVFWFLSA-N 1 0 328.416 3.740 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC3(CCOCC3)CO2)cc1[N+](=O)[O-] ZINC000878371851 1137713243 /nfs/dbraw/zinc/71/32/43/1137713243.db2.gz SFKPWSSTBIUMON-WBVHZDCISA-N 1 0 348.443 3.530 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000878446549 1137716273 /nfs/dbraw/zinc/71/62/73/1137716273.db2.gz GNYSIRQZZLGKCH-MBNYWOFBSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+](CCC2CC2)CC2CC2)o1 ZINC000878995337 1137734732 /nfs/dbraw/zinc/73/47/32/1137734732.db2.gz BXTILWPGZSSJGU-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@@H](NCc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880097043 1137768013 /nfs/dbraw/zinc/76/80/13/1137768013.db2.gz YUCHMMIMFZFENE-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000129715660 1137828944 /nfs/dbraw/zinc/82/89/44/1137828944.db2.gz USRPKIVPLFKPMH-QGZVFWFLSA-N 1 0 329.356 3.786 20 5 EHBDRO CC(C)(C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)CC(F)F ZINC000883258853 1137851104 /nfs/dbraw/zinc/85/11/04/1137851104.db2.gz RHSMCYXAWFHAAA-UHFFFAOYSA-N 1 0 341.402 3.835 20 5 EHBDRO COC[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000883317901 1137854543 /nfs/dbraw/zinc/85/45/43/1137854543.db2.gz ZTHVBAHHWKXUQB-BETUJISGSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCC3(COC3)CC1)CCCC2 ZINC000883382944 1137858585 /nfs/dbraw/zinc/85/85/85/1137858585.db2.gz QMSNIYPBZMQNRJ-GOSISDBHSA-N 1 0 330.428 3.911 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000119294074 1137940273 /nfs/dbraw/zinc/94/02/73/1137940273.db2.gz LNVVYNVYKYFIAO-DJIMGWMZSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CC1CCC(C(F)(F)F)CC1)CC2 ZINC000332498162 1137945625 /nfs/dbraw/zinc/94/56/25/1137945625.db2.gz CHKVCHPOYKFPGT-UHFFFAOYSA-N 1 0 343.349 3.717 20 5 EHBDRO Cc1cc(N2CCC[C@H](c3ncccn3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000884711550 1137970027 /nfs/dbraw/zinc/97/00/27/1137970027.db2.gz RGSYIHHSKRVVFV-AWEZNQCLSA-N 1 0 349.394 3.625 20 5 EHBDRO CO[C@@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000886057880 1138036338 /nfs/dbraw/zinc/03/63/38/1138036338.db2.gz ZZJUWEJYGYUSDR-HUUCEWRRSA-N 1 0 326.824 3.728 20 5 EHBDRO CO[C@H]1CCC[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000886119140 1138048784 /nfs/dbraw/zinc/04/87/84/1138048784.db2.gz YTXNUZGTDFJLFD-HOCLYGCPSA-N 1 0 331.416 3.556 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CC[C@@]3(CO[C@H](C)C3)O2)cc1[N+](=O)[O-] ZINC000886333432 1138068575 /nfs/dbraw/zinc/06/85/75/1138068575.db2.gz IJHZSSOPARUFMP-SIXWZSSISA-N 1 0 348.443 3.534 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](C)CC1 ZINC000068837698 1138086300 /nfs/dbraw/zinc/08/63/00/1138086300.db2.gz RXSDBQYYTWVLNO-OLZOCXBDSA-N 1 0 330.388 3.828 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000074994520 1138125513 /nfs/dbraw/zinc/12/55/13/1138125513.db2.gz WHOXWNJRDKBCFS-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO CCc1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000089508948 1138200109 /nfs/dbraw/zinc/20/01/09/1138200109.db2.gz DQYDFCICPCUZCZ-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO CCOC[C@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093838651 1138241899 /nfs/dbraw/zinc/24/18/99/1138241899.db2.gz LPGNCMNLBWFXSX-ZDUSSCGKSA-N 1 0 347.440 3.577 20 5 EHBDRO C[N@@H+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000093871974 1138242373 /nfs/dbraw/zinc/24/23/73/1138242373.db2.gz GOLUCJWDQHUKSH-VQHVLOKHSA-N 1 0 329.444 3.558 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(n2c(C)ccc2C)CC1 ZINC000337637300 1138629479 /nfs/dbraw/zinc/62/94/79/1138629479.db2.gz CPHBJKPKTAFGQP-UHFFFAOYSA-N 1 0 343.427 3.859 20 5 EHBDRO Cc1nccn1CCCNc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000337820728 1138675827 /nfs/dbraw/zinc/67/58/27/1138675827.db2.gz QPLZDLFXPGLZTF-UHFFFAOYSA-N 1 0 332.404 3.779 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(COC)cc2)cc1[N+](=O)[O-] ZINC000152735884 1139106284 /nfs/dbraw/zinc/10/62/84/1139106284.db2.gz STVINMOGGWVGAB-AWEZNQCLSA-N 1 0 344.411 3.991 20 5 EHBDRO C[N@H+]1[C@@H]2CC[C@H]1CCN(C(=O)c1cc3ccccc3c3cccnc13)C2 ZINC000174628443 1139431781 /nfs/dbraw/zinc/43/17/81/1139431781.db2.gz YPUYEFJSIWTGBZ-DLBZAZTESA-N 1 0 345.446 3.697 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313948 1139583162 /nfs/dbraw/zinc/58/31/62/1139583162.db2.gz SBUIGHYUTUAKNH-XEUAFLOLSA-N 1 0 348.443 3.876 20 5 EHBDRO C[C@@H](c1ccccn1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000177353498 1139615774 /nfs/dbraw/zinc/61/57/74/1139615774.db2.gz PZWKQYWUMLCTOO-AWEZNQCLSA-N 1 0 327.384 3.594 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H](C)c1ccccc1 ZINC000177582541 1139627761 /nfs/dbraw/zinc/62/77/61/1139627761.db2.gz SVKHYEUOFASZQW-UONOGXRCSA-N 1 0 342.395 3.743 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000179219029 1139742585 /nfs/dbraw/zinc/74/25/85/1139742585.db2.gz ZPACPJRVBCFVHC-HOCLYGCPSA-N 1 0 333.435 3.587 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c(O)c2)cc1[N+](=O)[O-] ZINC000179416476 1139756291 /nfs/dbraw/zinc/75/62/91/1139756291.db2.gz NLWFYVJKNJSDQV-LBPRGKRZSA-N 1 0 346.383 3.559 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)cc1[N+](=O)[O-] ZINC000180884630 1139870547 /nfs/dbraw/zinc/87/05/47/1139870547.db2.gz DHWVUOKNRJYCNN-UHFFFAOYSA-N 1 0 329.400 3.765 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1ccc(OC(C)(C)C)nc1 ZINC000183655589 1140051882 /nfs/dbraw/zinc/05/18/82/1140051882.db2.gz SXKPGTOSVLOYJW-UHFFFAOYSA-N 1 0 329.400 3.765 20 5 EHBDRO Cc1c(CN[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722960 1140166355 /nfs/dbraw/zinc/16/63/55/1140166355.db2.gz DVMCVPBQPOBQTI-NVXWUHKLSA-N 1 0 331.460 3.646 20 5 EHBDRO CC1(C)CCC[C@@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000191865000 1140490199 /nfs/dbraw/zinc/49/01/99/1140490199.db2.gz HZKVEPCLBOZDOW-INIZCTEOSA-N 1 0 329.400 3.961 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000192133600 1140505466 /nfs/dbraw/zinc/50/54/66/1140505466.db2.gz RPRSQONPXYFASI-ZWKOTPCHSA-N 1 0 348.349 3.535 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCS[C@@H](C)CC1 ZINC000192175638 1140508429 /nfs/dbraw/zinc/50/84/29/1140508429.db2.gz ZPILTHLLYYXTRN-RYUDHWBXSA-N 1 0 348.428 3.533 20 5 EHBDRO COC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000192994565 1140558556 /nfs/dbraw/zinc/55/85/56/1140558556.db2.gz UMBOREFCTZYDQF-RTBURBONSA-N 1 0 326.396 3.950 20 5 EHBDRO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268915311 1141025404 /nfs/dbraw/zinc/02/54/04/1141025404.db2.gz NQSVMYSIQZMYNX-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000269386770 1141102236 /nfs/dbraw/zinc/10/22/36/1141102236.db2.gz WKCQGZFHHTUAMZ-ZFWWWQNUSA-N 1 0 336.457 3.690 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC[C@H](O)CC3)s2)cc1 ZINC000269897896 1141155393 /nfs/dbraw/zinc/15/53/93/1141155393.db2.gz YBLVDXSTFJBXDT-CTYIDZIISA-N 1 0 332.425 3.716 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000270020763 1141169060 /nfs/dbraw/zinc/16/90/60/1141169060.db2.gz OKTHIYRHTOCWCI-UWWQBHOKSA-N 1 0 344.411 3.531 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025739 1141296393 /nfs/dbraw/zinc/29/63/93/1141296393.db2.gz BBXDJHABSSFHEL-SJKOYZFVSA-N 1 0 348.374 3.517 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2csc([N+](=O)[O-])c2)CC1 ZINC000271303641 1141343166 /nfs/dbraw/zinc/34/31/66/1141343166.db2.gz UZMFCMJPWAMAAQ-UHFFFAOYSA-N 1 0 340.445 3.646 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271558773 1141397991 /nfs/dbraw/zinc/39/79/91/1141397991.db2.gz WIBDAPHEKCVWEI-KBPBESRZSA-N 1 0 346.456 3.856 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000271562454 1141398362 /nfs/dbraw/zinc/39/83/62/1141398362.db2.gz WBJNJPDVSNYGHO-KGLIPLIRSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153894085 1014487274 /nfs/dbraw/zinc/48/72/74/1014487274.db2.gz DOONYQSNLXFHDE-RYUDHWBXSA-N 1 0 347.415 3.880 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCCN1CC[C@@](F)(c2ccccc2)C1 ZINC000584303776 1032100681 /nfs/dbraw/zinc/10/06/81/1032100681.db2.gz PFHSYYDYFVXYGV-SFHVURJKSA-N 1 0 330.359 3.544 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000120257912 1014833775 /nfs/dbraw/zinc/83/37/75/1014833775.db2.gz UKFOADFITYVAEJ-KUHUBIRLSA-N 1 0 344.411 3.686 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000120258222 1014834399 /nfs/dbraw/zinc/83/43/99/1014834399.db2.gz UKFOADFITYVAEJ-AUUYWEPGSA-N 1 0 344.411 3.686 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000430219833 1015087235 /nfs/dbraw/zinc/08/72/35/1015087235.db2.gz NWZFVASZVGGNBO-XEKQOVJPSA-N 1 0 342.395 3.646 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000157583421 1015111432 /nfs/dbraw/zinc/11/14/32/1015111432.db2.gz ZASXXSRRFQTSIN-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1cc(NC[C@H](c2ccco2)[NH+](C)C)c2cccc([N+](=O)[O-])c2n1 ZINC000302048355 1015123405 /nfs/dbraw/zinc/12/34/05/1015123405.db2.gz ZBKDWUKXQQKVCZ-MRXNPFEDSA-N 1 0 340.383 3.759 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(-c2ncon2)cc1 ZINC001167088912 1015621168 /nfs/dbraw/zinc/62/11/68/1015621168.db2.gz GALOUJPDEYMKCQ-UHFFFAOYSA-N 1 0 337.447 3.945 20 5 EHBDRO CC[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cc2Br)CC1 ZINC000233473071 1015629123 /nfs/dbraw/zinc/62/91/23/1015629123.db2.gz RCMFNMYGYKXBLM-UHFFFAOYSA-N 1 0 342.237 3.562 20 5 EHBDRO COc1ccc(-c2ccc(C[N@@H+]3CCSC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000536684535 1032122727 /nfs/dbraw/zinc/12/27/27/1032122727.db2.gz JVVQCCIODJOGLL-LBPRGKRZSA-N 1 0 348.424 3.801 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000091919186 1015838705 /nfs/dbraw/zinc/83/87/05/1015838705.db2.gz YHXBEXIINQZPCJ-CQSZACIVSA-N 1 0 328.416 3.617 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]1CCO ZINC000275145598 1016094559 /nfs/dbraw/zinc/09/45/59/1016094559.db2.gz UGNYDZRTFKUALJ-RRFJBIMHSA-N 1 0 338.473 3.606 20 5 EHBDRO CCOc1cc(NC[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471250936 1016130855 /nfs/dbraw/zinc/13/08/55/1016130855.db2.gz PGEYHLMWIPUGHN-QGZVFWFLSA-N 1 0 329.400 3.708 20 5 EHBDRO Cc1ccc(C[C@@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)cc1 ZINC001167263976 1016867067 /nfs/dbraw/zinc/86/70/67/1016867067.db2.gz HAZSLYQOCFOPDU-KRWDZBQOSA-N 1 0 325.412 3.753 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449107392 1032186150 /nfs/dbraw/zinc/18/61/50/1032186150.db2.gz MFWTZCUIKWYVSV-OAHLLOKOSA-N 1 0 340.423 3.856 20 5 EHBDRO CCOc1cc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)ccc1O ZINC000459476202 1032190868 /nfs/dbraw/zinc/19/08/68/1032190868.db2.gz HACLXHJXLLSOTB-UHFFFAOYSA-N 1 0 330.384 3.724 20 5 EHBDRO CCC(CC)[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1cccs1 ZINC000538174867 1032196481 /nfs/dbraw/zinc/19/64/81/1032196481.db2.gz GYMOYMZMZNJOIU-KRWDZBQOSA-N 1 0 349.456 3.585 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593524 1032314568 /nfs/dbraw/zinc/31/45/68/1032314568.db2.gz VOYBOPWMXNVOAE-SCLBCKFNSA-N 1 0 334.416 3.710 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000449201846 1032327032 /nfs/dbraw/zinc/32/70/32/1032327032.db2.gz HOGPUSUSTRTBSV-ZTNFWEORSA-N 1 0 339.439 3.561 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2C[C@H](OCC(C)C)C2(C)C)cc1[N+](=O)[O-] ZINC000538399233 1032329332 /nfs/dbraw/zinc/32/93/32/1032329332.db2.gz ZZSMMZQNWVNZNI-SJORKVTESA-N 1 0 336.432 3.533 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](OCC(C)C)C2(C)C)cc1[N+](=O)[O-] ZINC000538399232 1032328582 /nfs/dbraw/zinc/32/85/82/1032328582.db2.gz ZZSMMZQNWVNZNI-IRXDYDNUSA-N 1 0 336.432 3.533 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835051 1032330149 /nfs/dbraw/zinc/33/01/49/1032330149.db2.gz ZGSGKAUHUBYGMZ-IAGOWNOFSA-N 1 0 333.476 3.922 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc(F)c(F)c1F ZINC000449232189 1032349412 /nfs/dbraw/zinc/34/94/12/1032349412.db2.gz HFECUDVUGQHVGX-LLVKDONJSA-N 1 0 338.329 3.775 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H](c1ccccc1)N(C)C ZINC000449251090 1032358767 /nfs/dbraw/zinc/35/87/67/1032358767.db2.gz QSGBNJMILMKJQN-JXXFODFXSA-N 1 0 341.455 3.807 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000449266802 1032386629 /nfs/dbraw/zinc/38/66/29/1032386629.db2.gz XMHOWFQNZBJAIP-XFQXTVEOSA-N 1 0 340.423 3.893 20 5 EHBDRO CC[N@H+](CCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)CC(C)C ZINC000536891957 1032401668 /nfs/dbraw/zinc/40/16/68/1032401668.db2.gz BGKNRRQAXIFAPW-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO CCC[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000459769287 1032460438 /nfs/dbraw/zinc/46/04/38/1032460438.db2.gz BPZUGVUUQDYUHW-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000537029088 1032493630 /nfs/dbraw/zinc/49/36/30/1032493630.db2.gz FZVONEHQGDHXAA-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO CC/C=C\C[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000449453261 1032569620 /nfs/dbraw/zinc/56/96/20/1032569620.db2.gz HSCCJNROLSSWCZ-PLNGDYQASA-N 1 0 348.321 3.600 20 5 EHBDRO C[C@H]1CCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000761234300 1032609162 /nfs/dbraw/zinc/60/91/62/1032609162.db2.gz KVNVPTVIVFDGBW-AWEZNQCLSA-N 1 0 326.400 3.553 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656208 1017107863 /nfs/dbraw/zinc/10/78/63/1017107863.db2.gz HZWKOUGIYNJYFY-HIFRSBDPSA-N 1 0 345.468 3.883 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnn4ccccc34)C2)cc1 ZINC000449501188 1032680932 /nfs/dbraw/zinc/68/09/32/1032680932.db2.gz PGAWOHGJYQDMGZ-INIZCTEOSA-N 1 0 336.395 3.622 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000471345195 1017140952 /nfs/dbraw/zinc/14/09/52/1017140952.db2.gz HXPSEAPMKOWEKC-OAHLLOKOSA-N 1 0 335.451 3.848 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449507235 1032692038 /nfs/dbraw/zinc/69/20/38/1032692038.db2.gz STLDSXKLSMUSKY-GUYCJALGSA-N 1 0 330.384 3.712 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947346 1017346518 /nfs/dbraw/zinc/34/65/18/1017346518.db2.gz KSHWCMUUFSKSCW-STQMWFEESA-N 1 0 331.441 3.553 20 5 EHBDRO C[C@H]([NH3+])[C@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415013061 1017408875 /nfs/dbraw/zinc/40/88/75/1017408875.db2.gz JYXHIEIEDDZFGA-RYUDHWBXSA-N 1 0 349.818 3.866 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916479 1017429157 /nfs/dbraw/zinc/42/91/57/1017429157.db2.gz RKWFYLWZHTWTCX-INIZCTEOSA-N 1 0 344.386 3.677 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000610285212 1017658591 /nfs/dbraw/zinc/65/85/91/1017658591.db2.gz PNKBZQBEYRPYEL-HNNXBMFYSA-N 1 0 331.441 3.615 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@H+]3C[C@@H]4CCCC[C@@H]4C3)o2)c1 ZINC000177528974 1017687404 /nfs/dbraw/zinc/68/74/04/1017687404.db2.gz ZKEDRILMUOVMMF-IYBDPMFKSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000118849886 1017993463 /nfs/dbraw/zinc/99/34/63/1017993463.db2.gz WALCDVDUTBFCFG-XPKDYRNWSA-N 1 0 342.399 3.798 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H](C)O ZINC000449533524 1032743582 /nfs/dbraw/zinc/74/35/82/1032743582.db2.gz BEPUVCSXLRTWLQ-ZUZCIYMTSA-N 1 0 338.791 3.757 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000449535682 1032748279 /nfs/dbraw/zinc/74/82/79/1032748279.db2.gz HWYZFFACQNTKML-GVKBTVHKSA-N 1 0 339.395 3.513 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCN(C)Cc1ccccc1 ZINC000468627384 1018514025 /nfs/dbraw/zinc/51/40/25/1018514025.db2.gz MWYPTYSZMIMSFL-LGMDPLHJSA-N 1 0 339.439 3.720 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000594008454 1032770864 /nfs/dbraw/zinc/77/08/64/1032770864.db2.gz OXEPKSFPMUSJKW-MRXNPFEDSA-N 1 0 341.411 3.557 20 5 EHBDRO C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399521 1018584721 /nfs/dbraw/zinc/58/47/21/1018584721.db2.gz JGULALVSRFBCNA-KSSFIOAISA-N 1 0 343.427 3.627 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000560847588 1018616743 /nfs/dbraw/zinc/61/67/43/1018616743.db2.gz NYDKDSIZEAASEK-YGRLFVJLSA-N 1 0 341.839 3.990 20 5 EHBDRO C[NH+]1CCC(C)(CNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000226356492 1018779629 /nfs/dbraw/zinc/77/96/29/1018779629.db2.gz MUJJKLDUWOPTFO-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000594019408 1032789428 /nfs/dbraw/zinc/78/94/28/1032789428.db2.gz KKXOSOVYSIVDNN-IUODEOHRSA-N 1 0 345.374 3.802 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)o1 ZINC000592415610 1032792145 /nfs/dbraw/zinc/79/21/45/1032792145.db2.gz WBLQEYBYXQNROP-UHFFFAOYSA-N 1 0 331.372 3.590 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000182314080 1018964764 /nfs/dbraw/zinc/96/47/64/1018964764.db2.gz GJOSTEKFVXNILK-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO CC(C)C(C)(C)C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000275823011 1018993554 /nfs/dbraw/zinc/99/35/54/1018993554.db2.gz FKLGTANDGRXWND-MRXNPFEDSA-N 1 0 330.432 3.690 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610420499 1019021993 /nfs/dbraw/zinc/02/19/93/1019021993.db2.gz YNONZBZRQRRWKV-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000610420498 1019022714 /nfs/dbraw/zinc/02/27/14/1019022714.db2.gz YNONZBZRQRRWKV-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)[nH]c1C(C)C ZINC000894192633 1019104458 /nfs/dbraw/zinc/10/44/58/1019104458.db2.gz HAMSXTAQVADYMU-GFCCVEGCSA-N 1 0 345.399 3.684 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN(C2CC2)C2CC[NH2+]CC2)o1 ZINC000592424353 1032812092 /nfs/dbraw/zinc/81/20/92/1032812092.db2.gz KVSGLCQQKUZPFP-UHFFFAOYSA-N 1 0 341.411 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2cccc(Cl)c2)[NH+]2CCCC2)cn1 ZINC000513168181 1019360311 /nfs/dbraw/zinc/36/03/11/1019360311.db2.gz XVSHDEZTVOEYMM-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnn(C)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151144377 1019378159 /nfs/dbraw/zinc/37/81/59/1019378159.db2.gz VYWYNTZOYSGXFA-GFCCVEGCSA-N 1 0 342.424 3.908 20 5 EHBDRO CCC[C@H]([NH2+]CC[C@@H](OC)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000345497719 1020319281 /nfs/dbraw/zinc/31/92/81/1020319281.db2.gz ZVLLIPJWAGXFTG-UONOGXRCSA-N 1 0 334.338 3.993 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC1CCN(c2ccccc2)CC1 ZINC000280709668 1020598211 /nfs/dbraw/zinc/59/82/11/1020598211.db2.gz XCBMBUSNGVEOFG-UHFFFAOYSA-N 1 0 325.412 3.601 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H](C)Cc1ccc(C)cc1 ZINC001167453970 1020658744 /nfs/dbraw/zinc/65/87/44/1020658744.db2.gz PKACUIPBTDIAQD-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO CC(C)CCC[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602505750 1032940837 /nfs/dbraw/zinc/94/08/37/1032940837.db2.gz YKIDLHBNNZYGME-OAHLLOKOSA-N 1 0 334.464 3.763 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436042 1021147987 /nfs/dbraw/zinc/14/79/87/1021147987.db2.gz YAQLVGKIUURGKP-GDBMZVCRSA-N 1 0 336.395 3.953 20 5 EHBDRO C[C@@H](O)CC(C)(C)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602549292 1032959586 /nfs/dbraw/zinc/95/95/86/1032959586.db2.gz AGTBVGRAMIIVPT-SNVBAGLBSA-N 1 0 334.338 3.500 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000341253568 1021195154 /nfs/dbraw/zinc/19/51/54/1021195154.db2.gz CPPSBXJCKRBVCR-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000439262693 1021286079 /nfs/dbraw/zinc/28/60/79/1021286079.db2.gz PSDDLPZWYRTDEL-LJQANCHMSA-N 1 0 328.412 3.758 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000518582800 1021348836 /nfs/dbraw/zinc/34/88/36/1021348836.db2.gz XCMDCXZVEIAVMD-MRXNPFEDSA-N 1 0 325.412 3.868 20 5 EHBDRO C[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1ccccc1-c1ccccc1 ZINC000157899295 1021515198 /nfs/dbraw/zinc/51/51/98/1021515198.db2.gz OGJYAFZVVWUMPX-UHFFFAOYSA-N 1 0 336.395 3.590 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc3N(C)C2)cc1[N+](=O)[O-] ZINC000437074596 1021527402 /nfs/dbraw/zinc/52/74/02/1021527402.db2.gz DEBPLANPCNMCMX-HOTGVXAUSA-N 1 0 339.439 3.863 20 5 EHBDRO CCN1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518771713 1021543473 /nfs/dbraw/zinc/54/34/73/1021543473.db2.gz RHWHKDYSAGRNQJ-INIZCTEOSA-N 1 0 345.468 3.897 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1(c2ccccc2)CC1 ZINC000509608508 1021551772 /nfs/dbraw/zinc/55/17/72/1021551772.db2.gz MBNNDFMKUCWRMN-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1c(OC)cccc1[N+](=O)[O-])c1ccco1 ZINC000519619942 1021576208 /nfs/dbraw/zinc/57/62/08/1021576208.db2.gz XFRJDQVDIRBGQS-AWEZNQCLSA-N 1 0 333.388 3.691 20 5 EHBDRO Cn1cc(C[N@H+](C)C[C@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519670679 1021611134 /nfs/dbraw/zinc/61/11/34/1021611134.db2.gz LOQQJBXNYAZFBP-HNNXBMFYSA-N 1 0 340.427 3.783 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c1 ZINC000090910080 1021689921 /nfs/dbraw/zinc/68/99/21/1021689921.db2.gz CVDYBCLHXPIPCW-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920826 1021819313 /nfs/dbraw/zinc/81/93/13/1021819313.db2.gz BWEJWJDXYGWFEP-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)c1ccc(C(=O)NC2CC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC000439974126 1021871342 /nfs/dbraw/zinc/87/13/42/1021871342.db2.gz PFNHWNLLBPODKD-UHFFFAOYSA-N 1 0 347.459 3.757 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602626183 1033019932 /nfs/dbraw/zinc/01/99/32/1033019932.db2.gz JLMKWIAGIAHWJH-HUUCEWRRSA-N 1 0 332.448 3.517 20 5 EHBDRO C[N@@H+]1CCCC[C@H]1CCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000924365987 1022087509 /nfs/dbraw/zinc/08/75/09/1022087509.db2.gz MWULXJGHBLTKQO-ZDUSSCGKSA-N 1 0 348.424 3.841 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]c(=O)oc21 ZINC000891624810 1022142444 /nfs/dbraw/zinc/14/24/44/1022142444.db2.gz HFUJMHXUFJERJS-UHFFFAOYSA-N 1 0 341.367 3.852 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@]2(C1)CCCOC2 ZINC000602651340 1033039893 /nfs/dbraw/zinc/03/98/93/1033039893.db2.gz HEHDOBKMWJQISD-HNNXBMFYSA-N 1 0 344.333 3.616 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187564728 1022337444 /nfs/dbraw/zinc/33/74/44/1022337444.db2.gz NNPPACQJHLSKBS-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000441424528 1022461725 /nfs/dbraw/zinc/46/17/25/1022461725.db2.gz IVMYTRMCMZNUPY-HNNXBMFYSA-N 1 0 328.412 3.709 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1cnc(C2CC2)o1 ZINC000449703167 1033067827 /nfs/dbraw/zinc/06/78/27/1033067827.db2.gz FNCJFKBSKLQGER-YOEHRIQHSA-N 1 0 341.411 3.961 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000438541927 1022804422 /nfs/dbraw/zinc/80/44/22/1022804422.db2.gz RZRCXGISBNDTCE-PWSUYJOCSA-N 1 0 344.358 3.526 20 5 EHBDRO COc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1OC ZINC000165960155 1022921017 /nfs/dbraw/zinc/92/10/17/1022921017.db2.gz VRARMQZRVGAAJR-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@H]1COCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000091800348 1023107366 /nfs/dbraw/zinc/10/73/66/1023107366.db2.gz QJZKAABZJAGKOO-NSHDSACASA-N 1 0 336.775 3.729 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1cccc(O)c1 ZINC000178376381 1023133309 /nfs/dbraw/zinc/13/33/09/1023133309.db2.gz PTONWCDCIXORGK-ZDUSSCGKSA-N 1 0 330.384 3.892 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](CCO)C2)s1 ZINC000093106415 1023151868 /nfs/dbraw/zinc/15/18/68/1023151868.db2.gz IZSLTAUWJUCDKF-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO Cc1ccccc1[C@@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000507178792 1023165391 /nfs/dbraw/zinc/16/53/91/1023165391.db2.gz IYODXWPTBAAAJQ-MRXNPFEDSA-N 1 0 326.396 3.772 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441489000 1023208464 /nfs/dbraw/zinc/20/84/64/1023208464.db2.gz INDGGQUCWCADKQ-UONOGXRCSA-N 1 0 336.432 3.881 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000477856855 1023230121 /nfs/dbraw/zinc/23/01/21/1023230121.db2.gz IRVIZMNANBHEEN-DNVCBOLYSA-N 1 0 334.460 3.837 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471009 1023232485 /nfs/dbraw/zinc/23/24/85/1023232485.db2.gz OVPOHBGFOKIVKP-HKUYNNGSSA-N 1 0 345.487 3.724 20 5 EHBDRO C[NH+](C)C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000091669467 1023293512 /nfs/dbraw/zinc/29/35/12/1023293512.db2.gz FDBCTBFYWDRWME-UHFFFAOYSA-N 1 0 345.468 3.849 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000510982831 1023547453 /nfs/dbraw/zinc/54/74/53/1023547453.db2.gz GPZIZXZDTXNISG-YOEHRIQHSA-N 1 0 326.396 3.948 20 5 EHBDRO CC(C)C[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000341900079 1023669327 /nfs/dbraw/zinc/66/93/27/1023669327.db2.gz XHQADEOJNJNRAU-OAHLLOKOSA-N 1 0 336.823 3.822 20 5 EHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])c3cccnc23)CCCCC1 ZINC000024057859 1023695991 /nfs/dbraw/zinc/69/59/91/1023695991.db2.gz FAALVDUSPYWKEJ-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000610810303 1023696509 /nfs/dbraw/zinc/69/65/09/1023696509.db2.gz AZQZEDHWJRFJDC-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000610809815 1023700892 /nfs/dbraw/zinc/70/08/92/1023700892.db2.gz LUZCWPXXQLFFGF-CZUORRHYSA-N 1 0 342.395 3.566 20 5 EHBDRO CCC[NH+](CCC)CCCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000342058605 1023810992 /nfs/dbraw/zinc/81/09/92/1023810992.db2.gz HMHVJGWEANVXJC-UHFFFAOYSA-N 1 0 337.449 3.524 20 5 EHBDRO CCC[C@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000602806431 1033180284 /nfs/dbraw/zinc/18/02/84/1033180284.db2.gz SPGSCCQPYFOSDM-HNNXBMFYSA-N 1 0 338.358 3.509 20 5 EHBDRO COc1ccc(C[NH2+][C@H](c2cccnc2)C2CCC2)cc1[N+](=O)[O-] ZINC000280857558 1024085209 /nfs/dbraw/zinc/08/52/09/1024085209.db2.gz MYXCYSPFQOJZNS-SFHVURJKSA-N 1 0 327.384 3.629 20 5 EHBDRO COc1ccccc1C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000522269015 1024127259 /nfs/dbraw/zinc/12/72/59/1024127259.db2.gz OXUAKONHZBDXAO-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO CC[NH+](CC)CCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000514212203 1024235330 /nfs/dbraw/zinc/23/53/30/1024235330.db2.gz BWPQMQOPPRHCMJ-UHFFFAOYSA-N 1 0 335.451 3.850 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000380677270 1024435143 /nfs/dbraw/zinc/43/51/43/1024435143.db2.gz OUUNGGKQDFMRRA-RZQQEMMASA-N 1 0 339.439 3.908 20 5 EHBDRO CC(=O)c1cc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232317 1024497658 /nfs/dbraw/zinc/49/76/58/1024497658.db2.gz YCYNPBUTAGAKOU-CQSZACIVSA-N 1 0 341.411 3.730 20 5 EHBDRO COc1cccc(NCc2ccccc2C[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000185126143 1024511887 /nfs/dbraw/zinc/51/18/87/1024511887.db2.gz JRDVVRAVSBCQAT-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC[C@H]3CCCC3(F)F)nc2c1 ZINC000895544303 1024602683 /nfs/dbraw/zinc/60/26/83/1024602683.db2.gz IFWZCBSXWCLMNU-SNVBAGLBSA-N 1 0 325.315 3.651 20 5 EHBDRO CC(C)C[N@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000474233402 1024614336 /nfs/dbraw/zinc/61/43/36/1024614336.db2.gz PKZNSOZWHDVZAB-UHFFFAOYSA-N 1 0 335.448 3.562 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCOC[C@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000430131414 1024663304 /nfs/dbraw/zinc/66/33/04/1024663304.db2.gz LVYZMJDPWZVBKU-QGZVFWFLSA-N 1 0 332.444 3.967 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000277346247 1024710273 /nfs/dbraw/zinc/71/02/73/1024710273.db2.gz YPXVZEDZTXRNBX-ZIAGYGMSSA-N 1 0 344.411 3.981 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000342292395 1024750789 /nfs/dbraw/zinc/75/07/89/1024750789.db2.gz ZGLLIFJQKUWJFM-ZKKXHLJNSA-N 1 0 346.814 3.627 20 5 EHBDRO C[NH2+]C[C@@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371618 1024857837 /nfs/dbraw/zinc/85/78/37/1024857837.db2.gz OABUPUAUYZRSOP-AWEZNQCLSA-N 1 0 345.468 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889922 1033245031 /nfs/dbraw/zinc/24/50/31/1033245031.db2.gz XAMPVCFOVPVQEF-MRXNPFEDSA-N 1 0 334.379 3.528 20 5 EHBDRO Cc1c2ccccc2oc1[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)C(C)C ZINC000539260076 1025002259 /nfs/dbraw/zinc/00/22/59/1025002259.db2.gz IGHNEUCZJKWLHM-KRWDZBQOSA-N 1 0 342.399 3.833 20 5 EHBDRO CCn1nc(C)c(CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926404 1033256879 /nfs/dbraw/zinc/25/68/79/1033256879.db2.gz PQTKFDPOKHYZCQ-AWEZNQCLSA-N 1 0 330.432 3.929 20 5 EHBDRO O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000435770334 1025130275 /nfs/dbraw/zinc/13/02/75/1025130275.db2.gz OOTRCWJKKQQPSE-QGZVFWFLSA-N 1 0 346.431 3.513 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)(C)C ZINC000897994138 1033267049 /nfs/dbraw/zinc/26/70/49/1033267049.db2.gz MUGYOJQCGQGKSO-MQBCKMQZSA-N 1 0 343.431 3.575 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC(C)(C)C1CC1 ZINC000551296572 1025243461 /nfs/dbraw/zinc/24/34/61/1025243461.db2.gz LUPKQQDPFUAHRD-ZDUSSCGKSA-N 1 0 333.432 3.728 20 5 EHBDRO COC(=O)[C@H](CC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461756 1025367208 /nfs/dbraw/zinc/36/72/08/1025367208.db2.gz SJOQELMWSYLMHX-RHSMWYFYSA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1cccc([N+](=O)[O-])c1 ZINC000119915823 1025422950 /nfs/dbraw/zinc/42/29/50/1025422950.db2.gz WBKHTYLKQJVHKU-JSGCOSHPSA-N 1 0 346.818 3.573 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC2(O)CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551818115 1025463896 /nfs/dbraw/zinc/46/38/96/1025463896.db2.gz UDUFPOLBQWJKGE-SFHVURJKSA-N 1 0 344.411 3.734 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240798 1025489466 /nfs/dbraw/zinc/48/94/66/1025489466.db2.gz RFGPMOAFHOPEDG-JSGCOSHPSA-N 1 0 333.432 3.741 20 5 EHBDRO C[C@@H]1[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000310399065 1025494057 /nfs/dbraw/zinc/49/40/57/1025494057.db2.gz UBVDILRTWNRYBB-WBMJQRKESA-N 1 0 346.818 3.718 20 5 EHBDRO CC(C)[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000436273374 1025543786 /nfs/dbraw/zinc/54/37/86/1025543786.db2.gz JXJWAFHVPGCADZ-GFCCVEGCSA-N 1 0 346.353 3.541 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000505811277 1025707188 /nfs/dbraw/zinc/70/71/88/1025707188.db2.gz DYEXLAAUMCUCOD-MRXNPFEDSA-N 1 0 342.395 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCC[NH+]3CCCCCC3)o2)cc1 ZINC000521820419 1025708648 /nfs/dbraw/zinc/70/86/48/1025708648.db2.gz UWBCVYJCVNVYIV-UHFFFAOYSA-N 1 0 343.427 3.820 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451354536 1025861012 /nfs/dbraw/zinc/86/10/12/1025861012.db2.gz RZDMZDBNCRMFSJ-WQCNXYOZSA-N 1 0 332.444 3.980 20 5 EHBDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1(C)C ZINC000783676027 1025863054 /nfs/dbraw/zinc/86/30/54/1025863054.db2.gz LIZPSQLJIJHDBJ-LSDHHAIUSA-N 1 0 326.824 3.930 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730870 1025915791 /nfs/dbraw/zinc/91/57/91/1025915791.db2.gz QXGRHFSAPVHZKC-SUMWQHHRSA-N 1 0 334.416 3.862 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CCc2ccccc21 ZINC000522061930 1025931659 /nfs/dbraw/zinc/93/16/59/1025931659.db2.gz CZBPNUZNTASIIZ-HNNXBMFYSA-N 1 0 326.396 3.813 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000178571151 1026026596 /nfs/dbraw/zinc/02/65/96/1026026596.db2.gz YSQKEXXWYNHPGQ-GBESFXJTSA-N 1 0 326.396 3.684 20 5 EHBDRO Cc1nccn1CCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451552123 1026105892 /nfs/dbraw/zinc/10/58/92/1026105892.db2.gz VQYRHQSTVZTRPE-SFHVURJKSA-N 1 0 342.443 3.760 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1(C)C ZINC000451554870 1026108496 /nfs/dbraw/zinc/10/84/96/1026108496.db2.gz QLNOZRVZDCMHRB-KRWDZBQOSA-N 1 0 336.432 3.629 20 5 EHBDRO CCOC[C@@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000475197891 1026375850 /nfs/dbraw/zinc/37/58/50/1026375850.db2.gz ZEMZRSKYHAVLEH-WFASDCNBSA-N 1 0 346.349 3.908 20 5 EHBDRO CSCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000237507976 1026511002 /nfs/dbraw/zinc/51/10/02/1026511002.db2.gz MSSRFGDIYUTASR-UHFFFAOYSA-N 1 0 336.388 3.979 20 5 EHBDRO C[C@@H]1CCC[C@@](CNc2ncc([N+](=O)[O-])cc2Cl)([NH+](C)C)C1 ZINC000317839095 1026738433 /nfs/dbraw/zinc/73/84/33/1026738433.db2.gz QTULVHQYBCDBLD-IAQYHMDHSA-N 1 0 326.828 3.566 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2cccc(F)c2)N(C)C)cc1[N+](=O)[O-] ZINC000479847520 1026856887 /nfs/dbraw/zinc/85/68/87/1026856887.db2.gz BQWDGSOQROSHRD-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501150417 1027099920 /nfs/dbraw/zinc/09/99/20/1027099920.db2.gz MPIVSGKYQNWVTE-AWEZNQCLSA-N 1 0 333.432 3.824 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCCC[C@H]([NH+]3CCCC3)C2)c2cccnc21 ZINC000413136926 1027104281 /nfs/dbraw/zinc/10/42/81/1027104281.db2.gz OCJUOOMOFAHUJB-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1cccc(F)c1)N(C)C ZINC000531677955 1027203363 /nfs/dbraw/zinc/20/33/63/1027203363.db2.gz QMHBKMOOJRCTIN-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H](O)C[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000061011965 1027268921 /nfs/dbraw/zinc/26/89/21/1027268921.db2.gz URZIYPDAEDGOFD-LLVKDONJSA-N 1 0 336.775 3.511 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](Nc2ccccc2)C1 ZINC000237095794 1027522099 /nfs/dbraw/zinc/52/20/99/1027522099.db2.gz DOKIZWFZECSRKJ-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@]4(C3)CCCOC4)o2)c1 ZINC000342836341 1027550815 /nfs/dbraw/zinc/55/08/15/1027550815.db2.gz JIGKTGMJYWKXFW-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO Cc1cc(NCCCC[N@@H+](C)C2CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000413348071 1027571038 /nfs/dbraw/zinc/57/10/38/1027571038.db2.gz NCPVFTKPGJVFFC-UHFFFAOYSA-N 1 0 328.416 3.738 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000178656396 1027613475 /nfs/dbraw/zinc/61/34/75/1027613475.db2.gz VFVLEBARVDRYCC-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293761154 1027661945 /nfs/dbraw/zinc/66/19/45/1027661945.db2.gz OXEUHSIFRNSDDK-RYUDHWBXSA-N 1 0 342.399 3.547 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N(C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000178681960 1027873005 /nfs/dbraw/zinc/87/30/05/1027873005.db2.gz DMZTVNLMJGKQPM-LSDHHAIUSA-N 1 0 335.448 3.588 20 5 EHBDRO CC[C@@](O)(CCC(F)(F)F)C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000897517698 1027888145 /nfs/dbraw/zinc/88/81/45/1027888145.db2.gz BSAOLUWTWXVWDN-OAHLLOKOSA-N 1 0 348.365 3.785 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000503656013 1028007441 /nfs/dbraw/zinc/00/74/41/1028007441.db2.gz YMIGEBYZTAMROD-CQSZACIVSA-N 1 0 330.359 3.602 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144924 1028206048 /nfs/dbraw/zinc/20/60/48/1028206048.db2.gz IITODWJQSXXXPY-UCLAIMLFSA-N 1 0 325.412 3.739 20 5 EHBDRO COC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCC1 ZINC000503928138 1028232784 /nfs/dbraw/zinc/23/27/84/1028232784.db2.gz KBXWIBWMPWCIMN-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263496 1028302377 /nfs/dbraw/zinc/30/23/77/1028302377.db2.gz ONIYCTQSCNLKDS-CZUORRHYSA-N 1 0 335.448 3.552 20 5 EHBDRO O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000031621212 1028472013 /nfs/dbraw/zinc/47/20/13/1028472013.db2.gz XCSHOJWMXBZZLX-UHFFFAOYSA-N 1 0 339.395 3.833 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000367723822 1028511889 /nfs/dbraw/zinc/51/18/89/1028511889.db2.gz NBZKSNSABWXOBX-IBGZPJMESA-N 1 0 326.396 3.852 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000523701624 1028553670 /nfs/dbraw/zinc/55/36/70/1028553670.db2.gz MEWIXCOFALJUKY-QGZVFWFLSA-N 1 0 326.396 3.593 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c1 ZINC000511227569 1028627946 /nfs/dbraw/zinc/62/79/46/1028627946.db2.gz CCJGSJCCQZBNDK-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)Nc3cccc([N+](=O)[O-])c3)ccc21 ZINC000454315258 1028754512 /nfs/dbraw/zinc/75/45/12/1028754512.db2.gz HTOPCEJEDVCDJC-QGZVFWFLSA-N 1 0 340.383 3.788 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000347376204 1028804593 /nfs/dbraw/zinc/80/45/93/1028804593.db2.gz ZXLMWYKYWMGKIP-DKGMDFAASA-N 1 0 326.400 3.601 20 5 EHBDRO CCC[C@H]([NH2+][C@H](C)C1(OC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000421876861 1028881905 /nfs/dbraw/zinc/88/19/05/1028881905.db2.gz LIOWBPMKMZCMMF-PBHICJAKSA-N 1 0 336.432 3.610 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H](OCC)C23CCC3)cc1[N+](=O)[O-] ZINC000504917981 1029045280 /nfs/dbraw/zinc/04/52/80/1029045280.db2.gz FLBQAAJDUXLONC-KKXDTOCCSA-N 1 0 348.443 3.992 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926341 1029071117 /nfs/dbraw/zinc/07/11/17/1029071117.db2.gz IFXOJFJNEITEKA-PMPSAXMXSA-N 1 0 349.475 3.765 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@H]3C2(C)C)cc1[N+](=O)[O-] ZINC000504927514 1029073921 /nfs/dbraw/zinc/07/39/21/1029073921.db2.gz PYEHTHXKGRACLH-WPPQDWHVSA-N 1 0 348.443 3.848 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H]1CCC[C@@H]1c1ccccc1 ZINC000446002927 1029319415 /nfs/dbraw/zinc/31/94/15/1029319415.db2.gz OGVJPFSYRMWMMC-SJORKVTESA-N 1 0 326.396 3.900 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285229 1029573499 /nfs/dbraw/zinc/57/34/99/1029573499.db2.gz XUAKTXAIKNBLPT-JSGCOSHPSA-N 1 0 333.432 3.741 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000583391097 1029755747 /nfs/dbraw/zinc/75/57/47/1029755747.db2.gz KJQLQCICDWTYES-KDOFPFPSSA-N 1 0 341.386 3.590 20 5 EHBDRO CCOC(=O)[C@@]1(C(C)C)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890941 1029842957 /nfs/dbraw/zinc/84/29/57/1029842957.db2.gz RKEAYSJBNSWOIL-FUKPKEADSA-N 1 0 346.427 3.519 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCC1CCOCC1)C1CC1 ZINC000453237200 1029961949 /nfs/dbraw/zinc/96/19/49/1029961949.db2.gz PBPYURXGVMYOEA-GOSISDBHSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000441215841 1030009614 /nfs/dbraw/zinc/00/96/14/1030009614.db2.gz GBDNGXBYHKZIFV-INIZCTEOSA-N 1 0 325.412 3.868 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000453288104 1030031384 /nfs/dbraw/zinc/03/13/84/1030031384.db2.gz JVLMHPCXGWAEIC-DOTOQJQBSA-N 1 0 328.412 3.812 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000453307291 1030077613 /nfs/dbraw/zinc/07/76/13/1030077613.db2.gz BWISUICDCKRTIZ-LSDHHAIUSA-N 1 0 348.443 3.993 20 5 EHBDRO Cc1c(C[N@@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000583546967 1030088558 /nfs/dbraw/zinc/08/85/58/1030088558.db2.gz YYFMGQSTVJUIQA-AEFFLSMTSA-N 1 0 330.428 3.684 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCc2ccccc21 ZINC000531953822 1030126178 /nfs/dbraw/zinc/12/61/78/1030126178.db2.gz VWMLFFARAZKOKO-CABCVRRESA-N 1 0 325.412 3.697 20 5 EHBDRO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980948 1030128894 /nfs/dbraw/zinc/12/88/94/1030128894.db2.gz XVBMJJKQEKDPQY-GXTWGEPZSA-N 1 0 330.359 3.818 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1OC ZINC000531955239 1030130903 /nfs/dbraw/zinc/13/09/03/1030130903.db2.gz LIKLAWMPCYOROW-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO COc1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000052467503 1030278103 /nfs/dbraw/zinc/27/81/03/1030278103.db2.gz OFYLWICTDKQIOV-UHFFFAOYSA-N 1 0 342.395 3.689 20 5 EHBDRO C[C@H](CC(=O)OC(C)(C)C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447588981 1030323517 /nfs/dbraw/zinc/32/35/17/1030323517.db2.gz WCAZTBOLUDPQGN-WBMJQRKESA-N 1 0 334.416 3.682 20 5 EHBDRO CCN(CCC[NH+](C)C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000583661178 1030386188 /nfs/dbraw/zinc/38/61/88/1030386188.db2.gz CXLIRDPDHHHPQB-UHFFFAOYSA-N 1 0 331.416 3.628 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@@H+]1C1CC1 ZINC000583666504 1030395834 /nfs/dbraw/zinc/39/58/34/1030395834.db2.gz BXUPSIHINWMCBK-OCCSQVGLSA-N 1 0 333.432 3.809 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cc(F)ccc1F)C1CC1 ZINC000482550263 1030523196 /nfs/dbraw/zinc/52/31/96/1030523196.db2.gz BKECMNOTCBEVFG-QGZVFWFLSA-N 1 0 332.350 3.984 20 5 EHBDRO CC(C)(C)OC(=O)CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000343412209 1030765654 /nfs/dbraw/zinc/76/56/54/1030765654.db2.gz GEVBIOWQVJDLJY-UHFFFAOYSA-N 1 0 334.416 3.681 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000527286534 1030769660 /nfs/dbraw/zinc/76/96/60/1030769660.db2.gz NVVPFCRFNIAJMX-ZRGSNEMSSA-N 1 0 337.423 3.774 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCC(C)(C)C1CC1 ZINC000550920333 1030799324 /nfs/dbraw/zinc/79/93/24/1030799324.db2.gz DNSNCLDQAFQVSE-CYBMUJFWSA-N 1 0 333.432 3.728 20 5 EHBDRO Cn1cc(C[NH2+]CC2CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000527363383 1030855366 /nfs/dbraw/zinc/85/53/66/1030855366.db2.gz DIYXKORDLDXELS-UHFFFAOYSA-N 1 0 328.416 3.521 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360665 1030986096 /nfs/dbraw/zinc/98/60/96/1030986096.db2.gz CORVCHKFCXLNDS-YOEHRIQHSA-N 1 0 344.411 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160795192 1031025343 /nfs/dbraw/zinc/02/53/43/1031025343.db2.gz MWRLHKMXWYWVNF-CYBMUJFWSA-N 1 0 332.404 3.693 20 5 EHBDRO COc1cccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1OC ZINC000192701004 1031260029 /nfs/dbraw/zinc/26/00/29/1031260029.db2.gz YNQIQMZOFRVKRZ-QGZVFWFLSA-N 1 0 342.395 3.779 20 5 EHBDRO CCCCCNC(=O)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000052722182 1031284461 /nfs/dbraw/zinc/28/44/61/1031284461.db2.gz ZBHJWUSOECNUMG-HNNXBMFYSA-N 1 0 347.459 3.674 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2cc3ccccc3o2)n1 ZINC000584033110 1031525015 /nfs/dbraw/zinc/52/50/15/1031525015.db2.gz ARQAGCBXPUKKKM-JKSUJKDBSA-N 1 0 340.383 3.811 20 5 EHBDRO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737962 1031703011 /nfs/dbraw/zinc/70/30/11/1031703011.db2.gz HERGFMCDWSRMQA-AGIUHOORSA-N 1 0 330.388 3.511 20 5 EHBDRO Cn1cccc1[C@@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312500 1031770953 /nfs/dbraw/zinc/77/09/53/1031770953.db2.gz DXUSMCVFXVQFBC-SFHVURJKSA-N 1 0 329.400 3.539 20 5 EHBDRO COc1cccc(C[C@@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594503618 1033404913 /nfs/dbraw/zinc/40/49/13/1033404913.db2.gz ZZMHXTOUZJNEDE-FZKQIMNGSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1cnc(CC[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000594512236 1033417026 /nfs/dbraw/zinc/41/70/26/1033417026.db2.gz VMWFRPNCBZAWLF-MRXNPFEDSA-N 1 0 327.428 3.760 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000594514484 1033420028 /nfs/dbraw/zinc/42/00/28/1033420028.db2.gz JEPANRMKXVRNSJ-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO CSCC(C)(C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000898305852 1033447253 /nfs/dbraw/zinc/44/72/53/1033447253.db2.gz VCNDIQULWAEBGN-UHFFFAOYSA-N 1 0 337.470 3.950 20 5 EHBDRO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CC[NH+](C)CC1 ZINC000603317314 1033544338 /nfs/dbraw/zinc/54/43/38/1033544338.db2.gz HTFHLOYWFOISNT-HNNXBMFYSA-N 1 0 347.462 3.848 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580856 1033571226 /nfs/dbraw/zinc/57/12/26/1033571226.db2.gz XCLZTCPNWBWQJB-HIFRSBDPSA-N 1 0 331.441 3.836 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000594977986 1033579732 /nfs/dbraw/zinc/57/97/32/1033579732.db2.gz PGAQYJMMUXDPCX-QLBOMPFWSA-N 1 0 329.444 3.605 20 5 EHBDRO CC(C)c1ncc2c(n1)CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000598935426 1033590591 /nfs/dbraw/zinc/59/05/91/1033590591.db2.gz GNROCAQUEBZDOB-FNORWQNLSA-N 1 0 338.411 3.580 20 5 EHBDRO Cn1ncc(C2CCC2)c1C[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000594943755 1033590855 /nfs/dbraw/zinc/59/08/55/1033590855.db2.gz PLXRKAOMDFTZLP-UHFFFAOYSA-N 1 0 348.834 3.582 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CO)C2CCC2)s1 ZINC000594957604 1033598874 /nfs/dbraw/zinc/59/88/74/1033598874.db2.gz UVRARZXTROGHCD-OAHLLOKOSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC(C4(O)CC4)CC3)o2)cc1 ZINC000593647760 1033608395 /nfs/dbraw/zinc/60/83/95/1033608395.db2.gz JSYOEJZGTUXABL-UHFFFAOYSA-N 1 0 342.395 3.592 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC1CC1 ZINC000598956141 1033609178 /nfs/dbraw/zinc/60/91/78/1033609178.db2.gz XXZCOBHACKEUSH-CYBMUJFWSA-N 1 0 342.395 3.995 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)CCc1ccc(O)cc1 ZINC000595014997 1033609891 /nfs/dbraw/zinc/60/98/91/1033609891.db2.gz XFVJYXOFUGNZFS-ZIAGYGMSSA-N 1 0 344.411 3.981 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)c(F)c1 ZINC000598986700 1033612249 /nfs/dbraw/zinc/61/22/49/1033612249.db2.gz LGUGKOLKKOXONM-HYVNUMGLSA-N 1 0 332.762 3.815 20 5 EHBDRO COc1ccc(C[NH2+]C2CCC3(CC3(F)F)CC2)cc1[N+](=O)[O-] ZINC000594983759 1033619148 /nfs/dbraw/zinc/61/91/48/1033619148.db2.gz NHHATKAWYFEDSL-UHFFFAOYSA-N 1 0 326.343 3.661 20 5 EHBDRO CC1(C)OCC[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000594997128 1033623766 /nfs/dbraw/zinc/62/37/66/1033623766.db2.gz YBMMNICEOYVILJ-AWEZNQCLSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@@H]3CCCOC3)o2)cc1 ZINC000598985341 1033631813 /nfs/dbraw/zinc/63/18/13/1033631813.db2.gz OLHQWOGMYFGIAT-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCc1ccnc2ccccc12 ZINC000595074681 1033644693 /nfs/dbraw/zinc/64/46/93/1033644693.db2.gz TVHQRUGRCORRME-IBGZPJMESA-N 1 0 333.391 3.963 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595069808 1033646774 /nfs/dbraw/zinc/64/67/74/1033646774.db2.gz SGRBXTQTUJZJGD-AUUYWEPGSA-N 1 0 344.411 3.950 20 5 EHBDRO C[C@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072774 1033647421 /nfs/dbraw/zinc/64/74/21/1033647421.db2.gz QOPVEJWVYZVXLI-NEPJUHHUSA-N 1 0 336.338 3.991 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000595039538 1033657429 /nfs/dbraw/zinc/65/74/29/1033657429.db2.gz QBDIEIWMOKOOHK-LXTVHRRPSA-N 1 0 336.432 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1noc3ccccc13)CCC2 ZINC000595052002 1033667749 /nfs/dbraw/zinc/66/77/49/1033667749.db2.gz ZZVSGNXTOCEFGO-KRWDZBQOSA-N 1 0 337.379 3.946 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCCc2scnc21 ZINC000599042128 1033673435 /nfs/dbraw/zinc/67/34/35/1033673435.db2.gz KAMLFUMREPJNPL-LBPRGKRZSA-N 1 0 337.832 3.914 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])OC)c1 ZINC000599058772 1033698420 /nfs/dbraw/zinc/69/84/20/1033698420.db2.gz UZNOHCOSIILPBV-PKOBYXMFSA-N 1 0 342.395 3.568 20 5 EHBDRO CC(C)[C@H](O)[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000595094125 1033699772 /nfs/dbraw/zinc/69/97/72/1033699772.db2.gz DMXGPIYZBRUHFH-HOJAQTOUSA-N 1 0 340.423 3.930 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060971 1033700549 /nfs/dbraw/zinc/70/05/49/1033700549.db2.gz ICONOWLMTAMBHD-ACJLOTCBSA-N 1 0 330.384 3.642 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccnc1C ZINC000599074428 1033716050 /nfs/dbraw/zinc/71/60/50/1033716050.db2.gz RHHWGMIAKALWRW-OAHLLOKOSA-N 1 0 331.441 3.959 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CO[C@H](C2CC2)C1 ZINC000599086255 1033726716 /nfs/dbraw/zinc/72/67/16/1033726716.db2.gz ZQMQWLCQCDRQOJ-FMKPAKJESA-N 1 0 336.457 3.623 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@H]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327727 1033730846 /nfs/dbraw/zinc/73/08/46/1033730846.db2.gz RHQZDZMLUCNZRI-HOTGVXAUSA-N 1 0 329.400 3.968 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000595343149 1033735610 /nfs/dbraw/zinc/73/56/10/1033735610.db2.gz DSFZLUZLKBEUCP-UHFFFAOYSA-N 1 0 342.370 3.755 20 5 EHBDRO C[C@@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595411000 1033790202 /nfs/dbraw/zinc/79/02/02/1033790202.db2.gz KZEOFRPQLJYDQL-AWEZNQCLSA-N 1 0 332.375 3.507 20 5 EHBDRO CC[N@H+](CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C(C)C ZINC000593705193 1033816476 /nfs/dbraw/zinc/81/64/76/1033816476.db2.gz QWBZAWUNNFAVHP-AWEZNQCLSA-N 1 0 333.354 3.518 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665497 1033836260 /nfs/dbraw/zinc/83/62/60/1033836260.db2.gz KRUQTVFYVBMCOE-AZUAARDMSA-N 1 0 339.439 3.562 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000595509004 1033836669 /nfs/dbraw/zinc/83/66/69/1033836669.db2.gz DRPYMXCBRWLUMM-QLJPJBMISA-N 1 0 336.388 3.588 20 5 EHBDRO CCC(C)(C)[C@@H](C)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000595640016 1033930635 /nfs/dbraw/zinc/93/06/35/1033930635.db2.gz YXYVLARMYYCDKO-SNVBAGLBSA-N 1 0 327.812 3.601 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]1CCO ZINC000595696270 1033950660 /nfs/dbraw/zinc/95/06/60/1033950660.db2.gz KAVRNQYCQWUPBP-IAQYHMDHSA-N 1 0 346.349 3.597 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)Cc1cccc([N+](=O)[O-])c1C ZINC000603846526 1033969659 /nfs/dbraw/zinc/96/96/59/1033969659.db2.gz HWCQIJHIJFOXRB-UHFFFAOYSA-N 1 0 328.368 3.654 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[N@H+](CC3CCCCC3)CC2)cs1 ZINC000603937362 1034054558 /nfs/dbraw/zinc/05/45/58/1034054558.db2.gz DYFAXWZSEGQGCN-UHFFFAOYSA-N 1 0 337.489 3.744 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000596161784 1034114096 /nfs/dbraw/zinc/11/40/96/1034114096.db2.gz KGXYYXJDIGYTGH-LBPRGKRZSA-N 1 0 327.375 3.922 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688048 1034115475 /nfs/dbraw/zinc/11/54/75/1034115475.db2.gz BNGUZGQGSJRJAW-SFAKSCPVSA-N 1 0 342.399 3.823 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604011991 1034136369 /nfs/dbraw/zinc/13/63/69/1034136369.db2.gz BPXQITFDVWVABJ-UHFFFAOYSA-N 1 0 344.411 3.894 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3CCC[N@H+](CC4CC4)C3)c2c1 ZINC000596570367 1034292940 /nfs/dbraw/zinc/29/29/40/1034292940.db2.gz IQQLELYAFRUDDQ-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@H]2c2ccc(O)cc2)c1 ZINC000604484187 1034389405 /nfs/dbraw/zinc/38/94/05/1034389405.db2.gz CNHSJGNVLHAVGU-SFHVURJKSA-N 1 0 328.368 3.516 20 5 EHBDRO Cc1ccc([C@@H](CNc2cccnc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000604508569 1034408064 /nfs/dbraw/zinc/40/80/64/1034408064.db2.gz TZBQVJGEQLVSPN-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000612194078 1034437068 /nfs/dbraw/zinc/43/70/68/1034437068.db2.gz XJGLHTGUFXSCMO-KRWDZBQOSA-N 1 0 326.396 3.559 20 5 EHBDRO CC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CCC1 ZINC000230313572 1034862425 /nfs/dbraw/zinc/86/24/25/1034862425.db2.gz JOOXSXGIIRRQNA-UHFFFAOYSA-N 1 0 327.222 3.979 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2C[C@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927682 1035077863 /nfs/dbraw/zinc/07/78/63/1035077863.db2.gz SQCFBAMUSNDDLZ-WBVHZDCISA-N 1 0 332.787 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2C[C@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927679 1035077906 /nfs/dbraw/zinc/07/79/06/1035077906.db2.gz SQCFBAMUSNDDLZ-NVXWUHKLSA-N 1 0 332.787 3.556 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nn(C)c2ccccc12 ZINC000612829304 1035251414 /nfs/dbraw/zinc/25/14/14/1035251414.db2.gz VDTYAYGUOSFOBV-CQSZACIVSA-N 1 0 338.411 3.592 20 5 EHBDRO C[N@@H+]1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573354 1035539968 /nfs/dbraw/zinc/53/99/68/1035539968.db2.gz RJBZRLUDQCVAFT-WMZOPIPTSA-N 1 0 345.830 3.783 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)C12CCC2 ZINC000581967309 1035663077 /nfs/dbraw/zinc/66/30/77/1035663077.db2.gz NDQWVNBNLWZVCO-ROUUACIJSA-N 1 0 343.427 3.556 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN(C)C(C)C ZINC000582247922 1035721184 /nfs/dbraw/zinc/72/11/84/1035721184.db2.gz UQKFBVMCOFIKME-GJZGRUSLSA-N 1 0 339.505 3.784 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000540906906 1035786513 /nfs/dbraw/zinc/78/65/13/1035786513.db2.gz AJWCMXNXBDGEAW-JKSUJKDBSA-N 1 0 347.459 3.694 20 5 EHBDRO CCCC[C@H]1CCC[C@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000460347896 1035925957 /nfs/dbraw/zinc/92/59/57/1035925957.db2.gz DPGHDAVUPQMRLR-WMLDXEAASA-N 1 0 333.432 3.506 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460344887 1035927412 /nfs/dbraw/zinc/92/74/12/1035927412.db2.gz CSKNBSXEHHOWJM-RRFJBIMHSA-N 1 0 333.432 3.870 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC000549409168 1035927821 /nfs/dbraw/zinc/92/78/21/1035927821.db2.gz WVSKQRFTFIDHCI-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@H]1CCCCO1 ZINC000492531542 1035934080 /nfs/dbraw/zinc/93/40/80/1035934080.db2.gz FZLVYITZVFEUIC-MRXNPFEDSA-N 1 0 336.432 3.775 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000780396957 1035995287 /nfs/dbraw/zinc/99/52/87/1035995287.db2.gz GRGGMFHENBNMTN-KALAYHLKSA-N 1 0 338.407 3.806 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 ZINC000056196797 1036138843 /nfs/dbraw/zinc/13/88/43/1036138843.db2.gz MWZQCSAKVFBDGL-HUUCEWRRSA-N 1 0 345.443 3.641 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201446 1036140188 /nfs/dbraw/zinc/14/01/88/1036140188.db2.gz YIDIYSPAUDJCND-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000414225461 1036163943 /nfs/dbraw/zinc/16/39/43/1036163943.db2.gz TZAOVMKYENGPHC-IRWQIABSSA-N 1 0 326.396 3.866 20 5 EHBDRO CC[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000414268865 1036375674 /nfs/dbraw/zinc/37/56/74/1036375674.db2.gz UBUPDGFOCWQVDP-YNEHKIRRSA-N 1 0 348.369 3.843 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000026224411 1036394440 /nfs/dbraw/zinc/39/44/40/1036394440.db2.gz NHNMQCKWEMSMAV-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](C)C[C@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543612 1036422193 /nfs/dbraw/zinc/42/21/93/1036422193.db2.gz QILJPNDCGIBZQH-CKFHNAJUSA-N 1 0 346.427 3.836 20 5 EHBDRO CC(C)(C)Oc1cc(N2CC[C@H](C[NH+]3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000590135973 1036787907 /nfs/dbraw/zinc/78/79/07/1036787907.db2.gz IKUSUOQKBRZUON-OAHLLOKOSA-N 1 0 347.459 3.694 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCO[C@@H]21 ZINC000539507464 1036828753 /nfs/dbraw/zinc/82/87/53/1036828753.db2.gz CLVCBCBZOWLMCV-KURKYZTESA-N 1 0 332.444 3.711 20 5 EHBDRO COCC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000539524235 1036859805 /nfs/dbraw/zinc/85/98/05/1036859805.db2.gz CZCMEEHQFKVXON-UHFFFAOYSA-N 1 0 336.775 3.777 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1cccc(C[NH+](C)C)c1 ZINC000590549951 1036934500 /nfs/dbraw/zinc/93/45/00/1036934500.db2.gz JGAYTCLWTIUZAZ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601501 1036966028 /nfs/dbraw/zinc/96/60/28/1036966028.db2.gz CMFLOQUQYJZZCG-CZUORRHYSA-N 1 0 328.416 3.515 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000152857435 1037000577 /nfs/dbraw/zinc/00/05/77/1037000577.db2.gz OXMLZPNPKKFNHV-GJZGRUSLSA-N 1 0 335.448 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3noc4c3CCCC4)C2)cc1 ZINC000590757332 1037027228 /nfs/dbraw/zinc/02/72/28/1037027228.db2.gz SOUKDKVUWYAJFS-HNNXBMFYSA-N 1 0 341.411 3.841 20 5 EHBDRO C[C@@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740731 1037137933 /nfs/dbraw/zinc/13/79/33/1037137933.db2.gz CCZXNUSHEVDOAS-MOPGFXCFSA-N 1 0 326.396 3.843 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccccn1 ZINC000595041463 1037211435 /nfs/dbraw/zinc/21/14/35/1037211435.db2.gz LTPQVRZKZPQNHA-ZDUSSCGKSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000542247173 1037211942 /nfs/dbraw/zinc/21/19/42/1037211942.db2.gz OPSJXTAFLYANIJ-ZDUSSCGKSA-N 1 0 333.432 3.600 20 5 EHBDRO COc1cc(NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786737 1037394893 /nfs/dbraw/zinc/39/48/93/1037394893.db2.gz BFAUKNSKCRGYRM-HUUCEWRRSA-N 1 0 335.448 3.773 20 5 EHBDRO COc1ccc(F)cc1C[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000462794845 1037408821 /nfs/dbraw/zinc/40/88/21/1037408821.db2.gz JDZGXPASKWQQKM-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@H](C)OC ZINC000462827492 1037431122 /nfs/dbraw/zinc/43/11/22/1037431122.db2.gz PSTDSGDXFSGPJV-ZDUSSCGKSA-N 1 0 348.399 3.720 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000462815811 1037434549 /nfs/dbraw/zinc/43/45/49/1037434549.db2.gz FBXHIINGBISJGE-GJZGRUSLSA-N 1 0 343.402 3.911 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCOC1 ZINC000462868931 1037491748 /nfs/dbraw/zinc/49/17/48/1037491748.db2.gz TXBVBJIMKLOOOK-MRXNPFEDSA-N 1 0 330.384 3.854 20 5 EHBDRO CC(C)c1ccc(C(=O)Nc2cccc3c2CC[NH2+]C3)cc1[N+](=O)[O-] ZINC000591681122 1037553625 /nfs/dbraw/zinc/55/36/25/1037553625.db2.gz QZSDITKDAPWMSN-UHFFFAOYSA-N 1 0 339.395 3.616 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538079 1037565374 /nfs/dbraw/zinc/56/53/74/1037565374.db2.gz XLAUKQLNFHMHDJ-LSDHHAIUSA-N 1 0 328.416 3.636 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2Nc2cc3c(c[nH+]2)CCCC3)n1 ZINC000462941442 1037566111 /nfs/dbraw/zinc/56/61/11/1037566111.db2.gz DHUJOCSONMBALH-JKSUJKDBSA-N 1 0 341.415 3.661 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532547501 1037567261 /nfs/dbraw/zinc/56/72/61/1037567261.db2.gz VLFQJQOZSSRCIN-RDJZCZTQSA-N 1 0 328.412 3.812 20 5 EHBDRO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC(C)(C)C1 ZINC000412037209 1037573644 /nfs/dbraw/zinc/57/36/44/1037573644.db2.gz NFXMJBVKIQLUAI-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)N[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000415921115 1037643076 /nfs/dbraw/zinc/64/30/76/1037643076.db2.gz QGLZVEBURCRITP-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000540186313 1037654422 /nfs/dbraw/zinc/65/44/22/1037654422.db2.gz RRSNFBFXDRIJCZ-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000341213650 1037764298 /nfs/dbraw/zinc/76/42/98/1037764298.db2.gz RHRWLRXKWQFWHK-QGZVFWFLSA-N 1 0 341.411 3.973 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540326434 1037823256 /nfs/dbraw/zinc/82/32/56/1037823256.db2.gz WXZGTDBLLWPRPV-RHSMWYFYSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1cc(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)cc([N+](=O)[O-])c1 ZINC000494069702 1037823992 /nfs/dbraw/zinc/82/39/92/1037823992.db2.gz RBOHXYFZXATEQC-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO Cc1c(C[NH+]2CCC(C)(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000592157634 1037901619 /nfs/dbraw/zinc/90/16/19/1037901619.db2.gz GXRKHYNKCIGLPJ-UHFFFAOYSA-N 1 0 348.443 3.847 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CC[C@H]4C[C@H]4C3)cs2)c1 ZINC000592378778 1037949292 /nfs/dbraw/zinc/94/92/92/1037949292.db2.gz CVHLWTFQYWLXRQ-FPMFFAJLSA-N 1 0 329.425 3.997 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@@H](c1ccccc1)[NH+](C)C ZINC000416121557 1038172331 /nfs/dbraw/zinc/17/23/31/1038172331.db2.gz KWUCXHIBLWOFTM-KRWDZBQOSA-N 1 0 327.384 3.535 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000470172231 1038447491 /nfs/dbraw/zinc/44/74/91/1038447491.db2.gz UCIFHHKMJDBRRU-GYTMMYARSA-N 1 0 330.428 3.747 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538878480 1038584857 /nfs/dbraw/zinc/58/48/57/1038584857.db2.gz ZIZISWLAUDTMMQ-ACJLOTCBSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959427 1038696605 /nfs/dbraw/zinc/69/66/05/1038696605.db2.gz PLTVMAQXRFUFKC-MAUKXSAKSA-N 1 0 329.375 3.900 20 5 EHBDRO CC[C@]1(CO)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000190224111 1038773136 /nfs/dbraw/zinc/77/31/36/1038773136.db2.gz FYSLLEUGKPXIDC-IBGZPJMESA-N 1 0 344.411 3.839 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000378635421 1038787913 /nfs/dbraw/zinc/78/79/13/1038787913.db2.gz UMOFAARDMUWZAD-MRXNPFEDSA-N 1 0 347.440 3.719 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000037131159 1038906586 /nfs/dbraw/zinc/90/65/86/1038906586.db2.gz DPANCVUBXBHSKQ-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO C[C@H](C[NH2+]C[C@@H](O)c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000905643370 1039025082 /nfs/dbraw/zinc/02/50/82/1039025082.db2.gz LGJOPDWSSQEFEC-SJKOYZFVSA-N 1 0 334.803 3.675 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000236846547 1039045286 /nfs/dbraw/zinc/04/52/86/1039045286.db2.gz JDOUJXBHRBYGJY-IBGZPJMESA-N 1 0 327.428 3.768 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CS1 ZINC000488518029 1039254151 /nfs/dbraw/zinc/25/41/51/1039254151.db2.gz PLXXNMOXESPCHV-HIFRSBDPSA-N 1 0 328.865 3.910 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000485746885 1039508636 /nfs/dbraw/zinc/50/86/36/1039508636.db2.gz UAKVXJKHBQEZGV-QGZVFWFLSA-N 1 0 342.395 3.949 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000552961534 1039671242 /nfs/dbraw/zinc/67/12/42/1039671242.db2.gz GUYNYLDKOIMOPM-UHFFFAOYSA-N 1 0 347.365 3.950 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC3(CCCC3)C2)c2c(c1)COCO2 ZINC000408415639 1039735345 /nfs/dbraw/zinc/73/53/45/1039735345.db2.gz KOSZZITWRAOYKZ-UHFFFAOYSA-N 1 0 332.400 3.618 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000570411039 1039791524 /nfs/dbraw/zinc/79/15/24/1039791524.db2.gz LLISXCQCAMQQLB-INIZCTEOSA-N 1 0 340.379 3.533 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000150743629 1039930656 /nfs/dbraw/zinc/93/06/56/1039930656.db2.gz BRJCZCMMWAUUKI-CQSZACIVSA-N 1 0 347.415 3.547 20 5 EHBDRO COc1cc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000192952406 1040158686 /nfs/dbraw/zinc/15/86/86/1040158686.db2.gz LEUQFGFEZOVMIV-MRXNPFEDSA-N 1 0 341.411 3.537 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2ccc(F)cc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480907365 1040169306 /nfs/dbraw/zinc/16/93/06/1040169306.db2.gz ZJXIWTBXRVXBED-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCCC1 ZINC000128279540 1040210595 /nfs/dbraw/zinc/21/05/95/1040210595.db2.gz SCPMQINDZUQZLA-UHFFFAOYSA-N 1 0 337.395 3.717 20 5 EHBDRO COc1ccccc1OCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490044662 1040321567 /nfs/dbraw/zinc/32/15/67/1040321567.db2.gz MMIVBBVJNSQTAS-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000481104889 1040370105 /nfs/dbraw/zinc/37/01/05/1040370105.db2.gz JKNZKPKHIYCSBM-ZFWWWQNUSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H]2CCCCO2)c2ccccc2)c1 ZINC000490183783 1040373100 /nfs/dbraw/zinc/37/31/00/1040373100.db2.gz BNZLHRXEWBXDAR-RTBURBONSA-N 1 0 326.396 3.843 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH2+][C@@H]3CC4CCC3CC4)o2)c1 ZINC000432989873 1040382147 /nfs/dbraw/zinc/38/21/47/1040382147.db2.gz VQJHZQGAFHXXNX-MQBCKMQZSA-N 1 0 341.411 3.961 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000481130210 1040386608 /nfs/dbraw/zinc/38/66/08/1040386608.db2.gz ZZIIZQGBWGAPDX-JKSUJKDBSA-N 1 0 339.439 3.692 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000512673672 1040486597 /nfs/dbraw/zinc/48/65/97/1040486597.db2.gz PZNITONOQYNHGN-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(N2CCCC2)nc1 ZINC000151044079 1040518732 /nfs/dbraw/zinc/51/87/32/1040518732.db2.gz VIEXRRFRGBYYKZ-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)C ZINC000418090041 1040565258 /nfs/dbraw/zinc/56/52/58/1040565258.db2.gz CEIJCZBKVHCACK-MRXNPFEDSA-N 1 0 349.456 3.869 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)c1 ZINC000029475235 1040633693 /nfs/dbraw/zinc/63/36/93/1040633693.db2.gz HZGFYOBIPGUFJI-IBGZPJMESA-N 1 0 326.396 3.540 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487154081 1040726580 /nfs/dbraw/zinc/72/65/80/1040726580.db2.gz HFUIISXUJQBDQR-HIFRSBDPSA-N 1 0 346.349 3.907 20 5 EHBDRO CC[C@@H]1C[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487163800 1040747111 /nfs/dbraw/zinc/74/71/11/1040747111.db2.gz SPOZOAQKHOEQDO-XHDPSFHLSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@@H](C)C[NH+]1CCCCCC1 ZINC000481418672 1040879010 /nfs/dbraw/zinc/87/90/10/1040879010.db2.gz YPHZUEUFALLGQX-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)(C)[C@@H]2CCC[C@@H]21 ZINC000555721207 1041058398 /nfs/dbraw/zinc/05/83/98/1041058398.db2.gz IRYKRCZGHRZCSG-WBVHZDCISA-N 1 0 345.443 3.742 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC2(CO)CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000433211337 1041099606 /nfs/dbraw/zinc/09/96/06/1041099606.db2.gz YFYMGKUWPDLCDZ-UHFFFAOYSA-N 1 0 332.444 3.751 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@@H](C)C1 ZINC000481604702 1041146148 /nfs/dbraw/zinc/14/61/48/1041146148.db2.gz ZYHVPOVZUUZLIJ-NEPJUHHUSA-N 1 0 339.823 3.697 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](CO)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433283866 1041233430 /nfs/dbraw/zinc/23/34/30/1041233430.db2.gz PQDKSPIUFLRMMF-ROUUACIJSA-N 1 0 344.386 3.780 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000481701963 1041270313 /nfs/dbraw/zinc/27/03/13/1041270313.db2.gz NALNOZWLKVODES-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1 ZINC000433331953 1041295410 /nfs/dbraw/zinc/29/54/10/1041295410.db2.gz QRMAIVSWHKQORI-UHFFFAOYSA-N 1 0 340.383 3.690 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCCO1 ZINC000511662218 1041372769 /nfs/dbraw/zinc/37/27/69/1041372769.db2.gz ANWYRJLWUGDZLD-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000108931333 1042111574 /nfs/dbraw/zinc/11/15/74/1042111574.db2.gz SUDWGEYMFBSNFY-RBSFLKMASA-N 1 0 342.443 3.921 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000112656376 1042416629 /nfs/dbraw/zinc/41/66/29/1042416629.db2.gz GLZVVTHSZLYJMZ-WFASDCNBSA-N 1 0 346.818 3.891 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181835881 1042549472 /nfs/dbraw/zinc/54/94/72/1042549472.db2.gz MZCUZFDHLMAMKD-HUUCEWRRSA-N 1 0 347.459 3.733 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432325879 1042906853 /nfs/dbraw/zinc/90/68/53/1042906853.db2.gz NHNJNUIOCTXLHQ-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000166498760 1042962808 /nfs/dbraw/zinc/96/28/08/1042962808.db2.gz HDXUWVVIEAJWKU-YLJYHZDGSA-N 1 0 340.423 3.895 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N1CCc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000467836776 1043896948 /nfs/dbraw/zinc/89/69/48/1043896948.db2.gz RQVXMLSSAFGLFW-HZPDHXFCSA-N 1 0 339.439 3.692 20 5 EHBDRO COC1CCC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279553257 1044223308 /nfs/dbraw/zinc/22/33/08/1044223308.db2.gz RBFGEMVTRPOJBU-UHFFFAOYSA-N 1 0 332.322 3.661 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nc(C)c(C)s1 ZINC000344969574 1044751245 /nfs/dbraw/zinc/75/12/45/1044751245.db2.gz AKEPIWPQCVNGSQ-XFXZXTDPSA-N 1 0 331.441 3.904 20 5 EHBDRO CCCC[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000184907595 1126710197 /nfs/dbraw/zinc/71/01/97/1126710197.db2.gz VKGMAAOQKLLEMF-QGZVFWFLSA-N 1 0 333.432 3.506 20 5 EHBDRO CC1(C[NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)COC1 ZINC000112711920 1127549782 /nfs/dbraw/zinc/54/97/82/1127549782.db2.gz ISOYBXOZGKWOOU-UHFFFAOYSA-N 1 0 346.358 3.652 20 5 EHBDRO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@H]1CCCC[N@@H+]1C ZINC000765525276 1127640270 /nfs/dbraw/zinc/64/02/70/1127640270.db2.gz CJZPAOZZUGFURQ-IAGOWNOFSA-N 1 0 348.443 3.581 20 5 EHBDRO C[C@@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225229 1127723128 /nfs/dbraw/zinc/72/31/28/1127723128.db2.gz DXQIURAFJTZACS-CQSZACIVSA-N 1 0 345.468 3.849 20 5 EHBDRO COc1cc(N[C@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301370090 1127742184 /nfs/dbraw/zinc/74/21/84/1127742184.db2.gz SCFXFWYUCBCJEF-QGZVFWFLSA-N 1 0 341.411 3.852 20 5 EHBDRO C[C@H](CS(C)(=O)=O)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000172122022 1127771241 /nfs/dbraw/zinc/77/12/41/1127771241.db2.gz XNVXJPSFEAJCDO-CQSZACIVSA-N 1 0 327.449 3.516 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000765765538 1128005202 /nfs/dbraw/zinc/00/52/02/1128005202.db2.gz GKRNYIAPJPBSNJ-QWHCGFSZSA-N 1 0 331.441 3.678 20 5 EHBDRO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC000301602404 1128515804 /nfs/dbraw/zinc/51/58/04/1128515804.db2.gz WHTMXMGDPLJALI-DOTOQJQBSA-N 1 0 340.427 3.621 20 5 EHBDRO CO[C@@H](c1ccccc1F)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000542725229 1128563075 /nfs/dbraw/zinc/56/30/75/1128563075.db2.gz ZOPHUXMGXXLCBB-SCLBCKFNSA-N 1 0 332.375 3.908 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1(C)C ZINC000273790047 1128667674 /nfs/dbraw/zinc/66/76/74/1128667674.db2.gz YLOYFHMQAKAWQL-GFCCVEGCSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[NH+]1CCCC1 ZINC001648832608 1120050856 /nfs/dbraw/zinc/05/08/56/1120050856.db2.gz DBNPBRUVSVROPT-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO COC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000494592454 1120686218 /nfs/dbraw/zinc/68/62/18/1120686218.db2.gz RMCIKFRSWPCOES-QGZVFWFLSA-N 1 0 334.803 3.768 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000495415771 1121178350 /nfs/dbraw/zinc/17/83/50/1121178350.db2.gz TXYGFFVOLHNJMP-NSHDSACASA-N 1 0 348.786 3.870 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000301056598 1121193100 /nfs/dbraw/zinc/19/31/00/1121193100.db2.gz KNZNCTJPKUHKRA-SFHVURJKSA-N 1 0 341.411 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCN(C4CC4)C3)s2)cc1 ZINC000609223438 1121563067 /nfs/dbraw/zinc/56/30/67/1121563067.db2.gz RKTSCAUAYJQFKO-CQSZACIVSA-N 1 0 343.452 3.650 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000301104696 1121920344 /nfs/dbraw/zinc/92/03/44/1121920344.db2.gz VMIAJXLYRFLMSP-STQMWFEESA-N 1 0 329.322 3.652 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+]CC=Cc2ccccc2[N+](=O)[O-])c1 ZINC000496586386 1122128510 /nfs/dbraw/zinc/12/85/10/1122128510.db2.gz YXXUORBRQUOPTR-YVMONPNESA-N 1 0 341.367 3.576 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000272776191 1122206870 /nfs/dbraw/zinc/20/68/70/1122206870.db2.gz UJSKAEPDIJUKJU-OLZOCXBDSA-N 1 0 327.384 3.965 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCC[C@@H]1O ZINC000497264040 1122428540 /nfs/dbraw/zinc/42/85/40/1122428540.db2.gz VZSCOOCIXQXDGY-KDOFPFPSSA-N 1 0 344.411 3.838 20 5 EHBDRO COc1ccccc1[C@@H](CNc1c(C)cccc1[N+](=O)[O-])[NH+](C)C ZINC000301203699 1122510211 /nfs/dbraw/zinc/51/02/11/1122510211.db2.gz XUNXHZFSSZJDLN-MRXNPFEDSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](CC3CCCCC3)CC2)c(F)c1 ZINC000917390988 1122595304 /nfs/dbraw/zinc/59/53/04/1122595304.db2.gz IBUCEYWQSAVOKH-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC[C@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000556203755 1122873655 /nfs/dbraw/zinc/87/36/55/1122873655.db2.gz ZGBHLTWEOBESOX-QGPMSJSTSA-N 1 0 342.443 3.976 20 5 EHBDRO C[C@H](CC(=O)OC(C)(C)C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498626785 1122997420 /nfs/dbraw/zinc/99/74/20/1122997420.db2.gz MQOULHDFSFUKLW-LLVKDONJSA-N 1 0 342.823 3.501 20 5 EHBDRO CCCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000556886845 1123167316 /nfs/dbraw/zinc/16/73/16/1123167316.db2.gz PINGDFUPKKBIBI-KRWDZBQOSA-N 1 0 342.443 3.978 20 5 EHBDRO C[NH+](C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000301806510 1129104595 /nfs/dbraw/zinc/10/45/95/1129104595.db2.gz WCZNTIMUEUKOIG-HNNXBMFYSA-N 1 0 339.317 3.727 20 5 EHBDRO CCC[N@H+](Cn1nc(C)c([N+](=O)[O-])c1C)[C@@H]1CCc2ccccc2C1 ZINC000919951297 1123243685 /nfs/dbraw/zinc/24/36/85/1123243685.db2.gz QNXXOHVUDFGCKE-GOSISDBHSA-N 1 0 342.443 3.635 20 5 EHBDRO CCC1CCC([N@H+](C)Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000921046748 1123458730 /nfs/dbraw/zinc/45/87/30/1123458730.db2.gz QCWXEVOAXCWODT-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301813938 1129126714 /nfs/dbraw/zinc/12/67/14/1129126714.db2.gz FYRQELMIOCZRCF-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCNc2cc[nH+]c3cc(F)ccc23)cc1 ZINC000609595509 1123613916 /nfs/dbraw/zinc/61/39/16/1123613916.db2.gz GDKDYJHPUBJCNX-UHFFFAOYSA-N 1 0 327.315 3.773 20 5 EHBDRO CC(C)(C)c1coc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000922134634 1129139866 /nfs/dbraw/zinc/13/98/66/1129139866.db2.gz QFRHCFZDQSMSKN-UHFFFAOYSA-N 1 0 342.399 3.694 20 5 EHBDRO CCC[NH+]1CCC(N[C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000152652632 1123727379 /nfs/dbraw/zinc/72/73/79/1123727379.db2.gz MSVNPZWOQGSMKV-AWEZNQCLSA-N 1 0 335.448 3.519 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836013 1123884032 /nfs/dbraw/zinc/88/40/32/1123884032.db2.gz HCDDJXOIXIMFDU-DNXIFWLFSA-N 1 0 326.400 3.601 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](CCO)CCc1ccccc1 ZINC000615835598 1123884462 /nfs/dbraw/zinc/88/44/62/1123884462.db2.gz UPKAFMCRTKIXJU-VKAVYKQESA-N 1 0 340.423 3.535 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615943416 1123912885 /nfs/dbraw/zinc/91/28/85/1123912885.db2.gz KHXBOBWHNMCTBS-KRWDZBQOSA-N 1 0 344.459 3.981 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539655 1129160231 /nfs/dbraw/zinc/16/02/31/1129160231.db2.gz DNJUPBFKECSJOH-DOMZBBRYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000180626359 1124037378 /nfs/dbraw/zinc/03/73/78/1124037378.db2.gz IGLKNYFGLHRHDL-HNNXBMFYSA-N 1 0 346.358 3.746 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000301837154 1129174876 /nfs/dbraw/zinc/17/48/76/1129174876.db2.gz MKASNDFHOUXTGE-HIFRSBDPSA-N 1 0 332.791 3.501 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000080580385 1124531085 /nfs/dbraw/zinc/53/10/85/1124531085.db2.gz QRBUOTIANCWOGH-SFHVURJKSA-N 1 0 347.390 3.595 20 5 EHBDRO Cc1cc(NC[C@H](c2cccs2)[NH+]2CCCC2)ncc1[N+](=O)[O-] ZINC000080585180 1124534034 /nfs/dbraw/zinc/53/40/34/1124534034.db2.gz GQYRYKQAFHGPKC-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO CC[C@@H](Cc1cccs1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000618618681 1125135788 /nfs/dbraw/zinc/13/57/88/1125135788.db2.gz KOUDFPHRHVEHQG-NSHDSACASA-N 1 0 330.413 3.644 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493201 1131352972 /nfs/dbraw/zinc/35/29/72/1131352972.db2.gz YGTATWMVBNCDRH-CKEIUWERSA-N 1 0 335.423 3.571 20 5 EHBDRO CO[C@@H](C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC000619808754 1125410564 /nfs/dbraw/zinc/41/05/64/1125410564.db2.gz ZIJBKBQBJGCBEK-IBGZPJMESA-N 1 0 326.396 3.947 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1c1cccc(F)c1[N+](=O)[O-] ZINC000301860640 1129227284 /nfs/dbraw/zinc/22/72/84/1129227284.db2.gz CEZUCYITICJFCC-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000766215009 1131371208 /nfs/dbraw/zinc/37/12/08/1131371208.db2.gz AFXYPJWSJOTAIX-ZDUSSCGKSA-N 1 0 345.374 3.549 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000117342442 1129434995 /nfs/dbraw/zinc/43/49/95/1129434995.db2.gz XSLIRELBMMPVBM-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000543438791 1129489262 /nfs/dbraw/zinc/48/92/62/1129489262.db2.gz NDQOQHBTXHXZAA-QGZVFWFLSA-N 1 0 345.424 3.644 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](c1cccs1)C1CC1 ZINC000543438783 1129489488 /nfs/dbraw/zinc/48/94/88/1129489488.db2.gz NDQOQHBTXHXZAA-KRWDZBQOSA-N 1 0 345.424 3.644 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1Nc1cccc(CC[NH+]2CCCC2)c1 ZINC000301991123 1129505598 /nfs/dbraw/zinc/50/55/98/1129505598.db2.gz XXLKSTXGHSPKMB-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO C[C@@H](O)CC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481054 1129590561 /nfs/dbraw/zinc/59/05/61/1129590561.db2.gz ZDFLICLIUBYECU-LLVKDONJSA-N 1 0 338.791 3.711 20 5 EHBDRO CC[C@@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000124326903 1129598323 /nfs/dbraw/zinc/59/83/23/1129598323.db2.gz CMMHPEIWLMWQFB-GFCCVEGCSA-N 1 0 338.791 3.759 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cn1 ZINC000390854223 1129638514 /nfs/dbraw/zinc/63/85/14/1129638514.db2.gz JYEDTCOEDPAEOZ-QGZVFWFLSA-N 1 0 340.427 3.702 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034608 1129764643 /nfs/dbraw/zinc/76/46/43/1129764643.db2.gz JMIDJNIIKMRSAU-GJZGRUSLSA-N 1 0 335.423 3.825 20 5 EHBDRO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302045566 1129764658 /nfs/dbraw/zinc/76/46/58/1129764658.db2.gz KILYNVKOMMVPCN-VXGBXAGGSA-N 1 0 338.839 3.708 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302061813 1129765659 /nfs/dbraw/zinc/76/56/59/1129765659.db2.gz UCGFKJRVXKVLCK-OLZOCXBDSA-N 1 0 348.403 3.568 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302061814 1129765814 /nfs/dbraw/zinc/76/58/14/1129765814.db2.gz UCGFKJRVXKVLCK-QWHCGFSZSA-N 1 0 348.403 3.568 20 5 EHBDRO Cc1cccc(NC2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000302508388 1129780499 /nfs/dbraw/zinc/78/04/99/1129780499.db2.gz RPYARHQYBMZFDZ-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2C2CCCC2)c2c(c1)COCO2 ZINC000055927961 1129790560 /nfs/dbraw/zinc/79/05/60/1129790560.db2.gz UBOVJDFPKCQGGJ-QGZVFWFLSA-N 1 0 332.400 3.616 20 5 EHBDRO CCc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000056197487 1129805578 /nfs/dbraw/zinc/80/55/78/1129805578.db2.gz ZJTMPGSPXXTJMJ-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056197054 1129806186 /nfs/dbraw/zinc/80/61/86/1129806186.db2.gz NIERJRYGWWOUAO-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCc2nc(C)ncc21 ZINC000766045807 1129935700 /nfs/dbraw/zinc/93/57/00/1129935700.db2.gz VXBJXQCNXVMYRN-SJKOYZFVSA-N 1 0 326.400 3.730 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000282494889 1129946964 /nfs/dbraw/zinc/94/69/64/1129946964.db2.gz HWOHIMOPSQPMGF-KSSFIOAISA-N 1 0 348.443 3.993 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173344053 1130213990 /nfs/dbraw/zinc/21/39/90/1130213990.db2.gz OYXYCPZTUGJZQX-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535391 1130233077 /nfs/dbraw/zinc/23/30/77/1130233077.db2.gz WOMHUDFMWBGYAS-IRXDYDNUSA-N 1 0 331.460 3.772 20 5 EHBDRO CC[N@@H+]1CC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907093 1130330166 /nfs/dbraw/zinc/33/01/66/1130330166.db2.gz FJFVBIMQLOFCHF-OXJNMPFZSA-N 1 0 339.439 3.616 20 5 EHBDRO Cn1cccc1[C@@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000175119273 1130408203 /nfs/dbraw/zinc/40/82/03/1130408203.db2.gz WIISSNNKKXXUSZ-INIZCTEOSA-N 1 0 329.400 3.539 20 5 EHBDRO C[NH+](C)C1(CNc2nc3ccc([N+](=O)[O-])cc3s2)CCCCC1 ZINC000731205813 1130778256 /nfs/dbraw/zinc/77/82/56/1130778256.db2.gz LOKOPOLVOLYNES-UHFFFAOYSA-N 1 0 334.445 3.881 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000766191863 1131073939 /nfs/dbraw/zinc/07/39/39/1131073939.db2.gz GXAZEFGYBQJYMZ-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO C[C@@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021845 1131570828 /nfs/dbraw/zinc/57/08/28/1131570828.db2.gz QGCGTCIVXUNFRA-TUAOUCFPSA-N 1 0 340.807 3.553 20 5 EHBDRO O=[N+]([O-])c1cn(C[N@H+](C2CC2)C2CCCCC2)nc1-c1ccncc1 ZINC000742145069 1131690619 /nfs/dbraw/zinc/69/06/19/1131690619.db2.gz LLKGKIKNLFHMBN-UHFFFAOYSA-N 1 0 341.415 3.608 20 5 EHBDRO CN(CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172897620 1131881838 /nfs/dbraw/zinc/88/18/38/1131881838.db2.gz BHGCOEVLKAOMAB-SFHVURJKSA-N 1 0 339.439 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCCc3ncccc31)CC2 ZINC001172900829 1131883884 /nfs/dbraw/zinc/88/38/84/1131883884.db2.gz GCNHWJXULXJJOM-UZLBHIALSA-N 1 0 337.423 3.904 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901030 1131884079 /nfs/dbraw/zinc/88/40/79/1131884079.db2.gz FSVBYCSVYQUSPE-KSSFIOAISA-N 1 0 340.423 3.769 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172901097 1131884127 /nfs/dbraw/zinc/88/41/27/1131884127.db2.gz JJSDFNLWUIGXGD-PKOBYXMFSA-N 1 0 325.412 3.978 20 5 EHBDRO [NH3+]Cc1cccc2ncn([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c21 ZINC001172902659 1131885692 /nfs/dbraw/zinc/88/56/92/1131885692.db2.gz LQTDTEGCROPJME-INIZCTEOSA-N 1 0 336.395 3.523 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172908610 1131887133 /nfs/dbraw/zinc/88/71/33/1131887133.db2.gz DYLSZBTYYCEWMO-SFHVURJKSA-N 1 0 340.423 3.983 20 5 EHBDRO CC(C)([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172896713 1131902633 /nfs/dbraw/zinc/90/26/33/1131902633.db2.gz RKNCEOKUZYBXJF-QGZVFWFLSA-N 1 0 325.412 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCc3ccsc3C1)CC2 ZINC001172914605 1131902754 /nfs/dbraw/zinc/90/27/54/1131902754.db2.gz IFCFVGBJZLZNSZ-MRXNPFEDSA-N 1 0 328.437 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](c3cccnc3)C1)CC2 ZINC001172915537 1131903171 /nfs/dbraw/zinc/90/31/71/1131903171.db2.gz OPGPJTKXIRCVRN-RTBURBONSA-N 1 0 337.423 3.727 20 5 EHBDRO C[C@@H](C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172911310 1131917855 /nfs/dbraw/zinc/91/78/55/1131917855.db2.gz IIBRMRGPIRJTFN-KSSFIOAISA-N 1 0 340.423 3.941 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[C@@H](F)CC2)c1F ZINC001173174909 1131991076 /nfs/dbraw/zinc/99/10/76/1131991076.db2.gz FZQQPFFDMNGIJP-SDDRHHMPSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2cc(C)cs2)c1F ZINC001173176105 1131991611 /nfs/dbraw/zinc/99/16/11/1131991611.db2.gz XLVMJCQUUSIBMF-LLVKDONJSA-N 1 0 338.404 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C(C(C)C)C(C)C)c1F ZINC001173188863 1131993185 /nfs/dbraw/zinc/99/31/85/1131993185.db2.gz LLVRSXZSWKFXAC-GFCCVEGCSA-N 1 0 326.412 3.944 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2ccc(C)cn2)c1F ZINC001173187671 1131993490 /nfs/dbraw/zinc/99/34/90/1131993490.db2.gz FFDZESAXMUPUPD-STQMWFEESA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C(C)(C)c2ccncc2)c1F ZINC001173183095 1131993767 /nfs/dbraw/zinc/99/37/67/1131993767.db2.gz LEYGNNDCKDNMRH-GFCCVEGCSA-N 1 0 347.390 3.593 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCCC(F)(F)F)c1F ZINC001173183214 1131994368 /nfs/dbraw/zinc/99/43/68/1131994368.db2.gz LNTRXVYPWDGNBL-VIFPVBQESA-N 1 0 338.301 3.606 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC001173217866 1132001944 /nfs/dbraw/zinc/00/19/44/1132001944.db2.gz MUDVZNQWNKYPJT-ACJLOTCBSA-N 1 0 348.830 3.893 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173216237 1132002047 /nfs/dbraw/zinc/00/20/47/1132002047.db2.gz HKGUCVVXPCZFDO-YOEHRIQHSA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOc1cccc(F)c1 ZINC001173220186 1132003894 /nfs/dbraw/zinc/00/38/94/1132003894.db2.gz VPDKVVZODXWUBM-CQSZACIVSA-N 1 0 332.375 3.724 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2cccnc2)CC1 ZINC001173224718 1132005452 /nfs/dbraw/zinc/00/54/52/1132005452.db2.gz OMAYFQYOXJECFQ-OAHLLOKOSA-N 1 0 325.412 3.533 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2ccccn2)CCC1 ZINC001173226656 1132007187 /nfs/dbraw/zinc/00/71/87/1132007187.db2.gz YHMMOCRWBXGNNI-INIZCTEOSA-N 1 0 339.439 3.923 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231190 1132009550 /nfs/dbraw/zinc/00/95/50/1132009550.db2.gz KJQBWOIBRVURHN-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C(=O)c2ccccc2)C1 ZINC001173233807 1132010834 /nfs/dbraw/zinc/01/08/34/1132010834.db2.gz YYWJXLCQEINBSN-MAUKXSAKSA-N 1 0 338.407 3.731 20 5 EHBDRO COC(=O)c1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173209748 1132012422 /nfs/dbraw/zinc/01/24/22/1132012422.db2.gz FHBZAIMJRGLZBP-ZIAGYGMSSA-N 1 0 342.395 3.663 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)n1C ZINC001173209824 1132013008 /nfs/dbraw/zinc/01/30/08/1132013008.db2.gz GLGNMBYOIYPURU-LLVKDONJSA-N 1 0 341.333 3.673 20 5 EHBDRO CC(C)C[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)C1CCCC1 ZINC000746056276 1132358780 /nfs/dbraw/zinc/35/87/80/1132358780.db2.gz XKLXTCFBBCUFKV-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccncc1F ZINC001175202636 1132584859 /nfs/dbraw/zinc/58/48/59/1132584859.db2.gz VYRBYLFYPVQTSS-UHFFFAOYSA-N 1 0 348.381 3.778 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168975976 1132617004 /nfs/dbraw/zinc/61/70/04/1132617004.db2.gz XVHLSLUBWGREFY-RISCZKNCSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCCC[C@H]2OCc2ccccc2)C1 ZINC001168958890 1132620462 /nfs/dbraw/zinc/62/04/62/1132620462.db2.gz RDRYBDZEEHHBPG-NCXUSEDFSA-N 1 0 332.444 3.549 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168966125 1132621669 /nfs/dbraw/zinc/62/16/69/1132621669.db2.gz GLQOJGFYAOLPDH-GDBMZVCRSA-N 1 0 349.431 3.569 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168991822 1132626571 /nfs/dbraw/zinc/62/65/71/1132626571.db2.gz CERNDIOBGIMJKF-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ncccc2C(F)(F)F)C2CC2)C1 ZINC001168997009 1132627686 /nfs/dbraw/zinc/62/76/86/1132627686.db2.gz AYSWGBJOOQIPNQ-QKCSRTOESA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(Oc3ccccc3Cl)CC2)C1 ZINC001169024973 1132640265 /nfs/dbraw/zinc/64/02/65/1132640265.db2.gz IGCXZBCJMRNVJR-KGLIPLIRSA-N 1 0 338.835 3.629 20 5 EHBDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055412 1132644480 /nfs/dbraw/zinc/64/44/80/1132644480.db2.gz PXDFNMORLFYEOR-ZOWXZIJZSA-N 1 0 341.249 3.887 20 5 EHBDRO C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057912 1132646491 /nfs/dbraw/zinc/64/64/91/1132646491.db2.gz YXKXZQDVZAAALQ-HIFRSBDPSA-N 1 0 330.350 3.625 20 5 EHBDRO COc1cc([N+](=O)[O-])c(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)cc1F ZINC001169697597 1132823791 /nfs/dbraw/zinc/82/37/91/1132823791.db2.gz OBCXJLZNDJVWIS-CQSZACIVSA-N 1 0 345.374 3.983 20 5 EHBDRO C[C@@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C1CCCC1 ZINC001176153308 1132865021 /nfs/dbraw/zinc/86/50/21/1132865021.db2.gz DMOSAILYOOOUEK-CYBMUJFWSA-N 1 0 337.851 3.697 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804355503 1133007292 /nfs/dbraw/zinc/00/72/92/1133007292.db2.gz ZCLKOBBTBYNSCB-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO CCOCC(C)(C)C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178836031 1133203116 /nfs/dbraw/zinc/20/31/16/1133203116.db2.gz QTAAAEKHPNOJPP-UHFFFAOYSA-N 1 0 345.237 3.510 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CCCN2CC(F)F)cc1[N+](=O)[O-] ZINC001179160557 1133233586 /nfs/dbraw/zinc/23/35/86/1133233586.db2.gz ZLNIEVHYOSONCK-CQSZACIVSA-N 1 0 341.402 3.537 20 5 EHBDRO CCC[C@@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001179359288 1133247550 /nfs/dbraw/zinc/24/75/50/1133247550.db2.gz RQTRBSHEGKECPF-AWEZNQCLSA-N 1 0 334.441 3.964 20 5 EHBDRO CC1(C)C[C@@]1(C)C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001179468524 1133253636 /nfs/dbraw/zinc/25/36/36/1133253636.db2.gz GIPPFGVQGNJSQN-AWEZNQCLSA-N 1 0 327.222 3.883 20 5 EHBDRO C[C@@H]1COC[C@@H]1[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644936 1133265867 /nfs/dbraw/zinc/26/58/67/1133265867.db2.gz AQHBBWLNBTUIFF-YGRLFVJLSA-N 1 0 336.775 3.633 20 5 EHBDRO CCSc1cccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000769910700 1133357775 /nfs/dbraw/zinc/35/77/75/1133357775.db2.gz GYZGHPNIQOOWIY-KRWDZBQOSA-N 1 0 332.425 3.530 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000770379220 1133416886 /nfs/dbraw/zinc/41/68/86/1133416886.db2.gz JLSXFGQNDZCPCI-UHFFFAOYSA-N 1 0 338.407 3.707 20 5 EHBDRO CCOC(=O)CC(C)(C)C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181878410 1133545758 /nfs/dbraw/zinc/54/57/58/1133545758.db2.gz ACGUVXYIXMWTOM-INIZCTEOSA-N 1 0 348.443 3.754 20 5 EHBDRO CCC(CC)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)SC ZINC000774207818 1133634557 /nfs/dbraw/zinc/63/45/57/1133634557.db2.gz GECJHSNUDKAMGR-UONOGXRCSA-N 1 0 340.493 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1COC3(CCCCC3)O1)CCC2 ZINC000774273517 1133653082 /nfs/dbraw/zinc/65/30/82/1133653082.db2.gz SKHKHJRXQLICHB-AEFFLSMTSA-N 1 0 346.427 3.638 20 5 EHBDRO CSCCCCCC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774355230 1133669592 /nfs/dbraw/zinc/66/95/92/1133669592.db2.gz PVRFQPUTIJDYQL-HUUCEWRRSA-N 1 0 340.493 3.788 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC000786811092 1133909280 /nfs/dbraw/zinc/90/92/80/1133909280.db2.gz ICWCOTAOROXXSH-BAAYTWLHSA-N 1 0 326.396 3.841 20 5 EHBDRO COc1cc(NCC[NH+](C(C)C)C(C)C)c(Cl)cc1[N+](=O)[O-] ZINC001184554564 1133956325 /nfs/dbraw/zinc/95/63/25/1133956325.db2.gz ALDSUVQHQOGIAU-UHFFFAOYSA-N 1 0 329.828 3.788 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000746676138 1133993109 /nfs/dbraw/zinc/99/31/09/1133993109.db2.gz ZWGNGXZTTAVIDL-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[C@H](CNc1ccc([N+](=O)[O-])cc1Br)[NH+]1CCCC1 ZINC001184820428 1133994645 /nfs/dbraw/zinc/99/46/45/1133994645.db2.gz JUCBNHYPZHXCRG-LLVKDONJSA-N 1 0 342.237 3.644 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000774843533 1134051437 /nfs/dbraw/zinc/05/14/37/1134051437.db2.gz JVHLVERDDRGUSQ-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC001185263139 1134059011 /nfs/dbraw/zinc/05/90/11/1134059011.db2.gz LXVIANAKTNOSBS-GOSISDBHSA-N 1 0 339.439 3.880 20 5 EHBDRO CC1(C)CC[N@H+](Cn2cc(-c3cccc([N+](=O)[O-])c3)cn2)CCS1 ZINC000788377394 1134119158 /nfs/dbraw/zinc/11/91/58/1134119158.db2.gz UJYQGRSCLIUNIA-UHFFFAOYSA-N 1 0 346.456 3.633 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C(C)C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000788541893 1134139740 /nfs/dbraw/zinc/13/97/40/1134139740.db2.gz YSJFKIGVTBQSRK-RBUKOAKNSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788568889 1134146348 /nfs/dbraw/zinc/14/63/48/1134146348.db2.gz FDZMUIKYTPBUBN-ZIAGYGMSSA-N 1 0 343.427 3.858 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788796781 1134170179 /nfs/dbraw/zinc/17/01/79/1134170179.db2.gz VALAHSBJEWIJKP-BDJLRTHQSA-N 1 0 349.818 3.869 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788777867 1134174046 /nfs/dbraw/zinc/17/40/46/1134174046.db2.gz QHPMSYYJDMCITF-DZGCQCFKSA-N 1 0 333.432 3.710 20 5 EHBDRO C[C@@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788825754 1134178191 /nfs/dbraw/zinc/17/81/91/1134178191.db2.gz ZOKXQCYOEZJEII-BMIGLBTASA-N 1 0 331.803 3.648 20 5 EHBDRO CC[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccccc1OC ZINC000775070032 1134283799 /nfs/dbraw/zinc/28/37/99/1134283799.db2.gz VBROHKRGXKSTEJ-KRWDZBQOSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790697243 1134454470 /nfs/dbraw/zinc/45/44/70/1134454470.db2.gz WOFVJIHQCSZZHM-ZDUSSCGKSA-N 1 0 343.383 3.922 20 5 EHBDRO CCC[N@H+](CC)CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000218973051 1134460034 /nfs/dbraw/zinc/46/00/34/1134460034.db2.gz OBKULAALCCIUID-UHFFFAOYSA-N 1 0 330.226 3.501 20 5 EHBDRO CC[C@@](C)([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000775386017 1134697068 /nfs/dbraw/zinc/69/70/68/1134697068.db2.gz BULSBCPZARIDEB-LJQANCHMSA-N 1 0 341.411 3.757 20 5 EHBDRO CCc1ccc(C[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170298056 1134738380 /nfs/dbraw/zinc/73/83/80/1134738380.db2.gz ZDOTZJOGQVPVPP-AWEZNQCLSA-N 1 0 328.412 3.887 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCOc3ccccc32)c([N+](=O)[O-])c1 ZINC001170300182 1134738885 /nfs/dbraw/zinc/73/88/85/1134738885.db2.gz YHQKUTZNWHRPSA-SUMWQHHRSA-N 1 0 342.395 3.648 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccncc1 ZINC001170304265 1134739198 /nfs/dbraw/zinc/73/91/98/1134739198.db2.gz ARNYZKCLOLQFFE-DYVFJYSZSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCc3ccncc32)c([N+](=O)[O-])c1 ZINC001170325832 1134748443 /nfs/dbraw/zinc/74/84/43/1134748443.db2.gz AMJKJBIBVHYDRI-FZKQIMNGSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170336494 1134752249 /nfs/dbraw/zinc/75/22/49/1134752249.db2.gz XVYRRFBXXGNDET-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348452 1134759660 /nfs/dbraw/zinc/75/96/60/1134759660.db2.gz XBUUVKXJTJUNPW-LBPRGKRZSA-N 1 0 332.425 3.654 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CC(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170351606 1134760707 /nfs/dbraw/zinc/76/07/07/1134760707.db2.gz GKIOVCMRESETDW-AWEZNQCLSA-N 1 0 326.396 3.634 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@]3(C)[C@@H](C2)C3(Cl)Cl)cccc1[N+](=O)[O-] ZINC000792912187 1134823333 /nfs/dbraw/zinc/82/33/33/1134823333.db2.gz YXFLRGCSLQBZJY-KGLIPLIRSA-N 1 0 329.227 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cccnc1F ZINC000793279190 1134901216 /nfs/dbraw/zinc/90/12/16/1134901216.db2.gz BBCCMOXNNIPPEN-CJNGLKHVSA-N 1 0 329.375 3.630 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](CCO)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001192358023 1135005651 /nfs/dbraw/zinc/00/56/51/1135005651.db2.gz CRDROILHPYCFCX-CYBMUJFWSA-N 1 0 334.803 3.804 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000804394362 1135054233 /nfs/dbraw/zinc/05/42/33/1135054233.db2.gz GVRSUJVMRFELOW-LJQANCHMSA-N 1 0 340.427 3.734 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)c(F)c1 ZINC001192880467 1135074283 /nfs/dbraw/zinc/07/42/83/1135074283.db2.gz BQLDSKFDQIEDIG-ZWKOTPCHSA-N 1 0 332.375 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NCCCCC[NH+]1CCCCC1 ZINC000804446935 1135079211 /nfs/dbraw/zinc/07/92/11/1135079211.db2.gz RTTPUCRQWZICRV-UHFFFAOYSA-N 1 0 336.392 3.571 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C1(CC)CC ZINC001193663289 1135169302 /nfs/dbraw/zinc/16/93/02/1135169302.db2.gz RMMREZWMSDCPOK-SJORKVTESA-N 1 0 336.432 3.547 20 5 EHBDRO CCCCO[C@@H]1C[C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1(C)C ZINC001194190023 1135241338 /nfs/dbraw/zinc/24/13/38/1135241338.db2.gz JDDQCCXHHOTNDL-DLBZAZTESA-N 1 0 336.432 3.677 20 5 EHBDRO CC(C)(C)OC(=O)CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194477856 1135276267 /nfs/dbraw/zinc/27/62/67/1135276267.db2.gz RNVGJJPAIJFRMW-HNNXBMFYSA-N 1 0 334.416 3.506 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477552 1135276462 /nfs/dbraw/zinc/27/64/62/1135276462.db2.gz MLIQADZJDBLRQC-SCTDSRPQSA-N 1 0 345.487 3.752 20 5 EHBDRO C[NH+](C)CC(C)(C)CNc1cc2ccc(Cl)nc2cc1[N+](=O)[O-] ZINC001157948716 1135337607 /nfs/dbraw/zinc/33/76/07/1135337607.db2.gz NKQMUQNCGLALIK-UHFFFAOYSA-N 1 0 336.823 3.796 20 5 EHBDRO CC[N@H+](CCCNC(=O)c1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC001130585056 1135422877 /nfs/dbraw/zinc/42/28/77/1135422877.db2.gz CHIXFMLGMZTGFD-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO CC(C)(C)OC(=O)C[C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195798125 1135471567 /nfs/dbraw/zinc/47/15/67/1135471567.db2.gz MZVOZUXUHXOGHP-QGZVFWFLSA-N 1 0 348.443 3.724 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@@H]1C1CCC1 ZINC001195825507 1135477954 /nfs/dbraw/zinc/47/79/54/1135477954.db2.gz KKSXDCRYMKXAHS-GOSISDBHSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@H](C4CC4)C3)c2)cc1 ZINC000808231188 1135633743 /nfs/dbraw/zinc/63/37/43/1135633743.db2.gz ZLZYIVXLDLZYJV-INIZCTEOSA-N 1 0 326.400 3.538 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563866 1135830911 /nfs/dbraw/zinc/83/09/11/1135830911.db2.gz TXPOPYPMTOLTCL-GJZGRUSLSA-N 1 0 338.835 3.887 20 5 EHBDRO Cc1cc(C)c2c(c1)CC[N@@H+](CCOc1ccccc1[N+](=O)[O-])C2 ZINC001198852312 1135860790 /nfs/dbraw/zinc/86/07/90/1135860790.db2.gz POVMRHGFOFDETH-UHFFFAOYSA-N 1 0 326.396 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2CC(c3cccc(Cl)c3)C2)cc1 ZINC000809732600 1135873644 /nfs/dbraw/zinc/87/36/44/1135873644.db2.gz GJVCCLNPNRFLPL-PVARCSIZSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1 ZINC001201450680 1136026733 /nfs/dbraw/zinc/02/67/33/1136026733.db2.gz ZHCMFWBSGXEMKV-ZDUSSCGKSA-N 1 0 349.793 3.756 20 5 EHBDRO Cc1cc(Br)cc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)c1 ZINC001201822499 1136067961 /nfs/dbraw/zinc/06/79/61/1136067961.db2.gz KPWXWIANBPNDNW-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCO[C@H](C4CC4)C3)o2)cc1 ZINC001201910631 1136074400 /nfs/dbraw/zinc/07/44/00/1136074400.db2.gz HTPNTPMMZMDIRY-KXBFYZLASA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1cscn1 ZINC000811481673 1136091571 /nfs/dbraw/zinc/09/15/71/1136091571.db2.gz JECWKMZXUAEVSH-UHFFFAOYSA-N 1 0 332.212 3.690 20 5 EHBDRO C[NH+](C)C1(CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC1 ZINC000811472630 1136095786 /nfs/dbraw/zinc/09/57/86/1136095786.db2.gz KTRWSJWIYHMQQQ-UHFFFAOYSA-N 1 0 346.258 3.866 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC001202227812 1136113746 /nfs/dbraw/zinc/11/37/46/1136113746.db2.gz OAPQMPJGVPAWQP-UHFFFAOYSA-N 1 0 336.395 3.626 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCCCc3ccccc32)cc1 ZINC000747815220 1136247943 /nfs/dbraw/zinc/24/79/43/1136247943.db2.gz KJNVNUYBCRZIPY-RTBURBONSA-N 1 0 326.396 3.686 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1ccc(Cl)nc1 ZINC000850441293 1136259323 /nfs/dbraw/zinc/25/93/23/1136259323.db2.gz UPDHZOQJPWGTTK-LLVKDONJSA-N 1 0 335.791 3.545 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812854327 1136262586 /nfs/dbraw/zinc/26/25/86/1136262586.db2.gz XEZHGCFAYGZBHH-SCLBCKFNSA-N 1 0 332.375 3.678 20 5 EHBDRO C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+](C2CCC2)C1 ZINC000813630982 1136354515 /nfs/dbraw/zinc/35/45/15/1136354515.db2.gz UBNPOWRDABKORH-LBPRGKRZSA-N 1 0 346.456 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583103 1136441796 /nfs/dbraw/zinc/44/17/96/1136441796.db2.gz WJNYXEAIAMOZGM-MAUKXSAKSA-N 1 0 346.814 3.771 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585262 1136442464 /nfs/dbraw/zinc/44/24/64/1136442464.db2.gz SOJQKJJBLLGUMZ-LSBZLQRGSA-N 1 0 326.396 3.506 20 5 EHBDRO CC(C)C[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579184 1136444093 /nfs/dbraw/zinc/44/40/93/1136444093.db2.gz LKWMDGMXOMIGBJ-IBGZPJMESA-N 1 0 328.412 3.786 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000852426871 1136455452 /nfs/dbraw/zinc/45/54/52/1136455452.db2.gz PURCLXDHKAYYCH-FUHWJXTLSA-N 1 0 342.395 3.839 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000776606652 1136470442 /nfs/dbraw/zinc/47/04/42/1136470442.db2.gz YVFFMIDYHKVJFT-OALUTQOASA-N 1 0 342.439 3.974 20 5 EHBDRO Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C2 ZINC000815185516 1136563652 /nfs/dbraw/zinc/56/36/52/1136563652.db2.gz ILCMZTIFDIOSAL-LJQANCHMSA-N 1 0 340.423 3.774 20 5 EHBDRO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774783 1136661294 /nfs/dbraw/zinc/66/12/94/1136661294.db2.gz OKJBUSBDADPSKT-KZNAEPCWSA-N 1 0 340.427 3.715 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414682 1136806626 /nfs/dbraw/zinc/80/66/26/1136806626.db2.gz ICZMXEJNNGWRTH-VXGBXAGGSA-N 1 0 333.215 3.949 20 5 EHBDRO Cc1[nH]c2ccc(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)cc2c1C ZINC000818974869 1136900753 /nfs/dbraw/zinc/90/07/53/1136900753.db2.gz FUOUCRRVZVAWTJ-LJQANCHMSA-N 1 0 339.395 3.516 20 5 EHBDRO Cc1[nH]c2ccc(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)cc2c1C ZINC000818974868 1136900831 /nfs/dbraw/zinc/90/08/31/1136900831.db2.gz FUOUCRRVZVAWTJ-IBGZPJMESA-N 1 0 339.395 3.516 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1COC2(CCCCCC2)O1 ZINC000776958650 1136904214 /nfs/dbraw/zinc/90/42/14/1136904214.db2.gz FACJCYFDVFYDIU-KMDWOBIYSA-N 1 0 346.427 3.664 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858013479 1136930967 /nfs/dbraw/zinc/93/09/67/1136930967.db2.gz CYIMXRYHFJUGAR-KRWDZBQOSA-N 1 0 339.395 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC[C@H]3CC=CCC3)CC2)cc1 ZINC000858515785 1136975757 /nfs/dbraw/zinc/97/57/57/1136975757.db2.gz UBKGXLBCZVHXKX-INIZCTEOSA-N 1 0 329.444 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]3COCC[C@@H]32)c1 ZINC000339015683 1136995346 /nfs/dbraw/zinc/99/53/46/1136995346.db2.gz WPCFZVODFYIFHG-NHYWBVRUSA-N 1 0 344.333 3.615 20 5 EHBDRO CC[NH+](CC)CCCCNC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000859357729 1137012762 /nfs/dbraw/zinc/01/27/62/1137012762.db2.gz LVRXKZNOTRVFOJ-UHFFFAOYSA-N 1 0 343.427 3.600 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859586369 1137021445 /nfs/dbraw/zinc/02/14/45/1137021445.db2.gz NNUFMVNEJLHNMS-HNAYVOBHSA-N 1 0 326.396 3.639 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830160 1137033586 /nfs/dbraw/zinc/03/35/86/1137033586.db2.gz NECOVKJHNUFIMG-VXFNFUGZSA-N 1 0 333.215 3.803 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2C[C@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000822807749 1137075209 /nfs/dbraw/zinc/07/52/09/1137075209.db2.gz FYFXULNJYNCFOR-UGFHNGPFSA-N 1 0 328.372 3.546 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)c1 ZINC000824949071 1137159012 /nfs/dbraw/zinc/15/90/12/1137159012.db2.gz XGIRVTLZIPFVQN-PBHICJAKSA-N 1 0 347.802 3.653 20 5 EHBDRO C[N@H+](CC1CC1)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865576388 1137296413 /nfs/dbraw/zinc/29/64/13/1137296413.db2.gz LDKVOAJMPVUPLL-CYBMUJFWSA-N 1 0 339.386 3.701 20 5 EHBDRO COc1cccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1OC(C)C ZINC000865786730 1137312043 /nfs/dbraw/zinc/31/20/43/1137312043.db2.gz UHMXBRAILFDKMO-UHFFFAOYSA-N 1 0 344.411 3.989 20 5 EHBDRO CCC(=O)c1ccc(N2CCC(C)([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000866019359 1137324771 /nfs/dbraw/zinc/32/47/71/1137324771.db2.gz BGCAZYXUYDUYKS-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@](C)(O)c1ccccc1 ZINC000846035340 1137328353 /nfs/dbraw/zinc/32/83/53/1137328353.db2.gz GSQXXGWVKYLMJJ-PXAZEXFGSA-N 1 0 334.803 3.634 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000846190123 1137340753 /nfs/dbraw/zinc/34/07/53/1137340753.db2.gz SKPHYQWOVYZHOT-CCKFTAQKSA-N 1 0 328.412 3.932 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@](C)(O)c1ccccc1 ZINC000846191302 1137341065 /nfs/dbraw/zinc/34/10/65/1137341065.db2.gz XOIADQDQWYXZBL-VHKYSDTDSA-N 1 0 340.423 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCC13CCOCC3)CCC2 ZINC000866531415 1137361963 /nfs/dbraw/zinc/36/19/63/1137361963.db2.gz QDXRQXZYOCYEJU-YJBOKZPZSA-N 1 0 330.428 3.769 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000866538568 1137362974 /nfs/dbraw/zinc/36/29/74/1137362974.db2.gz SVSKCHXFUJWBHJ-JQFCIGGWSA-N 1 0 348.443 3.707 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@H]23)cc1[N+](=O)[O-] ZINC000773134443 1137467524 /nfs/dbraw/zinc/46/75/24/1137467524.db2.gz JJMKOPUAKZLINO-RUAUBTSSSA-N 1 0 338.498 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]C2(c3ccccc3Cl)CC2)cc1 ZINC001171471166 1137492840 /nfs/dbraw/zinc/49/28/40/1137492840.db2.gz PCGFRDKYIQOUGG-UHFFFAOYSA-N 1 0 332.787 3.906 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872018914 1137564954 /nfs/dbraw/zinc/56/49/54/1137564954.db2.gz QZQORWBWZQEGAL-GFCCVEGCSA-N 1 0 342.374 3.743 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1cn(C)nc1C ZINC000872030722 1137566324 /nfs/dbraw/zinc/56/63/24/1137566324.db2.gz BBSPXCQHEHIJOQ-WDEREUQCSA-N 1 0 334.445 3.770 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1ccsc1 ZINC000872037789 1137566981 /nfs/dbraw/zinc/56/69/81/1137566981.db2.gz IEJCXHAIDRVGMU-YGRLFVJLSA-N 1 0 338.454 3.762 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@@H](C)c3c(F)cccc3[N+](=O)[O-])nc12 ZINC000872041421 1137567032 /nfs/dbraw/zinc/56/70/32/1137567032.db2.gz SRSCECLISDDAIQ-ZDUSSCGKSA-N 1 0 342.374 3.583 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)CCCO ZINC000872046207 1137567459 /nfs/dbraw/zinc/56/74/59/1137567459.db2.gz FUCSAZOXAYYPIB-LBPRGKRZSA-N 1 0 326.462 3.766 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057571 1137568671 /nfs/dbraw/zinc/56/86/71/1137568671.db2.gz GBQFDZKXLMIHHJ-SONRMIBWSA-N 1 0 334.391 3.732 20 5 EHBDRO Cc1cccc2nc(CC[NH2+][C@H](C)c3c(F)cccc3[N+](=O)[O-])cn21 ZINC000872080548 1137570160 /nfs/dbraw/zinc/57/01/60/1137570160.db2.gz AFDSUCOXJRARIW-CYBMUJFWSA-N 1 0 342.374 3.583 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872082916 1137570316 /nfs/dbraw/zinc/57/03/16/1137570316.db2.gz DUPCUFBTPUFACD-MRRJBJDNSA-N 1 0 345.374 3.700 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1c2ccccc2CN1C)c1c(F)cccc1[N+](=O)[O-] ZINC000872091963 1137570875 /nfs/dbraw/zinc/57/08/75/1137570875.db2.gz KRQJEEJQUOAXAH-PXAZEXFGSA-N 1 0 329.375 3.571 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129598 1137573125 /nfs/dbraw/zinc/57/31/25/1137573125.db2.gz REMXLQIKFZEWMM-STQMWFEESA-N 1 0 345.374 3.802 20 5 EHBDRO Cc1nccnc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000872133161 1137573509 /nfs/dbraw/zinc/57/35/09/1137573509.db2.gz KVPCEKKOYSYMEQ-ZMSDIMECSA-N 1 0 340.427 3.755 20 5 EHBDRO CCCCn1cc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c(C)n1 ZINC000873100107 1137590131 /nfs/dbraw/zinc/59/01/31/1137590131.db2.gz KGYVXCYMAGDMIC-UHFFFAOYSA-N 1 0 330.432 3.806 20 5 EHBDRO CCOc1ccccc1[C@@H](CC)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876994443 1137667295 /nfs/dbraw/zinc/66/72/95/1137667295.db2.gz IVBRPLAKCKWVCY-MQBCKMQZSA-N 1 0 344.415 3.634 20 5 EHBDRO Cc1n[nH]cc1C1CC[NH+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877506883 1137679095 /nfs/dbraw/zinc/67/90/95/1137679095.db2.gz GPUQJDRPIXUTFS-UHFFFAOYSA-N 1 0 328.416 3.623 20 5 EHBDRO Cc1ccc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc12 ZINC000877587379 1137682148 /nfs/dbraw/zinc/68/21/48/1137682148.db2.gz JQOKIPZDZQFGPB-UHFFFAOYSA-N 1 0 336.395 3.746 20 5 EHBDRO C[C@@]1(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@]1(F)Cl ZINC000877610953 1137682755 /nfs/dbraw/zinc/68/27/55/1137682755.db2.gz MRZOESBOUUGAMA-KGLIPLIRSA-N 1 0 327.743 3.530 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCC2(CCOCC2)O1 ZINC000877993108 1137698924 /nfs/dbraw/zinc/69/89/24/1137698924.db2.gz XHLRZJCXRLBHBI-SFHVURJKSA-N 1 0 348.443 3.533 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCOCC3)CO2)cc1[N+](=O)[O-] ZINC000878371849 1137713215 /nfs/dbraw/zinc/71/32/15/1137713215.db2.gz SFKPWSSTBIUMON-NVXWUHKLSA-N 1 0 348.443 3.530 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1(C)C ZINC000878432926 1137715771 /nfs/dbraw/zinc/71/57/71/1137715771.db2.gz MNLGRBWALMVLAF-GFCCVEGCSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000129715474 1137828904 /nfs/dbraw/zinc/82/89/04/1137828904.db2.gz USRPKIVPLFKPMH-KRWDZBQOSA-N 1 0 329.356 3.786 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)CC(F)F ZINC000883258559 1137850981 /nfs/dbraw/zinc/85/09/81/1137850981.db2.gz GWQCOISGIUOGEM-NSHDSACASA-N 1 0 343.374 3.583 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000131452128 1137853575 /nfs/dbraw/zinc/85/35/75/1137853575.db2.gz CFTOOPLGHJGZHX-QGZVFWFLSA-N 1 0 331.416 3.669 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000132569299 1137867435 /nfs/dbraw/zinc/86/74/35/1137867435.db2.gz LCAVRYHJNIQMPG-HUUCEWRRSA-N 1 0 326.487 3.874 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000102794182 1137873955 /nfs/dbraw/zinc/87/39/55/1137873955.db2.gz KOGAWZWJQMROFU-UHFFFAOYSA-N 1 0 332.404 3.949 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034158 1137929360 /nfs/dbraw/zinc/92/93/60/1137929360.db2.gz ZVOFYHWMPOOBNR-CZAUZLFCSA-N 1 0 332.444 3.917 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000120324719 1137948576 /nfs/dbraw/zinc/94/85/76/1137948576.db2.gz FDNGOAAVGDLNBH-KBXCAEBGSA-N 1 0 344.411 3.686 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC000884570377 1137963460 /nfs/dbraw/zinc/96/34/60/1137963460.db2.gz NYIUCLIYDWEWRW-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2C)c(C[NH+](C)C)c1 ZINC000072839555 1138108233 /nfs/dbraw/zinc/10/82/33/1138108233.db2.gz DTMKFQUFYIFRJN-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]3C3CCCC3)o2)cc1 ZINC000079393823 1138155796 /nfs/dbraw/zinc/15/57/96/1138155796.db2.gz VQRIOEBHDTUPQW-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO C[C@H]1C[C@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639010 1138466309 /nfs/dbraw/zinc/46/63/09/1138466309.db2.gz ORYPXUNXPRKABX-WMLDXEAASA-N 1 0 343.427 3.769 20 5 EHBDRO CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOCC1 ZINC000131162277 1138499464 /nfs/dbraw/zinc/49/94/64/1138499464.db2.gz LBFPBONQUFYFIL-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)O[C@@H](C)C2 ZINC000132100208 1138561959 /nfs/dbraw/zinc/56/19/59/1138561959.db2.gz XVXCKEPGDHDXSJ-STQMWFEESA-N 1 0 342.395 3.778 20 5 EHBDRO CC[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092481 1138711525 /nfs/dbraw/zinc/71/15/25/1138711525.db2.gz FEKLVSBBTSXTAX-OCCSQVGLSA-N 1 0 337.420 3.549 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc2ccccc2[nH]c1=O ZINC000338362908 1138857143 /nfs/dbraw/zinc/85/71/43/1138857143.db2.gz RAAREXKZQAGMQE-UHFFFAOYSA-N 1 0 337.379 3.523 20 5 EHBDRO O[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C1CCOCC1 ZINC000265509146 1138935401 /nfs/dbraw/zinc/93/54/01/1138935401.db2.gz FOSRFWLKBKRIPF-QFIPXVFZSA-N 1 0 335.447 3.870 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314754 1139585298 /nfs/dbraw/zinc/58/52/98/1139585298.db2.gz WEIPAKFDUHJCKM-KJUJZPGYSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccccc1 ZINC000177582547 1139628043 /nfs/dbraw/zinc/62/80/43/1139628043.db2.gz SVKHYEUOFASZQW-KGLIPLIRSA-N 1 0 342.395 3.743 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC[C@@H]1CCCCO1)C1CC1 ZINC000183998837 1140073370 /nfs/dbraw/zinc/07/33/70/1140073370.db2.gz ZQJMVYYHFJEWMM-ZWKOTPCHSA-N 1 0 332.444 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H](CCO)c1ccco1 ZINC000186543436 1140209553 /nfs/dbraw/zinc/20/95/53/1140209553.db2.gz VWRANQPEIKFCGD-UAGQMJEPSA-N 1 0 344.411 3.612 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000193623698 1140580712 /nfs/dbraw/zinc/58/07/12/1140580712.db2.gz SZKGFQNMFGWJEJ-CYBMUJFWSA-N 1 0 333.369 3.902 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])ccc1OC ZINC000268906666 1141022702 /nfs/dbraw/zinc/02/27/02/1141022702.db2.gz FBDBBVZTCOSBEI-AWEZNQCLSA-N 1 0 344.411 3.643 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c1 ZINC000269750575 1141141548 /nfs/dbraw/zinc/14/15/48/1141141548.db2.gz ZUBVKXUTIWMZMJ-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000271372713 1141353344 /nfs/dbraw/zinc/35/33/44/1141353344.db2.gz GYWIGXLFIAWLKY-YEWWUXTCSA-N 1 0 336.432 3.848 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc([S@@](C)=O)cc1 ZINC000271454717 1141372082 /nfs/dbraw/zinc/37/20/82/1141372082.db2.gz GPHBILIPEDXGEK-WDVBMNPBSA-N 1 0 332.425 3.744 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548319 1141394415 /nfs/dbraw/zinc/39/44/15/1141394415.db2.gz UEFSGFWVDMEDHW-SGTLLEGYSA-N 1 0 348.374 3.608 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000274256172 1141490631 /nfs/dbraw/zinc/49/06/31/1141490631.db2.gz LKBBZEXXRYBOIJ-KRWDZBQOSA-N 1 0 328.368 3.525 20 5 EHBDRO CC(C)C[NH+]1CCN(c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC001164657603 719337795 /nfs/dbraw/zinc/33/77/95/719337795.db2.gz UJIBPUXCFPIJPW-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000537966235 1032067649 /nfs/dbraw/zinc/06/76/49/1032067649.db2.gz AJTKVLNNIOLZTB-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CSc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 ZINC000579711996 1014248280 /nfs/dbraw/zinc/24/82/80/1014248280.db2.gz LNTPFDMAMBXQGY-DOMZBBRYSA-N 1 0 330.409 3.799 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(c3ccsc3)CC2)c1 ZINC000186947544 1014621640 /nfs/dbraw/zinc/62/16/40/1014621640.db2.gz LBYACTQSEWDPAG-KRWDZBQOSA-N 1 0 332.425 3.569 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCCN1CC[C@](F)(c2ccccc2)C1 ZINC000584303775 1032100711 /nfs/dbraw/zinc/10/07/11/1032100711.db2.gz PFHSYYDYFVXYGV-GOSISDBHSA-N 1 0 330.359 3.544 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@]1(C)CCCc2ccccc21 ZINC000430207426 1014935510 /nfs/dbraw/zinc/93/55/10/1014935510.db2.gz ZPSKPMXVOYYQCR-IBGZPJMESA-N 1 0 326.396 3.945 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000157583319 1015110631 /nfs/dbraw/zinc/11/06/31/1015110631.db2.gz ZASXXSRRFQTSIN-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000430245514 1015225613 /nfs/dbraw/zinc/22/56/13/1015225613.db2.gz SXLYZDSWFDXHTD-UHFFFAOYSA-N 1 0 326.396 3.767 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000471169680 1015232638 /nfs/dbraw/zinc/23/26/38/1015232638.db2.gz NJUFXDJOETZUDW-HXUWFJFHSA-N 1 0 339.439 3.738 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000579868708 1015575759 /nfs/dbraw/zinc/57/57/59/1015575759.db2.gz HAESZOZHJYCHOQ-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO CCC[C@@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000165112865 1015723367 /nfs/dbraw/zinc/72/33/67/1015723367.db2.gz YGUZRBTUQZUJAE-QGZVFWFLSA-N 1 0 347.459 3.674 20 5 EHBDRO Cc1cc(C)c(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000154969916 1016007499 /nfs/dbraw/zinc/00/74/99/1016007499.db2.gz BRIMWDWSDJHQDZ-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C/c2nc3cc([N+](=O)[O-])ccc3s2)s1 ZINC000349106329 1016048064 /nfs/dbraw/zinc/04/80/64/1016048064.db2.gz IBNDWNLNFLIVGS-AATRIKPKSA-N 1 0 346.437 3.893 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1nc2c(s1)CCCC2 ZINC000175536707 1016347057 /nfs/dbraw/zinc/34/70/57/1016347057.db2.gz LERVAOXHVSYOBM-UHFFFAOYSA-N 1 0 331.441 3.605 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000510220654 1016494307 /nfs/dbraw/zinc/49/43/07/1016494307.db2.gz MBVUQQCHQOBSBS-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000414593702 1017002404 /nfs/dbraw/zinc/00/24/04/1017002404.db2.gz RCHOYPCIJBPWTM-RCFWFJCLSA-N 1 0 341.386 3.616 20 5 EHBDRO COC1(C[C@@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCC1 ZINC000573194134 1032156784 /nfs/dbraw/zinc/15/67/84/1032156784.db2.gz HMKGLPAXTLTFAL-CYBMUJFWSA-N 1 0 331.416 3.556 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2cc(F)ccc12 ZINC000449107463 1032185252 /nfs/dbraw/zinc/18/52/52/1032185252.db2.gz MUNKPLOSZWJAEV-CYBMUJFWSA-N 1 0 341.386 3.979 20 5 EHBDRO C[C@@H]([NH2+]CCN1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000538174774 1032197161 /nfs/dbraw/zinc/19/71/61/1032197161.db2.gz DOCBOROEWIWEGX-OAHLLOKOSA-N 1 0 325.412 3.698 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000538391396 1032336424 /nfs/dbraw/zinc/33/64/24/1032336424.db2.gz AHNARZJVLSHOMS-IBGZPJMESA-N 1 0 342.395 3.723 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)c1ccc(Cl)cc1 ZINC000449249255 1032354234 /nfs/dbraw/zinc/35/42/34/1032354234.db2.gz IRQCVNGPQNWVQM-BLLLJJGKSA-N 1 0 334.803 3.502 20 5 EHBDRO CC[C@](C)(C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449470468 1032588562 /nfs/dbraw/zinc/58/85/62/1032588562.db2.gz AQWRMRMAQGOVKG-MRXNPFEDSA-N 1 0 335.429 3.623 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000449472425 1032592020 /nfs/dbraw/zinc/59/20/20/1032592020.db2.gz AEFMRSXFNQMXMU-CVEARBPZSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@@H]1CCC[N@@H+]1Cc1cccc(-c2cc(CO)cc([N+](=O)[O-])c2)c1 ZINC000592984886 1032655632 /nfs/dbraw/zinc/65/56/32/1032655632.db2.gz BSOGBTWICDSVKL-CQSZACIVSA-N 1 0 326.396 3.738 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1O ZINC000190052794 1017268972 /nfs/dbraw/zinc/26/89/72/1017268972.db2.gz CJIMKUAUUMBZER-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@@H](CCc1n[nH]c2ccccc21)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000541153046 1017890522 /nfs/dbraw/zinc/89/05/22/1017890522.db2.gz DWUUFMKUIMEAAZ-AWEZNQCLSA-N 1 0 338.411 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544020 1032735751 /nfs/dbraw/zinc/73/57/51/1032735751.db2.gz VAWJUWVJTBOIIH-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000120188198 1017995741 /nfs/dbraw/zinc/99/57/41/1017995741.db2.gz YPSVTCXAMCSWNU-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000449535684 1032748295 /nfs/dbraw/zinc/74/82/95/1032748295.db2.gz HWYZFFACQNTKML-MGDPNLISSA-N 1 0 339.395 3.513 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1F ZINC000594019737 1032792020 /nfs/dbraw/zinc/79/20/20/1032792020.db2.gz SLZXFHSFUSRKHM-MRXNPFEDSA-N 1 0 345.374 3.722 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)o1 ZINC000592415911 1032793335 /nfs/dbraw/zinc/79/33/35/1032793335.db2.gz VWVCJVHZXJYBMO-UHFFFAOYSA-N 1 0 331.372 3.590 20 5 EHBDRO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1ccccc1[N+](=O)[O-] ZINC000379622242 1019002246 /nfs/dbraw/zinc/00/22/46/1019002246.db2.gz GMTHQCXOIJVPKN-UHFFFAOYSA-N 1 0 327.428 3.595 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000120603126 1019087019 /nfs/dbraw/zinc/08/70/19/1019087019.db2.gz ODPPNYVUBAOZQJ-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1c(C[NH2+][C@@H](Cn2cccn2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000610433074 1019094069 /nfs/dbraw/zinc/09/40/69/1019094069.db2.gz VMDKBAGMOXNNHL-SFHVURJKSA-N 1 0 336.395 3.631 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](c3cc(C)ccn3)C2)ccc1[N+](=O)[O-] ZINC000579608382 1019257880 /nfs/dbraw/zinc/25/78/80/1019257880.db2.gz RZURRZXMDNDFFZ-MRXNPFEDSA-N 1 0 341.411 3.686 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000129324238 1019485324 /nfs/dbraw/zinc/48/53/24/1019485324.db2.gz SBLMPYXUMHWSLJ-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2C2CC2)c(OC(F)F)c1 ZINC000433802582 1019646725 /nfs/dbraw/zinc/64/67/25/1019646725.db2.gz JPWCLJLDDYUXOH-ZDUSSCGKSA-N 1 0 341.358 3.625 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1ccccc1[N+](=O)[O-] ZINC000610451917 1019865011 /nfs/dbraw/zinc/86/50/11/1019865011.db2.gz NWAJOBKVUCKRBY-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)(C)c2ccccc2C)cc1[N+](=O)[O-] ZINC000518277247 1020487475 /nfs/dbraw/zinc/48/74/75/1020487475.db2.gz ACPOHFOTIZZSNA-UHFFFAOYSA-N 1 0 328.412 3.979 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CC[C@H](O)CC1 ZINC000276119632 1020664365 /nfs/dbraw/zinc/66/43/65/1020664365.db2.gz YIKQFESWVIXUMR-HDJSIYSDSA-N 1 0 330.384 3.590 20 5 EHBDRO C[C@H]1COC[C@@H](c2ccccc2)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038374 1020674947 /nfs/dbraw/zinc/67/49/47/1020674947.db2.gz JFAJFLWKWHLHFY-KXBFYZLASA-N 1 0 326.396 3.599 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@H]2CCCO[C@H]2c2ccccc2)cc1 ZINC000602521152 1032933039 /nfs/dbraw/zinc/93/30/39/1032933039.db2.gz NCXVDWNKWUUPAC-QUCCMNQESA-N 1 0 340.423 3.895 20 5 EHBDRO Cc1noc(C)c1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602537545 1032950304 /nfs/dbraw/zinc/95/03/04/1032950304.db2.gz FJQSKKDESNGQSB-UHFFFAOYSA-N 1 0 343.305 3.551 20 5 EHBDRO CC(C)c1nnc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000426305421 1021225975 /nfs/dbraw/zinc/22/59/75/1021225975.db2.gz GWYQQOGGRYTSKO-OAHLLOKOSA-N 1 0 346.456 3.779 20 5 EHBDRO CCC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOCC1 ZINC000602560672 1032972510 /nfs/dbraw/zinc/97/25/10/1032972510.db2.gz JXIABAJXYKWNMW-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO CCC[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000120889533 1021479961 /nfs/dbraw/zinc/47/99/61/1021479961.db2.gz UIYKGCGAQAASDV-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602574502 1032983006 /nfs/dbraw/zinc/98/30/06/1032983006.db2.gz ABOZJFJLSULTSV-LBPRGKRZSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCO)C2CCC2)s1 ZINC000439766977 1021693423 /nfs/dbraw/zinc/69/34/23/1021693423.db2.gz ODQOJSBINWDOES-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000439778847 1021703098 /nfs/dbraw/zinc/70/30/98/1021703098.db2.gz BEZYZEYXWCHLBG-XQRVVYSFSA-N 1 0 338.407 3.717 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000129426816 1021751141 /nfs/dbraw/zinc/75/11/41/1021751141.db2.gz NLNXYOITLQYXRN-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO CCCC[N@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000593705096 1033010876 /nfs/dbraw/zinc/01/08/76/1033010876.db2.gz LPTGQNQKRDPJOF-CQSZACIVSA-N 1 0 333.354 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC[C@@H](CO)CC3)s2)cc1 ZINC000151393689 1022002435 /nfs/dbraw/zinc/00/24/35/1022002435.db2.gz FYPGCRFFWCGCFF-CTYIDZIISA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000602613061 1033028729 /nfs/dbraw/zinc/02/87/29/1033028729.db2.gz MWCUPWQCNUZDRC-HKUYNNGSSA-N 1 0 344.386 3.786 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCCc3ccc([N+](=O)[O-])cc3)cccc21 ZINC000602639276 1033028876 /nfs/dbraw/zinc/02/88/76/1033028876.db2.gz IRUNABPLUJURDA-GOSISDBHSA-N 1 0 341.411 3.635 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000178205917 1022147422 /nfs/dbraw/zinc/14/74/22/1022147422.db2.gz MJFMATZBAWYUTN-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@]3(CCOC3)C2)o1 ZINC000449684733 1033040158 /nfs/dbraw/zinc/04/01/58/1033040158.db2.gz MEWRTBIWXSOELE-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO Cc1ccc2c(c1)nc(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])n2C ZINC000187590629 1022369352 /nfs/dbraw/zinc/36/93/52/1022369352.db2.gz FFOHUWACFGFGBW-FNORWQNLSA-N 1 0 336.395 3.593 20 5 EHBDRO CC[C@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000425957691 1022460817 /nfs/dbraw/zinc/46/08/17/1022460817.db2.gz JSSFQOSKHJZLAR-OAHLLOKOSA-N 1 0 328.416 3.622 20 5 EHBDRO CC(C)([NH3+])CCC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000592536715 1033057611 /nfs/dbraw/zinc/05/76/11/1033057611.db2.gz PZJYBUQHWDARNN-UHFFFAOYSA-N 1 0 343.383 3.843 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000602686724 1033067645 /nfs/dbraw/zinc/06/76/45/1033067645.db2.gz GYPKKYDPXLPBOG-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](C2CCCCC2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000058913221 1022678309 /nfs/dbraw/zinc/67/83/09/1022678309.db2.gz LYUBUUUUYGXGBI-GOSISDBHSA-N 1 0 333.432 3.720 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000438482206 1022704488 /nfs/dbraw/zinc/70/44/88/1022704488.db2.gz XMUFFMCHDLEWCR-DQOPKJQZSA-N 1 0 328.343 3.861 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602697143 1033075997 /nfs/dbraw/zinc/07/59/97/1033075997.db2.gz IARDJUUJYNZTCL-STQMWFEESA-N 1 0 332.322 3.661 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000441452440 1022867450 /nfs/dbraw/zinc/86/74/50/1022867450.db2.gz XFOQKKOKZYVICG-KRWDZBQOSA-N 1 0 334.416 3.527 20 5 EHBDRO C[C@@H]1C[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942848 1022928828 /nfs/dbraw/zinc/92/88/28/1022928828.db2.gz NCOKEUMGQYQKJU-BDJLRTHQSA-N 1 0 349.818 3.596 20 5 EHBDRO COC1CC(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602704982 1033093599 /nfs/dbraw/zinc/09/35/99/1033093599.db2.gz IXQVRHRQZTUDOJ-UHFFFAOYSA-N 1 0 332.322 3.518 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1(F)F ZINC000602712513 1033097146 /nfs/dbraw/zinc/09/71/46/1033097146.db2.gz YXGDMDAANYDXSI-VIFPVBQESA-N 1 0 341.177 3.554 20 5 EHBDRO CC[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378895 1023038782 /nfs/dbraw/zinc/03/87/82/1023038782.db2.gz GMQFXNJPEAGILE-OAHLLOKOSA-N 1 0 332.425 3.934 20 5 EHBDRO Cc1ccccc1[C@@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000507178936 1023166023 /nfs/dbraw/zinc/16/60/23/1023166023.db2.gz JJZYWVALRDBIQE-MRXNPFEDSA-N 1 0 326.396 3.772 20 5 EHBDRO CC[N@H+](CCc1ccccc1)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000507173326 1023173617 /nfs/dbraw/zinc/17/36/17/1023173617.db2.gz LTGCBQRJTGQROI-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc(-n3cccn3)c2)C2CC2)c1 ZINC000507174507 1023174646 /nfs/dbraw/zinc/17/46/46/1023174646.db2.gz RPWCJMXEDXMRRM-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO Cc1ccc(C)n1C1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000507346680 1023258862 /nfs/dbraw/zinc/25/88/62/1023258862.db2.gz HTCBZDTWBLNAEL-UHFFFAOYSA-N 1 0 327.428 3.893 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383496980 1023290462 /nfs/dbraw/zinc/29/04/62/1023290462.db2.gz XLPYTXDNYJDTMB-HNNXBMFYSA-N 1 0 329.375 3.668 20 5 EHBDRO COCC1(C2CC2)C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000602730236 1033120474 /nfs/dbraw/zinc/12/04/74/1033120474.db2.gz AGLSLDFHHGPXAT-UHFFFAOYSA-N 1 0 342.395 3.713 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000063258402 1033135396 /nfs/dbraw/zinc/13/53/96/1033135396.db2.gz DSDPXQBMLRJUJC-UHFFFAOYSA-N 1 0 331.441 3.677 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H]2c2c(C)n[nH]c2C)ccc1[N+](=O)[O-] ZINC000276960202 1023478484 /nfs/dbraw/zinc/47/84/84/1023478484.db2.gz VIOOYRKPWKFGGN-MRXNPFEDSA-N 1 0 344.415 3.671 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3ccccc3[N+](=O)[O-])C2)c1 ZINC000449757498 1033147774 /nfs/dbraw/zinc/14/77/74/1033147774.db2.gz SFGTUMVRHRCMFA-QAQDUYKDSA-N 1 0 326.396 3.981 20 5 EHBDRO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449752910 1033167988 /nfs/dbraw/zinc/16/79/88/1033167988.db2.gz DUDXMZWZCXDEMR-SJLPKXTDSA-N 1 0 330.384 3.902 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000522269026 1024127228 /nfs/dbraw/zinc/12/72/28/1024127228.db2.gz SDJGWZVSTAVXFO-LJQANCHMSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000443946460 1024146959 /nfs/dbraw/zinc/14/69/59/1024146959.db2.gz LXOKJWJVWMIDIR-ZIAGYGMSSA-N 1 0 348.447 3.596 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](C)[C@@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000091960528 1024227525 /nfs/dbraw/zinc/22/75/25/1024227525.db2.gz MVSOINKKYRPZFS-KXBFYZLASA-N 1 0 342.443 3.998 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000358367531 1024241528 /nfs/dbraw/zinc/24/15/28/1024241528.db2.gz MFLILXIPANDSCC-LJQANCHMSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1cccc(NCc2cccc(C[NH+]3CCCC3)c2)c1[N+](=O)[O-] ZINC000185169509 1024589309 /nfs/dbraw/zinc/58/93/09/1024589309.db2.gz NQDVEIOVHFGUGG-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO CCC[N@H+](CC)C[C@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000514639508 1024627279 /nfs/dbraw/zinc/62/72/79/1024627279.db2.gz DITRPYPHUCXOFY-JTQLQIEISA-N 1 0 334.342 3.541 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)[C@@H]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000342278776 1024701148 /nfs/dbraw/zinc/70/11/48/1024701148.db2.gz FTLXXHFCXIBESF-JCGIZDLHSA-N 1 0 347.459 3.673 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000539069824 1024728820 /nfs/dbraw/zinc/72/88/20/1024728820.db2.gz AAJUQLZFZUXXSL-QGZVFWFLSA-N 1 0 336.338 3.993 20 5 EHBDRO C[NH2+]C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000435372185 1024837357 /nfs/dbraw/zinc/83/73/57/1024837357.db2.gz QGPACZXXPHSNHV-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO [NH3+][C@@H]1CCN(Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000435377231 1024856660 /nfs/dbraw/zinc/85/66/60/1024856660.db2.gz ZJZFYSDUSQWKCJ-CYBMUJFWSA-N 1 0 347.802 3.574 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@@H]4CCCO4)C3)o2)c1 ZINC000895842265 1024888398 /nfs/dbraw/zinc/88/83/98/1024888398.db2.gz CXSNEHVLSPXVNY-QAPCUYQASA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](c2ccc3cccnc3n2)C1 ZINC000602889969 1033244132 /nfs/dbraw/zinc/24/41/32/1033244132.db2.gz XROGWXZLYJIYCE-OAHLLOKOSA-N 1 0 334.379 3.528 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000427971121 1024915682 /nfs/dbraw/zinc/91/56/82/1024915682.db2.gz JFXQUDOXNUMOFH-DJIMGWMZSA-N 1 0 332.444 3.853 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@H](F)C3)o2)c([N+](=O)[O-])c1 ZINC000520879952 1025101235 /nfs/dbraw/zinc/10/12/35/1025101235.db2.gz ZPDJRGGKDXJBJS-NWDGAFQWSA-N 1 0 334.347 3.844 20 5 EHBDRO Cc1ccc(CNC[C@H]2CCC[N@@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000435750526 1025111538 /nfs/dbraw/zinc/11/15/38/1025111538.db2.gz YGDOFEJPIDZJTG-GOSISDBHSA-N 1 0 331.460 3.790 20 5 EHBDRO C/C=C\C[C@@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000472148063 1025150998 /nfs/dbraw/zinc/15/09/98/1025150998.db2.gz VOELQGUETPTUJC-ZRMMWKCHSA-N 1 0 332.425 3.740 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515506209 1025317785 /nfs/dbraw/zinc/31/77/85/1025317785.db2.gz OZMQLTRNPRBWEU-CQSZACIVSA-N 1 0 341.411 3.707 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2cc([N+](=O)[O-])ccc2C(C)=O)CC1 ZINC000521417680 1025378549 /nfs/dbraw/zinc/37/85/49/1025378549.db2.gz FYYUBURWWCJPLT-UHFFFAOYSA-N 1 0 347.459 3.746 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896510120 1025490833 /nfs/dbraw/zinc/49/08/33/1025490833.db2.gz LCOLIIUWMBLGGM-SASJJMKUSA-N 1 0 328.349 3.968 20 5 EHBDRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451104125 1025567760 /nfs/dbraw/zinc/56/77/60/1025567760.db2.gz KDOCUGVTWCEVHD-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000436311466 1025594530 /nfs/dbraw/zinc/59/45/30/1025594530.db2.gz XVIUJYGWTNQQBW-GHMZBOCLSA-N 1 0 346.353 3.683 20 5 EHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(F)cc(Cl)cc1Br ZINC001227171302 1025677868 /nfs/dbraw/zinc/67/78/68/1025677868.db2.gz AEESEALIEXSULG-QMMMGPOBSA-N 1 0 325.629 3.715 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc(Nc3cc[nH+]cc3)cc2)cc1[N+](=O)[O-] ZINC000522849971 1025787027 /nfs/dbraw/zinc/78/70/27/1025787027.db2.gz QMNWGYYNZMUAJM-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@@H](COc3ccccc3)C2)c(F)c1 ZINC000505838245 1025807208 /nfs/dbraw/zinc/80/72/08/1025807208.db2.gz HOOFGXBYCIZNGD-CQSZACIVSA-N 1 0 330.359 3.635 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844010 1025859896 /nfs/dbraw/zinc/85/98/96/1025859896.db2.gz CSUXFGUWZZDHHW-INIZCTEOSA-N 1 0 326.396 3.804 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000451355438 1025860221 /nfs/dbraw/zinc/86/02/21/1025860221.db2.gz VCNMCLQGFCRNPC-JFIYKMOQSA-N 1 0 348.443 3.509 20 5 EHBDRO C[C@H](CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C[NH+]1CCCC1 ZINC000516073906 1025952129 /nfs/dbraw/zinc/95/21/29/1025952129.db2.gz FLROKKYAUOMTCZ-DOMZBBRYSA-N 1 0 345.365 3.520 20 5 EHBDRO CCc1nc(C)c(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543464 1026091012 /nfs/dbraw/zinc/09/10/12/1026091012.db2.gz BWBWRMHGOSQJMI-HNNXBMFYSA-N 1 0 329.400 3.833 20 5 EHBDRO COCC[C@H](c1ccccc1)[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511124144 1026257341 /nfs/dbraw/zinc/25/73/41/1026257341.db2.gz KPOXRQNHZLVJDH-GOSISDBHSA-N 1 0 328.412 3.847 20 5 EHBDRO CC(C)N(C)c1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cn1 ZINC000338956852 1026302268 /nfs/dbraw/zinc/30/22/68/1026302268.db2.gz BHLQMAYJMWHTOP-UHFFFAOYSA-N 1 0 342.443 3.509 20 5 EHBDRO CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3)c2C1 ZINC000158336462 1026327595 /nfs/dbraw/zinc/32/75/95/1026327595.db2.gz TXXKQGWCVPKRLV-UHFFFAOYSA-N 1 0 339.395 3.819 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000288537949 1026383646 /nfs/dbraw/zinc/38/36/46/1026383646.db2.gz WLQLWQSVXNNKIS-INIZCTEOSA-N 1 0 334.803 3.770 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000451977993 1026417836 /nfs/dbraw/zinc/41/78/36/1026417836.db2.gz NZLALFPAGJGDMW-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO CC1CCC([N@H+](CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)C2CC2)CC1 ZINC000339221913 1026433625 /nfs/dbraw/zinc/43/36/25/1026433625.db2.gz OBUXLCBKMZSARU-UHFFFAOYSA-N 1 0 345.443 3.601 20 5 EHBDRO C[C@@H]1COCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277719197 1026670037 /nfs/dbraw/zinc/67/00/37/1026670037.db2.gz JBELWOVLZPWBLU-DOMZBBRYSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418287 1026790684 /nfs/dbraw/zinc/79/06/84/1026790684.db2.gz NVLNIOWGVDTDBA-UGSOOPFHSA-N 1 0 349.394 3.514 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000543907457 1027301913 /nfs/dbraw/zinc/30/19/13/1027301913.db2.gz PVBSDAWFUDAVAI-QILLFSRXSA-N 1 0 345.443 3.742 20 5 EHBDRO Cc1ccc(NC(=O)NCCC[N@@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000501576294 1027377594 /nfs/dbraw/zinc/37/75/94/1027377594.db2.gz DYEBIJSQTRFSCB-UHFFFAOYSA-N 1 0 348.447 3.679 20 5 EHBDRO C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@@H]12 ZINC000548761147 1027408473 /nfs/dbraw/zinc/40/84/73/1027408473.db2.gz GJBLRZRYKSEPTP-VYDXJSESSA-N 1 0 345.443 3.824 20 5 EHBDRO O=C(CC[NH2+]CCCC1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000548761213 1027409232 /nfs/dbraw/zinc/40/92/32/1027409232.db2.gz RPSGVIJFHUAMNB-UHFFFAOYSA-N 1 0 333.432 3.874 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@H](CCO)CC2)c1 ZINC000421018119 1028005029 /nfs/dbraw/zinc/00/50/29/1028005029.db2.gz OAYHLIVULFVGMO-LBPRGKRZSA-N 1 0 346.349 3.598 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC(CCC[NH+]3CCCC3)CC2)c1 ZINC000533560624 1028086332 /nfs/dbraw/zinc/08/63/32/1028086332.db2.gz JGNDIAJFNCTXKR-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@@H]1CCCC[C@H]1C ZINC000444679067 1028148311 /nfs/dbraw/zinc/14/83/11/1028148311.db2.gz SYBJJNCKUPWGIM-CXAGYDPISA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681885 1028150448 /nfs/dbraw/zinc/15/04/48/1028150448.db2.gz RULKDUNXTZRSIV-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263497 1028301279 /nfs/dbraw/zinc/30/12/79/1028301279.db2.gz ONIYCTQSCNLKDS-XJKSGUPXSA-N 1 0 335.448 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CC23CCSCC3)c(Cl)c1 ZINC000421378908 1028339659 /nfs/dbraw/zinc/33/96/59/1028339659.db2.gz KYKJBSJHQSMLPF-GFCCVEGCSA-N 1 0 326.849 3.871 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391331 1028367136 /nfs/dbraw/zinc/36/71/36/1028367136.db2.gz UAFNQWCTPWXDCW-BBRMVZONSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423376548 1028397421 /nfs/dbraw/zinc/39/74/21/1028397421.db2.gz YFRBKQRDPVDEGO-ACJLOTCBSA-N 1 0 325.412 3.775 20 5 EHBDRO CC[C@H](NCc1cc([N+](=O)[O-])ccc1OC)c1ccccc1OC ZINC000178730323 1028453246 /nfs/dbraw/zinc/45/32/46/1028453246.db2.gz POBRZNRBKPYOTG-INIZCTEOSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701363 1028553077 /nfs/dbraw/zinc/55/30/77/1028553077.db2.gz HTEVDUCHWQXBMV-IBGZPJMESA-N 1 0 340.423 3.853 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569539 1028702847 /nfs/dbraw/zinc/70/28/47/1028702847.db2.gz GGUGPPOWGDJJQL-OPNNQBFTSA-N 1 0 332.444 3.746 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)cc1 ZINC000421744475 1028747257 /nfs/dbraw/zinc/74/72/57/1028747257.db2.gz OACCJPMNMVLCMQ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000421791730 1028800287 /nfs/dbraw/zinc/80/02/87/1028800287.db2.gz KLNPCKKAOLVBHQ-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000504900446 1029027698 /nfs/dbraw/zinc/02/76/98/1029027698.db2.gz YDVQJCLQMRLQPN-OAGGEKHMSA-N 1 0 349.500 3.682 20 5 EHBDRO CN(Cc1cccc(O)c1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000532934666 1029097978 /nfs/dbraw/zinc/09/79/78/1029097978.db2.gz ZNSCJJOFDIJCLR-UHFFFAOYSA-N 1 0 338.310 3.534 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066368 1029235173 /nfs/dbraw/zinc/23/51/73/1029235173.db2.gz WSJVREGQZGKCNL-GUYCJALGSA-N 1 0 334.416 3.862 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCOc2ccc(C(F)(F)F)cc2)cs1 ZINC000237845037 1029458980 /nfs/dbraw/zinc/45/89/80/1029458980.db2.gz YOTWQXADGJNVSC-UHFFFAOYSA-N 1 0 346.330 3.844 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCOc1ccc(F)cc1)C2 ZINC000536004244 1029716512 /nfs/dbraw/zinc/71/65/12/1029716512.db2.gz PRFKUMLQESBJPU-UHFFFAOYSA-N 1 0 330.359 3.561 20 5 EHBDRO CCc1nc(C)c(CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)o1 ZINC000292184590 1029746126 /nfs/dbraw/zinc/74/61/26/1029746126.db2.gz FRBWPNPAIBNSEW-UHFFFAOYSA-N 1 0 326.356 3.922 20 5 EHBDRO Cc1cccc(CCCNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)n1 ZINC000343223078 1029813476 /nfs/dbraw/zinc/81/34/76/1029813476.db2.gz HKSRXYDIQXASGE-UHFFFAOYSA-N 1 0 336.395 3.621 20 5 EHBDRO C[C@H](CCc1cccc(F)c1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446845085 1029824921 /nfs/dbraw/zinc/82/49/21/1029824921.db2.gz XSZUFRJKQYKGAP-GFCCVEGCSA-N 1 0 342.374 3.721 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cccc1[N+](=O)[O-] ZINC000152241894 1029840670 /nfs/dbraw/zinc/84/06/70/1029840670.db2.gz VFNZTLKEVVUTHF-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@@H](CCO)CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453230093 1029951438 /nfs/dbraw/zinc/95/14/38/1029951438.db2.gz GTUAFMUDTLAUMS-DNVCBOLYSA-N 1 0 328.412 3.682 20 5 EHBDRO CC(C)[C@H](O)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525697784 1030030747 /nfs/dbraw/zinc/03/07/47/1030030747.db2.gz UWFMIHDNHLPYBE-MRXNPFEDSA-N 1 0 334.441 3.820 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC2(CC)COC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453351687 1030143610 /nfs/dbraw/zinc/14/36/10/1030143610.db2.gz GWYATMZCQMXIHI-GOSISDBHSA-N 1 0 344.411 3.856 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCOC1 ZINC000453356785 1030149382 /nfs/dbraw/zinc/14/93/82/1030149382.db2.gz JCHIVNNDXDJVFY-LSDHHAIUSA-N 1 0 338.473 3.872 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000531965818 1030151654 /nfs/dbraw/zinc/15/16/54/1030151654.db2.gz DZRSXIWNGNRNJW-SFHVURJKSA-N 1 0 342.443 3.539 20 5 EHBDRO COc1ccc(OCC[N@H+](Cc2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000441262923 1030195288 /nfs/dbraw/zinc/19/52/88/1030195288.db2.gz WHECYKCPMBSGIG-UHFFFAOYSA-N 1 0 348.424 3.708 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2ccccc2Cl)n1 ZINC000447544082 1030277236 /nfs/dbraw/zinc/27/72/36/1030277236.db2.gz NDRHFTCQQHBJPD-HZPDHXFCSA-N 1 0 348.834 3.761 20 5 EHBDRO CCc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000447546229 1030280401 /nfs/dbraw/zinc/28/04/01/1030280401.db2.gz UGOLLQOSVMTLOR-CABCVRRESA-N 1 0 334.445 3.689 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447576689 1030338905 /nfs/dbraw/zinc/33/89/05/1030338905.db2.gz ZMHFOQPPQCJCLC-KBXCAEBGSA-N 1 0 332.444 3.751 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1nccs1)C(C)C ZINC000159767738 1030357025 /nfs/dbraw/zinc/35/70/25/1030357025.db2.gz MHJHDIBVOIIUTO-UHFFFAOYSA-N 1 0 335.429 3.513 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(C3CC3)cc2)n1 ZINC000447603877 1030357658 /nfs/dbraw/zinc/35/76/58/1030357658.db2.gz ZDZWRZOLPJRPBJ-ZWKOTPCHSA-N 1 0 340.427 3.942 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000532210599 1030481301 /nfs/dbraw/zinc/48/13/01/1030481301.db2.gz HIBGJRWMLJVOTB-LSDHHAIUSA-N 1 0 325.412 3.697 20 5 EHBDRO CC[C@H](C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[NH+](C)C ZINC000532220602 1030487556 /nfs/dbraw/zinc/48/75/56/1030487556.db2.gz QMXVRQWOWOWKJZ-QGZVFWFLSA-N 1 0 343.383 3.666 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1C[C@@H](C)O ZINC000447836900 1030526076 /nfs/dbraw/zinc/52/60/76/1030526076.db2.gz YOVHCEZXVBRMQT-GDBMZVCRSA-N 1 0 336.432 3.507 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+]([C@@H]3CCc4ccc(F)cc43)CC2)c1 ZINC000482831020 1030741331 /nfs/dbraw/zinc/74/13/31/1030741331.db2.gz ZIHUYHSKVXDOSH-LJQANCHMSA-N 1 0 341.386 3.543 20 5 EHBDRO CO[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894738 1030774135 /nfs/dbraw/zinc/77/41/35/1030774135.db2.gz GOMVSSDVNMRYBR-RTBURBONSA-N 1 0 326.396 3.699 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H](CO)C(C)(C)C ZINC000537658515 1030902062 /nfs/dbraw/zinc/90/20/62/1030902062.db2.gz JXOKMNLDEWKRNP-QGZVFWFLSA-N 1 0 332.400 3.694 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000042633393 1031043056 /nfs/dbraw/zinc/04/30/56/1031043056.db2.gz JEMMPFMUFBFEJM-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1cc(C[N@H+](C)C2CCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000093475797 1031289455 /nfs/dbraw/zinc/28/94/55/1031289455.db2.gz HBFHWFYARSAWTN-UHFFFAOYSA-N 1 0 348.321 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CCC[C@@H](C(F)(F)F)C3)nc2c1 ZINC000278596244 1031576478 /nfs/dbraw/zinc/57/64/78/1031576478.db2.gz FJYSYNCJOLCNHJ-ZJUUUORDSA-N 1 0 342.321 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CC(c4ccc(F)cc4)C3)nc2c1 ZINC000278611110 1031640487 /nfs/dbraw/zinc/64/04/87/1031640487.db2.gz GPBISVRRMRRHKA-UHFFFAOYSA-N 1 0 340.358 3.646 20 5 EHBDRO C[NH+]1CCC(Nc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000060991607 1033382604 /nfs/dbraw/zinc/38/26/04/1033382604.db2.gz SLDVVOCMJKABBF-UHFFFAOYSA-N 1 0 337.729 3.773 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000594514501 1033420522 /nfs/dbraw/zinc/42/05/22/1033420522.db2.gz JUSVPOIPIBIWSU-KSSFIOAISA-N 1 0 325.412 3.532 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000594515334 1033421963 /nfs/dbraw/zinc/42/19/63/1033421963.db2.gz NVDXIIWDWBHGQH-MDZRGWNJSA-N 1 0 339.439 3.922 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000594516716 1033423163 /nfs/dbraw/zinc/42/31/63/1033423163.db2.gz CWGJDTPVHJNWLK-DYVFJYSZSA-N 1 0 346.814 3.601 20 5 EHBDRO Nc1cccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000594737194 1033511059 /nfs/dbraw/zinc/51/10/59/1033511059.db2.gz YRHDQUKMWQRQKQ-CRAIPNDOSA-N 1 0 325.412 3.678 20 5 EHBDRO CCOc1cc(CN[C@H](C)c2ccccc2[N+](=O)[O-])c(F)cc1OC ZINC000598972732 1033621929 /nfs/dbraw/zinc/62/19/29/1033621929.db2.gz DLZFSRJIFGGJMF-GFCCVEGCSA-N 1 0 348.374 3.992 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(F)c(F)c2N(C)C)cccc1[N+](=O)[O-] ZINC000598977252 1033624874 /nfs/dbraw/zinc/62/48/74/1033624874.db2.gz IFDTYVUFPNNMGR-UHFFFAOYSA-N 1 0 335.354 3.537 20 5 EHBDRO C/C=C\C[NH2+]Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000599004459 1033638431 /nfs/dbraw/zinc/63/84/31/1033638431.db2.gz FAGRSMFQEZNENE-ARJAWSKDSA-N 1 0 342.395 3.848 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CO[C@H](C4CC4)C3)o2)c1 ZINC000599006385 1033640675 /nfs/dbraw/zinc/64/06/75/1033640675.db2.gz HTWYBDMZTYYTAF-KDOFPFPSSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000595072435 1033646883 /nfs/dbraw/zinc/64/68/83/1033646883.db2.gz HUDDFAGYAHIWBF-NEPJUHHUSA-N 1 0 336.338 3.991 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCC(OC(C)C)CC1 ZINC000595036624 1033655919 /nfs/dbraw/zinc/65/59/19/1033655919.db2.gz TYRAFXHDKZSWOD-HLIUYOAVSA-N 1 0 336.432 3.990 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)C1CC[NH+](C)CC1 ZINC000599042913 1033671665 /nfs/dbraw/zinc/67/16/65/1033671665.db2.gz GPQIQZDOUSJDRA-CYBMUJFWSA-N 1 0 335.448 3.914 20 5 EHBDRO Cn1ncc(C2CC2)c1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595077875 1033695532 /nfs/dbraw/zinc/69/55/32/1033695532.db2.gz QUEWZXVFORVVSO-QGZVFWFLSA-N 1 0 340.427 3.718 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000595077192 1033695978 /nfs/dbraw/zinc/69/59/78/1033695978.db2.gz MYUQICLXOBZPLJ-LJHODMEESA-N 1 0 326.396 3.818 20 5 EHBDRO Cn1ncc(C2CC2)c1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595077874 1033696557 /nfs/dbraw/zinc/69/65/57/1033696557.db2.gz QUEWZXVFORVVSO-KRWDZBQOSA-N 1 0 340.427 3.718 20 5 EHBDRO CCC[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595093986 1033700247 /nfs/dbraw/zinc/70/02/47/1033700247.db2.gz RHBDRQHWFQVOGA-OAHLLOKOSA-N 1 0 342.386 3.966 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC[C@@H]3CC[N@@H+]3C3CCCC3)c2c1 ZINC000599165282 1033782603 /nfs/dbraw/zinc/78/26/03/1033782603.db2.gz QFCQSKPNYLQMHL-INIZCTEOSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484678 1033809738 /nfs/dbraw/zinc/80/97/38/1033809738.db2.gz MVSZBDSABIJPGH-GOSISDBHSA-N 1 0 329.400 3.835 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@H](c3ccccn3)C2)c(F)c1 ZINC000595500418 1033831733 /nfs/dbraw/zinc/83/17/33/1033831733.db2.gz CKCYQGUNTKFHIK-LBPRGKRZSA-N 1 0 333.338 3.648 20 5 EHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(C(=O)OC)cc1 ZINC000550704401 1033894680 /nfs/dbraw/zinc/89/46/80/1033894680.db2.gz WZYBJIGSUOWHIC-SFHVURJKSA-N 1 0 342.395 3.665 20 5 EHBDRO CCC(C)(C)[C@@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000595638916 1033913606 /nfs/dbraw/zinc/91/36/06/1033913606.db2.gz OLDKOGIRFBCNNK-SNVBAGLBSA-N 1 0 327.812 3.601 20 5 EHBDRO C[C@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094823 1033932435 /nfs/dbraw/zinc/93/24/35/1033932435.db2.gz IJGQHBOYITZDCI-ZDUSSCGKSA-N 1 0 337.379 3.898 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000550730490 1033957017 /nfs/dbraw/zinc/95/70/17/1033957017.db2.gz SZNIRWXUIWDTDV-OAHLLOKOSA-N 1 0 341.411 3.834 20 5 EHBDRO C[C@@H](c1cc(F)ccc1F)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855153 1033980420 /nfs/dbraw/zinc/98/04/20/1033980420.db2.gz KBBUYBQMLBOHNP-LBPRGKRZSA-N 1 0 336.338 3.945 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1F ZINC000599674990 1034079765 /nfs/dbraw/zinc/07/97/65/1034079765.db2.gz FXPLRERLSRGUKH-CYBMUJFWSA-N 1 0 348.349 3.871 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC3(CCC([NH+](C)C)CC3)CC2)n1 ZINC000596254729 1034149420 /nfs/dbraw/zinc/14/94/20/1034149420.db2.gz DVHAKIGIIRGXGQ-UHFFFAOYSA-N 1 0 346.475 3.697 20 5 EHBDRO CCC(=O)c1ccc(NCC2CC[NH+](CC3CC3)CC2)c([N+](=O)[O-])c1 ZINC000596563224 1034289741 /nfs/dbraw/zinc/28/97/41/1034289741.db2.gz RUODGHOEXZMAQL-UHFFFAOYSA-N 1 0 345.443 3.721 20 5 EHBDRO CCc1ccc([C@H](NCC2([NH3+])CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596648174 1034346970 /nfs/dbraw/zinc/34/69/70/1034346970.db2.gz KNBWIUFYPKTEQF-GOSISDBHSA-N 1 0 343.427 3.701 20 5 EHBDRO Cc1ccc(CNCC(C)(C)[NH+]2C[C@@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604417943 1034369982 /nfs/dbraw/zinc/36/99/82/1034369982.db2.gz SUAASUWSEFVDLY-GJZGRUSLSA-N 1 0 333.476 3.749 20 5 EHBDRO COc1ccc([C@@H](CNc2ccsc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000604433080 1034377933 /nfs/dbraw/zinc/37/79/33/1034377933.db2.gz JWKWNRASCQRPRZ-MRXNPFEDSA-N 1 0 347.440 3.914 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1NCCC[NH+]1CCCCC1 ZINC000604507097 1034404436 /nfs/dbraw/zinc/40/44/36/1034404436.db2.gz FYLOILJSDKIKBR-UHFFFAOYSA-N 1 0 342.237 3.645 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4COC[C@@H]4C3)s2)cc1 ZINC000597229663 1034611401 /nfs/dbraw/zinc/61/14/01/1034611401.db2.gz ICPRMVOVVVCWCA-CABCVRRESA-N 1 0 344.436 3.792 20 5 EHBDRO C[C@H](c1ccco1)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000411385616 1034879591 /nfs/dbraw/zinc/87/95/91/1034879591.db2.gz HCAUZYDAYGYABW-CYBMUJFWSA-N 1 0 343.383 3.742 20 5 EHBDRO CC(C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236607678 1034943367 /nfs/dbraw/zinc/94/33/67/1034943367.db2.gz RVTJBDNRIHBSBG-KRWDZBQOSA-N 1 0 334.441 3.820 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000411888071 1035069833 /nfs/dbraw/zinc/06/98/33/1035069833.db2.gz ABDQCNDGMWUSJB-ZNOIYHFQSA-N 1 0 326.396 3.866 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[C@H]1C ZINC000580340933 1035429134 /nfs/dbraw/zinc/42/91/34/1035429134.db2.gz FQZUOTBNLRXZQK-AHEZYBDSSA-N 1 0 342.443 3.832 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000463450192 1035518332 /nfs/dbraw/zinc/51/83/32/1035518332.db2.gz RZFCBSNTLULSSC-QGZVFWFLSA-N 1 0 345.443 3.934 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271988928 1035634824 /nfs/dbraw/zinc/63/48/24/1035634824.db2.gz FWHBJLUDBDXCLB-MOPGFXCFSA-N 1 0 326.396 3.678 20 5 EHBDRO C[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCCO1 ZINC000271984687 1035636238 /nfs/dbraw/zinc/63/62/38/1035636238.db2.gz KMMXGIUVCSRALF-BLLLJJGKSA-N 1 0 347.440 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000540789167 1035683544 /nfs/dbraw/zinc/68/35/44/1035683544.db2.gz MWMVCGJOAUOAOG-PLYYQAHHSA-N 1 0 330.428 3.902 20 5 EHBDRO O=[N+]([O-])c1ccsc1N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000588072496 1035700244 /nfs/dbraw/zinc/70/02/44/1035700244.db2.gz RGCMIFZMAOVAAN-GOSISDBHSA-N 1 0 343.452 3.759 20 5 EHBDRO COc1cc2c(cc1F)CN([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000540837661 1035722077 /nfs/dbraw/zinc/72/20/77/1035722077.db2.gz NFDQJIJCQLEGQB-LBPRGKRZSA-N 1 0 330.359 3.862 20 5 EHBDRO C[C@]12C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@@H]1[C@@H]1CC[C@H]2C1 ZINC000582401932 1035751243 /nfs/dbraw/zinc/75/12/43/1035751243.db2.gz PVUKRJFHFOXQEH-AZGFTEDZSA-N 1 0 327.384 3.604 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000271415236 1035869019 /nfs/dbraw/zinc/86/90/19/1035869019.db2.gz ARLBTOQYRNVHIQ-OAHLLOKOSA-N 1 0 330.384 3.853 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460344885 1035921504 /nfs/dbraw/zinc/92/15/04/1035921504.db2.gz CSKNBSXEHHOWJM-KFWWJZLASA-N 1 0 333.432 3.870 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361951 1036018403 /nfs/dbraw/zinc/01/84/03/1036018403.db2.gz JCMTYGUMJAHMCV-HZPDHXFCSA-N 1 0 344.415 3.949 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000492765749 1036266557 /nfs/dbraw/zinc/26/65/57/1036266557.db2.gz DNAJLSAWBXKTSF-QGZVFWFLSA-N 1 0 346.431 3.604 20 5 EHBDRO COC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000589340415 1036353182 /nfs/dbraw/zinc/35/31/82/1036353182.db2.gz DOZQWVYXVLLLCD-INIZCTEOSA-N 1 0 334.803 3.768 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414301781 1036550046 /nfs/dbraw/zinc/55/00/46/1036550046.db2.gz BVOUCRRGJZDEMZ-LPHOPBHVSA-N 1 0 346.402 3.941 20 5 EHBDRO CC[C@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777046 1036768062 /nfs/dbraw/zinc/76/80/62/1036768062.db2.gz OMTNRTNBKAGCSV-KBXCAEBGSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cccc(Cl)c1NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180434142 1036825451 /nfs/dbraw/zinc/82/54/51/1036825451.db2.gz QNQIYNVUNUAWNY-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CCC(OC(F)F)CC1 ZINC000590662248 1036995727 /nfs/dbraw/zinc/99/57/27/1036995727.db2.gz FRWFVAVNIFLYKC-HYXAFXHYSA-N 1 0 326.343 3.748 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000130238590 1037038525 /nfs/dbraw/zinc/03/85/25/1037038525.db2.gz PPBILQSUFGLROC-HNNXBMFYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000590811723 1037050998 /nfs/dbraw/zinc/05/09/98/1037050998.db2.gz RWDCMUDRNZNPOG-QGZVFWFLSA-N 1 0 347.462 3.991 20 5 EHBDRO C[C@@H](CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCCCC1 ZINC000542272530 1037251133 /nfs/dbraw/zinc/25/11/33/1037251133.db2.gz XMLXVGUHFLHYMJ-LBPRGKRZSA-N 1 0 343.374 3.873 20 5 EHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829601 1037254297 /nfs/dbraw/zinc/25/42/97/1037254297.db2.gz REKKBSJDDNWHES-XJKSGUPXSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@H]1OCC[C@@]1(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000542315264 1037280265 /nfs/dbraw/zinc/28/02/65/1037280265.db2.gz CWVVFDHHRVQJTG-YVEFUNNKSA-N 1 0 332.425 3.980 20 5 EHBDRO CC(C)Oc1ccc([C@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000271789250 1037283895 /nfs/dbraw/zinc/28/38/95/1037283895.db2.gz QGINSEXIPSTVDS-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000462792513 1037406595 /nfs/dbraw/zinc/40/65/95/1037406595.db2.gz VNLYIGFVXDYJSG-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CCOc1cc(N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992813 1037430430 /nfs/dbraw/zinc/43/04/30/1037430430.db2.gz FZIHWPDOENKNNF-UXLLHSPISA-N 1 0 347.459 3.835 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000462815812 1037435679 /nfs/dbraw/zinc/43/56/79/1037435679.db2.gz FBXHIINGBISJGE-HUUCEWRRSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786894 1037533749 /nfs/dbraw/zinc/53/37/49/1037533749.db2.gz GTABYMUDLFIOSS-QWQRMKEZSA-N 1 0 344.411 3.836 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](CCO)c1ccccc1 ZINC000532516530 1037557031 /nfs/dbraw/zinc/55/70/31/1037557031.db2.gz HJNMOSICRZQMDS-WBVHZDCISA-N 1 0 328.412 3.720 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000532551549 1037600930 /nfs/dbraw/zinc/60/09/30/1037600930.db2.gz VTCIVONPLRXUSE-CRAIPNDOSA-N 1 0 328.412 3.812 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)C1CCCC1 ZINC000573610106 1037628729 /nfs/dbraw/zinc/62/87/29/1037628729.db2.gz JQBJEPZEQXVYTG-HUUCEWRRSA-N 1 0 338.473 3.606 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccsc2[N+](=O)[O-])CC1 ZINC000591821603 1037638266 /nfs/dbraw/zinc/63/82/66/1037638266.db2.gz XBJVXHSTMYGALH-LBPRGKRZSA-N 1 0 332.429 3.689 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@@]2(CCSC2)C1 ZINC000540164173 1037650588 /nfs/dbraw/zinc/65/05/88/1037650588.db2.gz KFTIKCRJWJZAAZ-VBQJREDUSA-N 1 0 336.457 3.609 20 5 EHBDRO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021676 1037673077 /nfs/dbraw/zinc/67/30/77/1037673077.db2.gz FOXUNYQISOMGJG-TUAOUCFPSA-N 1 0 340.807 3.553 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000540344168 1037846726 /nfs/dbraw/zinc/84/67/26/1037846726.db2.gz FHNCVFDAVVKYBO-IBGZPJMESA-N 1 0 344.411 3.969 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccccc1[N+](=O)[O-] ZINC000897463505 1037868023 /nfs/dbraw/zinc/86/80/23/1037868023.db2.gz HIWSIBAEYVQUMJ-ZDUSSCGKSA-N 1 0 328.416 3.576 20 5 EHBDRO C[N@H+](CCc1cccc(NC(=O)c2ccc([N+](=O)[O-])s2)c1)C1CC1 ZINC000341294161 1037884564 /nfs/dbraw/zinc/88/45/64/1037884564.db2.gz RTUVCJPTVSYNNY-UHFFFAOYSA-N 1 0 345.424 3.545 20 5 EHBDRO CC(C)CCC[C@@H](C)NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000540378803 1037888051 /nfs/dbraw/zinc/88/80/51/1037888051.db2.gz DSISLHFZIBTWAR-HUUCEWRRSA-N 1 0 335.448 3.576 20 5 EHBDRO COc1cc(C[N@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000058452153 1037918537 /nfs/dbraw/zinc/91/85/37/1037918537.db2.gz DRRSURSTSGYQBE-PHIMTYICSA-N 1 0 344.358 3.683 20 5 EHBDRO CC[C@H](C)C[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375087 1037924580 /nfs/dbraw/zinc/92/45/80/1037924580.db2.gz QAYJXFDGLQVHIT-JSGCOSHPSA-N 1 0 349.456 3.605 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000540476817 1037988050 /nfs/dbraw/zinc/98/80/50/1037988050.db2.gz TWVKPPVCMVBJBB-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO COCC1([NH2+]Cc2ccc(-c3ccc(OC)cc3[N+](=O)[O-])o2)CCC1 ZINC000341357507 1038011069 /nfs/dbraw/zinc/01/10/69/1038011069.db2.gz QWHGPHJVTBBHDA-UHFFFAOYSA-N 1 0 346.383 3.522 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592527485 1038024615 /nfs/dbraw/zinc/02/46/15/1038024615.db2.gz HIBCBLGAESCBOM-CNRGFGOASA-N 1 0 330.428 3.551 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000540599203 1038132577 /nfs/dbraw/zinc/13/25/77/1038132577.db2.gz UENCDRSSRFFDOD-VURMDHGXSA-N 1 0 338.407 3.904 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000378404937 1038592267 /nfs/dbraw/zinc/59/22/67/1038592267.db2.gz QLGYLBOYRWVUCD-AWEZNQCLSA-N 1 0 336.395 3.846 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2(O)CCC2)ccc1Oc1ccc(F)cc1 ZINC000238142683 1038669616 /nfs/dbraw/zinc/66/96/16/1038669616.db2.gz VQKRUKRTXMKAOZ-UHFFFAOYSA-N 1 0 346.358 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CCC(O)CC3)s2)cc1 ZINC000238148567 1038674855 /nfs/dbraw/zinc/67/48/55/1038674855.db2.gz YBLVDXSTFJBXDT-UHFFFAOYSA-N 1 0 332.425 3.716 20 5 EHBDRO CC[C@]1(CO)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214058 1038696898 /nfs/dbraw/zinc/69/68/98/1038696898.db2.gz QRXPFWSASVQAFD-IBGZPJMESA-N 1 0 344.411 3.839 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000479853035 1038785074 /nfs/dbraw/zinc/78/50/74/1038785074.db2.gz RJBNTIOXUUCDCT-OAHLLOKOSA-N 1 0 347.440 3.964 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@@H](CNCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876360 1038822256 /nfs/dbraw/zinc/82/22/56/1038822256.db2.gz NLKHUBZNBCDYHC-FQEVSTJZSA-N 1 0 339.439 3.595 20 5 EHBDRO C[C@H](C[C@H](O)c1cccs1)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268737 1038910489 /nfs/dbraw/zinc/91/04/89/1038910489.db2.gz YMZXDHSOBBCZGY-YGRLFVJLSA-N 1 0 340.832 3.912 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585137 1038912800 /nfs/dbraw/zinc/91/28/00/1038912800.db2.gz GHVULNVRYMBPBZ-OLZOCXBDSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCCC1 ZINC000477855852 1038964937 /nfs/dbraw/zinc/96/49/37/1038964937.db2.gz IZLXCYKKLQCUTI-ICSRJNTNSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2nc3ccccc3s2)c(F)c1 ZINC000479984970 1038972857 /nfs/dbraw/zinc/97/28/57/1038972857.db2.gz QEOGNYVVCDZPOR-UHFFFAOYSA-N 1 0 331.372 3.676 20 5 EHBDRO COc1ccccc1C1(C[NH2+]Cc2csc([N+](=O)[O-])c2)CCC1 ZINC000185293957 1039067499 /nfs/dbraw/zinc/06/74/99/1039067499.db2.gz CXAMQJYNXQAKOW-UHFFFAOYSA-N 1 0 332.425 3.876 20 5 EHBDRO CC(C)Cc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000488739116 1039364863 /nfs/dbraw/zinc/36/48/63/1039364863.db2.gz VEQTVMWRJNEVFJ-UHFFFAOYSA-N 1 0 342.443 3.827 20 5 EHBDRO C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000485802501 1039577119 /nfs/dbraw/zinc/57/71/19/1039577119.db2.gz BBNOGVIGYCHWRV-LBPRGKRZSA-N 1 0 343.408 3.934 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H]3CCSC3)cs2)c1 ZINC000279941937 1039593285 /nfs/dbraw/zinc/59/32/85/1039593285.db2.gz JKGBXMGACQUEAW-NSHDSACASA-N 1 0 335.454 3.561 20 5 EHBDRO COc1cc(C[N@H+](Cc2ccc(F)cc2)C2CC2)ccc1[N+](=O)[O-] ZINC000485817963 1039596595 /nfs/dbraw/zinc/59/65/95/1039596595.db2.gz REFYEIXWUHCCOH-UHFFFAOYSA-N 1 0 330.359 3.907 20 5 EHBDRO Cc1cc(C[C@H](C)[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000417312938 1039669556 /nfs/dbraw/zinc/66/95/56/1039669556.db2.gz UCXDSOJUPVPIEI-SGTLLEGYSA-N 1 0 328.416 3.615 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417320310 1039677295 /nfs/dbraw/zinc/67/72/95/1039677295.db2.gz JJTQTCHQSONBTD-KRWDZBQOSA-N 1 0 327.384 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CCN(C3CC3)CC1)CCCC2 ZINC000417325525 1039682928 /nfs/dbraw/zinc/68/29/28/1039682928.db2.gz QUPYHZKXGOECOY-IBGZPJMESA-N 1 0 329.444 3.579 20 5 EHBDRO CO[C@@H](CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000417325128 1039683122 /nfs/dbraw/zinc/68/31/22/1039683122.db2.gz DLODJEFIVCEJCP-CABCVRRESA-N 1 0 346.349 3.919 20 5 EHBDRO CC(C)N(C)C[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990958 1040022369 /nfs/dbraw/zinc/02/23/69/1040022369.db2.gz HEUIXBDWCXXSOL-BQFCYCMXSA-N 1 0 333.476 3.624 20 5 EHBDRO CCn1c(SC[C@@H](C)[NH+](C)C)nc2cc3ccccc3cc2c1=O ZINC000479229333 1040066013 /nfs/dbraw/zinc/06/60/13/1040066013.db2.gz YHDDNEWOUKZFMO-CYBMUJFWSA-N 1 0 341.480 3.612 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(Nc3ncc(Cl)cc3[N+](=O)[O-])cccc21 ZINC000432927121 1040196764 /nfs/dbraw/zinc/19/67/64/1040196764.db2.gz GASUSMYISVCPIF-ZDUSSCGKSA-N 1 0 348.790 3.772 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCN2CC=CCC2)c2ccccc2)c1 ZINC000479526427 1040323437 /nfs/dbraw/zinc/32/34/37/1040323437.db2.gz MJOWCBPRGPLYFH-HXUWFJFHSA-N 1 0 337.423 3.536 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc2[nH]c(=O)[nH]c2c1)c1cccc([N+](=O)[O-])c1 ZINC000123090414 1040482391 /nfs/dbraw/zinc/48/23/91/1040482391.db2.gz GECKAYUMESDVBT-IAQYHMDHSA-N 1 0 340.383 3.566 20 5 EHBDRO C[C@H]([NH2+]CC1(CO)CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000433066075 1040619866 /nfs/dbraw/zinc/61/98/66/1040619866.db2.gz HWZVKYALSAFIOI-IJNIYJAUSA-N 1 0 340.423 3.802 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001167750761 1040798803 /nfs/dbraw/zinc/79/88/03/1040798803.db2.gz BJCOJKPGPVIOBD-AWEZNQCLSA-N 1 0 332.448 3.545 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCCO1 ZINC000511657386 1040862290 /nfs/dbraw/zinc/86/22/90/1040862290.db2.gz QOJASFGGEHBTHB-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H](CN[C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150147 1040928172 /nfs/dbraw/zinc/92/81/72/1040928172.db2.gz VRRFTATWRBMZSS-KBXCAEBGSA-N 1 0 331.460 3.639 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc3[nH]c(=O)oc3c2)cccc1[N+](=O)[O-] ZINC000586793755 1041027389 /nfs/dbraw/zinc/02/73/89/1041027389.db2.gz HPRLXGXEGGCIDT-NSHDSACASA-N 1 0 327.340 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)c(F)c1 ZINC000760645060 1041038996 /nfs/dbraw/zinc/03/89/96/1041038996.db2.gz ATLPJPHOJAJXNX-UHFFFAOYSA-N 1 0 344.386 3.654 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c(F)c1 ZINC000433199007 1041050603 /nfs/dbraw/zinc/05/06/03/1041050603.db2.gz JDJHCSAEDDGPAL-OAHLLOKOSA-N 1 0 343.402 3.740 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@@H]21 ZINC000555721464 1041059461 /nfs/dbraw/zinc/05/94/61/1041059461.db2.gz REJPPJATMIELLI-GJZGRUSLSA-N 1 0 342.399 3.655 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000541569754 1041062697 /nfs/dbraw/zinc/06/26/97/1041062697.db2.gz OOCZQVPYBPZEDI-GOSISDBHSA-N 1 0 326.396 3.714 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]1C ZINC000249370352 1041131182 /nfs/dbraw/zinc/13/11/82/1041131182.db2.gz AOTOWFIEKIJMBT-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC000110596610 1041220033 /nfs/dbraw/zinc/22/00/33/1041220033.db2.gz USGAAKUFDUYBQM-ALOPSCKCSA-N 1 0 338.411 3.597 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CC1(C)C ZINC000419314212 1041253232 /nfs/dbraw/zinc/25/32/32/1041253232.db2.gz HOLVBZFZVWIMCZ-ZIAGYGMSSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1cc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)on1 ZINC000512971822 1041320620 /nfs/dbraw/zinc/32/06/20/1041320620.db2.gz MFLCWKGQSHILDO-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO C[C@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccn1 ZINC000181771124 1042082769 /nfs/dbraw/zinc/08/27/69/1042082769.db2.gz BVVWNHMFLIEBCQ-ZDUSSCGKSA-N 1 0 338.367 3.538 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000125472070 1042142109 /nfs/dbraw/zinc/14/21/09/1042142109.db2.gz NORXQVIFOHBHHJ-ROUUACIJSA-N 1 0 345.830 3.783 20 5 EHBDRO CN(C(=O)C[NH2+][C@@H]1CCCC[C@@H]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000111173959 1042238727 /nfs/dbraw/zinc/23/87/27/1042238727.db2.gz VUJLBZQUEIBBMJ-DLBZAZTESA-N 1 0 347.459 3.752 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([N@H+](C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310836 1042259498 /nfs/dbraw/zinc/25/94/98/1042259498.db2.gz ABUTZKAZXIPZSN-INIZCTEOSA-N 1 0 347.440 3.748 20 5 EHBDRO C[C@@H]1C[N@@H+](CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000432325860 1042906369 /nfs/dbraw/zinc/90/63/69/1042906369.db2.gz NCEADUSMRASLKE-BETUJISGSA-N 1 0 341.839 3.550 20 5 EHBDRO Cc1noc(C)c1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278964046 1043095795 /nfs/dbraw/zinc/09/57/95/1043095795.db2.gz BNDHQTHUXJWHST-KRWDZBQOSA-N 1 0 329.400 3.754 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000278991288 1043151267 /nfs/dbraw/zinc/15/12/67/1043151267.db2.gz DVGVTYNJLSPQTK-ZWKOTPCHSA-N 1 0 326.396 3.640 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2c3ccccc3C[C@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000279211184 1043576275 /nfs/dbraw/zinc/57/62/75/1043576275.db2.gz YGIUYBGAWFPMRI-IPMKNSEASA-N 1 0 338.407 3.565 20 5 EHBDRO C[C@@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1nccs1 ZINC000279442584 1044089285 /nfs/dbraw/zinc/08/92/85/1044089285.db2.gz HPVNNFQPSBQNIC-MRVPVSSYSA-N 1 0 331.319 3.921 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])c1 ZINC000120426387 1044310990 /nfs/dbraw/zinc/31/09/90/1044310990.db2.gz HOQGDFODSIKOQZ-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO C[C@@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000344780037 1044412303 /nfs/dbraw/zinc/41/23/03/1044412303.db2.gz UPLDWFMHOALSDE-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000178570631 1044648123 /nfs/dbraw/zinc/64/81/23/1044648123.db2.gz NQQMGSMVBCGTBV-IBGZPJMESA-N 1 0 326.396 3.508 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000183739554 1125744189 /nfs/dbraw/zinc/74/41/89/1125744189.db2.gz LHWUMOYOXQTRAH-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO Cc1ccc(C[NH2+][C@@](C)(CO)Cc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC001656293673 1126257338 /nfs/dbraw/zinc/25/73/38/1126257338.db2.gz PSVIBEKLTHVQIR-GOSISDBHSA-N 1 0 348.830 3.640 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000192493380 1126896898 /nfs/dbraw/zinc/89/68/98/1126896898.db2.gz UUJJFHVAEPMLFP-SFHVURJKSA-N 1 0 341.411 3.607 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(C(=O)C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090918563 1127126069 /nfs/dbraw/zinc/12/60/69/1127126069.db2.gz LJTPWOUGRZQAGU-KRWDZBQOSA-N 1 0 347.459 3.673 20 5 EHBDRO CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccc(F)c1 ZINC000083128712 1127209950 /nfs/dbraw/zinc/20/99/50/1127209950.db2.gz RSBKEYUJVWAOID-UHFFFAOYSA-N 1 0 329.331 3.897 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000139654786 1127434943 /nfs/dbraw/zinc/43/49/43/1127434943.db2.gz KRVOQAJJHWMETL-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO Cc1ccsc1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765335367 1127600078 /nfs/dbraw/zinc/60/00/78/1127600078.db2.gz SGYKKLAHJRRAOH-UHFFFAOYSA-N 1 0 331.441 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ccc(F)cc2F)C2CC2)cc1 ZINC001168541068 1127615729 /nfs/dbraw/zinc/61/57/29/1127615729.db2.gz FVSWUSMJWJACQR-SFHVURJKSA-N 1 0 348.349 3.993 20 5 EHBDRO Cc1ccnc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000301279635 1127622915 /nfs/dbraw/zinc/62/29/15/1127622915.db2.gz JRLGNHCNRJCGNA-INIZCTEOSA-N 1 0 326.400 3.547 20 5 EHBDRO CCOc1cc([N+](=O)[O-])ccc1N1C[C@@H](CC[NH3+])c2ccccc21 ZINC001168547864 1127701010 /nfs/dbraw/zinc/70/10/10/1127701010.db2.gz ASHXPRRZIIPBNX-CYBMUJFWSA-N 1 0 327.384 3.578 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ncc([N+](=O)[O-])cc1Cl ZINC000301283643 1127729666 /nfs/dbraw/zinc/72/96/66/1127729666.db2.gz PLKPZHMCJXXQEG-GFCCVEGCSA-N 1 0 326.828 3.710 20 5 EHBDRO Cc1ccnc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000301308958 1127735727 /nfs/dbraw/zinc/73/57/27/1127735727.db2.gz XDJFVMGXQLDSKM-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C3CCCC3)C2)cc1OC(F)F ZINC000301390934 1127741771 /nfs/dbraw/zinc/74/17/71/1127741771.db2.gz GSUPZOMURGVWEL-GFCCVEGCSA-N 1 0 341.358 3.625 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCSCC(F)(F)F)C1CC1 ZINC000552588298 1127759361 /nfs/dbraw/zinc/75/93/61/1127759361.db2.gz VBKDWRQAFAPDRT-ZDUSSCGKSA-N 1 0 348.390 3.801 20 5 EHBDRO Cc1cc(NCC(C)(C)[NH2+][C@H](C)c2ccccc2)ncc1[N+](=O)[O-] ZINC000301421623 1127765257 /nfs/dbraw/zinc/76/52/57/1127765257.db2.gz FLFVVSJYGOMHEV-CQSZACIVSA-N 1 0 328.416 3.840 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000301428410 1127887502 /nfs/dbraw/zinc/88/75/02/1127887502.db2.gz HTUCVKUPYFYMKO-INIZCTEOSA-N 1 0 343.402 3.692 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000301435201 1127889513 /nfs/dbraw/zinc/88/95/13/1127889513.db2.gz KDMKXLRTHHVLHO-QGZVFWFLSA-N 1 0 325.412 3.553 20 5 EHBDRO CN(c1c(Cl)cc(Cl)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000553296302 1128407023 /nfs/dbraw/zinc/40/70/23/1128407023.db2.gz VXOOPQBIHNSKRP-FOSCPWQOSA-N 1 0 344.242 3.963 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301472322 1128466882 /nfs/dbraw/zinc/46/68/82/1128466882.db2.gz KQTGRDLHRXZFOZ-ZDUSSCGKSA-N 1 0 325.840 3.725 20 5 EHBDRO Cc1ccnc(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000301484129 1128473389 /nfs/dbraw/zinc/47/33/89/1128473389.db2.gz VCFOXFYUTYBQLT-AWEZNQCLSA-N 1 0 334.807 3.666 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301567432 1128498164 /nfs/dbraw/zinc/49/81/64/1128498164.db2.gz KBXQKMSBTKOTBV-MNOVXSKESA-N 1 0 342.237 3.642 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000301599732 1128505782 /nfs/dbraw/zinc/50/57/82/1128505782.db2.gz UOTNMZGRCSCEEB-WBVHZDCISA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000301602883 1128516415 /nfs/dbraw/zinc/51/64/15/1128516415.db2.gz WQSNJLKTWAHSHV-CRAIPNDOSA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000542703456 1128549253 /nfs/dbraw/zinc/54/92/53/1128549253.db2.gz NREBROWZIHKNCX-ROUUACIJSA-N 1 0 345.487 3.990 20 5 EHBDRO CC1CC[NH+](CCCNc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000347659521 1128564809 /nfs/dbraw/zinc/56/48/09/1128564809.db2.gz RUYQKFGCRYRMNR-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765849806 1128581740 /nfs/dbraw/zinc/58/17/40/1128581740.db2.gz QYQCRXXKFBDQMK-ROUUACIJSA-N 1 0 326.396 3.640 20 5 EHBDRO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+](C)C1CC1 ZINC000057707644 1128661861 /nfs/dbraw/zinc/66/18/61/1128661861.db2.gz FAIMQMJLLYBQMJ-CQSZACIVSA-N 1 0 333.435 3.601 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123253974 1128736025 /nfs/dbraw/zinc/73/60/25/1128736025.db2.gz VBUYBISOJBIEKD-GJZGRUSLSA-N 1 0 328.412 3.928 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2Nc2cc3c(c[nH+]2)CCCC3)n1 ZINC000462941441 1128806042 /nfs/dbraw/zinc/80/60/42/1128806042.db2.gz DHUJOCSONMBALH-HZPDHXFCSA-N 1 0 341.415 3.661 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(OC2COC2)cc1 ZINC001168463321 1120423694 /nfs/dbraw/zinc/42/36/94/1120423694.db2.gz KCCUIODIGBWSNV-UHFFFAOYSA-N 1 0 341.475 3.673 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000554945285 1128916446 /nfs/dbraw/zinc/91/64/46/1128916446.db2.gz GQADKLUSSFVRDP-NVXWUHKLSA-N 1 0 337.423 3.793 20 5 EHBDRO CCOC(=O)N(C)C1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000494658903 1120713883 /nfs/dbraw/zinc/71/38/83/1120713883.db2.gz JOICQZWAOXXOGI-AWEZNQCLSA-N 1 0 349.431 3.517 20 5 EHBDRO Cc1cc(N2CC[C@H](C(C)(C)C)[C@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542508631 1120855929 /nfs/dbraw/zinc/85/59/29/1120855929.db2.gz LUNDWWWSTQQVIK-MAUKXSAKSA-N 1 0 343.427 3.685 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCOCc1ccccc1)C2 ZINC000542514233 1120871038 /nfs/dbraw/zinc/87/10/38/1120871038.db2.gz CXYOHEWRBJKGNL-UHFFFAOYSA-N 1 0 326.396 3.560 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000542533847 1120932487 /nfs/dbraw/zinc/93/24/87/1120932487.db2.gz XSIKUJSWJATBAR-CJNGLKHVSA-N 1 0 334.416 3.757 20 5 EHBDRO CCC[NH+]1CCC(N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000495328458 1121079323 /nfs/dbraw/zinc/07/93/23/1121079323.db2.gz RRWSLUMDABHLEL-UHFFFAOYSA-N 1 0 345.365 3.924 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000193327938 1121114360 /nfs/dbraw/zinc/11/43/60/1121114360.db2.gz AOTOWFIEKIJMBT-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1cc(NC[C@@H](C)[N@@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301067608 1121302081 /nfs/dbraw/zinc/30/20/81/1121302081.db2.gz CEKKBOPPARSNQY-CYBMUJFWSA-N 1 0 331.441 3.823 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)c1 ZINC000390706933 1129016568 /nfs/dbraw/zinc/01/65/68/1129016568.db2.gz RDPSPGULIVSNFY-INIZCTEOSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@@H+]2Cc2ccccc2)c(F)c1 ZINC000390707006 1129017594 /nfs/dbraw/zinc/01/75/94/1129017594.db2.gz RQSNQXTXBUBVME-MRXNPFEDSA-N 1 0 329.375 3.810 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000301104661 1121919513 /nfs/dbraw/zinc/91/95/13/1121919513.db2.gz VISRRSKIWGMOBN-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000301756541 1129034331 /nfs/dbraw/zinc/03/43/31/1129034331.db2.gz DUNGRMNQYNWTBF-HNNXBMFYSA-N 1 0 333.432 3.577 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154306458 1122548434 /nfs/dbraw/zinc/54/84/34/1122548434.db2.gz UJZHNCHPUPMABP-LJHODMEESA-N 1 0 326.396 3.506 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000497474755 1122560028 /nfs/dbraw/zinc/56/00/28/1122560028.db2.gz ZJCJTPDLASCRPW-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000194552447 1122739862 /nfs/dbraw/zinc/73/98/62/1122739862.db2.gz PZYVCUKEUVWPNK-IBGZPJMESA-N 1 0 339.395 3.583 20 5 EHBDRO COc1ccc(-c2ccc(C[N@H+](C)[C@@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566112 1122777407 /nfs/dbraw/zinc/77/74/07/1122777407.db2.gz FAARRBCIBVTZCQ-GFCCVEGCSA-N 1 0 348.424 3.801 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-])C(C)(C)O ZINC000556237697 1122890639 /nfs/dbraw/zinc/89/06/39/1122890639.db2.gz FCZXZOPBBZTCDO-SWLSCSKDSA-N 1 0 326.462 3.605 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]C[C@@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000556251717 1122898263 /nfs/dbraw/zinc/89/82/63/1122898263.db2.gz DYGZFADFHLFCOO-DOTOQJQBSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1c(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911741 1123112470 /nfs/dbraw/zinc/11/24/70/1123112470.db2.gz QEPZMWXAKMHBMB-GOSISDBHSA-N 1 0 345.487 3.847 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000556872219 1123162886 /nfs/dbraw/zinc/16/28/86/1123162886.db2.gz PGGZBOFGVJGXFS-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO CC(C)CCOC1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000195198282 1123249862 /nfs/dbraw/zinc/24/98/62/1123249862.db2.gz WBZWKFWLEORWLO-UHFFFAOYSA-N 1 0 336.432 3.501 20 5 EHBDRO O=C(NCCCCCCC[NH+]1CCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000920258532 1123344936 /nfs/dbraw/zinc/34/49/36/1123344936.db2.gz ZZTQOOMTCVIUTL-UHFFFAOYSA-N 1 0 348.447 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(OC3CCCC3)CC2)cc1 ZINC000195328395 1123369588 /nfs/dbraw/zinc/36/95/88/1123369588.db2.gz YKEFOJRWCZHSAS-UHFFFAOYSA-N 1 0 348.443 3.787 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(F)cc1 ZINC000064350114 1123574302 /nfs/dbraw/zinc/57/43/02/1123574302.db2.gz XAKXQKQRFXCMFC-SFHVURJKSA-N 1 0 332.375 3.678 20 5 EHBDRO CC1(C)CN(Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000078516976 1129154515 /nfs/dbraw/zinc/15/45/15/1129154515.db2.gz OHCKWLWQRCIUEZ-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1cnc(NC2CC[NH+](CC3CCCC3)CC2)c(Cl)c1 ZINC000301254467 1124964280 /nfs/dbraw/zinc/96/42/80/1124964280.db2.gz CTJJIBSOIZUWFQ-UHFFFAOYSA-N 1 0 338.839 3.710 20 5 EHBDRO Cc1ccccc1[C@@H](CO)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984941 1125257180 /nfs/dbraw/zinc/25/71/80/1125257180.db2.gz MMBJKJBZAKRLHT-RTBURBONSA-N 1 0 340.423 3.949 20 5 EHBDRO CC[C@@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000182418827 1125277512 /nfs/dbraw/zinc/27/75/12/1125277512.db2.gz QUSQVSJCKLTLQK-MRXNPFEDSA-N 1 0 333.388 3.709 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000619531729 1125358387 /nfs/dbraw/zinc/35/83/87/1125358387.db2.gz SUSGMARJVBLIML-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000182939560 1125406189 /nfs/dbraw/zinc/40/61/89/1125406189.db2.gz LLWABCWMWRCLCK-LLVKDONJSA-N 1 0 339.823 3.745 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]([C@H]3CCOC3)C2)c(Cl)c1 ZINC000466363636 1129403672 /nfs/dbraw/zinc/40/36/72/1129403672.db2.gz FPOACOBPVHBUCW-AEGPPILISA-N 1 0 338.835 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](CO)CC2CCCC2)c(Cl)c1 ZINC000466409869 1129428731 /nfs/dbraw/zinc/42/87/31/1129428731.db2.gz OZWZKCXUNSKJDW-CYBMUJFWSA-N 1 0 326.824 3.527 20 5 EHBDRO CN(CCC1CCN(c2cc[nH+]cc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000301970429 1129465765 /nfs/dbraw/zinc/46/57/65/1129465765.db2.gz DMKJKFQYAZSYAT-UHFFFAOYSA-N 1 0 340.427 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@@H](O)[C@@H]4C3)s2)cc1 ZINC000543413223 1129473305 /nfs/dbraw/zinc/47/33/05/1129473305.db2.gz ZUKMGJDZOAPXOS-IAOVAPTHSA-N 1 0 344.436 3.526 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000543427515 1129482880 /nfs/dbraw/zinc/48/28/80/1129482880.db2.gz BHVFJDDAZVMMES-GJZGRUSLSA-N 1 0 332.400 3.795 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N(C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390571408 1129624199 /nfs/dbraw/zinc/62/41/99/1129624199.db2.gz TZIJQQDDUYCUOL-HZPDHXFCSA-N 1 0 327.428 3.766 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc3c(c2)OCCCO3)cccc1[N+](=O)[O-] ZINC000393097010 1129736131 /nfs/dbraw/zinc/73/61/31/1129736131.db2.gz WUQKKMCHZCCCFJ-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO CSCC[C@H](C)[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000126523307 1129751705 /nfs/dbraw/zinc/75/17/05/1129751705.db2.gz VWYXLPHKLIKWFS-ZDUSSCGKSA-N 1 0 349.456 3.866 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032642 1129764289 /nfs/dbraw/zinc/76/42/89/1129764289.db2.gz SPQUPQLHOYTZMS-DZGCQCFKSA-N 1 0 331.441 3.979 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196363 1129805444 /nfs/dbraw/zinc/80/54/44/1129805444.db2.gz FOXLQVNSTPQZSJ-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cc(F)ccc1F)c1cccc([N+](=O)[O-])c1 ZINC000056197016 1129805614 /nfs/dbraw/zinc/80/56/14/1129805614.db2.gz XPPKPPRQHOSSCX-MNOVXSKESA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1 ZINC000056197505 1129806154 /nfs/dbraw/zinc/80/61/54/1129806154.db2.gz DMLHTGSJHQGWEP-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000509159043 1129870874 /nfs/dbraw/zinc/87/08/74/1129870874.db2.gz YVMLOWMERMPHKF-OAHLLOKOSA-N 1 0 332.425 3.934 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000163648455 1129943386 /nfs/dbraw/zinc/94/33/86/1129943386.db2.gz LTJSCGPAHLKCBG-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)n1 ZINC000355220305 1129948032 /nfs/dbraw/zinc/94/80/32/1129948032.db2.gz NHAQODULFAGAOL-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](c2cnn(C)c2)C(C)C)cc1[N+](=O)[O-] ZINC000922891840 1130017823 /nfs/dbraw/zinc/01/78/23/1130017823.db2.gz LOEHJUKNVISICN-GOSISDBHSA-N 1 0 330.432 3.939 20 5 EHBDRO Cc1n[nH]cc1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000171384370 1130050590 /nfs/dbraw/zinc/05/05/90/1130050590.db2.gz BVNKFYRMCKLASM-UHFFFAOYSA-N 1 0 328.397 3.645 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363621 1130219333 /nfs/dbraw/zinc/21/93/33/1130219333.db2.gz MYYMDQJYYMCLPG-WMLDXEAASA-N 1 0 331.416 3.922 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419129 1130228073 /nfs/dbraw/zinc/22/80/73/1130228073.db2.gz SLTHKKUGMNNEBO-SJCJKPOMSA-N 1 0 349.381 3.827 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173451342 1130232654 /nfs/dbraw/zinc/23/26/54/1130232654.db2.gz NOEXCQILTHUYBJ-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000246306944 1130370859 /nfs/dbraw/zinc/37/08/59/1130370859.db2.gz DMEUQOLFEGEQMJ-KHYOSLBOSA-N 1 0 328.412 3.546 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831167 1130386228 /nfs/dbraw/zinc/38/62/28/1130386228.db2.gz PDIBPQNVRMVQPY-LBPRGKRZSA-N 1 0 334.807 3.670 20 5 EHBDRO CCOC(=O)CC[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532328 1130390515 /nfs/dbraw/zinc/39/05/15/1130390515.db2.gz CNUYOTNLQMSFMT-CABCVRRESA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208668 1130779609 /nfs/dbraw/zinc/77/96/09/1130779609.db2.gz CSRIBIGJRIOEQO-NWDGAFQWSA-N 1 0 334.445 3.737 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c1 ZINC000733992027 1131180645 /nfs/dbraw/zinc/18/06/45/1131180645.db2.gz LNCZXIRPJQYIKR-GOSISDBHSA-N 1 0 326.400 3.724 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000736628311 1131428263 /nfs/dbraw/zinc/42/82/63/1131428263.db2.gz IWCKXCLQPKAKMK-AWEZNQCLSA-N 1 0 332.350 3.938 20 5 EHBDRO CCCC[NH+](CCCC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742144603 1131690642 /nfs/dbraw/zinc/69/06/42/1131690642.db2.gz FAUMKAZMSAUITQ-UHFFFAOYSA-N 1 0 331.420 3.713 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1Cl ZINC000742369116 1131711122 /nfs/dbraw/zinc/71/11/22/1131711122.db2.gz MMSTYEBLUMHKFO-UHFFFAOYSA-N 1 0 336.775 3.555 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@@H]3CC(F)(F)C[C@@H]3C1)CC2 ZINC001172902716 1131885291 /nfs/dbraw/zinc/88/52/91/1131885291.db2.gz BTKULUXRZGJUQM-XHSDSOJGSA-N 1 0 336.382 3.819 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172904338 1131885840 /nfs/dbraw/zinc/88/58/40/1131885840.db2.gz XEEMRJNHKKEWRE-QGZVFWFLSA-N 1 0 344.386 3.780 20 5 EHBDRO COCC[C@@H]1CCCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914778 1131902809 /nfs/dbraw/zinc/90/28/09/1131902809.db2.gz ISFWITFZGABKJF-ZWKOTPCHSA-N 1 0 332.444 3.733 20 5 EHBDRO CC(C)OC1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172915560 1131902869 /nfs/dbraw/zinc/90/28/69/1131902869.db2.gz PATHXMHVLWOYED-QGZVFWFLSA-N 1 0 332.444 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+](C1CCC1)C1CCOCC1)CC2 ZINC001172914070 1131903000 /nfs/dbraw/zinc/90/30/00/1131903000.db2.gz YUEKXQNUXRVOMN-GOSISDBHSA-N 1 0 344.455 3.876 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380843 1131907402 /nfs/dbraw/zinc/90/74/02/1131907402.db2.gz SZYDYGVHTNKFKH-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO Cc1ccc(C(=O)C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912045 1131917927 /nfs/dbraw/zinc/91/79/27/1131917927.db2.gz LMXSFYPHOLFHNP-GOSISDBHSA-N 1 0 338.407 3.623 20 5 EHBDRO [NH3+]Cc1cccc2c1cnn2[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913509 1131918899 /nfs/dbraw/zinc/91/88/99/1131918899.db2.gz WNOIIUVKJUEFGY-MRXNPFEDSA-N 1 0 336.395 3.523 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000743498755 1131930522 /nfs/dbraw/zinc/93/05/22/1131930522.db2.gz RZAYYNXOJXSMCJ-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000743856556 1131988541 /nfs/dbraw/zinc/98/85/41/1131988541.db2.gz KPQWMLZLCFOBON-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2ccc(C)cn2)c1F ZINC001173187404 1131993299 /nfs/dbraw/zinc/99/32/99/1131993299.db2.gz FFDZESAXMUPUPD-OLZOCXBDSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C(C(C)C)C(C)C)c1F ZINC001173188864 1131993464 /nfs/dbraw/zinc/99/34/64/1131993464.db2.gz LLVRSXZSWKFXAC-LBPRGKRZSA-N 1 0 326.412 3.944 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c1F ZINC001173187396 1131993681 /nfs/dbraw/zinc/99/36/81/1131993681.db2.gz FEJPJSABGBFMBO-QWRGUYRKSA-N 1 0 346.349 3.841 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC[C@@H](C(F)F)C2)c1F ZINC001173189251 1131995010 /nfs/dbraw/zinc/99/50/10/1131995010.db2.gz JXACYPBALGSAIC-WDEREUQCSA-N 1 0 346.349 3.651 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccc(F)cn1)C1CC1 ZINC001173226643 1132006217 /nfs/dbraw/zinc/00/62/17/1132006217.db2.gz YHCSFAMQBSRJMW-KZULUSFZSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1ccccc1Cl ZINC001173225555 1132006330 /nfs/dbraw/zinc/00/63/30/1132006330.db2.gz RRROGRDBLGAUEU-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](CCN(C)C)Cc1ccccc1 ZINC001173226150 1132006463 /nfs/dbraw/zinc/00/64/63/1132006463.db2.gz LDXOOCLNIHAOTD-KRWDZBQOSA-N 1 0 341.455 3.590 20 5 EHBDRO Cc1ccc([C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173231105 1132009615 /nfs/dbraw/zinc/00/96/15/1132009615.db2.gz XKKTXKVBQRCSSF-LIRRHRJNSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC001173235877 1132010671 /nfs/dbraw/zinc/01/06/71/1132010671.db2.gz VPUDHQHHXQQIGS-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nc2ccccc2s1 ZINC001173212087 1132014359 /nfs/dbraw/zinc/01/43/59/1132014359.db2.gz WOYRJPDWQGBUOA-LBPRGKRZSA-N 1 0 327.409 3.925 20 5 EHBDRO Cc1nn(C[N@@H+](CCc2ccc(F)cc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000746065304 1132364240 /nfs/dbraw/zinc/36/42/40/1132364240.db2.gz CNQYLERQTYIPTG-UHFFFAOYSA-N 1 0 348.422 3.705 20 5 EHBDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001174565693 1132417272 /nfs/dbraw/zinc/41/72/72/1132417272.db2.gz RPLPDEQHZZHFGR-SJORKVTESA-N 1 0 348.443 3.690 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168976735 1132617369 /nfs/dbraw/zinc/61/73/69/1132617369.db2.gz FYNVRYCASRVWKO-SDDRHHMPSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001168976225 1132617449 /nfs/dbraw/zinc/61/74/49/1132617449.db2.gz ZWIDGGLBZCTULX-RNCFNFMXSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)C1 ZINC001168978203 1132617912 /nfs/dbraw/zinc/61/79/12/1132617912.db2.gz PTRAKQDYFAKPFR-UKRRQHHQSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001168978153 1132618321 /nfs/dbraw/zinc/61/83/21/1132618321.db2.gz OXOJHUDHNUKMPT-UKRRQHHQSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cc(-c3cccc(Cl)c3)no2)C1 ZINC001168983827 1132619481 /nfs/dbraw/zinc/61/94/81/1132619481.db2.gz LKUZYDACGKWBNH-RISCZKNCSA-N 1 0 335.791 3.530 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC001168966799 1132621430 /nfs/dbraw/zinc/62/14/30/1132621430.db2.gz LFPZFNHTVUYULP-RTBURBONSA-N 1 0 340.423 3.801 20 5 EHBDRO CC[N@H+](Cc1cccc(Br)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035074 1132636592 /nfs/dbraw/zinc/63/65/92/1132636592.db2.gz ADLOSRCAFXEMDG-ZFWWWQNUSA-N 1 0 341.249 3.716 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040152 1132638483 /nfs/dbraw/zinc/63/84/83/1132638483.db2.gz YHTQTDVZJKYHRM-UKPHBRMFSA-N 1 0 338.835 3.629 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(Oc3ccccc3Cl)CC2)C1 ZINC001169024971 1132640592 /nfs/dbraw/zinc/64/05/92/1132640592.db2.gz IGCXZBCJMRNVJR-KBPBESRZSA-N 1 0 338.835 3.629 20 5 EHBDRO C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057913 1132646675 /nfs/dbraw/zinc/64/66/75/1132646675.db2.gz YXKXZQDVZAAALQ-UKRRQHHQSA-N 1 0 330.350 3.625 20 5 EHBDRO CCOc1cc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)ccc1[N+](=O)[O-] ZINC001169151498 1132679053 /nfs/dbraw/zinc/67/90/53/1132679053.db2.gz KIWOCIHNAZLBCC-RDTXWAMCSA-N 1 0 335.448 3.949 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1cnc(Cl)cc1[N+](=O)[O-] ZINC001169683882 1132818033 /nfs/dbraw/zinc/81/80/33/1132818033.db2.gz DXNOSFQLGCKFKG-GFCCVEGCSA-N 1 0 332.791 3.883 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967253 1132924530 /nfs/dbraw/zinc/92/45/30/1132924530.db2.gz IGQNOMCBQIYNBI-MLGOLLRUSA-N 1 0 334.803 3.502 20 5 EHBDRO C[NH+](C)CCCC1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000767004850 1132928103 /nfs/dbraw/zinc/92/81/03/1132928103.db2.gz UUPXBDSSIUSUDN-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H]([NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC000804357270 1133008317 /nfs/dbraw/zinc/00/83/17/1133008317.db2.gz BPCRBLZVQBMDJU-ZQIUZPCESA-N 1 0 345.443 3.639 20 5 EHBDRO Cc1ncc(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)s1 ZINC001178245094 1133145070 /nfs/dbraw/zinc/14/50/70/1133145070.db2.gz ZUXLCLCXEKSPDJ-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178558034 1133181351 /nfs/dbraw/zinc/18/13/51/1133181351.db2.gz WZZVXNVXEDJJGQ-MNOVXSKESA-N 1 0 327.222 3.883 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCc3ccoc3)o2)c([N+](=O)[O-])c1 ZINC001179165614 1133233970 /nfs/dbraw/zinc/23/39/70/1133233970.db2.gz VENSFSUMJOKHNZ-UHFFFAOYSA-N 1 0 342.351 3.789 20 5 EHBDRO C[NH+](C)C1CN(C(=O)CCc2c3ccccc3cc3ccccc32)C1 ZINC001182411540 1133651024 /nfs/dbraw/zinc/65/10/24/1133651024.db2.gz YZQZTJQWGRSOKF-UHFFFAOYSA-N 1 0 332.447 3.698 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC001184053649 1133891327 /nfs/dbraw/zinc/89/13/27/1133891327.db2.gz BZNMYUWNMXDZJB-ZNWBIBPKSA-N 1 0 344.455 3.853 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1c(F)cccc1F ZINC000786815394 1133909959 /nfs/dbraw/zinc/90/99/59/1133909959.db2.gz SGBLQLASBDRRBI-UEOUDEGLSA-N 1 0 348.349 3.600 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccccc1C ZINC000786816707 1133911488 /nfs/dbraw/zinc/91/14/88/1133911488.db2.gz WBKYSJQJQBPDIT-ATEOEAFZSA-N 1 0 326.396 3.630 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])CC(C)C ZINC001184740946 1133986139 /nfs/dbraw/zinc/98/61/39/1133986139.db2.gz XWCYSJFSJCQPJF-CYBMUJFWSA-N 1 0 338.408 3.671 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@@H+]1CCCC[C@H]1C ZINC001184856822 1133998878 /nfs/dbraw/zinc/99/88/78/1133998878.db2.gz MTYGYMMSRLNJFS-KGLIPLIRSA-N 1 0 328.416 3.818 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000788537326 1134138638 /nfs/dbraw/zinc/13/86/38/1134138638.db2.gz JHXSKLJVBLQITR-ROUUACIJSA-N 1 0 332.375 3.582 20 5 EHBDRO Cc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788610932 1134145650 /nfs/dbraw/zinc/14/56/50/1134145650.db2.gz KEGYVOMTOBUEFP-KBPBESRZSA-N 1 0 329.400 3.604 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(N[C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788710747 1134161867 /nfs/dbraw/zinc/16/18/67/1134161867.db2.gz ISPWGWHJMIQLCM-CYBMUJFWSA-N 1 0 328.416 3.720 20 5 EHBDRO CC1(C)CCC[N@H+](CCNc2ncc([N+](=O)[O-])c3ccccc32)C1 ZINC001186266803 1134190689 /nfs/dbraw/zinc/19/06/89/1134190689.db2.gz HSWUMONCDXUBSS-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC[C@H]2[C@@H]2CCOC2)c1 ZINC000788984032 1134200348 /nfs/dbraw/zinc/20/03/48/1134200348.db2.gz MILATKUZXTVXES-ISTRZQFTSA-N 1 0 338.835 3.933 20 5 EHBDRO Cc1cccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000775060037 1134273251 /nfs/dbraw/zinc/27/32/51/1134273251.db2.gz FSMQOYGZFUHCSW-HNNXBMFYSA-N 1 0 341.367 3.801 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789508203 1134287823 /nfs/dbraw/zinc/28/78/23/1134287823.db2.gz ZUZYNILOULPDBO-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513472 1134289228 /nfs/dbraw/zinc/28/92/28/1134289228.db2.gz JZJGWRUGQURPFT-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606107 1134582547 /nfs/dbraw/zinc/58/25/47/1134582547.db2.gz QMDFJUOFNRJTQX-XLIONFOSSA-N 1 0 340.423 3.735 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)c([N+](=O)[O-])c1 ZINC001170297508 1134737293 /nfs/dbraw/zinc/73/72/93/1134737293.db2.gz OHDXZZVYLBPCSM-KGLIPLIRSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cccc(C)c2C)c([N+](=O)[O-])c1 ZINC001170296695 1134737333 /nfs/dbraw/zinc/73/73/33/1134737333.db2.gz HQLVZVNMQBSPBL-AWEZNQCLSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001170299215 1134737949 /nfs/dbraw/zinc/73/79/49/1134737949.db2.gz SOUKEARGEWWGHV-GJZGRUSLSA-N 1 0 328.412 3.928 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170327227 1134748458 /nfs/dbraw/zinc/74/84/58/1134748458.db2.gz GAWUIBVZNFDMTF-HNNXBMFYSA-N 1 0 328.412 3.709 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352869 1134754409 /nfs/dbraw/zinc/75/44/09/1134754409.db2.gz SIFBYIAYZFONLV-CYBMUJFWSA-N 1 0 330.384 3.792 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170343520 1134758845 /nfs/dbraw/zinc/75/88/45/1134758845.db2.gz PYKSLRZDNFEHHG-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170351627 1134760582 /nfs/dbraw/zinc/76/05/82/1134760582.db2.gz GMDKTUSCAZPJBM-NSHDSACASA-N 1 0 328.359 3.512 20 5 EHBDRO CN(CC[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC001190895190 1134764579 /nfs/dbraw/zinc/76/45/79/1134764579.db2.gz OGJSSZARYFNSIK-UHFFFAOYSA-N 1 0 333.819 3.816 20 5 EHBDRO CC[C@@H]1c2ccccc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191039251 1134782164 /nfs/dbraw/zinc/78/21/64/1134782164.db2.gz NTZNQKRCEIBVHP-LJQANCHMSA-N 1 0 326.396 3.983 20 5 EHBDRO CC(C)[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001191538677 1134881249 /nfs/dbraw/zinc/88/12/49/1134881249.db2.gz CKZWOWSYDQYTQY-NSHDSACASA-N 1 0 327.222 3.835 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000793239061 1134886235 /nfs/dbraw/zinc/88/62/35/1134886235.db2.gz QJWPSNUTAPMPAD-ROUUACIJSA-N 1 0 332.375 3.726 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199945 1134978722 /nfs/dbraw/zinc/97/87/22/1134978722.db2.gz PXVCSAZDSWHBLK-CVEARBPZSA-N 1 0 347.459 3.988 20 5 EHBDRO C[C@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000804606403 1135136092 /nfs/dbraw/zinc/13/60/92/1135136092.db2.gz LPUBJPMEHXKOHB-QWHCGFSZSA-N 1 0 348.403 3.568 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784281 1135199746 /nfs/dbraw/zinc/19/97/46/1135199746.db2.gz ZMCVOHGOQVPRDR-BXUZGUMPSA-N 1 0 348.359 3.637 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)C(C)C ZINC001194408040 1135266009 /nfs/dbraw/zinc/26/60/09/1135266009.db2.gz ATVGZYFFFWTWRT-INIZCTEOSA-N 1 0 336.823 3.740 20 5 EHBDRO Cc1cccc(C[N@@H+](C)[C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC001194615579 1135298919 /nfs/dbraw/zinc/29/89/19/1135298919.db2.gz HSMJJXOOUIFJJP-OAHLLOKOSA-N 1 0 341.411 3.671 20 5 EHBDRO CC(C)(C)OC(=O)CC[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233623 1135389871 /nfs/dbraw/zinc/38/98/71/1135389871.db2.gz KDHWGDORZBMWJR-OAHLLOKOSA-N 1 0 348.443 3.929 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@@H](C4CC4)C3)c2)cc1 ZINC000808231189 1135634042 /nfs/dbraw/zinc/63/40/42/1135634042.db2.gz ZLZYIVXLDLZYJV-MRXNPFEDSA-N 1 0 326.400 3.538 20 5 EHBDRO CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CO)c1ccccc1 ZINC001197256214 1135666700 /nfs/dbraw/zinc/66/67/00/1135666700.db2.gz OSWLZZRJLMRRFY-QGZVFWFLSA-N 1 0 334.803 3.804 20 5 EHBDRO C[N@H+](CCCCCn1cccn1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000104663745 1135854833 /nfs/dbraw/zinc/85/48/33/1135854833.db2.gz UPUHSQYWLUQJDB-UHFFFAOYSA-N 1 0 336.823 3.747 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](c2cccs2)N2CCCC2)cccc1[N+](=O)[O-] ZINC001198969416 1135870246 /nfs/dbraw/zinc/87/02/46/1135870246.db2.gz PBRNOMGKCHRNRG-KRWDZBQOSA-N 1 0 345.468 3.891 20 5 EHBDRO [NH3+]CCN(Cc1ccc(C(F)(F)F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000809734340 1135874023 /nfs/dbraw/zinc/87/40/23/1135874023.db2.gz BBYIOOPKDBLODM-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO C[N@H+](CCC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000809712966 1135876467 /nfs/dbraw/zinc/87/64/67/1135876467.db2.gz BDWGXUMZSHHFII-UHFFFAOYSA-N 1 0 326.827 3.954 20 5 EHBDRO [NH3+]CCN(Cc1ccc(C(F)(F)F)s1)c1ccc([N+](=O)[O-])cc1 ZINC000809735966 1135882168 /nfs/dbraw/zinc/88/21/68/1135882168.db2.gz BEORRDOKXJTSHH-UHFFFAOYSA-N 1 0 345.346 3.640 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H](CO)C1CCCCC1 ZINC000809974245 1135907220 /nfs/dbraw/zinc/90/72/20/1135907220.db2.gz QGDZZNBAFVTBQZ-CQSZACIVSA-N 1 0 347.242 3.932 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCO1 ZINC000809975716 1135907283 /nfs/dbraw/zinc/90/72/83/1135907283.db2.gz SIPIMPVNJOVDJP-CHWSQXEVSA-N 1 0 333.215 3.949 20 5 EHBDRO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC000809973121 1135907421 /nfs/dbraw/zinc/90/74/21/1135907421.db2.gz ITOOKFSZXQFMKL-YGRLFVJLSA-N 1 0 347.242 3.885 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)nc1 ZINC000810224056 1135940004 /nfs/dbraw/zinc/94/00/04/1135940004.db2.gz SPSLCPCNRLFWEW-SNVBAGLBSA-N 1 0 336.189 3.603 20 5 EHBDRO CCC[NH+]1CCC(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811486237 1136092356 /nfs/dbraw/zinc/09/23/56/1136092356.db2.gz HHLKXYYVIKNEAZ-UHFFFAOYSA-N 1 0 346.258 3.866 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1ccc(O)cc1 ZINC000811476826 1136096347 /nfs/dbraw/zinc/09/63/47/1136096347.db2.gz SVFPGIHNFXBTKH-UHFFFAOYSA-N 1 0 341.194 3.940 20 5 EHBDRO C[C@H](C1CC1)[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271955 1136124331 /nfs/dbraw/zinc/12/43/31/1136124331.db2.gz PIGGULWUPYBOBQ-QRWLVFNGSA-N 1 0 340.423 3.929 20 5 EHBDRO CC(C)[N@@H+](Cc1cccc(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277988 1136126093 /nfs/dbraw/zinc/12/60/93/1136126093.db2.gz RZBKEVLKAMIXNQ-GOSISDBHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC(C)[C@@H]1c2ccccc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276668 1136131071 /nfs/dbraw/zinc/13/10/71/1136131071.db2.gz IRXVKSUNGNNAQF-WOJBJXKFSA-N 1 0 340.423 3.884 20 5 EHBDRO C[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000776278077 1136131193 /nfs/dbraw/zinc/13/11/93/1136131193.db2.gz RPDXKWXPEPXDDR-YSGRDPCXSA-N 1 0 340.423 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2COC3(CCC3)C2)o1 ZINC000850367457 1136242590 /nfs/dbraw/zinc/24/25/90/1136242590.db2.gz JUCGPFOXTPKUGG-ZDUSSCGKSA-N 1 0 328.368 3.656 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851219 1136261225 /nfs/dbraw/zinc/26/12/25/1136261225.db2.gz QOSAXEJOFLIJFB-BEFAXECRSA-N 1 0 328.412 3.847 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2COC3(CCC3)C2)c2ccccc2)c1 ZINC000850523826 1136277565 /nfs/dbraw/zinc/27/75/65/1136277565.db2.gz DCNYGJDPJQFVHV-MJGOQNOKSA-N 1 0 338.407 3.985 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CC1SCCS1 ZINC000850562326 1136286570 /nfs/dbraw/zinc/28/65/70/1136286570.db2.gz ZUMBMAVGWRKNOM-TZMCWYRMSA-N 1 0 338.498 3.702 20 5 EHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)[C@H](O)c1ccccc1 ZINC000852066246 1136430958 /nfs/dbraw/zinc/43/09/58/1136430958.db2.gz MXBDBMKSLIXGSA-UGSOOPFHSA-N 1 0 332.375 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000776583342 1136441568 /nfs/dbraw/zinc/44/15/68/1136441568.db2.gz DNXJTSNBXZBCOU-DLBZAZTESA-N 1 0 330.384 3.839 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587821 1136447001 /nfs/dbraw/zinc/44/70/01/1136447001.db2.gz OVMJBAXDFKHCDC-AUUYWEPGSA-N 1 0 326.396 3.854 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589397 1136450558 /nfs/dbraw/zinc/45/05/58/1136450558.db2.gz RXSUDWBTYMYSEA-MJGOQNOKSA-N 1 0 328.412 3.581 20 5 EHBDRO CCC(C)(C)[C@H](C)[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852355395 1136451513 /nfs/dbraw/zinc/45/15/13/1136451513.db2.gz FQZGZUPZQGOLNK-JTQLQIEISA-N 1 0 327.812 3.601 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000852651648 1136473463 /nfs/dbraw/zinc/47/34/63/1136473463.db2.gz QAXLMADMHDYQCN-XSRFYTQQSA-N 1 0 325.340 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000852758897 1136483857 /nfs/dbraw/zinc/48/38/57/1136483857.db2.gz GRWAGTSSGVTUPN-CALCHBBNSA-N 1 0 336.819 3.641 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000853016245 1136498557 /nfs/dbraw/zinc/49/85/57/1136498557.db2.gz UURTZDKTQLZAQS-KGLIPLIRSA-N 1 0 339.386 3.748 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc(O)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575555 1136618105 /nfs/dbraw/zinc/61/81/05/1136618105.db2.gz UXRYTOVBRRQBDJ-QWHCGFSZSA-N 1 0 329.400 3.555 20 5 EHBDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCO1 ZINC000815614706 1136618846 /nfs/dbraw/zinc/61/88/46/1136618846.db2.gz ZBQGPGFZFQCPTH-QITLCBANSA-N 1 0 335.448 3.811 20 5 EHBDRO C[C@H](CCOCc1ccccc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626503 1136620879 /nfs/dbraw/zinc/62/08/79/1136620879.db2.gz FUUJOOBRZXTTRG-CABCVRRESA-N 1 0 343.427 3.823 20 5 EHBDRO Cc1c(C[N@@H+](Cc2ccccc2)[C@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000112659816 1136644100 /nfs/dbraw/zinc/64/41/00/1136644100.db2.gz IHGPFIAUVSJTLB-HXUWFJFHSA-N 1 0 342.439 3.922 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000776820377 1136701660 /nfs/dbraw/zinc/70/16/60/1136701660.db2.gz DKWGQXSDSUCMPO-YCPHGPKFSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCC1([NH+](C)C)CCCCCC1 ZINC001135606437 1136727693 /nfs/dbraw/zinc/72/76/93/1136727693.db2.gz SRIYCWJVUZACEQ-UHFFFAOYSA-N 1 0 347.459 3.596 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000856806484 1136813060 /nfs/dbraw/zinc/81/30/60/1136813060.db2.gz FTRIZYRSGUJDNL-NSHDSACASA-N 1 0 333.215 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCC[C@@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000817906659 1136845293 /nfs/dbraw/zinc/84/52/93/1136845293.db2.gz AQHNUWHMHALHJT-DJIMGWMZSA-N 1 0 337.851 3.649 20 5 EHBDRO Cc1ccccc1[C@@H](O)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000819092008 1136907635 /nfs/dbraw/zinc/90/76/35/1136907635.db2.gz PQKVILPACLWFJZ-IBGZPJMESA-N 1 0 328.412 3.549 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](O)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000819091275 1136907919 /nfs/dbraw/zinc/90/79/19/1136907919.db2.gz CWRZMPPYJBIMDU-IBGZPJMESA-N 1 0 346.402 3.688 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000819143111 1136912703 /nfs/dbraw/zinc/91/27/03/1136912703.db2.gz ZTCYCHIHZNGWGO-CORIIIEPSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000819143113 1136912852 /nfs/dbraw/zinc/91/28/52/1136912852.db2.gz ZTCYCHIHZNGWGO-OSAQELSMSA-N 1 0 346.349 3.587 20 5 EHBDRO C[C@H]([NH2+]CCC1CN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000859230977 1137009005 /nfs/dbraw/zinc/00/90/05/1137009005.db2.gz OZQSMGUKJMAKQO-ZDUSSCGKSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2C[C@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000822807747 1137075082 /nfs/dbraw/zinc/07/50/82/1137075082.db2.gz FYFXULNJYNCFOR-DFBGVHRSSA-N 1 0 328.372 3.546 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC[C@H]1CCCOC1 ZINC000862432913 1137144209 /nfs/dbraw/zinc/14/42/09/1137144209.db2.gz FKWAWKUKOHWKKX-SNVBAGLBSA-N 1 0 333.215 3.808 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCCC3(F)F)CC2)cc1 ZINC000824799935 1137152983 /nfs/dbraw/zinc/15/29/83/1137152983.db2.gz RVKIAWLEUOILJE-ZDUSSCGKSA-N 1 0 339.386 3.589 20 5 EHBDRO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821146 1137153761 /nfs/dbraw/zinc/15/37/61/1137153761.db2.gz VCRIQEPDUPMWOL-CQSZACIVSA-N 1 0 348.834 3.670 20 5 EHBDRO Cc1ccccc1C1([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000844351476 1137214491 /nfs/dbraw/zinc/21/44/91/1137214491.db2.gz PDUMYXXZBHTIBO-GOSISDBHSA-N 1 0 326.396 3.606 20 5 EHBDRO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000794620133 1137221331 /nfs/dbraw/zinc/22/13/31/1137221331.db2.gz HXERPRMIJOFHMQ-CQSZACIVSA-N 1 0 345.399 3.505 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000846039069 1137329061 /nfs/dbraw/zinc/32/90/61/1137329061.db2.gz STQWQHDCVDXXNE-GJZGRUSLSA-N 1 0 330.787 3.788 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000866147374 1137331761 /nfs/dbraw/zinc/33/17/61/1137331761.db2.gz OWNLDCPWHSCPAA-UHFFFAOYSA-N 1 0 346.353 3.683 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cn(C)c2ncccc12)c1cccc([N+](=O)[O-])c1 ZINC000866569868 1137365919 /nfs/dbraw/zinc/36/59/19/1137365919.db2.gz AGSBGNBMYKNIOD-GOSISDBHSA-N 1 0 338.411 3.765 20 5 EHBDRO [NH3+]Cc1ccc2cn(-c3cc4cccnc4c4ncccc34)nc2c1 ZINC001171324012 1137420192 /nfs/dbraw/zinc/42/01/92/1137420192.db2.gz VFTCOMGCLLVXKK-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Br)o1 ZINC000036819297 1137473976 /nfs/dbraw/zinc/47/39/76/1137473976.db2.gz ILOXKYQDBXKGBS-UHFFFAOYSA-N 1 0 325.162 3.727 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NC1CCN(c2cccnc2)CC1 ZINC001171473526 1137493049 /nfs/dbraw/zinc/49/30/49/1137493049.db2.gz LEHHHBGZSQUIOB-UHFFFAOYSA-N 1 0 339.507 3.759 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1c(F)cccc1[N+](=O)[O-] ZINC000872037734 1137566876 /nfs/dbraw/zinc/56/68/76/1137566876.db2.gz FQQRDPIBCNGGGC-LLVKDONJSA-N 1 0 333.319 3.535 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057566 1137568651 /nfs/dbraw/zinc/56/86/51/1137568651.db2.gz GBQFDZKXLMIHHJ-JQHQGBHXSA-N 1 0 334.391 3.732 20 5 EHBDRO C[C@H](CC(=O)Nc1ccccc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129590 1137573052 /nfs/dbraw/zinc/57/30/52/1137573052.db2.gz QLOMZECIFYVOHZ-KGLIPLIRSA-N 1 0 327.384 3.663 20 5 EHBDRO Cc1nccnc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000872133159 1137573410 /nfs/dbraw/zinc/57/34/10/1137573410.db2.gz KVPCEKKOYSYMEQ-UXLLHSPISA-N 1 0 340.427 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000872217493 1137575907 /nfs/dbraw/zinc/57/59/07/1137575907.db2.gz XVXVEMVQCJFRBD-GUDVDZBRSA-N 1 0 326.396 3.554 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H](c3ccccc3)C3CCC3)C2)c1 ZINC000877011252 1137667498 /nfs/dbraw/zinc/66/74/98/1137667498.db2.gz BUKWMRPUADTWNK-HTWSVDAQSA-N 1 0 326.400 3.626 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]C23CCC(CC2)C3)cc1Br ZINC000877309120 1137674179 /nfs/dbraw/zinc/67/41/79/1137674179.db2.gz GVUOXBLGQAMRMP-UHFFFAOYSA-N 1 0 331.235 3.841 20 5 EHBDRO Cc1ccc(SC[C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877402020 1137675518 /nfs/dbraw/zinc/67/55/18/1137675518.db2.gz VQVHIVFLLNZFOH-NFOMZHRRSA-N 1 0 346.456 3.574 20 5 EHBDRO C[C@]1(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@@]1(F)Cl ZINC000877610952 1137682795 /nfs/dbraw/zinc/68/27/95/1137682795.db2.gz MRZOESBOUUGAMA-KBPBESRZSA-N 1 0 327.743 3.530 20 5 EHBDRO CONC(=O)C1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000877787808 1137689815 /nfs/dbraw/zinc/68/98/15/1137689815.db2.gz QDTUMVBAFANXHC-UHFFFAOYSA-N 1 0 348.446 3.883 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878112332 1137702988 /nfs/dbraw/zinc/70/29/88/1137702988.db2.gz ZXQDXHIRNZHYEQ-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO C[C@H]1CC[C@@]2(CC[N@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399660 1137714394 /nfs/dbraw/zinc/71/43/94/1137714394.db2.gz PNGCDXXNPJEVBO-SCLBCKFNSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399658 1137714447 /nfs/dbraw/zinc/71/44/47/1137714447.db2.gz PNGCDXXNPJEVBO-ACJLOTCBSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447923 1137716485 /nfs/dbraw/zinc/71/64/85/1137716485.db2.gz OVZLGIYKROZIIL-JSGCOSHPSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497113 1137718033 /nfs/dbraw/zinc/71/80/33/1137718033.db2.gz QTVGNSHLRMFMIN-UPJWGTAASA-N 1 0 330.388 3.511 20 5 EHBDRO CC(C)[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1CCC1 ZINC000878516650 1137718669 /nfs/dbraw/zinc/71/86/69/1137718669.db2.gz UJABZBRTNFOACM-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000879964640 1137763636 /nfs/dbraw/zinc/76/36/36/1137763636.db2.gz MCVAZSJUWHJWBE-GFCCVEGCSA-N 1 0 346.349 3.597 20 5 EHBDRO C[C@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CCN1c1cc[nH+]cc1 ZINC000882820811 1137835159 /nfs/dbraw/zinc/83/51/59/1137835159.db2.gz BAJOTYQJYXMZQE-LBPRGKRZSA-N 1 0 348.353 3.643 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000882962247 1137839917 /nfs/dbraw/zinc/83/99/17/1137839917.db2.gz MFDYQSBFBKGZMC-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C2CCC3(COC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000883381985 1137858332 /nfs/dbraw/zinc/85/83/32/1137858332.db2.gz XKTKRZZJPXRNGN-QGZVFWFLSA-N 1 0 330.428 3.866 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3CCC4(COC4)CC3)o2)c1 ZINC000883391937 1137859386 /nfs/dbraw/zinc/85/93/86/1137859386.db2.gz WWBBXZWOFGWPMR-UHFFFAOYSA-N 1 0 342.395 3.904 20 5 EHBDRO C[NH+](C)C[C@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865591 1137889786 /nfs/dbraw/zinc/88/97/86/1137889786.db2.gz QQTBWHXXMDYZOK-KRWDZBQOSA-N 1 0 333.819 3.641 20 5 EHBDRO Cc1c(C[N@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@H]2O)cccc1[N+](=O)[O-] ZINC000331948612 1137926574 /nfs/dbraw/zinc/92/65/74/1137926574.db2.gz PAGXPESNAQDAPZ-ZFKCKOODSA-N 1 0 332.444 3.665 20 5 EHBDRO Cc1[nH]c(C2CCN(c3ccc([N+](=O)[O-])cc3Cl)CC2)[nH+]c1C ZINC000884708316 1137970296 /nfs/dbraw/zinc/97/02/96/1137970296.db2.gz UVJWOMOCDWQABS-UHFFFAOYSA-N 1 0 334.807 3.972 20 5 EHBDRO CC(C)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCC1 ZINC000068449345 1138085053 /nfs/dbraw/zinc/08/50/53/1138085053.db2.gz UEGWBRNIVWIWKB-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO CC(C)[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cnn(C)c1 ZINC000886586521 1138099813 /nfs/dbraw/zinc/09/98/13/1138099813.db2.gz TUCBESSFPVBYQA-INIZCTEOSA-N 1 0 336.823 3.511 20 5 EHBDRO CN(Cc1csc([N+](=O)[O-])c1)C[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110088 1138129799 /nfs/dbraw/zinc/12/97/99/1138129799.db2.gz GYVUIPKWNISAAR-INIZCTEOSA-N 1 0 345.468 3.610 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000085635951 1138184856 /nfs/dbraw/zinc/18/48/56/1138184856.db2.gz NNLOHHJBPYDXRP-OAHLLOKOSA-N 1 0 348.447 3.550 20 5 EHBDRO COCCCOc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000090718756 1138213025 /nfs/dbraw/zinc/21/30/25/1138213025.db2.gz BOPOXVFFEOVEEI-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@](C)(O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000090890990 1138214105 /nfs/dbraw/zinc/21/41/05/1138214105.db2.gz LMDOECBMQZHYIC-UGSOOPFHSA-N 1 0 332.375 3.601 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000091957895 1138223360 /nfs/dbraw/zinc/22/33/60/1138223360.db2.gz VRBOJDGOILLOBB-RIGVPDNZSA-N 1 0 342.395 3.789 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCOC1 ZINC000093839944 1138241792 /nfs/dbraw/zinc/24/17/92/1138241792.db2.gz WSMCEKHWCKXBSW-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO Cc1ccc(C[NH2+]CCCc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000124376897 1138285578 /nfs/dbraw/zinc/28/55/78/1138285578.db2.gz IGEVRZTUZIEXDE-UHFFFAOYSA-N 1 0 338.411 3.512 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000263802840 1138370445 /nfs/dbraw/zinc/37/04/45/1138370445.db2.gz WIKUAGQISFWWMG-FRRDWIJNSA-N 1 0 330.388 3.684 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316148 1139577059 /nfs/dbraw/zinc/57/70/59/1139577059.db2.gz RSGAYGHEGXUSJG-YOEHRIQHSA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102180 1139735075 /nfs/dbraw/zinc/73/50/75/1139735075.db2.gz VGSZZPLDRXVUBH-PBHICJAKSA-N 1 0 337.419 3.682 20 5 EHBDRO CCCCNC(=O)C1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182590431 1139981424 /nfs/dbraw/zinc/98/14/24/1139981424.db2.gz APLUHPKJACTXSL-OAHLLOKOSA-N 1 0 347.459 3.593 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCc3sccc32)c([N+](=O)[O-])cc1O ZINC000183789549 1140058482 /nfs/dbraw/zinc/05/84/82/1140058482.db2.gz JOSARYBZAFAQOA-LBPRGKRZSA-N 1 0 334.397 3.538 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H](CCO)c1ccco1 ZINC000186543396 1140209413 /nfs/dbraw/zinc/20/94/13/1140209413.db2.gz VWRANQPEIKFCGD-XIRDDKMYSA-N 1 0 344.411 3.612 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC2)C1 ZINC000186994834 1140231107 /nfs/dbraw/zinc/23/11/07/1140231107.db2.gz ILOUAYYCHRRKGB-LBPRGKRZSA-N 1 0 328.372 3.582 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCCC4(CC4)C3)o2)c1 ZINC000187002288 1140232033 /nfs/dbraw/zinc/23/20/33/1140232033.db2.gz UOSRWLWURRCQNJ-UHFFFAOYSA-N 1 0 327.384 3.668 20 5 EHBDRO COCC1=CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000187618244 1140264445 /nfs/dbraw/zinc/26/44/45/1140264445.db2.gz WVUPPDAYHIYTFI-UHFFFAOYSA-N 1 0 328.368 3.633 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])cc1 ZINC000190587129 1140411173 /nfs/dbraw/zinc/41/11/73/1140411173.db2.gz UDWNOOLJDHZEFM-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000192184975 1140509146 /nfs/dbraw/zinc/50/91/46/1140509146.db2.gz HMXQZDDVVWSQDP-LBPRGKRZSA-N 1 0 333.413 3.577 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)OCCO3)CCC2 ZINC000192603349 1140539417 /nfs/dbraw/zinc/53/94/17/1140539417.db2.gz XHPAQZLIABUUGE-KRWDZBQOSA-N 1 0 340.379 3.533 20 5 EHBDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192883111 1140554138 /nfs/dbraw/zinc/55/41/38/1140554138.db2.gz QLRMHLYFSGBNGL-ZMZPIMSZSA-N 1 0 329.400 3.798 20 5 EHBDRO CCCNc1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000193152094 1140565135 /nfs/dbraw/zinc/56/51/35/1140565135.db2.gz UBTJFISJTHTFIB-UHFFFAOYSA-N 1 0 329.400 3.715 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CC2)CC1 ZINC000271131121 1141312394 /nfs/dbraw/zinc/31/23/94/1141312394.db2.gz LVWKBPFAOWCOTK-AWEZNQCLSA-N 1 0 349.500 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC4(C3)CCOCC4)o2)cc1 ZINC000271238030 1141331308 /nfs/dbraw/zinc/33/13/08/1141331308.db2.gz XLIXYMJGIQZHMX-UHFFFAOYSA-N 1 0 342.395 3.857 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000271515348 1141385732 /nfs/dbraw/zinc/38/57/32/1141385732.db2.gz OPZBABKBORKYRR-ZFWWWQNUSA-N 1 0 334.416 3.746 20 5 EHBDRO CCOCCC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000271529132 1141388966 /nfs/dbraw/zinc/38/89/66/1141388966.db2.gz QSDOVGUKFSSYQN-QGZVFWFLSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000271565770 1141398538 /nfs/dbraw/zinc/39/85/38/1141398538.db2.gz XQTXKYVTAMGYOC-HIFRSBDPSA-N 1 0 336.457 3.690 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccnc(OC)c2)cc1[N+](=O)[O-] ZINC000348677038 1141565450 /nfs/dbraw/zinc/56/54/50/1141565450.db2.gz DXPHLDMAWUZCQV-OLZOCXBDSA-N 1 0 345.399 3.809 20 5 EHBDRO CCN(Cc1csc([N+](=O)[O-])c1)Cc1ccc(C[NH+](C)C)cc1 ZINC000349015512 1141623214 /nfs/dbraw/zinc/62/32/14/1141623214.db2.gz YKSHCIGYQGLHKW-UHFFFAOYSA-N 1 0 333.457 3.740 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000349037210 1141626338 /nfs/dbraw/zinc/62/63/38/1141626338.db2.gz RBPZUPRDUISFJB-CQSZACIVSA-N 1 0 344.358 3.526 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)c1cc2ccc(Cl)nc2cc1[N+](=O)[O-] ZINC001165044651 721939065 /nfs/dbraw/zinc/93/90/65/721939065.db2.gz QJFZOYYDSLRPRT-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000510077040 1014724690 /nfs/dbraw/zinc/72/46/90/1014724690.db2.gz AHTPXUJEWZKSAK-AWEZNQCLSA-N 1 0 348.443 3.957 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876436 1014812851 /nfs/dbraw/zinc/81/28/51/1014812851.db2.gz SWPGCFRYHJZMBF-FUHWJXTLSA-N 1 0 331.460 3.634 20 5 EHBDRO COc1ccc(-c2ccc(C[N@@H+]3CCSC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000536684534 1032122826 /nfs/dbraw/zinc/12/28/26/1032122826.db2.gz JVVQCCIODJOGLL-GFCCVEGCSA-N 1 0 348.424 3.801 20 5 EHBDRO CC1=C[C@H](C)C[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282937 1015780898 /nfs/dbraw/zinc/78/08/98/1015780898.db2.gz GVQPOCQIIJDSIS-AAEUAGOBSA-N 1 0 328.372 3.604 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1CN1CCC[N@H+](CC2CCCCC2)CC1 ZINC001167116516 1016102032 /nfs/dbraw/zinc/10/20/32/1016102032.db2.gz QYNSDXARGSFRTK-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152023 1016487094 /nfs/dbraw/zinc/48/70/94/1016487094.db2.gz IXEATXZKRJCMPF-KDOFPFPSSA-N 1 0 341.411 3.971 20 5 EHBDRO CC1(C)C[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@H]1O ZINC000275435423 1016771998 /nfs/dbraw/zinc/77/19/98/1016771998.db2.gz JPPADSZWJPZAOK-GOSISDBHSA-N 1 0 337.419 3.539 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)c1 ZINC000538205857 1032202127 /nfs/dbraw/zinc/20/21/27/1032202127.db2.gz ZVXJKLXUCDMLSD-QGZVFWFLSA-N 1 0 348.834 3.966 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449132118 1032226057 /nfs/dbraw/zinc/22/60/57/1032226057.db2.gz SAGBKEDNWDWESN-UHFFFAOYSA-N 1 0 348.443 3.963 20 5 EHBDRO CC(C)[N@@H+](C)C[C@@H](C)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000461032275 1032230349 /nfs/dbraw/zinc/23/03/49/1032230349.db2.gz ZWCRIUDTDLUMMR-OAHLLOKOSA-N 1 0 335.451 3.847 20 5 EHBDRO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc([C@@H]([NH3+])CC(C)C)no1 ZINC000414626517 1017077374 /nfs/dbraw/zinc/07/73/74/1017077374.db2.gz YDWDRRHQFYDRDI-ZFWWWQNUSA-N 1 0 332.404 3.760 20 5 EHBDRO CC[N@H+](Cc1ccccc1C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000485143983 1032331771 /nfs/dbraw/zinc/33/17/71/1032331771.db2.gz JZTLDMVVWJAZMX-HNNXBMFYSA-N 1 0 341.411 3.752 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOc1ccc(F)c(F)c1 ZINC000536851050 1032348030 /nfs/dbraw/zinc/34/80/30/1032348030.db2.gz IAAWGXGOBMIJGB-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOC1CCCCC1)C1CC1 ZINC000536859885 1032359364 /nfs/dbraw/zinc/35/93/64/1032359364.db2.gz VEFHTIBILSURLJ-SFHVURJKSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000449278349 1032397801 /nfs/dbraw/zinc/39/78/01/1032397801.db2.gz IVJDHZWCXYZDNY-GUYCJALGSA-N 1 0 326.396 3.899 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000449350802 1032465405 /nfs/dbraw/zinc/46/54/05/1032465405.db2.gz WKMYQYYEKMNKGT-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)o2)c1 ZINC000459788936 1032475008 /nfs/dbraw/zinc/47/50/08/1032475008.db2.gz RARAWLITNKZWIK-UHOFOFEASA-N 1 0 327.384 3.571 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC1 ZINC000459807922 1032483379 /nfs/dbraw/zinc/48/33/79/1032483379.db2.gz RPQVSKZHRHIDIE-HNNXBMFYSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000449472426 1032592993 /nfs/dbraw/zinc/59/29/93/1032592993.db2.gz AEFMRSXFNQMXMU-HOTGVXAUSA-N 1 0 332.444 3.855 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000449478758 1032601467 /nfs/dbraw/zinc/60/14/67/1032601467.db2.gz KYZUVZMXIAMZGX-XBNGYDHASA-N 1 0 330.428 3.937 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn4ccccc4n3)C2)cc1 ZINC000449506666 1032688973 /nfs/dbraw/zinc/68/89/73/1032688973.db2.gz ZHOSJJLLWJDMSK-INIZCTEOSA-N 1 0 336.395 3.622 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3c[nH]c4ncccc34)CC2)c1 ZINC000118838191 1017643993 /nfs/dbraw/zinc/64/39/93/1017643993.db2.gz ZRTIPLXTWQWQSK-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO C[C@H]1CCN(c2ccc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000610284395 1017685038 /nfs/dbraw/zinc/68/50/38/1017685038.db2.gz YCRPVESVRYBZPC-AWEZNQCLSA-N 1 0 331.441 3.757 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010021 1018197040 /nfs/dbraw/zinc/19/70/40/1018197040.db2.gz BSXIIFICMOXOGP-RHSMWYFYSA-N 1 0 340.427 3.678 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NC(C)(C)CCC[NH3+])cc1[N+](=O)[O-] ZINC000415708168 1018419598 /nfs/dbraw/zinc/41/95/98/1018419598.db2.gz XDTFXEGSCFMHTD-UHFFFAOYSA-N 1 0 336.436 3.531 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000473513224 1019107157 /nfs/dbraw/zinc/10/71/57/1019107157.db2.gz LMTYGORRDUOODB-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO CC(C)[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000480432796 1032821621 /nfs/dbraw/zinc/82/16/21/1032821621.db2.gz NLLZEPNMTRXAJT-QGZVFWFLSA-N 1 0 328.416 3.675 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](C(C)C)[NH+]2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000513190151 1019392181 /nfs/dbraw/zinc/39/21/81/1019392181.db2.gz QLMHAIQSBBLXHD-LJQANCHMSA-N 1 0 347.459 3.966 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000182970085 1019859297 /nfs/dbraw/zinc/85/92/97/1019859297.db2.gz QJIXSGDGBJIGTC-JKSUJKDBSA-N 1 0 342.443 3.652 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855560 1020214188 /nfs/dbraw/zinc/21/41/88/1020214188.db2.gz DDLCOMAYZDYNNC-LLVKDONJSA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@@H]1CC[C@H]([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922880 1020242720 /nfs/dbraw/zinc/24/27/20/1020242720.db2.gz GDFGLRSNFKFCJM-CABCVRRESA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@@H]1CCCC12CC2 ZINC000706777223 1020243555 /nfs/dbraw/zinc/24/35/55/1020243555.db2.gz XVEHHGKEBQTTBX-CYBMUJFWSA-N 1 0 325.206 3.780 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]2COCC[C@H]21 ZINC000602485461 1032913037 /nfs/dbraw/zinc/91/30/37/1032913037.db2.gz QRDDEVWPNMBQBA-GXTWGEPZSA-N 1 0 344.333 3.615 20 5 EHBDRO CC1=C(C)C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000280723852 1020612162 /nfs/dbraw/zinc/61/21/62/1020612162.db2.gz KKRWUTYAQZGSCP-UHFFFAOYSA-N 1 0 327.384 3.834 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H](N2CCCC2=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000581380758 1020766478 /nfs/dbraw/zinc/76/64/78/1020766478.db2.gz DWRYRLGNDKMKOU-RYRKJORJSA-N 1 0 345.443 3.569 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCCOCC(F)(F)F)C1CC1 ZINC000135231747 1020919553 /nfs/dbraw/zinc/91/95/53/1020919553.db2.gz CYZSJTUEBAGYLP-UHFFFAOYSA-N 1 0 332.322 3.528 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C2CCN(C(=O)CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000178081866 1021150689 /nfs/dbraw/zinc/15/06/89/1021150689.db2.gz OTQPNTLSGRTZAZ-HNNXBMFYSA-N 1 0 347.459 3.591 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1CCCOC1 ZINC000507423254 1021254582 /nfs/dbraw/zinc/25/45/82/1021254582.db2.gz RFMIZDUFUACNFB-RBSFLKMASA-N 1 0 338.473 3.870 20 5 EHBDRO CN(CCCC[NH+](C)C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000607033368 1032968448 /nfs/dbraw/zinc/96/84/48/1032968448.db2.gz SCSMUOJMACYRDS-UHFFFAOYSA-N 1 0 335.451 3.802 20 5 EHBDRO COC1CCC(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602570494 1032981499 /nfs/dbraw/zinc/98/14/99/1032981499.db2.gz AKROHIJWZPCNLY-UHFFFAOYSA-N 1 0 346.349 3.908 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000439778846 1021703997 /nfs/dbraw/zinc/70/39/97/1021703997.db2.gz BEZYZEYXWCHLBG-GQCTYLIASA-N 1 0 338.407 3.717 20 5 EHBDRO COCCOc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909988 1021713982 /nfs/dbraw/zinc/71/39/82/1021713982.db2.gz IEYAESSKZUICAS-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]3OCC[C@H]32)c2cc([N+](=O)[O-])ccc21 ZINC000519861137 1021735729 /nfs/dbraw/zinc/73/57/29/1021735729.db2.gz IOHLRIHRTFBUPX-HNONPPJISA-N 1 0 330.428 3.864 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)c2c1 ZINC000610538848 1021807389 /nfs/dbraw/zinc/80/73/89/1021807389.db2.gz VTRLDRGXIWOTFT-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@](O)(C3CC3)C2)s1 ZINC000426524795 1021810649 /nfs/dbraw/zinc/81/06/49/1021810649.db2.gz PNBDIWNELVQKLY-GOSISDBHSA-N 1 0 344.436 3.670 20 5 EHBDRO CCCC[N@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000593705095 1033010297 /nfs/dbraw/zinc/01/02/97/1033010297.db2.gz LPTGQNQKRDPJOF-AWEZNQCLSA-N 1 0 333.354 3.520 20 5 EHBDRO O=C(CC[NH2+][C@@H](c1ccccc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000179107390 1033017445 /nfs/dbraw/zinc/01/74/45/1033017445.db2.gz JBFGVJWXMGDFGM-IBGZPJMESA-N 1 0 339.395 3.664 20 5 EHBDRO CC[C@](C)(COc1ncccc1Cl)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000441306994 1022140428 /nfs/dbraw/zinc/14/04/28/1022140428.db2.gz KUEPYYCATSKLJE-QGZVFWFLSA-N 1 0 349.818 3.981 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@H]1CCOC1 ZINC000449680395 1033032706 /nfs/dbraw/zinc/03/27/06/1033032706.db2.gz GLEFPZNWSAPRML-BQFCYCMXSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)C(C)(C)C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000574300446 1033033358 /nfs/dbraw/zinc/03/33/58/1033033358.db2.gz HXKYDGOMEXTYLT-MRXNPFEDSA-N 1 0 330.432 3.690 20 5 EHBDRO CC[C@@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000425957690 1022462315 /nfs/dbraw/zinc/46/23/15/1022462315.db2.gz JSSFQOSKHJZLAR-HNNXBMFYSA-N 1 0 328.416 3.622 20 5 EHBDRO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989791 1022591962 /nfs/dbraw/zinc/59/19/62/1022591962.db2.gz UPMAWLYMMKCBOQ-OCCSQVGLSA-N 1 0 332.425 3.526 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](C2CCCCC2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000058913216 1022678505 /nfs/dbraw/zinc/67/85/05/1022678505.db2.gz LYUBUUUUYGXGBI-SFHVURJKSA-N 1 0 333.432 3.720 20 5 EHBDRO CC(C)[C@@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498570 1022727768 /nfs/dbraw/zinc/72/77/68/1022727768.db2.gz YFWBLTLOKRLXGT-GXTWGEPZSA-N 1 0 330.388 3.684 20 5 EHBDRO CCN(CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CCC(F)(F)F ZINC000426049875 1022753270 /nfs/dbraw/zinc/75/32/70/1022753270.db2.gz KBEMTYHJCSKOIS-ZDUSSCGKSA-N 1 0 347.381 3.828 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000894737637 1022818002 /nfs/dbraw/zinc/81/80/02/1022818002.db2.gz AYOCSIRDIZWTCN-RDJZCZTQSA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@@H]1CCC[C@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517970410 1022901096 /nfs/dbraw/zinc/90/10/96/1022901096.db2.gz ZQOFOYICRFILSF-ACJLOTCBSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H]1CCC[C@@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517970411 1022901870 /nfs/dbraw/zinc/90/18/70/1022901870.db2.gz ZQOFOYICRFILSF-FZKQIMNGSA-N 1 0 346.452 3.964 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000506420900 1023102225 /nfs/dbraw/zinc/10/22/25/1023102225.db2.gz HKMSYBIOGUFCIA-OAHLLOKOSA-N 1 0 343.427 3.771 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)(C)c2cccc(C)c2)cc1[N+](=O)[O-] ZINC000518280445 1023190964 /nfs/dbraw/zinc/19/09/64/1023190964.db2.gz OQWKRDMIELQOQU-UHFFFAOYSA-N 1 0 328.412 3.979 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@@H]21 ZINC000248417902 1023260484 /nfs/dbraw/zinc/26/04/84/1023260484.db2.gz JXUAFBHIIUQWAD-DAXOMENPSA-N 1 0 342.399 3.655 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(OC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC000276942789 1023432902 /nfs/dbraw/zinc/43/29/02/1023432902.db2.gz SMMJYHLBWIWJOD-UHFFFAOYSA-N 1 0 336.432 3.773 20 5 EHBDRO CCOC(=O)C1CCC([NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000602752913 1033145863 /nfs/dbraw/zinc/14/58/63/1033145863.db2.gz WQZLQCNYEBEUCX-SDNWHVSQSA-N 1 0 346.427 3.710 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+][C@H]1CCCC2(CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000897773693 1033161031 /nfs/dbraw/zinc/16/10/31/1033161031.db2.gz LKMJKFXDHKUQCB-RDJZCZTQSA-N 1 0 340.427 3.730 20 5 EHBDRO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449755673 1033172667 /nfs/dbraw/zinc/17/26/67/1033172667.db2.gz NXXYPTLGLUDKTF-SJLPKXTDSA-N 1 0 330.384 3.902 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOC(F)(F)F)s2)cc1 ZINC000473992132 1023964921 /nfs/dbraw/zinc/96/49/21/1023964921.db2.gz OHFXPAGHRXJCOD-UHFFFAOYSA-N 1 0 346.330 3.949 20 5 EHBDRO COc1c(O)ccc(CNc2[nH+]ccc(C)c2C2CC2)c1[N+](=O)[O-] ZINC000895347338 1024335979 /nfs/dbraw/zinc/33/59/79/1024335979.db2.gz GQDYWUHDGYLJPK-UHFFFAOYSA-N 1 0 329.356 3.502 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000538423815 1024346334 /nfs/dbraw/zinc/34/63/34/1024346334.db2.gz RBTYAUZQDUPLJL-HWKANZROSA-N 1 0 338.363 3.616 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)CF)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000342201837 1024386726 /nfs/dbraw/zinc/38/67/26/1024386726.db2.gz MESBVBAXKBVTQF-ZDUSSCGKSA-N 1 0 348.374 3.630 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1cccnc1)C1CCC1 ZINC000280925986 1024442400 /nfs/dbraw/zinc/44/24/00/1024442400.db2.gz RLMAJQCLRBNKRA-GOSISDBHSA-N 1 0 327.384 3.629 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2ccccc2C1 ZINC000520748293 1024608568 /nfs/dbraw/zinc/60/85/68/1024608568.db2.gz KBAWLNSBGNDMRQ-ZDUSSCGKSA-N 1 0 329.375 3.593 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000346404118 1024722731 /nfs/dbraw/zinc/72/27/31/1024722731.db2.gz PYLOXXMDCYNEQN-CYBMUJFWSA-N 1 0 338.795 3.731 20 5 EHBDRO CCC[C@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001167958632 1024772508 /nfs/dbraw/zinc/77/25/08/1024772508.db2.gz KQMBHQGZCRUYLR-LBPRGKRZSA-N 1 0 339.823 3.699 20 5 EHBDRO COc1cc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000508000984 1024817013 /nfs/dbraw/zinc/81/70/13/1024817013.db2.gz UQNQRZHHCSUBAL-VURMDHGXSA-N 1 0 342.395 3.757 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC000897969858 1033242135 /nfs/dbraw/zinc/24/21/35/1033242135.db2.gz BZSQYMLTFQOCTE-AUWJEWJLSA-N 1 0 330.428 3.935 20 5 EHBDRO C[C@H]1C[C@@H]([NH3+])CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946165 1024904916 /nfs/dbraw/zinc/90/49/16/1024904916.db2.gz BYSGAORBLGWFDM-RYUDHWBXSA-N 1 0 349.818 3.820 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000427971125 1024915264 /nfs/dbraw/zinc/91/52/64/1024915264.db2.gz JFXQUDOXNUMOFH-USXIJHARSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000514972467 1024934802 /nfs/dbraw/zinc/93/48/02/1024934802.db2.gz PALGOMDJGIQVFT-NSHDSACASA-N 1 0 339.823 3.745 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000119705360 1024938538 /nfs/dbraw/zinc/93/85/38/1024938538.db2.gz RTPPCFAGOVZGKC-ZDUSSCGKSA-N 1 0 328.368 3.607 20 5 EHBDRO Cc1ccc([C@@H](C)C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000515054412 1024988557 /nfs/dbraw/zinc/98/85/57/1024988557.db2.gz GUVFTAJFGNUTAK-HNNXBMFYSA-N 1 0 341.411 3.625 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CCc4cccc5cccc3c54)C2)c1 ZINC000895935109 1024991204 /nfs/dbraw/zinc/99/12/04/1024991204.db2.gz OICTXRJLNAXUMB-LADRWXRNSA-N 1 0 348.406 3.925 20 5 EHBDRO COc1cc(NC[C@H]2CCC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435585073 1025019032 /nfs/dbraw/zinc/01/90/32/1025019032.db2.gz RUDJUSZQOQCMOI-MRXNPFEDSA-N 1 0 333.432 3.812 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2C[C@H]3CCC[C@@H]32)cc1Br ZINC000897958707 1033258766 /nfs/dbraw/zinc/25/87/66/1033258766.db2.gz MHSGWLQUHKNQQL-POZPLHJXSA-N 1 0 331.235 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(CNC[C@@H]2CCC[N@@H+]2C2CCCCC2)c(F)c1 ZINC000435746950 1025122201 /nfs/dbraw/zinc/12/22/01/1025122201.db2.gz CDXJZUPXBCSLFB-KRWDZBQOSA-N 1 0 335.423 3.621 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000346804356 1025124935 /nfs/dbraw/zinc/12/49/35/1025124935.db2.gz XOVYJEWDURJWPL-GOSISDBHSA-N 1 0 342.395 3.779 20 5 EHBDRO CC(C)COc1ccc(CC[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000520974199 1025141058 /nfs/dbraw/zinc/14/10/58/1025141058.db2.gz USDRCZUVFVHOOA-UHFFFAOYSA-N 1 0 328.412 3.962 20 5 EHBDRO COc1ccc(CCC[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072014222 1025147130 /nfs/dbraw/zinc/14/71/30/1025147130.db2.gz QJSNPXRVPFHJKM-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1coc(-c2cccs2)n1 ZINC000511073425 1025271972 /nfs/dbraw/zinc/27/19/72/1025271972.db2.gz PQQOJFIMBLVNCE-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO CCCC1(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000151539646 1025302544 /nfs/dbraw/zinc/30/25/44/1025302544.db2.gz UPCZOETVQOAADU-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]C2CCC3(CCCO3)CC2)cc1 ZINC000515538888 1025332529 /nfs/dbraw/zinc/33/25/29/1025332529.db2.gz HEZAWGVGIOFMNQ-UHFFFAOYSA-N 1 0 332.444 3.999 20 5 EHBDRO COc1cc(C[NH+]2CCC(Cc3nccs3)CC2)ccc1[N+](=O)[O-] ZINC000602956481 1033279151 /nfs/dbraw/zinc/27/91/51/1033279151.db2.gz RJPFAEJHHLQJNG-UHFFFAOYSA-N 1 0 347.440 3.515 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(CC[NH+](C)C)C1CCCC1 ZINC000119952162 1025484322 /nfs/dbraw/zinc/48/43/22/1025484322.db2.gz YFBYIIZSWFSXOZ-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)NCCC1=CCCCC1 ZINC000451105721 1025539223 /nfs/dbraw/zinc/53/92/23/1025539223.db2.gz MYBUSXLGTKIJHU-LSDHHAIUSA-N 1 0 345.443 3.641 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000896561979 1025607485 /nfs/dbraw/zinc/60/74/85/1025607485.db2.gz RNGCUAXERROESQ-UHFFFAOYSA-N 1 0 334.803 3.647 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)N(C)C ZINC000443004427 1025654868 /nfs/dbraw/zinc/65/48/68/1025654868.db2.gz DCUCOYVGOFRNTM-OXJNMPFZSA-N 1 0 341.455 3.993 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1)N(C)C ZINC000443008632 1025659347 /nfs/dbraw/zinc/65/93/47/1025659347.db2.gz GZNMZXXGYBGRAL-HNAYVOBHSA-N 1 0 327.428 3.684 20 5 EHBDRO CCN(CC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1C ZINC000521818461 1025706626 /nfs/dbraw/zinc/70/66/26/1025706626.db2.gz QNDXLUMDNMKSLG-UHFFFAOYSA-N 1 0 343.427 3.528 20 5 EHBDRO COc1cc2c(NCc3cccc([N+](=O)[O-])c3)cc[nH+]c2cc1F ZINC000530422608 1025795084 /nfs/dbraw/zinc/79/50/84/1025795084.db2.gz WHCDZHQUBQYPFB-UHFFFAOYSA-N 1 0 327.315 3.903 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCSCC1 ZINC000474921306 1025858728 /nfs/dbraw/zinc/85/87/28/1025858728.db2.gz BUYUOXQCFANIFD-NSHDSACASA-N 1 0 328.865 3.912 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCn2ccnc2)cc1C(F)(F)F ZINC000321446974 1025874362 /nfs/dbraw/zinc/87/43/62/1025874362.db2.gz NKZFADAGCVAREN-UHFFFAOYSA-N 1 0 328.294 3.702 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(N2CCCC2)n1 ZINC000611590956 1025990116 /nfs/dbraw/zinc/99/01/16/1025990116.db2.gz FLROOJWYZTWJNB-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO Cc1noc(C)c1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451549168 1026101515 /nfs/dbraw/zinc/10/15/15/1026101515.db2.gz PBXUIDSHUPSOQH-INIZCTEOSA-N 1 0 329.400 3.622 20 5 EHBDRO CC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475114618 1026211314 /nfs/dbraw/zinc/21/13/14/1026211314.db2.gz AHHGJOGXMCHIHL-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(OC(C)(C)C)n1 ZINC000511123542 1026245939 /nfs/dbraw/zinc/24/59/39/1026245939.db2.gz KLEDJUKUNPUJHK-UHFFFAOYSA-N 1 0 343.427 3.842 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000475158396 1026263387 /nfs/dbraw/zinc/26/33/87/1026263387.db2.gz MCLGCDHZXWWRAG-HZPDHXFCSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2CCN(c3ccccc3)CC2)c(F)c1 ZINC000475271517 1026433041 /nfs/dbraw/zinc/43/30/41/1026433041.db2.gz VUNZTKORPGWMOX-UHFFFAOYSA-N 1 0 343.402 3.740 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1ncc(-c2ccccc2)o1 ZINC000511141355 1026448041 /nfs/dbraw/zinc/44/80/41/1026448041.db2.gz VYHWSQMTKDEVSB-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[NH2+]C1CCCCC1 ZINC000127788739 1026474196 /nfs/dbraw/zinc/47/41/96/1026474196.db2.gz BLBDHYPTONPOFC-UHFFFAOYSA-N 1 0 348.447 3.646 20 5 EHBDRO COC[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000121277626 1026589198 /nfs/dbraw/zinc/58/91/98/1026589198.db2.gz DKXHDGZHCJJBGR-OAHLLOKOSA-N 1 0 332.425 3.838 20 5 EHBDRO CCC(=O)c1ccc(N[C@@H]2CC[N@@H+](C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000479970958 1026919780 /nfs/dbraw/zinc/91/97/80/1026919780.db2.gz QMSXLSUAIUKGOO-CQSZACIVSA-N 1 0 331.416 3.616 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000128076044 1026928031 /nfs/dbraw/zinc/92/80/31/1026928031.db2.gz QASLUSYRPBQQHS-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CC(C)C[N@@H+]1CCCC[C@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000342784006 1027032003 /nfs/dbraw/zinc/03/20/03/1027032003.db2.gz REOUDPZQZNTFTO-LBPRGKRZSA-N 1 0 349.460 3.522 20 5 EHBDRO COC[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000121334243 1027054237 /nfs/dbraw/zinc/05/42/37/1027054237.db2.gz SMCHDEBTNCFVJI-MRXNPFEDSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)CC[C@@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000237569181 1027219126 /nfs/dbraw/zinc/21/91/26/1027219126.db2.gz HTGICRXFOQBYEK-RHSMWYFYSA-N 1 0 341.411 3.561 20 5 EHBDRO Cc1csc(C2([NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CCC2)n1 ZINC000453173618 1027493774 /nfs/dbraw/zinc/49/37/74/1027493774.db2.gz KVCOSQPUOCCVFA-GFCCVEGCSA-N 1 0 331.441 3.960 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@@H](c2cccc(F)c2)[C@H]([NH3+])C1 ZINC000420381472 1027500581 /nfs/dbraw/zinc/50/05/81/1027500581.db2.gz CVBBMYXUNSXZKC-FASAQXTFSA-N 1 0 343.402 3.530 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCCOC(C)C)o2)c([N+](=O)[O-])c1 ZINC000237287732 1027515705 /nfs/dbraw/zinc/51/57/05/1027515705.db2.gz GLOXUAYHGHWHCL-UHFFFAOYSA-N 1 0 348.399 3.768 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440412986 1027707488 /nfs/dbraw/zinc/70/74/88/1027707488.db2.gz WHUDDNRHIAQXHT-KRWDZBQOSA-N 1 0 327.384 3.616 20 5 EHBDRO CC(C)[NH+](CCN(C)c1ccc([N+](=O)[O-])c2cccnc21)C(C)C ZINC000503303755 1027717226 /nfs/dbraw/zinc/71/72/26/1027717226.db2.gz RTQHWQSOORIFCZ-UHFFFAOYSA-N 1 0 330.432 3.698 20 5 EHBDRO Cc1cnc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC000078632478 1028038505 /nfs/dbraw/zinc/03/85/05/1028038505.db2.gz CLNJZFOQSDUMJC-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO Cc1c(NC(=O)N[C@H](CCC[NH3+])c2ccccc2)cccc1[N+](=O)[O-] ZINC000414703630 1028052661 /nfs/dbraw/zinc/05/26/61/1028052661.db2.gz MJNRSTHMWARMRQ-MRXNPFEDSA-N 1 0 342.399 3.505 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC2(O)CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612409833 1028090420 /nfs/dbraw/zinc/09/04/20/1028090420.db2.gz UAIQJCBQCUIPIV-SFHVURJKSA-N 1 0 344.411 3.734 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(COc3ccccc3)CC2)c1 ZINC000065612492 1028111440 /nfs/dbraw/zinc/11/14/40/1028111440.db2.gz SDEOXHHCOFGSIO-UHFFFAOYSA-N 1 0 326.396 3.886 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178702039 1028121752 /nfs/dbraw/zinc/12/17/52/1028121752.db2.gz JZHKCVMIRSYDRO-RDTXWAMCSA-N 1 0 330.432 3.867 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680972 1028150691 /nfs/dbraw/zinc/15/06/91/1028150691.db2.gz XWJDRIGGGIGOOL-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CON=C(N)C1CCCCC1 ZINC000729674932 1028350767 /nfs/dbraw/zinc/35/07/67/1028350767.db2.gz WEEVLKLRFIXYIY-UHFFFAOYSA-N 1 0 335.404 3.961 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000421388722 1028361963 /nfs/dbraw/zinc/36/19/63/1028361963.db2.gz QIYPNNHPEJKNDD-ZBFHGGJFSA-N 1 0 330.384 3.902 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000523701364 1028553463 /nfs/dbraw/zinc/55/34/63/1028553463.db2.gz HTEVDUCHWQXBMV-LJQANCHMSA-N 1 0 340.423 3.853 20 5 EHBDRO C[NH+](C)Cc1c2ccccc2oc1C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000074040800 1028594602 /nfs/dbraw/zinc/59/46/02/1028594602.db2.gz WMAOYQSITCIFSY-UHFFFAOYSA-N 1 0 339.351 3.655 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+]C(C)(C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000508671057 1028609382 /nfs/dbraw/zinc/60/93/82/1028609382.db2.gz OOVJAFWGWOZFJT-UHFFFAOYSA-N 1 0 341.411 3.757 20 5 EHBDRO C[C@H]([NH2+]C1(C2CCC2)CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593080360 1028937781 /nfs/dbraw/zinc/93/77/81/1028937781.db2.gz MDXBMDBQZOBMAH-NSHDSACASA-N 1 0 328.372 3.628 20 5 EHBDRO CO[C@H]1C[C@H]2C[C@@H]([NH2+]CCc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]2C1 ZINC000424281331 1028952736 /nfs/dbraw/zinc/95/27/36/1028952736.db2.gz NCJUHMYKVRRDBY-SDSIWUNFSA-N 1 0 338.835 3.584 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccccc2OC)cc1[N+](=O)[O-] ZINC000504899963 1029028099 /nfs/dbraw/zinc/02/80/99/1029028099.db2.gz OWNLXKKTWGOCLR-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000504899566 1029041988 /nfs/dbraw/zinc/04/19/88/1029041988.db2.gz IUIDJWKEFYQLIH-CZUORRHYSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739813 1029047811 /nfs/dbraw/zinc/04/78/11/1029047811.db2.gz JHNRTGOLNAWXPN-NWDGAFQWSA-N 1 0 336.823 3.606 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000504906028 1029051056 /nfs/dbraw/zinc/05/10/56/1029051056.db2.gz RQQSDTYTUNCIDO-CRAIPNDOSA-N 1 0 349.475 3.765 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1(C[NH3+])CCC1 ZINC000414789313 1029077938 /nfs/dbraw/zinc/07/79/38/1029077938.db2.gz NYXNMCWHYBRVLD-UHFFFAOYSA-N 1 0 349.818 3.821 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532966848 1029111961 /nfs/dbraw/zinc/11/19/61/1029111961.db2.gz XCABTIZWRCEVMX-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1OC ZINC000524425121 1029158898 /nfs/dbraw/zinc/15/88/98/1029158898.db2.gz HAECNZWBKQJYLP-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513823527 1029524085 /nfs/dbraw/zinc/52/40/85/1029524085.db2.gz VZMSUWKWWHHDTI-CWLKWCNXSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@H](C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262048 1029542247 /nfs/dbraw/zinc/54/22/47/1029542247.db2.gz WTPZFAQEKCRRIG-CABCVRRESA-N 1 0 341.411 3.657 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000524822167 1029546266 /nfs/dbraw/zinc/54/62/66/1029546266.db2.gz JECAUHSBVJNRJE-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCCCNc2ccccn2)cccc1[N+](=O)[O-] ZINC000162874424 1029645010 /nfs/dbraw/zinc/64/50/10/1029645010.db2.gz SJQSCOSQCZLKCE-OAHLLOKOSA-N 1 0 328.416 3.841 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000162952995 1029736956 /nfs/dbraw/zinc/73/69/56/1029736956.db2.gz PKXXTRZGILAMGH-FBDRMZKKSA-N 1 0 338.473 3.715 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000453288109 1030030195 /nfs/dbraw/zinc/03/01/95/1030030195.db2.gz JVLMHPCXGWAEIC-WBVHZDCISA-N 1 0 328.412 3.812 20 5 EHBDRO C[C@H](CCCCO)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453288602 1030031472 /nfs/dbraw/zinc/03/14/72/1030031472.db2.gz POEICHMGSDUQRY-BEFAXECRSA-N 1 0 328.412 3.825 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000531944477 1030064830 /nfs/dbraw/zinc/06/48/30/1030064830.db2.gz SHBGRMNTOMCRLV-MRXNPFEDSA-N 1 0 328.368 3.607 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000453330948 1030068466 /nfs/dbraw/zinc/06/84/66/1030068466.db2.gz BSSLTFDLXSTDGA-FNHZYXHNSA-N 1 0 341.411 3.869 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000572975212 1030098778 /nfs/dbraw/zinc/09/87/78/1030098778.db2.gz OPNVPFILTZFTEL-QSFXBCCZSA-N 1 0 338.407 3.950 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Cl)c1 ZINC000447304301 1030102208 /nfs/dbraw/zinc/10/22/08/1030102208.db2.gz IJMARUCNNRCIBM-CQSZACIVSA-N 1 0 346.818 3.638 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000531993682 1030242619 /nfs/dbraw/zinc/24/26/19/1030242619.db2.gz VTISKKHYAUCHDG-NVXWUHKLSA-N 1 0 328.412 3.812 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447527167 1030251273 /nfs/dbraw/zinc/25/12/73/1030251273.db2.gz FLKSNHDFEDFNOS-IAGOWNOFSA-N 1 0 342.443 3.842 20 5 EHBDRO CSc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447533903 1030269441 /nfs/dbraw/zinc/26/94/41/1030269441.db2.gz ZFSYFYUYFVQDQE-CVEARBPZSA-N 1 0 346.456 3.787 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000447535829 1030271441 /nfs/dbraw/zinc/27/14/41/1030271441.db2.gz IRTNWQOHTKQGDF-HZPDHXFCSA-N 1 0 332.379 3.512 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1ccc(F)cc1F)CCC2 ZINC000447572288 1030291292 /nfs/dbraw/zinc/29/12/92/1030291292.db2.gz BGFVNWAVETWYJH-QGZVFWFLSA-N 1 0 348.349 3.919 20 5 EHBDRO CC(C)(CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000447595108 1030333779 /nfs/dbraw/zinc/33/37/79/1030333779.db2.gz LDEUCPOENGMPPT-SFHVURJKSA-N 1 0 331.460 3.684 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[C@@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631585 1030433705 /nfs/dbraw/zinc/43/37/05/1030433705.db2.gz OAMWBRBKAKUCFQ-TZMCWYRMSA-N 1 0 346.383 3.521 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000160082745 1030525091 /nfs/dbraw/zinc/52/50/91/1030525091.db2.gz ISJMEQPLZLDLHT-GOSISDBHSA-N 1 0 327.384 3.514 20 5 EHBDRO OCC1(C[NH2+]Cc2c3ccccc3cc3ccccc32)CCOCC1 ZINC000130003270 1030613626 /nfs/dbraw/zinc/61/36/26/1030613626.db2.gz DDBHWYQYGUEUPZ-UHFFFAOYSA-N 1 0 335.447 3.872 20 5 EHBDRO C/C(=C\c1nc(-c2ccn3c[nH+]cc3c2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000447959187 1030630679 /nfs/dbraw/zinc/63/06/79/1030630679.db2.gz NDFOXMNUTRZDTF-XYOKQWHBSA-N 1 0 347.334 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]2C[NH+]2CCCCC2)c2ccncc21 ZINC000160451995 1030764492 /nfs/dbraw/zinc/76/44/92/1030764492.db2.gz IRGJWUJJYWZSKF-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1cc([C@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000550938176 1030807121 /nfs/dbraw/zinc/80/71/21/1030807121.db2.gz RFIZDCPQWWCRBU-AWEZNQCLSA-N 1 0 329.400 3.672 20 5 EHBDRO C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361712 1030984260 /nfs/dbraw/zinc/98/42/60/1030984260.db2.gz YCOTULQTZAPZBW-GOEBONIOSA-N 1 0 344.411 3.980 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCOC2)ccc1Oc1ccccc1Cl ZINC000178996007 1031060005 /nfs/dbraw/zinc/06/00/05/1031060005.db2.gz GRXPWEWJFOTMSU-CYBMUJFWSA-N 1 0 348.786 3.919 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccccc1 ZINC000161105648 1031319660 /nfs/dbraw/zinc/31/96/60/1031319660.db2.gz MLFJRRVOBBDSCU-CRAIPNDOSA-N 1 0 328.412 3.629 20 5 EHBDRO CCC(CC)C[N@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000782477190 1031746950 /nfs/dbraw/zinc/74/69/50/1031746950.db2.gz JADHXMHMHOZHMT-UHFFFAOYSA-N 1 0 339.411 3.821 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@]12C[C@H]1COC21CCC1 ZINC000898064739 1033309842 /nfs/dbraw/zinc/30/98/42/1033309842.db2.gz KXFWPRVVIXUJPZ-ZAWBGVFASA-N 1 0 328.412 3.547 20 5 EHBDRO Cc1nn(-c2ccccc2)cc1C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505736 1033406369 /nfs/dbraw/zinc/40/63/69/1033406369.db2.gz XOEKJJIXBYQPJN-IBGZPJMESA-N 1 0 348.406 3.866 20 5 EHBDRO Cc1cc(N2CC[C@@H](Cc3ccncc3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611931177 1033415508 /nfs/dbraw/zinc/41/55/08/1033415508.db2.gz YZHRDXYEVUDXCM-INIZCTEOSA-N 1 0 348.406 3.915 20 5 EHBDRO COc1cc(C[NH2+]C(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061002579 1033415796 /nfs/dbraw/zinc/41/57/96/1033415796.db2.gz QOQHWOCQWOXRLK-UHFFFAOYSA-N 1 0 330.384 3.680 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293224 1033575204 /nfs/dbraw/zinc/57/52/04/1033575204.db2.gz TUIYLQZGPKCQBV-ZFWWWQNUSA-N 1 0 348.472 3.816 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000594936930 1033586282 /nfs/dbraw/zinc/58/62/82/1033586282.db2.gz YCSNGXBBSBXQGJ-RHSMWYFYSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[C@H]1CCCC[C@H]1O ZINC000595022310 1033614438 /nfs/dbraw/zinc/61/44/38/1033614438.db2.gz LAISMINQSWSRHQ-JJRVBVJISA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595022753 1033614732 /nfs/dbraw/zinc/61/47/32/1033614732.db2.gz VHVQLVXHSXLFLA-SJKOYZFVSA-N 1 0 342.395 3.950 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CO[C@H](C3CC3)C2)s1 ZINC000599008209 1033643096 /nfs/dbraw/zinc/64/30/96/1033643096.db2.gz WIQOVMLSOOGUDG-GUYCJALGSA-N 1 0 344.436 3.980 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000595029141 1033650846 /nfs/dbraw/zinc/65/08/46/1033650846.db2.gz HSTKJNZWZGSJOZ-PWUKJLEFSA-N 1 0 346.427 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000595039541 1033658817 /nfs/dbraw/zinc/65/88/17/1033658817.db2.gz QBDIEIWMOKOOHK-XGUBFFRZSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](Cc1ccccc1)OC ZINC000595043247 1033662105 /nfs/dbraw/zinc/66/21/05/1033662105.db2.gz VNZOECWUPMQWSG-WMLDXEAASA-N 1 0 344.411 3.512 20 5 EHBDRO CO[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000599016359 1033665588 /nfs/dbraw/zinc/66/55/88/1033665588.db2.gz RIPGZXSIBXZQPE-MJHDQNEOSA-N 1 0 336.775 3.775 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595104920 1033692100 /nfs/dbraw/zinc/69/21/00/1033692100.db2.gz AETSHWYITOEDCG-VOBQZIQPSA-N 1 0 340.423 3.726 20 5 EHBDRO CC[C@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000595097047 1033702982 /nfs/dbraw/zinc/70/29/82/1033702982.db2.gz GUJLBNQDKIHEND-KRWDZBQOSA-N 1 0 328.416 3.837 20 5 EHBDRO Cc1cc(N2CCN(c3ccccc3[N+](=O)[O-])CC2)c2ccccc2[nH+]1 ZINC000592954352 1033710804 /nfs/dbraw/zinc/71/08/04/1033710804.db2.gz ZFMZFYSUALBEHM-UHFFFAOYSA-N 1 0 348.406 3.778 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CCCC[N@@H+]2C2CC2)ccc2cnccc21 ZINC000599072321 1033714654 /nfs/dbraw/zinc/71/46/54/1033714654.db2.gz BVQCUCOPMPAYTG-OAHLLOKOSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1cccc(C[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000089512135 1033763321 /nfs/dbraw/zinc/76/33/21/1033763321.db2.gz AGSTXSVJHYLUHL-SFHVURJKSA-N 1 0 326.396 3.714 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cnc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000593021354 1033835962 /nfs/dbraw/zinc/83/59/62/1033835962.db2.gz WETAQDICAWGBEZ-JTQLQIEISA-N 1 0 340.305 3.563 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603868410 1033994028 /nfs/dbraw/zinc/99/40/28/1033994028.db2.gz LOSRLTIUPDCWJX-SFHVURJKSA-N 1 0 326.396 3.811 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690698 1034096297 /nfs/dbraw/zinc/09/62/97/1034096297.db2.gz PGUAFRYWOSCHOY-BAABZTOOSA-N 1 0 342.399 3.823 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cn1 ZINC000599695605 1034100594 /nfs/dbraw/zinc/10/05/94/1034100594.db2.gz DOQLEMXNDCORFJ-QGZVFWFLSA-N 1 0 347.802 3.893 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000596168107 1034116602 /nfs/dbraw/zinc/11/66/02/1034116602.db2.gz KREUFOZHKROQKL-RISCZKNCSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000163320426 1034145978 /nfs/dbraw/zinc/14/59/78/1034145978.db2.gz NMYKLKNGIFNWKS-UHFFFAOYSA-N 1 0 337.851 3.556 20 5 EHBDRO C[NH+](C)CCCC(C)(C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000456165840 1034157087 /nfs/dbraw/zinc/15/70/87/1034157087.db2.gz FAYHICWESSZOQT-UHFFFAOYSA-N 1 0 349.456 3.660 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2CC[NH+](Cc3ccncc3)CC2)c1 ZINC000596443513 1034247258 /nfs/dbraw/zinc/24/72/58/1034247258.db2.gz YVDRIOUYEYXECV-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO CC1(C)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccncc1 ZINC000596590226 1034307889 /nfs/dbraw/zinc/30/78/89/1034307889.db2.gz DPJUAROYPPDUPF-GOSISDBHSA-N 1 0 341.411 3.842 20 5 EHBDRO CC[C@@H]([NH2+]CCOCc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000179463333 1034327322 /nfs/dbraw/zinc/32/73/22/1034327322.db2.gz JDJJMEAUQRCZJL-LJQANCHMSA-N 1 0 344.411 3.861 20 5 EHBDRO CCc1ccc([C@@H](NCC2([NH3+])CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596648175 1034345845 /nfs/dbraw/zinc/34/58/45/1034345845.db2.gz KNBWIUFYPKTEQF-SFHVURJKSA-N 1 0 343.427 3.701 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](c2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000892467034 1034431795 /nfs/dbraw/zinc/43/17/95/1034431795.db2.gz DOFRPYVXOYNEAX-MRXNPFEDSA-N 1 0 348.374 3.935 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000310510720 1034531606 /nfs/dbraw/zinc/53/16/06/1034531606.db2.gz DHYUNJJBSDRJNN-GJZGRUSLSA-N 1 0 349.431 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000364082274 1034536780 /nfs/dbraw/zinc/53/67/80/1034536780.db2.gz FJABFKWGMOSRIJ-WDEREUQCSA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C(F)(F)F)c1 ZINC000364082273 1034537298 /nfs/dbraw/zinc/53/72/98/1034537298.db2.gz FJABFKWGMOSRIJ-QWRGUYRKSA-N 1 0 329.322 3.652 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007155 1035025918 /nfs/dbraw/zinc/02/59/18/1035025918.db2.gz SQDBNSHQAHRVLN-KRWDZBQOSA-N 1 0 341.411 3.768 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCCn2ccnc2)c2ccccc2)c1 ZINC000179963807 1035095398 /nfs/dbraw/zinc/09/53/98/1035095398.db2.gz BWPUXWHXTTXJFX-LJQANCHMSA-N 1 0 336.395 3.561 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000570409533 1035243363 /nfs/dbraw/zinc/24/33/63/1035243363.db2.gz BMNBIHGORCKPCH-KRWDZBQOSA-N 1 0 339.395 3.720 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000414084782 1035465584 /nfs/dbraw/zinc/46/55/84/1035465584.db2.gz XTJPXWGULLFYGL-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c1 ZINC000534706573 1035503389 /nfs/dbraw/zinc/50/33/89/1035503389.db2.gz QVAMQLBUJOUIMA-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)N[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581612115 1035530556 /nfs/dbraw/zinc/53/05/56/1035530556.db2.gz CPOFWSYTJAVJBV-BXUZGUMPSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1ccsc1N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000588072497 1035699883 /nfs/dbraw/zinc/69/98/83/1035699883.db2.gz RGCMIFZMAOVAAN-SFHVURJKSA-N 1 0 343.452 3.759 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000492374093 1035703057 /nfs/dbraw/zinc/70/30/57/1035703057.db2.gz GKLVQWFTZVMMJI-GUYCJALGSA-N 1 0 349.862 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000173979854 1035823452 /nfs/dbraw/zinc/82/34/52/1035823452.db2.gz DUPVWJQMFCRYBR-IBGZPJMESA-N 1 0 340.423 3.676 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1(C2CCC2)CCC1 ZINC000414174446 1035891908 /nfs/dbraw/zinc/89/19/08/1035891908.db2.gz HLIBKPHLSMNLKI-ZDUSSCGKSA-N 1 0 331.416 3.624 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460344886 1035925935 /nfs/dbraw/zinc/92/59/35/1035925935.db2.gz CSKNBSXEHHOWJM-RBSFLKMASA-N 1 0 333.432 3.870 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000463956439 1035999115 /nfs/dbraw/zinc/99/91/15/1035999115.db2.gz ZWAJWHWSQANDCI-HUUCEWRRSA-N 1 0 348.447 3.596 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201703 1036139645 /nfs/dbraw/zinc/13/96/45/1036139645.db2.gz NWINZMQIQHUXKZ-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO CCC[C@@]1(CO)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000589210516 1036312982 /nfs/dbraw/zinc/31/29/82/1036312982.db2.gz NKEJLVKCYGJOBZ-LJQANCHMSA-N 1 0 344.411 3.839 20 5 EHBDRO CCOc1cc(C[N@H+](C)CC2(O)CCCCCC2)ccc1[N+](=O)[O-] ZINC000492819560 1036320915 /nfs/dbraw/zinc/32/09/15/1036320915.db2.gz SOYUMLVQBRQPDC-UHFFFAOYSA-N 1 0 336.432 3.511 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(C)(C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000589287051 1036341618 /nfs/dbraw/zinc/34/16/18/1036341618.db2.gz DJCHXDDZBHZQTC-AWEZNQCLSA-N 1 0 345.443 3.742 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@]2(C)OCCc3sccc32)cc1[N+](=O)[O-] ZINC000589325776 1036343721 /nfs/dbraw/zinc/34/37/21/1036343721.db2.gz YBDBHLMVHGTSSF-KRWDZBQOSA-N 1 0 332.425 3.542 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000026227442 1036399727 /nfs/dbraw/zinc/39/97/27/1036399727.db2.gz DZDUWKCDOAMESU-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541548176 1036425712 /nfs/dbraw/zinc/42/57/12/1036425712.db2.gz FJPOYKCDDPOOFI-HNNXBMFYSA-N 1 0 334.803 3.596 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000589939345 1036687161 /nfs/dbraw/zinc/68/71/61/1036687161.db2.gz PXTOYDVVNBCMFK-OVGLELJOSA-N 1 0 344.436 3.962 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414339777 1036763839 /nfs/dbraw/zinc/76/38/39/1036763839.db2.gz GBYWZGINMBZHKU-BBRMVZONSA-N 1 0 329.375 3.663 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000180394573 1036773669 /nfs/dbraw/zinc/77/36/69/1036773669.db2.gz NVLXTTURXQLASK-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cccc(O)c1Cl ZINC000590186760 1036789737 /nfs/dbraw/zinc/78/97/37/1036789737.db2.gz YBDRUYNJPGINAS-UHFFFAOYSA-N 1 0 341.194 3.940 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000539509364 1036849555 /nfs/dbraw/zinc/84/95/55/1036849555.db2.gz JOSOUODNYXFZNU-QAPCUYQASA-N 1 0 346.471 3.694 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCC[C@@H](CO)C2)c2ccccc2)c1 ZINC000414349930 1036880050 /nfs/dbraw/zinc/88/00/50/1036880050.db2.gz YMSJVTQQTLLYKO-MOXGXCLJSA-N 1 0 340.423 3.825 20 5 EHBDRO C[NH+]1CCC2(CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CC1 ZINC000590568187 1036952517 /nfs/dbraw/zinc/95/25/17/1036952517.db2.gz YXBZAWNKFAROLZ-UHFFFAOYSA-N 1 0 343.349 3.536 20 5 EHBDRO C[C@@H]1C[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233795 1036957819 /nfs/dbraw/zinc/95/78/19/1036957819.db2.gz UYHZXTBHFAACFG-MOXGXCLJSA-N 1 0 339.439 3.757 20 5 EHBDRO C[C@H](O)C[C@H](C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180601054 1036984247 /nfs/dbraw/zinc/98/42/47/1036984247.db2.gz YRPNWGWIWNQGAB-DOXZYTNZSA-N 1 0 328.412 3.681 20 5 EHBDRO CC(C)Oc1ncccc1CNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761514579 1037093811 /nfs/dbraw/zinc/09/38/11/1037093811.db2.gz DLZCWIRAEUSKKF-UHFFFAOYSA-N 1 0 335.791 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](CCO)c2cccs2)cc1Cl ZINC000761527378 1037104139 /nfs/dbraw/zinc/10/41/39/1037104139.db2.gz UMEUNJGQJNFHRP-GFCCVEGCSA-N 1 0 326.805 3.523 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2(c3cccc(Cl)c3)CC2)c1 ZINC000271758886 1037130042 /nfs/dbraw/zinc/13/00/42/1037130042.db2.gz HMAHWNZCXUIJPG-MRXNPFEDSA-N 1 0 332.787 3.561 20 5 EHBDRO CC[N@H+](CCC(=O)OC)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000511510487 1037234157 /nfs/dbraw/zinc/23/41/57/1037234157.db2.gz VSMMVAWMEHDMBD-UHFFFAOYSA-N 1 0 348.424 3.708 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@](C)(OC)C1CC1 ZINC000462807042 1037426105 /nfs/dbraw/zinc/42/61/05/1037426105.db2.gz KZVGYELDVYRAKT-PBHICJAKSA-N 1 0 338.473 3.870 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000532476383 1037467371 /nfs/dbraw/zinc/46/73/71/1037467371.db2.gz VKMATZBUGNGBBM-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@@H]2CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000493714458 1037575815 /nfs/dbraw/zinc/57/58/15/1037575815.db2.gz YUZRIMURXWZZDK-GOEBONIOSA-N 1 0 336.432 3.631 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000532550535 1037596463 /nfs/dbraw/zinc/59/64/63/1037596463.db2.gz PRDYNJYMKIKOFR-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cncc(C)c1 ZINC000540153426 1037627472 /nfs/dbraw/zinc/62/74/72/1037627472.db2.gz KMOAKSZSLVRZCG-HNNXBMFYSA-N 1 0 331.441 3.959 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])s2)CC1 ZINC000591822233 1037638073 /nfs/dbraw/zinc/63/80/73/1037638073.db2.gz LHQWWMCWPZDYFL-LBPRGKRZSA-N 1 0 332.429 3.689 20 5 EHBDRO C[C@@H](CO)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000549945976 1037768562 /nfs/dbraw/zinc/76/85/62/1037768562.db2.gz PASRZLPNQNQXOW-NSHDSACASA-N 1 0 346.349 3.739 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1ccccc1 ZINC000104661185 1038439768 /nfs/dbraw/zinc/43/97/68/1038439768.db2.gz APBPMSFOQSNWBG-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@@H](O)Cc1ccccc1 ZINC000539050222 1038653686 /nfs/dbraw/zinc/65/36/86/1038653686.db2.gz HKVCNBDAQXMGNB-KHYOSLBOSA-N 1 0 328.412 3.546 20 5 EHBDRO COc1ccc(OC)c(CCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000539056214 1038657312 /nfs/dbraw/zinc/65/73/12/1038657312.db2.gz AAAAOOVECQMIMD-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539225109 1038738329 /nfs/dbraw/zinc/73/83/29/1038738329.db2.gz KNFHYHOSAKVFDE-PBHICJAKSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500472089 1038783329 /nfs/dbraw/zinc/78/33/29/1038783329.db2.gz WFEDEZURFOXBCL-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552047527 1038914094 /nfs/dbraw/zinc/91/40/94/1038914094.db2.gz PMYBUFNFZODFLU-VKJFTORMSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480225307 1039324590 /nfs/dbraw/zinc/32/45/90/1039324590.db2.gz GALRLEXIVTZSIP-INIZCTEOSA-N 1 0 339.439 3.612 20 5 EHBDRO CS(=O)(=O)CCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000237299983 1039335899 /nfs/dbraw/zinc/33/58/99/1039335899.db2.gz NQHDHXGEKAEEJU-UHFFFAOYSA-N 1 0 327.449 3.517 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668094 1039386127 /nfs/dbraw/zinc/38/61/27/1039386127.db2.gz ICUGJSLWRZBFEK-IUODEOHRSA-N 1 0 346.818 3.891 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000728918109 1039390809 /nfs/dbraw/zinc/39/08/09/1039390809.db2.gz JEJBMXZAZXGMCD-RTBURBONSA-N 1 0 344.386 3.822 20 5 EHBDRO CCOc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OCC ZINC000480438219 1039544390 /nfs/dbraw/zinc/54/43/90/1039544390.db2.gz ASJNEVSNKQRONE-UHFFFAOYSA-N 1 0 344.411 3.990 20 5 EHBDRO Cc1ccc(NC(=O)CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000485796180 1039547653 /nfs/dbraw/zinc/54/76/53/1039547653.db2.gz VDYIOQUVDBNDJQ-OAHLLOKOSA-N 1 0 341.411 3.843 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349996 1039702881 /nfs/dbraw/zinc/70/28/81/1039702881.db2.gz NWHKSEYZJWEXTH-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO Cc1ncsc1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417352192 1039726241 /nfs/dbraw/zinc/72/62/41/1039726241.db2.gz URBVEBISKLJOPG-MRXNPFEDSA-N 1 0 331.441 3.960 20 5 EHBDRO C[C@@H]([NH2+]CC1(N2CCSCC2)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000480779652 1040002658 /nfs/dbraw/zinc/00/26/58/1040002658.db2.gz ODEZMISARNSNRJ-OAHLLOKOSA-N 1 0 349.500 3.607 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CCN(Cc2sccc2Cl)CC1 ZINC000555016323 1040066580 /nfs/dbraw/zinc/06/65/80/1040066580.db2.gz XIUQIOPRTGIZBU-UHFFFAOYSA-N 1 0 337.832 3.632 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000573507033 1040136950 /nfs/dbraw/zinc/13/69/50/1040136950.db2.gz YXKOTMADSWXICX-SJORKVTESA-N 1 0 346.814 3.949 20 5 EHBDRO C[C@@H]([NH2+]CCCOCCc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000480912652 1040155292 /nfs/dbraw/zinc/15/52/92/1040155292.db2.gz QQRQPEIAZLTALG-MRXNPFEDSA-N 1 0 328.412 3.895 20 5 EHBDRO C[NH+](C)[C@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130766 1040365199 /nfs/dbraw/zinc/36/51/99/1040365199.db2.gz OJAKAUPAAHNFTQ-WOJBJXKFSA-N 1 0 339.439 3.614 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075411 1040434483 /nfs/dbraw/zinc/43/44/83/1040434483.db2.gz PLUASMGBLMDSKW-FMKPAKJESA-N 1 0 331.416 3.576 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481195220 1040471713 /nfs/dbraw/zinc/47/17/13/1040471713.db2.gz XHNHGADCQNLUDO-HOCLYGCPSA-N 1 0 333.432 3.790 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490340288 1040501198 /nfs/dbraw/zinc/50/11/98/1040501198.db2.gz MHFKEPDJOAERMK-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847035 1040576477 /nfs/dbraw/zinc/57/64/77/1040576477.db2.gz LQPGOCDWAWMIPC-QWHCGFSZSA-N 1 0 342.399 3.806 20 5 EHBDRO CC(C)[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487154083 1040726009 /nfs/dbraw/zinc/72/60/09/1040726009.db2.gz HFUIISXUJQBDQR-UKRRQHHQSA-N 1 0 346.349 3.907 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCCO1 ZINC000511657385 1040863016 /nfs/dbraw/zinc/86/30/16/1040863016.db2.gz QOJASFGGEHBTHB-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC001167754017 1040871692 /nfs/dbraw/zinc/87/16/92/1040871692.db2.gz SSFCPPMXTIGVCN-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO Cc1cc(C)n(CCC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433177903 1041023560 /nfs/dbraw/zinc/02/35/60/1041023560.db2.gz RDONFOSSURQPRH-GOSISDBHSA-N 1 0 342.443 3.810 20 5 EHBDRO CC(C)[C@@H](O)C1(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433235649 1041123721 /nfs/dbraw/zinc/12/37/21/1041123721.db2.gz WWQMXQZUSBXGBQ-DLBZAZTESA-N 1 0 332.444 3.704 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000419299009 1041161467 /nfs/dbraw/zinc/16/14/67/1041161467.db2.gz HITOOBAMQVJPNV-UHFFFAOYSA-N 1 0 334.416 3.527 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CC2(CCO)CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433291304 1041227981 /nfs/dbraw/zinc/22/79/81/1041227981.db2.gz UIFTULBRKCEURE-QGZVFWFLSA-N 1 0 332.444 3.850 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCCNc2ccccn2)c2cc([N+](=O)[O-])ccc21 ZINC000433284640 1041233194 /nfs/dbraw/zinc/23/31/94/1041233194.db2.gz FEYYLVCXOOXZEI-QGZVFWFLSA-N 1 0 340.427 3.804 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCOc2ncccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000433300676 1041239231 /nfs/dbraw/zinc/23/92/31/1041239231.db2.gz UBGQAYWGQHWPSX-MRXNPFEDSA-N 1 0 345.374 3.520 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CC1(C)C ZINC000419313684 1041249446 /nfs/dbraw/zinc/24/94/46/1041249446.db2.gz GNHFZXJFHWBANZ-ZIAGYGMSSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1cccnc1NCc1ccccc1C[NH+]1CCCCC1 ZINC000015141424 1041353679 /nfs/dbraw/zinc/35/36/79/1041353679.db2.gz QZRPDPPMAFXVAQ-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000511668796 1041456847 /nfs/dbraw/zinc/45/68/47/1041456847.db2.gz VSILLLZNSGRWBA-AQDCRGGLSA-N 1 0 338.407 3.854 20 5 EHBDRO Cc1ccc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000124579123 1041721345 /nfs/dbraw/zinc/72/13/45/1041721345.db2.gz YNXZDMHVBHTTJD-HXUWFJFHSA-N 1 0 340.423 3.849 20 5 EHBDRO Cc1nc(C)c([C@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875323 1041787599 /nfs/dbraw/zinc/78/75/99/1041787599.db2.gz NLRAZLQZLISFTF-LBPRGKRZSA-N 1 0 335.429 3.740 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cccc(Br)c2)cc1[N+](=O)[O-] ZINC000048818147 1042419344 /nfs/dbraw/zinc/41/93/44/1042419344.db2.gz PZRYBSQZIVTQCM-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO Cc1nc(C(C)(C)[NH2+]CCOc2ccccc2[N+](=O)[O-])sc1C ZINC000072865574 1042632906 /nfs/dbraw/zinc/63/29/06/1042632906.db2.gz UEJNDTGTDGIUTN-UHFFFAOYSA-N 1 0 335.429 3.572 20 5 EHBDRO CC(C)OCC[NH+]1CCC(Nc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000432319357 1042844545 /nfs/dbraw/zinc/84/45/45/1042844545.db2.gz XXVCIUSKHRSPJE-UHFFFAOYSA-N 1 0 341.839 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000166498661 1042962985 /nfs/dbraw/zinc/96/29/85/1042962985.db2.gz HDXUWVVIEAJWKU-PXNSSMCTSA-N 1 0 340.423 3.895 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754347 1043024564 /nfs/dbraw/zinc/02/45/64/1043024564.db2.gz IWRZBHOWAQTWLU-UHFFFAOYSA-N 1 0 341.411 3.709 20 5 EHBDRO CC(C)([NH2+]Cc1cc(-n2ccnc2)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000344146133 1043328695 /nfs/dbraw/zinc/32/86/95/1043328695.db2.gz QEUMDEZXKSUOEI-UHFFFAOYSA-N 1 0 342.424 3.867 20 5 EHBDRO C[C@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@@H+]1C ZINC000090095025 1043367689 /nfs/dbraw/zinc/36/76/89/1043367689.db2.gz WVBSFPKPIMBFMF-GOEBONIOSA-N 1 0 340.427 3.576 20 5 EHBDRO C[C@@H](c1ccccc1)N(CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259845 1044430791 /nfs/dbraw/zinc/43/07/91/1044430791.db2.gz LSLACFRFNZNJRL-AWEZNQCLSA-N 1 0 339.395 3.759 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000512339692 1044794375 /nfs/dbraw/zinc/79/43/75/1044794375.db2.gz YWJJPHKOHTULBF-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO COc1ccc(CNc2cc[nH+]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000500459103 1044872149 /nfs/dbraw/zinc/87/21/49/1044872149.db2.gz VDSXDGIRXWUUIJ-UHFFFAOYSA-N 1 0 327.315 3.903 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000183356159 1125537562 /nfs/dbraw/zinc/53/75/62/1125537562.db2.gz KSXGAWXYRACGGD-CABCVRRESA-N 1 0 341.411 3.624 20 5 EHBDRO Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC001560872629 1126214136 /nfs/dbraw/zinc/21/41/36/1126214136.db2.gz PMFMBNIIOCNOTC-INIZCTEOSA-N 1 0 348.830 3.558 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000072965825 1126953837 /nfs/dbraw/zinc/95/38/37/1126953837.db2.gz YSPVVGMTBGPNRQ-LSDHHAIUSA-N 1 0 337.489 3.743 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000131207239 1126969126 /nfs/dbraw/zinc/96/91/26/1126969126.db2.gz SJZNSVZRHQAOCW-KRWDZBQOSA-N 1 0 346.383 3.550 20 5 EHBDRO COc1ccc([C@@H](C)N(C)Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000083133643 1127210112 /nfs/dbraw/zinc/21/01/12/1127210112.db2.gz QBADQBMDHWRKHA-GFCCVEGCSA-N 1 0 341.367 3.938 20 5 EHBDRO C[C@H]1CCC[C@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000765308092 1127596560 /nfs/dbraw/zinc/59/65/60/1127596560.db2.gz VNARXYYIPISGNU-HOTGVXAUSA-N 1 0 331.460 3.980 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000301380007 1127739419 /nfs/dbraw/zinc/73/94/19/1127739419.db2.gz YPXPIHQNKHXWHV-GFCCVEGCSA-N 1 0 343.349 3.536 20 5 EHBDRO CSc1ccccc1[C@@H](C)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000282211968 1128084989 /nfs/dbraw/zinc/08/49/89/1128084989.db2.gz YAJSZAADHYBZRL-WBMJQRKESA-N 1 0 332.425 3.701 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272956525 1128217902 /nfs/dbraw/zinc/21/79/02/1128217902.db2.gz FKHMXULIYQXTGM-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272956521 1128217989 /nfs/dbraw/zinc/21/79/89/1128217989.db2.gz FKHMXULIYQXTGM-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]1[C@H]([NH+]2CCCC2)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553359185 1128414807 /nfs/dbraw/zinc/41/48/07/1128414807.db2.gz WGLIGYZKEBPAQG-BXUZGUMPSA-N 1 0 343.349 3.677 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000301467876 1128439218 /nfs/dbraw/zinc/43/92/18/1128439218.db2.gz YNQPOBNNAXVEAV-KRWDZBQOSA-N 1 0 325.412 3.553 20 5 EHBDRO CC(C)OCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000301488320 1128481917 /nfs/dbraw/zinc/48/19/17/1128481917.db2.gz ZSWLCYUBSHMMRK-UHFFFAOYSA-N 1 0 341.839 3.550 20 5 EHBDRO Cc1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000301562902 1128498220 /nfs/dbraw/zinc/49/82/20/1128498220.db2.gz IWOZSXXQNCVHOU-RDJZCZTQSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848112 1128560180 /nfs/dbraw/zinc/56/01/80/1128560180.db2.gz FOXNBIITMGOLLW-WBMJQRKESA-N 1 0 326.352 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000765849005 1128573420 /nfs/dbraw/zinc/57/34/20/1128573420.db2.gz NMGIHOQPPJCILJ-VAMGGRTRSA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000765849917 1128581691 /nfs/dbraw/zinc/58/16/91/1128581691.db2.gz UZBWDFUPODEAFB-DFQSSKMNSA-N 1 0 340.423 3.629 20 5 EHBDRO COc1cc(C[NH+]2[C@H](C)CC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000123121035 1128611507 /nfs/dbraw/zinc/61/15/07/1128611507.db2.gz PPABTBCBVMJTSZ-NXEZZACHSA-N 1 0 330.331 3.578 20 5 EHBDRO C[C@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO)c1ccccc1 ZINC000554279721 1128633869 /nfs/dbraw/zinc/63/38/69/1128633869.db2.gz PLTSFXBABGRSOZ-CVEARBPZSA-N 1 0 328.412 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]2C[NH+]2CCCCC2)c(Cl)c1 ZINC000542931053 1128864075 /nfs/dbraw/zinc/86/40/75/1128864075.db2.gz CLYMZDHLGLETGW-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000172169418 1120207081 /nfs/dbraw/zinc/20/70/81/1120207081.db2.gz RVSBCEHZEOLQQI-QWRGUYRKSA-N 1 0 339.823 3.744 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CNC1(c2ccc(F)cc2)CCC1 ZINC000609194194 1120542821 /nfs/dbraw/zinc/54/28/21/1120542821.db2.gz CPNSPOKUBMDRJO-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO CC(C)CN(CC[NH+](C)C)C(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000495315608 1121063078 /nfs/dbraw/zinc/06/30/78/1121063078.db2.gz CRONOQWIMVNRQJ-UHFFFAOYSA-N 1 0 349.475 3.552 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)cc1[N+](=O)[O-] ZINC000495427640 1121187121 /nfs/dbraw/zinc/18/71/21/1121187121.db2.gz SINPBWCHBDNUQE-LRDDRELGSA-N 1 0 336.432 3.990 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000254988975 1128976644 /nfs/dbraw/zinc/97/66/44/1128976644.db2.gz GXUIOFDNLLGDTH-YVMONPNESA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]C(C)(C)c1cccs1 ZINC000542574352 1121510119 /nfs/dbraw/zinc/51/01/19/1121510119.db2.gz NGBJTAODPOTJDF-UHFFFAOYSA-N 1 0 347.440 3.818 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000193630465 1121514224 /nfs/dbraw/zinc/51/42/24/1121514224.db2.gz PVTMPUWHQKBVHA-SFHVURJKSA-N 1 0 341.411 3.973 20 5 EHBDRO CCO[C@@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000194464919 1121909464 /nfs/dbraw/zinc/90/94/64/1121909464.db2.gz OEYPGYFRTITIQA-BEBFYNPSSA-N 1 0 326.396 3.975 20 5 EHBDRO CC(=O)c1ccc(NC[C@H]2CCC[N@@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000301756542 1129033864 /nfs/dbraw/zinc/03/38/64/1129033864.db2.gz DUNGRMNQYNWTBF-OAHLLOKOSA-N 1 0 333.432 3.577 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1C ZINC000916575984 1122201451 /nfs/dbraw/zinc/20/14/51/1122201451.db2.gz GDIVFOCCNNNBII-NQBHXWOUSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc(N2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000917088533 1122486206 /nfs/dbraw/zinc/48/62/06/1122486206.db2.gz KLVMEGJVIJJIEH-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000556130204 1122832849 /nfs/dbraw/zinc/83/28/49/1122832849.db2.gz KDCIWZQDGQJNCM-OAHLLOKOSA-N 1 0 341.411 3.834 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCCC1 ZINC000070760476 1122919899 /nfs/dbraw/zinc/91/98/99/1122919899.db2.gz AUTCNYXEVMKBHH-UHFFFAOYSA-N 1 0 325.412 3.827 20 5 EHBDRO CCC(CC)[C@H](CNCc1ccc(OC)c([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000609287666 1122939891 /nfs/dbraw/zinc/93/98/91/1122939891.db2.gz LYXBWUTYUGJQQO-SFHVURJKSA-N 1 0 349.475 3.594 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H](C2CC2)C2CCOCC2)cc1 ZINC000925463942 1123033465 /nfs/dbraw/zinc/03/34/65/1123033465.db2.gz CBTZWESHUPRWAP-IBGZPJMESA-N 1 0 332.444 3.712 20 5 EHBDRO CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609571505 1123610804 /nfs/dbraw/zinc/61/08/04/1123610804.db2.gz LDZCTCPXXYGANF-FZKQIMNGSA-N 1 0 332.400 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCS[C@H](c3ccccc3)C2)c1 ZINC000609800859 1123665305 /nfs/dbraw/zinc/66/53/05/1123665305.db2.gz UEWFCXMFKFFGKZ-SFHVURJKSA-N 1 0 344.436 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916597 1123691712 /nfs/dbraw/zinc/69/17/12/1123691712.db2.gz ZRTSHNMBEUJKNB-QGZVFWFLSA-N 1 0 328.387 3.841 20 5 EHBDRO CC[C@@H](COC)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610009962 1123712995 /nfs/dbraw/zinc/71/29/95/1123712995.db2.gz LAZMHRQJOIHMOZ-INIZCTEOSA-N 1 0 343.427 3.877 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1OCCc2ccccc21 ZINC000615724306 1123863963 /nfs/dbraw/zinc/86/39/63/1123863963.db2.gz YOASTLRVAMAYEU-WLEBTQASSA-N 1 0 338.407 3.902 20 5 EHBDRO CC(C)[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000180259813 1123976034 /nfs/dbraw/zinc/97/60/34/1123976034.db2.gz LHXTYGLUOGMRDI-OAHLLOKOSA-N 1 0 340.786 3.571 20 5 EHBDRO CC[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOC1 ZINC000616487731 1124011693 /nfs/dbraw/zinc/01/16/93/1124011693.db2.gz UZUGXHIKGKVZTI-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(c3cccnc3)CC2)ccc1[N+](=O)[O-] ZINC000617216808 1124100442 /nfs/dbraw/zinc/10/04/42/1124100442.db2.gz VIPSFKLXNFQLMK-UHFFFAOYSA-N 1 0 341.411 3.768 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)NCCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000181830426 1125054097 /nfs/dbraw/zinc/05/40/97/1125054097.db2.gz DIUVRPXWYROJJS-HNNXBMFYSA-N 1 0 345.443 3.561 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000182230315 1125222784 /nfs/dbraw/zinc/22/27/84/1125222784.db2.gz ADIFLJVHAMVOAI-HNNXBMFYSA-N 1 0 347.459 3.514 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000446843443 1125334982 /nfs/dbraw/zinc/33/49/82/1125334982.db2.gz NNLUWKOSCRDPHK-GSPCDJLXSA-N 1 0 340.427 3.611 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000182906849 1125391552 /nfs/dbraw/zinc/39/15/52/1125391552.db2.gz CGYQUBWQYYUVGF-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000182906824 1125391911 /nfs/dbraw/zinc/39/19/11/1125391911.db2.gz OFUNVUWRAFHINQ-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)C2)cc1C(F)(F)F ZINC000301860186 1129228162 /nfs/dbraw/zinc/22/81/62/1129228162.db2.gz SWYHGKKBMUJHQC-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCCC[C@@H]23)nc1-c1ccccc1 ZINC000301880118 1129252205 /nfs/dbraw/zinc/25/22/05/1129252205.db2.gz PCZQYXPTVMVTRD-HOTGVXAUSA-N 1 0 338.411 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCCC[C@H]23)nc1-c1ccccc1 ZINC000301880123 1129252620 /nfs/dbraw/zinc/25/26/20/1129252620.db2.gz PCZQYXPTVMVTRD-JKSUJKDBSA-N 1 0 338.411 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000067386480 1129269059 /nfs/dbraw/zinc/26/90/59/1129269059.db2.gz CDYYMGITWGPCFS-FQEVSTJZSA-N 1 0 349.390 3.748 20 5 EHBDRO Cc1ccnc(NCc2cccc(C[NH+]3CCCC3)c2)c1[N+](=O)[O-] ZINC000115515838 1129271346 /nfs/dbraw/zinc/27/13/46/1129271346.db2.gz KDWWGKPSLAVEMI-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1ccccc1 ZINC000499668767 1129285347 /nfs/dbraw/zinc/28/53/47/1129285347.db2.gz FCGGSHRKTUWRRT-SFHVURJKSA-N 1 0 336.395 3.858 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301995347 1129505651 /nfs/dbraw/zinc/50/56/51/1129505651.db2.gz SJRFABWFGQUODO-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043388 1129531607 /nfs/dbraw/zinc/53/16/07/1129531607.db2.gz SWPGCFRYHJZMBF-AEFFLSMTSA-N 1 0 331.460 3.634 20 5 EHBDRO COCC[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)C ZINC000092563180 1129552532 /nfs/dbraw/zinc/55/25/32/1129552532.db2.gz BANDOEYOXUBBJC-UHFFFAOYSA-N 1 0 349.456 3.823 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(c3ccnn3C)CC2)cc1[N+](=O)[O-] ZINC000092810431 1129562555 /nfs/dbraw/zinc/56/25/55/1129562555.db2.gz MEGLVGLGYGTNEI-UHFFFAOYSA-N 1 0 342.443 3.831 20 5 EHBDRO C[C@@H](N[C@@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955479 1129593325 /nfs/dbraw/zinc/59/33/25/1129593325.db2.gz YJLYJYGKEMUJSL-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cc(F)ccc1OC ZINC000922623894 1129600249 /nfs/dbraw/zinc/60/02/49/1129600249.db2.gz WREWSGSWZVQVOH-HNNXBMFYSA-N 1 0 348.374 3.992 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ncccc1[N+](=O)[O-] ZINC000390863198 1129639107 /nfs/dbraw/zinc/63/91/07/1129639107.db2.gz NIFQJZBDHCSKTK-KRWDZBQOSA-N 1 0 340.427 3.702 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2C=C[C@H]3C[C@@H]2CO3)o1 ZINC000922723749 1129643604 /nfs/dbraw/zinc/64/36/04/1129643604.db2.gz OZAYWOAVVQKPJM-ZNMIVQPWSA-N 1 0 340.379 3.536 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCCC[C@@H]1C(C)C ZINC000331055545 1129652199 /nfs/dbraw/zinc/65/21/99/1129652199.db2.gz KRXXFRBYACFKCV-HUUCEWRRSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H](CO)[C@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000157180545 1129752683 /nfs/dbraw/zinc/75/26/83/1129752683.db2.gz VDKPWUURKNCPEE-AVGNSLFASA-N 1 0 334.441 3.991 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CN(C)[C@@H](C)c1cccs1 ZINC000096992916 1129753804 /nfs/dbraw/zinc/75/38/04/1129753804.db2.gz VVVDCXKMHBVGSS-LBPRGKRZSA-N 1 0 333.413 3.596 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034607 1129764764 /nfs/dbraw/zinc/76/47/64/1129764764.db2.gz JMIDJNIIKMRSAU-CABCVRRESA-N 1 0 335.423 3.825 20 5 EHBDRO Cc1cc(NCC[N@H+]2CC=C(C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302180457 1129772069 /nfs/dbraw/zinc/77/20/69/1129772069.db2.gz YFPFKEARWXHJAI-UHFFFAOYSA-N 1 0 326.400 3.515 20 5 EHBDRO Cc1cc(NC[C@H](C)C[NH+]2CCCC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302679085 1129785383 /nfs/dbraw/zinc/78/53/83/1129785383.db2.gz RFICASOGNQRHSP-ZDUSSCGKSA-N 1 0 328.416 3.595 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])C2)CC1 ZINC000509125796 1129788525 /nfs/dbraw/zinc/78/85/25/1129788525.db2.gz LQFWQFZIPYHSPX-INIZCTEOSA-N 1 0 349.450 3.678 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(F)c1 ZINC000056196712 1129806218 /nfs/dbraw/zinc/80/62/18/1129806218.db2.gz KBEJRSLEWBUAJG-GHMZBOCLSA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1 ZINC000056197510 1129806784 /nfs/dbraw/zinc/80/67/84/1129806784.db2.gz DMLHTGSJHQGWEP-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO CC(C)(CCO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305846714 1129928525 /nfs/dbraw/zinc/92/85/25/1129928525.db2.gz SUMXIMBWKWYLKE-SFHVURJKSA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCc2nc(C)ncc21 ZINC000766045808 1129935660 /nfs/dbraw/zinc/93/56/60/1129935660.db2.gz VXBJXQCNXVMYRN-YVEFUNNKSA-N 1 0 326.400 3.730 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316591 1130205368 /nfs/dbraw/zinc/20/53/68/1130205368.db2.gz YJUXMNCGNUFARK-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000173321136 1130206743 /nfs/dbraw/zinc/20/67/43/1130206743.db2.gz OPFGIHAZDSFTNJ-CQSZACIVSA-N 1 0 339.395 3.572 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173451124 1130232607 /nfs/dbraw/zinc/23/26/07/1130232607.db2.gz XRVCDZBDJJACDB-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539080 1130244869 /nfs/dbraw/zinc/24/48/69/1130244869.db2.gz UYEOZADGXIKQGN-GFCCVEGCSA-N 1 0 336.413 3.737 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000246352097 1130374818 /nfs/dbraw/zinc/37/48/18/1130374818.db2.gz HUUGRIKWGPMQOV-KYNGSXCRSA-N 1 0 325.412 3.691 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246463095 1130384313 /nfs/dbraw/zinc/38/43/13/1130384313.db2.gz PZJBGRIUOIVRTN-JVPBZIDWSA-N 1 0 328.412 3.628 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H](C(F)(F)F)C1 ZINC000175028115 1130398997 /nfs/dbraw/zinc/39/89/97/1130398997.db2.gz NAILGLOONFQVJL-GFCCVEGCSA-N 1 0 332.322 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@H+](CC3CC3)C3CCCCC3)c2c1 ZINC000727824931 1130597268 /nfs/dbraw/zinc/59/72/68/1130597268.db2.gz JAODJYGUWUODGT-UHFFFAOYSA-N 1 0 328.416 3.947 20 5 EHBDRO O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000731451198 1130798047 /nfs/dbraw/zinc/79/80/47/1130798047.db2.gz BYQUYSJFKLJCLP-AWEZNQCLSA-N 1 0 333.775 3.516 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282656465 1131134886 /nfs/dbraw/zinc/13/48/86/1131134886.db2.gz IFZLFYPESRDBTO-MRXNPFEDSA-N 1 0 338.835 3.730 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cnn(-c2ccccc2)c1 ZINC000766193631 1131159563 /nfs/dbraw/zinc/15/95/63/1131159563.db2.gz MIKVULHSFRJRDO-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000742391433 1131714919 /nfs/dbraw/zinc/71/49/19/1131714919.db2.gz HYVNGRXIUUBPQO-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cnccc1Cl)CC2 ZINC001172897000 1131881765 /nfs/dbraw/zinc/88/17/65/1131881765.db2.gz VYGARVWYXWOKKR-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)cn1 ZINC001172899172 1131882037 /nfs/dbraw/zinc/88/20/37/1131882037.db2.gz LNCAFJVIYCCKFD-LRDDRELGSA-N 1 0 329.375 3.727 20 5 EHBDRO C[C@@H](Cc1cccc(O)c1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898445 1131883031 /nfs/dbraw/zinc/88/30/31/1131883031.db2.gz AYNONCFHJKZZHH-KBXCAEBGSA-N 1 0 340.423 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ncccc1Cl)CC2 ZINC001172901369 1131884022 /nfs/dbraw/zinc/88/40/22/1131884022.db2.gz MLPBLDDETKZIMQ-AWEZNQCLSA-N 1 0 331.803 3.680 20 5 EHBDRO C[C@H](COc1ccccc1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902782 1131884663 /nfs/dbraw/zinc/88/46/63/1131884663.db2.gz MBYJISORDSSOMQ-CRAIPNDOSA-N 1 0 340.423 3.899 20 5 EHBDRO COC[C@@]12CCC[C@@H]1C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908555 1131887943 /nfs/dbraw/zinc/88/79/43/1131887943.db2.gz OGIIBAHHDYYEDP-GGPKGHCWSA-N 1 0 344.455 3.591 20 5 EHBDRO CO[C@@H]1CCC[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910550 1131916769 /nfs/dbraw/zinc/91/67/69/1131916769.db2.gz LVERWRJPTAWPSX-LCLWPZTBSA-N 1 0 344.455 3.589 20 5 EHBDRO Cc1cc([C@H]2CCC[N@@H+]2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910418 1131916908 /nfs/dbraw/zinc/91/69/08/1131916908.db2.gz ZFIDFAGNRXRWQF-QFBILLFUSA-N 1 0 341.411 3.976 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c1F ZINC001173176887 1131992018 /nfs/dbraw/zinc/99/20/18/1131992018.db2.gz NKJYCLUNSGJDCN-CYZMBNFOSA-N 1 0 328.359 3.544 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCO2 ZINC001173224991 1132005055 /nfs/dbraw/zinc/00/50/55/1132005055.db2.gz QGUCYCPHRFXLHD-QWHCGFSZSA-N 1 0 328.368 3.605 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)nc1 ZINC001173224198 1132005271 /nfs/dbraw/zinc/00/52/71/1132005271.db2.gz MRWLDKYGNTZTOQ-HNNXBMFYSA-N 1 0 327.428 3.797 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OC2CCC2)n1 ZINC001173223277 1132005726 /nfs/dbraw/zinc/00/57/26/1132005726.db2.gz HNRFDFAKRYDINO-AWEZNQCLSA-N 1 0 341.411 3.642 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2ccc(F)cc2)C1 ZINC001173227260 1132006879 /nfs/dbraw/zinc/00/68/79/1132006879.db2.gz PAWLSDDAARZWTF-AUUYWEPGSA-N 1 0 344.386 3.818 20 5 EHBDRO COc1cccc([C@@H](C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173230017 1132007545 /nfs/dbraw/zinc/00/75/45/1132007545.db2.gz PWKWXFNXBFIDOH-LSDHHAIUSA-N 1 0 328.412 3.928 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1cccnc1F)C1CC1 ZINC001173229591 1132007630 /nfs/dbraw/zinc/00/76/30/1132007630.db2.gz NXTGBRNRVBHVRH-PXAZEXFGSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1OC ZINC001173231193 1132008697 /nfs/dbraw/zinc/00/86/97/1132008697.db2.gz KJQBWOIBRVURHN-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CSc2ccccc2C1 ZINC001173231107 1132009287 /nfs/dbraw/zinc/00/92/87/1132009287.db2.gz XLRBRFMYXJGITJ-BBRMVZONSA-N 1 0 328.437 3.832 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1CC(=O)OC(C)(C)C ZINC001173231924 1132009393 /nfs/dbraw/zinc/00/93/93/1132009393.db2.gz OXGXYWDDKSEECK-RHSMWYFYSA-N 1 0 348.443 3.722 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173232046 1132009685 /nfs/dbraw/zinc/00/96/85/1132009685.db2.gz CKUCCYLVGBVPKA-LIRRHRJNSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC001173209520 1132013343 /nfs/dbraw/zinc/01/33/43/1132013343.db2.gz CODLRWXCVJHJKV-SJKOYZFVSA-N 1 0 330.359 3.778 20 5 EHBDRO Cc1cccc2c1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173211936 1132013641 /nfs/dbraw/zinc/01/36/41/1132013641.db2.gz VOCJSBYLDUEVGP-WMLDXEAASA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1N1CCCC1 ZINC001173212575 1132014374 /nfs/dbraw/zinc/01/43/74/1132014374.db2.gz AZZBFAXXTLRZHE-MRXNPFEDSA-N 1 0 339.439 3.916 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccccc2N2CCCCCC2)C1 ZINC001168965701 1132621786 /nfs/dbraw/zinc/62/17/86/1132621786.db2.gz CEXAIADAXNVSNU-AEFFLSMTSA-N 1 0 331.460 3.602 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(Br)c2Cl)C1 ZINC001168990267 1132634995 /nfs/dbraw/zinc/63/49/95/1132634995.db2.gz ZKECFOVVINFFAC-MWLCHTKSSA-N 1 0 347.640 3.638 20 5 EHBDRO CN(C)c1ccc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)c([N+](=O)[O-])c1 ZINC001169153779 1132680987 /nfs/dbraw/zinc/68/09/87/1132680987.db2.gz UDZIWIWSKNTQST-ACJLOTCBSA-N 1 0 334.464 3.616 20 5 EHBDRO Nc1ccc(NCC2([NH+]3CCCCC3)CCCCC2)c([N+](=O)[O-])c1 ZINC000804323863 1132761034 /nfs/dbraw/zinc/76/10/34/1132761034.db2.gz NFBCPNJGQBITIB-UHFFFAOYSA-N 1 0 332.448 3.778 20 5 EHBDRO CC[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001169495402 1132771691 /nfs/dbraw/zinc/77/16/91/1132771691.db2.gz RGIBIXISCNJULE-QWRGUYRKSA-N 1 0 327.222 3.978 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOC12CCCC2 ZINC001176823942 1133003029 /nfs/dbraw/zinc/00/30/29/1133003029.db2.gz ZTTUPVDOGPOQHA-KRWDZBQOSA-N 1 0 334.416 3.573 20 5 EHBDRO CC(C)[NH+]1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC001177157974 1133037315 /nfs/dbraw/zinc/03/73/15/1133037315.db2.gz PCENBIDTWINYRZ-UHFFFAOYSA-N 1 0 343.427 3.817 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761318 1133048725 /nfs/dbraw/zinc/04/87/25/1133048725.db2.gz JXOLTSQMKMJXOL-INIZCTEOSA-N 1 0 343.431 3.856 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000768093616 1133091402 /nfs/dbraw/zinc/09/14/02/1133091402.db2.gz PABCGYAWAFGTPT-HUUCEWRRSA-N 1 0 335.448 3.519 20 5 EHBDRO CCCCN1CCCC[C@@H]1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741716 1133098403 /nfs/dbraw/zinc/09/84/03/1133098403.db2.gz CHZLCYBMGKNVBN-QGZVFWFLSA-N 1 0 333.476 3.956 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CC1(C2CC2)CC1 ZINC001178268208 1133151613 /nfs/dbraw/zinc/15/16/13/1133151613.db2.gz YWEMCVSNWWSMTO-UHFFFAOYSA-N 1 0 325.206 3.637 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccc(F)cc1F ZINC001178326677 1133160247 /nfs/dbraw/zinc/16/02/47/1133160247.db2.gz OMAHBWKLLDHCMO-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO C[C@H](Cc1cn(C)c2ccc(F)cc12)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001178944019 1133215539 /nfs/dbraw/zinc/21/55/39/1133215539.db2.gz ALSZVMYSTWEWTR-CYBMUJFWSA-N 1 0 341.386 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ccc(CO)cc3)o2)cc1 ZINC001179021047 1133218251 /nfs/dbraw/zinc/21/82/51/1133218251.db2.gz QLHOXWWHNADOKU-UHFFFAOYSA-N 1 0 338.363 3.637 20 5 EHBDRO Cc1cn2c(C[NH2+]C[C@@H](C)c3ccccc3[N+](=O)[O-])c(C)nc2s1 ZINC001179686290 1133270486 /nfs/dbraw/zinc/27/04/86/1133270486.db2.gz VBXNHELQLLQLPT-LLVKDONJSA-N 1 0 344.440 3.814 20 5 EHBDRO COC[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC001179662714 1133272280 /nfs/dbraw/zinc/27/22/80/1133272280.db2.gz TYFYCQRFKRKSFH-AWEZNQCLSA-N 1 0 349.456 3.727 20 5 EHBDRO CC(C)([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1 ZINC000769748073 1133342611 /nfs/dbraw/zinc/34/26/11/1133342611.db2.gz WEPYIOWCAHFIRI-UHFFFAOYSA-N 1 0 328.347 3.635 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCCCO1 ZINC001180310590 1133355986 /nfs/dbraw/zinc/35/59/86/1133355986.db2.gz LWEKGTPWDKADNP-CGTJXYLNSA-N 1 0 332.444 3.855 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]CCc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001181788465 1133527969 /nfs/dbraw/zinc/52/79/69/1133527969.db2.gz YFSGOSRNROHZKZ-QAQDUYKDSA-N 1 0 326.396 3.682 20 5 EHBDRO Cc1noc(C)c1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774219596 1133641145 /nfs/dbraw/zinc/64/11/45/1133641145.db2.gz TTZABBWCQXFCJF-GOSISDBHSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H](O)c2ccc(Cl)cc2)C2CC2)c1 ZINC000774658067 1133835474 /nfs/dbraw/zinc/83/54/74/1133835474.db2.gz CXRWSTPDSCPAIL-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000786575916 1133876933 /nfs/dbraw/zinc/87/69/33/1133876933.db2.gz YQATZJYSCIVRPW-MRXNPFEDSA-N 1 0 334.807 3.545 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2ccc([N+](=O)[O-])c(F)c2)cc1 ZINC000788479052 1134129999 /nfs/dbraw/zinc/12/99/99/1134129999.db2.gz MYRYPMQKSPDODD-UHFFFAOYSA-N 1 0 332.375 3.807 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000788581215 1134147026 /nfs/dbraw/zinc/14/70/26/1134147026.db2.gz TWUBPNGSWZNPOG-UYAOXDASSA-N 1 0 340.423 3.815 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc21 ZINC000788590077 1134148077 /nfs/dbraw/zinc/14/80/77/1134148077.db2.gz RYGOUWHXOOPSEX-PBHICJAKSA-N 1 0 346.427 3.593 20 5 EHBDRO Cc1cccc2c(CC[NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)c[nH]c21 ZINC000788612994 1134151800 /nfs/dbraw/zinc/15/18/00/1134151800.db2.gz NUGDQCIDAHEEMS-CYBMUJFWSA-N 1 0 338.411 3.860 20 5 EHBDRO CC[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000788629341 1134153792 /nfs/dbraw/zinc/15/37/92/1134153792.db2.gz TULYRBPZKLWEJO-GXTWGEPZSA-N 1 0 347.390 3.824 20 5 EHBDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815724 1134176189 /nfs/dbraw/zinc/17/61/89/1134176189.db2.gz DPAYQIPTXJRSAC-QLJPJBMISA-N 1 0 345.374 3.663 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501753 1134286194 /nfs/dbraw/zinc/28/61/94/1134286194.db2.gz CZFJCCGIFIETIA-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO CC(C)c1cccc2c1CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549154 1134295402 /nfs/dbraw/zinc/29/54/02/1134295402.db2.gz PRMUAJJNYVRIFI-FQEVSTJZSA-N 1 0 340.423 3.810 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@H]4CCCC[C@H]4C3)nc2c1 ZINC000775180553 1134483811 /nfs/dbraw/zinc/48/38/11/1134483811.db2.gz ZZCMDSVIHPIGPF-HZSPNIEDSA-N 1 0 328.416 3.920 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC001170291895 1134734697 /nfs/dbraw/zinc/73/46/97/1134734697.db2.gz GZKHLWNOEPSLKF-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297603 1134737396 /nfs/dbraw/zinc/73/73/96/1134737396.db2.gz QPHNAKGPHUIHCJ-PWSUYJOCSA-N 1 0 335.429 3.650 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297544 1134737682 /nfs/dbraw/zinc/73/76/82/1134737682.db2.gz PAYOJINMWRFRQQ-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170299573 1134737962 /nfs/dbraw/zinc/73/79/62/1134737962.db2.gz UYIJCJWTYHVEJM-RYUDHWBXSA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170298604 1134738279 /nfs/dbraw/zinc/73/82/79/1134738279.db2.gz MYKUFMICFZPLGT-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCc3ncccc32)c([N+](=O)[O-])c1 ZINC001170304666 1134738941 /nfs/dbraw/zinc/73/89/41/1134738941.db2.gz DSXIZLGAOUYCMH-ACJLOTCBSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cccc(F)c2F)c([N+](=O)[O-])c1 ZINC001170304717 1134739789 /nfs/dbraw/zinc/73/97/89/1134739789.db2.gz GGAPILQMJGRDPQ-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170305681 1134739871 /nfs/dbraw/zinc/73/98/71/1134739871.db2.gz PKQUBQXBADMEFM-KUHUBIRLSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170323406 1134747340 /nfs/dbraw/zinc/74/73/40/1134747340.db2.gz JMTSLPVMDWNQSC-WMLDXEAASA-N 1 0 340.423 3.854 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329026 1134749420 /nfs/dbraw/zinc/74/94/20/1134749420.db2.gz NGJAINQNLUDCDD-ABAIWWIYSA-N 1 0 346.349 3.604 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328777 1134749748 /nfs/dbraw/zinc/74/97/48/1134749748.db2.gz MHWFYAAUODDHSD-LBPRGKRZSA-N 1 0 328.359 3.656 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CCC3(CC(F)C3)CC2)c([N+](=O)[O-])c1 ZINC001170335495 1134752392 /nfs/dbraw/zinc/75/23/92/1134752392.db2.gz OQYUOEFRWZWNQS-ZDUSSCGKSA-N 1 0 336.407 3.749 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170354469 1134754111 /nfs/dbraw/zinc/75/41/11/1134754111.db2.gz LSFDCRUSIABEIC-CQSZACIVSA-N 1 0 346.402 3.848 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C(C)(C)C)CC1 ZINC001191021193 1134780001 /nfs/dbraw/zinc/78/00/01/1134780001.db2.gz DAZBLCHIECJCOV-OAHLLOKOSA-N 1 0 347.459 3.990 20 5 EHBDRO CO[C@]1(C)C[C@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202044 1134814907 /nfs/dbraw/zinc/81/49/07/1134814907.db2.gz DVWWPENSWUUDDL-GOEBONIOSA-N 1 0 326.824 3.884 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccccc1CC(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000775537560 1135034157 /nfs/dbraw/zinc/03/41/57/1135034157.db2.gz AJIYMRBJLJFLKX-GOSISDBHSA-N 1 0 342.395 3.551 20 5 EHBDRO CO[C@@H]1[C@H](C)[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC001194458721 1135270349 /nfs/dbraw/zinc/27/03/49/1135270349.db2.gz TULWHEYSGKDACG-OWYVNGRQSA-N 1 0 346.349 3.763 20 5 EHBDRO CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000805840167 1135333586 /nfs/dbraw/zinc/33/35/86/1135333586.db2.gz MMTQTRMJJPTKFD-GDBMZVCRSA-N 1 0 332.425 3.773 20 5 EHBDRO COc1cccc(C2([NH2+]CCc3ccc([N+](=O)[O-])cc3)CCC2)c1 ZINC001196376533 1135552113 /nfs/dbraw/zinc/55/21/13/1135552113.db2.gz XKHGCPFGIMJDOC-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO C[C@@H](COCC1CCCCC1)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC001197989254 1135763760 /nfs/dbraw/zinc/76/37/60/1135763760.db2.gz LJGNBKWCYUGHEE-HNNXBMFYSA-N 1 0 336.432 3.549 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](c2cccs2)N2CCCC2)cccc1[N+](=O)[O-] ZINC001198969417 1135870184 /nfs/dbraw/zinc/87/01/84/1135870184.db2.gz PBRNOMGKCHRNRG-QGZVFWFLSA-N 1 0 345.468 3.891 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])cc1O ZINC001199053506 1135876278 /nfs/dbraw/zinc/87/62/78/1135876278.db2.gz ZZWVRQRXCPJPNJ-UMVBOHGHSA-N 1 0 334.416 3.758 20 5 EHBDRO C[NH+](C)C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCC1 ZINC001199027806 1135877077 /nfs/dbraw/zinc/87/70/77/1135877077.db2.gz JDYAVMIJBXPMSU-UHFFFAOYSA-N 1 0 343.427 3.819 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)ccn1 ZINC001199144268 1135882767 /nfs/dbraw/zinc/88/27/67/1135882767.db2.gz PSYUWQGLCHMOQY-UHFFFAOYSA-N 1 0 339.351 3.548 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)cc1Cl ZINC000809758409 1135887879 /nfs/dbraw/zinc/88/78/79/1135887879.db2.gz MFVUIQLNSTXQAX-HIFRSBDPSA-N 1 0 338.835 3.887 20 5 EHBDRO C[N@H+](CCc1ccncc1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809968401 1135904875 /nfs/dbraw/zinc/90/48/75/1135904875.db2.gz AZNODEZFQKUVJJ-UHFFFAOYSA-N 1 0 340.210 3.971 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000809975181 1135907454 /nfs/dbraw/zinc/90/74/54/1135907454.db2.gz AAWOQJIXWJIIMF-VHSXEESVSA-N 1 0 333.215 3.806 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000809975719 1135907594 /nfs/dbraw/zinc/90/75/94/1135907594.db2.gz SIPIMPVNJOVDJP-STQMWFEESA-N 1 0 333.215 3.949 20 5 EHBDRO CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479551 1136097665 /nfs/dbraw/zinc/09/76/65/1136097665.db2.gz HVRXDBQZIDHSQR-OTYXRUKQSA-N 1 0 335.231 3.788 20 5 EHBDRO COCC1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000811501163 1136100511 /nfs/dbraw/zinc/10/05/11/1136100511.db2.gz UKDQXLKATAOTRN-UHFFFAOYSA-N 1 0 333.215 3.808 20 5 EHBDRO [NH3+]CCN(Cc1cscc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000811506776 1136101205 /nfs/dbraw/zinc/10/12/05/1136101205.db2.gz FMUUXAUPRTXYIE-UHFFFAOYSA-N 1 0 345.346 3.640 20 5 EHBDRO C[N@@H+](Cc1csc2ccccc12)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277922 1136131115 /nfs/dbraw/zinc/13/11/15/1136131115.db2.gz QURRCFRMVAJQAM-KRWDZBQOSA-N 1 0 342.420 3.975 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCCO1 ZINC000338924312 1136180488 /nfs/dbraw/zinc/18/04/88/1136180488.db2.gz HCHNXCVGBPOZOT-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1cnc(Cl)cc1[N+](=O)[O-] ZINC001170679913 1136219239 /nfs/dbraw/zinc/21/92/39/1136219239.db2.gz LSWBWDKQCQPFEU-JTQLQIEISA-N 1 0 343.774 3.516 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC000850426979 1136256878 /nfs/dbraw/zinc/25/68/78/1136256878.db2.gz JHUHGMUYAYWTPT-CHWSQXEVSA-N 1 0 330.384 3.508 20 5 EHBDRO CC(C)[C@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553736 1136284219 /nfs/dbraw/zinc/28/42/19/1136284219.db2.gz CACWDPNOHAMSAL-AGRHKRQWSA-N 1 0 343.427 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000813792392 1136362678 /nfs/dbraw/zinc/36/26/78/1136362678.db2.gz XYPWABKATJMUGU-CQSZACIVSA-N 1 0 349.793 3.756 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CCC1 ZINC000814169681 1136415071 /nfs/dbraw/zinc/41/50/71/1136415071.db2.gz LTMUQGJSDHFFNG-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000852034818 1136428622 /nfs/dbraw/zinc/42/86/22/1136428622.db2.gz JFHDHUVTBJXUFX-ZWKOTPCHSA-N 1 0 332.375 3.582 20 5 EHBDRO CCC[N@H+](CCc1cccc(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585582 1136448431 /nfs/dbraw/zinc/44/84/31/1136448431.db2.gz XDVCVSYQFOTDKI-LJQANCHMSA-N 1 0 346.402 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000776586827 1136449033 /nfs/dbraw/zinc/44/90/33/1136449033.db2.gz ISDGNUZBTPJYCA-PMACEKPBSA-N 1 0 338.407 3.780 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591981 1136452978 /nfs/dbraw/zinc/45/29/78/1136452978.db2.gz NPISFMFRSPXBHL-CCKFTAQKSA-N 1 0 326.396 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)CN2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593021 1136453557 /nfs/dbraw/zinc/45/35/57/1136453557.db2.gz TUKXPSXDBHFJJB-DLBZAZTESA-N 1 0 332.787 3.729 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc2c(c1)CCCO2 ZINC000852779276 1136485548 /nfs/dbraw/zinc/48/55/48/1136485548.db2.gz BHISHSLEVMGEEJ-GFCCVEGCSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814641790 1136488546 /nfs/dbraw/zinc/48/85/46/1136488546.db2.gz LEGZXNDZYLDQDG-IEBWSBKVSA-N 1 0 326.396 3.508 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(OCc2cccc3c2CC[NH2+]C3)cc1F ZINC000853135816 1136513463 /nfs/dbraw/zinc/51/34/63/1136513463.db2.gz JBAXNJPMBCZNFN-UHFFFAOYSA-N 1 0 336.750 3.612 20 5 EHBDRO CC1(C)CC(Nc2nc3ccc([N+](=O)[O-])cc3s2)CC(C)(C)[NH2+]1 ZINC000111193436 1136520415 /nfs/dbraw/zinc/52/04/15/1136520415.db2.gz HTHYSMRIJULPNN-UHFFFAOYSA-N 1 0 334.445 3.926 20 5 EHBDRO O=[N+]([O-])c1cn(C[N@H+](C2CC2)C2CCCCC2)nc1-c1ccccn1 ZINC000853489226 1136537208 /nfs/dbraw/zinc/53/72/08/1136537208.db2.gz KQQAXVYKNIYATQ-UHFFFAOYSA-N 1 0 341.415 3.608 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815628430 1136621219 /nfs/dbraw/zinc/62/12/19/1136621219.db2.gz ZTPPGAJJNSBHIO-CRFBAAHOSA-N 1 0 341.411 3.748 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815628431 1136621531 /nfs/dbraw/zinc/62/15/31/1136621531.db2.gz ZTPPGAJJNSBHIO-NRXGSXMXSA-N 1 0 341.411 3.748 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776752135 1136634303 /nfs/dbraw/zinc/63/43/03/1136634303.db2.gz ISUITBWLGWBVMB-FMKPAKJESA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@H]2C2CC2)cc1Cl ZINC000816656711 1136745251 /nfs/dbraw/zinc/74/52/51/1136745251.db2.gz BJKUDHNADSIPBZ-MRXNPFEDSA-N 1 0 336.819 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3ccsc3)CC2)cc1 ZINC000776882661 1136773191 /nfs/dbraw/zinc/77/31/91/1136773191.db2.gz PVUXBNYOTRKKTO-QGZVFWFLSA-N 1 0 332.425 3.569 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000114508386 1136799463 /nfs/dbraw/zinc/79/94/63/1136799463.db2.gz HVUFHKABTXRLFS-IBGZPJMESA-N 1 0 328.412 3.716 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H]2CC23CCSCC3)c1 ZINC000817411817 1136806298 /nfs/dbraw/zinc/80/62/98/1136806298.db2.gz WCVMYEASLZWIHV-GFCCVEGCSA-N 1 0 326.849 3.871 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CCCCCc2ccccc2)c1 ZINC000819011076 1136900175 /nfs/dbraw/zinc/90/01/75/1136900175.db2.gz LEJRNZGQTAQJET-IBGZPJMESA-N 1 0 328.412 3.631 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(Cc3ccccc3)CCC2)cc1 ZINC000819152407 1136914536 /nfs/dbraw/zinc/91/45/36/1136914536.db2.gz SPCZIUOBCKZGRH-LJQANCHMSA-N 1 0 340.423 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333737 1136932305 /nfs/dbraw/zinc/93/23/05/1136932305.db2.gz REAOCOISQOVEML-QZTJIDSGSA-N 1 0 348.349 3.574 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC1CC1 ZINC000858169994 1136946157 /nfs/dbraw/zinc/94/61/57/1136946157.db2.gz HFUMJVSYQWKYJL-ZDUSSCGKSA-N 1 0 342.395 3.995 20 5 EHBDRO C[C@@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858483981 1136972087 /nfs/dbraw/zinc/97/20/87/1136972087.db2.gz GBNVLZCAUWCQOS-XIKOKIGWSA-N 1 0 326.400 3.764 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(OC)c1 ZINC000858502106 1136974010 /nfs/dbraw/zinc/97/40/10/1136974010.db2.gz HGBYBFSTPBIWAK-RYUDHWBXSA-N 1 0 345.399 3.606 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339015954 1136996099 /nfs/dbraw/zinc/99/60/99/1136996099.db2.gz YOGKFQOFRKQYIP-CQSZACIVSA-N 1 0 345.365 3.530 20 5 EHBDRO Cc1cccc([C@@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)c1 ZINC000859849265 1137034413 /nfs/dbraw/zinc/03/44/13/1137034413.db2.gz BXNSLGONYRIQRN-OALUTQOASA-N 1 0 328.412 3.924 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccco1)[NH+]1CCCC1 ZINC000266029647 1137111747 /nfs/dbraw/zinc/11/17/47/1137111747.db2.gz RRGOJWLVGDKFQO-QGZVFWFLSA-N 1 0 345.399 3.583 20 5 EHBDRO CC[C@H](CCc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000863572003 1137192279 /nfs/dbraw/zinc/19/22/79/1137192279.db2.gz IIYLIVJEZJGWJE-MJGOQNOKSA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1c(F)cc([N+](=O)[O-])cc1-n1c2ccccc2c2c1C[C@@H]([NH3+])CC2 ZINC001171099947 1137196210 /nfs/dbraw/zinc/19/62/10/1137196210.db2.gz QXHWQVASUQBFNH-LBPRGKRZSA-N 1 0 339.370 3.802 20 5 EHBDRO C[C@H](CSc1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359985 1137215317 /nfs/dbraw/zinc/21/53/17/1137215317.db2.gz LXGJXYNJJPNODU-RDTXWAMCSA-N 1 0 346.452 3.741 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3cnc(Cl)cc3[N+](=O)[O-])c2c1 ZINC001171169192 1137280012 /nfs/dbraw/zinc/28/00/12/1137280012.db2.gz XRCRKQKQYFHCFN-NSHDSACASA-N 1 0 344.802 3.785 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(Cl)cc1N1CCC([NH+]2CCCCC2)CC1 ZINC000845468041 1137293844 /nfs/dbraw/zinc/29/38/44/1137293844.db2.gz HYAWRFTYOPHFSG-UHFFFAOYSA-N 1 0 341.814 3.842 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCSCCC(F)(F)F ZINC000865788506 1137312053 /nfs/dbraw/zinc/31/20/53/1137312053.db2.gz TWNTUVOUGSORGL-HWKANZROSA-N 1 0 334.363 3.883 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@](C)(O)c1ccccc1 ZINC000846035342 1137328385 /nfs/dbraw/zinc/32/83/85/1137328385.db2.gz GSQXXGWVKYLMJJ-SJKOYZFVSA-N 1 0 334.803 3.634 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000866259741 1137340166 /nfs/dbraw/zinc/34/01/66/1137340166.db2.gz PHUCROUBHGXIQC-QWHCGFSZSA-N 1 0 332.375 3.591 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000866389978 1137351058 /nfs/dbraw/zinc/35/10/58/1137351058.db2.gz JWYHTPMCZFBKIY-APPDUMDISA-N 1 0 330.359 3.648 20 5 EHBDRO COC(=O)c1csc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000866541338 1137363197 /nfs/dbraw/zinc/36/31/97/1137363197.db2.gz YPZPMXKXUUYBMC-NSHDSACASA-N 1 0 334.397 3.602 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866610984 1137368996 /nfs/dbraw/zinc/36/89/96/1137368996.db2.gz WZNNNRSDGCGVAD-IRUJWGPZSA-N 1 0 329.322 3.725 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1cccc2c1OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000772987891 1137419803 /nfs/dbraw/zinc/41/98/03/1137419803.db2.gz ZIIWMCLNGOJYNY-QGZVFWFLSA-N 1 0 342.395 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CCCC(F)(F)C3)CC2)cc1 ZINC000773080844 1137463665 /nfs/dbraw/zinc/46/36/65/1137463665.db2.gz NUHHPVADYJHJAQ-AWEZNQCLSA-N 1 0 339.386 3.731 20 5 EHBDRO C[C@H](NC1CC[NH+](C2CCCC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038887 1137566908 /nfs/dbraw/zinc/56/69/08/1137566908.db2.gz ATSZUPOHPIZXIN-ZDUSSCGKSA-N 1 0 335.423 3.792 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041579 1137567138 /nfs/dbraw/zinc/56/71/38/1137567138.db2.gz UPUAGODCBQQEDP-JHJVBQTASA-N 1 0 326.462 3.764 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000872044048 1137567427 /nfs/dbraw/zinc/56/74/27/1137567427.db2.gz PUECNKNZWYUBFG-ZCDTZLGTSA-N 1 0 336.457 3.925 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1OCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872046286 1137567532 /nfs/dbraw/zinc/56/75/32/1137567532.db2.gz WDSIRNRBANZDAJ-PXAZEXFGSA-N 1 0 330.359 3.699 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1cccc(F)c1 ZINC000872048736 1137567756 /nfs/dbraw/zinc/56/77/56/1137567756.db2.gz LAWKYIBGSUKNQU-RVPKQNPDSA-N 1 0 336.338 3.646 20 5 EHBDRO C[C@H]([NH2+]CCSCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872054513 1137568318 /nfs/dbraw/zinc/56/83/18/1137568318.db2.gz XLBGWXYLVQUSMH-QMMMGPOBSA-N 1 0 326.315 3.680 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1scnc1C ZINC000872074809 1137569859 /nfs/dbraw/zinc/56/98/59/1137569859.db2.gz HYPLLRRUAUYWEV-SNVBAGLBSA-N 1 0 337.470 3.975 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ncc(Cl)s1)C1CC1 ZINC000872115954 1137572114 /nfs/dbraw/zinc/57/21/14/1137572114.db2.gz NLFPYQMNBIHTRU-GFCCVEGCSA-N 1 0 337.832 3.816 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000872127158 1137572988 /nfs/dbraw/zinc/57/29/88/1137572988.db2.gz XIWGPWMQKZDHDE-JHJVBQTASA-N 1 0 332.425 3.745 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000872244552 1137576304 /nfs/dbraw/zinc/57/63/04/1137576304.db2.gz NMCIECPKMHLUQI-GOSISDBHSA-N 1 0 344.411 3.595 20 5 EHBDRO CC(=O)c1cc(N2CCC(C)([NH+]3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000872665417 1137582663 /nfs/dbraw/zinc/58/26/63/1137582663.db2.gz XPIKUAJIGSFMPM-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO COCCOc1cccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873014392 1137588147 /nfs/dbraw/zinc/58/81/47/1137588147.db2.gz QBTALIDHMNVJQZ-UHFFFAOYSA-N 1 0 344.411 3.527 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873132791 1137590956 /nfs/dbraw/zinc/59/09/56/1137590956.db2.gz GNFFYZWNRIXGFQ-INIZCTEOSA-N 1 0 342.395 3.834 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000873183732 1137592969 /nfs/dbraw/zinc/59/29/69/1137592969.db2.gz DYTZYWKUFLBWMQ-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1c2ccccc2oc1[C@@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876944489 1137665887 /nfs/dbraw/zinc/66/58/87/1137665887.db2.gz MGCQGRHTMRBYLJ-IYXRBSQSSA-N 1 0 340.383 3.900 20 5 EHBDRO CC(C)(C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(Cl)c1 ZINC000876989249 1137667087 /nfs/dbraw/zinc/66/70/87/1137667087.db2.gz WKYXWBHXBHBYSW-UHFFFAOYSA-N 1 0 348.834 3.716 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCC3(CCCC3)CC2)o1 ZINC000878121522 1137703551 /nfs/dbraw/zinc/70/35/51/1137703551.db2.gz KZBQFAAHZDQIOE-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135254 1137703986 /nfs/dbraw/zinc/70/39/86/1137703986.db2.gz VXWHCXYCNFINFV-IPYPFGDCSA-N 1 0 342.399 3.798 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419433 1137715082 /nfs/dbraw/zinc/71/50/82/1137715082.db2.gz FDTGRPKWLDKNLW-HIFRSBDPSA-N 1 0 344.415 3.949 20 5 EHBDRO CC(C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCCO1 ZINC000879405752 1137746805 /nfs/dbraw/zinc/74/68/05/1137746805.db2.gz HJBWGVNMZLFKPX-INIZCTEOSA-N 1 0 345.399 3.687 20 5 EHBDRO Cc1cncc([C@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000879747630 1137757720 /nfs/dbraw/zinc/75/77/20/1137757720.db2.gz OIJNAAZFNUTKSR-MRXNPFEDSA-N 1 0 327.384 3.514 20 5 EHBDRO Cc1csc([C@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880012044 1137765485 /nfs/dbraw/zinc/76/54/85/1137765485.db2.gz XOKDAKRRSGSBFS-AWEZNQCLSA-N 1 0 347.440 3.618 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000129715259 1137828852 /nfs/dbraw/zinc/82/88/52/1137828852.db2.gz GIXHIOYAQBUWPK-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000882962854 1137839927 /nfs/dbraw/zinc/83/99/27/1137839927.db2.gz GEUUUPDWGWIPHL-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNCc1ccc(C)nc1Cl ZINC000883291359 1137852964 /nfs/dbraw/zinc/85/29/64/1137852964.db2.gz BMOBAJCYMSLLGK-UHFFFAOYSA-N 1 0 335.791 3.640 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccco1 ZINC000131451929 1137853542 /nfs/dbraw/zinc/85/35/42/1137853542.db2.gz CFTOOPLGHJGZHX-KRWDZBQOSA-N 1 0 331.416 3.669 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2nc3ccccc3[nH]2)CC1 ZINC000109763892 1137897243 /nfs/dbraw/zinc/89/72/43/1137897243.db2.gz LQFXJIKHAPFRNV-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(NC(=O)C2CC2)cc1 ZINC000120102993 1137946643 /nfs/dbraw/zinc/94/66/43/1137946643.db2.gz VQKNPWVWOKFUSO-CYBMUJFWSA-N 1 0 339.395 3.794 20 5 EHBDRO CC[C@H]([NH2+][C@@H](CCO)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120282488 1137948029 /nfs/dbraw/zinc/94/80/29/1137948029.db2.gz RQHRFURZEFBQPP-OALUTQOASA-N 1 0 344.411 3.768 20 5 EHBDRO CC(=O)NCCC[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000121309000 1137956820 /nfs/dbraw/zinc/95/68/20/1137956820.db2.gz QRLODFNLVUQISN-LBPRGKRZSA-N 1 0 347.440 3.500 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000885969512 1138029281 /nfs/dbraw/zinc/02/92/81/1138029281.db2.gz UQGDZZJAFQVBKN-HNNXBMFYSA-N 1 0 334.416 3.575 20 5 EHBDRO C[C@@H]1SCCN(Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886014439 1138032234 /nfs/dbraw/zinc/03/22/34/1138032234.db2.gz HQRKTEWTVFTWIH-BBRMVZONSA-N 1 0 329.425 3.668 20 5 EHBDRO CC1CCC([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000072803691 1138107807 /nfs/dbraw/zinc/10/78/07/1138107807.db2.gz ONMLXQBKQMXDHM-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CN(Cc1csc([N+](=O)[O-])c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000074322121 1138119868 /nfs/dbraw/zinc/11/98/68/1138119868.db2.gz FUUCATGOEQUAKL-UHFFFAOYSA-N 1 0 345.468 3.753 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000089512644 1138200526 /nfs/dbraw/zinc/20/05/26/1138200526.db2.gz RTQCWPMBPQRZLC-MAUKXSAKSA-N 1 0 326.396 3.852 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CC[NH+](C2CCCCC2)CC1 ZINC000126484335 1138331771 /nfs/dbraw/zinc/33/17/71/1138331771.db2.gz SAKRFGZOYLPXFL-SOFGYWHQSA-N 1 0 329.444 3.558 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000126818902 1138339864 /nfs/dbraw/zinc/33/98/64/1138339864.db2.gz UULBELXAWSEJFO-HNNXBMFYSA-N 1 0 342.443 3.995 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000337321996 1138532219 /nfs/dbraw/zinc/53/22/19/1138532219.db2.gz ZRBRWGUDXPGIQE-SJLPKXTDSA-N 1 0 325.412 3.848 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC3CCSCC3)cs2)c1 ZINC000264937911 1138680905 /nfs/dbraw/zinc/68/09/05/1138680905.db2.gz DVOJVDYKMRXDAM-UHFFFAOYSA-N 1 0 349.481 3.951 20 5 EHBDRO O=c1cc(C[NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)c2c(ccc3ccccc32)o1 ZINC000151136404 1139011359 /nfs/dbraw/zinc/01/13/59/1139011359.db2.gz UQYFHDQTWLIEMA-QRVBRYPASA-N 1 0 349.430 3.993 20 5 EHBDRO Cc1ccc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)cc1[N+](=O)[O-] ZINC000174390467 1139418139 /nfs/dbraw/zinc/41/81/39/1139418139.db2.gz ZWNWXXWJWOHGON-UHFFFAOYSA-N 1 0 344.386 3.838 20 5 EHBDRO C[C@@H](c1ccc([S@](C)=O)cc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384689 1139487630 /nfs/dbraw/zinc/48/76/30/1139487630.db2.gz KDLXXJFYCIOTSV-BSEYFRJRSA-N 1 0 346.452 3.568 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000177882026 1139650557 /nfs/dbraw/zinc/65/05/57/1139650557.db2.gz JFNWUTCNRIJLGJ-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178648751 1139709046 /nfs/dbraw/zinc/70/90/46/1139709046.db2.gz PIWPKPIARFUJNT-QAPCUYQASA-N 1 0 328.412 3.720 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000178689675 1139712270 /nfs/dbraw/zinc/71/22/70/1139712270.db2.gz DIPWNNQXAKAFNW-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181818094 1139933653 /nfs/dbraw/zinc/93/36/53/1139933653.db2.gz WJFCHKNBUAAVJF-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004610 1139944766 /nfs/dbraw/zinc/94/47/66/1139944766.db2.gz LVMMPFBQSBWWDZ-CHWSQXEVSA-N 1 0 327.384 3.965 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000182911818 1140000199 /nfs/dbraw/zinc/00/01/99/1140000199.db2.gz DJQBSAGIKSFGQZ-RLFYNMQTSA-N 1 0 328.416 3.744 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1nccs1 ZINC000186749605 1140220265 /nfs/dbraw/zinc/22/02/65/1140220265.db2.gz JTFXKNWRNZKHDK-DOMZBBRYSA-N 1 0 331.441 3.766 20 5 EHBDRO COCC1=CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000187620597 1140264971 /nfs/dbraw/zinc/26/49/71/1140264971.db2.gz JFEAFHOYFMHGBJ-UHFFFAOYSA-N 1 0 328.368 3.633 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000266489168 1140693681 /nfs/dbraw/zinc/69/36/81/1140693681.db2.gz RZVXFNKPFUNTEN-HNNXBMFYSA-N 1 0 325.412 3.914 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776816 1140989466 /nfs/dbraw/zinc/98/94/66/1140989466.db2.gz WBSPZSVYHIVADF-APPDUMDISA-N 1 0 336.338 3.566 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000269386764 1141101999 /nfs/dbraw/zinc/10/19/99/1141101999.db2.gz WKCQGZFHHTUAMZ-HIFRSBDPSA-N 1 0 336.457 3.690 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000270372094 1141213798 /nfs/dbraw/zinc/21/37/98/1141213798.db2.gz KDVCMDKXOUKMLN-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000271129503 1141312251 /nfs/dbraw/zinc/31/22/51/1141312251.db2.gz LLILJUMXISVDLZ-KUHUBIRLSA-N 1 0 344.411 3.552 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1nccs1 ZINC000271163903 1141315788 /nfs/dbraw/zinc/31/57/88/1141315788.db2.gz SOIHMDAZAKXBMN-GFCCVEGCSA-N 1 0 337.470 3.754 20 5 EHBDRO CCC1(O)CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000271167790 1141317347 /nfs/dbraw/zinc/31/73/47/1141317347.db2.gz CULLKDMFMYQULQ-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCSCC1 ZINC000271455678 1141371622 /nfs/dbraw/zinc/37/16/22/1141371622.db2.gz JDCAGZAKOHBWOD-GFCCVEGCSA-N 1 0 326.487 3.951 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000359872812 201114531 /nfs/dbraw/zinc/11/45/31/201114531.db2.gz PRWIPTCMUMLVSI-IEBWSBKVSA-N 1 0 326.396 3.771 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000359872818 201114610 /nfs/dbraw/zinc/11/46/10/201114610.db2.gz PRWIPTCMUMLVSI-MJGOQNOKSA-N 1 0 326.396 3.771 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCC[C@@H](C)C1 ZINC000195666957 241032507 /nfs/dbraw/zinc/03/25/07/241032507.db2.gz KYXJZOWUMBHMGD-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO CC[NH+](CC)C1CCN(c2nc(Cl)c(Cl)cc2[N+](=O)[O-])CC1 ZINC001165052802 722001777 /nfs/dbraw/zinc/00/17/77/722001777.db2.gz FNYBCOGEKQRTOV-UHFFFAOYSA-N 1 0 347.246 3.607 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccccc1[N+](=O)[O-] ZINC000339408841 1014372624 /nfs/dbraw/zinc/37/26/24/1014372624.db2.gz DTSGLDSPVLBPST-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1cccc(F)c1)N(C)C ZINC000449062941 1032107293 /nfs/dbraw/zinc/10/72/93/1032107293.db2.gz KZMMOTIOEWSUTI-LIRRHRJNSA-N 1 0 345.418 3.557 20 5 EHBDRO CC(=O)Nc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000127058131 1015210181 /nfs/dbraw/zinc/21/01/81/1015210181.db2.gz GLLAIELXYSRBSZ-UHFFFAOYSA-N 1 0 339.395 3.718 20 5 EHBDRO CC[NH+](CC)Cc1ccc(-c2nc(-c3ccc([N+](=O)[O-])cc3)no2)o1 ZINC000609474244 1015756018 /nfs/dbraw/zinc/75/60/18/1015756018.db2.gz GXVZHHIWPRQEGJ-UHFFFAOYSA-N 1 0 342.355 3.747 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)Cc1cn(C)nc1C(F)(F)F ZINC000155291502 1016417880 /nfs/dbraw/zinc/41/78/80/1016417880.db2.gz KBVRERDOXBYPDY-SNVBAGLBSA-N 1 0 342.321 3.540 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000175716516 1016897609 /nfs/dbraw/zinc/89/76/09/1016897609.db2.gz MRCVOGZYVBWHRL-OAHLLOKOSA-N 1 0 345.443 3.805 20 5 EHBDRO COC1([C@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC000414523843 1016954840 /nfs/dbraw/zinc/95/48/40/1016954840.db2.gz JDFXTCRAUBDNOY-ZDUSSCGKSA-N 1 0 330.384 3.902 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449168832 1032262234 /nfs/dbraw/zinc/26/22/34/1032262234.db2.gz BQQHQBULUFVTJH-GUYCJALGSA-N 1 0 332.375 3.642 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449188185 1032283318 /nfs/dbraw/zinc/28/33/18/1032283318.db2.gz NOXGTUICMSMXSI-DYVFJYSZSA-N 1 0 326.396 3.812 20 5 EHBDRO COCC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000278750298 1032338032 /nfs/dbraw/zinc/33/80/32/1032338032.db2.gz NXLKRPVWGIRNRB-SJORKVTESA-N 1 0 330.384 3.933 20 5 EHBDRO Cn1cc([C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430306 1032358771 /nfs/dbraw/zinc/35/87/71/1032358771.db2.gz VALJVPTZZLATLY-LKUPDRCFSA-N 1 0 328.416 3.719 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000459656599 1032382085 /nfs/dbraw/zinc/38/20/85/1032382085.db2.gz LKEWUUKLZQZMAS-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CC(C)([NH2+]Cc1ccnn1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449244969 1032383090 /nfs/dbraw/zinc/38/30/90/1032383090.db2.gz XFLZEZGEHQMQDL-UHFFFAOYSA-N 1 0 328.416 3.931 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccsc1 ZINC000026720213 1032395672 /nfs/dbraw/zinc/39/56/72/1032395672.db2.gz OIEWVVZTFXLRCG-KRWDZBQOSA-N 1 0 342.424 3.919 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000449287680 1032404605 /nfs/dbraw/zinc/40/46/05/1032404605.db2.gz XMHOWFQNZBJAIP-QSFXBCCZSA-N 1 0 340.423 3.893 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000449288418 1032406421 /nfs/dbraw/zinc/40/64/21/1032406421.db2.gz ZUHNWHBRFYTESK-XQQFMLRXSA-N 1 0 331.420 3.508 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC(C)(C)C1 ZINC000459735211 1032438768 /nfs/dbraw/zinc/43/87/68/1032438768.db2.gz DMBOGYCVDTWJMM-UHFFFAOYSA-N 1 0 329.400 3.913 20 5 EHBDRO C[C@H]([NH2+]C1CCN(C(=O)CC(C)(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000449347445 1032462979 /nfs/dbraw/zinc/46/29/79/1032462979.db2.gz HHOMGAWXUZTNIL-AWEZNQCLSA-N 1 0 347.459 3.673 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000449453418 1032570409 /nfs/dbraw/zinc/57/04/09/1032570409.db2.gz MVZABNRCWVNIBJ-FJTFPGJYSA-N 1 0 330.428 3.624 20 5 EHBDRO Cc1c(C[NH2+]C[C@H]2CCN(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000602003372 1032589914 /nfs/dbraw/zinc/58/99/14/1032589914.db2.gz JDYHSUBATLWAJD-MRXNPFEDSA-N 1 0 325.412 3.519 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000449478755 1032601266 /nfs/dbraw/zinc/60/12/66/1032601266.db2.gz KYZUVZMXIAMZGX-IUYQLWOBSA-N 1 0 330.428 3.937 20 5 EHBDRO CO[C@](C)(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449484540 1032635040 /nfs/dbraw/zinc/63/50/40/1032635040.db2.gz MTGPUWAZPZPPKZ-LHUXKHBRSA-N 1 0 326.396 3.759 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449488619 1032647288 /nfs/dbraw/zinc/64/72/88/1032647288.db2.gz JFKKNABNVAFHEA-QFBILLFUSA-N 1 0 339.439 3.842 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680410 1032655977 /nfs/dbraw/zinc/65/59/77/1032655977.db2.gz UYUQMSWONFHLRB-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO C[NH2+]C[C@H]1CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414662066 1017112216 /nfs/dbraw/zinc/11/22/16/1017112216.db2.gz PUPSBKMJTJXKCM-CYBMUJFWSA-N 1 0 349.818 3.692 20 5 EHBDRO O=C(C[C@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000177392072 1017661335 /nfs/dbraw/zinc/66/13/35/1017661335.db2.gz HUSQSINEHIXVCK-OAHLLOKOSA-N 1 0 330.409 3.894 20 5 EHBDRO COC(=O)[C@H](C)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000177415267 1017665784 /nfs/dbraw/zinc/66/57/84/1017665784.db2.gz DAZLGBNQFLQYAC-KDOFPFPSSA-N 1 0 342.395 3.543 20 5 EHBDRO COc1cc(NC[C@H](c2ccsc2)[NH+](C)C)c([N+](=O)[O-])cc1F ZINC000343842141 1017675345 /nfs/dbraw/zinc/67/53/45/1017675345.db2.gz KCICLGTZMLNBAV-CQSZACIVSA-N 1 0 339.392 3.519 20 5 EHBDRO CC1CCC(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236781627 1018215636 /nfs/dbraw/zinc/21/56/36/1018215636.db2.gz UCSOTBMWALORNG-UHFFFAOYSA-N 1 0 342.443 3.911 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3nc[nH]c3C2)c2ccccc2)c1 ZINC000377799746 1018394514 /nfs/dbraw/zinc/39/45/14/1018394514.db2.gz YWSRMZCRZGKJLG-JXFKEZNVSA-N 1 0 348.406 3.554 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000545418693 1018534139 /nfs/dbraw/zinc/53/41/39/1018534139.db2.gz PVRXWCUZNLVWMK-ZDUSSCGKSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1nccc([C@@H]2CCC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368003 1018535650 /nfs/dbraw/zinc/53/56/50/1018535650.db2.gz AQKGNPWQJAHLQC-UKRRQHHQSA-N 1 0 326.400 3.634 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000336970637 1018582544 /nfs/dbraw/zinc/58/25/44/1018582544.db2.gz OPXYFUMUXOSQLC-KRWDZBQOSA-N 1 0 339.395 3.761 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000064915940 1018715304 /nfs/dbraw/zinc/71/53/04/1018715304.db2.gz WLQJUULOZPGUBZ-UKRRQHHQSA-N 1 0 329.375 3.981 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1F ZINC000594019604 1032793692 /nfs/dbraw/zinc/79/36/92/1032793692.db2.gz PDMROAVNMFOXHF-MRXNPFEDSA-N 1 0 345.374 3.722 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2NC1CC[NH+](C2CCCC2)CC1 ZINC000580345453 1019120574 /nfs/dbraw/zinc/12/05/74/1019120574.db2.gz JHKWGCYYRXHJTR-GOSISDBHSA-N 1 0 329.444 3.579 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[NH2+]C34CCCC4)o2)cc1 ZINC000592438462 1032845033 /nfs/dbraw/zinc/84/50/33/1032845033.db2.gz MQBHCDSLYBNNGV-GOSISDBHSA-N 1 0 341.411 3.619 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182829997 1019758337 /nfs/dbraw/zinc/75/83/37/1019758337.db2.gz HJXJVCGQFUZNQS-KGLIPLIRSA-N 1 0 334.416 3.628 20 5 EHBDRO CC(C)c1ccc(CNC[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000513641966 1019897915 /nfs/dbraw/zinc/89/79/15/1019897915.db2.gz CDTJHQQRWAMGLU-INIZCTEOSA-N 1 0 333.476 3.930 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000513679181 1019942756 /nfs/dbraw/zinc/94/27/56/1019942756.db2.gz VMGFESNFIMIZBN-CYBMUJFWSA-N 1 0 344.411 3.641 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)C2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000275983572 1020017701 /nfs/dbraw/zinc/01/77/01/1020017701.db2.gz YLYHFEDHXGYNFB-UHFFFAOYSA-N 1 0 347.459 3.663 20 5 EHBDRO CC(C)c1nc([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000121248550 1020036233 /nfs/dbraw/zinc/03/62/33/1020036233.db2.gz AFKGOHYZDAVLSV-LBPRGKRZSA-N 1 0 335.429 3.904 20 5 EHBDRO C[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000594046756 1032880909 /nfs/dbraw/zinc/88/09/09/1032880909.db2.gz YMXNZOVFSXOVKS-LBPRGKRZSA-N 1 0 328.359 3.777 20 5 EHBDRO C[N@H+](CCOc1ccccc1F)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000761253619 1032887367 /nfs/dbraw/zinc/88/73/67/1032887367.db2.gz NWIUGIDJIWTLGP-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO C[C@@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000183186666 1020542539 /nfs/dbraw/zinc/54/25/39/1020542539.db2.gz BPFDIQXJBPXMOY-ZMSDIMECSA-N 1 0 331.460 3.898 20 5 EHBDRO CC[N@H+](C)Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000126319639 1020570877 /nfs/dbraw/zinc/57/08/77/1020570877.db2.gz DQOVZSOHHXTUCI-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000360875589 1020846303 /nfs/dbraw/zinc/84/63/03/1020846303.db2.gz XDGKIXCRSZLXRC-YOEHRIQHSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419754 1021090477 /nfs/dbraw/zinc/09/04/77/1021090477.db2.gz VKNPKYQIIMLSQJ-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCN(C4CC4)CC3)s2)cc1 ZINC000506494842 1021181623 /nfs/dbraw/zinc/18/16/23/1021181623.db2.gz IQIBAEJNMYJCSX-UHFFFAOYSA-N 1 0 343.452 3.603 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000090843965 1021213198 /nfs/dbraw/zinc/21/31/98/1021213198.db2.gz PXHKHZGMRMXUJL-KSSFIOAISA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426299878 1021214799 /nfs/dbraw/zinc/21/47/99/1021214799.db2.gz ZMKVTYDRORUUKR-UKRRQHHQSA-N 1 0 329.375 3.663 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426299876 1021214896 /nfs/dbraw/zinc/21/48/96/1021214896.db2.gz ZMKVTYDRORUUKR-DZGCQCFKSA-N 1 0 329.375 3.663 20 5 EHBDRO COc1ccc(OCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000516295011 1021262219 /nfs/dbraw/zinc/26/22/19/1021262219.db2.gz VJEMKBDMTHUEJE-UHFFFAOYSA-N 1 0 344.411 3.893 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000519751470 1021658401 /nfs/dbraw/zinc/65/84/01/1021658401.db2.gz XOJUQFPOLQUWNW-DZGCQCFKSA-N 1 0 326.396 3.730 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H]4CCC[C@H]43)o2)c1 ZINC000426485342 1021689756 /nfs/dbraw/zinc/68/97/56/1021689756.db2.gz JDJHGYABTPFXGD-CZUORRHYSA-N 1 0 327.384 3.667 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602581382 1032998953 /nfs/dbraw/zinc/99/89/53/1032998953.db2.gz JEHVEEHNNPNJEW-ZFWWWQNUSA-N 1 0 346.349 3.907 20 5 EHBDRO COc1c(O)ccc(CN(C)Cc2ccc(Cl)s2)c1[N+](=O)[O-] ZINC000891499102 1021769521 /nfs/dbraw/zinc/76/95/21/1021769521.db2.gz MNJGTFLOCHIQMR-UHFFFAOYSA-N 1 0 342.804 3.656 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178238421 1022251846 /nfs/dbraw/zinc/25/18/46/1022251846.db2.gz YZDNLWJKJQPGAV-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO CCc1ccc([C@H](NC[C@H](C)C[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000425941608 1022326030 /nfs/dbraw/zinc/32/60/30/1022326030.db2.gz CBYDUJPNXICIAY-IFXJQAMLSA-N 1 0 345.443 3.627 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000175985421 1022360390 /nfs/dbraw/zinc/36/03/90/1022360390.db2.gz DLGDTTMWEKXXGT-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(O)c1 ZINC000126657324 1022370457 /nfs/dbraw/zinc/37/04/57/1022370457.db2.gz BHKAXBSZIVPEOO-AWEZNQCLSA-N 1 0 341.411 3.620 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468234 1033054489 /nfs/dbraw/zinc/05/44/89/1033054489.db2.gz UUHSYJINJVXCEZ-YPMHNXCESA-N 1 0 339.823 3.697 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc3nc(C)ccc3c2)cc1[N+](=O)[O-] ZINC000438183324 1022446910 /nfs/dbraw/zinc/44/69/10/1022446910.db2.gz JADAWGPJWCUATH-UHFFFAOYSA-N 1 0 337.379 3.750 20 5 EHBDRO C[C@@]1(CCCO)CCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668128 1033064154 /nfs/dbraw/zinc/06/41/54/1033064154.db2.gz UCMCBYREOSOMFR-HNNXBMFYSA-N 1 0 346.349 3.741 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CO)CCCCC2)o1 ZINC000610583472 1022809179 /nfs/dbraw/zinc/80/91/79/1022809179.db2.gz VFNNMPXBOGMJNL-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000438569387 1022822384 /nfs/dbraw/zinc/82/23/84/1022822384.db2.gz NJCXLOVDCMEOLW-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Nc2ccccn2)CC1 ZINC000536368841 1023069885 /nfs/dbraw/zinc/06/98/85/1023069885.db2.gz ICZMHRBCTFISTO-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000509574105 1023071978 /nfs/dbraw/zinc/07/19/78/1023071978.db2.gz IWPIYYLJBULQKD-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000506443609 1023154778 /nfs/dbraw/zinc/15/47/78/1023154778.db2.gz MHADDOPQRMYUNC-KRWDZBQOSA-N 1 0 343.427 3.771 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507154995 1023161506 /nfs/dbraw/zinc/16/15/06/1023161506.db2.gz MMNKLIZCAUVSKQ-UHFFFAOYSA-N 1 0 325.412 3.825 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cccc2c1OCO2 ZINC000507176736 1023163930 /nfs/dbraw/zinc/16/39/30/1023163930.db2.gz ZBTFDXVDAYIYBX-UHFFFAOYSA-N 1 0 328.368 3.734 20 5 EHBDRO COCC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000507176082 1023175896 /nfs/dbraw/zinc/17/58/96/1023175896.db2.gz XGEKPJKEUHEIST-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936240 1023180441 /nfs/dbraw/zinc/18/04/41/1023180441.db2.gz SGGMYLMGKVJXLQ-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H](C)c1cc2ccccc2o1 ZINC000602758788 1033131137 /nfs/dbraw/zinc/13/11/37/1033131137.db2.gz NQUTWOXSYPWKHH-LBPRGKRZSA-N 1 0 328.372 3.539 20 5 EHBDRO COc1ccc2oc(C[NH2+]CCOc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000535717304 1023590005 /nfs/dbraw/zinc/59/00/05/1023590005.db2.gz OGVYBHPJFMEJHY-UHFFFAOYSA-N 1 0 342.351 3.518 20 5 EHBDRO CCC[C@H]([NH2+]C1CCN(CC(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610806980 1023694543 /nfs/dbraw/zinc/69/45/43/1023694543.db2.gz MGSFSQCYULCMHW-INIZCTEOSA-N 1 0 341.402 3.755 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1COc2c(cccc2OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000610809841 1023701370 /nfs/dbraw/zinc/70/13/70/1023701370.db2.gz VNQRRPSWMYUKQS-NVXWUHKLSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+]Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)CO1 ZINC000897779785 1033172576 /nfs/dbraw/zinc/17/25/76/1033172576.db2.gz AVIWMOWCJGGUIB-VZDIAYEVSA-N 1 0 342.395 3.902 20 5 EHBDRO CCSc1ccc([C@@H](C)[NH2+]CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC000602798483 1033173017 /nfs/dbraw/zinc/17/30/17/1033173017.db2.gz CPFBZLIEUDGIFR-GFCCVEGCSA-N 1 0 334.445 3.563 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1C=C[C@H]2C[C@@H]1CO2 ZINC000896851191 1024043516 /nfs/dbraw/zinc/04/35/16/1024043516.db2.gz RZXVCMADCPPZHN-NDMJEZRESA-N 1 0 343.210 3.582 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC2([C@@H](C)CCO)CCC2)cc1[N+](=O)[O-] ZINC000538446797 1024365249 /nfs/dbraw/zinc/36/52/49/1024365249.db2.gz YMRSVGKWAZSXEU-HNNXBMFYSA-N 1 0 334.460 3.997 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(CN3CC(C4CCC4)C3)cs2)c1 ZINC000520660122 1024372842 /nfs/dbraw/zinc/37/28/42/1024372842.db2.gz FQTHGJLSVSKEGE-UHFFFAOYSA-N 1 0 329.425 3.950 20 5 EHBDRO Cc1noc([C@@H]2CCC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)n1 ZINC000091832828 1024388947 /nfs/dbraw/zinc/38/89/47/1024388947.db2.gz AXDSJGADBYJSJJ-OAHLLOKOSA-N 1 0 344.415 3.789 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](Cc1ccco1)C(C)C ZINC000346301073 1024592910 /nfs/dbraw/zinc/59/29/10/1024592910.db2.gz CJKNYBRLYFNEDU-UHFFFAOYSA-N 1 0 345.399 3.735 20 5 EHBDRO Cc1cc(N2CCC[C@@H]2c2ccnn2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000895720284 1024764876 /nfs/dbraw/zinc/76/48/76/1024764876.db2.gz VHFZOFCXDHPNKX-QGZVFWFLSA-N 1 0 337.383 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425371666 1024894609 /nfs/dbraw/zinc/89/46/09/1024894609.db2.gz LOIXXGCCCVUSCF-MTGFJVSHSA-N 1 0 342.439 3.889 20 5 EHBDRO Cc1cc(N[C@@H](CC[NH+](C)C)c2cccnc2)c(F)cc1[N+](=O)[O-] ZINC000895891527 1024948092 /nfs/dbraw/zinc/94/80/92/1024948092.db2.gz RIVKORPIZNEASV-HNNXBMFYSA-N 1 0 332.379 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310359404 1025131721 /nfs/dbraw/zinc/13/17/21/1025131721.db2.gz JMDZSCXHTSNBFJ-OAHLLOKOSA-N 1 0 329.375 3.668 20 5 EHBDRO Cc1nc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)c(C)o1 ZINC000346824565 1025153061 /nfs/dbraw/zinc/15/30/61/1025153061.db2.gz KMPSMWFDXFAWFG-UHFFFAOYSA-N 1 0 341.367 3.792 20 5 EHBDRO C[C@@H]([NH2+]CCCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173384211 1033271526 /nfs/dbraw/zinc/27/15/26/1033271526.db2.gz SZVXGPWMYKCEOB-CYBMUJFWSA-N 1 0 337.420 3.502 20 5 EHBDRO CC(=O)c1cc(NC2CCC(C)([NH+]3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000896256797 1025287797 /nfs/dbraw/zinc/28/77/97/1025287797.db2.gz ZRVRYJIWDHFOLC-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO COC(=O)[C@H](CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000425470145 1025388039 /nfs/dbraw/zinc/38/80/39/1025388039.db2.gz GAVHKQBOHXKTGI-KBXCAEBGSA-N 1 0 342.395 3.592 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896510122 1025491344 /nfs/dbraw/zinc/49/13/44/1025491344.db2.gz LCOLIIUWMBLGGM-VJBOLBCHSA-N 1 0 328.349 3.968 20 5 EHBDRO CCC1([NH+](C)C)CCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000602988821 1033288428 /nfs/dbraw/zinc/28/84/28/1033288428.db2.gz YELKNJZPVLMVHR-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451146118 1025596899 /nfs/dbraw/zinc/59/68/99/1025596899.db2.gz MSCKCMDZROZHBK-UHFFFAOYSA-N 1 0 338.835 3.765 20 5 EHBDRO CC(C)(CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000436371107 1025638501 /nfs/dbraw/zinc/63/85/01/1025638501.db2.gz XVYYILOYXZPMKR-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000487423004 1025672358 /nfs/dbraw/zinc/67/23/58/1025672358.db2.gz VEJMGQQWTSVOJI-SJORKVTESA-N 1 0 347.462 3.991 20 5 EHBDRO CCOC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474921286 1025858501 /nfs/dbraw/zinc/85/85/01/1025858501.db2.gz BRZGPVLFIBFAKE-HIFRSBDPSA-N 1 0 326.824 3.586 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCc2ccccc21 ZINC000522061932 1025930425 /nfs/dbraw/zinc/93/04/25/1025930425.db2.gz CZBPNUZNTASIIZ-OAHLLOKOSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCc1cccc2cccnc21 ZINC000516087837 1025966014 /nfs/dbraw/zinc/96/60/14/1025966014.db2.gz CZOBWVVQDDHAAK-GOSISDBHSA-N 1 0 333.391 3.963 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2ccco2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000023386311 1025994117 /nfs/dbraw/zinc/99/41/17/1025994117.db2.gz AYIFDILOIOMQJT-QGZVFWFLSA-N 1 0 343.383 3.639 20 5 EHBDRO C[N@@H+]1CCC[C@H](c2nc(-c3ccc4ccc5cccnc5c4n3)no2)C1 ZINC001211877473 1026002928 /nfs/dbraw/zinc/00/29/28/1026002928.db2.gz QVKRQNLOQHJVGF-HNNXBMFYSA-N 1 0 345.406 3.642 20 5 EHBDRO CCOc1cccc(N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000516124723 1026014446 /nfs/dbraw/zinc/01/44/46/1026014446.db2.gz WAQVJFVLUFAXMC-XHSDSOJGSA-N 1 0 347.459 3.835 20 5 EHBDRO CCOc1cccc(N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000516124722 1026015601 /nfs/dbraw/zinc/01/56/01/1026015601.db2.gz WAQVJFVLUFAXMC-OWCLPIDISA-N 1 0 347.459 3.835 20 5 EHBDRO CCc1noc(C)c1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550427 1026102891 /nfs/dbraw/zinc/10/28/91/1026102891.db2.gz RQWHVYXUCHHVBT-HNNXBMFYSA-N 1 0 329.400 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC2CC[NH+](C3CCCCC3)CC2)c1 ZINC000530618269 1026141188 /nfs/dbraw/zinc/14/11/88/1026141188.db2.gz XKANSUQNCZMCOJ-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H]([NH+]3CCCCC3)C2)cc1C(F)(F)F ZINC000530616635 1026141812 /nfs/dbraw/zinc/14/18/12/1026141812.db2.gz XUWLMFTVMQKXNH-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO CCN(CCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000475148513 1026239469 /nfs/dbraw/zinc/23/94/69/1026239469.db2.gz KYSBIKRGTMDZKN-CYBMUJFWSA-N 1 0 347.381 3.828 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783677619 1026306387 /nfs/dbraw/zinc/30/63/87/1026306387.db2.gz QJJMTEZUGRKYSP-GOEBONIOSA-N 1 0 326.824 3.932 20 5 EHBDRO Cc1ccc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)cc1[N+](=O)[O-] ZINC000530871498 1026370726 /nfs/dbraw/zinc/37/07/26/1026370726.db2.gz GNOSBKOPQMKLCT-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000451957044 1026416166 /nfs/dbraw/zinc/41/61/66/1026416166.db2.gz OQOFGRNZAMMOLW-OAHLLOKOSA-N 1 0 336.432 3.562 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)ncn2C ZINC000342619173 1026474482 /nfs/dbraw/zinc/47/44/82/1026474482.db2.gz GTADDJXSXZKCAF-UHFFFAOYSA-N 1 0 338.411 3.892 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000339428592 1026562041 /nfs/dbraw/zinc/56/20/41/1026562041.db2.gz MHFTWPMYVFYZPR-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO CCC(=O)c1ccc(NC2CC[NH+](CC(C)C)CC2)c([N+](=O)[O-])c1 ZINC000479908095 1026878579 /nfs/dbraw/zinc/87/85/79/1026878579.db2.gz FIQZWBKECMOWPE-UHFFFAOYSA-N 1 0 333.432 3.720 20 5 EHBDRO CC(C)c1ccc(CN[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200570 1027076357 /nfs/dbraw/zinc/07/63/57/1027076357.db2.gz CPVROQRQISIXSF-CVEARBPZSA-N 1 0 333.476 3.928 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOc1ccccc1)C1CC1 ZINC000531692450 1027191458 /nfs/dbraw/zinc/19/14/58/1027191458.db2.gz WKBLROPUPPXQRY-SFHVURJKSA-N 1 0 326.396 3.585 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1cccc(F)c1)N(C)C ZINC000531677953 1027201225 /nfs/dbraw/zinc/20/12/25/1027201225.db2.gz QMHBKMOOJRCTIN-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178648848 1027267044 /nfs/dbraw/zinc/26/70/44/1027267044.db2.gz MMGDGDSQKBHUSQ-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO C[NH2+]CCC1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000420227635 1027396888 /nfs/dbraw/zinc/39/68/88/1027396888.db2.gz OTEFCYCNFYTVKB-UHFFFAOYSA-N 1 0 345.365 3.748 20 5 EHBDRO CCOc1ccc(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501776692 1027529049 /nfs/dbraw/zinc/52/90/49/1027529049.db2.gz NURAJPCTPHWJTO-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000503576729 1027921709 /nfs/dbraw/zinc/92/17/09/1027921709.db2.gz HCAJYPKXDJXXOD-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H]([NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC000533511375 1027994292 /nfs/dbraw/zinc/99/42/92/1027994292.db2.gz FADKVYRIQZXYOJ-GGXPGOJBSA-N 1 0 331.460 3.993 20 5 EHBDRO CC(C)c1ccc(C(=O)Nc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000422870791 1028027924 /nfs/dbraw/zinc/02/79/24/1028027924.db2.gz CGPMPJUZYWJBNC-GFCCVEGCSA-N 1 0 327.384 3.990 20 5 EHBDRO Cc1cnc(NCc2cccc(C[NH+]3CCCC3)c2)c([N+](=O)[O-])c1 ZINC000078629687 1028034560 /nfs/dbraw/zinc/03/45/60/1028034560.db2.gz XCZRMTNDNWPATA-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CCCn1nccc1C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000502323139 1028099143 /nfs/dbraw/zinc/09/91/43/1028099143.db2.gz TYWOOBYZUGBDCN-UHFFFAOYSA-N 1 0 342.443 3.889 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000237173203 1028172549 /nfs/dbraw/zinc/17/25/49/1028172549.db2.gz CMHJXHLFOZAYGL-KRWDZBQOSA-N 1 0 345.468 3.753 20 5 EHBDRO CCC([NH3+])(CC)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423287762 1028326608 /nfs/dbraw/zinc/32/66/08/1028326608.db2.gz OJRLQXHMLZDCRT-SFHVURJKSA-N 1 0 327.428 3.791 20 5 EHBDRO C[C@H]1C[C@H](CO)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369111 1028327736 /nfs/dbraw/zinc/32/77/36/1028327736.db2.gz XVUCUWGEVRCRJP-KBPBESRZSA-N 1 0 346.452 3.774 20 5 EHBDRO C[C@@H]1C[C@H](CO)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369112 1028330181 /nfs/dbraw/zinc/33/01/81/1028330181.db2.gz XVUCUWGEVRCRJP-KGLIPLIRSA-N 1 0 346.452 3.774 20 5 EHBDRO C[C@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738972 1028330210 /nfs/dbraw/zinc/33/02/10/1028330210.db2.gz OXPIEQQLWAEQGB-INIZCTEOSA-N 1 0 339.439 3.910 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)OCCCO3)cccc1[N+](=O)[O-] ZINC000161887799 1028346620 /nfs/dbraw/zinc/34/66/20/1028346620.db2.gz VTVIJWPUEAUORB-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]34CCOC4)s2)cc1 ZINC000421400054 1028347432 /nfs/dbraw/zinc/34/74/32/1028347432.db2.gz QZJQAQUODNXOMI-KRWDZBQOSA-N 1 0 330.409 3.688 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc2c(c1)CCC2 ZINC000178728890 1028376127 /nfs/dbraw/zinc/37/61/27/1028376127.db2.gz OSOVBAYUJVYRMD-ZDUSSCGKSA-N 1 0 326.396 3.943 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@H](O)c2ccccc2)CC1 ZINC000042634813 1028493102 /nfs/dbraw/zinc/49/31/02/1028493102.db2.gz GXQNUYGGKQUEPT-LJQANCHMSA-N 1 0 326.396 3.540 20 5 EHBDRO C[NH+](C)C1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000421685749 1028673983 /nfs/dbraw/zinc/67/39/83/1028673983.db2.gz VIVLDDLHDDCHGY-UHFFFAOYSA-N 1 0 347.462 3.991 20 5 EHBDRO CCCN(CC[NH+](C)C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000343055362 1028827998 /nfs/dbraw/zinc/82/79/98/1028827998.db2.gz RFWWRRVGXIHBOX-UHFFFAOYSA-N 1 0 335.451 3.802 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000504905779 1029051237 /nfs/dbraw/zinc/05/12/37/1029051237.db2.gz NQTWNWUKXBPGFC-HNNXBMFYSA-N 1 0 337.464 3.763 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCN1CC ZINC000504911346 1029053455 /nfs/dbraw/zinc/05/34/55/1029053455.db2.gz FAPHGSDDOWPEJR-HUUCEWRRSA-N 1 0 337.489 3.539 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCCc3[nH]c(=O)ccc32)cc1[N+](=O)[O-] ZINC000343088965 1029094711 /nfs/dbraw/zinc/09/47/11/1029094711.db2.gz ATGLIKXOCOFPJU-INIZCTEOSA-N 1 0 341.411 3.986 20 5 EHBDRO CO[C@]1(C(F)(F)F)CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925020 1029110277 /nfs/dbraw/zinc/11/02/77/1029110277.db2.gz RSHIXXWFPALGIU-BXUZGUMPSA-N 1 0 332.322 3.699 20 5 EHBDRO COC1(C)CC[NH+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000271780429 1029167128 /nfs/dbraw/zinc/16/71/28/1029167128.db2.gz RXVVBKDDVBXDBR-UHFFFAOYSA-N 1 0 337.419 3.947 20 5 EHBDRO COCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000508546395 1029227815 /nfs/dbraw/zinc/22/78/15/1029227815.db2.gz SFKNDULKOOCFFT-OAHLLOKOSA-N 1 0 344.411 3.813 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513821044 1029522297 /nfs/dbraw/zinc/52/22/97/1029522297.db2.gz AXEMMGWPMLGEHO-RIVXBTQJSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192480561 1029684522 /nfs/dbraw/zinc/68/45/22/1029684522.db2.gz HDPGSRLYTSFHNX-GXTWGEPZSA-N 1 0 332.429 3.516 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192480570 1029684912 /nfs/dbraw/zinc/68/49/12/1029684912.db2.gz HDPGSRLYTSFHNX-OCCSQVGLSA-N 1 0 332.429 3.516 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000525184015 1029732578 /nfs/dbraw/zinc/73/25/78/1029732578.db2.gz APRPDCYRVJQRCH-UHFFFAOYSA-N 1 0 346.383 3.676 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525246131 1029755851 /nfs/dbraw/zinc/75/58/51/1029755851.db2.gz NMPWJKFSHMQQCY-ZIAGYGMSSA-N 1 0 332.400 3.742 20 5 EHBDRO CCOc1cc(N[C@H]2C[N@H+](C)Cc3ccccc32)ccc1[N+](=O)[O-] ZINC000536022776 1029819990 /nfs/dbraw/zinc/81/99/90/1029819990.db2.gz JLYMZWOPOWYNAF-INIZCTEOSA-N 1 0 327.384 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CC[C@@H](c4ccccc4)C3)nc2c1 ZINC000446843947 1029824442 /nfs/dbraw/zinc/82/44/42/1029824442.db2.gz CZQQWEVGXWGGLT-CABCVRRESA-N 1 0 336.395 3.897 20 5 EHBDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407735 1029839414 /nfs/dbraw/zinc/83/94/14/1029839414.db2.gz HLAMISMXLMIVHU-HUUCEWRRSA-N 1 0 326.824 3.884 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1ccc(C)c(OC)c1 ZINC000525462981 1029858748 /nfs/dbraw/zinc/85/87/48/1029858748.db2.gz QGTLWJQTUQYPRO-UHFFFAOYSA-N 1 0 344.411 3.643 20 5 EHBDRO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000531868640 1029942708 /nfs/dbraw/zinc/94/27/08/1029942708.db2.gz SESRZOQVTBCNDA-AWEZNQCLSA-N 1 0 334.416 3.539 20 5 EHBDRO CCC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000508586578 1029963804 /nfs/dbraw/zinc/96/38/04/1029963804.db2.gz ICLGPABSIAWHEY-UHFFFAOYSA-N 1 0 330.432 3.863 20 5 EHBDRO Cc1cccc([C@H](C)[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000441207055 1029966568 /nfs/dbraw/zinc/96/65/68/1029966568.db2.gz XSTOQIZMMJLASI-INIZCTEOSA-N 1 0 325.412 3.786 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1 ZINC000035012995 1029979556 /nfs/dbraw/zinc/97/95/56/1029979556.db2.gz IAMMIMHIDKUOLM-JTQLQIEISA-N 1 0 336.189 3.603 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000237947258 1030023305 /nfs/dbraw/zinc/02/33/05/1030023305.db2.gz COIVCIPXCDGSJC-KRZKXXONSA-N 1 0 341.411 3.628 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453308366 1030078794 /nfs/dbraw/zinc/07/87/94/1030078794.db2.gz LLKAGHSYDYAKOI-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[NH+]2CCCC2)s1 ZINC000237954185 1030139825 /nfs/dbraw/zinc/13/98/25/1030139825.db2.gz DYJFPOGISSCJKC-UHFFFAOYSA-N 1 0 345.468 3.899 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CC(C)(C)OC1(C)C ZINC000482157693 1030231498 /nfs/dbraw/zinc/23/14/98/1030231498.db2.gz NBXKFPJVEXNMRK-INIZCTEOSA-N 1 0 336.432 3.818 20 5 EHBDRO Cc1ccc([C@H](C)C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447538421 1030273924 /nfs/dbraw/zinc/27/39/24/1030273924.db2.gz CAWQFZHYUPKJIB-NJAFHUGGSA-N 1 0 342.443 3.977 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000447563165 1030308573 /nfs/dbraw/zinc/30/85/73/1030308573.db2.gz OPFFXSYXSUOKDT-XOKHGSTOSA-N 1 0 346.406 3.807 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000453614343 1030405239 /nfs/dbraw/zinc/40/52/39/1030405239.db2.gz MCWGMGLOCQXJPQ-IBGZPJMESA-N 1 0 340.423 3.978 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1C[C@@H](C)O ZINC000447836903 1030528642 /nfs/dbraw/zinc/52/86/42/1030528642.db2.gz YOVHCEZXVBRMQT-ZBFHGGJFSA-N 1 0 336.432 3.507 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ccccn2)CC1 ZINC000348507664 1030611422 /nfs/dbraw/zinc/61/14/22/1030611422.db2.gz ISOPNRRESCDGMT-AWEZNQCLSA-N 1 0 327.384 3.594 20 5 EHBDRO C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccn3c[nH+]cc3c2)no1 ZINC000447952335 1030621914 /nfs/dbraw/zinc/62/19/14/1030621914.db2.gz FCHCHYZPJKEJGC-XYOKQWHBSA-N 1 0 347.334 3.853 20 5 EHBDRO C[N@H+](Cc1c2ccccc2cc2ccccc21)[C@@H]1CCS(=O)(=O)C1 ZINC000157606994 1030667533 /nfs/dbraw/zinc/66/75/33/1030667533.db2.gz QGZBUYVUAYAOIH-QGZVFWFLSA-N 1 0 339.460 3.612 20 5 EHBDRO C[C@@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@@H+]1C ZINC000343436006 1030867451 /nfs/dbraw/zinc/86/74/51/1030867451.db2.gz LJGSGCBFLROKBB-KUHUBIRLSA-N 1 0 333.435 3.601 20 5 EHBDRO C[C@H](CO)CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536163991 1031140282 /nfs/dbraw/zinc/14/02/82/1031140282.db2.gz YMMUKAPUKATRIN-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO C[C@@H]1C[C@@H]([NH3+])CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946163 1031258442 /nfs/dbraw/zinc/25/84/42/1031258442.db2.gz BYSGAORBLGWFDM-NEPJUHHUSA-N 1 0 349.818 3.820 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCCC12CCCCC2 ZINC000536176285 1031292158 /nfs/dbraw/zinc/29/21/58/1031292158.db2.gz FMQVRAQNPXBNTB-UHFFFAOYSA-N 1 0 331.416 3.640 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H](C)C1CCCCC1 ZINC000483739115 1031311704 /nfs/dbraw/zinc/31/17/04/1031311704.db2.gz CNJNKXBZSYVKRX-KBPBESRZSA-N 1 0 333.432 3.870 20 5 EHBDRO COc1cc(C[NH2+][C@]2(C)CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000483752880 1031318980 /nfs/dbraw/zinc/31/89/80/1031318980.db2.gz FDQVXSKSXWYELI-LJQANCHMSA-N 1 0 326.396 3.945 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2cc3ccccc3o2)n1 ZINC000584033108 1031525500 /nfs/dbraw/zinc/52/55/00/1031525500.db2.gz ARQAGCBXPUKKKM-HOTGVXAUSA-N 1 0 340.383 3.811 20 5 EHBDRO Cc1nn(C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000111171368 1031753798 /nfs/dbraw/zinc/75/37/98/1031753798.db2.gz SLBUOSIAZLSPDF-CQSZACIVSA-N 1 0 334.807 3.509 20 5 EHBDRO Cc1c(-c2noc([C@@H]3CC[C@@H]4CCCC[C@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000904123203 1031759598 /nfs/dbraw/zinc/75/95/98/1031759598.db2.gz JCLNCDXCTZQWRS-CFVMTHIKSA-N 1 0 342.399 3.937 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485910 1033366947 /nfs/dbraw/zinc/36/69/47/1033366947.db2.gz TZRWEYUWGDVNRN-DZGCQCFKSA-N 1 0 334.445 3.508 20 5 EHBDRO CCc1ccc([C@@H](C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)N(C)C)cc1 ZINC000061014974 1033431757 /nfs/dbraw/zinc/43/17/57/1033431757.db2.gz IANXPBWQQKVFNR-HXUWFJFHSA-N 1 0 341.455 3.858 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2ncc3n2CCCC3)CC1 ZINC000278781512 1033514502 /nfs/dbraw/zinc/51/45/02/1033514502.db2.gz DFDRNGSMGGNXMT-UHFFFAOYSA-N 1 0 340.427 3.507 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cccc(OC2CC2)c1F ZINC000594929682 1033552158 /nfs/dbraw/zinc/55/21/58/1033552158.db2.gz NHEKJXAZIXRLKF-UHFFFAOYSA-N 1 0 330.359 3.607 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580858 1033571397 /nfs/dbraw/zinc/57/13/97/1033571397.db2.gz XCLZTCPNWBWQJB-ZFWWWQNUSA-N 1 0 331.441 3.836 20 5 EHBDRO COC[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000594969935 1033578026 /nfs/dbraw/zinc/57/80/26/1033578026.db2.gz UOGVBCCKHWTWQL-AHKGRUIUSA-N 1 0 342.395 3.594 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000594936900 1033586692 /nfs/dbraw/zinc/58/66/92/1033586692.db2.gz XRQOPGSSNIUTFX-HUUCEWRRSA-N 1 0 344.411 3.859 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000594996062 1033624125 /nfs/dbraw/zinc/62/41/25/1033624125.db2.gz RGCZCHDIBBGQQI-NZSAHSFTSA-N 1 0 342.370 3.561 20 5 EHBDRO C[N@@H+]1CCCC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994320 1033648033 /nfs/dbraw/zinc/64/80/33/1033648033.db2.gz JUNTYYGIAQVNRF-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000595046636 1033662462 /nfs/dbraw/zinc/66/24/62/1033662462.db2.gz LWBSDNQSYONQCE-ZFWWWQNUSA-N 1 0 334.416 3.746 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599020522 1033668497 /nfs/dbraw/zinc/66/84/97/1033668497.db2.gz SFRICCOJKBQVMT-UTSMFGRCSA-N 1 0 339.395 3.753 20 5 EHBDRO Cc1cc(N[C@@H](C)C2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000599045107 1033675651 /nfs/dbraw/zinc/67/56/51/1033675651.db2.gz VBLDCLLXFQESOH-ZDUSSCGKSA-N 1 0 328.416 3.594 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](n2cccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000599058417 1033696634 /nfs/dbraw/zinc/69/66/34/1033696634.db2.gz UKRDONKAWZSWKS-BXUZGUMPSA-N 1 0 342.321 3.554 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000595084076 1033698957 /nfs/dbraw/zinc/69/89/57/1033698957.db2.gz FHNVKHGAXWHFHT-YXJHDRRASA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000599059533 1033699359 /nfs/dbraw/zinc/69/93/59/1033699359.db2.gz HZWXTFRQVVYAKP-KSSFIOAISA-N 1 0 326.396 3.695 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CCC(O)CC1 ZINC000595095722 1033703328 /nfs/dbraw/zinc/70/33/28/1033703328.db2.gz WWNZIIBOQIRNSV-SHARSMKWSA-N 1 0 338.473 3.606 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)C1CC1 ZINC000599073228 1033714626 /nfs/dbraw/zinc/71/46/26/1033714626.db2.gz FZISCXQZCBIZTK-OALUTQOASA-N 1 0 343.471 3.522 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCc3ccc(C)cc32)c([N+](=O)[O-])cc1OC ZINC000593675661 1033727244 /nfs/dbraw/zinc/72/72/44/1033727244.db2.gz AZZRSSZMJQEZFP-INIZCTEOSA-N 1 0 342.395 3.698 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093024 1033730740 /nfs/dbraw/zinc/73/07/40/1033730740.db2.gz MEDBTRPCEIIGQC-KZULUSFZSA-N 1 0 327.384 3.800 20 5 EHBDRO C[C@H](CO)C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000593676891 1033732983 /nfs/dbraw/zinc/73/29/83/1033732983.db2.gz OQQRPMUHFZVLEA-CQSZACIVSA-N 1 0 344.411 3.695 20 5 EHBDRO C[C@@H](CO)C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000593676890 1033733456 /nfs/dbraw/zinc/73/34/56/1033733456.db2.gz OQQRPMUHFZVLEA-AWEZNQCLSA-N 1 0 344.411 3.695 20 5 EHBDRO CC(=O)c1cc(NC[C@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125693 1033745197 /nfs/dbraw/zinc/74/51/97/1033745197.db2.gz AKAOUAKENKXAMB-MRXNPFEDSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2C2CCCC2)cc1OC(F)F ZINC000599164756 1033779682 /nfs/dbraw/zinc/77/96/82/1033779682.db2.gz LTRBRXPCFGIXAE-CYBMUJFWSA-N 1 0 341.358 3.625 20 5 EHBDRO COCc1ccnc(N[C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000593698550 1033799384 /nfs/dbraw/zinc/79/93/84/1033799384.db2.gz SWDCGYPFAIFENM-DOTOQJQBSA-N 1 0 341.411 3.960 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000593017930 1033817804 /nfs/dbraw/zinc/81/78/04/1033817804.db2.gz DKYLVXSUCXUZRI-KRWDZBQOSA-N 1 0 342.395 3.931 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1(CO)CCC1 ZINC000593719039 1033835624 /nfs/dbraw/zinc/83/56/24/1033835624.db2.gz UGZYALNUHKTKAI-AWEZNQCLSA-N 1 0 338.473 3.608 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000593723598 1033842893 /nfs/dbraw/zinc/84/28/93/1033842893.db2.gz ZLIXKNWLOAZDRP-OGWOLHLISA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1noc(C[NH+]2CCC3(CCc4ccccc4C3)CC2)c1[N+](=O)[O-] ZINC000595570198 1033846756 /nfs/dbraw/zinc/84/67/56/1033846756.db2.gz UIOXIUMMQXNTJZ-UHFFFAOYSA-N 1 0 341.411 3.662 20 5 EHBDRO C[C@@H](CO)[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670817 1033944017 /nfs/dbraw/zinc/94/40/17/1033944017.db2.gz DNPVLWXDCHTWLD-XHDPSFHLSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]([C@H]4CCCCO4)C3)nc2c1 ZINC000595788873 1034000306 /nfs/dbraw/zinc/00/03/06/1034000306.db2.gz KLCBQPZGWDYROW-XJKSGUPXSA-N 1 0 345.399 3.517 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856400 1034009525 /nfs/dbraw/zinc/00/95/25/1034009525.db2.gz BWGNLJJOSXVNAC-ARQBPDDDSA-N 1 0 342.399 3.969 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C1CC1)C1CCC(C)CC1 ZINC000603895544 1034016185 /nfs/dbraw/zinc/01/61/85/1034016185.db2.gz ODJNRUGVBQZHEZ-UHFFFAOYSA-N 1 0 345.443 3.885 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000059893811 1034042605 /nfs/dbraw/zinc/04/26/05/1034042605.db2.gz HHKLEMYEGIUAQN-LLVKDONJSA-N 1 0 331.338 3.756 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000603942727 1034060070 /nfs/dbraw/zinc/06/00/70/1034060070.db2.gz PKZIXTXLLHTYND-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CC[N@@H+](C2CCCC2)C1 ZINC000450320755 1034126690 /nfs/dbraw/zinc/12/66/90/1034126690.db2.gz XJYPBXCJGOMGCA-CYBMUJFWSA-N 1 0 326.400 3.572 20 5 EHBDRO CSC1(CNc2ccc(C(F)F)cc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000596237326 1034130808 /nfs/dbraw/zinc/13/08/08/1034130808.db2.gz DMSZTPVNYOVFIH-UHFFFAOYSA-N 1 0 345.415 3.772 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCC[C@H]2CCO)c2ccccc2)c1 ZINC000250122685 1034140010 /nfs/dbraw/zinc/14/00/10/1034140010.db2.gz VPDMOKMWYWYCRC-CWFSZBLJSA-N 1 0 340.423 3.825 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)ccc21 ZINC000456259125 1034256703 /nfs/dbraw/zinc/25/67/03/1034256703.db2.gz DWDZCHPWZLCHKU-KRWDZBQOSA-N 1 0 343.358 3.535 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCSC(F)(F)F)cc1[N+](=O)[O-] ZINC000179404318 1034276930 /nfs/dbraw/zinc/27/69/30/1034276930.db2.gz PMRLRTWXFNYXDG-SECBINFHSA-N 1 0 338.351 3.897 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)c2ccncc21 ZINC000596570700 1034293664 /nfs/dbraw/zinc/29/36/64/1034293664.db2.gz MVZYZOVLKBQQHG-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO CC1(C)CN(CCCOc2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccnc1 ZINC000596591118 1034307514 /nfs/dbraw/zinc/30/75/14/1034307514.db2.gz GRSPEXQDPKVTJR-GOSISDBHSA-N 1 0 341.411 3.842 20 5 EHBDRO [NH3+]C1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000596648352 1034346865 /nfs/dbraw/zinc/34/68/65/1034346865.db2.gz QSXLDCLQXSBNQF-GOSISDBHSA-N 1 0 325.412 3.545 20 5 EHBDRO Cc1ccc(CNCC(C)(C)[N@@H+]2C[C@H](C)C[C@H](C)C2)cc1[N+](=O)[O-] ZINC000604417942 1034371877 /nfs/dbraw/zinc/37/18/77/1034371877.db2.gz SUAASUWSEFVDLY-GASCZTMLSA-N 1 0 333.476 3.749 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435880 1034379403 /nfs/dbraw/zinc/37/94/03/1034379403.db2.gz CJFQXNNXBGLRGE-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](COC)C(C)C ZINC000534329519 1034403153 /nfs/dbraw/zinc/40/31/53/1034403153.db2.gz AZRZRRZRFZCPRM-ZIAGYGMSSA-N 1 0 326.462 3.726 20 5 EHBDRO CCc1cc(CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000450604874 1034556105 /nfs/dbraw/zinc/55/61/05/1034556105.db2.gz XYUXRDIEDGPHBP-UHFFFAOYSA-N 1 0 329.400 3.742 20 5 EHBDRO Cn1ncc(C2CC2)c1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137898 1034560306 /nfs/dbraw/zinc/56/03/06/1034560306.db2.gz HOZDSUXCOVVDTL-MRXNPFEDSA-N 1 0 340.427 3.585 20 5 EHBDRO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)[C@H]1O ZINC000597207651 1034591088 /nfs/dbraw/zinc/59/10/88/1034591088.db2.gz ZUQOUALIVUGADK-MCBXIFIFSA-N 1 0 346.452 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+](CC2CC2)C2CCC2)c1 ZINC000475667915 1034626032 /nfs/dbraw/zinc/62/60/32/1034626032.db2.gz HXVGRFJCASVITC-UHFFFAOYSA-N 1 0 326.343 3.961 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CNc3ccccc3C2)cc1[N+](=O)[O-] ZINC000593319489 1034656761 /nfs/dbraw/zinc/65/67/61/1034656761.db2.gz LTJVFEFTKAISQI-BBRMVZONSA-N 1 0 341.411 3.681 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CNc2ccccc2C1)C1CC1 ZINC000593319685 1034657673 /nfs/dbraw/zinc/65/76/73/1034657673.db2.gz OLJIRYDTIMSCIM-IEBWSBKVSA-N 1 0 337.423 3.542 20 5 EHBDRO Cc1cccc(N2CC[C@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000614977218 1034741695 /nfs/dbraw/zinc/74/16/95/1034741695.db2.gz GFYDJQFAYYLAJK-KRWDZBQOSA-N 1 0 325.412 3.614 20 5 EHBDRO CCO[C@@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000450745707 1034748240 /nfs/dbraw/zinc/74/82/40/1034748240.db2.gz PWCIDXMPZNXEDK-KZULUSFZSA-N 1 0 329.400 3.703 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc(C(=O)OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000411476291 1034891511 /nfs/dbraw/zinc/89/15/11/1034891511.db2.gz PPCIXHWBRBTDBN-AWEZNQCLSA-N 1 0 334.397 3.684 20 5 EHBDRO COc1cncc(/C=C\CC[N@H+](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000563061169 1035022429 /nfs/dbraw/zinc/02/24/29/1035022429.db2.gz ZKCWNQNTTDOJJZ-ALCCZGGFSA-N 1 0 327.384 3.534 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000615835147 1035028613 /nfs/dbraw/zinc/02/86/13/1035028613.db2.gz UDPFCAFSVYEZMW-ZROIWOOFSA-N 1 0 348.406 3.974 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(O)CCC[C@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000188602890 1035238411 /nfs/dbraw/zinc/23/84/11/1035238411.db2.gz DMVQMUCLMFZRPO-CORIIIEPSA-N 1 0 346.349 3.729 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(F)(F)F ZINC000548973023 1035357026 /nfs/dbraw/zinc/35/70/26/1035357026.db2.gz PCLLVQJQVJTPJG-UHFFFAOYSA-N 1 0 342.264 3.874 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCO1 ZINC000581085216 1035472567 /nfs/dbraw/zinc/47/25/67/1035472567.db2.gz OYDJXRVYOKSGKH-ZIAGYGMSSA-N 1 0 332.322 3.661 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)c1 ZINC000122127345 1035599840 /nfs/dbraw/zinc/59/98/40/1035599840.db2.gz PXORFWZJNQVXQJ-AUUYWEPGSA-N 1 0 343.427 3.557 20 5 EHBDRO CC(C)c1cnc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)s1 ZINC000581995318 1035671688 /nfs/dbraw/zinc/67/16/88/1035671688.db2.gz CUJBODABFQKTSV-UHFFFAOYSA-N 1 0 344.440 3.988 20 5 EHBDRO CC[NH+](CC)CCSCc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089690373 1035854282 /nfs/dbraw/zinc/85/42/82/1035854282.db2.gz GKHLZARBDOOJHB-UHFFFAOYSA-N 1 0 335.429 3.825 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1Cc2cccc(OC)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000414191920 1035976472 /nfs/dbraw/zinc/97/64/72/1035976472.db2.gz SDVDIRBGXOGOJK-CRAIPNDOSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201700 1036138908 /nfs/dbraw/zinc/13/89/08/1036138908.db2.gz NWINZMQIQHUXKZ-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000414226166 1036149642 /nfs/dbraw/zinc/14/96/42/1036149642.db2.gz TVBKIFIIEVSRRZ-XVSDVWIESA-N 1 0 326.396 3.866 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[C@@H](C)O1 ZINC000414252603 1036302211 /nfs/dbraw/zinc/30/22/11/1036302211.db2.gz ATJBXVQHPCVSRN-DMHIMHRUSA-N 1 0 332.444 3.709 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)Nc1ccc([N+](=O)[O-])c(N)c1F)[NH+](C)C ZINC000589600659 1036543839 /nfs/dbraw/zinc/54/38/39/1036543839.db2.gz CUBVXLHZDNAUHU-XIKOKIGWSA-N 1 0 346.406 3.728 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@@H]1C ZINC000541688173 1036559243 /nfs/dbraw/zinc/55/92/43/1036559243.db2.gz TYVXZHQKDIUGHO-NJSLBKSFSA-N 1 0 342.395 3.516 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCc2ccncc2)c2ccccc2)c1 ZINC000493074922 1036640046 /nfs/dbraw/zinc/64/00/46/1036640046.db2.gz AJDAXAIHVORJBE-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414317894 1036644452 /nfs/dbraw/zinc/64/44/52/1036644452.db2.gz WTKPVGJUUBZBGQ-YJBOKZPZSA-N 1 0 332.375 3.551 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647941 1036660920 /nfs/dbraw/zinc/66/09/20/1036660920.db2.gz NOKSMWBHBKJRLS-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3CCC(C4CC4)CC3)co2)cc1 ZINC000590006413 1036696829 /nfs/dbraw/zinc/69/68/29/1036696829.db2.gz CQSNUMPLGNOMGK-UHFFFAOYSA-N 1 0 327.384 3.872 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782683 1036722266 /nfs/dbraw/zinc/72/22/66/1036722266.db2.gz GLRDWIAFUSYIBO-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO CC(C)N(C(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000180400977 1036753669 /nfs/dbraw/zinc/75/36/69/1036753669.db2.gz ZLJNVCQAORQPIP-OAHLLOKOSA-N 1 0 341.411 3.687 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000464774910 1036764688 /nfs/dbraw/zinc/76/46/88/1036764688.db2.gz LPKBJSMZQDEVLM-SFHVURJKSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@]1(CO)CCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237742786 1036901190 /nfs/dbraw/zinc/90/11/90/1036901190.db2.gz YKUBOZWVUIBTKS-ZWKOTPCHSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000271705490 1036961829 /nfs/dbraw/zinc/96/18/29/1036961829.db2.gz IFYPVMKCMYTHNT-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000609144354 1037059455 /nfs/dbraw/zinc/05/94/55/1037059455.db2.gz PUWHTNCMZDAVRD-HNNXBMFYSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000173895181 1037069995 /nfs/dbraw/zinc/06/99/95/1037069995.db2.gz CBFNYVDKCTXXDZ-XNJGSVPQSA-N 1 0 332.400 3.614 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCCC[C@H]([NH+]3CCCC3)C2)cc1Cl ZINC000761506013 1037088304 /nfs/dbraw/zinc/08/83/04/1037088304.db2.gz LXKDISUAXSXZSO-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[N@H+](CCc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000539851788 1037280520 /nfs/dbraw/zinc/28/05/20/1037280520.db2.gz BJWYTYIOHXZBGK-UHFFFAOYSA-N 1 0 342.367 3.932 20 5 EHBDRO C[C@@H]1C[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)[C@H]2CCCC[C@H]12 ZINC000130174375 1037309050 /nfs/dbraw/zinc/30/90/50/1037309050.db2.gz PTDGJHFGABFONN-MRRJBJDNSA-N 1 0 349.406 3.573 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([C@H](C)CCO)CCC1 ZINC000271813981 1037359318 /nfs/dbraw/zinc/35/93/18/1037359318.db2.gz BFTJINSZGKWZBU-HZPDHXFCSA-N 1 0 334.460 3.694 20 5 EHBDRO CO[C@](C)(C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000462801897 1037421268 /nfs/dbraw/zinc/42/12/68/1037421268.db2.gz DVCFRCPFOALLIO-UCLAIMLFSA-N 1 0 332.444 3.711 20 5 EHBDRO CCc1ccc([C@@H](NC[C@H]2CCCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578052 1037514082 /nfs/dbraw/zinc/51/40/82/1037514082.db2.gz PUYIIQRLMNBUCR-BEFAXECRSA-N 1 0 343.427 3.571 20 5 EHBDRO CCc1ccc([C@@H](N[C@@H]2CCC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578383 1037516786 /nfs/dbraw/zinc/51/67/86/1037516786.db2.gz YIQJZLXTHBPKRW-BEFAXECRSA-N 1 0 343.427 3.571 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+]([C@H](C)CO)C1CCCC1 ZINC000472619545 1037542735 /nfs/dbraw/zinc/54/27/35/1037542735.db2.gz RAQJWKFKECLYKC-CQSZACIVSA-N 1 0 336.432 3.507 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(OCC2CCCC2)CC1 ZINC000177502800 1037560052 /nfs/dbraw/zinc/56/00/52/1037560052.db2.gz MCAMNBDJGDLFOO-UHFFFAOYSA-N 1 0 348.443 3.645 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)N1CCCCC1 ZINC000468638904 1037602470 /nfs/dbraw/zinc/60/24/70/1037602470.db2.gz CSASZBUGIGLMQI-FOWTUZBSSA-N 1 0 331.460 3.852 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1)CC(C)C ZINC000540207430 1037710495 /nfs/dbraw/zinc/71/04/95/1037710495.db2.gz VUPYDOBIQXEAQO-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO CSc1ccc([C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000549938020 1037723421 /nfs/dbraw/zinc/72/34/21/1037723421.db2.gz PJYJCQWOXKOVDJ-SFHVURJKSA-N 1 0 345.468 3.709 20 5 EHBDRO Cc1cc(N(C)C[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000463068806 1037731401 /nfs/dbraw/zinc/73/14/01/1037731401.db2.gz MRZCKULQHKTOKL-GOSISDBHSA-N 1 0 339.439 3.862 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410482 1037907658 /nfs/dbraw/zinc/90/76/58/1037907658.db2.gz ZNLCJWYWDFNHES-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](O)[C@H]2CCc2ccccc2)cs1 ZINC000592165649 1037909736 /nfs/dbraw/zinc/90/97/36/1037909736.db2.gz DIOPGRXXXQOAPK-IAGOWNOFSA-N 1 0 346.452 3.614 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccc1)C1(CO)CC=CC1 ZINC000592174894 1037915787 /nfs/dbraw/zinc/91/57/87/1037915787.db2.gz MWPOHOHDHYUFES-IBGZPJMESA-N 1 0 338.407 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(CO)cc1 ZINC000592392855 1037934891 /nfs/dbraw/zinc/93/48/91/1037934891.db2.gz AADBUJSDBJPUSJ-HKUYNNGSSA-N 1 0 340.423 3.588 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cc2n(n1)CCCC2 ZINC000592389152 1037954898 /nfs/dbraw/zinc/95/48/98/1037954898.db2.gz JCRJISMBDPSEAM-GFCCVEGCSA-N 1 0 348.834 3.674 20 5 EHBDRO COc1ccc(C[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C2CC2)cc1 ZINC000051254765 1037957851 /nfs/dbraw/zinc/95/78/51/1037957851.db2.gz UYAWLQAVJLUKTR-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO CC(C)([NH2+]Cc1cc(-n2ccnc2)cs1)c1ccccc1[N+](=O)[O-] ZINC000492192557 1038103152 /nfs/dbraw/zinc/10/31/52/1038103152.db2.gz HOPDHILMJXZALX-UHFFFAOYSA-N 1 0 342.424 3.867 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(=O)C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000122878677 1038125694 /nfs/dbraw/zinc/12/56/94/1038125694.db2.gz CKPMEYMVISVCKO-CQSZACIVSA-N 1 0 347.459 3.591 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC001167735154 1038444808 /nfs/dbraw/zinc/44/48/08/1038444808.db2.gz STRPKPGKSOEWCM-HZPDHXFCSA-N 1 0 331.460 3.537 20 5 EHBDRO CC1(C)OCc2cc(C[NH2+]CCc3ccccc3[N+](=O)[O-])ccc2O1 ZINC000274407593 1038486864 /nfs/dbraw/zinc/48/68/64/1038486864.db2.gz IHEKINKXQRMZDR-UHFFFAOYSA-N 1 0 342.395 3.572 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(c3c[nH]cn3)CC2)cc1[N+](=O)[O-] ZINC000378344046 1038492372 /nfs/dbraw/zinc/49/23/72/1038492372.db2.gz XNRATVHUIFMIOZ-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO C/C(=C\c1ccccc1)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737317 1038501280 /nfs/dbraw/zinc/50/12/80/1038501280.db2.gz VVQCPKXQVUSWFV-GSPCDJLXSA-N 1 0 338.411 3.580 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000549426304 1038569363 /nfs/dbraw/zinc/56/93/63/1038569363.db2.gz YXTDBIJUXJUGSG-UHFFFAOYSA-N 1 0 348.443 3.847 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000488025562 1038789010 /nfs/dbraw/zinc/78/90/10/1038789010.db2.gz UKWDUAVMAINQCJ-HNNXBMFYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC(C)(C)[NH2+]CCC(=O)O[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000906087586 1039284757 /nfs/dbraw/zinc/28/47/57/1039284757.db2.gz OAELCUAGSKLBLZ-ZDUSSCGKSA-N 1 0 348.321 3.520 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)cc1[N+](=O)[O-] ZINC000480276677 1039373404 /nfs/dbraw/zinc/37/34/04/1039373404.db2.gz HUXATSLBNYDUIL-CXAGYDPISA-N 1 0 333.457 3.918 20 5 EHBDRO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668096 1039386567 /nfs/dbraw/zinc/38/65/67/1039386567.db2.gz ICUGJSLWRZBFEK-SWLSCSKDSA-N 1 0 346.818 3.891 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)O ZINC000480472225 1039591409 /nfs/dbraw/zinc/59/14/09/1039591409.db2.gz IRCGHIYDXVQBLE-KRWDZBQOSA-N 1 0 332.400 3.740 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000480503515 1039613511 /nfs/dbraw/zinc/61/35/11/1039613511.db2.gz YNPWDQVEZYSQQI-HVEPWOEZSA-N 1 0 332.444 3.919 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489101300 1039621091 /nfs/dbraw/zinc/62/10/91/1039621091.db2.gz GISJMASOARRXLT-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc(Nc2ccc(CC[NH+]3CCCCC3)cc2)cn1 ZINC000554753555 1039673025 /nfs/dbraw/zinc/67/30/25/1039673025.db2.gz PDNTYLIWIIXECQ-UHFFFAOYSA-N 1 0 326.400 3.762 20 5 EHBDRO Cc1oc(C(C)(C)C)cc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000894080754 1040060866 /nfs/dbraw/zinc/06/08/66/1040060866.db2.gz XAPHNVIJLGJKFS-UHFFFAOYSA-N 1 0 346.431 3.827 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000573743499 1040213978 /nfs/dbraw/zinc/21/39/78/1040213978.db2.gz RWAAOXDXGAXCFV-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO COc1cc(C[N@H+](C)C2(C)CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000489879728 1040219931 /nfs/dbraw/zinc/21/99/31/1040219931.db2.gz FLZGECCNJDZSIJ-UHFFFAOYSA-N 1 0 344.358 3.969 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000120280580 1040307970 /nfs/dbraw/zinc/30/79/70/1040307970.db2.gz AHDWUTUEJYNZIR-IRXDYDNUSA-N 1 0 331.416 3.922 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000481104884 1040371167 /nfs/dbraw/zinc/37/11/67/1040371167.db2.gz JKNZKPKHIYCSBM-DZGCQCFKSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000481195098 1040388531 /nfs/dbraw/zinc/38/85/31/1040388531.db2.gz WVWSBKUHLCHVPG-MDZLAQPJSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CC[C@@H](C)C[C@@H]1C ZINC000481187498 1040452286 /nfs/dbraw/zinc/45/22/86/1040452286.db2.gz HAOBFCYEESGPKT-DVOMOZLQSA-N 1 0 333.432 3.646 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481195221 1040472240 /nfs/dbraw/zinc/47/22/40/1040472240.db2.gz XHNHGADCQNLUDO-ZBFHGGJFSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCCCC1(C)C ZINC000481196434 1040472900 /nfs/dbraw/zinc/47/29/00/1040472900.db2.gz ZDAZBAVRROZXRJ-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H]1CC[C@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051139 1040563624 /nfs/dbraw/zinc/56/36/24/1040563624.db2.gz GLUQZTUZOLYFQO-GUYCJALGSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@H]1CC[C@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051138 1040563939 /nfs/dbraw/zinc/56/39/39/1040563939.db2.gz GLUQZTUZOLYFQO-DYVFJYSZSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062404 1040584001 /nfs/dbraw/zinc/58/40/01/1040584001.db2.gz SUIZOFDZNNGMAK-PIISCBOPSA-N 1 0 342.399 3.874 20 5 EHBDRO CC(C)(C)C1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000500139917 1040590160 /nfs/dbraw/zinc/59/01/60/1040590160.db2.gz OHGBTKFOTMWTHX-UHFFFAOYSA-N 1 0 333.432 3.682 20 5 EHBDRO Cc1cscc1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000487178461 1040766148 /nfs/dbraw/zinc/76/61/48/1040766148.db2.gz GAFAUQZVJIFOMQ-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000600213370 1040850831 /nfs/dbraw/zinc/85/08/31/1040850831.db2.gz CSVDCTNAEJCRGZ-OAHLLOKOSA-N 1 0 342.395 3.689 20 5 EHBDRO CCOc1cccc(NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000541551911 1040878741 /nfs/dbraw/zinc/87/87/41/1040878741.db2.gz SDGVRCIOSWGKPM-INIZCTEOSA-N 1 0 347.390 3.847 20 5 EHBDRO COC(=O)c1cc([C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178860 1041010163 /nfs/dbraw/zinc/01/01/63/1041010163.db2.gz CQORMHLEDGYOHQ-LBPRGKRZSA-N 1 0 346.383 3.518 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)(C)[C@H]2CCC[C@H]21 ZINC000555721204 1041059287 /nfs/dbraw/zinc/05/92/87/1041059287.db2.gz IRYKRCZGHRZCSG-DOTOQJQBSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]([NH2+]CC(C)(C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000164069519 1041144486 /nfs/dbraw/zinc/14/44/86/1041144486.db2.gz YQBLZSPIAINWSK-GFCCVEGCSA-N 1 0 337.420 3.549 20 5 EHBDRO C[C@@H]([NH2+]CC(C)(C)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 ZINC000481718384 1041284288 /nfs/dbraw/zinc/28/42/88/1041284288.db2.gz ACVIEDFGIYNSHN-CYBMUJFWSA-N 1 0 342.395 3.952 20 5 EHBDRO CCCN(CC[NH+]1CCCCCC1)C(=O)c1cc([N+](=O)[O-])ccc1C ZINC000566821127 1041453679 /nfs/dbraw/zinc/45/36/79/1041453679.db2.gz NSRINFCDXFHCIV-UHFFFAOYSA-N 1 0 347.459 3.631 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](C)C1CCCCC1 ZINC000566814155 1041454110 /nfs/dbraw/zinc/45/41/10/1041454110.db2.gz XCEDHSRGXSAUPJ-CQSZACIVSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CCO)CCC2)s1 ZINC000136523913 1041812996 /nfs/dbraw/zinc/81/29/96/1041812996.db2.gz WVKCFOMIMGDEPS-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO CC[C@H](C)C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253532 1042254060 /nfs/dbraw/zinc/25/40/60/1042254060.db2.gz HIZJUVAOCIPLJF-QWRGUYRKSA-N 1 0 327.812 3.553 20 5 EHBDRO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC(C)(C)O ZINC000093414644 1042296828 /nfs/dbraw/zinc/29/68/28/1042296828.db2.gz LEKZPEHUGHUNRT-UHFFFAOYSA-N 1 0 348.374 3.729 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120315750 1042390409 /nfs/dbraw/zinc/39/04/09/1042390409.db2.gz HXSFQSJUXLYBPP-QAPCUYQASA-N 1 0 343.427 3.984 20 5 EHBDRO CC(C)[C@H](CO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000112658927 1042416574 /nfs/dbraw/zinc/41/65/74/1042416574.db2.gz HXZYOALUNSERSP-IBGZPJMESA-N 1 0 328.412 3.614 20 5 EHBDRO CC(C)[C@@H](C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000749673234 1042791425 /nfs/dbraw/zinc/79/14/25/1042791425.db2.gz STIIBHCNQDCEOG-RTBURBONSA-N 1 0 328.412 3.658 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122137881 1042864959 /nfs/dbraw/zinc/86/49/59/1042864959.db2.gz MQZVJWMHTOKLLU-AWEZNQCLSA-N 1 0 339.395 3.572 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC000072925502 1042878038 /nfs/dbraw/zinc/87/80/38/1042878038.db2.gz PETZGJPDXFZNKE-HNNXBMFYSA-N 1 0 349.456 3.869 20 5 EHBDRO C[C@H]1C[NH+](CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000432325862 1042906868 /nfs/dbraw/zinc/90/68/68/1042906868.db2.gz NCEADUSMRASLKE-STQMWFEESA-N 1 0 341.839 3.550 20 5 EHBDRO CCC[C@@H](C)[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000569127234 1042946260 /nfs/dbraw/zinc/94/62/60/1042946260.db2.gz CEQGEIBSQAVGQM-MLGOLLRUSA-N 1 0 349.456 3.605 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000106468590 1042986001 /nfs/dbraw/zinc/98/60/01/1042986001.db2.gz MVUKUZRXYLEYFV-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCCC[C@H]2CCO)o1 ZINC000585767851 1043029906 /nfs/dbraw/zinc/02/99/06/1043029906.db2.gz MVELHMATGVSUSW-HNNXBMFYSA-N 1 0 344.411 3.982 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278966363 1043099069 /nfs/dbraw/zinc/09/90/69/1043099069.db2.gz BSTAOPNNOCHXCX-SFHVURJKSA-N 1 0 342.443 3.892 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000344045395 1043152673 /nfs/dbraw/zinc/15/26/73/1043152673.db2.gz IECGOFYFJWRNPC-GOSISDBHSA-N 1 0 326.396 3.813 20 5 EHBDRO CC1(C)C[C@@H](NC2CC[NH+](C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003348 1043165715 /nfs/dbraw/zinc/16/57/15/1043165715.db2.gz GASXFJKXRMYIPJ-LJQANCHMSA-N 1 0 343.471 3.924 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cnc(-c2ccco2)s1 ZINC000344061072 1043186637 /nfs/dbraw/zinc/18/66/37/1043186637.db2.gz IOKFXFXZCJGANE-UHFFFAOYSA-N 1 0 329.381 3.644 20 5 EHBDRO COCC1(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000571880325 1043750959 /nfs/dbraw/zinc/75/09/59/1043750959.db2.gz ADPNCDVPHURHDP-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000344725597 1044342447 /nfs/dbraw/zinc/34/24/47/1044342447.db2.gz GWICIMZUFCDBQI-ZDUSSCGKSA-N 1 0 326.805 3.787 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCc2c[nH]c3ncccc23)cc1[N+](=O)[O-] ZINC000344842077 1044508789 /nfs/dbraw/zinc/50/87/89/1044508789.db2.gz UGPQRRMOIIMBHF-UHFFFAOYSA-N 1 0 338.411 3.927 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764283771 1127473367 /nfs/dbraw/zinc/47/33/67/1127473367.db2.gz SKDKRSHBQKCVCY-LLVKDONJSA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[C@H]1C ZINC000552066369 1127554000 /nfs/dbraw/zinc/55/40/00/1127554000.db2.gz HLFFBLRRIVSLCI-DEICHXMPSA-N 1 0 342.443 3.832 20 5 EHBDRO Cc1ccnc(NC2CC[NH+](CC3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000301275725 1127700461 /nfs/dbraw/zinc/70/04/61/1127700461.db2.gz ISOYIJILYUTFNS-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cn2)CC1 ZINC000301313468 1127736669 /nfs/dbraw/zinc/73/66/69/1127736669.db2.gz KCTOBMKWAVQPLD-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000273018395 1128432982 /nfs/dbraw/zinc/43/29/82/1128432982.db2.gz CESZKXDDZOUSLP-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063153 1128438615 /nfs/dbraw/zinc/43/86/15/1128438615.db2.gz MVAURWNQFASBPI-IUODEOHRSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC3CCCC3)C2)c2ncccc12 ZINC000301477505 1128468163 /nfs/dbraw/zinc/46/81/63/1128468163.db2.gz UDUIVPLUKLTBNS-HNNXBMFYSA-N 1 0 340.427 3.819 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000301479811 1128468725 /nfs/dbraw/zinc/46/87/25/1128468725.db2.gz NQIWRUHVONMVPK-INIZCTEOSA-N 1 0 341.411 3.680 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000153592780 1128486427 /nfs/dbraw/zinc/48/64/27/1128486427.db2.gz NYXOQKVRNBKTMV-KGLIPLIRSA-N 1 0 344.411 3.981 20 5 EHBDRO CC(=O)c1ccc(NC2CC[NH+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000301568516 1128498087 /nfs/dbraw/zinc/49/80/87/1128498087.db2.gz WDWDVRCCDIWOGT-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765848515 1128559544 /nfs/dbraw/zinc/55/95/44/1128559544.db2.gz HKHIXBIBVTYKIC-VMDGZTHMSA-N 1 0 326.396 3.856 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2noc(C(C)C)n2)CC1 ZINC000273450704 1128538659 /nfs/dbraw/zinc/53/86/59/1128538659.db2.gz OOJNJIGKLDRUNX-UHFFFAOYSA-N 1 0 344.415 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000765849919 1128581428 /nfs/dbraw/zinc/58/14/28/1128581428.db2.gz UZBWDFUPODEAFB-YSIASYRMSA-N 1 0 340.423 3.629 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765849808 1128581752 /nfs/dbraw/zinc/58/17/52/1128581752.db2.gz QYQCRXXKFBDQMK-ZWKOTPCHSA-N 1 0 326.396 3.640 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(C)nc2)cc1[N+](=O)[O-] ZINC000153729463 1128655110 /nfs/dbraw/zinc/65/51/10/1128655110.db2.gz QRHXXIOUPOSKJN-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1NC[C@@H]1CC[N@@H+]1Cc1ccccc1 ZINC000715651299 1128655826 /nfs/dbraw/zinc/65/58/26/1128655826.db2.gz VYZCAAKJODHLGT-HNNXBMFYSA-N 1 0 331.803 3.935 20 5 EHBDRO CCOC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000091677700 1128779223 /nfs/dbraw/zinc/77/92/23/1128779223.db2.gz SHFUZXGEDBNONN-UHFFFAOYSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1ccnc(N2CCN(c3cc(C)c([N+](=O)[O-])cc3Cl)CC2)c1 ZINC000301657604 1128850274 /nfs/dbraw/zinc/85/02/74/1128850274.db2.gz BJLYNYOOANBJQO-UHFFFAOYSA-N 1 0 346.818 3.587 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673402 1128899388 /nfs/dbraw/zinc/89/93/88/1128899388.db2.gz RJWAONUPVYSHLT-PBHICJAKSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1ccc(CN[C@H](C[NH+](C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938856 1128905325 /nfs/dbraw/zinc/90/53/25/1128905325.db2.gz YPVLMEHAQIKDBJ-QGZVFWFLSA-N 1 0 347.846 3.949 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCOC1 ZINC000494449505 1120562458 /nfs/dbraw/zinc/56/24/58/1120562458.db2.gz YMDIRVKLBWDJIC-SMDDNHRTSA-N 1 0 332.322 3.518 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114207 1120691436 /nfs/dbraw/zinc/69/14/36/1120691436.db2.gz MDSPIIGBWVPNLZ-KSSFIOAISA-N 1 0 344.411 3.686 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000542545469 1121002659 /nfs/dbraw/zinc/00/26/59/1121002659.db2.gz QZIXZAOWLIHXJY-GJZGRUSLSA-N 1 0 344.411 3.764 20 5 EHBDRO CC(C)[NH+](CCSCCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000762198938 1121165668 /nfs/dbraw/zinc/16/56/68/1121165668.db2.gz IQTIFSMDXRTEPZ-UHFFFAOYSA-N 1 0 326.462 3.826 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])cc1)[NH+]1CCCC1 ZINC000301056597 1121193172 /nfs/dbraw/zinc/19/31/72/1121193172.db2.gz KNZNCTJPKUHKRA-GOSISDBHSA-N 1 0 341.411 3.852 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)OCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000915134713 1121209743 /nfs/dbraw/zinc/20/97/43/1121209743.db2.gz VUBLAFAQFQUYCF-UHFFFAOYSA-N 1 0 342.395 3.794 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC000762632413 1121389039 /nfs/dbraw/zinc/38/90/39/1121389039.db2.gz ISOBYQUINFZCMX-RBUKOAKNSA-N 1 0 326.396 3.855 20 5 EHBDRO COCc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000154283204 1121523012 /nfs/dbraw/zinc/52/30/12/1121523012.db2.gz SEDFZKPYKYELIB-UHFFFAOYSA-N 1 0 326.396 3.906 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000090653951 1121669364 /nfs/dbraw/zinc/66/93/64/1121669364.db2.gz DMEUQOLFEGEQMJ-YZVOILCLSA-N 1 0 328.412 3.546 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(C)cc1 ZINC000194014209 1121752500 /nfs/dbraw/zinc/75/25/00/1121752500.db2.gz LNMFOWWXAFEGCZ-QGZVFWFLSA-N 1 0 341.411 3.891 20 5 EHBDRO COCc1cc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000194415604 1121883637 /nfs/dbraw/zinc/88/36/37/1121883637.db2.gz WMGJKKDSJSEQTO-CQSZACIVSA-N 1 0 344.411 3.643 20 5 EHBDRO COc1ccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1OC ZINC000122815809 1121952734 /nfs/dbraw/zinc/95/27/34/1121952734.db2.gz HDACOZCUGZSWIM-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000301747295 1129029140 /nfs/dbraw/zinc/02/91/40/1129029140.db2.gz QWHBTCKDHOILBS-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000153888093 1122088015 /nfs/dbraw/zinc/08/80/15/1122088015.db2.gz TVWJVOTVMZCJSX-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301754813 1129035932 /nfs/dbraw/zinc/03/59/32/1129035932.db2.gz WYVVFEQLTMGLTR-LBPRGKRZSA-N 1 0 326.828 3.710 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301754812 1129036157 /nfs/dbraw/zinc/03/61/57/1129036157.db2.gz WYVVFEQLTMGLTR-GFCCVEGCSA-N 1 0 326.828 3.710 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000272776189 1122223839 /nfs/dbraw/zinc/22/38/39/1122223839.db2.gz UJSKAEPDIJUKJU-CHWSQXEVSA-N 1 0 327.384 3.965 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775456 1129058992 /nfs/dbraw/zinc/05/89/92/1129058992.db2.gz LCIRCOFLJCIHFP-LRDDRELGSA-N 1 0 335.835 3.701 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154339444 1122564676 /nfs/dbraw/zinc/56/46/76/1122564676.db2.gz XMVIHCHCPFVECL-VPWXQRGCSA-N 1 0 340.423 3.815 20 5 EHBDRO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[NH+]1CCCCC1 ZINC000917840215 1122691513 /nfs/dbraw/zinc/69/15/13/1122691513.db2.gz QEZGBFVVPNRHSS-INIZCTEOSA-N 1 0 347.462 3.992 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCCO2 ZINC000194619287 1122789506 /nfs/dbraw/zinc/78/95/06/1122789506.db2.gz IPLYHAZQLBFETM-ZDUSSCGKSA-N 1 0 328.368 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCCO3)o2)cc1 ZINC000556620409 1123063371 /nfs/dbraw/zinc/06/33/71/1123063371.db2.gz ZXHACWCQRLSJRR-IEBWSBKVSA-N 1 0 342.395 3.998 20 5 EHBDRO CC(C)C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000155112443 1123189949 /nfs/dbraw/zinc/18/99/49/1123189949.db2.gz VUBXMDMGPPBSPE-AWEZNQCLSA-N 1 0 347.440 3.972 20 5 EHBDRO Cc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+]2CCCC2)cc1 ZINC000609383691 1123568109 /nfs/dbraw/zinc/56/81/09/1123568109.db2.gz HTHTYWULAKLZAZ-SFHVURJKSA-N 1 0 340.427 3.856 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(C)(C)O ZINC000609707887 1123648413 /nfs/dbraw/zinc/64/84/13/1123648413.db2.gz KXMDPFBOSPJSEO-AWEZNQCLSA-N 1 0 343.427 3.612 20 5 EHBDRO CC[C@H](C[NH+]1CCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000609839903 1123678147 /nfs/dbraw/zinc/67/81/47/1123678147.db2.gz IIUWLWPAPLQZIN-GFCCVEGCSA-N 1 0 342.237 3.644 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)c1cccc(F)c1 ZINC000179572111 1123797957 /nfs/dbraw/zinc/79/79/57/1123797957.db2.gz USTJAQSGDLFPSI-UHFFFAOYSA-N 1 0 345.374 3.506 20 5 EHBDRO C[C@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000237662265 1123806297 /nfs/dbraw/zinc/80/62/97/1123806297.db2.gz OBUVTBALGBXWEJ-OAHLLOKOSA-N 1 0 343.427 3.819 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000615835122 1123884218 /nfs/dbraw/zinc/88/42/18/1123884218.db2.gz PURRORKVIFRPAP-PMXLPMHFSA-N 1 0 340.427 3.741 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2cc[nH]n2)C1 ZINC000615836012 1123884381 /nfs/dbraw/zinc/88/43/81/1123884381.db2.gz HCDDJXOIXIMFDU-DKGMDFAASA-N 1 0 326.400 3.601 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000615836101 1123885396 /nfs/dbraw/zinc/88/53/96/1123885396.db2.gz RUKGBZQQDZSVIL-PTNGSMBKSA-N 1 0 338.407 3.805 20 5 EHBDRO O=[N+]([O-])c1cc(CNC[C@@H](c2ccccc2)[NH+]2CCCC2)cs1 ZINC000237974937 1123935209 /nfs/dbraw/zinc/93/52/09/1123935209.db2.gz NLGUNPCOAXWGBS-INIZCTEOSA-N 1 0 331.441 3.583 20 5 EHBDRO CC(C)(CCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000080536263 1123987830 /nfs/dbraw/zinc/98/78/30/1123987830.db2.gz HCAILXODDDORSG-UHFFFAOYSA-N 1 0 334.441 3.822 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216828 1124100341 /nfs/dbraw/zinc/10/03/41/1124100341.db2.gz ZQJWZVYOHHMWIH-WBVHZDCISA-N 1 0 348.443 3.632 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000078635517 1129174832 /nfs/dbraw/zinc/17/48/32/1129174832.db2.gz UCIKRUAMTYNVDT-MRXNPFEDSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@H]1CCC[C@@](CNc2ncnc3sc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000326557574 1124646413 /nfs/dbraw/zinc/64/64/13/1124646413.db2.gz VEQFMJFXIXHAJT-MEDUHNTESA-N 1 0 349.460 3.522 20 5 EHBDRO CC(C)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000182157333 1125192098 /nfs/dbraw/zinc/19/20/98/1125192098.db2.gz GCVRFDNRCYSMHV-OAHLLOKOSA-N 1 0 340.786 3.571 20 5 EHBDRO CCC1(O)CCC([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000618985511 1125257735 /nfs/dbraw/zinc/25/77/35/1125257735.db2.gz CDVUUJKNKJRKOE-IUNXBHMESA-N 1 0 332.444 3.991 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000619531679 1125358627 /nfs/dbraw/zinc/35/86/27/1125358627.db2.gz RGBZNEDSPGCGIO-QGZVFWFLSA-N 1 0 328.368 3.646 20 5 EHBDRO CC(C)Cn1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cn1 ZINC000183063027 1125428843 /nfs/dbraw/zinc/42/88/43/1125428843.db2.gz QIVXYCSSMUMUFJ-UHFFFAOYSA-N 1 0 330.432 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3ccc(F)cc3)CC2)cc1 ZINC000115557233 1129274135 /nfs/dbraw/zinc/27/41/35/1129274135.db2.gz UOLYWROCWZIYEL-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO CC(C)(C)Oc1cc(NC2CC[NH+](C3CC3)CC2)ccc1[N+](=O)[O-] ZINC000301897957 1129281792 /nfs/dbraw/zinc/28/17/92/1129281792.db2.gz WHTDTEOMXATARY-UHFFFAOYSA-N 1 0 333.432 3.811 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000466418518 1129438419 /nfs/dbraw/zinc/43/84/19/1129438419.db2.gz YKTBXQYEJCQQQJ-IKFRKZOMSA-N 1 0 332.444 3.777 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000301978680 1129465918 /nfs/dbraw/zinc/46/59/18/1129465918.db2.gz AARHFXSPNOSSMT-OAHLLOKOSA-N 1 0 340.427 3.516 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@]2(C)CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000154127148 1129534670 /nfs/dbraw/zinc/53/46/70/1129534670.db2.gz WVVZUPJNOFTLBZ-KKXDTOCCSA-N 1 0 336.432 3.585 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000154455696 1129559758 /nfs/dbraw/zinc/55/97/58/1129559758.db2.gz SPRZGUPBLQGVDQ-QGZVFWFLSA-N 1 0 330.384 3.590 20 5 EHBDRO Cn1cc(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093441805 1129588132 /nfs/dbraw/zinc/58/81/32/1129588132.db2.gz LPKRGWQEWVZCLE-IYBDPMFKSA-N 1 0 340.427 3.617 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@@H]3C=C[C@H]4C[C@@H]3CO4)o2)c1 ZINC000922721864 1129643675 /nfs/dbraw/zinc/64/36/75/1129643675.db2.gz HFURZGXBVOWRIP-UXLLHSPISA-N 1 0 340.379 3.536 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000302027467 1129764208 /nfs/dbraw/zinc/76/42/08/1129764208.db2.gz QWDHZPCKWBZPBO-CQSZACIVSA-N 1 0 328.416 3.595 20 5 EHBDRO CCOC(=O)CC[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044545 1129796912 /nfs/dbraw/zinc/79/69/12/1129796912.db2.gz CNUYOTNLQMSFMT-LSDHHAIUSA-N 1 0 334.416 3.711 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196832 1129805726 /nfs/dbraw/zinc/80/57/26/1129805726.db2.gz VJEGJRHJRRZYOX-LSDHHAIUSA-N 1 0 341.411 3.687 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2(c3cccc(F)c3)CCOCC2)cc1 ZINC000131807475 1129844696 /nfs/dbraw/zinc/84/46/96/1129844696.db2.gz HIEHRWPZVFCENU-UHFFFAOYSA-N 1 0 344.386 3.572 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1C[C@H](C)C[C@H](C)C1 ZINC000227695577 1129917593 /nfs/dbraw/zinc/91/75/93/1129917593.db2.gz WJPWEVOCOHKVPV-GRYCIOLGSA-N 1 0 339.823 3.553 20 5 EHBDRO COc1cccc(NC[C@H](C)[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000355408452 1129950789 /nfs/dbraw/zinc/95/07/89/1129950789.db2.gz BJYGBUWTZIKBRN-AWEZNQCLSA-N 1 0 329.400 3.536 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509053 1129974376 /nfs/dbraw/zinc/97/43/76/1129974376.db2.gz SQGZRWBBRNFERJ-IAGOWNOFSA-N 1 0 328.416 3.837 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)[C@@H]1c1ccccc1 ZINC000245446191 1130208848 /nfs/dbraw/zinc/20/88/48/1130208848.db2.gz ZOENFVFMFGQBDH-HBUWYVDXSA-N 1 0 339.395 3.615 20 5 EHBDRO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246107123 1130344413 /nfs/dbraw/zinc/34/44/13/1130344413.db2.gz DJEJMQDPYMIZCT-WBVHZDCISA-N 1 0 326.400 3.627 20 5 EHBDRO C[N@H+](CCc1ccc(Cl)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000733301264 1131018799 /nfs/dbraw/zinc/01/87/99/1131018799.db2.gz ZFJJMOFIQCMGBT-UHFFFAOYSA-N 1 0 344.802 3.730 20 5 EHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146882 1131691291 /nfs/dbraw/zinc/69/12/91/1131691291.db2.gz QUTPUKJPDRUQSA-OAHLLOKOSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cnccc1Cl)CC2 ZINC001172896999 1131880601 /nfs/dbraw/zinc/88/06/01/1131880601.db2.gz VYGARVWYXWOKKR-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(C3CCCC3)CC2)c1 ZINC000743377885 1131914977 /nfs/dbraw/zinc/91/49/77/1131914977.db2.gz RBLTVKNHLPKPCW-UHFFFAOYSA-N 1 0 328.416 3.804 20 5 EHBDRO CCC[NH+](CCC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014922 1131935964 /nfs/dbraw/zinc/93/59/64/1131935964.db2.gz WJWMDNITRJMOKK-UHFFFAOYSA-N 1 0 341.402 3.964 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013792 1131936204 /nfs/dbraw/zinc/93/62/04/1131936204.db2.gz FXUFAQPXBPSZKY-GFCCVEGCSA-N 1 0 339.386 3.716 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCCc2ccccc2)c1F ZINC001173174670 1131990734 /nfs/dbraw/zinc/99/07/34/1131990734.db2.gz AJKVDHISHVUQDY-CQSZACIVSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2cccc(C)c2)c1F ZINC001173175172 1131991135 /nfs/dbraw/zinc/99/11/35/1131991135.db2.gz LGGBAGKIBAPNDP-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC3(CCCC3)C2)c1F ZINC001173188472 1131993847 /nfs/dbraw/zinc/99/38/47/1131993847.db2.gz FOUJUQWVBKJNIS-ZDUSSCGKSA-N 1 0 336.407 3.940 20 5 EHBDRO CC[N@H+](Cc1ccncc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184465 1131994147 /nfs/dbraw/zinc/99/41/47/1131994147.db2.gz NLNGUFBXLZLSFZ-ZDUSSCGKSA-N 1 0 347.390 3.591 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173218014 1132002489 /nfs/dbraw/zinc/00/24/89/1132002489.db2.gz IOEQSHUQIGAWJM-SCLBCKFNSA-N 1 0 342.395 3.648 20 5 EHBDRO COc1cccc2c(C[NH3+])cn([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)c21 ZINC001173222078 1132004164 /nfs/dbraw/zinc/00/41/64/1132004164.db2.gz SVZDEWFPUJYKCG-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220205 1132004608 /nfs/dbraw/zinc/00/46/08/1132004608.db2.gz VWKUCHHAZYCAJV-CABCVRRESA-N 1 0 328.412 3.842 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOc1cccc(F)c1 ZINC001173220185 1132004662 /nfs/dbraw/zinc/00/46/62/1132004662.db2.gz VPDKVVZODXWUBM-AWEZNQCLSA-N 1 0 332.375 3.724 20 5 EHBDRO Cc1cccc(C2(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC001173226931 1132006744 /nfs/dbraw/zinc/00/67/44/1132006744.db2.gz DQELTBJTLGMMFS-OAHLLOKOSA-N 1 0 325.412 3.551 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC001173225363 1132006868 /nfs/dbraw/zinc/00/68/68/1132006868.db2.gz JMPZREPYBLQDKL-YVEFUNNKSA-N 1 0 330.815 3.936 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCOc1ccccc1 ZINC001173231210 1132009662 /nfs/dbraw/zinc/00/96/62/1132009662.db2.gz YNSYDERATORIIC-MRXNPFEDSA-N 1 0 328.412 3.975 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OC(F)F)cc1 ZINC001173213249 1132014164 /nfs/dbraw/zinc/01/41/64/1132014164.db2.gz HGRYYXLZZJXSEN-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001173238451 1132027939 /nfs/dbraw/zinc/02/79/39/1132027939.db2.gz SRZKTLDQYUELGT-LBPRGKRZSA-N 1 0 332.350 3.862 20 5 EHBDRO C[NH+](C)Cc1ccccc1-n1c2ccccc2cc2c(=O)c(N)ccc1-2 ZINC001173930346 1132187745 /nfs/dbraw/zinc/18/77/45/1132187745.db2.gz DMSRFKMSSOBABA-UHFFFAOYSA-N 1 0 343.430 3.739 20 5 EHBDRO COc1cccc(CC[NH+]2CCCC2)c1Nc1ccc([N+](=O)[O-])cc1 ZINC001174477962 1132382333 /nfs/dbraw/zinc/38/23/33/1132382333.db2.gz FRFSWNRRDGPLHM-UHFFFAOYSA-N 1 0 341.411 3.985 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168966128 1132621775 /nfs/dbraw/zinc/62/17/75/1132621775.db2.gz GLQOJGFYAOLPDH-HOCLYGCPSA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001168973476 1132624994 /nfs/dbraw/zinc/62/49/94/1132624994.db2.gz OTXCLGZFUDKAQY-SKDRFNHKSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccnc(C(F)(F)F)c2)C2CC2)C1 ZINC001168997034 1132627760 /nfs/dbraw/zinc/62/77/60/1132627760.db2.gz BCEWAKORJOXNGL-RIEGTJTDSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cccc(Br)c2Cl)C1 ZINC001168990266 1132634774 /nfs/dbraw/zinc/63/47/74/1132634774.db2.gz ZKECFOVVINFFAC-KOLCDFICSA-N 1 0 347.640 3.638 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2c3ccc(Cl)cc3c3c2CC[NH2+]C3)C1 ZINC001169030325 1132636027 /nfs/dbraw/zinc/63/60/27/1132636027.db2.gz YSPCZSDYTBSNSB-WCQYABFASA-N 1 0 333.819 3.558 20 5 EHBDRO Nc1ccc2cc3ccc(Nc4cnc5n[nH]cc5c4)cc3[nH+]c2c1 ZINC001175404979 1132660972 /nfs/dbraw/zinc/66/09/72/1132660972.db2.gz SAEANDZGVONSMI-UHFFFAOYSA-N 1 0 326.363 3.985 20 5 EHBDRO [NH3+]Cc1cccc2c1cnn2-c1cc2cccnc2c2ncccc12 ZINC001169191478 1132688176 /nfs/dbraw/zinc/68/81/76/1132688176.db2.gz CDBGLTHAEGYTGI-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)Cc1ccsc1 ZINC001169604455 1132793111 /nfs/dbraw/zinc/79/31/11/1132793111.db2.gz MJSRNRVGEMEJCU-CQSZACIVSA-N 1 0 334.441 3.988 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NC[C@H](CO)Cc1ccccc1 ZINC001169902909 1132893655 /nfs/dbraw/zinc/89/36/55/1132893655.db2.gz AQUHUDUXPAHICI-LJQANCHMSA-N 1 0 327.492 3.546 20 5 EHBDRO C[NH+](C)Cc1ccc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)cc1 ZINC001176295912 1132894455 /nfs/dbraw/zinc/89/44/55/1132894455.db2.gz QHLZGVGVBFXRBH-UHFFFAOYSA-N 1 0 343.430 3.739 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3cc(O)ccc3C2)c1 ZINC000767730132 1133044514 /nfs/dbraw/zinc/04/45/14/1133044514.db2.gz XVUMDBGZHDZTHG-CQSZACIVSA-N 1 0 332.787 3.601 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177294667 1133047478 /nfs/dbraw/zinc/04/74/78/1133047478.db2.gz ONJUDYXXJUPIEV-NCSNTAPHSA-N 1 0 345.487 3.956 20 5 EHBDRO COc1ccc(CCC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001177449695 1133064243 /nfs/dbraw/zinc/06/42/43/1133064243.db2.gz JUAXWXFUBYEELA-UHFFFAOYSA-N 1 0 328.412 3.943 20 5 EHBDRO NC(=O)[C@@H]1CC[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000768138671 1133101617 /nfs/dbraw/zinc/10/16/17/1133101617.db2.gz QAXZFORQVFKEQN-CYBMUJFWSA-N 1 0 338.838 3.954 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1nc2c(s1)CCC2 ZINC001178326855 1133160050 /nfs/dbraw/zinc/16/00/50/1133160050.db2.gz RUUDGKSUAUFYHV-UHFFFAOYSA-N 1 0 337.832 3.526 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@H]1COc2ccccc2O1 ZINC001178978721 1133213303 /nfs/dbraw/zinc/21/33/03/1133213303.db2.gz ZSQYVVOIXPXVIG-HNNXBMFYSA-N 1 0 342.395 3.531 20 5 EHBDRO CC(C)(C)N1CC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142760 1133228952 /nfs/dbraw/zinc/22/89/52/1133228952.db2.gz MNGINLRZARKVOR-MRXNPFEDSA-N 1 0 343.427 3.817 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348062 1133242920 /nfs/dbraw/zinc/24/29/20/1133242920.db2.gz NFFKLIRTWXZGTI-JWXAPSBJSA-N 1 0 330.384 3.756 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H](CCO)C3CCCC3)o2)c1 ZINC001179670522 1133272770 /nfs/dbraw/zinc/27/27/70/1133272770.db2.gz VEIHPPOURGNGMJ-SFHVURJKSA-N 1 0 344.411 3.886 20 5 EHBDRO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@@H](O)c1ccc(C)cc1 ZINC000769483968 1133289051 /nfs/dbraw/zinc/28/90/51/1133289051.db2.gz QQJFNTVGECPOTR-LJQANCHMSA-N 1 0 328.412 3.767 20 5 EHBDRO C[C@H]1COCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000769457802 1133294778 /nfs/dbraw/zinc/29/47/78/1133294778.db2.gz UTNJBYLGSWQLSL-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@H](C2CC[NH+](C)CC2)C1 ZINC000770132206 1133391299 /nfs/dbraw/zinc/39/12/99/1133391299.db2.gz OZBJFAFBLUGATD-AWEZNQCLSA-N 1 0 337.851 3.725 20 5 EHBDRO CCC(CC)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)SC ZINC000774207816 1133634698 /nfs/dbraw/zinc/63/46/98/1133634698.db2.gz GECJHSNUDKAMGR-KGLIPLIRSA-N 1 0 340.493 3.786 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1(C)C ZINC001183135639 1133774313 /nfs/dbraw/zinc/77/43/13/1133774313.db2.gz CXHDJKQQYLLLAT-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000786880481 1133922985 /nfs/dbraw/zinc/92/29/85/1133922985.db2.gz QSCMDQWVTXCZKY-KBXCAEBGSA-N 1 0 346.427 3.914 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](C3CCCC3)CC2)c(C(F)F)c1 ZINC001184793025 1133991840 /nfs/dbraw/zinc/99/18/40/1133991840.db2.gz PGMMFTBZXFTPIU-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998594 1134017712 /nfs/dbraw/zinc/01/77/12/1134017712.db2.gz FIDYFXUKQMUMRD-RBSFLKMASA-N 1 0 342.443 3.921 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(-n2cccn2)c1 ZINC000788488847 1134131473 /nfs/dbraw/zinc/13/14/73/1134131473.db2.gz MFSGZZLCFXHSQD-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO CC[C@@H]1CN(c2sccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC001186070004 1134164438 /nfs/dbraw/zinc/16/44/38/1134164438.db2.gz MEBJYLAZTLMMTA-OAHLLOKOSA-N 1 0 331.441 3.757 20 5 EHBDRO COCCC1(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCCCC1 ZINC000788756682 1134165667 /nfs/dbraw/zinc/16/56/67/1134165667.db2.gz YJOVHFFZCLJEEV-CQSZACIVSA-N 1 0 335.448 3.815 20 5 EHBDRO CCO[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788772831 1134173974 /nfs/dbraw/zinc/17/39/74/1134173974.db2.gz BIJBGHUJPVTSAC-SCLBCKFNSA-N 1 0 329.400 3.605 20 5 EHBDRO CCO[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788772832 1134174035 /nfs/dbraw/zinc/17/40/35/1134174035.db2.gz BIJBGHUJPVTSAC-UGSOOPFHSA-N 1 0 329.400 3.605 20 5 EHBDRO O=[N+]([O-])c1c(NCC2CC[NH+](C3CC3)CC2)cccc1C(F)(F)F ZINC001186316616 1134199436 /nfs/dbraw/zinc/19/94/36/1134199436.db2.gz WSZPDHDHPUQRAY-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CC(C)C[N@H+](C)CCCNc1c(Br)cccc1[N+](=O)[O-] ZINC001186913269 1134273766 /nfs/dbraw/zinc/27/37/66/1134273766.db2.gz ADXJTRASWLTLGS-UHFFFAOYSA-N 1 0 344.253 3.747 20 5 EHBDRO CC1(C)CC[N@H+](CCNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC001187861553 1134391602 /nfs/dbraw/zinc/39/16/02/1134391602.db2.gz KOISBWMJMLGZGX-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO Cn1c2ccc(F)cc2nc1NCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000775159450 1134418945 /nfs/dbraw/zinc/41/89/45/1134418945.db2.gz QCUWLJFXFOFYQE-UHFFFAOYSA-N 1 0 334.738 3.886 20 5 EHBDRO CCCc1ccc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC001190332339 1134684017 /nfs/dbraw/zinc/68/40/17/1134684017.db2.gz RPZRXISUGOJZJD-UHFFFAOYSA-N 1 0 339.439 3.870 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000775375412 1134684395 /nfs/dbraw/zinc/68/43/95/1134684395.db2.gz STFNJMCYTQKAKA-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC001170296628 1134737038 /nfs/dbraw/zinc/73/70/38/1134737038.db2.gz HCESNVXMKAARDY-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170297194 1134737120 /nfs/dbraw/zinc/73/71/20/1134737120.db2.gz LVSLTJLJJGAMNS-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cccc(F)c2C)c([N+](=O)[O-])c1 ZINC001170305593 1134739586 /nfs/dbraw/zinc/73/95/86/1134739586.db2.gz NOFGZPOJKBIQEI-GFCCVEGCSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170323407 1134747233 /nfs/dbraw/zinc/74/72/33/1134747233.db2.gz JMTSLPVMDWNQSC-YOEHRIQHSA-N 1 0 340.423 3.854 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCc3ccncc32)c([N+](=O)[O-])c1 ZINC001170325835 1134748313 /nfs/dbraw/zinc/74/83/13/1134748313.db2.gz AMJKJBIBVHYDRI-SCLBCKFNSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CCc3ccccc3CC2)c([N+](=O)[O-])c1 ZINC001170345251 1134758455 /nfs/dbraw/zinc/75/84/55/1134758455.db2.gz IZWWJDHOEVLARX-HNNXBMFYSA-N 1 0 340.423 3.635 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792877045 1134811486 /nfs/dbraw/zinc/81/14/86/1134811486.db2.gz PSUFYWYTFZYHGQ-CYBMUJFWSA-N 1 0 343.383 3.959 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](C)[C@H]1c1ccc(C)cc1 ZINC001191184188 1134821267 /nfs/dbraw/zinc/82/12/67/1134821267.db2.gz VEFYAGDIAVMLPU-KXBFYZLASA-N 1 0 342.443 3.881 20 5 EHBDRO C[C@H](CCNC(=O)OC(C)(C)C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000793598714 1134966399 /nfs/dbraw/zinc/96/63/99/1134966399.db2.gz BFWBNGSOPYSBCP-RCQQVGEISA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617515 1135040787 /nfs/dbraw/zinc/04/07/87/1135040787.db2.gz UPOSFOPNHBMSFY-MSOLQXFVSA-N 1 0 348.349 3.647 20 5 EHBDRO Cc1ccc(N[C@H]2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504170 1135093464 /nfs/dbraw/zinc/09/34/64/1135093464.db2.gz NMBHZFQLZVWSGQ-QWRGUYRKSA-N 1 0 342.237 3.560 20 5 EHBDRO CC[C@@H]1Cc2ccccc2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001193119686 1135104762 /nfs/dbraw/zinc/10/47/62/1135104762.db2.gz YZXXWWCYLAWKQK-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCCC[C@@H]2C)c1 ZINC000747207158 1135163715 /nfs/dbraw/zinc/16/37/15/1135163715.db2.gz HKTIEOOOSIYCRN-ZDUSSCGKSA-N 1 0 339.411 3.809 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781931 1135199582 /nfs/dbraw/zinc/19/95/82/1135199582.db2.gz LBNHQALBKBOHIH-NWDGAFQWSA-N 1 0 348.359 3.637 20 5 EHBDRO C[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC001194394959 1135263295 /nfs/dbraw/zinc/26/32/95/1135263295.db2.gz XLNQAVSSBGFOFQ-HNNXBMFYSA-N 1 0 345.468 3.610 20 5 EHBDRO CN(CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC001194683619 1135305509 /nfs/dbraw/zinc/30/55/09/1135305509.db2.gz PFDOCHPLTBLELO-UHFFFAOYSA-N 1 0 327.428 3.552 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1CC1CCCC1 ZINC001195639453 1135445586 /nfs/dbraw/zinc/44/55/86/1135445586.db2.gz URHSTALJFIOSQE-MRXNPFEDSA-N 1 0 345.443 3.886 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@H]2CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001195795707 1135470750 /nfs/dbraw/zinc/47/07/50/1135470750.db2.gz AJWWFPGEQATJEB-INIZCTEOSA-N 1 0 348.443 3.990 20 5 EHBDRO CCCCN(Cc1cccnc1[N+](=O)[O-])C1CC(C)(C)[NH2+]C(C)(C)C1 ZINC001196545654 1135579308 /nfs/dbraw/zinc/57/93/08/1135579308.db2.gz SAPCROPURPRYMY-UHFFFAOYSA-N 1 0 348.491 3.901 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000807917038 1135590039 /nfs/dbraw/zinc/59/00/39/1135590039.db2.gz IOZYZUOLFFDLPO-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO Cc1nn(C[NH+]2CCC(C)(CC(C)C)CC2)c2ncc([N+](=O)[O-])cc12 ZINC000808231285 1135638390 /nfs/dbraw/zinc/63/83/90/1135638390.db2.gz CIRUNLSKTPNZJN-UHFFFAOYSA-N 1 0 345.447 3.754 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC001197611047 1135708027 /nfs/dbraw/zinc/70/80/27/1135708027.db2.gz MXBVFVQHDGCHEG-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1cc(Cl)cc(Cl)c1F ZINC001197610214 1135708099 /nfs/dbraw/zinc/70/80/99/1135708099.db2.gz CVABIQGWAPENSZ-MRVPVSSYSA-N 1 0 347.177 3.588 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[NH+](C2CCCC2)CC1 ZINC000809347544 1135822320 /nfs/dbraw/zinc/82/23/20/1135822320.db2.gz VQEUHAGZLUFTBB-UHFFFAOYSA-N 1 0 325.359 3.597 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001198818849 1135859755 /nfs/dbraw/zinc/85/97/55/1135859755.db2.gz BRJRALKJMCHOJR-FFZOFVMBSA-N 1 0 343.471 3.772 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700321 1135868955 /nfs/dbraw/zinc/86/89/55/1135868955.db2.gz CPTYFTGQFHIUPE-TZMCWYRMSA-N 1 0 326.824 3.764 20 5 EHBDRO CO[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[C@@H]1C ZINC000809984858 1135908744 /nfs/dbraw/zinc/90/87/44/1135908744.db2.gz AYXNAZUUHMNPBW-TVQRCGJNSA-N 1 0 333.215 3.758 20 5 EHBDRO CO[C@@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[C@H]1C ZINC000809984856 1135908782 /nfs/dbraw/zinc/90/87/82/1135908782.db2.gz AYXNAZUUHMNPBW-NOZJJQNGSA-N 1 0 333.215 3.758 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC3(CCC3)[C@@H]2[C@@H]2CCCO2)ccc1Cl ZINC000810093563 1135920513 /nfs/dbraw/zinc/92/05/13/1135920513.db2.gz OCYLLNWFZZDZNT-HOTGVXAUSA-N 1 0 336.819 3.782 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001199720883 1135922847 /nfs/dbraw/zinc/92/28/47/1135922847.db2.gz BGHAOIDPBSSXBU-GOSISDBHSA-N 1 0 342.439 3.659 20 5 EHBDRO CC(C)[C@H](C(=O)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+](C)C ZINC000811085627 1136047825 /nfs/dbraw/zinc/04/78/25/1136047825.db2.gz UUTHDROXLMFSII-GFCCVEGCSA-N 1 0 349.214 3.531 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H](O)c1ccccc1 ZINC000811471957 1136095049 /nfs/dbraw/zinc/09/50/49/1136095049.db2.gz OSERSBBCHDJKRO-AWEZNQCLSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1oc(-c2cccs2)nc1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC001202228765 1136108025 /nfs/dbraw/zinc/10/80/25/1136108025.db2.gz XELNWVVPXMAOFV-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccccc2)CC2CCC2)cc1 ZINC000776275054 1136129252 /nfs/dbraw/zinc/12/92/52/1136129252.db2.gz FVHQKPVRPOBJFF-HXUWFJFHSA-N 1 0 340.423 3.931 20 5 EHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278194 1136133878 /nfs/dbraw/zinc/13/38/78/1136133878.db2.gz SNIKGPBPMFXYHI-RBUKOAKNSA-N 1 0 326.396 3.774 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1ccc(Cl)nc1 ZINC000850441294 1136259248 /nfs/dbraw/zinc/25/92/48/1136259248.db2.gz UPDHZOQJPWGTTK-NSHDSACASA-N 1 0 335.791 3.545 20 5 EHBDRO CC[C@@H](C)[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579236 1136444204 /nfs/dbraw/zinc/44/42/04/1136444204.db2.gz KAYKLDLKDFZHPI-BEFAXECRSA-N 1 0 328.412 3.929 20 5 EHBDRO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000776579583 1136444634 /nfs/dbraw/zinc/44/46/34/1136444634.db2.gz NRNUGIQQOYBPDW-LIRRHRJNSA-N 1 0 344.411 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666338 1136491840 /nfs/dbraw/zinc/49/18/40/1136491840.db2.gz GMGJIIKVNURMBM-YJBOKZPZSA-N 1 0 346.814 3.771 20 5 EHBDRO Cc1cccc2c1CCC[C@H]2[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000853126134 1136512405 /nfs/dbraw/zinc/51/24/05/1136512405.db2.gz BXHDUDWFAPKGGD-MOPGFXCFSA-N 1 0 326.396 3.604 20 5 EHBDRO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCC[C@@H](C)C1 ZINC000111193289 1136520373 /nfs/dbraw/zinc/52/03/73/1136520373.db2.gz PYRIPQLZTJNOGG-NEPJUHHUSA-N 1 0 334.445 3.737 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(C2CCC2)s1 ZINC000338959429 1136604912 /nfs/dbraw/zinc/60/49/12/1136604912.db2.gz YNJZYVTVPRLMOF-UHFFFAOYSA-N 1 0 331.441 3.993 20 5 EHBDRO C[C@@H]([NH2+]CCCn1ccc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554437 1136609926 /nfs/dbraw/zinc/60/99/26/1136609926.db2.gz ZKFLEOQPQVGXJT-CQSZACIVSA-N 1 0 338.411 3.873 20 5 EHBDRO CC(C)(CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C1CC1 ZINC000815657348 1136622966 /nfs/dbraw/zinc/62/29/66/1136622966.db2.gz WVGGETKKMYSLBX-UHFFFAOYSA-N 1 0 331.460 3.980 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@@H](c3ccc(F)cc3)C2)c1 ZINC000819274212 1136930802 /nfs/dbraw/zinc/93/08/02/1136930802.db2.gz FSGBDJAFJODHSH-DKSSEZFCSA-N 1 0 344.386 3.693 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1 ZINC000819334429 1136932354 /nfs/dbraw/zinc/93/23/54/1136932354.db2.gz XYIVCMJQBOHUOV-HBUWYVDXSA-N 1 0 346.814 3.817 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040794 1136934434 /nfs/dbraw/zinc/93/44/34/1136934434.db2.gz QGEJQCXSUFLQPN-DOTOQJQBSA-N 1 0 341.411 3.821 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)cn1 ZINC000858341949 1136959642 /nfs/dbraw/zinc/95/96/42/1136959642.db2.gz IDTAYPVBTRBXLM-QGZVFWFLSA-N 1 0 347.802 3.893 20 5 EHBDRO Cc1ccc(NC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)n1 ZINC000777256378 1137142996 /nfs/dbraw/zinc/14/29/96/1137142996.db2.gz WQYLMVZCBMYBAY-UHFFFAOYSA-N 1 0 326.400 3.688 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483471 1137146504 /nfs/dbraw/zinc/14/65/04/1137146504.db2.gz UPRYHHFOWAQTDM-ZGBFETHSSA-N 1 0 338.407 3.592 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2cc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000339058930 1137192409 /nfs/dbraw/zinc/19/24/09/1137192409.db2.gz JDCKZINDCPWFIW-UHFFFAOYSA-N 1 0 339.351 3.655 20 5 EHBDRO C[C@@H](CSc1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359983 1137215344 /nfs/dbraw/zinc/21/53/44/1137215344.db2.gz LXGJXYNJJPNODU-KSSFIOAISA-N 1 0 346.452 3.741 20 5 EHBDRO CCCCC[C@@H]1CCCN1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631448 1137221732 /nfs/dbraw/zinc/22/17/32/1137221732.db2.gz AVGCYAUGQSCQCD-CYBMUJFWSA-N 1 0 333.388 3.505 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1 ZINC001171188383 1137297636 /nfs/dbraw/zinc/29/76/36/1137297636.db2.gz BKHCZRLCYNWANS-SNPRPXQTSA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)([NH3+])CNc1ccc2ccc3ccc(Br)nc3c2n1 ZINC001171192572 1137300790 /nfs/dbraw/zinc/30/07/90/1137300790.db2.gz FWXNTTCGQMIMBQ-UHFFFAOYSA-N 1 0 345.244 3.695 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000866310501 1137344621 /nfs/dbraw/zinc/34/46/21/1137344621.db2.gz FAMKZKDPBLVWFO-VMGRFDJRSA-N 1 0 338.423 3.848 20 5 EHBDRO COCc1cc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)ccc1OC ZINC000866539301 1137362855 /nfs/dbraw/zinc/36/28/55/1137362855.db2.gz JQFRTRQWJFLXAR-CQSZACIVSA-N 1 0 344.411 3.909 20 5 EHBDRO CCC[C@H]([NH2+]Cc1cccc2c1OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000772987890 1137419902 /nfs/dbraw/zinc/41/99/02/1137419902.db2.gz ZIIWMCLNGOJYNY-KRWDZBQOSA-N 1 0 342.395 3.997 20 5 EHBDRO Cc1ncc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000773083052 1137463920 /nfs/dbraw/zinc/46/39/20/1137463920.db2.gz RYQNUUVTUTZYPP-MRXNPFEDSA-N 1 0 331.441 3.513 20 5 EHBDRO C[C@H]1CC[C@@](CO)([N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100779 1137484662 /nfs/dbraw/zinc/48/46/62/1137484662.db2.gz VCGUXVDPVGHTRM-XHDPSFHLSA-N 1 0 346.349 3.597 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000872022240 1137565189 /nfs/dbraw/zinc/56/51/89/1137565189.db2.gz IHPGXFXMNTWRCD-RCBQFDQVSA-N 1 0 335.473 3.594 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1ccccn1 ZINC000872084428 1137570410 /nfs/dbraw/zinc/57/04/10/1137570410.db2.gz SBQGPTFLILGRTC-OLZOCXBDSA-N 1 0 331.441 3.994 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC(=O)Nc1c(C)cccc1C ZINC000873008638 1137587920 /nfs/dbraw/zinc/58/79/20/1137587920.db2.gz SJBDBPKCPXGGPL-UHFFFAOYSA-N 1 0 341.411 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000873097792 1137590164 /nfs/dbraw/zinc/59/01/64/1137590164.db2.gz FZHGVGQKFVNBHC-LFPIHBKWSA-N 1 0 346.452 3.800 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000876945379 1137665861 /nfs/dbraw/zinc/66/58/61/1137665861.db2.gz BNQCNJQYZJWGEL-SASJJMKUSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877077453 1137669706 /nfs/dbraw/zinc/66/97/06/1137669706.db2.gz IQSFYMHCWGBETM-BRHYBRFTSA-N 1 0 344.390 3.547 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc2ccccc2o1 ZINC000877463787 1137677122 /nfs/dbraw/zinc/67/71/22/1137677122.db2.gz HRJPGJLQKNBORX-LMWSTFAQSA-N 1 0 326.356 3.592 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCC[C@H]3c3ccccc3)C2)c1 ZINC000877559304 1137681273 /nfs/dbraw/zinc/68/12/73/1137681273.db2.gz USAXMGAUYQXHCH-JIZBTBOESA-N 1 0 340.427 3.668 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 ZINC000126717303 1137689155 /nfs/dbraw/zinc/68/91/55/1137689155.db2.gz QFRRFGZFIZSMRV-JOYOIKCWSA-N 1 0 326.805 3.694 20 5 EHBDRO OCC1(CO)CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000877799267 1137690236 /nfs/dbraw/zinc/69/02/36/1137690236.db2.gz LNBCNHRCTMVGHK-UHFFFAOYSA-N 1 0 335.447 3.560 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@H]2C2CC2)o1 ZINC000878050630 1137700841 /nfs/dbraw/zinc/70/08/41/1137700841.db2.gz ZLZALHDQRGKBCE-ZDUSSCGKSA-N 1 0 348.790 3.673 20 5 EHBDRO C[C@H]1C[C@H](C)[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878127041 1137703445 /nfs/dbraw/zinc/70/34/45/1137703445.db2.gz XFIXYFZREWFYDK-UWVGGRQHSA-N 1 0 336.779 3.529 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000878369778 1137713151 /nfs/dbraw/zinc/71/31/51/1137713151.db2.gz APBPZPPITZYBFP-ROUUACIJSA-N 1 0 348.443 3.611 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000878369777 1137713178 /nfs/dbraw/zinc/71/31/78/1137713178.db2.gz APBPZPPITZYBFP-QZTJIDSGSA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1csc2ccccc12 ZINC000878421175 1137715205 /nfs/dbraw/zinc/71/52/05/1137715205.db2.gz SOOIBXOOLDARDE-NSHDSACASA-N 1 0 330.413 3.665 20 5 EHBDRO C[C@H]1CCC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507752 1137718387 /nfs/dbraw/zinc/71/83/87/1137718387.db2.gz JPBFLDWDBDHSSH-JOYOIKCWSA-N 1 0 336.779 3.576 20 5 EHBDRO C[C@@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878811584 1137728939 /nfs/dbraw/zinc/72/89/39/1137728939.db2.gz MFTROUJLZCUXGK-SECBINFHSA-N 1 0 338.795 3.822 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000879210223 1137741223 /nfs/dbraw/zinc/74/12/23/1137741223.db2.gz WRJDELOMCIVOLF-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@H]1CCCOC1 ZINC000880466731 1137779527 /nfs/dbraw/zinc/77/95/27/1137779527.db2.gz QLOUJWZVKYIATD-YOEHRIQHSA-N 1 0 336.432 3.677 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000130625697 1137840130 /nfs/dbraw/zinc/84/01/30/1137840130.db2.gz WVUODFOSEWKOBK-ICSRJNTNSA-N 1 0 340.423 3.548 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC[C@@H]2CCCC2(F)F)n1 ZINC000883274639 1137851897 /nfs/dbraw/zinc/85/18/97/1137851897.db2.gz QSDUOKXPCBCYLR-BFHYXJOUSA-N 1 0 342.390 3.690 20 5 EHBDRO CC[C@H](c1ccncc1)[N@H+](CC)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000131487311 1137854389 /nfs/dbraw/zinc/85/43/89/1137854389.db2.gz XCNBFEJZWROOSV-QGZVFWFLSA-N 1 0 339.399 3.770 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000132569550 1137867474 /nfs/dbraw/zinc/86/74/74/1137867474.db2.gz LCAVRYHJNIQMPG-GJZGRUSLSA-N 1 0 326.487 3.874 20 5 EHBDRO C[C@](CO)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000348253312 1137881369 /nfs/dbraw/zinc/88/13/69/1137881369.db2.gz DMQLSIHOZRZCDP-WOJBJXKFSA-N 1 0 340.423 3.512 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@@H]1CCCC[C@H]1O)CCC2 ZINC000331675290 1137916849 /nfs/dbraw/zinc/91/68/49/1137916849.db2.gz PQBPXXIKWUNCAJ-KFKAGJAMSA-N 1 0 332.444 3.893 20 5 EHBDRO CC(C)n1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861037 1137935987 /nfs/dbraw/zinc/93/59/87/1137935987.db2.gz UBSOWEIZGBFNTQ-HOCLYGCPSA-N 1 0 343.431 3.708 20 5 EHBDRO C[C@@H]1C[C@@H](C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119245033 1137939505 /nfs/dbraw/zinc/93/95/05/1137939505.db2.gz GXQJTLBXQIGZSW-ZOWXZIJZSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000332323338 1137939796 /nfs/dbraw/zinc/93/97/96/1137939796.db2.gz NYZKVZSQMMVONP-GJZGRUSLSA-N 1 0 328.416 3.577 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000120958380 1137953976 /nfs/dbraw/zinc/95/39/76/1137953976.db2.gz CQKHGNGACFPSAH-CYBMUJFWSA-N 1 0 331.391 3.646 20 5 EHBDRO C[C@@H]1SCCN(Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886014442 1138032378 /nfs/dbraw/zinc/03/23/78/1138032378.db2.gz HQRKTEWTVFTWIH-XJKSGUPXSA-N 1 0 329.425 3.668 20 5 EHBDRO Cc1ccc(C[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000136999104 1138045054 /nfs/dbraw/zinc/04/50/54/1138045054.db2.gz DAVAQHMVOUJIIL-KRWDZBQOSA-N 1 0 334.441 3.909 20 5 EHBDRO CC(C)(C)OC(=O)CC1([NH2+]Cc2cccnc2[N+](=O)[O-])CCCCC1 ZINC000886274505 1138063197 /nfs/dbraw/zinc/06/31/97/1138063197.db2.gz VCBQYJCDTYAZFT-UHFFFAOYSA-N 1 0 349.431 3.514 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066264 1138224396 /nfs/dbraw/zinc/22/43/96/1138224396.db2.gz WKYNLOMPHWPJDJ-NMXXFREBSA-N 1 0 341.455 3.557 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134922593 1138713466 /nfs/dbraw/zinc/71/34/66/1138713466.db2.gz UGWKHLIUPLNLSS-IDHHARJASA-N 1 0 329.444 3.605 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c2ccncc21 ZINC000150879618 1138989784 /nfs/dbraw/zinc/98/97/84/1138989784.db2.gz KXCKIQILCYTNEC-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2csc(CC)n2)cc1[N+](=O)[O-] ZINC000153503116 1139139989 /nfs/dbraw/zinc/13/99/89/1139139989.db2.gz KPKPCUJLVSRWTC-GFCCVEGCSA-N 1 0 349.456 3.906 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750109 1139150907 /nfs/dbraw/zinc/15/09/07/1139150907.db2.gz GQFIYOVMVJDOFD-RDTXWAMCSA-N 1 0 344.411 3.686 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc(C)c([N+](=O)[O-])c1 ZINC000177330032 1139613184 /nfs/dbraw/zinc/61/31/84/1139613184.db2.gz NUJRACZXLIEOQI-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H](C)c1ccccc1 ZINC000177582533 1139628013 /nfs/dbraw/zinc/62/80/13/1139628013.db2.gz SVKHYEUOFASZQW-ZIAGYGMSSA-N 1 0 342.395 3.743 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000178331945 1139688424 /nfs/dbraw/zinc/68/84/24/1139688424.db2.gz PKXXTRZGILAMGH-MDPRTELFSA-N 1 0 338.473 3.715 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000179403306 1139754849 /nfs/dbraw/zinc/75/48/49/1139754849.db2.gz UGEZCLIIXUHIFY-NSHDSACASA-N 1 0 335.791 3.893 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000181842276 1139935848 /nfs/dbraw/zinc/93/58/48/1139935848.db2.gz WTQNUIARCLMNRJ-NSHDSACASA-N 1 0 348.424 3.911 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000183876302 1140063522 /nfs/dbraw/zinc/06/35/22/1140063522.db2.gz UCPUVTLPKFAVIB-AWEZNQCLSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193043620 1140562243 /nfs/dbraw/zinc/56/22/43/1140562243.db2.gz SQWFJQZZYMJHRC-APPDUMDISA-N 1 0 329.400 3.970 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000266142193 1140647224 /nfs/dbraw/zinc/64/72/24/1140647224.db2.gz HKKXRLHCJUEFLC-CHWSQXEVSA-N 1 0 332.425 3.838 20 5 EHBDRO COCCOc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000268898140 1141020622 /nfs/dbraw/zinc/02/06/22/1141020622.db2.gz BYFMQHZBPDVZJC-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@H]1CCC[NH2+]C1 ZINC000269217100 1141080118 /nfs/dbraw/zinc/08/01/18/1141080118.db2.gz RADOEEXMFMZLDS-HOCLYGCPSA-N 1 0 333.435 3.506 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672669 1141134134 /nfs/dbraw/zinc/13/41/34/1141134134.db2.gz RKPNDQBAFOYLGJ-VKJFTORMSA-N 1 0 329.444 3.605 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCC[C@H]1O ZINC000270170605 1141187702 /nfs/dbraw/zinc/18/77/02/1141187702.db2.gz UGPBAVRPUOMXHN-MAUKXSAKSA-N 1 0 337.419 3.539 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cn(C)nc1C ZINC000271131394 1141311372 /nfs/dbraw/zinc/31/13/72/1141311372.db2.gz MBAAYTPCXXODTN-OCCSQVGLSA-N 1 0 348.472 3.858 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(C2CC2)CC1 ZINC000271131124 1141311989 /nfs/dbraw/zinc/31/19/89/1141311989.db2.gz LVWKBPFAOWCOTK-CQSZACIVSA-N 1 0 349.500 3.682 20 5 EHBDRO CCOCCCC[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271163816 1141316497 /nfs/dbraw/zinc/31/64/97/1141316497.db2.gz SJSOCPKLKOBHDC-AWEZNQCLSA-N 1 0 326.462 3.872 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000271255227 1141335513 /nfs/dbraw/zinc/33/55/13/1141335513.db2.gz LLBCNVOHMDPWBH-OCCSQVGLSA-N 1 0 332.425 3.980 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000271430666 1141364528 /nfs/dbraw/zinc/36/45/28/1141364528.db2.gz BWZNGUUDZPRMJF-LBPRGKRZSA-N 1 0 348.472 3.855 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000271515341 1141385519 /nfs/dbraw/zinc/38/55/19/1141385519.db2.gz OPZBABKBORKYRR-HIFRSBDPSA-N 1 0 334.416 3.746 20 5 EHBDRO [NH3+]CCN(Cc1csc(Cl)c1Cl)c1ccccc1[N+](=O)[O-] ZINC000348936353 1141612423 /nfs/dbraw/zinc/61/24/23/1141612423.db2.gz SXDFHQOCIQGSKP-UHFFFAOYSA-N 1 0 346.239 3.928 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C/c2ccc3cc([N+](=O)[O-])ccc3n2)s1 ZINC000349113081 1141640446 /nfs/dbraw/zinc/64/04/46/1141640446.db2.gz PSVVKLLHLJIKOI-VMPITWQZSA-N 1 0 340.408 3.832 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C/c2ccc3cccc([N+](=O)[O-])c3n2)s1 ZINC000349108163 1141640563 /nfs/dbraw/zinc/64/05/63/1141640563.db2.gz KWVGYBDXGDERBU-CMDGGOBGSA-N 1 0 340.408 3.832 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC000175730103 1014820211 /nfs/dbraw/zinc/82/02/11/1014820211.db2.gz IDVQAQFYSCPIGR-KRWDZBQOSA-N 1 0 345.374 3.756 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000610215037 1015006739 /nfs/dbraw/zinc/00/67/39/1015006739.db2.gz YELKGCHBPYNEKH-INIZCTEOSA-N 1 0 326.396 3.668 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCn1cnc2ccccc21 ZINC000449064206 1032109152 /nfs/dbraw/zinc/10/91/52/1032109152.db2.gz SZCVQTNCXDSKKQ-HNNXBMFYSA-N 1 0 338.411 3.555 20 5 EHBDRO CSc1ccc([C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000339590664 1015089322 /nfs/dbraw/zinc/08/93/22/1015089322.db2.gz OHLNWYHBLCBGNU-GOSISDBHSA-N 1 0 345.468 3.709 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000430226728 1015124163 /nfs/dbraw/zinc/12/41/63/1015124163.db2.gz NQMFNJVEKFLXMX-JQHSSLGASA-N 1 0 348.443 3.629 20 5 EHBDRO CC(C)[N@@H+](C)C[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000578179164 1015149602 /nfs/dbraw/zinc/14/96/02/1015149602.db2.gz JUNXGXZZWILTLL-ZDUSSCGKSA-N 1 0 348.472 3.537 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000339670820 1015491696 /nfs/dbraw/zinc/49/16/96/1015491696.db2.gz FUFRMWBBMHGYDF-JSGCOSHPSA-N 1 0 342.399 3.828 20 5 EHBDRO CC(=O)N1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000339762404 1015658339 /nfs/dbraw/zinc/65/83/39/1015658339.db2.gz HUNQPRZUTPSSSP-ACJLOTCBSA-N 1 0 339.395 3.743 20 5 EHBDRO CC(C)(CO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000136086749 1016807047 /nfs/dbraw/zinc/80/70/47/1016807047.db2.gz ATJNZFDVTWITLQ-UHFFFAOYSA-N 1 0 338.791 3.616 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000449076960 1032167841 /nfs/dbraw/zinc/16/78/41/1032167841.db2.gz VGGXZZYRFXFRQO-STQMWFEESA-N 1 0 328.368 3.605 20 5 EHBDRO CCc1ccc([C@@H](COC)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449152788 1032256057 /nfs/dbraw/zinc/25/60/57/1032256057.db2.gz HFUYDTHQZZSBAY-XJKSGUPXSA-N 1 0 332.400 3.659 20 5 EHBDRO COc1ccc([C@@H](C)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279529 1032267216 /nfs/dbraw/zinc/26/72/16/1032267216.db2.gz KEMYBECXNGQSGT-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO COc1ccccc1/C=C\C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000567000770 1032291811 /nfs/dbraw/zinc/29/18/11/1032291811.db2.gz RJRNRLANVITAHV-YFHOEESVSA-N 1 0 326.396 3.791 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCC[C@H]2O)ccc1Oc1ccc(F)cc1 ZINC000238089462 1032303772 /nfs/dbraw/zinc/30/37/72/1032303772.db2.gz NTZDPXYQQSYGBI-NVXWUHKLSA-N 1 0 346.358 3.529 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000449211480 1032314782 /nfs/dbraw/zinc/31/47/82/1032314782.db2.gz XSTITVVIAHIQDZ-XFQXTVEOSA-N 1 0 340.423 3.893 20 5 EHBDRO C[C@H]([NH2+]CCN1CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536841437 1032335314 /nfs/dbraw/zinc/33/53/14/1032335314.db2.gz UKUCIOWSGHSORI-ZDUSSCGKSA-N 1 0 331.441 3.680 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)CC(C)(C)C ZINC000536835371 1032331104 /nfs/dbraw/zinc/33/11/04/1032331104.db2.gz YBBHYYTTZGQAOP-UONOGXRCSA-N 1 0 340.489 3.852 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOc1ccc(F)c(F)c1 ZINC000536851047 1032348782 /nfs/dbraw/zinc/34/87/82/1032348782.db2.gz IAAWGXGOBMIJGB-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000459650945 1032373504 /nfs/dbraw/zinc/37/35/04/1032373504.db2.gz ONDCQVBBVVHFBG-HZPDHXFCSA-N 1 0 327.428 3.922 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000459666392 1032394919 /nfs/dbraw/zinc/39/49/19/1032394919.db2.gz MNPJCOIYRJDASK-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000449334530 1032469854 /nfs/dbraw/zinc/46/98/54/1032469854.db2.gz FCZFPQBLKOUIDE-IAQYHMDHSA-N 1 0 348.349 3.917 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000449480955 1032608429 /nfs/dbraw/zinc/60/84/29/1032608429.db2.gz QBADUICOUUHIAX-OAHLLOKOSA-N 1 0 334.803 3.768 20 5 EHBDRO COc1ccc(C2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000593041483 1032676724 /nfs/dbraw/zinc/67/67/24/1032676724.db2.gz QKKXHQBVZLGNQU-AWEZNQCLSA-N 1 0 341.411 3.939 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506992 1032691827 /nfs/dbraw/zinc/69/18/27/1032691827.db2.gz ZZYMDYKZVKYOMK-MRXNPFEDSA-N 1 0 342.395 3.689 20 5 EHBDRO C[C@@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944943 1017345811 /nfs/dbraw/zinc/34/58/11/1017345811.db2.gz HRKYYBAYAJVPBA-VXGBXAGGSA-N 1 0 349.818 3.738 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000155464031 1017783573 /nfs/dbraw/zinc/78/35/73/1017783573.db2.gz DLZDYJGVMIGQRB-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO CC[C@H]([NH2+]CCN(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000360252240 1017980090 /nfs/dbraw/zinc/98/00/90/1017980090.db2.gz VPEJPQYONKTXOL-IBGZPJMESA-N 1 0 327.428 3.768 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(N(C)C)c1 ZINC000468626803 1018497912 /nfs/dbraw/zinc/49/79/12/1018497912.db2.gz JGKCTNGDEYPBCL-GDNBJRDFSA-N 1 0 325.412 3.854 20 5 EHBDRO Cc1ccc(-c2csc([C@@H]3C[N@@H+]4CCC[C@@H]4CO3)n2)cc1[N+](=O)[O-] ZINC000102662597 1018572894 /nfs/dbraw/zinc/57/28/94/1018572894.db2.gz KCCPFLCSZRECDA-CJNGLKHVSA-N 1 0 345.424 3.562 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000480871979 1018608526 /nfs/dbraw/zinc/60/85/26/1018608526.db2.gz WELMNQOSVAQMSD-OAHLLOKOSA-N 1 0 345.418 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H](CCO)c1ccccc1F)CCC2 ZINC000592403640 1032798682 /nfs/dbraw/zinc/79/86/82/1032798682.db2.gz ROCHLRDRTBCCEY-OALUTQOASA-N 1 0 344.386 3.825 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120590104 1019074059 /nfs/dbraw/zinc/07/40/59/1019074059.db2.gz LJOUMRRAWKOZFI-STQMWFEESA-N 1 0 330.432 3.535 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000172576898 1032808146 /nfs/dbraw/zinc/80/81/46/1032808146.db2.gz WTSSUBUXWBEGFK-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000172576896 1032809473 /nfs/dbraw/zinc/80/94/73/1032809473.db2.gz WTSSUBUXWBEGFK-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NCC1([NH+]2CCSCC2)CCCC1 ZINC000513184792 1019403012 /nfs/dbraw/zinc/40/30/12/1019403012.db2.gz PRUVTLCNHNLUMN-UHFFFAOYSA-N 1 0 339.436 3.507 20 5 EHBDRO Cn1cc([C@H]2C[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000580841783 1020128791 /nfs/dbraw/zinc/12/87/91/1020128791.db2.gz MHGNXKVKQZKAHT-CQSZACIVSA-N 1 0 348.834 3.607 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)N(CC[NH+]1CCCCCC1)C(C)C ZINC000345890644 1020590924 /nfs/dbraw/zinc/59/09/24/1020590924.db2.gz RCDQMYNDLBTSDW-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CCCOC3CCCCC3)nc2c1 ZINC000602510157 1032944982 /nfs/dbraw/zinc/94/49/82/1032944982.db2.gz DGHDHWODNBLPKS-UHFFFAOYSA-N 1 0 333.388 3.565 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341203900 1021094975 /nfs/dbraw/zinc/09/49/75/1021094975.db2.gz DEEIOVIOGVSHTP-INIZCTEOSA-N 1 0 327.384 3.583 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341221997 1021123559 /nfs/dbraw/zinc/12/35/59/1021123559.db2.gz WQFNLHBONSEROH-MRXNPFEDSA-N 1 0 341.411 3.973 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccsc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000610514223 1021151570 /nfs/dbraw/zinc/15/15/70/1021151570.db2.gz YRZVGGJSWTWORV-HNNXBMFYSA-N 1 0 347.440 3.914 20 5 EHBDRO CSCCCC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602559708 1032972589 /nfs/dbraw/zinc/97/25/89/1032972589.db2.gz ZWTXZGGUSDRZDH-UHFFFAOYSA-N 1 0 339.280 3.652 20 5 EHBDRO C[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccs1 ZINC000602561034 1032973201 /nfs/dbraw/zinc/97/32/01/1032973201.db2.gz PPYSTWHLKCFFGX-NSHDSACASA-N 1 0 331.397 3.766 20 5 EHBDRO C[N@@H+]1CCC2(CN(C(=O)c3ccc4cc5ccccc5cc4c3)C2)C1 ZINC001270140623 1021360819 /nfs/dbraw/zinc/36/08/19/1021360819.db2.gz MKZRODYKXBJWPD-UHFFFAOYSA-N 1 0 330.431 3.771 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC000894845980 1021363315 /nfs/dbraw/zinc/36/33/15/1021363315.db2.gz PKDGSLGNWZVEBM-UHFFFAOYSA-N 1 0 348.834 3.717 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1O ZINC000426374971 1021413067 /nfs/dbraw/zinc/41/30/67/1021413067.db2.gz ZKVKMLDJQKHKHF-ZDUSSCGKSA-N 1 0 344.411 3.728 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449653041 1032979647 /nfs/dbraw/zinc/97/96/47/1032979647.db2.gz RMKJOAIVIGBEEH-MRXNPFEDSA-N 1 0 341.411 3.664 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCOCc1ccccc1 ZINC000439481914 1021488034 /nfs/dbraw/zinc/48/80/34/1021488034.db2.gz OMZNLBJLDGATFO-UHFFFAOYSA-N 1 0 344.411 3.642 20 5 EHBDRO CCOc1cc(C[N@H+](C)Cc2ccccc2N(C)C)ccc1[N+](=O)[O-] ZINC000516509642 1021502685 /nfs/dbraw/zinc/50/26/85/1021502685.db2.gz WSTRQQZGUAQGEF-UHFFFAOYSA-N 1 0 343.427 3.692 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC3(c4cccc(F)c4)CC3)nc2c1 ZINC000602551379 1032984397 /nfs/dbraw/zinc/98/43/97/1032984397.db2.gz CRGZOGDBOJDQEG-UHFFFAOYSA-N 1 0 341.342 3.697 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(N(C)C)CCC1 ZINC000437090980 1021544180 /nfs/dbraw/zinc/54/41/80/1021544180.db2.gz BVKSBEQBIGBGDR-CQSZACIVSA-N 1 0 337.489 3.539 20 5 EHBDRO CC(C)[N@H+](CCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000506749699 1021917695 /nfs/dbraw/zinc/91/76/95/1021917695.db2.gz BTLCASXDKZZBKP-UHFFFAOYSA-N 1 0 338.791 3.711 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)n1 ZINC000178201372 1022099783 /nfs/dbraw/zinc/09/97/83/1022099783.db2.gz LHOKEVPWLAWQKO-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000178205904 1022148547 /nfs/dbraw/zinc/14/85/47/1022148547.db2.gz MJFMATZBAWYUTN-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cc(Cl)c(-n2cc(CC[NH3+])c3cc(O)ccc32)c([N+](=O)[O-])c1 ZINC001167989712 1022218256 /nfs/dbraw/zinc/21/82/56/1022218256.db2.gz DYJSASCVGKVNQO-UHFFFAOYSA-N 1 0 345.786 3.707 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336453 1022375304 /nfs/dbraw/zinc/37/53/04/1022375304.db2.gz JTMBQUVGXPWYQY-GJZGRUSLSA-N 1 0 340.427 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCCCOc1ccccc1)CC2 ZINC000438113204 1022398416 /nfs/dbraw/zinc/39/84/16/1022398416.db2.gz DYYNPWAKOWCEDL-UHFFFAOYSA-N 1 0 326.396 3.812 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1cc(C)c([N+](=O)[O-])cn1 ZINC000074727231 1022472393 /nfs/dbraw/zinc/47/23/93/1022472393.db2.gz YPMFBULRRQALIN-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000441427411 1022531972 /nfs/dbraw/zinc/53/19/72/1022531972.db2.gz GTCFVGNKSXSCRP-OAHLLOKOSA-N 1 0 344.411 3.545 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)Cc1ccccc1 ZINC000193037801 1022667874 /nfs/dbraw/zinc/66/78/74/1022667874.db2.gz MPMYGZNRVADRHH-KPOBHBOGSA-N 1 0 340.423 3.554 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC(F)F ZINC000602698634 1033079182 /nfs/dbraw/zinc/07/91/82/1033079182.db2.gz DSMIHYJMIDMTGR-MRVPVSSYSA-N 1 0 326.265 3.995 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536345656 1022954855 /nfs/dbraw/zinc/95/48/55/1022954855.db2.gz NJUZGNASMGCPAF-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO Cc1ccc(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000506357997 1023000136 /nfs/dbraw/zinc/00/01/36/1023000136.db2.gz WEAPKKCNNFQZAX-ZDUSSCGKSA-N 1 0 348.447 3.535 20 5 EHBDRO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@@H]1COc2ccccc2O1 ZINC000610705517 1023277162 /nfs/dbraw/zinc/27/71/62/1023277162.db2.gz RIBLUEHQPADKBV-QGZVFWFLSA-N 1 0 342.395 3.647 20 5 EHBDRO CC[NH+](CC)CCOc1ccc(CNc2ccsc2[N+](=O)[O-])cc1 ZINC000063262192 1033135079 /nfs/dbraw/zinc/13/50/79/1033135079.db2.gz OUHOVPKXKILXMJ-UHFFFAOYSA-N 1 0 349.456 3.989 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H]4COCC[C@H]43)o2)c1 ZINC000535801269 1023647783 /nfs/dbraw/zinc/64/77/83/1023647783.db2.gz GFPMOJHYYBTBHI-MAUKXSAKSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1c(C[N@H+](Cc2ccccc2)CC2(CO)CC2)cccc1[N+](=O)[O-] ZINC000341951811 1023716966 /nfs/dbraw/zinc/71/69/66/1023716966.db2.gz NPMFVELGRVYJMR-UHFFFAOYSA-N 1 0 340.423 3.678 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])cc1C ZINC000610831065 1023780712 /nfs/dbraw/zinc/78/07/12/1023780712.db2.gz HVTRAEZIZUOZNM-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818798 1023782777 /nfs/dbraw/zinc/78/27/77/1023782777.db2.gz SJTBIYJDLPQPAP-NWDGAFQWSA-N 1 0 340.383 3.897 20 5 EHBDRO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](C)c1cc2ccccc2o1 ZINC000176216748 1023883450 /nfs/dbraw/zinc/88/34/50/1023883450.db2.gz VYOCXYMTXQQJDA-CYBMUJFWSA-N 1 0 328.372 3.621 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2nc3c(s2)CCC3)cc1Cl ZINC000896841069 1023990925 /nfs/dbraw/zinc/99/09/25/1023990925.db2.gz IHUIQYAGLALNBK-UHFFFAOYSA-N 1 0 337.832 3.526 20 5 EHBDRO COc1ccc2c(c1)CCC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000522268430 1024127776 /nfs/dbraw/zinc/12/77/76/1024127776.db2.gz AUFOCOLVVYTAKH-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO O=[N+]([O-])c1cnccc1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000142810483 1024144888 /nfs/dbraw/zinc/14/48/88/1024144888.db2.gz KXTZKHKDUKWAKM-ALOPSCKCSA-N 1 0 338.411 3.597 20 5 EHBDRO CC1=NO[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000895311297 1024269635 /nfs/dbraw/zinc/26/96/35/1024269635.db2.gz ONSLNTSNSVIMHX-LBPRGKRZSA-N 1 0 331.397 3.578 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C)C[C@H](C)C1 ZINC000443643640 1024307883 /nfs/dbraw/zinc/30/78/83/1024307883.db2.gz SEOLYIDDGLRGJV-KBPBESRZSA-N 1 0 333.432 3.600 20 5 EHBDRO CCn1ccnc1[C@@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000280966407 1024465688 /nfs/dbraw/zinc/46/56/88/1024465688.db2.gz KCEPDCOTBSLRCM-KRWDZBQOSA-N 1 0 328.416 3.581 20 5 EHBDRO CC(C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000895658152 1024694642 /nfs/dbraw/zinc/69/46/42/1024694642.db2.gz IDCJCQICACGPKC-RXNMKEHESA-N 1 0 326.396 3.710 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2ccc([N+](=O)[O-])cn2)c2cccs2)CC1 ZINC000025371280 1024733852 /nfs/dbraw/zinc/73/38/52/1024733852.db2.gz ZIQIOGHQRZKYGZ-HNNXBMFYSA-N 1 0 346.456 3.936 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+]C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000409636350 1033232784 /nfs/dbraw/zinc/23/27/84/1033232784.db2.gz BZAYNXRVQDDXQI-QGZVFWFLSA-N 1 0 341.411 3.631 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600321 1024803000 /nfs/dbraw/zinc/80/30/00/1024803000.db2.gz NGSUKYRUVHZTSN-YWZLYKJASA-N 1 0 340.423 3.724 20 5 EHBDRO C[NH2+]C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375544 1024841034 /nfs/dbraw/zinc/84/10/34/1024841034.db2.gz NBAATNSQDUWYJW-LBPRGKRZSA-N 1 0 349.818 3.550 20 5 EHBDRO CC(C)n1cncc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369119 1024886622 /nfs/dbraw/zinc/88/66/22/1024886622.db2.gz LETUNNZTAPQTRX-INIZCTEOSA-N 1 0 328.416 3.752 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000342329058 1024897608 /nfs/dbraw/zinc/89/76/08/1024897608.db2.gz VRXRQDRAQZXXQX-GULBITTBSA-N 1 0 347.459 3.591 20 5 EHBDRO CCN(Cc1ccoc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000092935998 1024926236 /nfs/dbraw/zinc/92/62/36/1024926236.db2.gz HOCKTRCQYDTELA-UHFFFAOYSA-N 1 0 326.299 3.811 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)s1 ZINC000249987745 1033252973 /nfs/dbraw/zinc/25/29/73/1033252973.db2.gz ZKLSYVXIEAAJSM-LXZKKBNFSA-N 1 0 344.436 3.980 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000072014224 1025147363 /nfs/dbraw/zinc/14/73/63/1025147363.db2.gz YFNBJKDNQMCZPP-UHFFFAOYSA-N 1 0 328.412 3.976 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000237362521 1025177455 /nfs/dbraw/zinc/17/74/55/1025177455.db2.gz VMXKDAFTLLDSOZ-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000515407734 1025218467 /nfs/dbraw/zinc/21/84/67/1025218467.db2.gz HOQOJIVCPDIDAO-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CO[C@H](C)C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000425421115 1025237897 /nfs/dbraw/zinc/23/78/97/1025237897.db2.gz QPYGMZJYFUWZQT-LLVKDONJSA-N 1 0 345.237 3.603 20 5 EHBDRO CC(C)OCCC[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425422909 1025246059 /nfs/dbraw/zinc/24/60/59/1025246059.db2.gz SVCIUXFVADTJBF-UHFFFAOYSA-N 1 0 345.237 3.604 20 5 EHBDRO CC[C@@H]([NH2+]Cc1c(C)cc(C)nc1OC)c1cccc([N+](=O)[O-])c1 ZINC000346951877 1025345475 /nfs/dbraw/zinc/34/54/75/1025345475.db2.gz URRBHBHXNXDJPR-QGZVFWFLSA-N 1 0 329.400 3.856 20 5 EHBDRO CC(C)c1ccc(CN2CCC([NH2+]C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000897984703 1033278974 /nfs/dbraw/zinc/27/89/74/1033278974.db2.gz DTVJGHIYGFRDFF-UHFFFAOYSA-N 1 0 331.460 3.825 20 5 EHBDRO CN(Cc1c(F)cccc1[N+](=O)[O-])C1CCN(c2ccccc2)CC1 ZINC000438997491 1025384554 /nfs/dbraw/zinc/38/45/54/1025384554.db2.gz HHEOBQOFVGVHHC-UHFFFAOYSA-N 1 0 343.402 3.835 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000119943903 1025477836 /nfs/dbraw/zinc/47/78/36/1025477836.db2.gz MRPBGOVDVNFPSE-CQSZACIVSA-N 1 0 330.388 3.703 20 5 EHBDRO COCCN(Cc1c(F)cccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000505779166 1025497810 /nfs/dbraw/zinc/49/78/10/1025497810.db2.gz YNROWMHNXYOIQY-CQSZACIVSA-N 1 0 332.375 3.944 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@@H]2OCCC[C@@H]12 ZINC000439060395 1025519492 /nfs/dbraw/zinc/51/94/92/1025519492.db2.gz VAIPYOKVHSEROB-CTASWTNQSA-N 1 0 336.457 3.623 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)Cc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000451106742 1025540839 /nfs/dbraw/zinc/54/08/39/1025540839.db2.gz YZXDWIVOEBGYIN-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2Cc3[nH]c4ccccc4c3C2)c(Cl)c1 ZINC000442852935 1025550677 /nfs/dbraw/zinc/55/06/77/1025550677.db2.gz YRXFWRUYQIPMEV-GFCCVEGCSA-N 1 0 341.798 3.987 20 5 EHBDRO CC[NH+](CC)CCCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318684 1025580616 /nfs/dbraw/zinc/58/06/16/1025580616.db2.gz PPGONBXROKPRGW-UHFFFAOYSA-N 1 0 334.342 3.543 20 5 EHBDRO Cc1nc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000347155929 1025589896 /nfs/dbraw/zinc/58/98/96/1025589896.db2.gz RCXFZZCIGLBWIU-MRXNPFEDSA-N 1 0 331.441 3.513 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000474865727 1025717205 /nfs/dbraw/zinc/71/72/05/1025717205.db2.gz BAPKEVDHLXDMGE-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H](CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C[NH+]1CCCC1 ZINC000516073909 1025952008 /nfs/dbraw/zinc/95/20/08/1025952008.db2.gz FLROKKYAUOMTCZ-WFASDCNBSA-N 1 0 345.365 3.520 20 5 EHBDRO CC(C)C[C@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[NH+](C)C ZINC000511109206 1026069040 /nfs/dbraw/zinc/06/90/40/1026069040.db2.gz KBLNAJDFXLTPGZ-CQSZACIVSA-N 1 0 349.456 3.516 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417609 1026075976 /nfs/dbraw/zinc/07/59/76/1026075976.db2.gz RAQBFCDBVOTHAZ-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000530627265 1026151529 /nfs/dbraw/zinc/15/15/29/1026151529.db2.gz NATVLFBXZOMGNG-SFHVURJKSA-N 1 0 328.412 3.674 20 5 EHBDRO COc1ccccc1OC[C@@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000478911446 1026365534 /nfs/dbraw/zinc/36/55/34/1026365534.db2.gz VPELEXMBERMGJM-LSDHHAIUSA-N 1 0 344.411 3.969 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000451948917 1026409894 /nfs/dbraw/zinc/40/98/94/1026409894.db2.gz AQRSHWWINGCXBA-HNNXBMFYSA-N 1 0 336.432 3.562 20 5 EHBDRO COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000475345073 1026504796 /nfs/dbraw/zinc/50/47/96/1026504796.db2.gz YZOGMZJTZXDUCC-SFHVURJKSA-N 1 0 328.412 3.722 20 5 EHBDRO Cn1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)c1 ZINC000531117663 1026607407 /nfs/dbraw/zinc/60/74/07/1026607407.db2.gz VKKQEKAOVKHPRF-UHFFFAOYSA-N 1 0 327.409 3.952 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000158630021 1026751945 /nfs/dbraw/zinc/75/19/45/1026751945.db2.gz PLLMEWWTZGNGAY-GOSISDBHSA-N 1 0 341.411 3.641 20 5 EHBDRO C[C@H]1CCCC[C@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237554820 1026994947 /nfs/dbraw/zinc/99/49/47/1026994947.db2.gz JBBUPGYHQQDVBY-HOCLYGCPSA-N 1 0 342.443 3.911 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413144734 1027129518 /nfs/dbraw/zinc/12/95/18/1027129518.db2.gz KUDFRYPGNKCDNZ-CYBMUJFWSA-N 1 0 344.390 3.766 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178648734 1027266741 /nfs/dbraw/zinc/26/67/41/1027266741.db2.gz PIWPKPIARFUJNT-MAUKXSAKSA-N 1 0 328.412 3.720 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)Nc1ncc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000413292037 1027452710 /nfs/dbraw/zinc/45/27/10/1027452710.db2.gz LFQKDRSSFBFVBL-WBMJQRKESA-N 1 0 332.379 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H](CO)CC3CCC3)s2)cc1 ZINC000475499956 1027477645 /nfs/dbraw/zinc/47/76/45/1027477645.db2.gz BSZFCSGOYWRTMB-OAHLLOKOSA-N 1 0 346.452 3.964 20 5 EHBDRO CCC[C@@H]([NH2+]CCC(=O)N1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000129092169 1027520704 /nfs/dbraw/zinc/52/07/04/1027520704.db2.gz JJCMGXLIYUIQCK-GOSISDBHSA-N 1 0 347.459 3.818 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000501785390 1027534228 /nfs/dbraw/zinc/53/42/28/1027534228.db2.gz PNJOGZPWKNIOPE-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178659870 1027619203 /nfs/dbraw/zinc/61/92/03/1027619203.db2.gz OPSPQHGBLUQKJB-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(Cc2cccs2)[C@@H]2C=C[C@@H](CO)C2)c1 ZINC000347330985 1027709838 /nfs/dbraw/zinc/70/98/38/1027709838.db2.gz HXZWHAHNRKNKHR-HZPDHXFCSA-N 1 0 344.436 3.596 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000091457200 1027875770 /nfs/dbraw/zinc/87/57/70/1027875770.db2.gz NXRXQMJBYBIYIK-UHFFFAOYSA-N 1 0 329.400 3.667 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174575 1027911780 /nfs/dbraw/zinc/91/17/80/1027911780.db2.gz IUNWSAUQCFZRMA-BBRMVZONSA-N 1 0 330.359 3.948 20 5 EHBDRO Cc1c(CN2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512143 1027996315 /nfs/dbraw/zinc/99/63/15/1027996315.db2.gz MNPPQENNCPBYRU-RKVPGOIHSA-N 1 0 331.460 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCC[C@@H](CCO)CC2)c1 ZINC000421018118 1028003261 /nfs/dbraw/zinc/00/32/61/1028003261.db2.gz OAYHLIVULFVGMO-GFCCVEGCSA-N 1 0 346.349 3.598 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680974 1028150494 /nfs/dbraw/zinc/15/04/94/1028150494.db2.gz XWJDRIGGGIGOOL-YOEHRIQHSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)n1 ZINC000444806582 1028277480 /nfs/dbraw/zinc/27/74/80/1028277480.db2.gz UXLYTBLWNUYVCD-OAHLLOKOSA-N 1 0 334.807 3.672 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)c1 ZINC000444792672 1028292648 /nfs/dbraw/zinc/29/26/48/1028292648.db2.gz FDTGEDXBUFABNB-INIZCTEOSA-N 1 0 334.807 3.672 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCCC(F)(F)C2)n1 ZINC000502593269 1028410510 /nfs/dbraw/zinc/41/05/10/1028410510.db2.gz BVXHXZCGFCPGRB-BFHYXJOUSA-N 1 0 342.390 3.690 20 5 EHBDRO C[NH+](C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccsc1 ZINC000440594880 1028413517 /nfs/dbraw/zinc/41/35/17/1028413517.db2.gz CRVKXRVWUXQURM-ZDUSSCGKSA-N 1 0 327.356 3.649 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@@H](O)c2ccccc2)CC1 ZINC000042634812 1028489698 /nfs/dbraw/zinc/48/96/98/1028489698.db2.gz GXQNUYGGKQUEPT-IBGZPJMESA-N 1 0 326.396 3.540 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCO)C1CCCCC1 ZINC000532747140 1028765552 /nfs/dbraw/zinc/76/55/52/1028765552.db2.gz QVSRIYYJURZQRO-UHFFFAOYSA-N 1 0 336.432 3.509 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912015 1029055434 /nfs/dbraw/zinc/05/54/34/1029055434.db2.gz OVGQBILFCUNYPI-XHSDSOJGSA-N 1 0 349.475 3.907 20 5 EHBDRO C[C@@H](Cc1ccccc1F)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583170355 1029110759 /nfs/dbraw/zinc/11/07/59/1029110759.db2.gz VSJLFQAHUWHWAP-ZDUSSCGKSA-N 1 0 341.386 3.979 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615005794 1029230792 /nfs/dbraw/zinc/23/07/92/1029230792.db2.gz UPVGJPHCAJDDIX-NSHDSACASA-N 1 0 331.294 3.803 20 5 EHBDRO CC[NH+]1CCC(NCc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000271937524 1029238654 /nfs/dbraw/zinc/23/86/54/1029238654.db2.gz YCBWNXYTOYLCCZ-UHFFFAOYSA-N 1 0 336.435 3.520 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(F)cn1 ZINC000513829353 1029525811 /nfs/dbraw/zinc/52/58/11/1029525811.db2.gz ARXPWZJOOOGCDH-CXAGYDPISA-N 1 0 329.375 3.630 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccc(F)cc3)CC2)n1 ZINC000121668507 1029677941 /nfs/dbraw/zinc/67/79/41/1029677941.db2.gz PFAPGAYHMJUTBX-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059130 1029725198 /nfs/dbraw/zinc/72/51/98/1029725198.db2.gz IJGYMGYUABMCMK-SFHVURJKSA-N 1 0 328.412 3.676 20 5 EHBDRO CCOc1ccc2c(c1)CCN(Cc1cc([N+](=O)[O-])ccc1OC)C2 ZINC000441089538 1029787330 /nfs/dbraw/zinc/78/73/30/1029787330.db2.gz BJVXMZRFPYOKKV-UHFFFAOYSA-N 1 0 342.395 3.560 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000343224681 1029809674 /nfs/dbraw/zinc/80/96/74/1029809674.db2.gz ZHHILLBFKWLAIZ-ZDUSSCGKSA-N 1 0 342.399 3.550 20 5 EHBDRO CC(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000533784107 1029825941 /nfs/dbraw/zinc/82/59/41/1029825941.db2.gz BIEPYHUZDGLNQO-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000324436004 1029831012 /nfs/dbraw/zinc/83/10/12/1029831012.db2.gz DEFTVDHTTPWSHJ-YVEFUNNKSA-N 1 0 328.368 3.778 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000533820157 1029879118 /nfs/dbraw/zinc/87/91/18/1029879118.db2.gz UACJZUQGTUBNNV-AWEZNQCLSA-N 1 0 349.337 3.795 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000525634473 1029984409 /nfs/dbraw/zinc/98/44/09/1029984409.db2.gz WYMAJKACHXSDHN-KRWDZBQOSA-N 1 0 326.396 3.538 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453263925 1029998992 /nfs/dbraw/zinc/99/89/92/1029998992.db2.gz VFCKEGIKTONELZ-DGCLKSJQSA-N 1 0 334.338 3.911 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525697566 1030027552 /nfs/dbraw/zinc/02/75/52/1030027552.db2.gz CIGXLQHZNCXMPB-UHFFFAOYSA-N 1 0 346.383 3.676 20 5 EHBDRO CC(C)[C@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000525697780 1030031653 /nfs/dbraw/zinc/03/16/53/1030031653.db2.gz TXVGTAUZTSNWON-MRXNPFEDSA-N 1 0 334.441 3.820 20 5 EHBDRO CCC[C@H]([NH2+][C@H](C(=O)N(C)CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000453295449 1030042307 /nfs/dbraw/zinc/04/23/07/1030042307.db2.gz YCNGUPWVIVCSHQ-IRXDYDNUSA-N 1 0 335.448 3.529 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000531948104 1030119102 /nfs/dbraw/zinc/11/91/02/1030119102.db2.gz AJGCZOVUFRRYHC-DNVCBOLYSA-N 1 0 327.428 3.857 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)n1 ZINC000481977712 1030143311 /nfs/dbraw/zinc/14/33/11/1030143311.db2.gz PGOWAPYKFRUVBK-INIZCTEOSA-N 1 0 346.475 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOCc1ccccc1)CCC2 ZINC000447526753 1030248640 /nfs/dbraw/zinc/24/86/40/1030248640.db2.gz CJTUDOXMRQESHQ-LJQANCHMSA-N 1 0 326.396 3.779 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447513080 1030260628 /nfs/dbraw/zinc/26/06/28/1030260628.db2.gz SOFRRUCLHNFPER-DJIMGWMZSA-N 1 0 328.416 3.668 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000245834570 1030268103 /nfs/dbraw/zinc/26/81/03/1030268103.db2.gz AVWQANPUKKMQHY-ATCWAGBWSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013892 1030272598 /nfs/dbraw/zinc/27/25/98/1030272598.db2.gz ZEALOROLMXXQAH-INIZCTEOSA-N 1 0 334.416 3.862 20 5 EHBDRO CSc1cc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000447586189 1030321198 /nfs/dbraw/zinc/32/11/98/1030321198.db2.gz MRXKJQBUSCSDOX-MRXNPFEDSA-N 1 0 329.425 3.879 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc(C)cc([N+](=O)[O-])c2)C1 ZINC000520348492 1030328866 /nfs/dbraw/zinc/32/88/66/1030328866.db2.gz XRLWUDHVBYIWQT-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870421 1030418422 /nfs/dbraw/zinc/41/84/22/1030418422.db2.gz JNXQIBNMAWEEAN-GOSISDBHSA-N 1 0 327.384 3.514 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000447732151 1030441216 /nfs/dbraw/zinc/44/12/16/1030441216.db2.gz VOBVSSXUHPARCY-AWEZNQCLSA-N 1 0 346.818 3.638 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnn(CC(F)(F)F)c1 ZINC000532244603 1030508830 /nfs/dbraw/zinc/50/88/30/1030508830.db2.gz HDPJERSKVRAZAD-LLVKDONJSA-N 1 0 342.321 3.513 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H](c2ccco2)N2CCCCC2)cs1 ZINC000237975030 1030531876 /nfs/dbraw/zinc/53/18/76/1030531876.db2.gz QDBSTNVSTQSMAQ-AWEZNQCLSA-N 1 0 335.429 3.566 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ccccn2)CC1 ZINC000348507665 1030612084 /nfs/dbraw/zinc/61/20/84/1030612084.db2.gz ISOPNRRESCDGMT-CQSZACIVSA-N 1 0 327.384 3.594 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607376 1030750952 /nfs/dbraw/zinc/75/09/52/1030750952.db2.gz OSCIMSKGPUCKGO-DOMZBBRYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000160440654 1030754352 /nfs/dbraw/zinc/75/43/52/1030754352.db2.gz LGGKINBDIYWRBS-CYBMUJFWSA-N 1 0 347.440 3.766 20 5 EHBDRO CCC(CC)[N@@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])CC(C)C ZINC000482866835 1030760232 /nfs/dbraw/zinc/76/02/32/1030760232.db2.gz MXRQTRQYYOVIFX-UHFFFAOYSA-N 1 0 335.448 3.988 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](Cc1ccccc1)C[C@H](C)O ZINC000527304336 1030767916 /nfs/dbraw/zinc/76/79/16/1030767916.db2.gz AQYOAMXUWBKYFF-YTBHAWNYSA-N 1 0 340.423 3.881 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000568107731 1030783276 /nfs/dbraw/zinc/78/32/76/1030783276.db2.gz WXWCNBORYZVMKW-UMVBOHGHSA-N 1 0 326.343 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCC[C@H](C(F)(F)F)C2)cc1 ZINC000527326342 1030798455 /nfs/dbraw/zinc/79/84/55/1030798455.db2.gz AZKQJVQQTGAQHB-RYUDHWBXSA-N 1 0 332.322 3.684 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCC(C)(C)C1CC1 ZINC000550920334 1030799351 /nfs/dbraw/zinc/79/93/51/1030799351.db2.gz DNSNCLDQAFQVSE-ZDUSSCGKSA-N 1 0 333.432 3.728 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC000483120922 1030968374 /nfs/dbraw/zinc/96/83/74/1030968374.db2.gz LIYIKLDITHDVLR-GFCCVEGCSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000483110859 1030975832 /nfs/dbraw/zinc/97/58/32/1030975832.db2.gz MJJITIVEZMLVCQ-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1c(C(=O)NC(C)(C)CC[NH+]2CCCCCC2)cccc1[N+](=O)[O-] ZINC000476835157 1031022436 /nfs/dbraw/zinc/02/24/36/1031022436.db2.gz XVELWXHJYFYXBG-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC000611797333 1031289056 /nfs/dbraw/zinc/28/90/56/1031289056.db2.gz UZYDNWKXJSGFCJ-KGLIPLIRSA-N 1 0 338.835 3.887 20 5 EHBDRO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000477203623 1031333335 /nfs/dbraw/zinc/33/33/35/1031333335.db2.gz NWKUYHCFXUTXAU-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(O)CCCC[C@H]2C1 ZINC000248136823 1031423574 /nfs/dbraw/zinc/42/35/74/1031423574.db2.gz PDQXHOAEAXOKNL-LPHOPBHVSA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCCO3)o2)c1 ZINC000551586963 1031473839 /nfs/dbraw/zinc/47/38/39/1031473839.db2.gz SOZGVPJBAWIZNS-MJGOQNOKSA-N 1 0 342.395 3.998 20 5 EHBDRO CC1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC[C@H]1C(F)(F)F ZINC000484340121 1031535080 /nfs/dbraw/zinc/53/50/80/1031535080.db2.gz MPDNKLKYRMMMNR-CQSZACIVSA-N 1 0 346.349 3.884 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000568531595 1031669033 /nfs/dbraw/zinc/66/90/33/1031669033.db2.gz HTKQQXQUPOZWCK-MJGOQNOKSA-N 1 0 343.402 3.614 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365243 1031870471 /nfs/dbraw/zinc/87/04/71/1031870471.db2.gz SZUBITLGGQRBPE-LRFDDAOPSA-N 1 0 342.399 3.569 20 5 EHBDRO CC[C@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000926959797 1031981690 /nfs/dbraw/zinc/98/16/90/1031981690.db2.gz CWRSFOZZUPZUEL-UONOGXRCSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCN2CCC2)s1 ZINC000594499180 1033401115 /nfs/dbraw/zinc/40/11/15/1033401115.db2.gz DQWIBXGLIQAVJJ-UHFFFAOYSA-N 1 0 331.441 3.509 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502851 1033404856 /nfs/dbraw/zinc/40/48/56/1033404856.db2.gz QVDDHXUBJLVJEW-JKSUJKDBSA-N 1 0 340.379 3.704 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCc3ccccc3NC2=O)cccc1[N+](=O)[O-] ZINC000594511762 1033415844 /nfs/dbraw/zinc/41/58/44/1033415844.db2.gz OHMDYVIFFFRNFH-GUYCJALGSA-N 1 0 339.395 3.507 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000594725398 1033506380 /nfs/dbraw/zinc/50/63/80/1033506380.db2.gz KDXXAPCETGGKBK-FNHZYXHNSA-N 1 0 326.396 3.818 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580855 1033571904 /nfs/dbraw/zinc/57/19/04/1033571904.db2.gz XCLZTCPNWBWQJB-DZGCQCFKSA-N 1 0 331.441 3.836 20 5 EHBDRO CSCC1(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000594964163 1033602624 /nfs/dbraw/zinc/60/26/24/1033602624.db2.gz WOBSRSFTPZJLRV-UHFFFAOYSA-N 1 0 346.399 3.819 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](OC)c1ccccc1 ZINC000595019476 1033611543 /nfs/dbraw/zinc/61/15/43/1033611543.db2.gz WKHINPOVEZNQTB-UGSOOPFHSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C(F)F)nc2)cc1[N+](=O)[O-] ZINC000595017916 1033612604 /nfs/dbraw/zinc/61/26/04/1033612604.db2.gz XKSBYWXPPWVECD-JTQLQIEISA-N 1 0 337.326 3.787 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)c1 ZINC000595020942 1033614699 /nfs/dbraw/zinc/61/46/99/1033614699.db2.gz BLSUVGOZSRPFNL-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(C2CCC2)cnn1C ZINC000594984275 1033618389 /nfs/dbraw/zinc/61/83/89/1033618389.db2.gz QPIIBPYWRFSQFW-ZROIWOOFSA-N 1 0 340.427 3.789 20 5 EHBDRO CC(C)CC[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000598991674 1033644289 /nfs/dbraw/zinc/64/42/89/1033644289.db2.gz RHQBYXPMIKYTOF-AWEZNQCLSA-N 1 0 349.456 3.605 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C)c1c(C)noc1C ZINC000595035036 1033654899 /nfs/dbraw/zinc/65/48/99/1033654899.db2.gz GMLKMSHAFHKRJQ-GHMZBOCLSA-N 1 0 333.388 3.663 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000595042534 1033660112 /nfs/dbraw/zinc/66/01/12/1033660112.db2.gz HKUVAUSLRGDSGS-CQSZACIVSA-N 1 0 341.411 3.771 20 5 EHBDRO CCc1nc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000595045352 1033663642 /nfs/dbraw/zinc/66/36/42/1033663642.db2.gz YWJPSRJAAAXJSL-NSHDSACASA-N 1 0 335.429 3.516 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC000593665402 1033665988 /nfs/dbraw/zinc/66/59/88/1033665988.db2.gz BYHTWSNQICSVJQ-KUHUBIRLSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)C1CCOCC1 ZINC000593665401 1033666200 /nfs/dbraw/zinc/66/62/00/1033666200.db2.gz BYHTWSNQICSVJQ-IFXJQAMLSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](O)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000595100572 1033689758 /nfs/dbraw/zinc/68/97/58/1033689758.db2.gz VPEKNWJLCXMBTA-RFUYNDQBSA-N 1 0 328.412 3.718 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081031 1033696464 /nfs/dbraw/zinc/69/64/64/1033696464.db2.gz PIOLWKHWNACIJD-KDOFPFPSSA-N 1 0 329.444 3.579 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081591 1033696957 /nfs/dbraw/zinc/69/69/57/1033696957.db2.gz SMNLMMRBTQRECB-LSDHHAIUSA-N 1 0 347.459 3.661 20 5 EHBDRO CC[C@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000599061589 1033700953 /nfs/dbraw/zinc/70/09/53/1033700953.db2.gz PXYMDSKRLZMNCK-ZDUSSCGKSA-N 1 0 342.321 3.588 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061971 1033701341 /nfs/dbraw/zinc/70/13/41/1033701341.db2.gz MXIKLEZSXSQVJS-LIRRHRJNSA-N 1 0 344.411 3.950 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1cnc2ccccc2n1 ZINC000595295406 1033720985 /nfs/dbraw/zinc/72/09/85/1033720985.db2.gz LSCXTVRPPRTSQM-UHFFFAOYSA-N 1 0 336.395 3.949 20 5 EHBDRO O=[N+]([O-])c1c(NC2CC[NH+](C3CCC3)CC2)ccc2cnccc21 ZINC000599088272 1033740984 /nfs/dbraw/zinc/74/09/84/1033740984.db2.gz PILQWDOPFKMRDJ-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000593681367 1033749123 /nfs/dbraw/zinc/74/91/23/1033749123.db2.gz FVZYDYPVGNUAPU-GFCCVEGCSA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CC[N@@H+]2C2CCCC2)ccc2ncccc21 ZINC000599165776 1033782330 /nfs/dbraw/zinc/78/23/30/1033782330.db2.gz SJNAFDJOMJPFAM-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000593021266 1033834928 /nfs/dbraw/zinc/83/49/28/1033834928.db2.gz SQJBMTWAJDWSKS-INIZCTEOSA-N 1 0 328.368 3.622 20 5 EHBDRO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000603853710 1033977196 /nfs/dbraw/zinc/97/71/96/1033977196.db2.gz KHPXTNFVBKJDLO-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H](CCF)C3)co2)cc1 ZINC000595755096 1033984811 /nfs/dbraw/zinc/98/48/11/1033984811.db2.gz GGYAWXWTPYVSAW-CYBMUJFWSA-N 1 0 333.363 3.821 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000603867320 1033994228 /nfs/dbraw/zinc/99/42/28/1033994228.db2.gz KTTHHODWFGWYMR-LJQANCHMSA-N 1 0 326.396 3.983 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])c(OC)c3)CCC2)c1 ZINC000595847058 1034008266 /nfs/dbraw/zinc/00/82/66/1034008266.db2.gz DSAUIIPPYIALDO-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@H]4CC[C@@H](C3)S4)co2)cc1 ZINC000599553369 1034008791 /nfs/dbraw/zinc/00/87/91/1034008791.db2.gz RDQSVPDQZOHXDO-CVEARBPZSA-N 1 0 345.424 3.720 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590223 1034028139 /nfs/dbraw/zinc/02/81/39/1034028139.db2.gz VWYRBWFEUOOVTH-CZUORRHYSA-N 1 0 348.443 3.703 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910280 1034030078 /nfs/dbraw/zinc/03/00/78/1034030078.db2.gz OHSKCOHIZAAZSG-LZQZEXGQSA-N 1 0 330.428 3.857 20 5 EHBDRO O=[N+]([O-])c1cc(N2CC[C@@H](C[NH+]3CCCC3)C2)ccc1C(F)(F)F ZINC000596134174 1034088765 /nfs/dbraw/zinc/08/87/65/1034088765.db2.gz DWIWFLSRDPSJFQ-LBPRGKRZSA-N 1 0 343.349 3.536 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691145 1034096392 /nfs/dbraw/zinc/09/63/92/1034096392.db2.gz QSLZBPZLRWGHBB-PYLYLYNFSA-N 1 0 342.399 3.823 20 5 EHBDRO CCC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](CC)c1ccccc1 ZINC000534134930 1034176210 /nfs/dbraw/zinc/17/62/10/1034176210.db2.gz YJQGTJREBCSQGT-SFHVURJKSA-N 1 0 343.427 3.620 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783667507 1034242729 /nfs/dbraw/zinc/24/27/29/1034242729.db2.gz RHXDPQNGYPVGEP-CYBMUJFWSA-N 1 0 338.791 3.579 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000596478970 1034254745 /nfs/dbraw/zinc/25/47/45/1034254745.db2.gz QNUBWSRFVHCONX-OAHLLOKOSA-N 1 0 333.432 3.560 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000456267357 1034266462 /nfs/dbraw/zinc/26/64/62/1034266462.db2.gz IVAUITFOUCTHLV-CQSZACIVSA-N 1 0 345.424 3.766 20 5 EHBDRO Cc1ccc([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000596647741 1034346698 /nfs/dbraw/zinc/34/66/98/1034346698.db2.gz ALVLCPIDXBQGDW-KFKAGJAMSA-N 1 0 339.439 3.700 20 5 EHBDRO COc1ccc(C2(C[NH2+]Cc3ccc([N+](=O)[O-])cc3F)CCC2)cc1 ZINC000612201618 1034472134 /nfs/dbraw/zinc/47/21/34/1034472134.db2.gz JIMPRIHKFGTFGF-UHFFFAOYSA-N 1 0 344.386 3.954 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC/C=C\c3ccccc3)C2)nc1 ZINC000450556368 1034518829 /nfs/dbraw/zinc/51/88/29/1034518829.db2.gz AVTHHOJQMCSCAH-LYLYKKCESA-N 1 0 338.411 3.580 20 5 EHBDRO C[C@]12COC[C@@H]1C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212093 1034595875 /nfs/dbraw/zinc/59/58/75/1034595875.db2.gz RPSMVSYVNXMZIZ-KSSFIOAISA-N 1 0 344.436 3.792 20 5 EHBDRO CCC(CC)[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000179786738 1034604999 /nfs/dbraw/zinc/60/49/99/1034604999.db2.gz XFVUGTFZQNDHBF-IBGZPJMESA-N 1 0 343.427 3.524 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cc1[N+](=O)[O-] ZINC000597205770 1034609293 /nfs/dbraw/zinc/60/92/93/1034609293.db2.gz IMWYTWIDLUSZGV-RBUKOAKNSA-N 1 0 340.423 3.501 20 5 EHBDRO C[C@H](O)C1([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000597234408 1034615482 /nfs/dbraw/zinc/61/54/82/1034615482.db2.gz KTOUVMRYEJXFGI-LBPRGKRZSA-N 1 0 346.358 3.529 20 5 EHBDRO C[C@@H](O)C1([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000597234407 1034616325 /nfs/dbraw/zinc/61/63/25/1034616325.db2.gz KTOUVMRYEJXFGI-GFCCVEGCSA-N 1 0 346.358 3.529 20 5 EHBDRO CCO[C@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000450745708 1034749739 /nfs/dbraw/zinc/74/97/39/1034749739.db2.gz PWCIDXMPZNXEDK-SGTLLEGYSA-N 1 0 329.400 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000172258402 1034870057 /nfs/dbraw/zinc/87/00/57/1034870057.db2.gz PQSCDTCUBQTESB-IBGZPJMESA-N 1 0 344.386 3.606 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000615837653 1035028747 /nfs/dbraw/zinc/02/87/47/1035028747.db2.gz SNGNOTOVPMBHPH-KZIRBZLESA-N 1 0 337.423 3.958 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000365428389 1035071637 /nfs/dbraw/zinc/07/16/37/1035071637.db2.gz MZPUDLVOJAASSY-LBPRGKRZSA-N 1 0 331.338 3.534 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCNC(=O)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000089666372 1035511550 /nfs/dbraw/zinc/51/15/50/1035511550.db2.gz KEQGFXVDOFJAJL-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1cc(NC[C@@H]2CC[N@@H+](C(C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000540648372 1035537310 /nfs/dbraw/zinc/53/73/10/1035537310.db2.gz USCXHWPHPWHCSH-AWEZNQCLSA-N 1 0 328.416 3.594 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075864703 1035568992 /nfs/dbraw/zinc/56/89/92/1035568992.db2.gz WJHHZNSPTXQYAA-INIZCTEOSA-N 1 0 344.386 3.773 20 5 EHBDRO CC[C@@](C)(CO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000152176952 1036037133 /nfs/dbraw/zinc/03/71/33/1036037133.db2.gz QTKYNHGAWUXAJQ-SFHVURJKSA-N 1 0 348.374 3.777 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201701 1036140063 /nfs/dbraw/zinc/14/00/63/1036140063.db2.gz NWINZMQIQHUXKZ-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCC(=O)Nc1ccccc1 ZINC000164985599 1036180533 /nfs/dbraw/zinc/18/05/33/1036180533.db2.gz WWWAZKIOKYDYQX-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113835 1036257240 /nfs/dbraw/zinc/25/72/40/1036257240.db2.gz ZOXJYGLTYCGZAP-FZMZJTMJSA-N 1 0 343.349 3.534 20 5 EHBDRO CCC(CC)[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)C1CC1 ZINC000165365472 1036434959 /nfs/dbraw/zinc/43/49/59/1036434959.db2.gz CUSQHLSEWHAAIY-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414301780 1036549840 /nfs/dbraw/zinc/54/98/40/1036549840.db2.gz BVOUCRRGJZDEMZ-APWZRJJASA-N 1 0 346.402 3.941 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H](CO)C1 ZINC000414337138 1036743270 /nfs/dbraw/zinc/74/32/70/1036743270.db2.gz KMTHLFMWDLVAMN-ZNMIVQPWSA-N 1 0 338.473 3.606 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3cc([N+](=O)[O-])ccc3OC)CCC2)c1 ZINC000595858581 1036749823 /nfs/dbraw/zinc/74/98/23/1036749823.db2.gz VVSPHGGLLVVJJT-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@@H]2[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000539511939 1036836967 /nfs/dbraw/zinc/83/69/67/1036836967.db2.gz JGJNHOMBZXTPJI-DOTOQJQBSA-N 1 0 332.425 3.975 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@H]2[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000539511942 1036837286 /nfs/dbraw/zinc/83/72/86/1036837286.db2.gz JGJNHOMBZXTPJI-WBVHZDCISA-N 1 0 332.425 3.975 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NCc1csc([N+](=O)[O-])c1 ZINC000539531014 1036888822 /nfs/dbraw/zinc/88/88/22/1036888822.db2.gz OYEIKQQHERQRTO-CABCVRRESA-N 1 0 325.478 3.647 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290573 1036889519 /nfs/dbraw/zinc/88/95/19/1036889519.db2.gz GKIYEJFGJXXJCQ-SMDDNHRTSA-N 1 0 330.388 3.874 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000590811720 1037051414 /nfs/dbraw/zinc/05/14/14/1037051414.db2.gz RWDCMUDRNZNPOG-KRWDZBQOSA-N 1 0 347.462 3.991 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2c(F)cccc2[N+](=O)[O-])c1 ZINC000609144355 1037059924 /nfs/dbraw/zinc/05/99/24/1037059924.db2.gz PUWHTNCMZDAVRD-OAHLLOKOSA-N 1 0 344.386 3.950 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000761506898 1037076106 /nfs/dbraw/zinc/07/61/06/1037076106.db2.gz OWJHEGPSDIXLCM-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524437 1037092750 /nfs/dbraw/zinc/09/27/50/1037092750.db2.gz CZEUSYNOJDTJTF-BLLLJJGKSA-N 1 0 334.803 3.502 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163396193 1037095163 /nfs/dbraw/zinc/09/51/63/1037095163.db2.gz OIDDBNWMHYVZHX-SWLSCSKDSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H]1CCC[N@@H+](C(C)(C)CNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521355 1037097047 /nfs/dbraw/zinc/09/70/47/1037097047.db2.gz GDASIXUJNDKPIR-CYBMUJFWSA-N 1 0 339.867 3.848 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@]3(C)CCO[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316627 1037281164 /nfs/dbraw/zinc/28/11/64/1037281164.db2.gz WUQDVDGPPMAKMV-XIKOKIGWSA-N 1 0 346.383 3.521 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([C@@H](C)CCO)CCC1 ZINC000271813979 1037360488 /nfs/dbraw/zinc/36/04/88/1037360488.db2.gz BFTJINSZGKWZBU-HOTGVXAUSA-N 1 0 334.460 3.694 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@@H]1Cc1ccccc1 ZINC000462751804 1037364417 /nfs/dbraw/zinc/36/44/17/1037364417.db2.gz CFKAMZYKGYEIPL-YJBOKZPZSA-N 1 0 326.396 3.714 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163410916 1037375008 /nfs/dbraw/zinc/37/50/08/1037375008.db2.gz XTSAZFUQMBCSMZ-WFASDCNBSA-N 1 0 330.388 3.703 20 5 EHBDRO COc1ccc(F)cc1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000462775427 1037377952 /nfs/dbraw/zinc/37/79/52/1037377952.db2.gz BZGUZGBGCHUIGO-UHFFFAOYSA-N 1 0 332.375 3.855 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000493571966 1037459738 /nfs/dbraw/zinc/45/97/38/1037459738.db2.gz IXTSIEWHSLDEJL-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000532550536 1037594703 /nfs/dbraw/zinc/59/47/03/1037594703.db2.gz PRDYNJYMKIKOFR-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000540150017 1037619785 /nfs/dbraw/zinc/61/97/85/1037619785.db2.gz CXFWFLGZZWEOOR-CVAIRZPRSA-N 1 0 339.439 3.999 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000030153658 1037632259 /nfs/dbraw/zinc/63/22/59/1037632259.db2.gz DCCNIUWRPSOKRS-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO Cc1cc(NCCn2cc([N+](=O)[O-])cn2)c2cc(Cl)cc(C)c2[nH+]1 ZINC000493827481 1037637580 /nfs/dbraw/zinc/63/75/80/1037637580.db2.gz ZSKYVYGSANIJEV-UHFFFAOYSA-N 1 0 345.790 3.722 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220565 1037784416 /nfs/dbraw/zinc/78/44/16/1037784416.db2.gz NVGNGAFCBIGPCG-DYVFJYSZSA-N 1 0 327.384 3.663 20 5 EHBDRO C[C@@H](C[NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897461717 1037850310 /nfs/dbraw/zinc/85/03/10/1037850310.db2.gz WETWORGXQVMWQX-DLBZAZTESA-N 1 0 339.439 3.814 20 5 EHBDRO COc1cc(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)ccc1[N+](=O)[O-] ZINC000592146443 1037868444 /nfs/dbraw/zinc/86/84/44/1037868444.db2.gz QIRMHSNBIKUZPB-UHFFFAOYSA-N 1 0 341.411 3.719 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000897466061 1037876098 /nfs/dbraw/zinc/87/60/98/1037876098.db2.gz NHYHXKZEESDOQK-UIBBOPPKSA-N 1 0 338.498 3.668 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000784396702 1037921805 /nfs/dbraw/zinc/92/18/05/1037921805.db2.gz CSIBABXVHPNHCH-LJQANCHMSA-N 1 0 346.402 3.897 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC[C@H]1CSc2ccccc2O1 ZINC000592373103 1037923730 /nfs/dbraw/zinc/92/37/30/1037923730.db2.gz UIUMLNCGYLQPNO-AWEZNQCLSA-N 1 0 330.409 3.628 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCOc2ncccc2Cl)cccc1[N+](=O)[O-] ZINC000090408354 1038054311 /nfs/dbraw/zinc/05/43/11/1038054311.db2.gz IECHRIIOOCRNIS-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000538777194 1038524001 /nfs/dbraw/zinc/52/40/01/1038524001.db2.gz GYDSSDMWSRYHII-CHWSQXEVSA-N 1 0 332.425 3.980 20 5 EHBDRO Cc1cc(NCc2ccc(OCC[NH+](C)C)cc2)c(F)cc1[N+](=O)[O-] ZINC000461772189 1038603004 /nfs/dbraw/zinc/60/30/04/1038603004.db2.gz BUEPHVYXXQYAIJ-UHFFFAOYSA-N 1 0 347.390 3.595 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788567 1038610608 /nfs/dbraw/zinc/61/06/08/1038610608.db2.gz XRQODSBVBBMGEA-RYUDHWBXSA-N 1 0 343.349 3.961 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ncc(C)cc2[N+](=O)[O-])CC1)CC(C)C ZINC000539107760 1038676183 /nfs/dbraw/zinc/67/61/83/1038676183.db2.gz SXRZUMFTPYOJMB-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000545458927 1038682944 /nfs/dbraw/zinc/68/29/44/1038682944.db2.gz XDBMFCXZTTYZKY-WDEREUQCSA-N 1 0 347.337 3.633 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000539297942 1038765781 /nfs/dbraw/zinc/76/57/81/1038765781.db2.gz XAJLFOUHCSCRHV-YJBOKZPZSA-N 1 0 330.359 3.601 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000539316624 1038770972 /nfs/dbraw/zinc/77/09/72/1038770972.db2.gz AYPNMYKXKVEUGK-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000488025564 1038789760 /nfs/dbraw/zinc/78/97/60/1038789760.db2.gz UKWDUAVMAINQCJ-OAHLLOKOSA-N 1 0 335.423 3.826 20 5 EHBDRO C[N@@H+](Cc1ccc2ccccc2c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000749637878 1038906933 /nfs/dbraw/zinc/90/69/33/1038906933.db2.gz FBVDYVSIVJRBPG-HXUWFJFHSA-N 1 0 336.391 3.913 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477843982 1038949456 /nfs/dbraw/zinc/94/94/56/1038949456.db2.gz HGJYJXRPLOVDLB-UZLBHIALSA-N 1 0 342.439 3.795 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC1CCC1 ZINC000478004936 1039130913 /nfs/dbraw/zinc/13/09/13/1039130913.db2.gz UEETVYMKUQUGST-OAHLLOKOSA-N 1 0 328.416 3.655 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000485473040 1039136773 /nfs/dbraw/zinc/13/67/73/1039136773.db2.gz HMALGUOIWVHCKB-YOEHRIQHSA-N 1 0 326.396 3.981 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1CO ZINC000249062714 1039343658 /nfs/dbraw/zinc/34/36/58/1039343658.db2.gz ICDCRLXCZNLTPG-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO COc1cc(C[NH+]2CCC(c3ccc(O)cc3)CC2)ccc1[N+](=O)[O-] ZINC000485743591 1039505124 /nfs/dbraw/zinc/50/51/24/1039505124.db2.gz KJLIOZGLWANGQC-UHFFFAOYSA-N 1 0 342.395 3.689 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000485746884 1039507066 /nfs/dbraw/zinc/50/70/66/1039507066.db2.gz UAKVXJKHBQEZGV-KRWDZBQOSA-N 1 0 342.395 3.949 20 5 EHBDRO COc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)ccc1SC ZINC000480447378 1039565745 /nfs/dbraw/zinc/56/57/45/1039565745.db2.gz SBGRPWCDYMRFOJ-UHFFFAOYSA-N 1 0 332.425 3.924 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1cccc(C)n1 ZINC000512516665 1039567947 /nfs/dbraw/zinc/56/79/47/1039567947.db2.gz JSOGEVHRDVDSKU-NTCAYCPXSA-N 1 0 325.412 3.924 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485798305 1039572364 /nfs/dbraw/zinc/57/23/64/1039572364.db2.gz DNJXECALPAJVGO-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO Cc1cccc(-c2n[nH]cc2C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000480480286 1039584628 /nfs/dbraw/zinc/58/46/28/1039584628.db2.gz HFMSTJRPOBUISN-UHFFFAOYSA-N 1 0 336.395 3.892 20 5 EHBDRO C[NH+](C)C1(CNc2ncnc3sc([N+](=O)[O-])cc32)CCCCCC1 ZINC000553249503 1039913652 /nfs/dbraw/zinc/91/36/52/1039913652.db2.gz LYAOWTJKBAOOAW-UHFFFAOYSA-N 1 0 349.460 3.666 20 5 EHBDRO N=C(Nc1cnc2c3ccccc3c3ccccc3c2n1)SCC[NH3+] ZINC001167909389 1039955201 /nfs/dbraw/zinc/95/52/01/1039955201.db2.gz HFUNNMYYJNZRHY-UHFFFAOYSA-N 1 0 347.447 3.975 20 5 EHBDRO COC(=O)c1ccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000489980364 1040286288 /nfs/dbraw/zinc/28/62/88/1040286288.db2.gz RESXXDJQWBXAJY-AWEZNQCLSA-N 1 0 342.395 3.883 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000490034536 1040302306 /nfs/dbraw/zinc/30/23/06/1040302306.db2.gz AJAUVHUTJVDMAT-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490014981 1040307286 /nfs/dbraw/zinc/30/72/86/1040307286.db2.gz RVVIVBWBBQUZCD-KRWDZBQOSA-N 1 0 326.396 3.668 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071077 1040332855 /nfs/dbraw/zinc/33/28/55/1040332855.db2.gz YLNFBJVZKJEEGW-SFHVURJKSA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@H]34)o2)c1 ZINC000190350907 1040501812 /nfs/dbraw/zinc/50/18/12/1040501812.db2.gz DXBYHNXONLILHJ-JFIYKMOQSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@@]1(O)C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000418110588 1040585711 /nfs/dbraw/zinc/58/57/11/1040585711.db2.gz JPFMIGGJZWHCRV-RSVKCKOMSA-N 1 0 336.775 3.511 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cs1 ZINC000433067328 1040623139 /nfs/dbraw/zinc/62/31/39/1040623139.db2.gz MYYXLHGWOWYTHE-MRXNPFEDSA-N 1 0 331.441 3.914 20 5 EHBDRO CC1(C)C[C@H](N[C@@H]2CC[N@@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114679 1040765273 /nfs/dbraw/zinc/76/52/73/1040765273.db2.gz GTIKIRFAQFDIBV-KUHUBIRLSA-N 1 0 343.471 3.924 20 5 EHBDRO COc1cc(N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000569775646 1040821001 /nfs/dbraw/zinc/82/10/01/1040821001.db2.gz CSOANMCTILDFHS-SCLBCKFNSA-N 1 0 329.400 3.707 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057271 1040894013 /nfs/dbraw/zinc/89/40/13/1040894013.db2.gz KQYGJOSRMWHAJD-GOSISDBHSA-N 1 0 331.460 3.683 20 5 EHBDRO CCC[C@H](C)[N@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491182646 1040944088 /nfs/dbraw/zinc/94/40/88/1040944088.db2.gz NEFVVCIDCFUKLO-NSHDSACASA-N 1 0 346.374 3.868 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168976736 1132617289 /nfs/dbraw/zinc/61/72/89/1132617289.db2.gz FYNVRYCASRVWKO-SRVKXCTJSA-N 1 0 327.222 3.545 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000555665338 1040975472 /nfs/dbraw/zinc/97/54/72/1040975472.db2.gz AYERRSPRJHJVBQ-AWEZNQCLSA-N 1 0 338.407 3.959 20 5 EHBDRO C[C@H]1CSC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000512864744 1041114379 /nfs/dbraw/zinc/11/43/79/1041114379.db2.gz OXLZQUYAIBSLPA-HZMBPMFUSA-N 1 0 335.454 3.559 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](CO)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000433231749 1041119832 /nfs/dbraw/zinc/11/98/32/1041119832.db2.gz KAKXFBSMEPXLTO-JKSUJKDBSA-N 1 0 332.425 3.702 20 5 EHBDRO C[C@@H](Cc1ccncc1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433280785 1041193434 /nfs/dbraw/zinc/19/34/34/1041193434.db2.gz FHJKDPPLJPTQPI-SCLBCKFNSA-N 1 0 325.412 3.933 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000500425582 1041438062 /nfs/dbraw/zinc/43/80/62/1041438062.db2.gz UMTRTEUVERITSI-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H]1OCCc2ccccc21 ZINC000511668798 1041457345 /nfs/dbraw/zinc/45/73/45/1041457345.db2.gz VSILLLZNSGRWBA-QKWWCAPFSA-N 1 0 338.407 3.854 20 5 EHBDRO CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000236871227 1042111702 /nfs/dbraw/zinc/11/17/02/1042111702.db2.gz ADDYDFXLJNZHMY-ACJLOTCBSA-N 1 0 332.400 3.742 20 5 EHBDRO C[N@H+](CCNc1ccc(Br)cc1[N+](=O)[O-])C1CCCC1 ZINC000111816843 1042294910 /nfs/dbraw/zinc/29/49/10/1042294910.db2.gz CBTUAIHLTZFFFX-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000128530300 1042629491 /nfs/dbraw/zinc/62/94/91/1042629491.db2.gz XOACSBFVCBMOSV-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cscc2Br)cc1 ZINC000382277639 1042677909 /nfs/dbraw/zinc/67/79/09/1042677909.db2.gz KBJFAZNSSIWVJQ-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CC2=Cc3ccccc3OC2)c1 ZINC000756899846 1042851081 /nfs/dbraw/zinc/85/10/81/1042851081.db2.gz DATWHXJLOBZLDE-UHFFFAOYSA-N 1 0 330.771 3.814 20 5 EHBDRO COc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1OC ZINC000165960262 1042914633 /nfs/dbraw/zinc/91/46/33/1042914633.db2.gz VRARMQZRVGAAJR-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000072948518 1042944150 /nfs/dbraw/zinc/94/41/50/1042944150.db2.gz LKHUOVGJRNOREZ-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000432339475 1042972622 /nfs/dbraw/zinc/97/26/22/1042972622.db2.gz ITYXSOHXACWZBI-DOMZBBRYSA-N 1 0 335.835 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCCC[C@H]3CCO)o2)cc1 ZINC000585767882 1043029943 /nfs/dbraw/zinc/02/99/43/1043029943.db2.gz VVYKHCNOJQGCML-INIZCTEOSA-N 1 0 344.411 3.982 20 5 EHBDRO CC1(C)C[C@H](NC2CC[NH+](C3CCC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279003346 1043165853 /nfs/dbraw/zinc/16/58/53/1043165853.db2.gz GASXFJKXRMYIPJ-IBGZPJMESA-N 1 0 343.471 3.924 20 5 EHBDRO C[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@@H+]1C ZINC000090095024 1043375615 /nfs/dbraw/zinc/37/56/15/1043375615.db2.gz WVBSFPKPIMBFMF-GDBMZVCRSA-N 1 0 340.427 3.576 20 5 EHBDRO CC(C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1cccs1 ZINC000344305697 1043640234 /nfs/dbraw/zinc/64/02/34/1043640234.db2.gz HINXFVPBZBJJPU-UHFFFAOYSA-N 1 0 334.397 3.548 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@@H]2CCCCS2)c1 ZINC000344362185 1043740361 /nfs/dbraw/zinc/74/03/61/1043740361.db2.gz RRSOQLZQZJMCRX-LBPRGKRZSA-N 1 0 332.372 3.572 20 5 EHBDRO CC(C)(O)c1ccc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000893675788 1043803304 /nfs/dbraw/zinc/80/33/04/1043803304.db2.gz MYVRSZCVDIWEJP-UHFFFAOYSA-N 1 0 334.803 3.765 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000279625780 1044327866 /nfs/dbraw/zinc/32/78/66/1044327866.db2.gz HIJVYHRIXUSDAW-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000344740950 1044358913 /nfs/dbraw/zinc/35/89/13/1044358913.db2.gz MUMHIYRDYNEYHB-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO CC[C@@H](C)[C@H](O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236869446 1044859549 /nfs/dbraw/zinc/85/95/49/1044859549.db2.gz BVSUVOGHAYQZOI-MLGOLLRUSA-N 1 0 334.441 3.820 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000183594158 1125613209 /nfs/dbraw/zinc/61/32/09/1125613209.db2.gz WDPLBPDSVXSJQL-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185856052 1127163227 /nfs/dbraw/zinc/16/32/27/1127163227.db2.gz SSJGJWBGBZIDIQ-CQSZACIVSA-N 1 0 330.388 3.799 20 5 EHBDRO Cc1ccnc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302497 1127736049 /nfs/dbraw/zinc/73/60/49/1127736049.db2.gz RWQOYZXBWFEFJM-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO COc1cc(N[C@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301328074 1127737231 /nfs/dbraw/zinc/73/72/31/1127737231.db2.gz JFBHYQSTXSSBJD-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000172373180 1127919935 /nfs/dbraw/zinc/91/99/35/1127919935.db2.gz VQAJRBAEDBVEKI-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1cnc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000301444913 1127932493 /nfs/dbraw/zinc/93/24/93/1127932493.db2.gz NRPXYXQGNBOLEV-CZUORRHYSA-N 1 0 346.456 3.855 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC[C@H](C[NH+]2CCCC2)C1 ZINC000553079428 1128166429 /nfs/dbraw/zinc/16/64/29/1128166429.db2.gz PNWMJDQXQSFLEM-LLVKDONJSA-N 1 0 344.242 3.824 20 5 EHBDRO C[C@H]1[C@H]([NH+]2CCCC2)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553359188 1128414989 /nfs/dbraw/zinc/41/49/89/1128414989.db2.gz WGLIGYZKEBPAQG-SMDDNHRTSA-N 1 0 343.349 3.677 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)C[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331060 1128409449 /nfs/dbraw/zinc/40/94/49/1128409449.db2.gz RZPZBRPFCIUQGS-MELADBBJSA-N 1 0 333.432 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(OC(F)(F)F)c2)cc1 ZINC000326845853 1128469433 /nfs/dbraw/zinc/46/94/33/1128469433.db2.gz PTDYAHDPEDFQIH-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO Cc1cnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301602410 1128516704 /nfs/dbraw/zinc/51/67/04/1128516704.db2.gz WHTMXMGDPLJALI-WBVHZDCISA-N 1 0 340.427 3.621 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[N@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631229 1128528372 /nfs/dbraw/zinc/52/83/72/1128528372.db2.gz PQIBGQQOGIZAOX-CQSZACIVSA-N 1 0 335.448 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000765849003 1128573782 /nfs/dbraw/zinc/57/37/82/1128573782.db2.gz NMGIHOQPPJCILJ-HSALFYBXSA-N 1 0 340.423 3.944 20 5 EHBDRO C[C@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000172619125 1128736704 /nfs/dbraw/zinc/73/67/04/1128736704.db2.gz JHKLFYKYDKZEEI-RDJZCZTQSA-N 1 0 347.462 3.943 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c2ncccc12 ZINC000715715945 1128810769 /nfs/dbraw/zinc/81/07/69/1128810769.db2.gz VESHJPTWEKZESQ-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO Cc1nc(NC[C@@H](c2cccs2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301657099 1128847119 /nfs/dbraw/zinc/84/71/19/1128847119.db2.gz SFMXKZMFXFREEX-AWEZNQCLSA-N 1 0 332.429 3.609 20 5 EHBDRO C[C@H](C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000734508029 1131243338 /nfs/dbraw/zinc/24/33/38/1131243338.db2.gz BZQDWDJHWJOBGO-CYBMUJFWSA-N 1 0 330.432 3.767 20 5 EHBDRO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@@H]1CCc2ccccc21 ZINC000595876754 1120362393 /nfs/dbraw/zinc/36/23/93/1120362393.db2.gz GFSDTZPNVRFPRO-AWEZNQCLSA-N 1 0 336.395 3.633 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](c1cccs1)C1CC1 ZINC000542511467 1120862179 /nfs/dbraw/zinc/86/21/79/1120862179.db2.gz RFDFIGGJFFMSBZ-KRWDZBQOSA-N 1 0 345.424 3.644 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)cc1[N+](=O)[O-] ZINC000495427641 1121186949 /nfs/dbraw/zinc/18/69/49/1121186949.db2.gz SINPBWCHBDNUQE-MLGOLLRUSA-N 1 0 336.432 3.990 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663371 1121561050 /nfs/dbraw/zinc/56/10/50/1121561050.db2.gz PXQLMBNSJXFWRQ-HOCLYGCPSA-N 1 0 347.459 3.661 20 5 EHBDRO C[C@@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380209 1121596174 /nfs/dbraw/zinc/59/61/74/1121596174.db2.gz BRNLJXUGSOIIOA-VQIMIIECSA-N 1 0 339.439 3.595 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+]2Cc2ccccc2)c1 ZINC000390706934 1129016864 /nfs/dbraw/zinc/01/68/64/1129016864.db2.gz RDPSPGULIVSNFY-MRXNPFEDSA-N 1 0 341.411 3.680 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2cccc([N+](=O)[O-])c2C(C)=O)c1 ZINC000763203557 1121868815 /nfs/dbraw/zinc/86/88/15/1121868815.db2.gz NOUPQABSKSEXBD-UHFFFAOYSA-N 1 0 341.411 3.861 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301193509 1122449588 /nfs/dbraw/zinc/44/95/88/1122449588.db2.gz SRTZPHWGHWHIJE-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000301773345 1129061348 /nfs/dbraw/zinc/06/13/48/1129061348.db2.gz FIOKJZHSRFMBBZ-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC(C)[C@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000497445805 1122554737 /nfs/dbraw/zinc/55/47/37/1122554737.db2.gz UCYFIAUODXDTLA-LJQANCHMSA-N 1 0 341.411 3.862 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301773155 1129063768 /nfs/dbraw/zinc/06/37/68/1129063768.db2.gz GMNWIRYCKRLLRF-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000917477103 1122612579 /nfs/dbraw/zinc/61/25/79/1122612579.db2.gz UGIZHFAOZKXCKW-UHFFFAOYSA-N 1 0 338.411 3.857 20 5 EHBDRO CC(=O)c1ccc(NC[C@@]2([NH+](C)C)CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000497648384 1122616592 /nfs/dbraw/zinc/61/65/92/1122616592.db2.gz SGKXHURWVMWBHO-SCLBCKFNSA-N 1 0 333.432 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCCC[C@H]([NH+]3CCCC3)C2)c2ccncc21 ZINC000301212258 1122800762 /nfs/dbraw/zinc/80/07/62/1122800762.db2.gz XNCBSBBVENOWPY-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H]1CCOC1 ZINC000132140458 1129079178 /nfs/dbraw/zinc/07/91/78/1129079178.db2.gz AAHOKDRFKIZMHL-HNNXBMFYSA-N 1 0 346.358 3.747 20 5 EHBDRO CC(=O)c1ccc(N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)c([N+](=O)[O-])c1 ZINC000919722095 1123133620 /nfs/dbraw/zinc/13/36/20/1123133620.db2.gz WSPKVKMDFILQAF-CPUCHLNUSA-N 1 0 345.443 3.639 20 5 EHBDRO CC(C)c1ccc(C[N@H+](C)C[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000556894617 1123171899 /nfs/dbraw/zinc/17/18/99/1123171899.db2.gz CLXAZBCJPHOICK-GOSISDBHSA-N 1 0 342.439 3.754 20 5 EHBDRO COC[C@H]1CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000556909061 1123195905 /nfs/dbraw/zinc/19/59/05/1123195905.db2.gz UVWFDJWBVDYRSI-GFCCVEGCSA-N 1 0 336.775 3.729 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)C1 ZINC000195508836 1123494589 /nfs/dbraw/zinc/49/45/89/1123494589.db2.gz AFGQTDSTUBNPGS-CYBMUJFWSA-N 1 0 346.456 3.895 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609571506 1123610862 /nfs/dbraw/zinc/61/08/62/1123610862.db2.gz LDZCTCPXXYGANF-SCLBCKFNSA-N 1 0 332.400 3.742 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000609891358 1123687778 /nfs/dbraw/zinc/68/77/78/1123687778.db2.gz AHPAYYPYGNLCNX-BETUJISGSA-N 1 0 340.855 3.813 20 5 EHBDRO C[C@@H]1c2ccc(F)cc2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610003614 1123711268 /nfs/dbraw/zinc/71/12/68/1123711268.db2.gz BNJCNQBRFPCKOU-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H]1c2c(F)cccc2CCN1CCOc1ccccc1[N+](=O)[O-] ZINC000610004144 1123712199 /nfs/dbraw/zinc/71/21/99/1123712199.db2.gz BDXCKDUTKZCWMP-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccnc(NCC(C)(C)[NH2+][C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000301248003 1123749965 /nfs/dbraw/zinc/74/99/65/1123749965.db2.gz BGMDYQJVGRROSV-CQSZACIVSA-N 1 0 328.416 3.840 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCc2ccc(O)cc2CC1 ZINC000615836102 1123885439 /nfs/dbraw/zinc/88/54/39/1123885439.db2.gz RUKGBZQQDZSVIL-RVDMUPIBSA-N 1 0 338.407 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC[NH+]2Cc3ccccc3C2)c2ncccc12 ZINC000068321502 1123917572 /nfs/dbraw/zinc/91/75/72/1123917572.db2.gz JTCIQTWZGZLUCG-UHFFFAOYSA-N 1 0 334.379 3.571 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301837153 1129169092 /nfs/dbraw/zinc/16/90/92/1129169092.db2.gz MKASNDFHOUXTGE-DZGCQCFKSA-N 1 0 332.791 3.501 20 5 EHBDRO CC[C@H]([NH2+]C[C@@](C)(O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181794891 1125042395 /nfs/dbraw/zinc/04/23/95/1125042395.db2.gz UZBDFNIUTCSXNF-ZWKOTPCHSA-N 1 0 332.375 3.682 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](C/C=C\c3ccc(Cl)cc3)CC2)n1 ZINC000618759973 1125192228 /nfs/dbraw/zinc/19/22/28/1125192228.db2.gz JTAMJHGOOUTWQW-UPHRSURJSA-N 1 0 346.818 3.795 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)CCc1ccccc1)C1CC1 ZINC000182554146 1125332865 /nfs/dbraw/zinc/33/28/65/1125332865.db2.gz QCEKDTMXUVHHNW-LJQANCHMSA-N 1 0 340.423 3.553 20 5 EHBDRO CCOc1cc(NC[C@@H](c2cccs2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000080763402 1125348304 /nfs/dbraw/zinc/34/83/04/1125348304.db2.gz VXCNBTKGPBZUBJ-AWEZNQCLSA-N 1 0 335.429 3.770 20 5 EHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000183084338 1125435526 /nfs/dbraw/zinc/43/55/26/1125435526.db2.gz MGBRKBGLKXYKQT-ZJUUUORDSA-N 1 0 332.347 3.729 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(OCc3ccccc3)CC2)cc1 ZINC000079928348 1129307821 /nfs/dbraw/zinc/30/78/21/1129307821.db2.gz WIIZAYABENXHGB-UHFFFAOYSA-N 1 0 340.423 3.819 20 5 EHBDRO COc1cc(NC[C@H](c2ccc(C)cc2)[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC000301913000 1129348833 /nfs/dbraw/zinc/34/88/33/1129348833.db2.gz CHDGUAVIGKMNMG-QGZVFWFLSA-N 1 0 347.390 3.766 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@@H]1C1CC1 ZINC000543242307 1129366061 /nfs/dbraw/zinc/36/60/61/1129366061.db2.gz JYRCIKWWZPTKFE-RTBURBONSA-N 1 0 342.395 3.902 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@](C)(O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402052 1129462504 /nfs/dbraw/zinc/46/25/04/1129462504.db2.gz CQRNSIXWRXWOBL-MSOLQXFVSA-N 1 0 332.400 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2OCc2cccnc2)cc1 ZINC000069784218 1129480667 /nfs/dbraw/zinc/48/06/67/1129480667.db2.gz ZODMOWXWUZDGOH-UHFFFAOYSA-N 1 0 349.390 3.859 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H](C)c1c(C)cccc1C ZINC000555059632 1129524830 /nfs/dbraw/zinc/52/48/30/1129524830.db2.gz RJYZJGGPUBGQON-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ncc(CC)s2)cc1[N+](=O)[O-] ZINC000154050662 1129530774 /nfs/dbraw/zinc/53/07/74/1129530774.db2.gz VRLBVURSAKKOIQ-LBPRGKRZSA-N 1 0 349.456 3.906 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093324610 1129584597 /nfs/dbraw/zinc/58/45/97/1129584597.db2.gz TUXPZXDSCXWWDG-ZKKXHLJNSA-N 1 0 326.396 3.877 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1(O)CCCC1 ZINC000093503093 1129590947 /nfs/dbraw/zinc/59/09/47/1129590947.db2.gz RNPAIJUVIQHVET-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280987 1129658773 /nfs/dbraw/zinc/65/87/73/1129658773.db2.gz UPNMSOQLMODUQD-CABCVRRESA-N 1 0 347.459 3.530 20 5 EHBDRO COc1cc(CN(Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1OC ZINC000125425741 1129691177 /nfs/dbraw/zinc/69/11/77/1129691177.db2.gz VDAAURZHYBCDJY-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000922844757 1129691260 /nfs/dbraw/zinc/69/12/60/1129691260.db2.gz ZESQCZXUIVSJSO-GXSJLCMTSA-N 1 0 332.372 3.570 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302048239 1129765356 /nfs/dbraw/zinc/76/53/56/1129765356.db2.gz WBNDXYWYDRTLAO-JTQLQIEISA-N 1 0 332.231 3.680 20 5 EHBDRO C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302051574 1129765886 /nfs/dbraw/zinc/76/58/86/1129765886.db2.gz OCOCNFJNRACJEQ-RYUDHWBXSA-N 1 0 338.839 3.708 20 5 EHBDRO Cc1cc(C)n(CCCNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)n1 ZINC000302168525 1129771376 /nfs/dbraw/zinc/77/13/76/1129771376.db2.gz LLQYNMHMFQVWSK-UHFFFAOYSA-N 1 0 339.399 3.767 20 5 EHBDRO Cc1cc(NC[C@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302177741 1129771690 /nfs/dbraw/zinc/77/16/90/1129771690.db2.gz NGGHOTNLXZHDIG-INIZCTEOSA-N 1 0 329.381 3.658 20 5 EHBDRO COc1ccc(CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)cc1O ZINC000302677501 1129785634 /nfs/dbraw/zinc/78/56/34/1129785634.db2.gz VAJBLLDGQDJNLK-UHFFFAOYSA-N 1 0 339.351 3.778 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H]3C3CCCC3)n2)c1 ZINC000055927423 1129790245 /nfs/dbraw/zinc/79/02/45/1129790245.db2.gz OVLWPJLRCGIEKS-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000056196228 1129805842 /nfs/dbraw/zinc/80/58/42/1129805842.db2.gz ZMCQIYUTEXXKSS-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196405 1129806083 /nfs/dbraw/zinc/80/60/83/1129806083.db2.gz RDKZWRFTCILAKT-KGLIPLIRSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000056196224 1129806132 /nfs/dbraw/zinc/80/61/32/1129806132.db2.gz ZMCQIYUTEXXKSS-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303532712 1129852392 /nfs/dbraw/zinc/85/23/92/1129852392.db2.gz GEDUDFAOOCLTPT-BEFAXECRSA-N 1 0 343.427 3.744 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC([C@@H](O)c3ccc(F)cc3)CC2)c1 ZINC000303992770 1129875409 /nfs/dbraw/zinc/87/54/09/1129875409.db2.gz NLCROZHPLVCRCG-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000305093737 1129911515 /nfs/dbraw/zinc/91/15/15/1129911515.db2.gz XYAKNHRXWVZGIF-UHFFFAOYSA-N 1 0 341.411 3.680 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305148324 1129912802 /nfs/dbraw/zinc/91/28/02/1129912802.db2.gz OACHXSSPPBXHFS-HDMKZQKVSA-N 1 0 328.412 3.800 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000133556902 1129952233 /nfs/dbraw/zinc/95/22/33/1129952233.db2.gz PKKCKBBZCSEPPF-UGSOOPFHSA-N 1 0 331.391 3.687 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000173458221 1130234116 /nfs/dbraw/zinc/23/41/16/1130234116.db2.gz HSVTXUHRHSXYSN-AWEZNQCLSA-N 1 0 347.802 3.928 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000173867779 1130321237 /nfs/dbraw/zinc/32/12/37/1130321237.db2.gz RZYFLCUNUNJIAV-CQSZACIVSA-N 1 0 337.851 3.556 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H]2c2cccc3ccccc32)c1 ZINC000174833018 1130386940 /nfs/dbraw/zinc/38/69/40/1130386940.db2.gz DUOMBLPKKHZNSN-LJQANCHMSA-N 1 0 336.395 3.782 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](CCn1cc([N+](=O)[O-])cn1)C1CC1 ZINC000174831174 1130387374 /nfs/dbraw/zinc/38/73/74/1130387374.db2.gz PDIBPQNVRMVQPY-GFCCVEGCSA-N 1 0 334.807 3.670 20 5 EHBDRO COc1ccccc1OCC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429255562 1130400686 /nfs/dbraw/zinc/40/06/86/1130400686.db2.gz NNWAKKMKKCDBSG-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO Cc1cccc(C)c1C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000738297761 1131467140 /nfs/dbraw/zinc/46/71/40/1131467140.db2.gz BJEGYSVOKIGAKQ-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO Cc1nc([C@@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899035 1131883003 /nfs/dbraw/zinc/88/30/03/1131883003.db2.gz LBNVLCVHHMRUCS-ABAIWWIYSA-N 1 0 331.441 3.958 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCc3ccccc3C1)CC2 ZINC001172900867 1131884049 /nfs/dbraw/zinc/88/40/49/1131884049.db2.gz GYLGMTNFLYDWOM-UXHICEINSA-N 1 0 336.435 3.989 20 5 EHBDRO CC(=O)[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901828 1131885058 /nfs/dbraw/zinc/88/50/58/1131885058.db2.gz PRNYAYTUACMKCI-UYAOXDASSA-N 1 0 338.407 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(F)cc1F)CC2 ZINC001172896042 1131901649 /nfs/dbraw/zinc/90/16/49/1131901649.db2.gz LFDLWZQPIMRGJC-INIZCTEOSA-N 1 0 332.350 3.910 20 5 EHBDRO COc1ccccc1CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896223 1131902059 /nfs/dbraw/zinc/90/20/59/1131902059.db2.gz BXUBIUYOZCNOGP-GOSISDBHSA-N 1 0 340.423 3.683 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381061 1131914440 /nfs/dbraw/zinc/91/44/40/1131914440.db2.gz TUJABFOPVRSLDP-GOEBONIOSA-N 1 0 343.431 3.711 20 5 EHBDRO CC(C)[N@H+](CCCCCO)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911729 1131917961 /nfs/dbraw/zinc/91/79/61/1131917961.db2.gz FJCHCDHFGOAADN-GOSISDBHSA-N 1 0 334.460 3.715 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1COc3ccc(F)cc31)CC2 ZINC001172912096 1131918261 /nfs/dbraw/zinc/91/82/61/1131918261.db2.gz LUNZOAYNQZYMAM-MAUKXSAKSA-N 1 0 342.370 3.705 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)Cc2cccs2)c1F ZINC001173188542 1131994111 /nfs/dbraw/zinc/99/41/11/1131994111.db2.gz GMRNPVRCDZFWKS-LLVKDONJSA-N 1 0 338.404 3.867 20 5 EHBDRO COc1ccc(F)c(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173216001 1132001569 /nfs/dbraw/zinc/00/15/69/1132001569.db2.gz GYDMZIYPTRFSPW-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2ccc(F)cc21 ZINC001173217816 1132001951 /nfs/dbraw/zinc/00/19/51/1132001951.db2.gz MNVCXSVIUAKQTJ-CYBMUJFWSA-N 1 0 341.386 3.994 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173218467 1132003205 /nfs/dbraw/zinc/00/32/05/1132003205.db2.gz KAGLIASRGBKWOG-KDOFPFPSSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1cc(OC)cc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173220135 1132003491 /nfs/dbraw/zinc/00/34/91/1132003491.db2.gz UPEPUTNIBKNJKN-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](CF)(C(F)(F)F)C1 ZINC001173221260 1132004226 /nfs/dbraw/zinc/00/42/26/1132004226.db2.gz GSEJDXUPRPRGAE-SMDDNHRTSA-N 1 0 334.313 3.750 20 5 EHBDRO COC(=O)CC1(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC001173220260 1132004649 /nfs/dbraw/zinc/00/46/49/1132004649.db2.gz WUIHUEAJYVDYCK-OAHLLOKOSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC001173224838 1132005487 /nfs/dbraw/zinc/00/54/87/1132005487.db2.gz PGIKUXPQWHFQPA-KPZWWZAWSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)c1ccc(F)cn1 ZINC001173225252 1132006611 /nfs/dbraw/zinc/00/66/11/1132006611.db2.gz REXODOMKIWVQBW-CYBMUJFWSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccc(F)cn1)C1CC1 ZINC001173226650 1132007072 /nfs/dbraw/zinc/00/70/72/1132007072.db2.gz YHCSFAMQBSRJMW-SGTLLEGYSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1cccnc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228805 1132008511 /nfs/dbraw/zinc/00/85/11/1132008511.db2.gz KLGGMNMMAQCISX-SCLBCKFNSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](CC(=O)OC(C)(C)C)C1 ZINC001173230817 1132008990 /nfs/dbraw/zinc/00/89/90/1132008990.db2.gz GXZQIZWNHXLRFP-GDBMZVCRSA-N 1 0 348.443 3.580 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230906 1132009304 /nfs/dbraw/zinc/00/93/04/1132009304.db2.gz WDFMINFXIBWBOR-LSDHHAIUSA-N 1 0 328.412 3.755 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](Cc1ccccc1)CC(C)(C)O ZINC001173233477 1132010742 /nfs/dbraw/zinc/01/07/42/1132010742.db2.gz WWWHLNQGGWCBTB-MRXNPFEDSA-N 1 0 342.439 3.799 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cnccc1C(F)(F)F ZINC001173210327 1132013915 /nfs/dbraw/zinc/01/39/15/1132013915.db2.gz IUOQIVMNSAOPOR-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2cc(F)c(F)cc2C1 ZINC001173238450 1132027886 /nfs/dbraw/zinc/02/78/86/1132027886.db2.gz SRZKTLDQYUELGT-GFCCVEGCSA-N 1 0 332.350 3.862 20 5 EHBDRO NC(=O)c1ccc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cc1 ZINC001174050324 1132207771 /nfs/dbraw/zinc/20/77/71/1132207771.db2.gz NAFQABJXJBIUSD-UHFFFAOYSA-N 1 0 328.375 3.813 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cccc(O)c1 ZINC001174896398 1132497340 /nfs/dbraw/zinc/49/73/40/1132497340.db2.gz QZAYQQREZLBXHX-UHFFFAOYSA-N 1 0 345.402 3.950 20 5 EHBDRO COc1cccc([C@H]([NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc2)c1 ZINC001168985318 1132619741 /nfs/dbraw/zinc/61/97/41/1132619741.db2.gz DGLXKHFOSGJOFO-ZAAXVRCTSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(n3ccc4ccccc43)CC2)C1 ZINC001169036541 1132636880 /nfs/dbraw/zinc/63/68/80/1132636880.db2.gz GKVOCDFBUNXKPS-QAPCUYQASA-N 1 0 327.428 3.724 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3cccc(F)c32)C1 ZINC001169041121 1132638497 /nfs/dbraw/zinc/63/84/97/1132638497.db2.gz BCCWBDVOTMHAJX-UKRRQHHQSA-N 1 0 345.418 3.865 20 5 EHBDRO CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169045709 1132640851 /nfs/dbraw/zinc/64/08/51/1132640851.db2.gz JTISPAKFDIDFTR-DZGCQCFKSA-N 1 0 330.350 3.973 20 5 EHBDRO COc1cc(C)c([N+](=O)[O-])cc1N[C@@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001169147722 1132676843 /nfs/dbraw/zinc/67/68/43/1132676843.db2.gz UTIPMHMPHASZCU-ACJLOTCBSA-N 1 0 335.448 3.867 20 5 EHBDRO CC[C@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001169495399 1132771360 /nfs/dbraw/zinc/77/13/60/1132771360.db2.gz RGIBIXISCNJULE-MNOVXSKESA-N 1 0 327.222 3.978 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc2nc[nH]c2c1[N+](=O)[O-] ZINC001169689674 1132821173 /nfs/dbraw/zinc/82/11/73/1132821173.db2.gz HSQCUOZDOQYLMF-ZDUSSCGKSA-N 1 0 337.383 3.711 20 5 EHBDRO Cc1cc2cc3cc(C)c(Nc4cnn(CCO)c4)cc3[nH+]c2cc1N ZINC001176479645 1132943460 /nfs/dbraw/zinc/94/34/60/1132943460.db2.gz SVUTWOBTPBAEQR-UHFFFAOYSA-N 1 0 347.422 3.519 20 5 EHBDRO Cc1ccc(C[NH2+][C@]2(CO)CC[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC001176933653 1133011332 /nfs/dbraw/zinc/01/13/32/1133011332.db2.gz YQAYKXXMRAPHNX-VLIAUNLRSA-N 1 0 340.423 3.778 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC001177203985 1133038908 /nfs/dbraw/zinc/03/89/08/1133038908.db2.gz JVTDXJMBYZGSLT-UHFFFAOYSA-N 1 0 339.351 3.548 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761575 1133048428 /nfs/dbraw/zinc/04/84/28/1133048428.db2.gz BGMBBGSIXKPNTB-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO Cc1nn(C[N@@H+]2CCC[C@@H]2CCCc2ccccc2)c(C)c1[N+](=O)[O-] ZINC000767763361 1133048977 /nfs/dbraw/zinc/04/89/77/1133048977.db2.gz NYCKIMSULXIYGD-SFHVURJKSA-N 1 0 342.443 3.853 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941490 1133073728 /nfs/dbraw/zinc/07/37/28/1133073728.db2.gz RWUSEZAKLCKDED-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]4OCC[C@H]43)o2)c1 ZINC001177976466 1133125889 /nfs/dbraw/zinc/12/58/89/1133125889.db2.gz FIYJVBHUEVDYGR-YQVWRLOYSA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H](O)c2cccc(Cl)c2)C2CC2)c1 ZINC000768544274 1133157870 /nfs/dbraw/zinc/15/78/70/1133157870.db2.gz KUXCNTBBHQELRU-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001182327207 1133634159 /nfs/dbraw/zinc/63/41/59/1133634159.db2.gz QCMOPJHWXLYMDT-CQSZACIVSA-N 1 0 345.365 3.528 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000774265959 1133650099 /nfs/dbraw/zinc/65/00/99/1133650099.db2.gz LLIIRCUYMJPVTC-SFHVURJKSA-N 1 0 341.367 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1COC3(CCCCC3)O1)CCC2 ZINC000774273522 1133652912 /nfs/dbraw/zinc/65/29/12/1133652912.db2.gz SKHKHJRXQLICHB-FUHWJXTLSA-N 1 0 346.427 3.638 20 5 EHBDRO C[C@@H](C[NH+](C)C)NC(=O)CCc1c2ccccc2cc2ccccc21 ZINC001182412331 1133655811 /nfs/dbraw/zinc/65/58/11/1133655811.db2.gz DAYYPNJEXFEZLL-INIZCTEOSA-N 1 0 334.463 3.992 20 5 EHBDRO Cc1ccc([C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000774408861 1133673595 /nfs/dbraw/zinc/67/35/95/1133673595.db2.gz JRCZJJBTCHYNBN-MOPGFXCFSA-N 1 0 326.396 3.678 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000774480622 1133687376 /nfs/dbraw/zinc/68/73/76/1133687376.db2.gz WXGIIFHFKJWFPD-DLBZAZTESA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774519269 1133702700 /nfs/dbraw/zinc/70/27/00/1133702700.db2.gz WLRZXSHHTDXFCL-UKRRQHHQSA-N 1 0 329.375 3.981 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnn(CC2CCC2)c1 ZINC001184035981 1133890371 /nfs/dbraw/zinc/89/03/71/1133890371.db2.gz UAEUWBZMLQWCCD-HNNXBMFYSA-N 1 0 342.443 3.702 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000786810999 1133909726 /nfs/dbraw/zinc/90/97/26/1133909726.db2.gz WXYWMRHKFKRCGN-YVJSUPCUSA-N 1 0 346.814 3.975 20 5 EHBDRO O=[N+]([O-])c1c(N2CC[NH+](C3CCCC3)CC2)cccc1C(F)(F)F ZINC001184793222 1133991674 /nfs/dbraw/zinc/99/16/74/1133991674.db2.gz YNOBGVJMRWYQFI-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000746674150 1133991752 /nfs/dbraw/zinc/99/17/52/1133991752.db2.gz OCBLHCKLRMWYOX-AWEZNQCLSA-N 1 0 337.851 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(F)c(F)c2)cc1Cl ZINC000787418748 1134000834 /nfs/dbraw/zinc/00/08/34/1134000834.db2.gz RJNDWEOPJNFOQI-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO Cc1cc(NC[C@@H](C)[N@@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC001185148878 1134047117 /nfs/dbraw/zinc/04/71/17/1134047117.db2.gz IOIYOSFDCHOFQC-CQSZACIVSA-N 1 0 343.402 3.901 20 5 EHBDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873511 1134089085 /nfs/dbraw/zinc/08/90/85/1134089085.db2.gz JGAUFQWRAYTOEC-CQSZACIVSA-N 1 0 341.367 3.801 20 5 EHBDRO Cc1cc(N(CC[NH+](C)C)CC2CCCCC2)c(F)cc1[N+](=O)[O-] ZINC001185899558 1134146786 /nfs/dbraw/zinc/14/67/86/1134146786.db2.gz VRDVSZQBZSPZGD-UHFFFAOYSA-N 1 0 337.439 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC[C@H]2[C@H]2CCOC2)c1 ZINC000788984036 1134200696 /nfs/dbraw/zinc/20/06/96/1134200696.db2.gz MILATKUZXTVXES-YLQAJVPDSA-N 1 0 338.835 3.933 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000789361215 1134262548 /nfs/dbraw/zinc/26/25/48/1134262548.db2.gz GBILQVVQVILIGF-MOPGFXCFSA-N 1 0 328.412 3.932 20 5 EHBDRO CCOc1cc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187063690 1134291706 /nfs/dbraw/zinc/29/17/06/1134291706.db2.gz LXQTVXPCBATOPX-INIZCTEOSA-N 1 0 333.432 3.812 20 5 EHBDRO Cc1cc(N2CC[N@@H+](C)C(C)(C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001187189666 1134307397 /nfs/dbraw/zinc/30/73/97/1134307397.db2.gz FVHAQDBQWXOQEL-UHFFFAOYSA-N 1 0 345.365 3.843 20 5 EHBDRO Nc1cc(CCCCNc2ncc([N+](=O)[O-])c3ccccc32)cc[nH+]1 ZINC001187739781 1134379148 /nfs/dbraw/zinc/37/91/48/1134379148.db2.gz JFOMNLIIFNUZPA-UHFFFAOYSA-N 1 0 337.383 3.555 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2ccccn2)C(C)C)c([N+](=O)[O-])c1 ZINC001170304330 1134738729 /nfs/dbraw/zinc/73/87/29/1134738729.db2.gz BQCRQNZAZIBMTA-AUUYWEPGSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@H](C)n2ccc3c2cccc3C[NH3+])c([N+](=O)[O-])c1 ZINC001170300105 1134739034 /nfs/dbraw/zinc/73/90/34/1134739034.db2.gz XACALSNODFFTOO-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccn1 ZINC001170304721 1134739421 /nfs/dbraw/zinc/73/94/21/1134739421.db2.gz GGSBPTCSSSKXPM-XJKSGUPXSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(C)Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170317443 1134746382 /nfs/dbraw/zinc/74/63/82/1134746382.db2.gz IRGNVRUERDZEAB-CQSZACIVSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326629 1134748426 /nfs/dbraw/zinc/74/84/26/1134748426.db2.gz AVXJPVCKUHXAPD-CQSZACIVSA-N 1 0 326.396 3.593 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCOC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170353159 1134753586 /nfs/dbraw/zinc/75/35/86/1134753586.db2.gz WWRKEEXHVTYJEA-OAHLLOKOSA-N 1 0 348.443 3.570 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170343562 1134758744 /nfs/dbraw/zinc/75/87/44/1134758744.db2.gz QPPZNACNPCTFHY-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346415 1134760047 /nfs/dbraw/zinc/76/00/47/1134760047.db2.gz NMMLDMXVCYYKEB-KSSFIOAISA-N 1 0 341.411 3.767 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC[NH+](C2CCCCC2)CC1 ZINC001192402506 1135014851 /nfs/dbraw/zinc/01/48/51/1135014851.db2.gz UPYXXLBIBPPCND-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])c1 ZINC000804373218 1135049820 /nfs/dbraw/zinc/04/98/20/1135049820.db2.gz QVGLKKITSVVNAM-UHFFFAOYSA-N 1 0 344.371 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000804564495 1135121534 /nfs/dbraw/zinc/12/15/34/1135121534.db2.gz WWXZAOGNVYCPLP-IUODEOHRSA-N 1 0 335.835 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000804589515 1135126311 /nfs/dbraw/zinc/12/63/11/1135126311.db2.gz DNPLNPMDPBBYJW-UHFFFAOYSA-N 1 0 346.818 3.972 20 5 EHBDRO C[N@H+](CCSc1c([N+](=O)[O-])cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000804674193 1135164281 /nfs/dbraw/zinc/16/42/81/1135164281.db2.gz OKNQRONPQYUGEB-UHFFFAOYSA-N 1 0 347.396 3.727 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC001196450619 1135568193 /nfs/dbraw/zinc/56/81/93/1135568193.db2.gz FNKARSSWVUBFMT-CQSZACIVSA-N 1 0 330.428 3.855 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](Cn2ccnc2)c2ccccc2)cc1[N+](=O)[O-] ZINC001197275702 1135668561 /nfs/dbraw/zinc/66/85/61/1135668561.db2.gz VWERBNDPVHEGHK-GOSISDBHSA-N 1 0 336.395 3.631 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H](C3CCOCC3)C2)c(F)c1 ZINC001197283387 1135672858 /nfs/dbraw/zinc/67/28/58/1135672858.db2.gz BHKRZLWOBZZZHT-OAHLLOKOSA-N 1 0 336.407 3.763 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)C1(Cc2ccccc2)CCCC1 ZINC001197565759 1135706756 /nfs/dbraw/zinc/70/67/56/1135706756.db2.gz XYFFPMVMSGNSQX-UHFFFAOYSA-N 1 0 342.443 3.587 20 5 EHBDRO C[N@@H+]1C[C@@]23CN(Cc4ccc(Cl)c([N+](=O)[O-])c4)C[C@]2(C1)CCCC3 ZINC001198821321 1135859642 /nfs/dbraw/zinc/85/96/42/1135859642.db2.gz QTKLPQZHFGASLZ-HDICACEKSA-N 1 0 349.862 3.556 20 5 EHBDRO CCOCOc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000809689351 1135872131 /nfs/dbraw/zinc/87/21/31/1135872131.db2.gz YQMMVPHBOATUQZ-UHFFFAOYSA-N 1 0 344.411 3.642 20 5 EHBDRO [NH3+]CCN(Cc1cc2ccccc2s1)c1ccc([N+](=O)[O-])cc1 ZINC000809734637 1135873478 /nfs/dbraw/zinc/87/34/78/1135873478.db2.gz JAXDGANCWKASBS-UHFFFAOYSA-N 1 0 327.409 3.775 20 5 EHBDRO Cc1oc2ccccc2c1CN(CC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC000809735283 1135873907 /nfs/dbraw/zinc/87/39/07/1135873907.db2.gz ZGXCCLHDDWLBSN-UHFFFAOYSA-N 1 0 325.368 3.615 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@H]3C2)c([N+](=O)[O-])cc1O ZINC001199053505 1135876352 /nfs/dbraw/zinc/87/63/52/1135876352.db2.gz ZZWVRQRXCPJPNJ-KCQAQPDRSA-N 1 0 334.416 3.758 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](O)c1ccccc1 ZINC000809748602 1135885360 /nfs/dbraw/zinc/88/53/60/1135885360.db2.gz WBTKNBZFPLJKHC-RYBIEJRYSA-N 1 0 326.396 3.711 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000810006291 1135913095 /nfs/dbraw/zinc/91/30/95/1135913095.db2.gz IONOOZLGSUXEGB-AEFFLSMTSA-N 1 0 345.830 3.783 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000810093374 1135920414 /nfs/dbraw/zinc/92/04/14/1135920414.db2.gz NHOHCOODRRVCHO-JKSUJKDBSA-N 1 0 336.819 3.782 20 5 EHBDRO CC(C)c1ccc(C(=O)O[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810836980 1136011995 /nfs/dbraw/zinc/01/19/95/1136011995.db2.gz JQJQZJOYOGOLAM-HUUCEWRRSA-N 1 0 332.400 3.502 20 5 EHBDRO C[C@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000811484366 1136091733 /nfs/dbraw/zinc/09/17/33/1136091733.db2.gz VJUBXPBZFORUOO-JOYOIKCWSA-N 1 0 344.242 3.616 20 5 EHBDRO CC[C@H]1c2ccsc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275027 1136129154 /nfs/dbraw/zinc/12/91/54/1136129154.db2.gz FOMIBXORJSPDOV-HOTGVXAUSA-N 1 0 332.425 3.699 20 5 EHBDRO CC(C)[C@H](C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776274503 1136129678 /nfs/dbraw/zinc/12/96/78/1136129678.db2.gz DMQNEWCOWRLMOS-OALUTQOASA-N 1 0 328.412 3.658 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000850312339 1136234104 /nfs/dbraw/zinc/23/41/04/1136234104.db2.gz JHYGVEYSHYOILR-GJZGRUSLSA-N 1 0 344.411 3.859 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@H](O)c1ccc(F)cc1 ZINC000850437083 1136258692 /nfs/dbraw/zinc/25/86/92/1136258692.db2.gz ZCJWUWGRTRDVRM-IUUKEHGRSA-N 1 0 348.374 3.515 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C[C@H](O)c1ccccc1 ZINC000850442017 1136259141 /nfs/dbraw/zinc/25/91/41/1136259141.db2.gz JRAKJLXVSXCYGZ-DEYYWGMASA-N 1 0 344.411 3.766 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@H](O)c1cccc(F)c1 ZINC000850444410 1136259872 /nfs/dbraw/zinc/25/98/72/1136259872.db2.gz JFUZKKSGQMVWSO-PZROIBLQSA-N 1 0 348.374 3.515 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000812854325 1136262684 /nfs/dbraw/zinc/26/26/84/1136262684.db2.gz XEZHGCFAYGZBHH-ACJLOTCBSA-N 1 0 332.375 3.678 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2COC3(CCC3)C2)c2ccccc2)c1 ZINC000850523822 1136277593 /nfs/dbraw/zinc/27/75/93/1136277593.db2.gz DCNYGJDPJQFVHV-HKUYNNGSSA-N 1 0 338.407 3.985 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H](O)c2ccccc21 ZINC000850528914 1136278994 /nfs/dbraw/zinc/27/89/94/1136278994.db2.gz OEBDOXVGDXKTLM-XVSDVWIESA-N 1 0 326.396 3.684 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850530501 1136280099 /nfs/dbraw/zinc/28/00/99/1136280099.db2.gz ZFAWPLCUODHMNX-ULFGMLNVSA-N 1 0 342.395 3.823 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@]12OCCC[C@H]1C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000850534080 1136281180 /nfs/dbraw/zinc/28/11/80/1136281180.db2.gz ILXFUVOJRBRIFP-OAGGEKHMSA-N 1 0 340.370 3.840 20 5 EHBDRO C[C@@]1(CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(F)F ZINC000850536714 1136281582 /nfs/dbraw/zinc/28/15/82/1136281582.db2.gz MRIFVLVIGFJMGA-MRXNPFEDSA-N 1 0 339.386 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)c(F)c1 ZINC000747840759 1136306973 /nfs/dbraw/zinc/30/69/73/1136306973.db2.gz SRKSQGUKILHNLQ-MOPGFXCFSA-N 1 0 344.386 3.822 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000852034816 1136428439 /nfs/dbraw/zinc/42/84/39/1136428439.db2.gz JFHDHUVTBJXUFX-QZTJIDSGSA-N 1 0 332.375 3.582 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)cc1 ZINC000776582460 1136442142 /nfs/dbraw/zinc/44/21/42/1136442142.db2.gz UQSAUXLICLMWSP-YLJYHZDGSA-N 1 0 340.423 3.898 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585016 1136442173 /nfs/dbraw/zinc/44/21/73/1136442173.db2.gz QXZCMFQLLSPSJU-MDYRTPRTSA-N 1 0 340.423 3.815 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](CC)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586084 1136445513 /nfs/dbraw/zinc/44/55/13/1136445513.db2.gz JLVZGAKNDBVMJS-AZUAARDMSA-N 1 0 342.439 3.971 20 5 EHBDRO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588187 1136446006 /nfs/dbraw/zinc/44/60/06/1136446006.db2.gz MDZFVILGWLIJNP-VMDGZTHMSA-N 1 0 344.386 3.850 20 5 EHBDRO Cc1cccc(C2([NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CCCC2)c1 ZINC000776593950 1136453999 /nfs/dbraw/zinc/45/39/99/1136453999.db2.gz YCCQKDPFGFAYTB-LJQANCHMSA-N 1 0 340.423 3.996 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1 ZINC000776604832 1136468707 /nfs/dbraw/zinc/46/87/07/1136468707.db2.gz HTUMYYUIKDLWTE-MRXNPFEDSA-N 1 0 332.787 3.561 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1 ZINC000776606697 1136470066 /nfs/dbraw/zinc/47/00/66/1136470066.db2.gz ZTJZILVGOGNCSL-KRWDZBQOSA-N 1 0 348.349 3.575 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H](C2CC[NH2+]CC2)C1 ZINC000853016141 1136498847 /nfs/dbraw/zinc/49/88/47/1136498847.db2.gz PKFDNZAROHOFGD-CQSZACIVSA-N 1 0 339.386 3.748 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]([NH+]2CCCC2)C1 ZINC000853185618 1136515352 /nfs/dbraw/zinc/51/53/52/1136515352.db2.gz IVGDLWRFNXRJPZ-CYBMUJFWSA-N 1 0 325.359 3.597 20 5 EHBDRO Cc1ccc(N2CCC([NH2+]Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000853656939 1136553410 /nfs/dbraw/zinc/55/34/10/1136553410.db2.gz HIBJXYOGYHWZOS-UHFFFAOYSA-N 1 0 325.412 3.662 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570429 1136612691 /nfs/dbraw/zinc/61/26/91/1136612691.db2.gz BYWRHEMVCQRLIT-CYBMUJFWSA-N 1 0 336.395 3.619 20 5 EHBDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815589946 1136615946 /nfs/dbraw/zinc/61/59/46/1136615946.db2.gz HXLYDEHLGDMNFE-AXHNFQJDSA-N 1 0 341.411 3.605 20 5 EHBDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815589948 1136616056 /nfs/dbraw/zinc/61/60/56/1136616056.db2.gz HXLYDEHLGDMNFE-IYJAJMOOSA-N 1 0 341.411 3.605 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000776815345 1136698866 /nfs/dbraw/zinc/69/88/66/1136698866.db2.gz IXQRXLGKHCJNRX-BZNIZROVSA-N 1 0 343.408 3.589 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000776820372 1136701664 /nfs/dbraw/zinc/70/16/64/1136701664.db2.gz DKWGQXSDSUCMPO-FMKPAKJESA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818985129 1136897345 /nfs/dbraw/zinc/89/73/45/1136897345.db2.gz OUWANCBLAVRVKU-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCCCCc2ccccc2)cc1 ZINC000819011695 1136899705 /nfs/dbraw/zinc/89/97/05/1136899705.db2.gz WMCROLQICYYGPH-IBGZPJMESA-N 1 0 328.412 3.631 20 5 EHBDRO CCCOc1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000819258297 1136929437 /nfs/dbraw/zinc/92/94/37/1136929437.db2.gz IXAAKBXMCDYRNK-IBGZPJMESA-N 1 0 344.411 3.515 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)nc1 ZINC000858488370 1136972428 /nfs/dbraw/zinc/97/24/28/1136972428.db2.gz RQOKCXAKFPSZBO-CYBMUJFWSA-N 1 0 328.416 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCCC34CC4)CC2)cc1 ZINC000858594657 1136981479 /nfs/dbraw/zinc/98/14/79/1136981479.db2.gz RNKGBZYXBVZOOY-HNNXBMFYSA-N 1 0 329.444 3.734 20 5 EHBDRO C[C@H]([NH2+]CCC1CN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000859318140 1137011322 /nfs/dbraw/zinc/01/13/22/1137011322.db2.gz CJIVNWJRGCLISF-ZDUSSCGKSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000844255979 1137208316 /nfs/dbraw/zinc/20/83/16/1137208316.db2.gz UTSJGJGGZPBURE-CQSZACIVSA-N 1 0 339.395 3.543 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3nc(Cl)ccc3[N+](=O)[O-])c2c1 ZINC001171168155 1137278619 /nfs/dbraw/zinc/27/86/19/1137278619.db2.gz KJVWOKRGMLLQOM-NSHDSACASA-N 1 0 344.802 3.785 20 5 EHBDRO Cc1c(Cl)cccc1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000865702993 1137305266 /nfs/dbraw/zinc/30/52/66/1137305266.db2.gz IOOQCJIAXMRBBW-QGZVFWFLSA-N 1 0 334.803 3.554 20 5 EHBDRO CCOCOc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000865788096 1137311967 /nfs/dbraw/zinc/31/19/67/1137311967.db2.gz YPLDEELMLYRCNO-UHFFFAOYSA-N 1 0 330.384 3.566 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@](C)(O)c1ccccc1 ZINC000846035341 1137328460 /nfs/dbraw/zinc/32/84/60/1137328460.db2.gz GSQXXGWVKYLMJJ-SJCJKPOMSA-N 1 0 334.803 3.634 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC000866244771 1137338628 /nfs/dbraw/zinc/33/86/28/1137338628.db2.gz UIYRJBRZOJEVMI-OLZOCXBDSA-N 1 0 332.375 3.508 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])sc1C ZINC000866286719 1137342862 /nfs/dbraw/zinc/34/28/62/1137342862.db2.gz CICMTEOVQWBZDU-JTQLQIEISA-N 1 0 337.420 3.571 20 5 EHBDRO CCOCCC1(C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCC1 ZINC000866305706 1137344058 /nfs/dbraw/zinc/34/40/58/1137344058.db2.gz KIFBXDVNTRGXSD-CQSZACIVSA-N 1 0 338.423 3.851 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000773121154 1137466834 /nfs/dbraw/zinc/46/68/34/1137466834.db2.gz UTQRTHGHUOHTPB-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12 ZINC000773133449 1137467415 /nfs/dbraw/zinc/46/74/15/1137467415.db2.gz FYEGVYSDFQPWHP-SRMUXQRQSA-N 1 0 338.498 3.933 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1OC ZINC000872017162 1137564761 /nfs/dbraw/zinc/56/47/61/1137564761.db2.gz VPCAWVSRPBJJPS-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]2CCCC[C@@H]12 ZINC000872022239 1137565235 /nfs/dbraw/zinc/56/52/35/1137565235.db2.gz IHPGXFXMNTWRCD-MAZHCROVSA-N 1 0 335.473 3.594 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000872024721 1137565514 /nfs/dbraw/zinc/56/55/14/1137565514.db2.gz DMSVBAHCYGUJDE-BFHYXJOUSA-N 1 0 335.473 3.594 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000872024723 1137565593 /nfs/dbraw/zinc/56/55/93/1137565593.db2.gz DMSVBAHCYGUJDE-MELADBBJSA-N 1 0 335.473 3.594 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1OCCc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872046289 1137567478 /nfs/dbraw/zinc/56/74/78/1137567478.db2.gz WDSIRNRBANZDAJ-YVEFUNNKSA-N 1 0 330.359 3.699 20 5 EHBDRO C[C@@H](Nc1cccc(OCC[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872059932 1137568725 /nfs/dbraw/zinc/56/87/25/1137568725.db2.gz LRRYGYZQFUTSSI-CYBMUJFWSA-N 1 0 347.390 3.847 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCOC1 ZINC000872065718 1137569244 /nfs/dbraw/zinc/56/92/44/1137569244.db2.gz AIQIVWMAACTFSS-WFASDCNBSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(CO)C[C@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072663 1137569786 /nfs/dbraw/zinc/56/97/86/1137569786.db2.gz IGAYLCFMPULGMC-RFUYNDQBSA-N 1 0 344.386 3.551 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075566 1137570042 /nfs/dbraw/zinc/57/00/42/1137570042.db2.gz DUPCUFBTPUFACD-DXCKQFNASA-N 1 0 345.374 3.700 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872082842 1137570265 /nfs/dbraw/zinc/57/02/65/1137570265.db2.gz BZMZTVNTPDFLRM-LXIYXOSZSA-N 1 0 332.375 3.681 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cnccc1C ZINC000872084685 1137570405 /nfs/dbraw/zinc/57/04/05/1137570405.db2.gz KBSXBKWCGGLCMS-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO C[C@H](CC(=O)N(C)c1ccccc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129786 1137573040 /nfs/dbraw/zinc/57/30/40/1137573040.db2.gz TZLRSULDVHQSIH-CABCVRRESA-N 1 0 341.411 3.687 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129845 1137573089 /nfs/dbraw/zinc/57/30/89/1137573089.db2.gz YXPGREOAGBOLEB-OLZOCXBDSA-N 1 0 345.374 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000872217494 1137575909 /nfs/dbraw/zinc/57/59/09/1137575909.db2.gz XVXVEMVQCJFRBD-QRVBRYPASA-N 1 0 326.396 3.554 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)C[C@@H](O)c1cccs1 ZINC000873097861 1137590226 /nfs/dbraw/zinc/59/02/26/1137590226.db2.gz XLCCLHSIMPFHOF-BLLLJJGKSA-N 1 0 334.441 3.875 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000873108510 1137590298 /nfs/dbraw/zinc/59/02/98/1137590298.db2.gz YUCJKMHMXSZBDS-PKOBYXMFSA-N 1 0 326.396 3.913 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873132792 1137590975 /nfs/dbraw/zinc/59/09/75/1137590975.db2.gz GNFFYZWNRIXGFQ-MRXNPFEDSA-N 1 0 342.395 3.834 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000125441020 1137634507 /nfs/dbraw/zinc/63/45/07/1137634507.db2.gz PIXRFKBFQPJWCE-OALUTQOASA-N 1 0 344.411 3.768 20 5 EHBDRO Cc1c(NC(=O)NCCC2CC[NH+](C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000876031186 1137642421 /nfs/dbraw/zinc/64/24/21/1137642421.db2.gz GKYBFVMXYJLSOK-UHFFFAOYSA-N 1 0 348.447 3.535 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(Cl)s1 ZINC000877035754 1137668197 /nfs/dbraw/zinc/66/81/97/1137668197.db2.gz JSEGUAMKJWUDFX-CBINBANVSA-N 1 0 340.836 3.951 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C(C3CCCC3)C3CCCC3)C2)c1 ZINC000877045426 1137668523 /nfs/dbraw/zinc/66/85/23/1137668523.db2.gz CFOSYTGHBXVESL-UHFFFAOYSA-N 1 0 332.448 3.833 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2nc(Cl)cs2)cc1 ZINC000877070165 1137669457 /nfs/dbraw/zinc/66/94/57/1137669457.db2.gz SRJLXWBWYZSFMG-UHFFFAOYSA-N 1 0 325.821 3.817 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000877557367 1137681064 /nfs/dbraw/zinc/68/10/64/1137681064.db2.gz LCOLIIUWMBLGGM-GPAUDHNESA-N 1 0 328.349 3.968 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC2(CCOCC2)[C@H]1C1CC1 ZINC000877553515 1137681071 /nfs/dbraw/zinc/68/10/71/1137681071.db2.gz UPJCMYMJBBAWMB-GOSISDBHSA-N 1 0 330.428 3.603 20 5 EHBDRO CN1Cc2ccccc2[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000877733742 1137687253 /nfs/dbraw/zinc/68/72/53/1137687253.db2.gz YMRRMPQAAYCVJP-KRWDZBQOSA-N 1 0 331.803 3.525 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351736 1137712117 /nfs/dbraw/zinc/71/21/17/1137712117.db2.gz YYYORIHGIMNKLG-RYUDHWBXSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690529 1137755322 /nfs/dbraw/zinc/75/53/22/1137755322.db2.gz XVTKUSFISZLCQM-HOCLYGCPSA-N 1 0 338.411 3.535 20 5 EHBDRO C[C@H]1c2sccc2CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376968 1137777026 /nfs/dbraw/zinc/77/70/26/1137777026.db2.gz NBDHJYBJCBLCOW-LBPRGKRZSA-N 1 0 345.424 3.604 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1ccnc(F)c1[N+](=O)[O-] ZINC000881775579 1137815395 /nfs/dbraw/zinc/81/53/95/1137815395.db2.gz WSTRFAFDJYFSLO-UHFFFAOYSA-N 1 0 332.379 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccns1 ZINC000883247947 1137850437 /nfs/dbraw/zinc/85/04/37/1137850437.db2.gz CFSGKFRWJPNAGA-BBRMVZONSA-N 1 0 331.441 3.595 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2CCC3(CCOCC3)CO2)cccc1[N+](=O)[O-] ZINC000883261781 1137851136 /nfs/dbraw/zinc/85/11/36/1137851136.db2.gz MNCJKUHMSKMGNO-JKSUJKDBSA-N 1 0 348.443 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1CCC2(CCOCC2)CO1 ZINC000883261937 1137851189 /nfs/dbraw/zinc/85/11/89/1137851189.db2.gz QZWPAAGTDCBBGM-DOTOQJQBSA-N 1 0 348.443 3.530 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2c3ccccc3NC2(C)C)cc1[N+](=O)[O-] ZINC000883462859 1137861128 /nfs/dbraw/zinc/86/11/28/1137861128.db2.gz BQQVXAOWKYFXHI-KRWDZBQOSA-N 1 0 327.384 3.638 20 5 EHBDRO Cc1nc(C)c([C@@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000106876526 1137884866 /nfs/dbraw/zinc/88/48/66/1137884866.db2.gz FYLJRFXMKUTUMQ-GFCCVEGCSA-N 1 0 335.429 3.740 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000332200169 1137935361 /nfs/dbraw/zinc/93/53/61/1137935361.db2.gz BYDUUWRGQKTCHK-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO C[NH+](C)C[C@@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915562 1137952024 /nfs/dbraw/zinc/95/20/24/1137952024.db2.gz VKQITJVTLWLCER-QGZVFWFLSA-N 1 0 333.819 3.641 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)c1ccc(Cl)cc1)C1CC1 ZINC000135226348 1137964754 /nfs/dbraw/zinc/96/47/54/1137964754.db2.gz FNCXHPUHIQDXAF-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO Cc1[nH]c(C2CCN(c3cc(Cl)ccc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000884707014 1137969802 /nfs/dbraw/zinc/96/98/02/1137969802.db2.gz VVBLNTLUCOUBEZ-UHFFFAOYSA-N 1 0 334.807 3.972 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000090666168 1138212912 /nfs/dbraw/zinc/21/29/12/1138212912.db2.gz VLAUDBPEESMKJN-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758834 1138421268 /nfs/dbraw/zinc/42/12/68/1138421268.db2.gz VOSRONDVTTYQQS-LRDDRELGSA-N 1 0 334.807 3.528 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OCC3CC3)nc2)cc1[N+](=O)[O-] ZINC000131322466 1138509888 /nfs/dbraw/zinc/50/98/88/1138509888.db2.gz DWUQBQNVXPPAPZ-AWEZNQCLSA-N 1 0 341.411 3.938 20 5 EHBDRO CC1=C(c2ccco2)CN(Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CC1 ZINC000338357935 1138852269 /nfs/dbraw/zinc/85/22/69/1138852269.db2.gz PFPJDIWSWKBHRQ-UHFFFAOYSA-N 1 0 338.367 3.744 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c(-c2cnn(C)c2)c1 ZINC000338428464 1138909722 /nfs/dbraw/zinc/90/97/22/1138909722.db2.gz DCIIYQKQHDBYHL-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283034158 1138942594 /nfs/dbraw/zinc/94/25/94/1138942594.db2.gz HVISBOMKWSLRIK-LLVKDONJSA-N 1 0 334.395 3.845 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)cc1 ZINC000174645700 1139432483 /nfs/dbraw/zinc/43/24/83/1139432483.db2.gz XAFDMELVUPRBCF-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH+](Cc2cccs2)Cc2cccs2)c1 ZINC000174812021 1139443458 /nfs/dbraw/zinc/44/34/58/1139443458.db2.gz HTNYEVOQDANTRR-UHFFFAOYSA-N 1 0 348.453 3.617 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316147 1139576531 /nfs/dbraw/zinc/57/65/31/1139576531.db2.gz RSGAYGHEGXUSJG-WMLDXEAASA-N 1 0 334.416 3.711 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000178729395 1139715139 /nfs/dbraw/zinc/71/51/39/1139715139.db2.gz BDTZEATYPQUAIP-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1csc([N+](=O)[O-])c1 ZINC000178818323 1139719267 /nfs/dbraw/zinc/71/92/67/1139719267.db2.gz VVZYQEJCWKOZEO-UHFFFAOYSA-N 1 0 345.424 3.813 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1O ZINC000182747610 1139989736 /nfs/dbraw/zinc/98/97/36/1139989736.db2.gz JMRRIISHKBMBTK-CYBMUJFWSA-N 1 0 330.384 3.810 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000183229633 1140022598 /nfs/dbraw/zinc/02/25/98/1140022598.db2.gz LADHCOQOQBCUBU-OLUCIUBSSA-N 1 0 346.427 3.602 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000183229689 1140022855 /nfs/dbraw/zinc/02/28/55/1140022855.db2.gz LADHCOQOQBCUBU-ZUXXIDCJSA-N 1 0 346.427 3.602 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000191358783 1140458361 /nfs/dbraw/zinc/45/83/61/1140458361.db2.gz QCTOHYTWOFEJFZ-OAHLLOKOSA-N 1 0 348.447 3.550 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000192024842 1140497592 /nfs/dbraw/zinc/49/75/92/1140497592.db2.gz JPDQFSMCKZKDQM-WBVHZDCISA-N 1 0 332.787 3.868 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000192592576 1140539450 /nfs/dbraw/zinc/53/94/50/1140539450.db2.gz KMJXAOROBILUAP-KRWDZBQOSA-N 1 0 342.395 3.779 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1cc(N)ccc1[N+](=O)[O-] ZINC000192768093 1140549385 /nfs/dbraw/zinc/54/93/85/1140549385.db2.gz ABWZHGGTTXLGPI-UHFFFAOYSA-N 1 0 328.416 3.631 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672667 1141134327 /nfs/dbraw/zinc/13/43/27/1141134327.db2.gz RKPNDQBAFOYLGJ-RVKKMQEKSA-N 1 0 329.444 3.605 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684241 1141135589 /nfs/dbraw/zinc/13/55/89/1141135589.db2.gz SHZCKIMIUIZJOO-ROUUACIJSA-N 1 0 330.359 3.604 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000270680339 1141255702 /nfs/dbraw/zinc/25/57/02/1141255702.db2.gz YJBOWCWPIHSVPM-SNUQEOBHSA-N 1 0 332.375 3.897 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891852 1141280441 /nfs/dbraw/zinc/28/04/41/1141280441.db2.gz PGJQAJVQSXMVLO-JSGCOSHPSA-N 1 0 341.415 3.531 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891854 1141280811 /nfs/dbraw/zinc/28/08/11/1141280811.db2.gz PGJQAJVQSXMVLO-TZMCWYRMSA-N 1 0 341.415 3.531 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CCOC2(CCC2)C1)C1CC1 ZINC000271450922 1141370196 /nfs/dbraw/zinc/37/01/96/1141370196.db2.gz DOOFBAJWBPHQJA-DLBZAZTESA-N 1 0 330.428 3.607 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000271548369 1141394602 /nfs/dbraw/zinc/39/46/02/1141394602.db2.gz LXOIEWHQHCRWNL-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000271563633 1141398864 /nfs/dbraw/zinc/39/88/64/1141398864.db2.gz OVAYCZZXRTYRLV-CBZIJGRNSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137753 1141506846 /nfs/dbraw/zinc/50/68/46/1141506846.db2.gz GBVYMPDFSRTHBX-DGCLKSJQSA-N 1 0 346.349 3.739 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000283074742 1141547763 /nfs/dbraw/zinc/54/77/63/1141547763.db2.gz KIDNLCPHMPFKIR-GOSISDBHSA-N 1 0 330.359 3.983 20 5 EHBDRO CN(CCC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccco1 ZINC000348819054 1141587262 /nfs/dbraw/zinc/58/72/62/1141587262.db2.gz VRAGQUXJJOLYPR-WEVVVXLNSA-N 1 0 343.427 3.655 20 5 EHBDRO Cc1cccc(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000071948907 203154420 /nfs/dbraw/zinc/15/44/20/203154420.db2.gz YTFOGTVVMGOEMQ-UHFFFAOYSA-N 1 0 339.439 3.576 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000154003190 1014784909 /nfs/dbraw/zinc/78/49/09/1014784909.db2.gz IPFUPSPVWIYIQV-SNVBAGLBSA-N 1 0 335.429 3.918 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000154248200 1015297274 /nfs/dbraw/zinc/29/72/74/1015297274.db2.gz WEUKBRRQZFRVIZ-GFCCVEGCSA-N 1 0 349.818 3.935 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2nc(C)c(C)s2)cc1[N+](=O)[O-] ZINC000154273672 1015332252 /nfs/dbraw/zinc/33/22/52/1015332252.db2.gz OEPWESVEXVTANA-LBPRGKRZSA-N 1 0 349.456 3.960 20 5 EHBDRO Cc1cnc(CC[N@@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)s1 ZINC000157732856 1015410621 /nfs/dbraw/zinc/41/06/21/1015410621.db2.gz AZZUUEFWZSNQQO-UHFFFAOYSA-N 1 0 349.456 3.821 20 5 EHBDRO Cc1cc(C)c(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000154970000 1016007127 /nfs/dbraw/zinc/00/71/27/1016007127.db2.gz BRIMWDWSDJHQDZ-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO COc1ccc(CCC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449085181 1032141847 /nfs/dbraw/zinc/14/18/47/1032141847.db2.gz KYIUUMMFQBPOIL-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2nc(C)ccc2c1 ZINC000189319621 1016504787 /nfs/dbraw/zinc/50/47/87/1016504787.db2.gz PHAJZVJWIZKQTJ-UHFFFAOYSA-N 1 0 337.379 3.750 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000181520244 1017020977 /nfs/dbraw/zinc/02/09/77/1017020977.db2.gz VWSBSWCPKBGUDX-HUUCEWRRSA-N 1 0 341.411 3.705 20 5 EHBDRO Cc1cccc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)c1[N+](=O)[O-] ZINC000904627843 1032166766 /nfs/dbraw/zinc/16/67/66/1032166766.db2.gz WFNDWXKCXVFUEP-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCc1nc2ccccc2[nH]1 ZINC000449103419 1032181971 /nfs/dbraw/zinc/18/19/71/1032181971.db2.gz QFMIAMJIVMDBDK-AWEZNQCLSA-N 1 0 338.411 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3[NH2+]CC[C@@H]4CCCC[C@H]34)n2)s1 ZINC000904689498 1032183650 /nfs/dbraw/zinc/18/36/50/1032183650.db2.gz KGNKJMSUAAVPIG-OUJBWJOFSA-N 1 0 334.401 3.547 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449167725 1032260346 /nfs/dbraw/zinc/26/03/46/1032260346.db2.gz KRMHVVMNSBNSJY-ZDUSSCGKSA-N 1 0 336.313 3.832 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000449161613 1032274780 /nfs/dbraw/zinc/27/47/80/1032274780.db2.gz GBQCVBCWWUFKEI-VIFPVBQESA-N 1 0 345.346 3.791 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000449191547 1032284708 /nfs/dbraw/zinc/28/47/08/1032284708.db2.gz PHYZCUYVESSIGM-NVXWUHKLSA-N 1 0 332.444 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC4(C3)CCOCC4)s2)cc1 ZINC000459623276 1032336076 /nfs/dbraw/zinc/33/60/76/1032336076.db2.gz RHCUYBOTTKDHFH-UHFFFAOYSA-N 1 0 344.436 3.936 20 5 EHBDRO Cc1ccc2c(c1)nc(C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])n2C ZINC000449247100 1032385491 /nfs/dbraw/zinc/38/54/91/1032385491.db2.gz FDNJBGYMOUDFOY-AWEZNQCLSA-N 1 0 338.411 3.511 20 5 EHBDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449316676 1032448590 /nfs/dbraw/zinc/44/85/90/1032448590.db2.gz ZWWHSAWWOKHUNZ-PXAZEXFGSA-N 1 0 344.386 3.951 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449349567 1032464651 /nfs/dbraw/zinc/46/46/51/1032464651.db2.gz QXXPEUZVUWCBGW-STQMWFEESA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@]1(C)OCCc2sccc21 ZINC000449337003 1032474525 /nfs/dbraw/zinc/47/45/25/1032474525.db2.gz OXJRHSNZMJOWGV-ACJLOTCBSA-N 1 0 346.452 3.665 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000537014624 1032483658 /nfs/dbraw/zinc/48/36/58/1032483658.db2.gz VFNCYAWIBSPFGG-GOSISDBHSA-N 1 0 330.359 3.854 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](CO)c1ccccc1 ZINC000449460827 1032577289 /nfs/dbraw/zinc/57/72/89/1032577289.db2.gz ZYNGXDJNWKVRJB-FERCGXDMSA-N 1 0 326.396 3.664 20 5 EHBDRO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090771178 1032594225 /nfs/dbraw/zinc/59/42/25/1032594225.db2.gz PYWXQVHFQFZKOP-KSSFIOAISA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H]2CCCC2(F)F)c1 ZINC000449497342 1032667902 /nfs/dbraw/zinc/66/79/02/1032667902.db2.gz QXQJSYBXQLRCKF-SNVBAGLBSA-N 1 0 336.285 3.721 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@]1(CO)C[C@H]1c1ccccc1 ZINC000289927277 1032676847 /nfs/dbraw/zinc/67/68/47/1032676847.db2.gz SRCUMVJZGINAQJ-WMZOPIPTSA-N 1 0 346.814 3.504 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449503708 1032686109 /nfs/dbraw/zinc/68/61/09/1032686109.db2.gz POYAAWOOLDDRTH-DYVFJYSZSA-N 1 0 330.384 3.712 20 5 EHBDRO CCc1ccccc1[C@H]([NH3+])CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000415061805 1017492035 /nfs/dbraw/zinc/49/20/35/1017492035.db2.gz DOEWSTDRDXOSOI-QGZVFWFLSA-N 1 0 333.819 3.600 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCOC3)C2)o1 ZINC000377237749 1017514289 /nfs/dbraw/zinc/51/42/89/1017514289.db2.gz JFZQRUOEUOTLIW-HUUCEWRRSA-N 1 0 342.395 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@]1(CO)C[C@@H]1c1ccccc1 ZINC000289927275 1032716777 /nfs/dbraw/zinc/71/67/77/1032716777.db2.gz SRCUMVJZGINAQJ-SJLPKXTDSA-N 1 0 346.814 3.504 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000155454307 1017726616 /nfs/dbraw/zinc/72/66/16/1017726616.db2.gz ZPFITNNZMISURD-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544021 1032735656 /nfs/dbraw/zinc/73/56/56/1032735656.db2.gz VAWJUWVJTBOIIH-WMLDXEAASA-N 1 0 347.802 3.653 20 5 EHBDRO CC[C@@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610345618 1018360028 /nfs/dbraw/zinc/36/00/28/1018360028.db2.gz ICCAWGSJZNPUML-ZFWWWQNUSA-N 1 0 332.400 3.742 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000548066709 1018720021 /nfs/dbraw/zinc/72/00/21/1018720021.db2.gz FRRBELXVNQIJCF-LJQANCHMSA-N 1 0 326.396 3.887 20 5 EHBDRO O=C(CC[NH+]1CCC(C2CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000610393481 1018745646 /nfs/dbraw/zinc/74/56/46/1018745646.db2.gz XUGXBDFVKLGCGX-UHFFFAOYSA-N 1 0 345.443 3.826 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc4cccnc4n3)CC2)cc1 ZINC000594019481 1032793394 /nfs/dbraw/zinc/79/33/94/1032793394.db2.gz MUDOKXUFAKJRHP-UHFFFAOYSA-N 1 0 348.406 3.918 20 5 EHBDRO O=C(c1ccccc1)C1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000052412035 1018934567 /nfs/dbraw/zinc/93/45/67/1018934567.db2.gz UPRCLOQSJCGSGF-UHFFFAOYSA-N 1 0 338.407 3.732 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000255495203 1019248526 /nfs/dbraw/zinc/24/85/26/1019248526.db2.gz BIQNSRBUGIDAHR-VORVDVFJSA-N 1 0 338.407 3.590 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412990 1019643604 /nfs/dbraw/zinc/64/36/04/1019643604.db2.gz FQJGSDCNOXFQJS-KRZKXXONSA-N 1 0 348.406 3.905 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803343 1019747925 /nfs/dbraw/zinc/74/79/25/1019747925.db2.gz DFVPQKYQLNKJSS-SJORKVTESA-N 1 0 331.460 3.915 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c1[N+](=O)[O-] ZINC000894231464 1019828219 /nfs/dbraw/zinc/82/82/19/1019828219.db2.gz NQRFJEHJEWXOSN-SHTZXODSSA-N 1 0 342.395 3.653 20 5 EHBDRO C[C@H]1CC[C@@H]([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922883 1020243494 /nfs/dbraw/zinc/24/34/94/1020243494.db2.gz GDFGLRSNFKFCJM-LSDHHAIUSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@H]1C[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000602476365 1032897283 /nfs/dbraw/zinc/89/72/83/1032897283.db2.gz OLGYSPIGJQYKQT-FZMZJTMJSA-N 1 0 345.365 3.528 20 5 EHBDRO CCOC[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602467017 1032903214 /nfs/dbraw/zinc/90/32/14/1032903214.db2.gz CKYQHVQUDZVJQF-GFCCVEGCSA-N 1 0 346.349 3.862 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651992 1020567349 /nfs/dbraw/zinc/56/73/49/1020567349.db2.gz ZGZXJYCHAWXCHH-GOSISDBHSA-N 1 0 345.399 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)c(Cl)c1 ZINC000449616880 1032936264 /nfs/dbraw/zinc/93/62/64/1032936264.db2.gz SCKMLIRJNLWANY-CXAGYDPISA-N 1 0 347.802 3.653 20 5 EHBDRO CCOC(CCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12)OCC ZINC000276206971 1020898779 /nfs/dbraw/zinc/89/87/79/1020898779.db2.gz KQCKUQVEBMTTEK-UHFFFAOYSA-N 1 0 333.388 3.653 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])s1)[NH+]1CCCC1 ZINC000610514191 1021151665 /nfs/dbraw/zinc/15/16/65/1021151665.db2.gz KIQVVOAWNLKDPP-CQSZACIVSA-N 1 0 347.440 3.914 20 5 EHBDRO Cc1csc(CCCC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)n1 ZINC000602534349 1032967097 /nfs/dbraw/zinc/96/70/97/1032967097.db2.gz TXKBQENFBIWKJX-UHFFFAOYSA-N 1 0 346.412 3.613 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[N@H+](Cc3ccc(F)cc3)CC2)cs1 ZINC000054173354 1021294045 /nfs/dbraw/zinc/29/40/45/1021294045.db2.gz QLZOBBWINYIHSE-UHFFFAOYSA-N 1 0 349.431 3.503 20 5 EHBDRO Cc1ccccc1O[C@H](C)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602559064 1032973548 /nfs/dbraw/zinc/97/35/48/1032973548.db2.gz SRYMAVKUSIHQFF-CYBMUJFWSA-N 1 0 341.367 3.602 20 5 EHBDRO CC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCOCC1 ZINC000602563543 1032975119 /nfs/dbraw/zinc/97/51/19/1032975119.db2.gz MFTPWVXBVAOCGP-UHFFFAOYSA-N 1 0 332.322 3.520 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000322943097 1021474758 /nfs/dbraw/zinc/47/47/58/1021474758.db2.gz MUOVGBZQCTTXOG-SRCQZFHVSA-N 1 0 338.835 3.764 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(C)(C)O ZINC000550294934 1021477895 /nfs/dbraw/zinc/47/78/95/1021477895.db2.gz GSNBXDNUAFAJSX-MRXNPFEDSA-N 1 0 334.441 3.962 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000506046362 1021812423 /nfs/dbraw/zinc/81/24/23/1021812423.db2.gz VNRZPTZISIUMHT-UHFFFAOYSA-N 1 0 328.368 3.654 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920828 1021819419 /nfs/dbraw/zinc/81/94/19/1021819419.db2.gz BWEJWJDXYGWFEP-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610538626 1021820482 /nfs/dbraw/zinc/82/04/82/1021820482.db2.gz YBKGZFPMCCXXRY-BEFAXECRSA-N 1 0 336.395 3.883 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516937612 1021873275 /nfs/dbraw/zinc/87/32/75/1021873275.db2.gz LUAWFUIYGPBPEM-XJKSGUPXSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCc2cccc(C[NH+]3CCCC3)c2)n1 ZINC000178167905 1021895597 /nfs/dbraw/zinc/89/55/97/1021895597.db2.gz ONVMRLPSWMMQIJ-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO COc1cccc2c1CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000426579134 1021967962 /nfs/dbraw/zinc/96/79/62/1021967962.db2.gz KNLYAZUUHCZSHE-YVMONPNESA-N 1 0 338.407 3.717 20 5 EHBDRO COc1cccc2c1CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])CC2 ZINC000426579133 1021968626 /nfs/dbraw/zinc/96/86/26/1021968626.db2.gz KNLYAZUUHCZSHE-VMPITWQZSA-N 1 0 338.407 3.717 20 5 EHBDRO C[C@@H](CC(F)(F)F)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602612449 1033027008 /nfs/dbraw/zinc/02/70/08/1033027008.db2.gz RSUHSXQZAKXTJK-YFKPBYRVSA-N 1 0 347.156 3.849 20 5 EHBDRO CC(C)[N@H+](Cc1cnn(C)c1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891626379 1022148120 /nfs/dbraw/zinc/14/81/20/1022148120.db2.gz XNDQEPPZRHMRKN-UHFFFAOYSA-N 1 0 328.416 3.616 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000517287582 1022214377 /nfs/dbraw/zinc/21/43/77/1022214377.db2.gz MSYJNNALQMBIPL-JKSUJKDBSA-N 1 0 345.399 3.563 20 5 EHBDRO C[C@@H]([NH2+]CC(C)(C)NC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000164102075 1022232309 /nfs/dbraw/zinc/23/23/09/1022232309.db2.gz CXLVQXGXGCMAEL-GFCCVEGCSA-N 1 0 337.420 3.549 20 5 EHBDRO COc1cccc2c1CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000425934806 1022267881 /nfs/dbraw/zinc/26/78/81/1022267881.db2.gz ATWQDPNNCCLJTF-XJKSGUPXSA-N 1 0 326.396 3.812 20 5 EHBDRO CCc1ccc([C@H](NC[C@@H](C)C[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000425941603 1022324728 /nfs/dbraw/zinc/32/47/28/1022324728.db2.gz CBYDUJPNXICIAY-AUUYWEPGSA-N 1 0 345.443 3.627 20 5 EHBDRO COc1ccc(C[N@H+](C)CC2(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000438252014 1022504891 /nfs/dbraw/zinc/50/48/91/1022504891.db2.gz BEIHGJURLWTNHO-UHFFFAOYSA-N 1 0 326.396 3.767 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+](C)C1CCCCC1 ZINC000517632150 1022510229 /nfs/dbraw/zinc/51/02/29/1022510229.db2.gz VWVVJZDGSWEXMV-UHFFFAOYSA-N 1 0 348.447 3.543 20 5 EHBDRO Cc1cc(Cl)cc(C)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425986513 1022580061 /nfs/dbraw/zinc/58/00/61/1022580061.db2.gz WHCBEBMHPUWRDF-UHFFFAOYSA-N 1 0 348.834 3.899 20 5 EHBDRO C[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989792 1022591790 /nfs/dbraw/zinc/59/17/90/1022591790.db2.gz UPMAWLYMMKCBOQ-TZMCWYRMSA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1ccccc1[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441440471 1022802606 /nfs/dbraw/zinc/80/26/06/1022802606.db2.gz QFFDFVFOIBGWQN-JXFKEZNVSA-N 1 0 340.423 3.908 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000894737638 1022817509 /nfs/dbraw/zinc/81/75/09/1022817509.db2.gz AYOCSIRDIZWTCN-WBVHZDCISA-N 1 0 347.802 3.653 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449717912 1033093957 /nfs/dbraw/zinc/09/39/57/1033093957.db2.gz FIKUEQYMCJRHHQ-HOCLYGCPSA-N 1 0 334.460 3.693 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000178366459 1023051774 /nfs/dbraw/zinc/05/17/74/1023051774.db2.gz KNENRMMANNDLNB-LBPRGKRZSA-N 1 0 345.365 3.581 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000165790044 1033102133 /nfs/dbraw/zinc/10/21/33/1033102133.db2.gz MEIGGUNSUAUMTD-GOSISDBHSA-N 1 0 345.443 3.886 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC000341741238 1023228872 /nfs/dbraw/zinc/22/88/72/1023228872.db2.gz JCOVTGJWMNHUJM-OAHLLOKOSA-N 1 0 334.807 3.613 20 5 EHBDRO COCc1ccccc1/C=C(/C)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000510871102 1023322916 /nfs/dbraw/zinc/32/29/16/1023322916.db2.gz DYFRYVFWZCYCKS-SSZFMOIBSA-N 1 0 340.423 3.977 20 5 EHBDRO CCC[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000610773963 1023495075 /nfs/dbraw/zinc/49/50/75/1023495075.db2.gz YWZYYXNQFOUNCE-MRXNPFEDSA-N 1 0 342.395 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](Cc3ccccc3)CC2)s1 ZINC000063255629 1033144143 /nfs/dbraw/zinc/14/41/43/1033144143.db2.gz SYYDHZQDDRLZPY-UHFFFAOYSA-N 1 0 331.441 3.980 20 5 EHBDRO CC[C@H]([NH2+][C@H]1COc2c(cccc2OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000610809843 1023701164 /nfs/dbraw/zinc/70/11/64/1023701164.db2.gz VNQRRPSWMYUKQS-WBVHZDCISA-N 1 0 342.395 3.648 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCOc3c(Cl)cccc32)cc1 ZINC000610811094 1023710532 /nfs/dbraw/zinc/71/05/32/1023710532.db2.gz VHZZRSHRZMFDNH-INIZCTEOSA-N 1 0 332.787 3.904 20 5 EHBDRO CCC1(CC)[C@H](OC)C[C@@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610845668 1023788157 /nfs/dbraw/zinc/78/81/57/1023788157.db2.gz DASJTARBDBJUOD-JKSUJKDBSA-N 1 0 347.415 3.762 20 5 EHBDRO CCOc1ccc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)nc1 ZINC000610865011 1023809880 /nfs/dbraw/zinc/80/98/80/1023809880.db2.gz HRJYBIBVZJYJCH-UHFFFAOYSA-N 1 0 327.384 3.553 20 5 EHBDRO CCN(Cc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000119467394 1024287656 /nfs/dbraw/zinc/28/76/56/1024287656.db2.gz MZKHQXOWBUIZSC-ZDUSSCGKSA-N 1 0 347.440 3.814 20 5 EHBDRO CO[C@@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488089 1024398307 /nfs/dbraw/zinc/39/83/07/1024398307.db2.gz OGJSXJXIYMCCTE-FZKQIMNGSA-N 1 0 332.375 3.908 20 5 EHBDRO Cn1cccc1[C@@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328656 1033208293 /nfs/dbraw/zinc/20/82/93/1033208293.db2.gz OJUDZPUOKTVGOI-SFHVURJKSA-N 1 0 329.400 3.539 20 5 EHBDRO Cc1cc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)ccc1Cl ZINC000507796906 1024424425 /nfs/dbraw/zinc/42/44/25/1024424425.db2.gz OJTRLODBPUKXIC-CQSZACIVSA-N 1 0 346.818 3.638 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)CC2 ZINC000485217492 1024471984 /nfs/dbraw/zinc/47/19/84/1024471984.db2.gz JKTJUYWQNPIPFN-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO CCOc1cccc(NC[C@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000346213331 1024504628 /nfs/dbraw/zinc/50/46/28/1024504628.db2.gz WPDDHEGIDCQJSE-OAHLLOKOSA-N 1 0 345.399 3.836 20 5 EHBDRO CN(CCOc1ccccc1Cl)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505581769 1024533346 /nfs/dbraw/zinc/53/33/46/1024533346.db2.gz MFAXZNFPXRCJKQ-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792086 1024654221 /nfs/dbraw/zinc/65/42/21/1024654221.db2.gz XTQLEUGSPOEJPM-JQHSSLGASA-N 1 0 336.407 3.640 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2cccc(OC)c2[N+](=O)[O-])c1 ZINC000185231197 1024654528 /nfs/dbraw/zinc/65/45/28/1024654528.db2.gz OGDHOXWYQWQBNI-UHFFFAOYSA-N 1 0 329.400 3.667 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)NCCC[N@@H+](C)C2CCCCC2)c1C ZINC000895625066 1024671907 /nfs/dbraw/zinc/67/19/07/1024671907.db2.gz CRPGRCMSGCXFFN-UHFFFAOYSA-N 1 0 347.459 3.596 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000427877715 1024842507 /nfs/dbraw/zinc/84/25/07/1024842507.db2.gz UFKSKLRBFPPHQM-QGZVFWFLSA-N 1 0 344.386 3.853 20 5 EHBDRO Cc1cc(N[C@H](CC[NH+](C)C)c2cccnc2)c(F)cc1[N+](=O)[O-] ZINC000895891528 1024947719 /nfs/dbraw/zinc/94/77/19/1024947719.db2.gz RIVKORPIZNEASV-OAHLLOKOSA-N 1 0 332.379 3.542 20 5 EHBDRO C[NH+](C)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000895892767 1024950102 /nfs/dbraw/zinc/95/01/02/1024950102.db2.gz RJBYCUNIRMGXDM-OAHLLOKOSA-N 1 0 334.807 3.748 20 5 EHBDRO COC1(OC)CC2(C[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)[C@@H]2C(C)C)C1 ZINC000895994871 1025062281 /nfs/dbraw/zinc/06/22/81/1025062281.db2.gz HKEPFCOXWGIQQG-QGZVFWFLSA-N 1 0 348.443 3.513 20 5 EHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1N1CCCC1 ZINC000015573715 1025076834 /nfs/dbraw/zinc/07/68/34/1025076834.db2.gz DKCOPURVCSVRDE-UHFFFAOYSA-N 1 0 325.412 3.827 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])nc2)CC1 ZINC000582086274 1025223660 /nfs/dbraw/zinc/22/36/60/1025223660.db2.gz PXQWLCWDDZVJBA-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119806612 1025246950 /nfs/dbraw/zinc/24/69/50/1025246950.db2.gz PSMXHSUJZIMJBU-CQSZACIVSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000346933793 1025326481 /nfs/dbraw/zinc/32/64/81/1025326481.db2.gz CHCUDDXEEFWGOF-QZTJIDSGSA-N 1 0 348.830 3.893 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)Cc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000521336732 1025331024 /nfs/dbraw/zinc/33/10/24/1025331024.db2.gz XDVUIUOLBDFWAS-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO Cc1cc(N2CCC(O)(C3CCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000896321911 1025337644 /nfs/dbraw/zinc/33/76/44/1025337644.db2.gz AJGORTXBDBNPST-UHFFFAOYSA-N 1 0 341.411 3.583 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@H](c3ccccc3)C2)n1 ZINC000436299186 1025564211 /nfs/dbraw/zinc/56/42/11/1025564211.db2.gz DXHVPPJNCAKQBQ-XLAORIBOSA-N 1 0 340.427 3.811 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)OC(C)C ZINC000185718431 1025689309 /nfs/dbraw/zinc/68/93/09/1025689309.db2.gz AMQASYDVRPXTNJ-LJQANCHMSA-N 1 0 344.411 3.859 20 5 EHBDRO CCC[N@H+](CC)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000472209568 1025749002 /nfs/dbraw/zinc/74/90/02/1025749002.db2.gz VDEJUEBLRZCHJD-UHFFFAOYSA-N 1 0 335.451 3.850 20 5 EHBDRO CC(=O)c1ccc(N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000439128817 1025786633 /nfs/dbraw/zinc/78/66/33/1025786633.db2.gz PKKNKPZHMUKKLE-DJJJIMSYSA-N 1 0 341.411 3.901 20 5 EHBDRO C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H](c1ccccc1)[NH+](C)C ZINC000439126866 1025787059 /nfs/dbraw/zinc/78/70/59/1025787059.db2.gz FXXNPQCHZPERPX-XHDPSFHLSA-N 1 0 334.807 3.747 20 5 EHBDRO CC(C)(CCC(=O)OCc1cccc(C[NH+]2CCCCC2)c1)[N+](=O)[O-] ZINC000840581582 1025860929 /nfs/dbraw/zinc/86/09/29/1025860929.db2.gz YUOHXQKNAASBBT-UHFFFAOYSA-N 1 0 348.443 3.551 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCC[C@H]1O ZINC000451412186 1025946040 /nfs/dbraw/zinc/94/60/40/1025946040.db2.gz FWFSNZZCDLBFFL-KZNAEPCWSA-N 1 0 348.443 3.507 20 5 EHBDRO CCC[N@H+](CC)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000516074594 1025955522 /nfs/dbraw/zinc/95/55/22/1025955522.db2.gz UADBDYRUEWRGAA-AWEZNQCLSA-N 1 0 333.354 3.520 20 5 EHBDRO CO[C@]1(C)C[C@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000451490102 1026034054 /nfs/dbraw/zinc/03/40/54/1026034054.db2.gz OLPHBNZNNAQIGH-MAUKXSAKSA-N 1 0 345.399 3.543 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516193390 1026101604 /nfs/dbraw/zinc/10/16/04/1026101604.db2.gz LEZCCSJLLVIQMG-MRXNPFEDSA-N 1 0 336.395 3.530 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1(C)C ZINC000451554871 1026107200 /nfs/dbraw/zinc/10/72/00/1026107200.db2.gz QLNOZRVZDCMHRB-QGZVFWFLSA-N 1 0 336.432 3.629 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000516208274 1026138311 /nfs/dbraw/zinc/13/83/11/1026138311.db2.gz LIYKCSUHLXPHJN-KRWDZBQOSA-N 1 0 332.375 3.681 20 5 EHBDRO Cc1cnc(C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000277595912 1026250523 /nfs/dbraw/zinc/25/05/23/1026250523.db2.gz XDTOHYFUDIVKBG-UHFFFAOYSA-N 1 0 331.441 3.782 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000339085553 1026384272 /nfs/dbraw/zinc/38/42/72/1026384272.db2.gz HDLJKLGXGVEXDQ-WDEREUQCSA-N 1 0 332.322 3.518 20 5 EHBDRO COc1cccc(N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1[N+](=O)[O-] ZINC000475351764 1026502216 /nfs/dbraw/zinc/50/22/16/1026502216.db2.gz MPHZCSYFJPFLSY-INIZCTEOSA-N 1 0 347.459 3.552 20 5 EHBDRO COc1cccc(C2(C[NH2+]C/C=C/c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000562074582 1026521858 /nfs/dbraw/zinc/52/18/58/1026521858.db2.gz PWHMCGICVMWBHX-FNORWQNLSA-N 1 0 338.407 3.938 20 5 EHBDRO COc1cc(C[NH2+]CC(C)(C)C2=CCCCC2)c([N+](=O)[O-])cc1O ZINC000479387556 1026615973 /nfs/dbraw/zinc/61/59/73/1026615973.db2.gz HOZLUXKPYOBVRF-UHFFFAOYSA-N 1 0 334.416 3.925 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580438 1026710468 /nfs/dbraw/zinc/71/04/68/1026710468.db2.gz QSSJEZJXFHXEJE-SFHVURJKSA-N 1 0 331.460 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)c(F)c1 ZINC000384257718 1026795372 /nfs/dbraw/zinc/79/53/72/1026795372.db2.gz BYZMHUIVZYGEIL-INIZCTEOSA-N 1 0 344.386 3.773 20 5 EHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237537603 1026836864 /nfs/dbraw/zinc/83/68/64/1026836864.db2.gz JBBUPGYHQQDVBY-GOEBONIOSA-N 1 0 342.443 3.911 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCc2c[nH]c3ccccc23)c(F)c1 ZINC000479957156 1026910405 /nfs/dbraw/zinc/91/04/05/1026910405.db2.gz HNWPWIMTSUKBBJ-UHFFFAOYSA-N 1 0 327.359 3.938 20 5 EHBDRO C[C@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178644044 1027232344 /nfs/dbraw/zinc/23/23/44/1027232344.db2.gz BTEZMEQFWFMUBX-INIZCTEOSA-N 1 0 340.423 3.994 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000186484626 1027374921 /nfs/dbraw/zinc/37/49/21/1027374921.db2.gz HCADGZHGBUQJAD-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO Cc1cc(N2CCC[C@]3(CC[NH2+]C3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000420251000 1027429555 /nfs/dbraw/zinc/42/95/55/1027429555.db2.gz KLNSZYDRMVHFPJ-OAHLLOKOSA-N 1 0 343.349 3.502 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)Nc1ncc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000413292035 1027453667 /nfs/dbraw/zinc/45/36/67/1027453667.db2.gz LFQKDRSSFBFVBL-LRDDRELGSA-N 1 0 332.379 3.541 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1Cc1ccccc1 ZINC000501868776 1027611040 /nfs/dbraw/zinc/61/10/40/1027611040.db2.gz FYEOYTXYTVMHAA-QGZVFWFLSA-N 1 0 326.396 3.681 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000513790217 1027840445 /nfs/dbraw/zinc/84/04/45/1027840445.db2.gz UIZNZUCXDAKBPF-APWZRJJASA-N 1 0 340.423 3.844 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@H]([NH+]3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000513732513 1027856541 /nfs/dbraw/zinc/85/65/41/1027856541.db2.gz GUGYUXGNYNPXDD-KRWDZBQOSA-N 1 0 331.460 3.778 20 5 EHBDRO CC[C@](C)(COc1ncccc1Cl)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000533534472 1028031327 /nfs/dbraw/zinc/03/13/27/1028031327.db2.gz RUZVIVCXNVUBIM-QGZVFWFLSA-N 1 0 349.818 3.981 20 5 EHBDRO CC(C)(C)Oc1cc(N2CCC[C@@H](c3ncc[nH]3)C2)ccc1[N+](=O)[O-] ZINC000091480156 1028074595 /nfs/dbraw/zinc/07/45/95/1028074595.db2.gz NUICALWUCNXIRI-CYBMUJFWSA-N 1 0 344.415 3.879 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178702047 1028121915 /nfs/dbraw/zinc/12/19/15/1028121915.db2.gz JZHKCVMIRSYDRO-KSSFIOAISA-N 1 0 330.432 3.867 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](CC(F)(F)F)C2)cc1 ZINC000444698570 1028174210 /nfs/dbraw/zinc/17/42/10/1028174210.db2.gz MFTJUKRWGFZRFA-GFCCVEGCSA-N 1 0 332.322 3.638 20 5 EHBDRO COC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCC1 ZINC000503932103 1028237795 /nfs/dbraw/zinc/23/77/95/1028237795.db2.gz STWAMVVIKHHRJC-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)CC34CCC4)o2)cc1 ZINC000421376088 1028337437 /nfs/dbraw/zinc/33/74/37/1028337437.db2.gz RDGHAOPTQZAEHM-MRXNPFEDSA-N 1 0 342.395 3.734 20 5 EHBDRO [NH3+][C@@H]1CCC[C@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374183 1028378060 /nfs/dbraw/zinc/37/80/60/1028378060.db2.gz HZADJUBNGGCULX-AOIWGVFYSA-N 1 0 325.412 3.544 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000423376551 1028397461 /nfs/dbraw/zinc/39/74/61/1028397461.db2.gz YFRBKQRDPVDEGO-UGSOOPFHSA-N 1 0 325.412 3.775 20 5 EHBDRO CCc1ccccc1[C@@H](N)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505220 1028469388 /nfs/dbraw/zinc/46/93/88/1028469388.db2.gz OCHUTDGQJMZGDA-KDOFPFPSSA-N 1 0 327.428 3.816 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000749694684 1028520405 /nfs/dbraw/zinc/52/04/05/1028520405.db2.gz XYQPBLYJLNIXMM-IAGOWNOFSA-N 1 0 332.787 3.559 20 5 EHBDRO C[C@@H](Nc1cccc(OCC[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000324839416 1028609476 /nfs/dbraw/zinc/60/94/76/1028609476.db2.gz HVWXSBFWWRJGNL-CQSZACIVSA-N 1 0 329.400 3.708 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCCC[C@@H]1C ZINC000052101536 1028812927 /nfs/dbraw/zinc/81/29/27/1028812927.db2.gz KQMWYBSRTFEJKY-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](C)C1(OC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000421877150 1028879094 /nfs/dbraw/zinc/87/90/94/1028879094.db2.gz LIOWBPMKMZCMMF-YOEHRIQHSA-N 1 0 336.432 3.610 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630564 1028925096 /nfs/dbraw/zinc/92/50/96/1028925096.db2.gz GVUDRGNISXPOED-OAHLLOKOSA-N 1 0 334.416 3.719 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895989 1029042450 /nfs/dbraw/zinc/04/24/50/1029042450.db2.gz WQJPLFVKAOLWEM-HZPDHXFCSA-N 1 0 349.475 3.765 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000504911961 1029055345 /nfs/dbraw/zinc/05/53/45/1029055345.db2.gz OGMJKCNTKWAKSB-HNNXBMFYSA-N 1 0 343.427 3.781 20 5 EHBDRO CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000524294194 1029056188 /nfs/dbraw/zinc/05/61/88/1029056188.db2.gz WUXQMIZEMZGFHH-UGSOOPFHSA-N 1 0 332.400 3.742 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCCCC1 ZINC000504925834 1029070636 /nfs/dbraw/zinc/07/06/36/1029070636.db2.gz FTHWKOQZBWPFQN-OAHLLOKOSA-N 1 0 337.489 3.541 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCN2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930043 1029075784 /nfs/dbraw/zinc/07/57/84/1029075784.db2.gz MYVRYQPXFWRVRA-HUUCEWRRSA-N 1 0 335.448 3.519 20 5 EHBDRO CO[C@@]1(C(F)(F)F)CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925021 1029109427 /nfs/dbraw/zinc/10/94/27/1029109427.db2.gz RSHIXXWFPALGIU-FZMZJTMJSA-N 1 0 332.322 3.699 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CC3(OC)CCC3)o2)c([N+](=O)[O-])c1 ZINC000355763939 1029116675 /nfs/dbraw/zinc/11/66/75/1029116675.db2.gz HAVGPVQCMMPKKC-UHFFFAOYSA-N 1 0 346.383 3.522 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)N(C)C1CC1 ZINC000237410961 1029177268 /nfs/dbraw/zinc/17/72/68/1029177268.db2.gz JXJHZPSVHZBLOJ-ZDUSSCGKSA-N 1 0 345.468 3.896 20 5 EHBDRO COc1cc(C[NH2+]CC2CC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000237134638 1029374226 /nfs/dbraw/zinc/37/42/26/1029374226.db2.gz JHXJMBPQZPEBJF-UHFFFAOYSA-N 1 0 342.395 3.682 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000533262049 1029541981 /nfs/dbraw/zinc/54/19/81/1029541981.db2.gz WTPZFAQEKCRRIG-GJZGRUSLSA-N 1 0 341.411 3.657 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000533285231 1029574012 /nfs/dbraw/zinc/57/40/12/1029574012.db2.gz XUAKTXAIKNBLPT-OCCSQVGLSA-N 1 0 333.432 3.741 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@H]1C(C)C ZINC000533296489 1029599155 /nfs/dbraw/zinc/59/91/55/1029599155.db2.gz BFNRIEZQDDQLSO-KRWDZBQOSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000192512896 1029806247 /nfs/dbraw/zinc/80/62/47/1029806247.db2.gz DCQLJBBZWAEEEF-KRWDZBQOSA-N 1 0 341.411 3.571 20 5 EHBDRO C[C@H](Cc1ccc(Cl)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835007 1029816093 /nfs/dbraw/zinc/81/60/93/1029816093.db2.gz JBIJLPZQEJPVBO-LLVKDONJSA-N 1 0 344.802 3.845 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@H](c4ccccc4)C3)nc2c1 ZINC000446843950 1029824518 /nfs/dbraw/zinc/82/45/18/1029824518.db2.gz CZQQWEVGXWGGLT-LSDHHAIUSA-N 1 0 336.395 3.897 20 5 EHBDRO CCOC(=O)[C@]1(C(C)C)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890943 1029842927 /nfs/dbraw/zinc/84/29/27/1029842927.db2.gz RKEAYSJBNSWOIL-QRBZPYHOSA-N 1 0 346.427 3.519 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000475648068 1029856771 /nfs/dbraw/zinc/85/67/71/1029856771.db2.gz IKUUDFIKQCGRCL-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)n1 ZINC000441173637 1029866907 /nfs/dbraw/zinc/86/69/07/1029866907.db2.gz CNLLEDBNAKUUBN-ZGKFYVQTSA-N 1 0 340.427 3.749 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c1 ZINC000537626334 1029905845 /nfs/dbraw/zinc/90/58/45/1029905845.db2.gz OPSCNWFAEBIZTO-RYUDHWBXSA-N 1 0 326.343 3.818 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCCCC2(F)F)n1 ZINC000453241031 1029918320 /nfs/dbraw/zinc/91/83/20/1029918320.db2.gz CXVBGLDDQSXXIU-HZSPNIEDSA-N 1 0 342.390 3.690 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCC2CCOCC2)cc1[N+](=O)[O-] ZINC000453235528 1029958394 /nfs/dbraw/zinc/95/83/94/1029958394.db2.gz MFKHJPJVVNTKRY-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO Cc1c(-c2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246159 1029973652 /nfs/dbraw/zinc/97/36/52/1029973652.db2.gz CRVLYZWHKXJQBY-LOWVWBTDSA-N 1 0 330.388 3.887 20 5 EHBDRO COc1cc2c(cc1OC)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000453249883 1029979048 /nfs/dbraw/zinc/97/90/48/1029979048.db2.gz VZNKNBVYUKNORW-YVEFUNNKSA-N 1 0 342.395 3.950 20 5 EHBDRO CCc1cnc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192910675 1030036518 /nfs/dbraw/zinc/03/65/18/1030036518.db2.gz MRHSMJWLGYUMII-INIZCTEOSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1ncsc1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453305600 1030072952 /nfs/dbraw/zinc/07/29/52/1030072952.db2.gz JIWKXJUPPFXGFB-OAHLLOKOSA-N 1 0 331.441 3.914 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2ccco2)N2CCCC2)cccc1[N+](=O)[O-] ZINC000152277326 1030075833 /nfs/dbraw/zinc/07/58/33/1030075833.db2.gz CLTOJRGWZOFTBU-QAPCUYQASA-N 1 0 343.427 3.984 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@@H](C)CC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453309407 1030080045 /nfs/dbraw/zinc/08/00/45/1030080045.db2.gz DUXWJMBWUJKUBT-UGSOOPFHSA-N 1 0 346.427 3.979 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453341455 1030127127 /nfs/dbraw/zinc/12/71/27/1030127127.db2.gz CBYVVQIMDNLSFO-JCKWVBRZSA-N 1 0 327.384 3.561 20 5 EHBDRO COc1ccc([C@@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058932685 1030133929 /nfs/dbraw/zinc/13/39/29/1030133929.db2.gz VUVSZXOFIPRTNH-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCc3sccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000441250917 1030135108 /nfs/dbraw/zinc/13/51/08/1030135108.db2.gz AYBLORAWNWMANJ-GFCCVEGCSA-N 1 0 348.424 3.663 20 5 EHBDRO CCC[C@@]1(COC)CCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000447403419 1030172119 /nfs/dbraw/zinc/17/21/19/1030172119.db2.gz ONBLECABKGVTNZ-KRWDZBQOSA-N 1 0 340.395 3.524 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCc2cccc(Cl)c2)n1 ZINC000447519122 1030242415 /nfs/dbraw/zinc/24/24/15/1030242415.db2.gz XSZNLTNZEZWXHC-HZPDHXFCSA-N 1 0 348.834 3.761 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509101 1030256713 /nfs/dbraw/zinc/25/67/13/1030256713.db2.gz LUISUPNLAKOLBL-DNVCBOLYSA-N 1 0 331.460 3.826 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1cccc(F)c1)CCC2 ZINC000447540038 1030276555 /nfs/dbraw/zinc/27/65/55/1030276555.db2.gz IMXRBUFQCLZYTF-SFHVURJKSA-N 1 0 330.359 3.780 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447545107 1030279678 /nfs/dbraw/zinc/27/96/78/1030279678.db2.gz XCOUAKWQQFUJQN-IRXDYDNUSA-N 1 0 328.416 3.682 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)n1 ZINC000447563384 1030308468 /nfs/dbraw/zinc/30/84/68/1030308468.db2.gz PQZLMLWLMPNODL-ZOFXXKQRSA-N 1 0 332.448 3.833 20 5 EHBDRO C[C@@H](CC(=O)OC(C)(C)C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447588977 1030324337 /nfs/dbraw/zinc/32/43/37/1030324337.db2.gz WCAZTBOLUDPQGN-LRDDRELGSA-N 1 0 334.416 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCCCN1C1CC1)CCC2 ZINC000447595663 1030332218 /nfs/dbraw/zinc/33/22/18/1030332218.db2.gz ALUQELBBIJKYJZ-IEBWSBKVSA-N 1 0 329.444 3.579 20 5 EHBDRO CO[C@H](CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000447598305 1030336637 /nfs/dbraw/zinc/33/66/37/1030336637.db2.gz HOEUVHTWEINCNG-ZIAGYGMSSA-N 1 0 332.322 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](CCO)C1CCCCC1)CCC2 ZINC000447577651 1030338362 /nfs/dbraw/zinc/33/83/62/1030338362.db2.gz ASYRKHDWDMJGCT-RTBURBONSA-N 1 0 332.444 3.893 20 5 EHBDRO Cc1cc(N[C@H]2CCO[C@@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000160340649 1030684343 /nfs/dbraw/zinc/68/43/43/1030684343.db2.gz KLPAUVBDFSNNEM-SCLBCKFNSA-N 1 0 327.384 3.821 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000128147706 1030770199 /nfs/dbraw/zinc/77/01/99/1030770199.db2.gz FDGPHABRWLBGMU-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](CC(C)C)C1 ZINC001168147714 1030925983 /nfs/dbraw/zinc/92/59/83/1030925983.db2.gz WXUHJTLVPUAJPD-MRXNPFEDSA-N 1 0 347.459 3.990 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483126646 1030988387 /nfs/dbraw/zinc/98/83/87/1030988387.db2.gz VMJOASXJSAFZSE-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1cc(C[NH2+]CCC=C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000483661701 1031267742 /nfs/dbraw/zinc/26/77/42/1031267742.db2.gz OBKMUDXQVFUOQC-UHFFFAOYSA-N 1 0 344.358 3.693 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@]1(C)CCCO1 ZINC000340496908 1031294484 /nfs/dbraw/zinc/29/44/84/1031294484.db2.gz HFHRTTWFLCBQSQ-IINYFYTJSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000161106205 1031320620 /nfs/dbraw/zinc/32/06/20/1031320620.db2.gz GYZCGTFLIZJHIB-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H]1CCCC[N@H+]1CC(C)C ZINC000483845835 1031362385 /nfs/dbraw/zinc/36/23/85/1031362385.db2.gz CQCHTONOJSFOLG-INIZCTEOSA-N 1 0 348.447 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H]1CCCC[N@H+]1CC(C)C ZINC000483845837 1031363918 /nfs/dbraw/zinc/36/39/18/1031363918.db2.gz CQCHTONOJSFOLG-MRXNPFEDSA-N 1 0 348.447 3.535 20 5 EHBDRO CCC1(CO)CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000129820853 1031369345 /nfs/dbraw/zinc/36/93/45/1031369345.db2.gz MTHUZMSFBWLEGY-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO Cc1c(NC(=O)NC[C@@H]2CCCC[N@H+]2CC(C)C)cccc1[N+](=O)[O-] ZINC000483874486 1031386944 /nfs/dbraw/zinc/38/69/44/1031386944.db2.gz VNQRSFRJJZENTI-HNNXBMFYSA-N 1 0 348.447 3.535 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC2(O)CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000551818114 1031682063 /nfs/dbraw/zinc/68/20/63/1031682063.db2.gz UDUFPOLBQWJKGE-GOSISDBHSA-N 1 0 344.411 3.734 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@H]1CCCCO1 ZINC000783642330 1031883172 /nfs/dbraw/zinc/88/31/72/1031883172.db2.gz SHMANFCSQLOORD-OAHLLOKOSA-N 1 0 326.824 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](CCO)c1ccccc1)CCC2 ZINC000278662891 1031890979 /nfs/dbraw/zinc/89/09/79/1031890979.db2.gz ITSSXHAUFQRXJQ-RTBURBONSA-N 1 0 326.396 3.686 20 5 EHBDRO COc1ccc2c(c1)OC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000537946250 1032053774 /nfs/dbraw/zinc/05/37/74/1032053774.db2.gz WCIFIMXJFHWAOJ-CJNGLKHVSA-N 1 0 342.395 3.566 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000898181542 1033383675 /nfs/dbraw/zinc/38/36/75/1033383675.db2.gz JQGMGRJTTMZJCV-FZKQIMNGSA-N 1 0 340.427 3.930 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](Cn1cccn1)c1ccccc1 ZINC000594494831 1033395844 /nfs/dbraw/zinc/39/58/44/1033395844.db2.gz INDCIBFLRFCGIP-OALUTQOASA-N 1 0 348.406 3.810 20 5 EHBDRO COCC[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000061002523 1033415926 /nfs/dbraw/zinc/41/59/26/1033415926.db2.gz DTZIWBIWIZHWMF-UHFFFAOYSA-N 1 0 336.775 3.777 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)n1cc(C[N@H+](C)C2CCCCC2)nn1 ZINC000603185810 1033424898 /nfs/dbraw/zinc/42/48/98/1033424898.db2.gz NPYSGVIYFRXQIF-CQSZACIVSA-N 1 0 343.431 3.560 20 5 EHBDRO Cc1ccc(C)c(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000061019952 1033438736 /nfs/dbraw/zinc/43/87/36/1033438736.db2.gz XAHGYLNAMDBFRO-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460345168 1033540374 /nfs/dbraw/zinc/54/03/74/1033540374.db2.gz FJPIQWFDCRVACV-RRFJBIMHSA-N 1 0 333.432 3.726 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011458 1033606166 /nfs/dbraw/zinc/60/61/66/1033606166.db2.gz HOQPSTJSHXREKQ-GDBMZVCRSA-N 1 0 344.411 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](CCCO)c1ccccc1 ZINC000595020762 1033614053 /nfs/dbraw/zinc/61/40/53/1033614053.db2.gz BLCDFTZALKJILP-KDOFPFPSSA-N 1 0 344.411 3.768 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000595003907 1033628030 /nfs/dbraw/zinc/62/80/30/1033628030.db2.gz NBMOZFUBBVJREZ-VXGBXAGGSA-N 1 0 344.367 3.744 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595007155 1033630626 /nfs/dbraw/zinc/63/06/26/1033630626.db2.gz KFJKEDAUUPPYMO-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)CCCCC1 ZINC000595104397 1033691762 /nfs/dbraw/zinc/69/17/62/1033691762.db2.gz PSTYKIAZHGFXNT-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccccc21 ZINC000595075716 1033694796 /nfs/dbraw/zinc/69/47/96/1033694796.db2.gz BALNXSUYPPDYBD-SCLBCKFNSA-N 1 0 339.395 3.589 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599058170 1033698626 /nfs/dbraw/zinc/69/86/26/1033698626.db2.gz JLWMHXFNUJIYRJ-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1 ZINC000595086691 1033699113 /nfs/dbraw/zinc/69/91/13/1033699113.db2.gz OFBJBPZCDDYDJV-URLQWDBASA-N 1 0 342.443 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)CCC2 ZINC000595093298 1033700346 /nfs/dbraw/zinc/70/03/46/1033700346.db2.gz HVTJWVNKEAQCRT-OAHLLOKOSA-N 1 0 340.370 3.502 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000595092836 1033701594 /nfs/dbraw/zinc/70/15/94/1033701594.db2.gz XJRDASLKEUTIPF-FZKQIMNGSA-N 1 0 326.396 3.899 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061969 1033701510 /nfs/dbraw/zinc/70/15/10/1033701510.db2.gz MXIKLEZSXSQVJS-IFXJQAMLSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000089513455 1033747423 /nfs/dbraw/zinc/74/74/23/1033747423.db2.gz VCUINMOLBDVKMS-QGZVFWFLSA-N 1 0 328.368 3.607 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593682190 1033751408 /nfs/dbraw/zinc/75/14/08/1033751408.db2.gz QIMTUDDPJBBAHV-CYBMUJFWSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CC[N@@H+]2C2CCCC2)ccc2cnccc21 ZINC000599164788 1033779389 /nfs/dbraw/zinc/77/93/89/1033779389.db2.gz MQIAOQLDVRSXJF-OAHLLOKOSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC[C@H]3CC[N@@H+]3C3CCCC3)c2c1 ZINC000599165283 1033782803 /nfs/dbraw/zinc/78/28/03/1033782803.db2.gz QFCQSKPNYLQMHL-MRXNPFEDSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489383 1033811094 /nfs/dbraw/zinc/81/10/94/1033811094.db2.gz ABBHJUKMPPXTFV-OAGGEKHMSA-N 1 0 327.384 3.659 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](C1CC1)C1CCOCC1)CCC2 ZINC000593714762 1033822465 /nfs/dbraw/zinc/82/24/65/1033822465.db2.gz AMVMKYOULKIRQO-RTBURBONSA-N 1 0 330.428 3.767 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(F)c(F)c2F)cc1Cl ZINC000783666243 1033843979 /nfs/dbraw/zinc/84/39/79/1033843979.db2.gz DCJVEYVLPSJILR-UHFFFAOYSA-N 1 0 344.720 3.998 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000593721496 1033846360 /nfs/dbraw/zinc/84/63/60/1033846360.db2.gz VSOSCFYQYKGURR-FJIDUMEYSA-N 1 0 340.427 3.729 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CCC1CCC1)[C@H]1CC[C@H](O)CC1 ZINC000595561912 1033862076 /nfs/dbraw/zinc/86/20/76/1033862076.db2.gz GHUHIVBEMIZLMD-IYARVYRRSA-N 1 0 332.444 3.891 20 5 EHBDRO CN1CCC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000608836167 1033909130 /nfs/dbraw/zinc/90/91/30/1033909130.db2.gz UKIYJYJISFNRLJ-ZDUSSCGKSA-N 1 0 331.441 3.507 20 5 EHBDRO Cc1cc(N2CCC(C[NH+]3CCCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000603855150 1033980822 /nfs/dbraw/zinc/98/08/22/1033980822.db2.gz JZKHQKONCSMRMD-UHFFFAOYSA-N 1 0 331.460 3.996 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000603859678 1033985038 /nfs/dbraw/zinc/98/50/38/1033985038.db2.gz QXBZWTKINNHOER-HUUCEWRRSA-N 1 0 342.443 3.923 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000603867929 1033994712 /nfs/dbraw/zinc/99/47/12/1033994712.db2.gz DGLVQZGLSXWRLT-GOSISDBHSA-N 1 0 330.359 3.950 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3ccc(F)cc3[N+](=O)[O-])CCC2)c1 ZINC000595854527 1034011070 /nfs/dbraw/zinc/01/10/70/1034011070.db2.gz VJYXMWRQQPMKBF-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO COc1cc(C[NH2+][C@H](c2ccccn2)C2CCC2)ccc1[N+](=O)[O-] ZINC000599573938 1034017335 /nfs/dbraw/zinc/01/73/35/1034017335.db2.gz LBZSOHUMHIBZLM-SFHVURJKSA-N 1 0 327.384 3.629 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910770 1034029134 /nfs/dbraw/zinc/02/91/34/1034029134.db2.gz RRRZRFUKRIOHKQ-CALCHBBNSA-N 1 0 336.819 3.641 20 5 EHBDRO Cc1cc(NCc2ccc(OCC[NH+](C)C)cc2)c([N+](=O)[O-])s1 ZINC000596081452 1034073104 /nfs/dbraw/zinc/07/31/04/1034073104.db2.gz XIXAXMOHHFHAMF-UHFFFAOYSA-N 1 0 335.429 3.517 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000169151523 1034104121 /nfs/dbraw/zinc/10/41/21/1034104121.db2.gz OHWDJZOGAWSWNA-MOPGFXCFSA-N 1 0 328.412 3.933 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000596478969 1034255337 /nfs/dbraw/zinc/25/53/37/1034255337.db2.gz QNUBWSRFVHCONX-HNNXBMFYSA-N 1 0 333.432 3.560 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000179442148 1034307028 /nfs/dbraw/zinc/30/70/28/1034307028.db2.gz PXYPYLHOKIKYRB-IBGZPJMESA-N 1 0 344.386 3.507 20 5 EHBDRO CC[C@H]([NH2+][C@H](COC)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000347353232 1034345674 /nfs/dbraw/zinc/34/56/74/1034345674.db2.gz OYFWCZGCFJEYFH-HKUYNNGSSA-N 1 0 328.412 3.893 20 5 EHBDRO Cc1c([C@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000596647961 1034346236 /nfs/dbraw/zinc/34/62/36/1034346236.db2.gz DRSVVTVXLIDBSI-KFKAGJAMSA-N 1 0 339.439 3.700 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000604539629 1034418349 /nfs/dbraw/zinc/41/83/49/1034418349.db2.gz AEGKKFXKSPLVPD-GFCCVEGCSA-N 1 0 331.338 3.580 20 5 EHBDRO Cn1ncc(C2CC2)c1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000597137897 1034559913 /nfs/dbraw/zinc/55/99/13/1034559913.db2.gz HOZDSUXCOVVDTL-INIZCTEOSA-N 1 0 340.427 3.585 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000597225033 1034625568 /nfs/dbraw/zinc/62/55/68/1034625568.db2.gz LXIGQLRSVOSRPP-FYXZTFBWSA-N 1 0 330.428 3.889 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1=CCSC1 ZINC000597246534 1034639149 /nfs/dbraw/zinc/63/91/49/1034639149.db2.gz WMWSNWFHYYUVTQ-UHFFFAOYSA-N 1 0 330.409 3.960 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000892482357 1034719834 /nfs/dbraw/zinc/71/98/34/1034719834.db2.gz VCKWURGLKWCPMF-MRXNPFEDSA-N 1 0 330.384 3.796 20 5 EHBDRO CC[C@H]([NH2+]CCn1ccc(C(F)(F)F)n1)c1cccc([N+](=O)[O-])c1 ZINC000601964777 1034851179 /nfs/dbraw/zinc/85/11/79/1034851179.db2.gz UJELKCDOCCFBFG-ZDUSSCGKSA-N 1 0 342.321 3.551 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000411477298 1034891547 /nfs/dbraw/zinc/89/15/47/1034891547.db2.gz RULJTKIWUUNNTE-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO COCC[C@H](c1ccccc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928395 1034900975 /nfs/dbraw/zinc/90/09/75/1034900975.db2.gz QBLXSTUKZZYGEG-LJQANCHMSA-N 1 0 328.412 3.847 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc1OC ZINC000612576882 1035073816 /nfs/dbraw/zinc/07/38/16/1035073816.db2.gz SEHRDNAPPVCKKJ-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@H+]2CC[C@@H](O)C2)cc1 ZINC000179950820 1035076532 /nfs/dbraw/zinc/07/65/32/1035076532.db2.gz FNKYSVFIBUGZAY-CQSZACIVSA-N 1 0 348.786 3.607 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(O)CCC[C@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000188602846 1035237246 /nfs/dbraw/zinc/23/72/46/1035237246.db2.gz DMVQMUCLMFZRPO-WHOFXGATSA-N 1 0 346.349 3.729 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000580340935 1035429045 /nfs/dbraw/zinc/42/90/45/1035429045.db2.gz FQZUOTBNLRXZQK-OAOQPFQOSA-N 1 0 342.443 3.832 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CS1 ZINC000581039235 1035466154 /nfs/dbraw/zinc/46/61/54/1035466154.db2.gz QMUNJOTYZUOLMT-GUYCJALGSA-N 1 0 333.457 3.738 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000580984599 1035468598 /nfs/dbraw/zinc/46/85/98/1035468598.db2.gz OFXFYGGHCMQXGU-NTPDMAOXSA-N 1 0 349.434 3.745 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000581262521 1035482179 /nfs/dbraw/zinc/48/21/79/1035482179.db2.gz XZXCIIVJAYVSOX-INIZCTEOSA-N 1 0 342.395 3.779 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nnc(C(C)C)s1 ZINC000492243855 1035522699 /nfs/dbraw/zinc/52/26/99/1035522699.db2.gz XGDZTKUTAXAERD-LCYFTJDESA-N 1 0 346.456 3.805 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039193 1035685967 /nfs/dbraw/zinc/68/59/67/1035685967.db2.gz CNZJESPUWZGWOK-GOEBONIOSA-N 1 0 347.459 3.693 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535008209 1035897140 /nfs/dbraw/zinc/89/71/40/1035897140.db2.gz FQVFHSHOOMKKCQ-CQSZACIVSA-N 1 0 335.448 3.914 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000535008206 1035897260 /nfs/dbraw/zinc/89/72/60/1035897260.db2.gz FQVFHSHOOMKKCQ-AWEZNQCLSA-N 1 0 335.448 3.914 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347907 1035932504 /nfs/dbraw/zinc/93/25/04/1035932504.db2.gz DSRCGZRVXRABCS-HUUCEWRRSA-N 1 0 333.432 3.872 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@H](Nc3ccccc3)C2)c(Cl)c1 ZINC000541070510 1035950038 /nfs/dbraw/zinc/95/00/38/1035950038.db2.gz JAYYJGXCJLHKDN-HNNXBMFYSA-N 1 0 331.803 3.935 20 5 EHBDRO C[C@H]([N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000535085162 1035981221 /nfs/dbraw/zinc/98/12/21/1035981221.db2.gz KWUFRDWYTVQKBE-ZDUSSCGKSA-N 1 0 330.432 3.862 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000582636346 1036079750 /nfs/dbraw/zinc/07/97/50/1036079750.db2.gz JHFDRTMZHKQOSI-MAUKXSAKSA-N 1 0 340.423 3.818 20 5 EHBDRO CCOc1cc(C[N@H+](C[C@@H](C)O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492787755 1036293788 /nfs/dbraw/zinc/29/37/88/1036293788.db2.gz GMOSIMRNLDNMLK-CQSZACIVSA-N 1 0 336.432 3.509 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495764 1036438347 /nfs/dbraw/zinc/43/83/47/1036438347.db2.gz KMSYKCPXGZKFER-UHFFFAOYSA-N 1 0 348.424 3.508 20 5 EHBDRO CCC(CC)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000165372980 1036440364 /nfs/dbraw/zinc/44/03/64/1036440364.db2.gz JYDZIMZKNFIHDN-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@H]1c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000026231486 1036441709 /nfs/dbraw/zinc/44/17/09/1036441709.db2.gz SGDPODCFBIMYLW-OAHLLOKOSA-N 1 0 345.424 3.822 20 5 EHBDRO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825988 1036510087 /nfs/dbraw/zinc/51/00/87/1036510087.db2.gz IPDGKFFJYCSDMZ-KSSFIOAISA-N 1 0 334.416 3.567 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000541691063 1036563069 /nfs/dbraw/zinc/56/30/69/1036563069.db2.gz URABNAIBUJMKBI-QUJCMNEKSA-N 1 0 342.395 3.646 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000464675720 1036649655 /nfs/dbraw/zinc/64/96/55/1036649655.db2.gz BWJIBTJHTVLICZ-HNNXBMFYSA-N 1 0 344.386 3.807 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)c1cccnc1 ZINC000414341118 1036784155 /nfs/dbraw/zinc/78/41/55/1036784155.db2.gz VEFWKVPKECLYJO-HNNXBMFYSA-N 1 0 327.428 3.878 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000076004795 1036788451 /nfs/dbraw/zinc/78/84/51/1036788451.db2.gz ROJMZFPUACGCRU-MRXNPFEDSA-N 1 0 349.475 3.546 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCc3cscn3)cs2)c1 ZINC000076331525 1036852528 /nfs/dbraw/zinc/85/25/28/1036852528.db2.gz BTJZALUAXNJZMU-UHFFFAOYSA-N 1 0 346.437 3.507 20 5 EHBDRO CC[NH+]1CCC(N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000491328684 1036852579 /nfs/dbraw/zinc/85/25/79/1036852579.db2.gz JBAKONBNWYHJKL-HXUWFJFHSA-N 1 0 339.439 3.758 20 5 EHBDRO CC(C)[C@@H](O)C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000539588697 1036957508 /nfs/dbraw/zinc/95/75/08/1036957508.db2.gz GAGHUUSWPJGEMJ-GOSISDBHSA-N 1 0 344.411 3.742 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000590653744 1036993043 /nfs/dbraw/zinc/99/30/43/1036993043.db2.gz LZOVMRFTVMRSRP-GXTWGEPZSA-N 1 0 332.322 3.661 20 5 EHBDRO CCOc1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000594919063 1037020401 /nfs/dbraw/zinc/02/04/01/1037020401.db2.gz WFZICBCEJXIIGK-UHFFFAOYSA-N 1 0 330.384 3.600 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000590779920 1037048303 /nfs/dbraw/zinc/04/83/03/1037048303.db2.gz ZLIXKNWLOAZDRP-ZSZQSSIHSA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1c(Cc2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211343 1037129577 /nfs/dbraw/zinc/12/95/77/1037129577.db2.gz DNHIBTPKYBEHNG-SCRDCRAPSA-N 1 0 344.415 3.811 20 5 EHBDRO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000590967192 1037145065 /nfs/dbraw/zinc/14/50/65/1037145065.db2.gz FZGGJJWQSNJFGK-OKILXGFUSA-N 1 0 326.352 3.551 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000325952724 1037292534 /nfs/dbraw/zinc/29/25/34/1037292534.db2.gz NXFMFSNATWURID-LLVKDONJSA-N 1 0 348.369 3.931 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3n[nH]cc3C2)c2ccccc2)c1 ZINC000180949695 1037340889 /nfs/dbraw/zinc/34/08/89/1037340889.db2.gz BYSAXISKHRIREP-FXAWDEMLSA-N 1 0 348.406 3.554 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000041888306 1037342276 /nfs/dbraw/zinc/34/22/76/1037342276.db2.gz ZMYLVBFCYSDALL-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000271815995 1037357051 /nfs/dbraw/zinc/35/70/51/1037357051.db2.gz MBZNCOLXPGQQRL-LBPRGKRZSA-N 1 0 326.824 3.527 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462783694 1037385377 /nfs/dbraw/zinc/38/53/77/1037385377.db2.gz UIVJKGMAYLSYSQ-NSHDSACASA-N 1 0 342.237 3.644 20 5 EHBDRO CC(C)[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000026266672 1037416987 /nfs/dbraw/zinc/41/69/87/1037416987.db2.gz QUCDAUPETHQOIS-LJQANCHMSA-N 1 0 341.411 3.910 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1OC ZINC000532474069 1037432286 /nfs/dbraw/zinc/43/22/86/1037432286.db2.gz RRBYQOHVZVKQJX-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3CCOCC3)s2)cc1 ZINC000171052138 1037433084 /nfs/dbraw/zinc/43/30/84/1037433084.db2.gz XQHRZAFFSHHJMT-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO CCOc1cc(NC[C@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000540023648 1037483470 /nfs/dbraw/zinc/48/34/70/1037483470.db2.gz BWCZIYFCTNBUJJ-OAHLLOKOSA-N 1 0 335.448 3.773 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1)CC1CC1 ZINC000540026800 1037486786 /nfs/dbraw/zinc/48/67/86/1037486786.db2.gz IPNUFOFCIVYIBF-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](CCO)c1ccccc1 ZINC000532516527 1037558015 /nfs/dbraw/zinc/55/80/15/1037558015.db2.gz HJNMOSICRZQMDS-DOTOQJQBSA-N 1 0 328.412 3.720 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CC[N@H+](CC3CCCC3)C2)ccc2ncccc21 ZINC000462947328 1037572265 /nfs/dbraw/zinc/57/22/65/1037572265.db2.gz LGLHZCYKGHYWAR-HNNXBMFYSA-N 1 0 340.427 3.819 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC(C)(C)C ZINC000532549548 1037588297 /nfs/dbraw/zinc/58/82/97/1037588297.db2.gz UGDVWDNTVCHCAK-JTQLQIEISA-N 1 0 327.812 3.553 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CCCc3c(O)cccc32)ccc1[N+](=O)[O-] ZINC000493741487 1037591692 /nfs/dbraw/zinc/59/16/92/1037591692.db2.gz XKPCEKYGNJWJGN-MRXNPFEDSA-N 1 0 342.395 3.866 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCN(C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000540154104 1037624601 /nfs/dbraw/zinc/62/46/01/1037624601.db2.gz VYHSENHDAXVHBO-CVAIRZPRSA-N 1 0 339.439 3.999 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](Cc2ccccc2)C2CC2)cc1 ZINC000540168303 1037636380 /nfs/dbraw/zinc/63/63/80/1037636380.db2.gz IEPURVDDELXHGW-LJQANCHMSA-N 1 0 326.396 3.585 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2)c1 ZINC000031531292 1037645320 /nfs/dbraw/zinc/64/53/20/1037645320.db2.gz UBXQKNLDGOXYLV-UHFFFAOYSA-N 1 0 327.384 3.689 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051180362 1037747380 /nfs/dbraw/zinc/74/73/80/1037747380.db2.gz MLBKTIFDQIYMPD-QGZVFWFLSA-N 1 0 342.395 3.949 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341207215 1037763219 /nfs/dbraw/zinc/76/32/19/1037763219.db2.gz JRHQUQCAQMYVRD-HNNXBMFYSA-N 1 0 327.384 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)o1 ZINC000249858045 1037768071 /nfs/dbraw/zinc/76/80/71/1037768071.db2.gz QJUCHUPTKQSBCL-JOQOYGCGSA-N 1 0 328.368 3.512 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]([C@H]1CC[C@H](O)CC1)[C@@H]1C=CCCC1 ZINC000592131272 1037844343 /nfs/dbraw/zinc/84/43/43/1037844343.db2.gz VXUJZVDXNUWSHG-KZNAEPCWSA-N 1 0 330.428 3.809 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386802 1037878815 /nfs/dbraw/zinc/87/88/15/1037878815.db2.gz ZWRYDRZNOZLUHN-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CC(C)(C)OC(=O)C1(C)CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000592157418 1037898986 /nfs/dbraw/zinc/89/89/86/1037898986.db2.gz XJGLJGBIAPATNI-UHFFFAOYSA-N 1 0 348.443 3.581 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592181458 1037910796 /nfs/dbraw/zinc/91/07/96/1037910796.db2.gz DLFZCJVOKWRBFE-OAHLLOKOSA-N 1 0 348.443 3.773 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000540426850 1037932375 /nfs/dbraw/zinc/93/23/75/1037932375.db2.gz MPSMZIIMBLQFKE-QGZVFWFLSA-N 1 0 348.834 3.966 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(CO)cc1)CCCC2 ZINC000592392973 1037934434 /nfs/dbraw/zinc/93/44/34/1037934434.db2.gz NTLZHNCQAYUZTB-IBGZPJMESA-N 1 0 326.396 3.644 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)[nH]1 ZINC000549407518 1038321878 /nfs/dbraw/zinc/32/18/78/1038321878.db2.gz GCEBEYCQPLPVAL-UHFFFAOYSA-N 1 0 336.395 3.659 20 5 EHBDRO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccnc(C)c1 ZINC000538550620 1038375920 /nfs/dbraw/zinc/37/59/20/1038375920.db2.gz DDGJOMMQTPBHLB-UHFFFAOYSA-N 1 0 345.424 3.865 20 5 EHBDRO CC(C)(C)Oc1cc(NCCCCn2ccnc2)ccc1[N+](=O)[O-] ZINC000538706884 1038482762 /nfs/dbraw/zinc/48/27/62/1038482762.db2.gz KBOCXOIWOQNWGK-UHFFFAOYSA-N 1 0 332.404 3.861 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538878481 1038584864 /nfs/dbraw/zinc/58/48/64/1038584864.db2.gz ZIZISWLAUDTMMQ-FZKQIMNGSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1cc(N2CCC(C[NH+]3CCCCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000461779907 1038605866 /nfs/dbraw/zinc/60/58/66/1038605866.db2.gz VRUJNGCTFOCXPO-UHFFFAOYSA-N 1 0 335.423 3.745 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290610 1038762919 /nfs/dbraw/zinc/76/29/19/1038762919.db2.gz ARCFYBURAKYVCX-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](O)C34CCCC4)o2)cc1 ZINC000552085208 1038945003 /nfs/dbraw/zinc/94/50/03/1038945003.db2.gz UFWFXSYEVSMERO-GOSISDBHSA-N 1 0 342.395 3.734 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@](C)(CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000477861700 1038972461 /nfs/dbraw/zinc/97/24/61/1038972461.db2.gz NDTWNOJKLIIYPE-JXFKEZNVSA-N 1 0 342.439 3.795 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@](CO)(C(C)C)C1 ZINC000552137791 1039000226 /nfs/dbraw/zinc/00/02/26/1039000226.db2.gz NAHXLJCRUSDESP-NXIIHZOPSA-N 1 0 332.444 3.729 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1c[nH]c2ccccc12 ZINC000236845940 1039045245 /nfs/dbraw/zinc/04/52/45/1039045245.db2.gz PIIJXOJSXVOCEY-UHFFFAOYSA-N 1 0 339.395 3.807 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000485473038 1039136925 /nfs/dbraw/zinc/13/69/25/1039136925.db2.gz HMALGUOIWVHCKB-RHSMWYFYSA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000905853506 1039159893 /nfs/dbraw/zinc/15/98/93/1039159893.db2.gz RXTRETPABOGACJ-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])[nH]1 ZINC000488465422 1039207279 /nfs/dbraw/zinc/20/72/79/1039207279.db2.gz OHIZDSVDFHALTP-IHRRRGAJSA-N 1 0 345.447 3.898 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCN([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494827 1039484614 /nfs/dbraw/zinc/48/46/14/1039484614.db2.gz BEICKWFBVRKEGU-APWZRJJASA-N 1 0 339.439 3.828 20 5 EHBDRO CCC(CC)[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[NH+](C)C ZINC000480435356 1039544874 /nfs/dbraw/zinc/54/48/74/1039544874.db2.gz SRTGDWFUEMEQBC-QGZVFWFLSA-N 1 0 330.432 3.921 20 5 EHBDRO COCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1ccccc1 ZINC000489126229 1039635536 /nfs/dbraw/zinc/63/55/36/1039635536.db2.gz JWXQAHLTLWZDDL-OAHLLOKOSA-N 1 0 344.411 3.813 20 5 EHBDRO Cc1noc(C)c1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417312153 1039666455 /nfs/dbraw/zinc/66/64/55/1039666455.db2.gz NCFKTLUWPOFZBW-SFHVURJKSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCO[C@H](C3CC3)C1)CCCC2 ZINC000417346590 1039708036 /nfs/dbraw/zinc/70/80/36/1039708036.db2.gz ULPSZSCQRDUJIA-LZQZEXGQSA-N 1 0 330.428 3.910 20 5 EHBDRO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cnc1F ZINC000894081946 1040039072 /nfs/dbraw/zinc/03/90/72/1040039072.db2.gz KQNZSHIREODWPA-UHFFFAOYSA-N 1 0 343.280 3.746 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000573507030 1040137547 /nfs/dbraw/zinc/13/75/47/1040137547.db2.gz YXKOTMADSWXICX-IAGOWNOFSA-N 1 0 346.814 3.949 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)C1CCCC1 ZINC000573610105 1040160858 /nfs/dbraw/zinc/16/08/58/1040160858.db2.gz JQBJEPZEQXVYTG-GJZGRUSLSA-N 1 0 338.473 3.606 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000490037574 1040301157 /nfs/dbraw/zinc/30/11/57/1040301157.db2.gz IBUOPEXCVKJFDK-NVXWUHKLSA-N 1 0 331.460 3.628 20 5 EHBDRO CCC[C@@](C)(CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236944081 1040309806 /nfs/dbraw/zinc/30/98/06/1040309806.db2.gz RCBAWPFGRWOSTN-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO COC(=O)c1ccc(CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1F ZINC000292073902 1040335593 /nfs/dbraw/zinc/33/55/93/1040335593.db2.gz DVRHAPGRAXNNHQ-UHFFFAOYSA-N 1 0 346.358 3.545 20 5 EHBDRO C[NH+](C)[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130765 1040365025 /nfs/dbraw/zinc/36/50/25/1040365025.db2.gz OJAKAUPAAHNFTQ-VQTJNVASSA-N 1 0 339.439 3.614 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481168573 1040421568 /nfs/dbraw/zinc/42/15/68/1040421568.db2.gz MOGMJKQNBMWHFU-PBHICJAKSA-N 1 0 333.432 3.790 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804447 1040471886 /nfs/dbraw/zinc/47/18/86/1040471886.db2.gz YQTBZWDQIKKDOP-CXAGYDPISA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481207350 1040490707 /nfs/dbraw/zinc/49/07/07/1040490707.db2.gz QDFFRUNFHANJFK-DGCLKSJQSA-N 1 0 339.823 3.745 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H](CCOC)C1 ZINC000467269247 1040514532 /nfs/dbraw/zinc/51/45/32/1040514532.db2.gz RHINOVZMEKOZAZ-OAHLLOKOSA-N 1 0 336.432 3.632 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1 ZINC000566572276 1040547211 /nfs/dbraw/zinc/54/72/11/1040547211.db2.gz CKRWDTPZOAEFBF-NVXWUHKLSA-N 1 0 341.411 3.685 20 5 EHBDRO C[C@@H]([C@H]1Cc2ccccc2O1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593277 1040622171 /nfs/dbraw/zinc/62/21/71/1040622171.db2.gz VJJPCHYUCBINMU-KPZWWZAWSA-N 1 0 330.359 3.558 20 5 EHBDRO C[C@]1(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCS1 ZINC000600125991 1040688113 /nfs/dbraw/zinc/68/81/13/1040688113.db2.gz SJPUXTAYTKWCBU-QGZVFWFLSA-N 1 0 336.457 3.724 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000614227380 1040764486 /nfs/dbraw/zinc/76/44/86/1040764486.db2.gz CBHODICLKBAHAL-ROUUACIJSA-N 1 0 336.432 3.547 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccc3c(c2)CCO3)C2CC2)cc1 ZINC000490821423 1040766221 /nfs/dbraw/zinc/76/62/21/1040766221.db2.gz OSTMAZIETJGYPU-UHFFFAOYSA-N 1 0 338.407 3.737 20 5 EHBDRO Cc1nccn1C[C@@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115164 1040778212 /nfs/dbraw/zinc/77/82/12/1040778212.db2.gz HVUCDKTWRGWGNW-SCLBCKFNSA-N 1 0 342.443 3.748 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001167752533 1040849425 /nfs/dbraw/zinc/84/94/25/1040849425.db2.gz VROPJDQSQSWJRH-CYBMUJFWSA-N 1 0 346.406 3.959 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000541566580 1041063364 /nfs/dbraw/zinc/06/33/64/1041063364.db2.gz PTSCUFHSINONSD-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(=O)c1cc(NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000587257382 1041167019 /nfs/dbraw/zinc/16/70/19/1041167019.db2.gz OBXUWRGXZJIHDH-GJZGRUSLSA-N 1 0 347.459 3.967 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](CO)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433286163 1041220987 /nfs/dbraw/zinc/22/09/87/1041220987.db2.gz UFRXWXZZOMGPSC-MSOLQXFVSA-N 1 0 344.386 3.780 20 5 EHBDRO CC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CC1(C)C ZINC000419313682 1041249837 /nfs/dbraw/zinc/24/98/37/1041249837.db2.gz GNHFZXJFHWBANZ-KGLIPLIRSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710997 1041474160 /nfs/dbraw/zinc/47/41/60/1041474160.db2.gz CHYNDCFCJONRGN-HZSPNIEDSA-N 1 0 333.432 3.576 20 5 EHBDRO COc1ccc(C[C@H](C)C[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1F ZINC000545596109 1041668851 /nfs/dbraw/zinc/66/88/51/1041668851.db2.gz PSQJNKJWOCFRLV-AWEZNQCLSA-N 1 0 346.402 3.753 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181787581 1042146766 /nfs/dbraw/zinc/14/67/66/1042146766.db2.gz HUUGRIKWGPMQOV-GDIGMMSISA-N 1 0 325.412 3.691 20 5 EHBDRO COc1ccc(C[NH2+]CCC2CC(OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000432252471 1042426860 /nfs/dbraw/zinc/42/68/60/1042426860.db2.gz GMEMICOGTWDEEP-UHFFFAOYSA-N 1 0 336.432 3.677 20 5 EHBDRO Cc1csc([C@@H](C)C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000893563028 1042662709 /nfs/dbraw/zinc/66/27/09/1042662709.db2.gz HNNRSGPMAUBIJS-VIFPVBQESA-N 1 0 325.821 3.906 20 5 EHBDRO C[C@H](COc1ccc(F)cc1F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481541304 1042758838 /nfs/dbraw/zinc/75/88/38/1042758838.db2.gz HUEOIWWLQXKFDN-NEPJUHHUSA-N 1 0 336.338 3.991 20 5 EHBDRO C[C@H]1CCSCCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549610224 1042835027 /nfs/dbraw/zinc/83/50/27/1042835027.db2.gz KAAAGISYQJWPTB-JTQLQIEISA-N 1 0 334.363 3.941 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)[C@@H]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000342278775 1042848022 /nfs/dbraw/zinc/84/80/22/1042848022.db2.gz FTLXXHFCXIBESF-FHLIZLRMSA-N 1 0 347.459 3.673 20 5 EHBDRO C[C@@H]1C[NH+](CCCCNc2c(Cl)cccc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000432325861 1042906749 /nfs/dbraw/zinc/90/67/49/1042906749.db2.gz NCEADUSMRASLKE-CHWSQXEVSA-N 1 0 341.839 3.550 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CC[C@@H](CO)CC2)c2ccccc2)c1 ZINC000585794325 1043039142 /nfs/dbraw/zinc/03/91/42/1043039142.db2.gz MKXATHSMUHLFEJ-MOXGXCLJSA-N 1 0 340.423 3.825 20 5 EHBDRO Cc1nn(CC[N@@H+](C)Cc2ccc(F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000344594690 1044166804 /nfs/dbraw/zinc/16/68/04/1044166804.db2.gz BFVNNBXGEDASOL-UHFFFAOYSA-N 1 0 342.374 3.524 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512217909 1044185651 /nfs/dbraw/zinc/18/56/51/1044185651.db2.gz IDCOYMFUYUDDCM-GFCCVEGCSA-N 1 0 334.803 3.717 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000279625784 1044328423 /nfs/dbraw/zinc/32/84/23/1044328423.db2.gz HIJVYHRIXUSDAW-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000279673956 1044394650 /nfs/dbraw/zinc/39/46/50/1044394650.db2.gz NQQZHBAYXHDIHD-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO C[N@@H+](Cc1ccc(F)c(Cl)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000763836375 1126882621 /nfs/dbraw/zinc/88/26/21/1126882621.db2.gz MRAWKWIKDZFDTG-INIZCTEOSA-N 1 0 338.766 3.553 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000182906804 1127353638 /nfs/dbraw/zinc/35/36/38/1127353638.db2.gz OFUNVUWRAFHINQ-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC23CCC3)c([N+](=O)[O-])cc1OC(F)F ZINC000444787027 1127527467 /nfs/dbraw/zinc/52/74/67/1127527467.db2.gz PXXCYKHDUOKMII-UHFFFAOYSA-N 1 0 342.342 3.723 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1COc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000765330368 1127598457 /nfs/dbraw/zinc/59/84/57/1127598457.db2.gz BEFIWOWWFRYWPU-KBXCAEBGSA-N 1 0 326.396 3.887 20 5 EHBDRO COc1c([N+](=O)[O-])cc(Cl)c(C)c1N[C@H]1CCCC[C@@H]1[NH+](C)C ZINC001168601235 1128279948 /nfs/dbraw/zinc/27/99/48/1128279948.db2.gz ONYZOPFVQFDPGB-STQMWFEESA-N 1 0 341.839 3.850 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000273038037 1128435668 /nfs/dbraw/zinc/43/56/68/1128435668.db2.gz HSLHMRFOACECBI-GFCCVEGCSA-N 1 0 326.824 3.527 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506896 1128484032 /nfs/dbraw/zinc/48/40/32/1128484032.db2.gz CYWKYZJRUCPULH-DNVCBOLYSA-N 1 0 325.412 3.917 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000301602886 1128517084 /nfs/dbraw/zinc/51/70/84/1128517084.db2.gz WQSNJLKTWAHSHV-YJBOKZPZSA-N 1 0 340.427 3.621 20 5 EHBDRO CC[C@H]([NH2+]C[C@@]1(O)CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000765881473 1128637265 /nfs/dbraw/zinc/63/72/65/1128637265.db2.gz RPKZJYZFVGOLPK-PMACEKPBSA-N 1 0 340.423 3.860 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(C)nc2)cc1[N+](=O)[O-] ZINC000153729357 1128654911 /nfs/dbraw/zinc/65/49/11/1128654911.db2.gz QRHXXIOUPOSKJN-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO C[C@H](O)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819737 1128661350 /nfs/dbraw/zinc/66/13/50/1128661350.db2.gz AQBUEXDDIUHGNW-DZGCQCFKSA-N 1 0 346.452 3.916 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccnn2C2CCC2)cc1 ZINC000921780292 1128755379 /nfs/dbraw/zinc/75/53/79/1128755379.db2.gz PADSSDANOJQTGJ-UHFFFAOYSA-N 1 0 328.416 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCC2)c2ccncc21 ZINC000338757896 1128880718 /nfs/dbraw/zinc/88/07/18/1128880718.db2.gz QICQKRRLUMCCMU-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@](C)(O)c2cccs2)cc1[N+](=O)[O-] ZINC000153000555 1120527205 /nfs/dbraw/zinc/52/72/05/1120527205.db2.gz CFZOJEQNNISCJA-KRWDZBQOSA-N 1 0 334.441 3.777 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC[C@H]2CCOC2)c2ccccc2)c1 ZINC000542486347 1120606885 /nfs/dbraw/zinc/60/68/85/1120606885.db2.gz FLIBMZTYMWZZPM-KXBFYZLASA-N 1 0 326.396 3.700 20 5 EHBDRO O=C(C[N@H+](C1CC1)C1CCCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000064808050 1128965061 /nfs/dbraw/zinc/96/50/61/1128965061.db2.gz GBDLCHOQEOUVOI-UHFFFAOYSA-N 1 0 337.807 3.594 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000495685598 1121362450 /nfs/dbraw/zinc/36/24/50/1121362450.db2.gz HTPNAASGOCUFJS-LBPRGKRZSA-N 1 0 329.356 3.624 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301079993 1121379514 /nfs/dbraw/zinc/37/95/14/1121379514.db2.gz RZJPYLNTMBNISH-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH2+]C2CCCCC2)c2ncccc12 ZINC000301096053 1121596467 /nfs/dbraw/zinc/59/64/67/1121596467.db2.gz OKXXEMUVDBKIIV-UHFFFAOYSA-N 1 0 328.416 3.867 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724054 1128996348 /nfs/dbraw/zinc/99/63/48/1128996348.db2.gz OOUGQRCVZABZGV-DGCLKSJQSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c(Cl)c1 ZINC000322895817 1121681577 /nfs/dbraw/zinc/68/15/77/1121681577.db2.gz BSPBGKWGCYTILD-DJIMGWMZSA-N 1 0 338.835 3.764 20 5 EHBDRO CC(C)n1cc([C@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000272609200 1121778672 /nfs/dbraw/zinc/77/86/72/1121778672.db2.gz KEBHNJOTOZPEOC-LBPRGKRZSA-N 1 0 336.823 3.919 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180146 1121798017 /nfs/dbraw/zinc/79/80/17/1121798017.db2.gz GNNJYBDKEINUEP-IUODEOHRSA-N 1 0 330.388 3.655 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000301735109 1129010400 /nfs/dbraw/zinc/01/04/00/1129010400.db2.gz ZPKKDYFANIYQHD-YPMHNXCESA-N 1 0 343.349 3.534 20 5 EHBDRO C[C@@H]1C[NH+](CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@@H](C)O1 ZINC000301737023 1129011721 /nfs/dbraw/zinc/01/17/21/1129011721.db2.gz VOPYQHSCVAQMPJ-CHWSQXEVSA-N 1 0 341.839 3.550 20 5 EHBDRO Cc1nc(N2CCOCC2)ccc1Nc1ccc([N+](=O)[O-])cc1Cl ZINC000301736368 1129010934 /nfs/dbraw/zinc/01/09/34/1129010934.db2.gz BJKOCEWQYFLTNK-UHFFFAOYSA-N 1 0 348.790 3.532 20 5 EHBDRO COc1cc(C[N@H+](C(C)C)C2CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000077357496 1129017004 /nfs/dbraw/zinc/01/70/04/1129017004.db2.gz UMJLQWFPIZZDIS-UHFFFAOYSA-N 1 0 344.358 3.968 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@H+](Cc2ccc(F)cc2)CC1 ZINC000301104778 1121919619 /nfs/dbraw/zinc/91/96/19/1121919619.db2.gz SWLFDGVIQKMPRV-UHFFFAOYSA-N 1 0 347.365 3.585 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCCC[C@@H]23)cc1C(F)(F)F ZINC000301117821 1121948873 /nfs/dbraw/zinc/94/88/73/1121948873.db2.gz WIJNNLUEHXPMQI-JSGCOSHPSA-N 1 0 329.322 3.652 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000301198249 1122441975 /nfs/dbraw/zinc/44/19/75/1122441975.db2.gz OVUFPOFNIDFBHF-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO Cc1c(C[NH2+]CCCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000917135516 1122530313 /nfs/dbraw/zinc/53/03/13/1122530313.db2.gz CJGICWHMTAZYDZ-UHFFFAOYSA-N 1 0 332.375 3.991 20 5 EHBDRO Cc1ccnc(NC2CCC([NH+]3CCC(C)CC3)CC2)c1[N+](=O)[O-] ZINC000301773643 1129061659 /nfs/dbraw/zinc/06/16/59/1129061659.db2.gz MJLNKXVMSZXGKG-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CCC[N@H+](CC2CCCCC2)CC1 ZINC000917409861 1122599315 /nfs/dbraw/zinc/59/93/15/1122599315.db2.gz FENGYOLQBMEDAI-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000917476581 1122612790 /nfs/dbraw/zinc/61/27/90/1122612790.db2.gz OVZHHHSSSLEYLD-UHFFFAOYSA-N 1 0 338.411 3.857 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)C1 ZINC000195509020 1123495332 /nfs/dbraw/zinc/49/53/32/1123495332.db2.gz ZHBACGHSTZGZFD-CYBMUJFWSA-N 1 0 346.456 3.895 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@H+](CC2CC2)C1 ZINC000609384340 1123567805 /nfs/dbraw/zinc/56/78/05/1123567805.db2.gz LGFHUMPQVQTTAS-LBPRGKRZSA-N 1 0 329.322 3.510 20 5 EHBDRO CCC(CC)(CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@H](C)c1ccccc1 ZINC000609513115 1123603063 /nfs/dbraw/zinc/60/30/63/1123603063.db2.gz YHIHKDNBVOURSU-CQSZACIVSA-N 1 0 345.447 3.650 20 5 EHBDRO COc1c(C)cnc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000130976306 1129134300 /nfs/dbraw/zinc/13/43/00/1129134300.db2.gz GALVAXKIADGDEW-UHFFFAOYSA-N 1 0 341.411 3.780 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCOC1CCCCCC1 ZINC000609826102 1123670373 /nfs/dbraw/zinc/67/03/73/1123670373.db2.gz ROKPLYARNKEYIY-UHFFFAOYSA-N 1 0 336.432 3.823 20 5 EHBDRO O=[N+]([O-])c1cnc(NCCCCC[NH+]2CCCCC2)c(Cl)c1 ZINC000609893847 1123688717 /nfs/dbraw/zinc/68/87/17/1123688717.db2.gz OGLGRORMTJSLAQ-UHFFFAOYSA-N 1 0 326.828 3.711 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(c3ccccc3F)CC2)c1 ZINC000609895503 1123689024 /nfs/dbraw/zinc/68/90/24/1123689024.db2.gz ZRHBCIVABYQQAY-UHFFFAOYSA-N 1 0 344.386 3.992 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000615834454 1123883921 /nfs/dbraw/zinc/88/39/21/1123883921.db2.gz VBABGCYVUULLML-SPQRHKFCSA-N 1 0 326.400 3.532 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615966695 1123919312 /nfs/dbraw/zinc/91/93/12/1123919312.db2.gz IDNVRAPCVJGOEF-GOEBONIOSA-N 1 0 330.432 3.727 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](c1ccnn1C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000615967267 1123919724 /nfs/dbraw/zinc/91/97/24/1123919724.db2.gz YLNQGKUIPOQFEZ-IRXDYDNUSA-N 1 0 330.432 3.809 20 5 EHBDRO CC1(C)CN(Cc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000078516539 1129155848 /nfs/dbraw/zinc/15/58/48/1129155848.db2.gz YVJNKSBNILBYFN-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCCOCC2)s1 ZINC000181028462 1124487692 /nfs/dbraw/zinc/48/76/92/1124487692.db2.gz NZAOLWGJMWSSPK-CYBMUJFWSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000618615626 1125134452 /nfs/dbraw/zinc/13/44/52/1125134452.db2.gz GNAWUGYOVHQUQB-KBXCAEBGSA-N 1 0 340.423 3.769 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2cc(F)ccc21 ZINC000182829178 1125373756 /nfs/dbraw/zinc/37/37/56/1125373756.db2.gz XPOWYLFMXPLFQO-KRWDZBQOSA-N 1 0 330.359 3.910 20 5 EHBDRO Cc1cc(NC2CC[NH+](CC3CC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000182919324 1125401113 /nfs/dbraw/zinc/40/11/13/1125401113.db2.gz YGFYVUAGKDOSBA-UHFFFAOYSA-N 1 0 340.427 3.738 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989297 1129220552 /nfs/dbraw/zinc/22/05/52/1129220552.db2.gz CNCWZPNQNDTMET-CHWSQXEVSA-N 1 0 328.368 3.778 20 5 EHBDRO C[C@H](CO)[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000067223883 1129256855 /nfs/dbraw/zinc/25/68/55/1129256855.db2.gz RRUIIDYPKSXJPO-LLVKDONJSA-N 1 0 336.775 3.511 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181739 1129315909 /nfs/dbraw/zinc/31/59/09/1129315909.db2.gz IYXZSELUSQFTLB-HUUCEWRRSA-N 1 0 331.416 3.518 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000489304591 1129320549 /nfs/dbraw/zinc/32/05/49/1129320549.db2.gz IPSHZYDOKLHVSD-HNNXBMFYSA-N 1 0 345.468 3.578 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418036 1129474777 /nfs/dbraw/zinc/47/47/77/1129474777.db2.gz MFRPFGRKJBZBSX-CVEARBPZSA-N 1 0 349.475 3.909 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000922455792 1129537638 /nfs/dbraw/zinc/53/76/38/1129537638.db2.gz XITPHFANFXJIFN-PFYGFVOHSA-N 1 0 344.333 3.698 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000922540145 1129568088 /nfs/dbraw/zinc/56/80/88/1129568088.db2.gz GTRFHDNWSGEFDH-KUHUBIRLSA-N 1 0 342.395 3.613 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000922560761 1129570349 /nfs/dbraw/zinc/57/03/49/1129570349.db2.gz LWMPJZTYJQFVHR-FNORWQNLSA-N 1 0 326.396 3.507 20 5 EHBDRO Cn1cc(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093441806 1129588449 /nfs/dbraw/zinc/58/84/49/1129588449.db2.gz LPKRGWQEWVZCLE-HZPDHXFCSA-N 1 0 340.427 3.617 20 5 EHBDRO COc1cccc(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000389794508 1129589738 /nfs/dbraw/zinc/58/97/38/1129589738.db2.gz SGRBJJCNIXSKJF-RHSMWYFYSA-N 1 0 341.411 3.536 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC1CCOCC1 ZINC000466472437 1129595131 /nfs/dbraw/zinc/59/51/31/1129595131.db2.gz XSFIQVFEUONKMI-GFCCVEGCSA-N 1 0 326.824 3.791 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390518310 1129621619 /nfs/dbraw/zinc/62/16/19/1129621619.db2.gz DUSIKLDDVRSAPL-OXQOHEQNSA-N 1 0 339.439 3.910 20 5 EHBDRO CC(C)(C)C[N@H+](CCCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555350636 1129632719 /nfs/dbraw/zinc/63/27/19/1129632719.db2.gz RVEALRJOBRKPCZ-UHFFFAOYSA-N 1 0 348.365 3.844 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044416 1129765384 /nfs/dbraw/zinc/76/53/84/1129765384.db2.gz JUNXAXLRHUVHRM-CJNGLKHVSA-N 1 0 345.443 3.862 20 5 EHBDRO Cc1cccc([C@@H](O)CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)c1 ZINC000302060157 1129765916 /nfs/dbraw/zinc/76/59/16/1129765916.db2.gz CBIXUYGUZHVFAK-IBGZPJMESA-N 1 0 337.379 3.905 20 5 EHBDRO Cc1cc(N[C@H](C)C[C@H](O)c2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302088403 1129767296 /nfs/dbraw/zinc/76/72/96/1129767296.db2.gz OJOHFICLBUSSNZ-PXAZEXFGSA-N 1 0 341.367 3.969 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226690055 1129864338 /nfs/dbraw/zinc/86/43/38/1129864338.db2.gz GLZVVTHSZLYJMZ-IUODEOHRSA-N 1 0 346.818 3.891 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](CO)C2)s1 ZINC000305230074 1129914686 /nfs/dbraw/zinc/91/46/86/1129914686.db2.gz XRIBHHQLWYAZLU-CYBMUJFWSA-N 1 0 332.425 3.528 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000429208924 1129978805 /nfs/dbraw/zinc/97/88/05/1129978805.db2.gz BGQPZPYABDIEPE-SNVBAGLBSA-N 1 0 332.231 3.680 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])C1 ZINC000429208923 1129978854 /nfs/dbraw/zinc/97/88/54/1129978854.db2.gz BGQPZPYABDIEPE-JTQLQIEISA-N 1 0 332.231 3.680 20 5 EHBDRO CC[C@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000173212239 1130196948 /nfs/dbraw/zinc/19/69/48/1130196948.db2.gz BTBXBYQTRUUUIP-AWEZNQCLSA-N 1 0 349.337 3.552 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000245510738 1130224385 /nfs/dbraw/zinc/22/43/85/1130224385.db2.gz WVVZUPJNOFTLBZ-MORSLUCNSA-N 1 0 336.432 3.585 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[NH+](C(C)C)C(C)C ZINC000174355542 1130353372 /nfs/dbraw/zinc/35/33/72/1130353372.db2.gz XKNQAQDBVDFONU-UHFFFAOYSA-N 1 0 336.436 3.534 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731205593 1130778190 /nfs/dbraw/zinc/77/81/90/1130778190.db2.gz ARVAFOIWTMAXBJ-GFCCVEGCSA-N 1 0 334.445 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCCC4(CCCCC4)C3)c2c1 ZINC000732190370 1130892752 /nfs/dbraw/zinc/89/27/52/1130892752.db2.gz GVZHBMGDWHZZNY-UHFFFAOYSA-N 1 0 328.416 3.948 20 5 EHBDRO CCc1cccc(NC(=O)CNCc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000740007018 1131516235 /nfs/dbraw/zinc/51/62/35/1131516235.db2.gz QRLQYDOAHSRCLY-UHFFFAOYSA-N 1 0 347.802 3.539 20 5 EHBDRO C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000742431373 1131730175 /nfs/dbraw/zinc/73/01/75/1131730175.db2.gz XXSLUIYRFCBGOJ-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1F ZINC000742715068 1131784399 /nfs/dbraw/zinc/78/43/99/1131784399.db2.gz RAYZFNPIKSSNKM-SWLSCSKDSA-N 1 0 342.367 3.536 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cnc(Cl)s1)CC2 ZINC001172897230 1131880904 /nfs/dbraw/zinc/88/09/04/1131880904.db2.gz YGCQRCHKGRMJBH-GFCCVEGCSA-N 1 0 337.832 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCC1(O)CCCCC1)CC2 ZINC001172899528 1131882524 /nfs/dbraw/zinc/88/25/24/1131882524.db2.gz OAEITDBJUBCJSA-QGZVFWFLSA-N 1 0 332.444 3.517 20 5 EHBDRO C[C@H](Cc1cccc(O)c1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898447 1131882762 /nfs/dbraw/zinc/88/27/62/1131882762.db2.gz AYNONCFHJKZZHH-KDOFPFPSSA-N 1 0 340.423 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H](CO)CC1CCCCC1)CC2 ZINC001172901341 1131883668 /nfs/dbraw/zinc/88/36/68/1131883668.db2.gz MESWSWICLQAOAC-MOPGFXCFSA-N 1 0 346.471 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1c(F)cccc1F)CC2 ZINC001172901321 1131883780 /nfs/dbraw/zinc/88/37/80/1131883780.db2.gz HCUBOWMGCBMIDT-HNNXBMFYSA-N 1 0 346.377 3.953 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cncc(F)c1 ZINC001172900070 1131884178 /nfs/dbraw/zinc/88/41/78/1131884178.db2.gz BQCOUNWTKSYDDD-PXAZEXFGSA-N 1 0 329.375 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOC1CCCCC1)CC2 ZINC001172901694 1131885206 /nfs/dbraw/zinc/88/52/06/1131885206.db2.gz JGOOQTBJSZTORU-KRWDZBQOSA-N 1 0 332.444 3.781 20 5 EHBDRO C[C@H](COc1ccccc1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172902785 1131885711 /nfs/dbraw/zinc/88/57/11/1131885711.db2.gz MBYJISORDSSOMQ-QAPCUYQASA-N 1 0 340.423 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H](c1cccnc1)C1CC1)CC2 ZINC001172903230 1131886034 /nfs/dbraw/zinc/88/60/34/1131886034.db2.gz POXDQXFTCGMXHT-ICSRJNTNSA-N 1 0 337.423 3.978 20 5 EHBDRO C[N@H+](CC(=O)c1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918689 1131904007 /nfs/dbraw/zinc/90/40/07/1131904007.db2.gz CBIVEOBDTBXJOS-SFHVURJKSA-N 1 0 338.407 3.657 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172911312 1131917426 /nfs/dbraw/zinc/91/74/26/1131917426.db2.gz IIBRMRGPIRJTFN-RDTXWAMCSA-N 1 0 340.423 3.941 20 5 EHBDRO CC(C)[N@H+](C1CCOCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911606 1131918128 /nfs/dbraw/zinc/91/81/28/1131918128.db2.gz CWEGGNKRCDUKDB-QGZVFWFLSA-N 1 0 332.444 3.732 20 5 EHBDRO C[C@@H](CN1CCC(C)CC1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913496 1131918903 /nfs/dbraw/zinc/91/89/03/1131918903.db2.gz WJEOTRIREBCRGR-LPHOPBHVSA-N 1 0 345.487 3.552 20 5 EHBDRO C[N@H+](CC(C)(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018232 1131936840 /nfs/dbraw/zinc/93/68/40/1131936840.db2.gz PZEMTHWNGDCABP-UHFFFAOYSA-N 1 0 341.402 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](CC3CCC3)CC2)c(C(F)(F)F)c1 ZINC000743845469 1131989886 /nfs/dbraw/zinc/98/98/86/1131989886.db2.gz CTFQMKSSSVIIGI-UHFFFAOYSA-N 1 0 343.349 3.536 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2C[C@H]2c2ccccc2)c1F ZINC001173190570 1131994606 /nfs/dbraw/zinc/99/46/06/1131994606.db2.gz YTZPEULTTIGPDG-INWMFGNUSA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2C[C@@H]2c2ccccc2)c1F ZINC001173190569 1131995316 /nfs/dbraw/zinc/99/53/16/1131995316.db2.gz YTZPEULTTIGPDG-BJJXKVORSA-N 1 0 344.386 3.819 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2ccc(F)cc2C1 ZINC001173222919 1132005373 /nfs/dbraw/zinc/00/53/73/1132005373.db2.gz GBBXNGNCQFNVAG-ACJLOTCBSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC001173227026 1132006344 /nfs/dbraw/zinc/00/63/44/1132006344.db2.gz MEBNCYYYPTXAAE-TVRKMHQQSA-N 1 0 345.487 3.722 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cncc1-c1cccc(C[NH3+])c1 ZINC001173229645 1132008082 /nfs/dbraw/zinc/00/80/82/1132008082.db2.gz OKXIVWVFWHHJBH-CQSZACIVSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c(-c2ccccc2)cnc1C[NH3+] ZINC001173229166 1132008526 /nfs/dbraw/zinc/00/85/26/1132008526.db2.gz LSIKTYSMNFPHNO-CQSZACIVSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CSc2ccccc2C1 ZINC001173231110 1132009648 /nfs/dbraw/zinc/00/96/48/1132009648.db2.gz XLRBRFMYXJGITJ-CZUORRHYSA-N 1 0 328.437 3.832 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCc1cn(C)c2ccccc12 ZINC001173234428 1132009927 /nfs/dbraw/zinc/00/99/27/1132009927.db2.gz OQYCRCVZLDXMEN-HNNXBMFYSA-N 1 0 337.423 3.850 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)cn1 ZINC001173214484 1132015400 /nfs/dbraw/zinc/01/54/00/1132015400.db2.gz NXKRDZQJQSWWMA-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173213549 1132015446 /nfs/dbraw/zinc/01/54/46/1132015446.db2.gz GFOQYYLZURQKGN-KSSFIOAISA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1ccn2cc(C[N@@H+](C)[C@H](C)Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001173237751 1132026516 /nfs/dbraw/zinc/02/65/16/1132026516.db2.gz LYSXLJIXSRAALN-OAHLLOKOSA-N 1 0 338.411 3.614 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000744437181 1132093830 /nfs/dbraw/zinc/09/38/30/1132093830.db2.gz JNGPPJGCDCFSEH-HNNXBMFYSA-N 1 0 328.416 3.784 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cccnc1 ZINC001173856974 1132156179 /nfs/dbraw/zinc/15/61/79/1132156179.db2.gz LUWYGGMBYJUGEA-UHFFFAOYSA-N 1 0 330.391 3.639 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1ccccc1)C1CC1 ZINC000746123459 1132379101 /nfs/dbraw/zinc/37/91/01/1132379101.db2.gz NLRVITPVKVMFSC-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)[C@]12C[C@H]1CCCC2 ZINC001175293074 1132615932 /nfs/dbraw/zinc/61/59/32/1132615932.db2.gz XEGRMQMKKCHWRT-CLCXKQKWSA-N 1 0 345.443 3.790 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]C2(c3ccccc3C(F)(F)F)CC2)C1 ZINC001168977420 1132617362 /nfs/dbraw/zinc/61/73/62/1132617362.db2.gz JQGFSHUEVMVSAU-RYUDHWBXSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001168965925 1132621570 /nfs/dbraw/zinc/62/15/70/1132621570.db2.gz DMZWPERZBNKMRU-GHMZBOCLSA-N 1 0 336.741 3.894 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1F ZINC001168986237 1132625150 /nfs/dbraw/zinc/62/51/50/1132625150.db2.gz XGQMLEIAQVXUFH-SCVCMEIPSA-N 1 0 345.212 3.684 20 5 EHBDRO COc1cccc2c1CC[C@H](CCC[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169006852 1132630138 /nfs/dbraw/zinc/63/01/38/1132630138.db2.gz ZLSLWNITDCDARV-JZXOWHBKSA-N 1 0 346.471 3.615 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(n3ccc4ccccc43)CC2)C1 ZINC001169036536 1132637229 /nfs/dbraw/zinc/63/72/29/1132637229.db2.gz GKVOCDFBUNXKPS-CRAIPNDOSA-N 1 0 327.428 3.724 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(Oc3cccc(Cl)c3)CC2)C1 ZINC001169023867 1132640011 /nfs/dbraw/zinc/64/00/11/1132640011.db2.gz FYEXZXNOQFOOQL-UKRRQHHQSA-N 1 0 338.835 3.629 20 5 EHBDRO CC1(C)C[C@@H](Nc2cc(F)cc(F)c2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169141598 1132674072 /nfs/dbraw/zinc/67/40/72/1132674072.db2.gz CLIOPDFPTZWSAT-BZNIZROVSA-N 1 0 327.375 3.829 20 5 EHBDRO C[N@@H+]1CC[C@@H]2CC[C@H](C1)N2Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC001176069757 1132827710 /nfs/dbraw/zinc/82/77/10/1132827710.db2.gz LLDJBGSUPGPHKU-QWHCGFSZSA-N 1 0 344.242 3.570 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761572 1133048203 /nfs/dbraw/zinc/04/82/03/1133048203.db2.gz BGMBBGSIXKPNTB-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCc3ccc(O)cc3CC2)ccc1Cl ZINC000768542283 1133152720 /nfs/dbraw/zinc/15/27/20/1133152720.db2.gz TUPJGEQDIBQTTE-UHFFFAOYSA-N 1 0 332.787 3.555 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768540715 1133153237 /nfs/dbraw/zinc/15/32/37/1133153237.db2.gz CGWOTIVVLBPYSR-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO CCO[C@@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001178326687 1133160030 /nfs/dbraw/zinc/16/00/30/1133160030.db2.gz OVZHWJVVZWEDRV-HUUCEWRRSA-N 1 0 326.824 3.728 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@H]1C1CC1 ZINC000769331655 1133263410 /nfs/dbraw/zinc/26/34/10/1133263410.db2.gz VVUZHVQKGNHOCT-ZDUSSCGKSA-N 1 0 325.206 3.732 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+]Cc2c3ccccc3cc3ccccc32)c1 ZINC000769424899 1133280808 /nfs/dbraw/zinc/28/08/08/1133280808.db2.gz XZMIFFLLQNYREJ-UHFFFAOYSA-N 1 0 346.390 3.888 20 5 EHBDRO CCCCOc1ccccc1CN(CC[NH3+])c1ccccc1[N+](=O)[O-] ZINC001181556041 1133500378 /nfs/dbraw/zinc/50/03/78/1133500378.db2.gz SAPDJKBUNDUUEV-UHFFFAOYSA-N 1 0 343.427 3.739 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC2CCOCC2)C1 ZINC001183560897 1133824220 /nfs/dbraw/zinc/82/42/20/1133824220.db2.gz JJDWPKSTJUUGRR-OQLLNIDSSA-N 1 0 330.428 3.747 20 5 EHBDRO CC[NH+](CC)CCSc1cccc(Br)c1[N+](=O)[O-] ZINC000820670402 1133850290 /nfs/dbraw/zinc/85/02/90/1133850290.db2.gz OAOQKDQZIJLHIF-UHFFFAOYSA-N 1 0 333.251 3.791 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccc(F)cc1)[NH+](C)C ZINC000786583038 1133870679 /nfs/dbraw/zinc/87/06/79/1133870679.db2.gz LIIWHQOUSOIGRA-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000786812688 1133910698 /nfs/dbraw/zinc/91/06/98/1133910698.db2.gz IVQSRTQAXQOYDP-SDNWHVSQSA-N 1 0 341.367 3.739 20 5 EHBDRO C[C@H](OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877273 1133915304 /nfs/dbraw/zinc/91/53/04/1133915304.db2.gz CDKQUPUZLPHLKS-SUMWQHHRSA-N 1 0 332.400 3.606 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000774844129 1134052464 /nfs/dbraw/zinc/05/24/64/1134052464.db2.gz RWSYVJYEXZKYFZ-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO Nc1ccc([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCCCC2)c1 ZINC000787895206 1134055960 /nfs/dbraw/zinc/05/59/60/1134055960.db2.gz SLBAYTCNNOQYMX-UHFFFAOYSA-N 1 0 340.427 3.775 20 5 EHBDRO C[C@@H]1C[C@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC001185775486 1134131763 /nfs/dbraw/zinc/13/17/63/1134131763.db2.gz QERDDIRMVBMERO-KOLCDFICSA-N 1 0 329.322 3.651 20 5 EHBDRO C[C@H]1C[C@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC001185775488 1134131860 /nfs/dbraw/zinc/13/18/60/1134131860.db2.gz QERDDIRMVBMERO-ONGXEEELSA-N 1 0 329.322 3.651 20 5 EHBDRO C[C@H]([NH2+]CCSCc1ccccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788506039 1134133078 /nfs/dbraw/zinc/13/30/78/1134133078.db2.gz UXKOCCNUFVIQGD-LBPRGKRZSA-N 1 0 349.431 3.900 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804996 1134172093 /nfs/dbraw/zinc/17/20/93/1134172093.db2.gz ZTVNEGCXUQXELO-LLVKDONJSA-N 1 0 342.374 3.691 20 5 EHBDRO CCO[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788772830 1134173802 /nfs/dbraw/zinc/17/38/02/1134173802.db2.gz BIJBGHUJPVTSAC-FZKQIMNGSA-N 1 0 329.400 3.605 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001187081681 1134296479 /nfs/dbraw/zinc/29/64/79/1134296479.db2.gz OTRRHGQOGIIJEC-HNNXBMFYSA-N 1 0 340.427 3.962 20 5 EHBDRO Cc1c(C[NH2+]C2CCC(O)(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000790693488 1134453850 /nfs/dbraw/zinc/45/38/50/1134453850.db2.gz CKVQEYOAXJDFGQ-UHFFFAOYSA-N 1 0 340.423 3.823 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC001170312734 1134744951 /nfs/dbraw/zinc/74/49/51/1134744951.db2.gz HKYMTPVXIKXUGN-XIKOKIGWSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCc3ccncc32)c([N+](=O)[O-])c1 ZINC001170325837 1134748062 /nfs/dbraw/zinc/74/80/62/1134748062.db2.gz AMJKJBIBVHYDRI-UGSOOPFHSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329061 1134749295 /nfs/dbraw/zinc/74/92/95/1134749295.db2.gz NVNNDWBXFAZDSU-KDOFPFPSSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170308750 1134753323 /nfs/dbraw/zinc/75/33/23/1134753323.db2.gz OIKWKGLDZGXQAK-STQMWFEESA-N 1 0 330.384 3.591 20 5 EHBDRO CC[NH+](CC)CCN(Cc1ccc([N+](=O)[O-])c(F)c1)CC(C)C ZINC001191435853 1134866407 /nfs/dbraw/zinc/86/64/07/1134866407.db2.gz JLUKETRZAGOVPN-UHFFFAOYSA-N 1 0 325.428 3.534 20 5 EHBDRO C[N@H+](CCN(Cc1cccc([N+](=O)[O-])c1)C1CC1)Cc1ccccc1 ZINC001191681524 1134898373 /nfs/dbraw/zinc/89/83/73/1134898373.db2.gz BWKBYVNCSVWRQN-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO C[C@@H](CCNC(=O)OC(C)(C)C)[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000793598712 1134967012 /nfs/dbraw/zinc/96/70/12/1134967012.db2.gz BFWBNGSOPYSBCP-KGXGESDWSA-N 1 0 349.431 3.501 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000775539436 1135038952 /nfs/dbraw/zinc/03/89/52/1135038952.db2.gz LOCBASNONYCRCQ-OALUTQOASA-N 1 0 328.412 3.986 20 5 EHBDRO C[C@@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000804606402 1135136083 /nfs/dbraw/zinc/13/60/83/1135136083.db2.gz LPUBJPMEHXKOHB-OLZOCXBDSA-N 1 0 348.403 3.568 20 5 EHBDRO CCCCO[C@H]1C[C@@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1(C)C ZINC001194190027 1135241281 /nfs/dbraw/zinc/24/12/81/1135241281.db2.gz JDDQCCXHHOTNDL-SJORKVTESA-N 1 0 336.432 3.677 20 5 EHBDRO C[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@H+](Cc2ccccc2)C1 ZINC001194394960 1135263588 /nfs/dbraw/zinc/26/35/88/1135263588.db2.gz XLNQAVSSBGFOFQ-OAHLLOKOSA-N 1 0 345.468 3.610 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000805840169 1135333793 /nfs/dbraw/zinc/33/37/93/1135333793.db2.gz MMTQTRMJJPTKFD-HOCLYGCPSA-N 1 0 332.425 3.773 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1cc2ccccc2[nH]1 ZINC000775625723 1135347063 /nfs/dbraw/zinc/34/70/63/1135347063.db2.gz CYYKSXLHEMLMJG-GFCCVEGCSA-N 1 0 325.368 3.936 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1 ZINC000775629700 1135354509 /nfs/dbraw/zinc/35/45/09/1135354509.db2.gz WKSLMLATZRGUDA-CYBMUJFWSA-N 1 0 325.368 3.806 20 5 EHBDRO CCC[N@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C(C)C ZINC001195595313 1135439871 /nfs/dbraw/zinc/43/98/71/1135439871.db2.gz AUABJLIQJOEYIU-UHFFFAOYSA-N 1 0 346.374 3.868 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000775684037 1135504946 /nfs/dbraw/zinc/50/49/46/1135504946.db2.gz WFYALWGCWJDYEP-MDZLAQPJSA-N 1 0 339.823 3.601 20 5 EHBDRO CC1(C)CCC[C@](CO)([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001196219483 1135534055 /nfs/dbraw/zinc/53/40/55/1135534055.db2.gz YQBZILIHYXLWTF-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(Cl)cc1 ZINC001197661012 1135717486 /nfs/dbraw/zinc/71/74/86/1135717486.db2.gz SHQSGYWIWRNVEL-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@@H]1C[C@H](C)CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001197891592 1135747364 /nfs/dbraw/zinc/74/73/64/1135747364.db2.gz ORUIFHQRCBXHEW-VXGBXAGGSA-N 1 0 339.823 3.555 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000809355129 1135823582 /nfs/dbraw/zinc/82/35/82/1135823582.db2.gz MADISZRGULTFSH-GFCCVEGCSA-N 1 0 327.375 3.701 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C2CCCC2)C1 ZINC001198707218 1135851783 /nfs/dbraw/zinc/85/17/83/1135851783.db2.gz SRNCGIFDTBMSOU-HOCLYGCPSA-N 1 0 345.443 3.824 20 5 EHBDRO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCc1ccccc1[N+](=O)[O-] ZINC000809689321 1135872024 /nfs/dbraw/zinc/87/20/24/1135872024.db2.gz XPMSDRWAVJGPJO-TWGQIWQCSA-N 1 0 341.367 3.691 20 5 EHBDRO CO[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[C@@H]1C ZINC000809984859 1135908530 /nfs/dbraw/zinc/90/85/30/1135908530.db2.gz AYXNAZUUHMNPBW-ZANVPECISA-N 1 0 333.215 3.758 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006293 1135913031 /nfs/dbraw/zinc/91/30/31/1135913031.db2.gz IONOOZLGSUXEGB-FUHWJXTLSA-N 1 0 345.830 3.783 20 5 EHBDRO Cc1cc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cnc1Cl ZINC001201693705 1136057401 /nfs/dbraw/zinc/05/74/01/1136057401.db2.gz PRVVGRGOVOWIDW-UHFFFAOYSA-N 1 0 340.210 3.937 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCCC[C@@H]1O ZINC000811480847 1136097497 /nfs/dbraw/zinc/09/74/97/1136097497.db2.gz IBKAHRZSDRZNSD-RNCFNFMXSA-N 1 0 333.215 3.542 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000776253676 1136102464 /nfs/dbraw/zinc/10/24/64/1136102464.db2.gz NTUIXWSWFNSLCP-AEFFLSMTSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H](c1cc(F)ccc1F)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276599 1136130948 /nfs/dbraw/zinc/13/09/48/1136130948.db2.gz KUIQHEYPXLVLRI-GTNSWQLSSA-N 1 0 336.338 3.599 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2CCc2ccccc2)cc1 ZINC000776279049 1136133855 /nfs/dbraw/zinc/13/38/55/1136133855.db2.gz WYKOBLSYIXTKMK-AZUAARDMSA-N 1 0 340.423 3.725 20 5 EHBDRO CC(C)(C)c1ccc(CC[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776279147 1136134873 /nfs/dbraw/zinc/13/48/73/1136134873.db2.gz XLNFZEDSEKFIDE-IBGZPJMESA-N 1 0 342.439 3.758 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(-n2c(-c3ccccc3)cnc2[C@H](C)[NH3+])c1F ZINC001170686320 1136247439 /nfs/dbraw/zinc/24/74/39/1136247439.db2.gz OQKQVUZLOKPUFY-LBPRGKRZSA-N 1 0 340.358 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)cc1 ZINC000776582458 1136442415 /nfs/dbraw/zinc/44/24/15/1136442415.db2.gz UQSAUXLICLMWSP-XLIONFOSSA-N 1 0 340.423 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000776585583 1136448356 /nfs/dbraw/zinc/44/83/56/1136448356.db2.gz XGDVTUKERJCZNV-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO Cc1cccc(C2=CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000776596975 1136457663 /nfs/dbraw/zinc/45/76/63/1136457663.db2.gz BJICVOZIMAOMEV-HXUWFJFHSA-N 1 0 338.407 3.726 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597665 1136459380 /nfs/dbraw/zinc/45/93/80/1136459380.db2.gz JRQSRFKYPXMKRF-VPZZIHKRSA-N 1 0 344.386 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccn2)cc1 ZINC000852567110 1136467033 /nfs/dbraw/zinc/46/70/33/1136467033.db2.gz MPJZVHPROPNRIO-APWZRJJASA-N 1 0 325.412 3.533 20 5 EHBDRO CN(Cc1cc([N+](=O)[O-])ccc1Cl)Cc1cccc2c1CC[NH2+]C2 ZINC000852745689 1136482934 /nfs/dbraw/zinc/48/29/34/1136482934.db2.gz WYWSNNIUUISUKH-UHFFFAOYSA-N 1 0 345.830 3.526 20 5 EHBDRO Cc1cccc2c1CCC[C@H]2[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000853126081 1136512449 /nfs/dbraw/zinc/51/24/49/1136512449.db2.gz AHALUVLNYBODHI-MOPGFXCFSA-N 1 0 326.396 3.604 20 5 EHBDRO Cc1ccc2c(c1)C[N@@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C2 ZINC000815186722 1136563605 /nfs/dbraw/zinc/56/36/05/1136563605.db2.gz XBGJVTQPLYRKSI-IBGZPJMESA-N 1 0 340.423 3.774 20 5 EHBDRO Cn1ncc2c1CC(C)(C)CN(Cc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000854059057 1136584242 /nfs/dbraw/zinc/58/42/42/1136584242.db2.gz ZATUMMAPKXLXSN-UHFFFAOYSA-N 1 0 348.834 3.566 20 5 EHBDRO Cn1ncc2c1CC(C)(C)CN(Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000854058897 1136584320 /nfs/dbraw/zinc/58/43/20/1136584320.db2.gz VYQXVHAZPWWGPT-UHFFFAOYSA-N 1 0 348.834 3.566 20 5 EHBDRO Cc1cc(Cl)c(C(=O)OCC[C@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000815405707 1136592639 /nfs/dbraw/zinc/59/26/39/1136592639.db2.gz GLUSLVZYABPPFM-GFCCVEGCSA-N 1 0 340.807 3.588 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815572691 1136617952 /nfs/dbraw/zinc/61/79/52/1136617952.db2.gz KPVLUXKNJZNMQF-ZDUSSCGKSA-N 1 0 341.411 3.568 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776752132 1136634628 /nfs/dbraw/zinc/63/46/28/1136634628.db2.gz ISUITBWLGWBVMB-DZKIICNBSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000776816420 1136707055 /nfs/dbraw/zinc/70/70/55/1136707055.db2.gz RRZVSGOMBMMOPG-MEDUHNTESA-N 1 0 343.408 3.589 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCCC[C@H]1C ZINC000339002304 1136844929 /nfs/dbraw/zinc/84/49/29/1136844929.db2.gz KQMWYBSRTFEJKY-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1N[C@@H](c1ccccc1)C(F)(F)F)C[NH2+]C2 ZINC001170883807 1136849130 /nfs/dbraw/zinc/84/91/30/1136849130.db2.gz QLKNLODBJPBTAC-HNNXBMFYSA-N 1 0 337.301 3.914 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819138082 1136912402 /nfs/dbraw/zinc/91/24/02/1136912402.db2.gz LWIQJDGCGBENPN-ZUSMLRIVSA-N 1 0 344.386 3.681 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819151033 1136913919 /nfs/dbraw/zinc/91/39/19/1136913919.db2.gz VQHJCJSTSDXEOP-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000819282480 1136927728 /nfs/dbraw/zinc/92/77/28/1136927728.db2.gz GJVCCLNPNRFLPL-ZVZYQTTQSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333738 1136932196 /nfs/dbraw/zinc/93/21/96/1136932196.db2.gz REAOCOISQOVEML-ROUUACIJSA-N 1 0 348.349 3.574 20 5 EHBDRO Cc1ccc(C2(C[NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000819339051 1136932742 /nfs/dbraw/zinc/93/27/42/1136932742.db2.gz KBVLBHIVHPTUCR-IBGZPJMESA-N 1 0 340.423 3.566 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)nc1 ZINC000858040798 1136934497 /nfs/dbraw/zinc/93/44/97/1136934497.db2.gz QGEJQCXSUFLQPN-RDJZCZTQSA-N 1 0 341.411 3.821 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ccnc(Cl)c2F)cc1 ZINC000823955428 1137119203 /nfs/dbraw/zinc/11/92/03/1137119203.db2.gz LCWCRHLLTIODNH-UHFFFAOYSA-N 1 0 337.782 3.895 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC[C@@H]1CCCOC1 ZINC000862432911 1137144315 /nfs/dbraw/zinc/14/43/15/1137144315.db2.gz FKWAWKUKOHWKKX-JTQLQIEISA-N 1 0 333.215 3.808 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000862483468 1137146728 /nfs/dbraw/zinc/14/67/28/1137146728.db2.gz UPRYHHFOWAQTDM-AQDCRGGLSA-N 1 0 338.407 3.592 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000824798233 1137152858 /nfs/dbraw/zinc/15/28/58/1137152858.db2.gz ACBNPYFEJVQBBT-BLLLJJGKSA-N 1 0 326.824 3.789 20 5 EHBDRO CCCCC[C@H]1CCCN1Cn1c(=O)oc2cccc([N+](=O)[O-])c21 ZINC000794631450 1137221786 /nfs/dbraw/zinc/22/17/86/1137221786.db2.gz AVGCYAUGQSCQCD-ZDUSSCGKSA-N 1 0 333.388 3.505 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567284 1137295734 /nfs/dbraw/zinc/29/57/34/1137295734.db2.gz HKFVZVIZGOGWSX-LBPRGKRZSA-N 1 0 327.375 3.701 20 5 EHBDRO COc1ccc(C[NH2+]C2CCC(OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000865697989 1137305074 /nfs/dbraw/zinc/30/50/74/1137305074.db2.gz FSLWYRHKDIPPNX-UHFFFAOYSA-N 1 0 336.432 3.819 20 5 EHBDRO C[C@]1(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C[C@@]1(F)Cl ZINC000846185582 1137340498 /nfs/dbraw/zinc/34/04/98/1137340498.db2.gz SNIBEEDOHFGMAR-UXOAXIEHSA-N 1 0 344.818 3.569 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](CCCO)c1ccccc1 ZINC000866271744 1137341611 /nfs/dbraw/zinc/34/16/11/1137341611.db2.gz PHLAXYZRGZFYPI-KSSFIOAISA-N 1 0 346.402 3.768 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1(CCO)CCCCC1 ZINC000866280629 1137342396 /nfs/dbraw/zinc/34/23/96/1137342396.db2.gz XDZWYMIVAVXVGH-CQSZACIVSA-N 1 0 338.423 3.587 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1 ZINC000866348116 1137348122 /nfs/dbraw/zinc/34/81/22/1137348122.db2.gz ZPZRNBNTWHUNBJ-SRVKXCTJSA-N 1 0 349.410 3.647 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC23CCOCC3)cc1[N+](=O)[O-] ZINC000866528783 1137361423 /nfs/dbraw/zinc/36/14/23/1137361423.db2.gz JYAVZEAZZRDVIP-GOEBONIOSA-N 1 0 348.443 3.851 20 5 EHBDRO COc1ccc2c(c1F)CC[C@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866539586 1137363054 /nfs/dbraw/zinc/36/30/54/1137363054.db2.gz DGNIYWAAKYQXRK-OAHLLOKOSA-N 1 0 330.359 3.828 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CCCO2 ZINC000866541324 1137363110 /nfs/dbraw/zinc/36/31/10/1137363110.db2.gz YKQKFCZXSDTFMK-QGZVFWFLSA-N 1 0 342.395 3.915 20 5 EHBDRO COc1cccc2c1OCCC[C@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540467 1137363256 /nfs/dbraw/zinc/36/32/56/1137363256.db2.gz OTEFHJOTEXUQMY-MRXNPFEDSA-N 1 0 342.395 3.915 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@H]1COc2cccc(OC)c2C1 ZINC001171312725 1137410862 /nfs/dbraw/zinc/41/08/62/1137410862.db2.gz IIBCVGFDQLPODD-QGZVFWFLSA-N 1 0 341.475 3.707 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000715138460 1137476230 /nfs/dbraw/zinc/47/62/30/1137476230.db2.gz UVAGRAGAKPIUBG-KCQAQPDRSA-N 1 0 349.431 3.549 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000715136098 1137476281 /nfs/dbraw/zinc/47/62/81/1137476281.db2.gz HUJGRDXJHQJXNC-MCIONIFRSA-N 1 0 349.431 3.549 20 5 EHBDRO C[NH+](C)C1CCC(Nc2cccc(Br)c2[N+](=O)[O-])CC1 ZINC000715569738 1137477338 /nfs/dbraw/zinc/47/73/38/1137477338.db2.gz LECDODKINQQBPZ-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCc1c[nH]nc1C ZINC000872019864 1137565022 /nfs/dbraw/zinc/56/50/22/1137565022.db2.gz ATEUMQFJFRCJSD-GFCCVEGCSA-N 1 0 334.445 3.632 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1CO ZINC000872028700 1137566180 /nfs/dbraw/zinc/56/61/80/1137566180.db2.gz SCCROUDPHRFGLE-GFCCVEGCSA-N 1 0 332.425 3.660 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](CO)c1ccccc1 ZINC000872038947 1137566893 /nfs/dbraw/zinc/56/68/93/1137566893.db2.gz BTZXDCLDAVEOMN-ZFWWWQNUSA-N 1 0 346.452 3.743 20 5 EHBDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872071394 1137569610 /nfs/dbraw/zinc/56/96/10/1137569610.db2.gz OLXMXHOWNFZBJX-FHSNZYRGSA-N 1 0 332.375 3.815 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075571 1137569973 /nfs/dbraw/zinc/56/99/73/1137569973.db2.gz DUPCUFBTPUFACD-QEORTHHSSA-N 1 0 345.374 3.700 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872088465 1137570561 /nfs/dbraw/zinc/57/05/61/1137570561.db2.gz OWXBWGBOBUASNS-IIYDPXPESA-N 1 0 332.375 3.549 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1c2ccccc2CN1C)c1c(F)cccc1[N+](=O)[O-] ZINC000872091966 1137570932 /nfs/dbraw/zinc/57/09/32/1137570932.db2.gz KRQJEEJQUOAXAH-YVEFUNNKSA-N 1 0 329.375 3.571 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129775 1137573177 /nfs/dbraw/zinc/57/31/77/1137573177.db2.gz RXBVVVFJLLTSGN-GJZGRUSLSA-N 1 0 341.411 3.971 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2C[C@H](Sc3ccccc3)C2)cc1 ZINC000872224605 1137576070 /nfs/dbraw/zinc/57/60/70/1137576070.db2.gz GLDINVFUCHWBSW-ZTFGCOKTSA-N 1 0 344.436 3.541 20 5 EHBDRO Cc1c(C[NH2+][C@@H](c2ccccc2)[C@@H](O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138763 1137591154 /nfs/dbraw/zinc/59/11/54/1137591154.db2.gz MPVLWTWLLQXQRF-OALUTQOASA-N 1 0 328.412 3.751 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cc(N)cc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000873288602 1137596459 /nfs/dbraw/zinc/59/64/59/1137596459.db2.gz JHBSDZJMMHPILD-KRWDZBQOSA-N 1 0 329.375 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C[NH+](C)C)cc1 ZINC000873929683 1137608191 /nfs/dbraw/zinc/60/81/91/1137608191.db2.gz CIGPRHPPMQHHET-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124848774 1137611140 /nfs/dbraw/zinc/61/11/40/1137611140.db2.gz VGWVFTCNMXKBMF-ROUUACIJSA-N 1 0 332.375 3.898 20 5 EHBDRO CC(C)[C@@H](C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876919804 1137665268 /nfs/dbraw/zinc/66/52/68/1137665268.db2.gz ZAWMNWARQCIHJL-LEOMRAHMSA-N 1 0 328.416 3.524 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(Cl)cc1 ZINC000876922413 1137665383 /nfs/dbraw/zinc/66/53/83/1137665383.db2.gz YHXUPDILYXICCX-XUJLQICISA-N 1 0 334.807 3.889 20 5 EHBDRO CC(C)(C)[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876928188 1137665476 /nfs/dbraw/zinc/66/54/76/1137665476.db2.gz WJPJXEOLKZASLC-DQPZFDDXSA-N 1 0 328.416 3.872 20 5 EHBDRO CC(C)c1ccc(C[C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877117845 1137670607 /nfs/dbraw/zinc/67/06/07/1137670607.db2.gz ZSYJGZHEVWFAKK-NNGSBXSVSA-N 1 0 342.443 3.839 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3C[C@H](c4ccc(Cl)cc4)C3)C2)c1 ZINC000877494109 1137678406 /nfs/dbraw/zinc/67/84/06/1137678406.db2.gz STPLUZLTRBXEJI-YCVWASFZSA-N 1 0 346.818 3.684 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000877797518 1137690186 /nfs/dbraw/zinc/69/01/86/1137690186.db2.gz WGRMGYJVAMTLQV-HNNXBMFYSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH+]2CCCCCC2)o1 ZINC000877942723 1137696479 /nfs/dbraw/zinc/69/64/79/1137696479.db2.gz OIERQJBKBZOUGW-UHFFFAOYSA-N 1 0 336.779 3.674 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878447312 1137716412 /nfs/dbraw/zinc/71/64/12/1137716412.db2.gz LKKDUMIJSFZSMP-YRGRVCCFSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699153 1137725564 /nfs/dbraw/zinc/72/55/64/1137725564.db2.gz NYOQHZFUAZQRBJ-SJKOYZFVSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499530 1137749339 /nfs/dbraw/zinc/74/93/39/1137749339.db2.gz XVTKUSFISZLCQM-GOEBONIOSA-N 1 0 338.411 3.535 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2cc3cnccc3o2)ccc1[N+](=O)[O-] ZINC000879715293 1137756432 /nfs/dbraw/zinc/75/64/32/1137756432.db2.gz TZAPEOJLULRWHQ-LBPRGKRZSA-N 1 0 341.367 3.986 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000880316350 1137774704 /nfs/dbraw/zinc/77/47/04/1137774704.db2.gz DXOFQYBDETVKKM-ZDUSSCGKSA-N 1 0 347.440 3.828 20 5 EHBDRO CO[C@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000883263140 1137851271 /nfs/dbraw/zinc/85/12/71/1137851271.db2.gz IYSGJCAEWBZCNW-NNUKFRKNSA-N 1 0 332.425 3.838 20 5 EHBDRO O=S1(=O)CCC[C@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000131693430 1137859234 /nfs/dbraw/zinc/85/92/34/1137859234.db2.gz JNJSFHRPOCLXIY-KRWDZBQOSA-N 1 0 339.460 3.660 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccccc2OC)cc1[N+](=O)[O-] ZINC000103483936 1137876521 /nfs/dbraw/zinc/87/65/21/1137876521.db2.gz RKBQVXVTAXKQQA-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000800186369 1137901569 /nfs/dbraw/zinc/90/15/69/1137901569.db2.gz JZFKOGPLTCINDV-UHFFFAOYSA-N 1 0 348.321 3.502 20 5 EHBDRO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824703 1137922084 /nfs/dbraw/zinc/92/20/84/1137922084.db2.gz QAKPTFDMNZWLRR-CXAGYDPISA-N 1 0 328.416 3.843 20 5 EHBDRO C[C@H]1SCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000118417391 1137933707 /nfs/dbraw/zinc/93/37/07/1137933707.db2.gz XCGZTMJVADXCBW-QWHCGFSZSA-N 1 0 347.440 3.618 20 5 EHBDRO O[C@@H]1CC[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)CC[C@@H]1O ZINC000886257779 1138062572 /nfs/dbraw/zinc/06/25/72/1138062572.db2.gz LEAJMKNNDCSFAO-NYYNZRKLSA-N 1 0 335.447 3.747 20 5 EHBDRO Cc1nc(C2CC[NH+]([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886665541 1138111376 /nfs/dbraw/zinc/11/13/76/1138111376.db2.gz AOTVICFYYZIKLV-AWEZNQCLSA-N 1 0 328.416 3.875 20 5 EHBDRO C[C@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000886707613 1138120414 /nfs/dbraw/zinc/12/04/14/1138120414.db2.gz MGMYBSFQZSLCBK-MAUKXSAKSA-N 1 0 348.443 3.611 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@H]2C)O1)c1cccc([N+](=O)[O-])c1 ZINC000886771909 1138137550 /nfs/dbraw/zinc/13/75/50/1138137550.db2.gz PSKYXSHSYBZREI-CSJNCLCHSA-N 1 0 348.443 3.608 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(c3ccc(F)cc3F)CCOCC2)c1 ZINC000089803177 1138205728 /nfs/dbraw/zinc/20/57/28/1138205728.db2.gz RUTTYPLSEWMTRQ-UHFFFAOYSA-N 1 0 348.349 3.669 20 5 EHBDRO NC(=O)N1CCC[N@H+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000092754161 1138231835 /nfs/dbraw/zinc/23/18/35/1138231835.db2.gz YFFOXDQDCMQZBJ-UHFFFAOYSA-N 1 0 333.435 3.579 20 5 EHBDRO C[NH+](C)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466771 1138309566 /nfs/dbraw/zinc/30/95/66/1138309566.db2.gz BTFAVUIDFLIGMK-AWEZNQCLSA-N 1 0 345.468 3.707 20 5 EHBDRO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000125516832 1138311048 /nfs/dbraw/zinc/31/10/48/1138311048.db2.gz IQKPIYYNIPLXTH-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO CCC[C@H]([NH2+]CC[S@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424385 1138357227 /nfs/dbraw/zinc/35/72/27/1138357227.db2.gz TZWCMGNELWAFEP-OYHNWAKOSA-N 1 0 326.462 3.573 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152567715 1139098940 /nfs/dbraw/zinc/09/89/40/1139098940.db2.gz DLFSYRJRHSKTGE-HZPDHXFCSA-N 1 0 325.412 3.772 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743888 1139106805 /nfs/dbraw/zinc/10/68/05/1139106805.db2.gz NXZPLSONPVDFBG-YVEFUNNKSA-N 1 0 348.374 3.517 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccccc2CC[NH+](C)C)c1C ZINC000890118023 1139312707 /nfs/dbraw/zinc/31/27/07/1139312707.db2.gz DTTDRHCEFZACEL-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174478293 1139423441 /nfs/dbraw/zinc/42/34/41/1139423441.db2.gz MNUYJVADMNDZDL-MRXNPFEDSA-N 1 0 347.462 3.802 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000177361652 1139615610 /nfs/dbraw/zinc/61/56/10/1139615610.db2.gz VJYCIHDOBBCUKV-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000177605978 1139629077 /nfs/dbraw/zinc/62/90/77/1139629077.db2.gz CAYWDCYTRFLJKZ-KXBFYZLASA-N 1 0 348.443 3.706 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(CO)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000178564093 1139704871 /nfs/dbraw/zinc/70/48/71/1139704871.db2.gz RKPLBUGCWWTDTD-GOSISDBHSA-N 1 0 332.375 3.857 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181456575 1139907515 /nfs/dbraw/zinc/90/75/15/1139907515.db2.gz XCCWITFNBDFPRB-HYVNUMGLSA-N 1 0 336.457 3.690 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000181833149 1139935158 /nfs/dbraw/zinc/93/51/58/1139935158.db2.gz RDFULKBXYOFDRC-LLVKDONJSA-N 1 0 334.397 3.602 20 5 EHBDRO CC[C@H]([NH2+]CC1CCC2(CC1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000190326443 1140399181 /nfs/dbraw/zinc/39/91/81/1140399181.db2.gz YMHWFTKJCRPIBH-KRWDZBQOSA-N 1 0 334.416 3.569 20 5 EHBDRO C[C@@H]1CSCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000190848416 1140421310 /nfs/dbraw/zinc/42/13/10/1140421310.db2.gz AEMSJYNWRJMCDZ-LBPRGKRZSA-N 1 0 349.481 3.903 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000192376937 1140526969 /nfs/dbraw/zinc/52/69/69/1140526969.db2.gz FFRLWRDJCZEOSH-HKUYNNGSSA-N 1 0 326.396 3.771 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192887826 1140554056 /nfs/dbraw/zinc/55/40/56/1140554056.db2.gz PHTJRSFCLMEBOC-WBVHZDCISA-N 1 0 332.425 3.531 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000193347510 1140572585 /nfs/dbraw/zinc/57/25/85/1140572585.db2.gz VYPYWLUPMUCEGL-LJQANCHMSA-N 1 0 342.395 3.853 20 5 EHBDRO Cc1sc(C(=O)Nc2cc(C)cc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000270405884 1141218243 /nfs/dbraw/zinc/21/82/43/1141218243.db2.gz XTSRZTIXHYKZMU-UHFFFAOYSA-N 1 0 333.413 3.587 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]CCc2ccccc2[N+](=O)[O-])CC1 ZINC000271080870 1141305520 /nfs/dbraw/zinc/30/55/20/1141305520.db2.gz WAOOTDSJLIUPJG-UHFFFAOYSA-N 1 0 348.443 3.627 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000271129504 1141312289 /nfs/dbraw/zinc/31/22/89/1141312289.db2.gz LLILJUMXISVDLZ-LIRRHRJNSA-N 1 0 344.411 3.552 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(CO)c1 ZINC000272700829 1141421644 /nfs/dbraw/zinc/42/16/44/1141421644.db2.gz YNGRMLQIFWNSBG-LBPRGKRZSA-N 1 0 334.803 3.634 20 5 EHBDRO CC(C)OC(=O)C[C@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275499 1141492170 /nfs/dbraw/zinc/49/21/70/1141492170.db2.gz BYVYDFNBGKKQDA-HUUCEWRRSA-N 1 0 334.416 3.710 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C\c2ccc3c(cccc3[N+](=O)[O-])n2)s1 ZINC000349113696 1141641338 /nfs/dbraw/zinc/64/13/38/1141641338.db2.gz STKYXEVTJDWZQX-CLFYSBASSA-N 1 0 340.408 3.832 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cccc(-c2nccn2C)c1 ZINC000359866639 201114921 /nfs/dbraw/zinc/11/49/21/201114921.db2.gz JDIFSMOLWBZSLO-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO c1cnc2c(c1)ccc1ccc(N3CC4(C3)CC[N@@H+](CC3CC3)C4)nc12 ZINC001164769224 721283421 /nfs/dbraw/zinc/28/34/21/721283421.db2.gz PZPCCDZHGLJRCL-UHFFFAOYSA-N 1 0 344.462 3.705 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1 ZINC000558465429 1014562018 /nfs/dbraw/zinc/56/20/18/1014562018.db2.gz BMNBNCFEQGYLBR-HXUWFJFHSA-N 1 0 338.407 3.607 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1cccc(F)c1)N(C)C ZINC000449062934 1032106324 /nfs/dbraw/zinc/10/63/24/1032106324.db2.gz KZMMOTIOEWSUTI-AUUYWEPGSA-N 1 0 345.418 3.557 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000449065957 1032111168 /nfs/dbraw/zinc/11/11/68/1032111168.db2.gz XTLQZAKZLUIORB-MAUKXSAKSA-N 1 0 343.427 3.546 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN3CC[C@@H]([NH+]4CCCC4)C3)o2)c1 ZINC000127055279 1015209628 /nfs/dbraw/zinc/20/96/28/1015209628.db2.gz TVLFWVKSGPARQL-QGZVFWFLSA-N 1 0 341.411 3.525 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc(OCC[NH+](C)C)c1 ZINC000449049137 1032122715 /nfs/dbraw/zinc/12/27/15/1032122715.db2.gz YHDBZHQTDSUHJS-OAHLLOKOSA-N 1 0 343.427 3.578 20 5 EHBDRO COCCCOc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000154849726 1015857959 /nfs/dbraw/zinc/85/79/59/1015857959.db2.gz BPAMKLFDTUFSTP-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000154971925 1016014040 /nfs/dbraw/zinc/01/40/40/1016014040.db2.gz GRFRHOMCTHTTQK-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO C[C@H](c1ccc([S@](C)=O)cc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384708 1016122044 /nfs/dbraw/zinc/12/20/44/1016122044.db2.gz KDLXXJFYCIOTSV-SHACYNPGSA-N 1 0 346.452 3.568 20 5 EHBDRO CC(C)N(CC[N@H+](C)Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC001167178727 1016487573 /nfs/dbraw/zinc/48/75/73/1016487573.db2.gz JOEQETGRUMHOBM-UHFFFAOYSA-N 1 0 341.455 3.937 20 5 EHBDRO COC[C@@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000120400421 1016803558 /nfs/dbraw/zinc/80/35/58/1016803558.db2.gz GQFQIZBIILDIHU-GFCCVEGCSA-N 1 0 334.347 3.651 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CS[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414497275 1016943169 /nfs/dbraw/zinc/94/31/69/1016943169.db2.gz FPIXFXBTZIONCE-VXGBXAGGSA-N 1 0 348.424 3.847 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)O1 ZINC000414512834 1016946933 /nfs/dbraw/zinc/94/69/33/1016946933.db2.gz JCPYWWNMTZYQRM-UMVBOHGHSA-N 1 0 330.384 3.758 20 5 EHBDRO COC1([C@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1 ZINC000414523530 1016952243 /nfs/dbraw/zinc/95/22/43/1016952243.db2.gz IKPAYFIDDIORLV-ZDUSSCGKSA-N 1 0 330.384 3.902 20 5 EHBDRO COc1cccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000414556525 1016974457 /nfs/dbraw/zinc/97/44/57/1016974457.db2.gz ODDPOHIEWRGLJZ-WMZOPIPTSA-N 1 0 326.396 3.805 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000414619520 1017066967 /nfs/dbraw/zinc/06/69/67/1017066967.db2.gz ODRWVLQSPVSBLY-LLVKDONJSA-N 1 0 344.293 3.710 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@H]1OC ZINC000538194821 1032212050 /nfs/dbraw/zinc/21/20/50/1032212050.db2.gz MJEREIDZCSSXQV-SQWLQELKSA-N 1 0 338.473 3.870 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000449167687 1032259041 /nfs/dbraw/zinc/25/90/41/1032259041.db2.gz BEGDDTHLJIIORT-MLGOLLRUSA-N 1 0 330.432 3.617 20 5 EHBDRO CCN(C(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000538277866 1032265696 /nfs/dbraw/zinc/26/56/96/1032265696.db2.gz YREQWRBILUFUKL-HNNXBMFYSA-N 1 0 347.459 3.735 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1cnn(C)c1)C(C)(C)C ZINC000449176344 1032269907 /nfs/dbraw/zinc/26/99/07/1032269907.db2.gz MPTJEJBNQDSOJR-DYVFJYSZSA-N 1 0 330.432 3.636 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc(C4CC4)nc3)C2)cc1 ZINC000459582417 1032280327 /nfs/dbraw/zinc/28/03/27/1032280327.db2.gz RFQCDNIFWNGRPS-QGZVFWFLSA-N 1 0 338.411 3.642 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]C1CCC(OC2CCCC2)CC1 ZINC000449165841 1032280705 /nfs/dbraw/zinc/28/07/05/1032280705.db2.gz BAMMENYNHQOKHN-UHFFFAOYSA-N 1 0 332.444 3.997 20 5 EHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615513 1032352647 /nfs/dbraw/zinc/35/26/47/1032352647.db2.gz PEABAZIOVPVEOP-SJCJKPOMSA-N 1 0 330.388 3.703 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000485201335 1032376963 /nfs/dbraw/zinc/37/69/63/1032376963.db2.gz GVLLDSHRXYYJKJ-MRXNPFEDSA-N 1 0 341.411 3.973 20 5 EHBDRO CCCCn1cc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000538455942 1032383146 /nfs/dbraw/zinc/38/31/46/1032383146.db2.gz ZNTBQHUAVNJPED-CLFYSBASSA-N 1 0 328.416 3.703 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CN(C)C)c1ccc(F)cc1 ZINC000449329706 1032442263 /nfs/dbraw/zinc/44/22/63/1032442263.db2.gz IYTCLTOXUYBEGL-RDTXWAMCSA-N 1 0 345.418 3.557 20 5 EHBDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449316677 1032448358 /nfs/dbraw/zinc/44/83/58/1032448358.db2.gz ZWWHSAWWOKHUNZ-SJCJKPOMSA-N 1 0 344.386 3.951 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)c1ccccn1 ZINC000449393307 1032501621 /nfs/dbraw/zinc/50/16/21/1032501621.db2.gz MEEKDLGNCYCIRS-RVDMUPIBSA-N 1 0 325.412 3.961 20 5 EHBDRO CC[C@H](C)[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449403236 1032525854 /nfs/dbraw/zinc/52/58/54/1032525854.db2.gz VLMVMGRRFQDXCF-LRDDRELGSA-N 1 0 349.456 3.869 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1[N+](=O)[O-] ZINC000449455723 1032572482 /nfs/dbraw/zinc/57/24/82/1032572482.db2.gz AYGAGOZIRAVEET-YQVWRLOYSA-N 1 0 332.444 3.844 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449478656 1032603457 /nfs/dbraw/zinc/60/34/57/1032603457.db2.gz KMSOWZKSNIHJNU-OAHLLOKOSA-N 1 0 334.803 3.768 20 5 EHBDRO CC(C)n1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494380 1032659629 /nfs/dbraw/zinc/65/96/29/1032659629.db2.gz AOHBXNHZMDTMPE-KRWDZBQOSA-N 1 0 328.416 3.752 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000593064132 1032664533 /nfs/dbraw/zinc/66/45/33/1032664533.db2.gz KKXOSOVYSIVDNN-WFASDCNBSA-N 1 0 345.374 3.802 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN(C2CC2)[C@H]2CC[NH2+]C2)s1 ZINC000414659165 1017107406 /nfs/dbraw/zinc/10/74/06/1017107406.db2.gz KOUMKYDRFCTMNM-AWEZNQCLSA-N 1 0 343.452 3.650 20 5 EHBDRO CCCN(CC[NH+]1CCCCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000574073956 1032691805 /nfs/dbraw/zinc/69/18/05/1032691805.db2.gz FHONVXMYSHLWML-UHFFFAOYSA-N 1 0 348.447 3.715 20 5 EHBDRO O=C(C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000177392059 1017660948 /nfs/dbraw/zinc/66/09/48/1017660948.db2.gz HUSQSINEHIXVCK-HNNXBMFYSA-N 1 0 330.409 3.894 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3OC)o2)c([N+](=O)[O-])c1 ZINC000449523430 1032719686 /nfs/dbraw/zinc/71/96/86/1032719686.db2.gz MYNHTUWJBJYMLT-CRAIPNDOSA-N 1 0 346.383 3.521 20 5 EHBDRO C[C@H]1c2ccc(F)cc2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000610003615 1017983797 /nfs/dbraw/zinc/98/37/97/1017983797.db2.gz BNJCNQBRFPCKOU-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NCC1CC[NH+](CCC(C)C)CC1 ZINC000431845456 1018054443 /nfs/dbraw/zinc/05/44/43/1018054443.db2.gz OOHFTELCYFOTKD-UHFFFAOYSA-N 1 0 349.475 3.911 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)c1 ZINC001167332760 1018225395 /nfs/dbraw/zinc/22/53/95/1018225395.db2.gz RMFFABLLYJSPRF-SFHVURJKSA-N 1 0 340.423 3.928 20 5 EHBDRO CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345671 1018360535 /nfs/dbraw/zinc/36/05/35/1018360535.db2.gz YGLVEXOWMUJLCN-OCCSQVGLSA-N 1 0 349.456 3.605 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701344 1018412119 /nfs/dbraw/zinc/41/21/19/1018412119.db2.gz NYZJDRWXYNBZSV-WFASDCNBSA-N 1 0 348.447 3.626 20 5 EHBDRO Cc1nccc([C@@H]2CCC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368001 1018535208 /nfs/dbraw/zinc/53/52/08/1018535208.db2.gz AQKGNPWQJAHLQC-DZGCQCFKSA-N 1 0 326.400 3.634 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000580221181 1018819301 /nfs/dbraw/zinc/81/93/01/1018819301.db2.gz FFDWYDVQLLAHST-AZUAARDMSA-N 1 0 339.439 3.562 20 5 EHBDRO CC[C@H]([NH2+]CCc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000592401811 1032797652 /nfs/dbraw/zinc/79/76/52/1032797652.db2.gz CZLCBLCRQSCVDN-SFHVURJKSA-N 1 0 338.411 3.834 20 5 EHBDRO C[C@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637260 1019011719 /nfs/dbraw/zinc/01/17/19/1019011719.db2.gz SHBRLPZFBRZXLD-QFBILLFUSA-N 1 0 339.439 3.738 20 5 EHBDRO C[C@@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610422092 1019029183 /nfs/dbraw/zinc/02/91/83/1019029183.db2.gz YRUHTUPVMLEHFU-DNVCBOLYSA-N 1 0 336.395 3.883 20 5 EHBDRO CN(c1ccsc1[N+](=O)[O-])[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610431089 1019084125 /nfs/dbraw/zinc/08/41/25/1019084125.db2.gz QAYHKZROZCFXQP-HNNXBMFYSA-N 1 0 331.441 3.757 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)cc1[N+](=O)[O-] ZINC000120626869 1019111090 /nfs/dbraw/zinc/11/10/90/1019111090.db2.gz ODWWHPJCYKWMRK-CZUORRHYSA-N 1 0 333.457 3.918 20 5 EHBDRO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449562766 1032812195 /nfs/dbraw/zinc/81/21/95/1032812195.db2.gz NXKZAYSKBLCKSC-UXLLHSPISA-N 1 0 342.443 3.873 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2([NH+]3CCSCC3)CCCC2)c(F)c1 ZINC000513168376 1019361797 /nfs/dbraw/zinc/36/17/97/1019361797.db2.gz ZASWXXQGEDTWBU-UHFFFAOYSA-N 1 0 339.436 3.507 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000536860729 1019374481 /nfs/dbraw/zinc/37/44/81/1019374481.db2.gz AKUCOFQGPJSOKN-INIZCTEOSA-N 1 0 348.399 3.939 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000182344504 1019458747 /nfs/dbraw/zinc/45/87/47/1019458747.db2.gz BGRQCTPADOIZCK-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000513380836 1019584882 /nfs/dbraw/zinc/58/48/82/1019584882.db2.gz MODKPCPFXTYVOC-MRXNPFEDSA-N 1 0 340.379 3.969 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H](C1CC1)C1CCOCC1 ZINC000926114103 1019708359 /nfs/dbraw/zinc/70/83/59/1019708359.db2.gz UZJSOOAXNYQAJK-QGZVFWFLSA-N 1 0 338.835 3.586 20 5 EHBDRO COc1cccc(NC[C@@H](c2cccs2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000548117150 1019724086 /nfs/dbraw/zinc/72/40/86/1019724086.db2.gz MJBSJNHHGBENLR-AWEZNQCLSA-N 1 0 347.440 3.914 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000182830018 1019757980 /nfs/dbraw/zinc/75/79/80/1019757980.db2.gz HJXJVCGQFUZNQS-KBPBESRZSA-N 1 0 334.416 3.628 20 5 EHBDRO CCc1ncc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000449608817 1032873304 /nfs/dbraw/zinc/87/33/04/1032873304.db2.gz KJYUADHZLBLXGR-BBRMVZONSA-N 1 0 329.400 3.646 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])C1 ZINC000109966625 1020173443 /nfs/dbraw/zinc/17/34/43/1020173443.db2.gz LRABUATUZVFTBS-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+](C[C@@H]1CCOC1)C1CC1 ZINC000602439516 1032887871 /nfs/dbraw/zinc/88/78/71/1032887871.db2.gz HJAZHRCYOYJJIN-NSHDSACASA-N 1 0 344.333 3.615 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000183144695 1020392747 /nfs/dbraw/zinc/39/27/47/1020392747.db2.gz DFUOOEFZZULESL-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CC(C(C)(C)C)C1 ZINC000581205726 1020518507 /nfs/dbraw/zinc/51/85/07/1020518507.db2.gz OQGXKLOMRFEMSW-OPFPJEHXSA-N 1 0 333.432 3.726 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]2COCC[C@@H]21 ZINC000602485462 1032912948 /nfs/dbraw/zinc/91/29/48/1032912948.db2.gz QRDDEVWPNMBQBA-JSGCOSHPSA-N 1 0 344.333 3.615 20 5 EHBDRO CCCC[NH+]1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413061585 1020635488 /nfs/dbraw/zinc/63/54/88/1020635488.db2.gz NRKUKUBODBJNFE-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CCC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000548160126 1020770889 /nfs/dbraw/zinc/77/08/89/1020770889.db2.gz VIBKWHSLTSCVHG-RHSMWYFYSA-N 1 0 333.432 3.506 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000581507902 1021028785 /nfs/dbraw/zinc/02/87/85/1021028785.db2.gz LZYGESNQFORBPT-HNNXBMFYSA-N 1 0 333.432 3.682 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCCSC3)o2)c([N+](=O)[O-])c1 ZINC000610511661 1021132103 /nfs/dbraw/zinc/13/21/03/1021132103.db2.gz WCGHMIIWBQBEAZ-LBPRGKRZSA-N 1 0 348.424 3.849 20 5 EHBDRO CCN1CCCC[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450807 1021189868 /nfs/dbraw/zinc/18/98/68/1021189868.db2.gz WMUILWHLUICTOJ-KRWDZBQOSA-N 1 0 343.427 3.819 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccncc2C)cc1[N+](=O)[O-] ZINC000090846941 1021205589 /nfs/dbraw/zinc/20/55/89/1021205589.db2.gz JUNRJSCMBBFFFW-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCc1ccc(O)cc1 ZINC000602528159 1032962152 /nfs/dbraw/zinc/96/21/52/1032962152.db2.gz NHXMIIKCDASZGM-UHFFFAOYSA-N 1 0 340.301 3.652 20 5 EHBDRO CC(C)c1nnc(CC[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000426307503 1021236540 /nfs/dbraw/zinc/23/65/40/1021236540.db2.gz RLPYDCNOTJOWGX-CYBMUJFWSA-N 1 0 348.472 3.723 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000157378826 1021297766 /nfs/dbraw/zinc/29/77/66/1021297766.db2.gz SBNHNGQHAIMOPJ-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO CCC[NH+]1CCC(N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000276434368 1021303823 /nfs/dbraw/zinc/30/38/23/1021303823.db2.gz QKKOCEBWYXXBLT-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](CCO)Cc1cccc(F)c1 ZINC000426368918 1021395144 /nfs/dbraw/zinc/39/51/44/1021395144.db2.gz CHRNBRSMMGTUMP-GDNBJRDFSA-N 1 0 344.386 3.632 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506564521 1021406474 /nfs/dbraw/zinc/40/64/74/1021406474.db2.gz UXGNKLLOVYMERQ-OAHLLOKOSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCCCC1 ZINC000602551568 1032986041 /nfs/dbraw/zinc/98/60/41/1032986041.db2.gz PKEPPMDXVSWADC-AWEZNQCLSA-N 1 0 332.448 3.517 20 5 EHBDRO COc1cccc([C@H](CNc2sccc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC000302010475 1021608684 /nfs/dbraw/zinc/60/86/84/1021608684.db2.gz YGDODTQJMJYACK-INIZCTEOSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@@H](CCc1ccco1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000519720511 1021633204 /nfs/dbraw/zinc/63/32/04/1021633204.db2.gz CNKAPNZVPIJINU-ZDUSSCGKSA-N 1 0 327.384 3.823 20 5 EHBDRO COCc1cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])ccc1F ZINC000581893799 1022183795 /nfs/dbraw/zinc/18/37/95/1022183795.db2.gz ATBRINMBFSNEAV-KRWDZBQOSA-N 1 0 330.359 3.657 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000550098070 1022425970 /nfs/dbraw/zinc/42/59/70/1022425970.db2.gz WIDQXLYWRWYVIR-GDBMZVCRSA-N 1 0 334.416 3.587 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000156528505 1022511556 /nfs/dbraw/zinc/51/15/56/1022511556.db2.gz PRLKUVBDLRZHRA-GOSISDBHSA-N 1 0 341.411 3.585 20 5 EHBDRO CN(C)C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCC1 ZINC000438341444 1022580785 /nfs/dbraw/zinc/58/07/85/1022580785.db2.gz ODFHDGAKKJGPQE-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c1[N+](=O)[O-] ZINC000894579725 1022582898 /nfs/dbraw/zinc/58/28/98/1022582898.db2.gz AGUQYGUFNBXVDA-NSHDSACASA-N 1 0 344.358 3.614 20 5 EHBDRO COc1cccc(N[C@H](C)C[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000310105574 1022584031 /nfs/dbraw/zinc/58/40/31/1022584031.db2.gz AJYWGIFRZRWAPF-CQSZACIVSA-N 1 0 329.400 3.536 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@H+](C[C@@H]2CCCO2)C2CCCC2)cc1 ZINC000441433475 1022587524 /nfs/dbraw/zinc/58/75/24/1022587524.db2.gz GPAOPVDDPSRWHO-IBGZPJMESA-N 1 0 348.443 3.787 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1([NH+](C)C)CCC1 ZINC000438490988 1022718206 /nfs/dbraw/zinc/71/82/06/1022718206.db2.gz GISGAACKYHXQQD-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000426060241 1022790586 /nfs/dbraw/zinc/79/05/86/1022790586.db2.gz RBOJGKYKBHFVJF-INIZCTEOSA-N 1 0 326.396 3.559 20 5 EHBDRO CCN(CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CCC(F)(F)F ZINC000426069264 1022809220 /nfs/dbraw/zinc/80/92/20/1022809220.db2.gz IELTUDLOBZBDLE-GFCCVEGCSA-N 1 0 333.354 3.520 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCO[C@H]3CCC[C@H]32)o1 ZINC000430881513 1022820189 /nfs/dbraw/zinc/82/01/89/1022820189.db2.gz BVADQUVWMHZBIY-AEFFLSMTSA-N 1 0 328.368 3.608 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000518065273 1022968168 /nfs/dbraw/zinc/96/81/68/1022968168.db2.gz AWPZETYCBSEWTL-OKILXGFUSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1ccccc1[C@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000507185287 1023170138 /nfs/dbraw/zinc/17/01/38/1023170138.db2.gz WOXCPBXOSKVRPM-INIZCTEOSA-N 1 0 326.396 3.772 20 5 EHBDRO Cc1cccc2ncc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)n21 ZINC000507168624 1023171967 /nfs/dbraw/zinc/17/19/67/1023171967.db2.gz RHSQOWQGOVOLKW-UHFFFAOYSA-N 1 0 336.395 3.716 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471013 1023232728 /nfs/dbraw/zinc/23/27/28/1023232728.db2.gz OVPOHBGFOKIVKP-MJGOQNOKSA-N 1 0 345.487 3.724 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000490071074 1023261033 /nfs/dbraw/zinc/26/10/33/1023261033.db2.gz YLNFBJVZKJEEGW-GOSISDBHSA-N 1 0 325.412 3.980 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000546126937 1023265930 /nfs/dbraw/zinc/26/59/30/1023265930.db2.gz PUTZJQDYMLWPSE-GXTWGEPZSA-N 1 0 333.432 3.598 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164526232 1023266250 /nfs/dbraw/zinc/26/62/50/1023266250.db2.gz KHVVKDNCTPWAQD-ZFWWWQNUSA-N 1 0 349.431 3.563 20 5 EHBDRO O=[N+]([O-])c1ccccc1NCC1CC[NH+](Cc2cccs2)CC1 ZINC000060874272 1033129083 /nfs/dbraw/zinc/12/90/83/1033129083.db2.gz INGGQCXSMIJXEM-UHFFFAOYSA-N 1 0 331.441 3.980 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247529013 1023451235 /nfs/dbraw/zinc/45/12/35/1023451235.db2.gz OBWKOBGVEFIYNQ-XNRPHZJLSA-N 1 0 342.399 3.798 20 5 EHBDRO CCC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000548488236 1023500518 /nfs/dbraw/zinc/50/05/18/1023500518.db2.gz QDMBNENUXHYSIK-GJZGRUSLSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+]Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C2)CO1 ZINC000897775359 1033162673 /nfs/dbraw/zinc/16/26/73/1033162673.db2.gz CFUPZDAHHRCIFZ-DQSQBROSSA-N 1 0 345.226 3.949 20 5 EHBDRO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288569 1024012875 /nfs/dbraw/zinc/01/28/75/1024012875.db2.gz YEGPFBVVNKFQJR-CHWSQXEVSA-N 1 0 336.823 3.569 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H]2CC[C@H](O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000474105944 1024225027 /nfs/dbraw/zinc/22/50/27/1024225027.db2.gz MFKNMYFWSRVABI-ACWOFJMJSA-N 1 0 344.411 3.590 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000156680815 1024419103 /nfs/dbraw/zinc/41/91/03/1024419103.db2.gz XZECTZCYCWNJKW-AWEZNQCLSA-N 1 0 329.400 3.938 20 5 EHBDRO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383927379 1024633778 /nfs/dbraw/zinc/63/37/78/1024633778.db2.gz RZLKOBUNVLYCMS-WBVHZDCISA-N 1 0 325.412 3.917 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000277346235 1024711323 /nfs/dbraw/zinc/71/13/23/1024711323.db2.gz YPXVZEDZTXRNBX-UONOGXRCSA-N 1 0 344.411 3.981 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000514761228 1024719104 /nfs/dbraw/zinc/71/91/04/1024719104.db2.gz IPJIXDIDVYTIPM-ZAAXVRCTSA-N 1 0 340.423 3.720 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C1CCC2(COC2)CC1 ZINC000895694805 1024729938 /nfs/dbraw/zinc/72/99/38/1024729938.db2.gz OEGQYOZNVBHTPX-UHFFFAOYSA-N 1 0 344.333 3.662 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc2cc[nH]c21 ZINC000342299553 1024757542 /nfs/dbraw/zinc/75/75/42/1024757542.db2.gz BKKICQYUDHPXOD-UHFFFAOYSA-N 1 0 325.368 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@H]4CCCO4)C3)o2)cc1 ZINC000895843868 1024891674 /nfs/dbraw/zinc/89/16/74/1024891674.db2.gz JESKMVLCRAJWGS-CRAIPNDOSA-N 1 0 342.395 3.856 20 5 EHBDRO COC1([C@@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCCC1 ZINC000514930341 1024908790 /nfs/dbraw/zinc/90/87/90/1024908790.db2.gz BWGSJUCFJYRYQH-CYBMUJFWSA-N 1 0 331.416 3.556 20 5 EHBDRO CC[C@@H]([NH2+]C1(C(=O)Nc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000427988715 1024927020 /nfs/dbraw/zinc/92/70/20/1024927020.db2.gz PUOSCVIWSBWOBO-QGZVFWFLSA-N 1 0 339.395 3.807 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000157562512 1024953202 /nfs/dbraw/zinc/95/32/02/1024953202.db2.gz WZZGTGQNVNLTIW-ZDUSSCGKSA-N 1 0 346.431 3.584 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539224489 1024969538 /nfs/dbraw/zinc/96/95/38/1024969538.db2.gz AAFVTUXCPWNJQP-DYVFJYSZSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnc(Cl)s1 ZINC000895154423 1025224033 /nfs/dbraw/zinc/22/40/33/1025224033.db2.gz ZBXCMNUSMRISID-SNVBAGLBSA-N 1 0 325.821 3.816 20 5 EHBDRO Cc1cccc(CN(CC[NH+](C)C)c2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000434946354 1025290871 /nfs/dbraw/zinc/29/08/71/1025290871.db2.gz JNAIIUVREMFSHF-UHFFFAOYSA-N 1 0 348.834 3.520 20 5 EHBDRO C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000381380984 1025421872 /nfs/dbraw/zinc/42/18/72/1025421872.db2.gz PFMKMBNXAQZATA-XQQFMLRXSA-N 1 0 337.420 3.547 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077320 1025497176 /nfs/dbraw/zinc/49/71/76/1025497176.db2.gz VKAZDDPBVQESRX-GUYCJALGSA-N 1 0 329.400 3.557 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)NCCC1=CCCCC1 ZINC000451105720 1025541285 /nfs/dbraw/zinc/54/12/85/1025541285.db2.gz MYBUSXLGTKIJHU-GJZGRUSLSA-N 1 0 345.443 3.641 20 5 EHBDRO Cn1cc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCCCC2)c([N+](=O)[O-])n1 ZINC000602966599 1033291233 /nfs/dbraw/zinc/29/12/33/1033291233.db2.gz LDVDYLIWGXEKEZ-QGZVFWFLSA-N 1 0 346.406 3.879 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000474038896 1025611878 /nfs/dbraw/zinc/61/18/78/1025611878.db2.gz RVNMTRMGTHXZQB-NSHDSACASA-N 1 0 328.359 3.907 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)ccc1F ZINC000451160592 1025615777 /nfs/dbraw/zinc/61/57/77/1025615777.db2.gz FMVBZKWVSXHGHH-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO Cc1c(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051531707 1025637726 /nfs/dbraw/zinc/63/77/26/1025637726.db2.gz AOMNSCQMHYUTJZ-FQEVSTJZSA-N 1 0 340.423 3.849 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200900 1025641936 /nfs/dbraw/zinc/64/19/36/1025641936.db2.gz OGEPLPOIFJVRNC-GUYCJALGSA-N 1 0 327.384 3.582 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)NCc1csc([N+](=O)[O-])c1)[NH+](C)C ZINC000443012248 1025662359 /nfs/dbraw/zinc/66/23/59/1025662359.db2.gz IQYHPLFWDOGUSL-CXAGYDPISA-N 1 0 333.457 3.746 20 5 EHBDRO Cc1nccn1CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000263785661 1025665690 /nfs/dbraw/zinc/66/56/90/1025665690.db2.gz GLBWJQBLIZRNQY-UHFFFAOYSA-N 1 0 340.383 3.540 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000444213305 1025918004 /nfs/dbraw/zinc/91/80/04/1025918004.db2.gz ORAPRQTVASXLBQ-CQSZACIVSA-N 1 0 333.432 3.598 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCN([C@H](C)c3ccsc3)CC2)c1 ZINC000338701484 1026176472 /nfs/dbraw/zinc/17/64/72/1026176472.db2.gz PRMSJHHMCNOHRK-CYBMUJFWSA-N 1 0 347.440 3.548 20 5 EHBDRO CCN(CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000475154828 1026252704 /nfs/dbraw/zinc/25/27/04/1026252704.db2.gz GZEQYCNDZZFICX-GFCCVEGCSA-N 1 0 333.354 3.520 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000127106547 1026256350 /nfs/dbraw/zinc/25/63/50/1026256350.db2.gz RPUUPARSWPUYLX-HNNXBMFYSA-N 1 0 343.427 3.812 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@@H](C)C1 ZINC000452066902 1026461443 /nfs/dbraw/zinc/46/14/43/1026461443.db2.gz LTMLYUNZGAWWTE-VNHYZAJKSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)n1 ZINC000611616120 1026519593 /nfs/dbraw/zinc/51/95/93/1026519593.db2.gz PUZOGMYMBRBXCM-QGZVFWFLSA-N 1 0 346.475 3.555 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418285 1026790437 /nfs/dbraw/zinc/79/04/37/1026790437.db2.gz NVLNIOWGVDTDBA-FZKQIMNGSA-N 1 0 349.394 3.514 20 5 EHBDRO CC(C)(C)OC1CC([NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000341633639 1026865694 /nfs/dbraw/zinc/86/56/94/1026865694.db2.gz ZDNIONSHOSVSFV-UHFFFAOYSA-N 1 0 348.443 3.784 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430330 1026902503 /nfs/dbraw/zinc/90/25/03/1026902503.db2.gz WIDHFSHWPBAXQF-SJORKVTESA-N 1 0 349.475 3.594 20 5 EHBDRO CC(C)(CO)C(C)(C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000531444804 1026927790 /nfs/dbraw/zinc/92/77/90/1026927790.db2.gz YGUVXABXEUCTHX-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO CC(C)N(CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(C)C ZINC000480080392 1026982787 /nfs/dbraw/zinc/98/27/87/1026982787.db2.gz LFHJVVCXMBTUMR-SFHVURJKSA-N 1 0 333.476 3.624 20 5 EHBDRO C[C@H]1COCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000277826140 1027065168 /nfs/dbraw/zinc/06/51/68/1027065168.db2.gz LIPAXUMUQNHJBQ-BLLLJJGKSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](Cc1ccccc1)CN(C)C ZINC000531684225 1027209966 /nfs/dbraw/zinc/20/99/66/1027209966.db2.gz FBWYMNPZZCHQKR-SJLPKXTDSA-N 1 0 341.455 3.727 20 5 EHBDRO COCCOc1ccccc1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531701071 1027221402 /nfs/dbraw/zinc/22/14/02/1027221402.db2.gz GWMCGQWHBGQDAU-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CCCC1CCC([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000548761452 1027364421 /nfs/dbraw/zinc/36/44/21/1027364421.db2.gz GNHATGGVDBRHIS-UHFFFAOYSA-N 1 0 333.432 3.872 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2(CO)CCCC2)c2ccccc2)c1 ZINC000186486033 1027377090 /nfs/dbraw/zinc/37/70/90/1027377090.db2.gz BFHLRWQJHVCDKS-IBGZPJMESA-N 1 0 340.423 3.827 20 5 EHBDRO C[NH2+]CCC1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000420223657 1027394664 /nfs/dbraw/zinc/39/46/64/1027394664.db2.gz BSPJJKZNOFPLGZ-UHFFFAOYSA-N 1 0 332.231 3.728 20 5 EHBDRO C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@@H]12 ZINC000548761145 1027409476 /nfs/dbraw/zinc/40/94/76/1027409476.db2.gz GJBLRZRYKSEPTP-HLLBOEOZSA-N 1 0 345.443 3.824 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000475567986 1027645283 /nfs/dbraw/zinc/64/52/83/1027645283.db2.gz FILFLYNCUKPIIL-GJZGRUSLSA-N 1 0 348.447 3.596 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293761156 1027661998 /nfs/dbraw/zinc/66/19/98/1027661998.db2.gz OXEUHSIFRNSDDK-VXGBXAGGSA-N 1 0 342.399 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](CC(F)(F)F)C1 ZINC000420941969 1027882851 /nfs/dbraw/zinc/88/28/51/1027882851.db2.gz GODBTWNUYPXGPV-LLVKDONJSA-N 1 0 332.322 3.768 20 5 EHBDRO CC(C)c1ccc(C(=O)NCc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000422890465 1028026670 /nfs/dbraw/zinc/02/66/70/1028026670.db2.gz SIFABXOSXGRAOT-ZDUSSCGKSA-N 1 0 341.411 3.668 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804448 1028035610 /nfs/dbraw/zinc/03/56/10/1028035610.db2.gz YQTBZWDQIKKDOP-DYVFJYSZSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCCOC1 ZINC000503926258 1028218744 /nfs/dbraw/zinc/21/87/44/1028218744.db2.gz IZSNRIGTQFFNOT-ZFWWWQNUSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccc(F)c(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000444744082 1028230003 /nfs/dbraw/zinc/23/00/03/1028230003.db2.gz NVLCRHLBDVMZQP-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCOC1 ZINC000503942116 1028247596 /nfs/dbraw/zinc/24/75/96/1028247596.db2.gz BOCVFLXNXOBZMN-HIFRSBDPSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444764810 1028249451 /nfs/dbraw/zinc/24/94/51/1028249451.db2.gz CHERDLKYBCZWPJ-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](N)c1ccccc1 ZINC000423231339 1028297510 /nfs/dbraw/zinc/29/75/10/1028297510.db2.gz ATJJXOJRWLWFCJ-HOTGVXAUSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@H](NC[C@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246328 1028306323 /nfs/dbraw/zinc/30/63/23/1028306323.db2.gz ZDHNCBILQWSZOZ-QWHCGFSZSA-N 1 0 331.441 3.726 20 5 EHBDRO C[C@H]1C[C@@H](CO)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358473 1028309776 /nfs/dbraw/zinc/30/97/76/1028309776.db2.gz BZTHAJCRWQMSRS-UONOGXRCSA-N 1 0 346.452 3.774 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000502590054 1028386538 /nfs/dbraw/zinc/38/65/38/1028386538.db2.gz BNXOFQYFBAWKNS-DGCLKSJQSA-N 1 0 334.750 3.888 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502601893 1028422188 /nfs/dbraw/zinc/42/21/88/1028422188.db2.gz RKMPLWBIGKFKMM-SFHVURJKSA-N 1 0 346.814 3.740 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423442176 1028432154 /nfs/dbraw/zinc/43/21/54/1028432154.db2.gz JMMHBHFHFCHIIS-AWEZNQCLSA-N 1 0 325.412 3.674 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755661 1028800072 /nfs/dbraw/zinc/80/00/72/1028800072.db2.gz IWKMMVPETHRMAP-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cccnc3CC2)cc1[N+](=O)[O-] ZINC000421832676 1028823533 /nfs/dbraw/zinc/82/35/33/1028823533.db2.gz GRJDGCMMPFMPJI-RHSMWYFYSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCCC2(O)CCC2)c2ccccc2)c1 ZINC000421851285 1028837013 /nfs/dbraw/zinc/83/70/13/1028837013.db2.gz FQDVQVOOQQXXEP-LJQANCHMSA-N 1 0 340.423 3.969 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1[N+](=O)[O-] ZINC000504900222 1029027354 /nfs/dbraw/zinc/02/73/54/1029027354.db2.gz UDQIPQIYWRMXJB-RDTXWAMCSA-N 1 0 338.448 3.831 20 5 EHBDRO CC[C@@H](C)[C@](C)(O)C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504911789 1029052641 /nfs/dbraw/zinc/05/26/41/1029052641.db2.gz LJLHYGMALQYNQY-CKEIUWERSA-N 1 0 340.489 3.852 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC2(CCCC2)C1 ZINC000445872867 1029202090 /nfs/dbraw/zinc/20/20/90/1029202090.db2.gz ZODQPDZHYNAORP-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000248184783 1029481590 /nfs/dbraw/zinc/48/15/90/1029481590.db2.gz GWTKNNOSFLNJSY-INIZCTEOSA-N 1 0 349.818 3.972 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H](CO)c1ccccc1 ZINC000513828859 1029527329 /nfs/dbraw/zinc/52/73/29/1029527329.db2.gz QVVRQNNWCZEGAY-UHOSZYNNSA-N 1 0 340.423 3.629 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(O)(CC)CC ZINC000504911171 1029544452 /nfs/dbraw/zinc/54/44/52/1029544452.db2.gz BLNLYYUFAXJHBA-ZDUSSCGKSA-N 1 0 326.462 3.606 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC2(C1)CCCCC2 ZINC000533294410 1029590664 /nfs/dbraw/zinc/59/06/64/1029590664.db2.gz XXYOIMOZLBBWSG-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000446488545 1029659458 /nfs/dbraw/zinc/65/94/58/1029659458.db2.gz NVYYDQFDQDUMAW-ZDUSSCGKSA-N 1 0 348.447 3.535 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ncc([N+](=O)[O-])s2)CC1 ZINC000192456943 1029671139 /nfs/dbraw/zinc/67/11/39/1029671139.db2.gz PSXNLGQYTDDVLX-LBPRGKRZSA-N 1 0 332.429 3.689 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ncc([N+](=O)[O-])s2)CC1 ZINC000192456949 1029671211 /nfs/dbraw/zinc/67/12/11/1029671211.db2.gz PSXNLGQYTDDVLX-GFCCVEGCSA-N 1 0 332.429 3.689 20 5 EHBDRO CC[S@](=O)[C@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000162911859 1029680459 /nfs/dbraw/zinc/68/04/59/1029680459.db2.gz UHDQDNICDCNOQF-BDTDXFHBSA-N 1 0 338.473 3.634 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN(C[C@@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686678 1029764172 /nfs/dbraw/zinc/76/41/72/1029764172.db2.gz RQFZJGJQUVCAEM-AWEZNQCLSA-N 1 0 340.370 3.797 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000156504752 1029860008 /nfs/dbraw/zinc/86/00/08/1029860008.db2.gz KTUTUMXTTWYIFW-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@@H](CCCc3ccccc3)C2)c1 ZINC000441190798 1029895228 /nfs/dbraw/zinc/89/52/28/1029895228.db2.gz SGQOSAWMEHSUGJ-GOSISDBHSA-N 1 0 342.443 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H]2CCO)s1 ZINC000428466035 1029908428 /nfs/dbraw/zinc/90/84/28/1029908428.db2.gz URZGXCKTZRTJKH-ZDUSSCGKSA-N 1 0 332.425 3.670 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1C ZINC000525709363 1030047000 /nfs/dbraw/zinc/04/70/00/1030047000.db2.gz VNFCZCWSPMQWII-UKRRQHHQSA-N 1 0 345.468 3.896 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C1CCN(C(=O)OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000186752375 1030068510 /nfs/dbraw/zinc/06/85/10/1030068510.db2.gz HRFBDDHIDQYCFK-SUMWQHHRSA-N 1 0 349.431 3.502 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CC(C)(C)O ZINC000453320117 1030100686 /nfs/dbraw/zinc/10/06/86/1030100686.db2.gz NEAHLVLENUZGGF-CHWSQXEVSA-N 1 0 326.462 3.605 20 5 EHBDRO Cc1cc(NC(=O)NCCCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000546742921 1030136749 /nfs/dbraw/zinc/13/67/49/1030136749.db2.gz XVHLGUOFVHAYCM-OAHLLOKOSA-N 1 0 348.447 3.679 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453390120 1030236157 /nfs/dbraw/zinc/23/61/57/1030236157.db2.gz XWNNIVVCDYNPNA-YRMAPFEESA-N 1 0 332.444 3.709 20 5 EHBDRO Cc1cc(C)cc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447540244 1030276698 /nfs/dbraw/zinc/27/66/98/1030276698.db2.gz IYQTUHVFLGCITJ-MSOLQXFVSA-N 1 0 342.443 3.724 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)s2)n1 ZINC000447544706 1030279060 /nfs/dbraw/zinc/27/90/60/1030279060.db2.gz OXMQKYGMPLEIJT-RYUDHWBXSA-N 1 0 340.836 3.780 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000245892124 1030281637 /nfs/dbraw/zinc/28/16/37/1030281637.db2.gz QBFLQGLEWRYDBW-ATCWAGBWSA-N 1 0 330.388 3.559 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453430619 1030285316 /nfs/dbraw/zinc/28/53/16/1030285316.db2.gz RBDGSESQOJRZIX-WMLDXEAASA-N 1 0 332.444 3.711 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000453431310 1030287120 /nfs/dbraw/zinc/28/71/20/1030287120.db2.gz RKMSSNWIIALXGQ-KBPBESRZSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1ncccc1Cl)CCC2 ZINC000447585436 1030319118 /nfs/dbraw/zinc/31/91/18/1030319118.db2.gz KGVJANWPVGOUDC-INIZCTEOSA-N 1 0 347.802 3.689 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCSCC(F)(F)F)CCC2 ZINC000447584608 1030319230 /nfs/dbraw/zinc/31/92/30/1030319230.db2.gz GRCCCZHFJYTHOA-CYBMUJFWSA-N 1 0 334.363 3.857 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607384 1030750367 /nfs/dbraw/zinc/75/03/67/1030750367.db2.gz OSCIMSKGPUCKGO-WFASDCNBSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCC1 ZINC000483132574 1030990324 /nfs/dbraw/zinc/99/03/24/1030990324.db2.gz FXLFRPFAIOOSHE-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368406 1031019940 /nfs/dbraw/zinc/01/99/40/1031019940.db2.gz UUHUZWZUHKMIIL-LSDHHAIUSA-N 1 0 344.411 3.980 20 5 EHBDRO COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2Cl)[NH+](C)C)c1 ZINC000007979739 1031288042 /nfs/dbraw/zinc/28/80/42/1031288042.db2.gz WTNOZLCQAIKHAF-KRWDZBQOSA-N 1 0 349.818 3.972 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@H]3CCCO3)o2)c1 ZINC000551586962 1031473817 /nfs/dbraw/zinc/47/38/17/1031473817.db2.gz SOZGVPJBAWIZNS-IEBWSBKVSA-N 1 0 342.395 3.998 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594495040 1033395828 /nfs/dbraw/zinc/39/58/28/1033395828.db2.gz NHLBGMCDBOKOIB-MRXNPFEDSA-N 1 0 342.395 3.649 20 5 EHBDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594496550 1033398583 /nfs/dbraw/zinc/39/85/83/1033398583.db2.gz NEUCNGRPPBDALG-SJORKVTESA-N 1 0 340.379 3.704 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594518715 1033425335 /nfs/dbraw/zinc/42/53/35/1033425335.db2.gz JHEYIISXIRJLLL-UAGQMJEPSA-N 1 0 347.459 3.661 20 5 EHBDRO CC(C)(C)O[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000594520097 1033427328 /nfs/dbraw/zinc/42/73/28/1033427328.db2.gz YTUZTSUNHZCVAT-AULYBMBSSA-N 1 0 344.358 3.632 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCN2CCCC[C@H]12 ZINC000594520390 1033429090 /nfs/dbraw/zinc/42/90/90/1033429090.db2.gz OCCPLGCGJVBRNV-SZVBFZGTSA-N 1 0 331.460 3.522 20 5 EHBDRO CCC(=O)c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c([N+](=O)[O-])c1 ZINC000594597641 1033444209 /nfs/dbraw/zinc/44/42/09/1033444209.db2.gz DGOHZZQYLWFVPN-ZBFHGGJFSA-N 1 0 331.416 3.616 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC1CC1 ZINC000598956143 1033609032 /nfs/dbraw/zinc/60/90/32/1033609032.db2.gz XXZCOBHACKEUSH-ZDUSSCGKSA-N 1 0 342.395 3.995 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](CCO)C1CCCCC1 ZINC000595021057 1033613654 /nfs/dbraw/zinc/61/36/54/1033613654.db2.gz OKEXZXPSPOSRQL-SUMWQHHRSA-N 1 0 336.432 3.585 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000594996063 1033623270 /nfs/dbraw/zinc/62/32/70/1033623270.db2.gz RGCZCHDIBBGQQI-QXAKKESOSA-N 1 0 342.370 3.561 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000595003512 1033629033 /nfs/dbraw/zinc/62/90/33/1033629033.db2.gz IDXREQFHGLQZFN-LBPRGKRZSA-N 1 0 335.448 3.563 20 5 EHBDRO Cn1cc(C[NH2+]C[C@]2(C)C[C@H]3C[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599006339 1033639981 /nfs/dbraw/zinc/63/99/81/1033639981.db2.gz VKCPZJGHZILGEI-CCWDJLKJSA-N 1 0 340.427 3.521 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595074662 1033641408 /nfs/dbraw/zinc/64/14/08/1033641408.db2.gz SRYZRIJUYTVPAW-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CO[C@@H](C3CC3)C2)s1 ZINC000599008210 1033643126 /nfs/dbraw/zinc/64/31/26/1033643126.db2.gz WIQOVMLSOOGUDG-SUMWQHHRSA-N 1 0 344.436 3.980 20 5 EHBDRO C[N@@H+]1CCCC[C@@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993954 1033646735 /nfs/dbraw/zinc/64/67/35/1033646735.db2.gz FKTKLCFMKZGMSC-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCCNc1ccccn1 ZINC000595040916 1033661277 /nfs/dbraw/zinc/66/12/77/1033661277.db2.gz PKFUEUXXZDMLKC-CQSZACIVSA-N 1 0 344.415 3.541 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)[C@@H](C)c1ccccc1 ZINC000595098164 1033688470 /nfs/dbraw/zinc/68/84/70/1033688470.db2.gz BKLMBQNFPMTJGF-GQIGUUNPSA-N 1 0 342.439 3.670 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1ccccc1)[C@H](C)O ZINC000595104751 1033692172 /nfs/dbraw/zinc/69/21/72/1033692172.db2.gz TXJDBQJMSZTFPB-ZRGWGRIASA-N 1 0 328.412 3.628 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)OC)c1 ZINC000599061118 1033701225 /nfs/dbraw/zinc/70/12/25/1033701225.db2.gz KQZXMMOYKMVNSH-IFXJQAMLSA-N 1 0 344.411 3.950 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073936 1033717095 /nfs/dbraw/zinc/71/70/95/1033717095.db2.gz NDPCZMGQGRPLNZ-WMLDXEAASA-N 1 0 347.459 3.661 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCC(C)(C)[NH2+][C@@H](C)c1ccccc1 ZINC000192563415 1033744251 /nfs/dbraw/zinc/74/42/51/1033744251.db2.gz XNJYCNISEVXECZ-ZDUSSCGKSA-N 1 0 345.447 3.661 20 5 EHBDRO CC(=O)c1ccc(NC[C@H]2CC[N@@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599126249 1033746687 /nfs/dbraw/zinc/74/66/87/1033746687.db2.gz FERUDIXYDRCYLP-MRXNPFEDSA-N 1 0 331.416 3.616 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@@H+]1C1CCCCC1 ZINC000599127993 1033748475 /nfs/dbraw/zinc/74/84/75/1033748475.db2.gz TXGVADRGIUEQMM-KRWDZBQOSA-N 1 0 333.432 3.560 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](Cc1ccccc1)[C@H](CO)C1CC1 ZINC000595389159 1033787541 /nfs/dbraw/zinc/78/75/41/1033787541.db2.gz LWQQTGLXLNKICL-LJQANCHMSA-N 1 0 344.386 3.507 20 5 EHBDRO C[C@@H](CCO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000593693798 1033800879 /nfs/dbraw/zinc/80/08/79/1033800879.db2.gz DVOSIWNXEKQAHA-NSHDSACASA-N 1 0 338.791 3.711 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1 ZINC000593022263 1033839619 /nfs/dbraw/zinc/83/96/19/1033839619.db2.gz XNVIZUQKTDMJFO-KGLIPLIRSA-N 1 0 342.395 3.663 20 5 EHBDRO CC(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000595686136 1033944565 /nfs/dbraw/zinc/94/45/65/1033944565.db2.gz QHMPYUONVQXPSR-GOSISDBHSA-N 1 0 345.374 3.659 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1CCO ZINC000595696272 1033950532 /nfs/dbraw/zinc/95/05/32/1033950532.db2.gz KAVRNQYCQWUPBP-NHYWBVRUSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1nccc([C@H]2CCC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834319 1033959724 /nfs/dbraw/zinc/95/97/24/1033959724.db2.gz QNUWPUOEJHIVET-BBRMVZONSA-N 1 0 326.400 3.634 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCOc1ccccc1C ZINC000603869831 1033997076 /nfs/dbraw/zinc/99/70/76/1033997076.db2.gz OQIZTSZEILWXQT-UHFFFAOYSA-N 1 0 344.411 3.813 20 5 EHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000595785542 1034000398 /nfs/dbraw/zinc/00/03/98/1034000398.db2.gz XPULYPDFMMWVPD-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CC1(C)C ZINC000595909475 1034025893 /nfs/dbraw/zinc/02/58/93/1034025893.db2.gz OLRVGBRNXHMSRK-YPMHNXCESA-N 1 0 330.388 3.684 20 5 EHBDRO O=[N+]([O-])c1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1C(F)(F)F ZINC000596082048 1034074530 /nfs/dbraw/zinc/07/45/30/1034074530.db2.gz FIWGYAYUNMGDTK-NEPJUHHUSA-N 1 0 329.322 3.652 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000179371741 1034163426 /nfs/dbraw/zinc/16/34/26/1034163426.db2.gz IKVWHXWNEZJVGS-RYUDHWBXSA-N 1 0 347.440 3.951 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000179375738 1034257091 /nfs/dbraw/zinc/25/70/91/1034257091.db2.gz IIRXERFSJJUMLV-NEPJUHHUSA-N 1 0 347.440 3.951 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(CCO)CC2)s1 ZINC000534333533 1034409069 /nfs/dbraw/zinc/40/90/69/1034409069.db2.gz AWXDPUBRVMHOEZ-UHFFFAOYSA-N 1 0 346.452 3.918 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450487983 1034418213 /nfs/dbraw/zinc/41/82/13/1034418213.db2.gz NYNDIYYABCOHGT-CQSZACIVSA-N 1 0 346.456 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC/C=C/c3ccccc3)C2)nc1 ZINC000450556366 1034520337 /nfs/dbraw/zinc/52/03/37/1034520337.db2.gz AVTHHOJQMCSCAH-AUNFYEFLSA-N 1 0 338.411 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]4COC[C@H]4C3)s2)cc1 ZINC000597229665 1034611444 /nfs/dbraw/zinc/61/14/44/1034611444.db2.gz ICPRMVOVVVCWCA-HUUCEWRRSA-N 1 0 344.436 3.792 20 5 EHBDRO O=C(CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccc(F)cc1 ZINC000540865183 1034687747 /nfs/dbraw/zinc/68/77/47/1034687747.db2.gz DHTPETNRFXXTQG-UHFFFAOYSA-N 1 0 342.370 3.971 20 5 EHBDRO CCO[C@@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C[C@@H]1C ZINC000450745706 1034749394 /nfs/dbraw/zinc/74/93/94/1034749394.db2.gz PWCIDXMPZNXEDK-KPZWWZAWSA-N 1 0 329.400 3.703 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411126030 1034795032 /nfs/dbraw/zinc/79/50/32/1034795032.db2.gz NIMQJHVMDDJNKW-SFHVURJKSA-N 1 0 339.395 3.761 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000601962268 1034842255 /nfs/dbraw/zinc/84/22/55/1034842255.db2.gz CIHBDORBQSYQLC-GFCCVEGCSA-N 1 0 332.322 3.661 20 5 EHBDRO CN(c1ccc(F)cc1[N+](=O)[O-])C1CC[NH+](CCC(F)(F)F)CC1 ZINC000450949359 1034972019 /nfs/dbraw/zinc/97/20/19/1034972019.db2.gz JTFKRUVWTHBSEA-UHFFFAOYSA-N 1 0 349.328 3.587 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000179907144 1035010638 /nfs/dbraw/zinc/01/06/38/1035010638.db2.gz YIJOWODXVLFPAI-MRXNPFEDSA-N 1 0 342.395 3.731 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](c2ccc(C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000892527646 1035424035 /nfs/dbraw/zinc/42/40/35/1035424035.db2.gz VFCGHIHBHDPIIL-KRWDZBQOSA-N 1 0 342.395 3.858 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613179302 1035443478 /nfs/dbraw/zinc/44/34/78/1035443478.db2.gz SLKYQLLHTDNKSB-NVXWUHKLSA-N 1 0 325.412 3.924 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000540750706 1035640345 /nfs/dbraw/zinc/64/03/45/1035640345.db2.gz MSGJJOXPVSQWQJ-CYBMUJFWSA-N 1 0 340.379 3.972 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccs1 ZINC000029871574 1035770661 /nfs/dbraw/zinc/77/06/61/1035770661.db2.gz UYJXSLKGWUVHFW-HNNXBMFYSA-N 1 0 342.424 3.919 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000540917710 1035806851 /nfs/dbraw/zinc/80/68/51/1035806851.db2.gz HDPVIJCVEBPHTO-OAHLLOKOSA-N 1 0 326.824 3.586 20 5 EHBDRO C[C@H]1C[C@H](c2cccnc2)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204724 1035822922 /nfs/dbraw/zinc/82/29/22/1035822922.db2.gz ASUXXYDDVNSMKR-HNAYVOBHSA-N 1 0 341.411 3.842 20 5 EHBDRO CCOc1cc(C[N@H+](C)Cc2ccc(OC)c(C)c2)ccc1[N+](=O)[O-] ZINC000492603703 1036058099 /nfs/dbraw/zinc/05/80/99/1036058099.db2.gz CAUYYKZDYNTECB-UHFFFAOYSA-N 1 0 344.411 3.943 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201447 1036139554 /nfs/dbraw/zinc/13/95/54/1036139554.db2.gz YIDIYSPAUDJCND-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@](C)(OC)C2CC2)cc1[N+](=O)[O-] ZINC000414226283 1036152060 /nfs/dbraw/zinc/15/20/60/1036152060.db2.gz BUMXOKKBSBOSII-ZJNRKIDTSA-N 1 0 336.432 3.848 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000588928737 1036188796 /nfs/dbraw/zinc/18/87/96/1036188796.db2.gz OOVFUNJCDMWZMW-IMMZDGJCSA-N 1 0 346.814 3.627 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000152277227 1036272235 /nfs/dbraw/zinc/27/22/35/1036272235.db2.gz JVJQZGIPLOGXEY-MAUKXSAKSA-N 1 0 343.427 3.984 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)OCC2CC2)cc1[N+](=O)[O-] ZINC000414249860 1036276168 /nfs/dbraw/zinc/27/61/68/1036276168.db2.gz ARZYLTYGXLCGNC-CYBMUJFWSA-N 1 0 336.432 3.849 20 5 EHBDRO C[C@]1(CCCO)CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000589199783 1036306778 /nfs/dbraw/zinc/30/67/78/1036306778.db2.gz IGWXIPJHTDIPTB-LJQANCHMSA-N 1 0 344.411 3.982 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000589281441 1036340407 /nfs/dbraw/zinc/34/04/07/1036340407.db2.gz HFNRDCVUDKWDCV-HNAYVOBHSA-N 1 0 337.423 3.793 20 5 EHBDRO COc1ccc(OCC[N@H+](C)CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC000535329900 1036341391 /nfs/dbraw/zinc/34/13/91/1036341391.db2.gz NDMOLBDPUAMYEY-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H](C)O[C@H]1C ZINC000414284057 1036437614 /nfs/dbraw/zinc/43/76/14/1036437614.db2.gz QAPSHSNUPNXBCV-ZQDZILKHSA-N 1 0 338.473 3.869 20 5 EHBDRO C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)C1CCCCC1 ZINC000541601536 1036482300 /nfs/dbraw/zinc/48/23/00/1036482300.db2.gz GXIXZHYCGXMERE-CABCVRRESA-N 1 0 347.459 3.752 20 5 EHBDRO CCC[N@H+](CC)C[C@@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000589609001 1036549267 /nfs/dbraw/zinc/54/92/67/1036549267.db2.gz DITRPYPHUCXOFY-SNVBAGLBSA-N 1 0 334.342 3.541 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCc1c[nH]c2cc(F)ccc12 ZINC000541772077 1036643543 /nfs/dbraw/zinc/64/35/43/1036643543.db2.gz VSWQLGHTVXJZEZ-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677557 1036652250 /nfs/dbraw/zinc/65/22/50/1036652250.db2.gz LXLOIXRXELUVMC-MRXNPFEDSA-N 1 0 344.386 3.732 20 5 EHBDRO CCC[C@@H]([NH2+]CCc1cn2c(n1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000152784734 1036724062 /nfs/dbraw/zinc/72/40/62/1036724062.db2.gz GIFBWJLVFAOQNE-GOSISDBHSA-N 1 0 342.443 3.801 20 5 EHBDRO C[N@H+](CCOC(C)(C)C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000590162695 1036778530 /nfs/dbraw/zinc/77/85/30/1036778530.db2.gz BTTLKDMVWWVYKT-UHFFFAOYSA-N 1 0 334.338 3.861 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](CO)C2CCCCC2)c(Cl)c1 ZINC000590194596 1036793847 /nfs/dbraw/zinc/79/38/47/1036793847.db2.gz SABJPQDGTNTUGW-AWEZNQCLSA-N 1 0 326.824 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@H]3Cc3ccccc3)c2c1 ZINC000026235873 1036842082 /nfs/dbraw/zinc/84/20/82/1036842082.db2.gz OBRXLFOKULTMLD-QGZVFWFLSA-N 1 0 336.395 3.609 20 5 EHBDRO C[C@H]1CC[C@]2(CC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169501 1036870938 /nfs/dbraw/zinc/87/09/38/1036870938.db2.gz VLZICBROBABZKZ-UGSOOPFHSA-N 1 0 349.406 3.575 20 5 EHBDRO C[C@@H](CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)NC(=O)OC(C)(C)C ZINC000180521809 1036913307 /nfs/dbraw/zinc/91/33/07/1036913307.db2.gz ZLSRJRNNPLPAAU-STQMWFEESA-N 1 0 337.420 3.549 20 5 EHBDRO CC(C)[C@@](C)(O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528249 1036919440 /nfs/dbraw/zinc/91/94/40/1036919440.db2.gz KDLNFJOAUYJPJO-MOPGFXCFSA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)cn1 ZINC000590690506 1037010763 /nfs/dbraw/zinc/01/07/63/1037010763.db2.gz LGTDBUUJNCSXQV-KRWDZBQOSA-N 1 0 326.400 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H](c3ccncc3)C2)cc1 ZINC000590741179 1037040522 /nfs/dbraw/zinc/04/05/22/1037040522.db2.gz ZURKGIDWRBDVNZ-QGZVFWFLSA-N 1 0 341.411 3.638 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CCC([NH+]3CCC(C)CC3)CC2)n1 ZINC000443697746 1037099539 /nfs/dbraw/zinc/09/95/39/1037099539.db2.gz YGDKYIIVMSOVMQ-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO COc1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)ccc1C ZINC000761528011 1037105195 /nfs/dbraw/zinc/10/51/95/1037105195.db2.gz XERIAJJTXXZQOV-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000193024473 1037271985 /nfs/dbraw/zinc/27/19/85/1037271985.db2.gz CEVOBRLZLLUOEO-JKSUJKDBSA-N 1 0 333.457 4.000 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@H]1Cc1ccccc1 ZINC000462751801 1037364373 /nfs/dbraw/zinc/36/43/73/1037364373.db2.gz CFKAMZYKGYEIPL-CRAIPNDOSA-N 1 0 326.396 3.714 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](CO)Cc1ccc(F)cc1 ZINC000532470080 1037404887 /nfs/dbraw/zinc/40/48/87/1037404887.db2.gz VGVSRXJLZACGDT-GOEBONIOSA-N 1 0 346.402 3.544 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@H]2CC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601347 1037486271 /nfs/dbraw/zinc/48/62/71/1037486271.db2.gz BOXHHPOAESDGLA-HOCLYGCPSA-N 1 0 336.432 3.631 20 5 EHBDRO Cc1cc(NC[C@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302187279 1037490462 /nfs/dbraw/zinc/49/04/62/1037490462.db2.gz PXJZYROOMKEJDC-SFHVURJKSA-N 1 0 341.342 3.736 20 5 EHBDRO CCc1ccc([C@H](N[C@H]2CCC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578385 1037517628 /nfs/dbraw/zinc/51/76/28/1037517628.db2.gz YIQJZLXTHBPKRW-HNAYVOBHSA-N 1 0 343.427 3.571 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000532518770 1037559441 /nfs/dbraw/zinc/55/94/41/1037559441.db2.gz UWNOFEHWLFBNRQ-GJZGRUSLSA-N 1 0 341.411 3.657 20 5 EHBDRO CO[C@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390318 1037620508 /nfs/dbraw/zinc/62/05/08/1037620508.db2.gz ZNXWRVLFIYPQAX-LJQANCHMSA-N 1 0 326.396 3.947 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@H]1C1CC1 ZINC000540151696 1037622968 /nfs/dbraw/zinc/62/29/68/1037622968.db2.gz STQMMJBKVPULMZ-CPUCHLNUSA-N 1 0 336.457 3.623 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])s2)CC1 ZINC000591822232 1037637052 /nfs/dbraw/zinc/63/70/52/1037637052.db2.gz LHQWWMCWPZDYFL-GFCCVEGCSA-N 1 0 332.429 3.689 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1ccsc1)N(C)C ZINC000468639622 1037655583 /nfs/dbraw/zinc/65/55/83/1037655583.db2.gz GCXWLKFLNPQWDO-MXHVWWQHSA-N 1 0 345.468 3.952 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc([N+](=O)[O-])cn2)CC1)CC(C)C ZINC000540205575 1037683974 /nfs/dbraw/zinc/68/39/74/1037683974.db2.gz KZAONVNSFWREQD-UHFFFAOYSA-N 1 0 334.464 3.574 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000046037859 1037730167 /nfs/dbraw/zinc/73/01/67/1037730167.db2.gz PLKDVUQYJARRFF-KRWDZBQOSA-N 1 0 342.395 3.949 20 5 EHBDRO COc1cc(CN2CC3(CCCC3)OC(C)(C)C2)ccc1[N+](=O)[O-] ZINC000443306725 1037763273 /nfs/dbraw/zinc/76/32/73/1037763273.db2.gz BGDZZORXZCMOIS-UHFFFAOYSA-N 1 0 334.416 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266260 1037813925 /nfs/dbraw/zinc/81/39/25/1037813925.db2.gz MMCVKFGFNRHEQZ-BBRMVZONSA-N 1 0 342.399 3.799 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000463198575 1037864013 /nfs/dbraw/zinc/86/40/13/1037864013.db2.gz NKMMWJVLBOQQFG-NUJGCVRESA-N 1 0 348.443 3.509 20 5 EHBDRO COc1cc(C[NH2+]C2(c3cccc(F)c3)CCC2)ccc1[N+](=O)[O-] ZINC000592145754 1037874791 /nfs/dbraw/zinc/87/47/91/1037874791.db2.gz ZGDNCNORTWNMSO-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO Cc1ccc(CN(Cc2ccco2)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000290563623 1037900213 /nfs/dbraw/zinc/90/02/13/1037900213.db2.gz SMQZKGFLNGQKKL-UHFFFAOYSA-N 1 0 343.427 3.593 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](C1CC1)C1CCCC1 ZINC000103466260 1037900434 /nfs/dbraw/zinc/90/04/34/1037900434.db2.gz ZKXGMCZLEIVSEP-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO COc1cccc(CC[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000468644299 1037918083 /nfs/dbraw/zinc/91/80/83/1037918083.db2.gz ZSHHBJDNYDHMJA-RVDMUPIBSA-N 1 0 326.396 3.839 20 5 EHBDRO CC1CCC([N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000053170403 1037919419 /nfs/dbraw/zinc/91/94/19/1037919419.db2.gz QXIGNYNULKSMLT-UHFFFAOYSA-N 1 0 331.416 3.576 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000540463546 1037964209 /nfs/dbraw/zinc/96/42/09/1037964209.db2.gz CQBDKJJVPVFHFI-QGZVFWFLSA-N 1 0 345.424 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC3(CC2)OCc2ccccc23)cc1 ZINC000378133431 1037985834 /nfs/dbraw/zinc/98/58/34/1037985834.db2.gz KRFSMSYMDVAUBT-UHFFFAOYSA-N 1 0 338.407 3.659 20 5 EHBDRO COc1ccc([C@H](C)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481619 1037993142 /nfs/dbraw/zinc/99/31/42/1037993142.db2.gz YEAPNJKMRJKBPT-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)C1CN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000686274669 1037995827 /nfs/dbraw/zinc/99/58/27/1037995827.db2.gz BOUQAPDURSIOEE-CHWSQXEVSA-N 1 0 349.431 3.501 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1cc(C)c([N+](=O)[O-])cn1)c1ccccc1 ZINC000325693559 1038079197 /nfs/dbraw/zinc/07/91/97/1038079197.db2.gz SUBYNSCKNHAVIL-KRWDZBQOSA-N 1 0 328.416 3.793 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000897470138 1038241773 /nfs/dbraw/zinc/24/17/73/1038241773.db2.gz YVZOJWSVHCCXPZ-GFCCVEGCSA-N 1 0 340.383 3.780 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CCC2(C1)CC[NH2+]CC2 ZINC000378399219 1038583867 /nfs/dbraw/zinc/58/38/67/1038583867.db2.gz HSYDKSOFPUPDNA-UHFFFAOYSA-N 1 0 345.446 3.604 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC3(C2)CCCCC3)c2c(c1)COCO2 ZINC000408072211 1038634535 /nfs/dbraw/zinc/63/45/35/1038634535.db2.gz NCMHKPYPOWWPKU-UHFFFAOYSA-N 1 0 332.400 3.618 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](C)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961578 1038698376 /nfs/dbraw/zinc/69/83/76/1038698376.db2.gz XUMUGMBNYAFZQO-QWRGUYRKSA-N 1 0 331.338 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000552034825 1038754727 /nfs/dbraw/zinc/75/47/27/1038754727.db2.gz BXLLHLFXMMBMCA-KRWDZBQOSA-N 1 0 344.415 3.608 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N(C)C)cccc1[N+](=O)[O-] ZINC000479847021 1038804018 /nfs/dbraw/zinc/80/40/18/1038804018.db2.gz AHMUPHWJWZGIAD-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(c2ccc(F)cc2F)CCC1 ZINC000539359650 1038847605 /nfs/dbraw/zinc/84/76/05/1038847605.db2.gz XRAUFTNAUOEZNP-UHFFFAOYSA-N 1 0 348.349 3.921 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000028166126 1038897143 /nfs/dbraw/zinc/89/71/43/1038897143.db2.gz PDRDHBGSVURHEJ-UHFFFAOYSA-N 1 0 331.397 3.504 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2c3ccccc3CC[C@H]2C)c1[N+](=O)[O-] ZINC000893269349 1038941044 /nfs/dbraw/zinc/94/10/44/1038941044.db2.gz NWJZKKHFDURHLP-SJKOYZFVSA-N 1 0 342.395 3.722 20 5 EHBDRO CN(CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000480218880 1039317721 /nfs/dbraw/zinc/31/77/21/1039317721.db2.gz DOMNIDCKFATASK-LJQANCHMSA-N 1 0 339.439 3.642 20 5 EHBDRO C[C@@H](O)[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000584634739 1039396203 /nfs/dbraw/zinc/39/62/03/1039396203.db2.gz JHDJPZBMCULTGG-LPMFXHHGSA-N 1 0 346.402 3.767 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429833461 1039417444 /nfs/dbraw/zinc/41/74/44/1039417444.db2.gz UJNDXXZNMALFLN-UHFFFAOYSA-N 1 0 341.411 3.573 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCN(c2ccccc2)CC1 ZINC000485720229 1039461103 /nfs/dbraw/zinc/46/11/03/1039461103.db2.gz XNQAGGHNLITWIT-INIZCTEOSA-N 1 0 325.412 3.786 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488974701 1039519408 /nfs/dbraw/zinc/51/94/08/1039519408.db2.gz IVNBWIURMNDNRF-XJKSGUPXSA-N 1 0 345.374 3.733 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000480444407 1039563980 /nfs/dbraw/zinc/56/39/80/1039563980.db2.gz MCCFVGXAARMQOL-HNNXBMFYSA-N 1 0 334.416 3.575 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)O ZINC000480444951 1039566557 /nfs/dbraw/zinc/56/65/57/1039566557.db2.gz MSMHNBFKDFXVQG-HNNXBMFYSA-N 1 0 349.456 3.603 20 5 EHBDRO Cc1cccc(CC[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000569216877 1039699684 /nfs/dbraw/zinc/69/96/84/1039699684.db2.gz CBEWNHOFBSBZRW-QGZVFWFLSA-N 1 0 325.412 3.720 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298583 1039815733 /nfs/dbraw/zinc/81/57/33/1039815733.db2.gz WZEQYKDAVIBUKV-VXGBXAGGSA-N 1 0 341.839 3.943 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192951760 1040158203 /nfs/dbraw/zinc/15/82/03/1040158203.db2.gz IUOCRVLSPZVWJW-AWEZNQCLSA-N 1 0 346.818 3.577 20 5 EHBDRO CC(C)(C[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1=CCCC1 ZINC000573594881 1040173501 /nfs/dbraw/zinc/17/35/01/1040173501.db2.gz BNVGLALJRLTYDY-UHFFFAOYSA-N 1 0 331.416 3.650 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128287340 1040287481 /nfs/dbraw/zinc/28/74/81/1040287481.db2.gz BAXAMESXXUOEJA-QWHCGFSZSA-N 1 0 337.395 3.573 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)CC1CCC1 ZINC000479555399 1040374423 /nfs/dbraw/zinc/37/44/23/1040374423.db2.gz OOWBPPURTXKPNW-HUUCEWRRSA-N 1 0 338.473 3.606 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000486785935 1040460417 /nfs/dbraw/zinc/46/04/17/1040460417.db2.gz FQJTXCRMPJJNTR-CQSZACIVSA-N 1 0 349.431 3.587 20 5 EHBDRO CC(C)CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000553865294 1040541994 /nfs/dbraw/zinc/54/19/94/1040541994.db2.gz HYVBFNMSNBYMRU-UHFFFAOYSA-N 1 0 333.432 3.824 20 5 EHBDRO CO[C@@H](CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433075770 1040635792 /nfs/dbraw/zinc/63/57/92/1040635792.db2.gz LGUYIHQBZIQUMA-KBPBESRZSA-N 1 0 346.349 3.874 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000092687371 1040696255 /nfs/dbraw/zinc/69/62/55/1040696255.db2.gz JTVYJOZBYRUZQC-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@H]1OCC[C@]1(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000542315258 1040734052 /nfs/dbraw/zinc/73/40/52/1040734052.db2.gz CWVVFDHHRVQJTG-PXAZEXFGSA-N 1 0 332.425 3.980 20 5 EHBDRO O=C(N[C@@H]1CC[N@@H+]2CCCC[C@@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355741 1040767762 /nfs/dbraw/zinc/76/77/62/1040767762.db2.gz WCDDTPNNRMXCRJ-UXHICEINSA-N 1 0 345.446 3.745 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123225528 1040785491 /nfs/dbraw/zinc/78/54/91/1040785491.db2.gz FLRKFHOXPAVSMS-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO COc1cc(NCc2cccc(C[NH+]3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000174679287 1040915598 /nfs/dbraw/zinc/91/55/98/1040915598.db2.gz QRCHZQICXQDFLD-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ccc(F)c(F)c1)C1CC1 ZINC000481554706 1041051376 /nfs/dbraw/zinc/05/13/76/1041051376.db2.gz BINBOBLVWGHTLK-QGZVFWFLSA-N 1 0 332.350 3.984 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)(C)[C@@H]2CCC[C@H]21 ZINC000555721205 1041058771 /nfs/dbraw/zinc/05/87/71/1041058771.db2.gz IRYKRCZGHRZCSG-NVXWUHKLSA-N 1 0 345.443 3.742 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000453431312 1041101686 /nfs/dbraw/zinc/10/16/86/1041101686.db2.gz RKMSSNWIIALXGQ-UONOGXRCSA-N 1 0 336.432 3.849 20 5 EHBDRO CCC[C@@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000512890743 1041180290 /nfs/dbraw/zinc/18/02/90/1041180290.db2.gz MIJVNJTXFCOKSQ-GOSISDBHSA-N 1 0 330.384 3.904 20 5 EHBDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433295446 1041248069 /nfs/dbraw/zinc/24/80/69/1041248069.db2.gz DMNSNURCXGDWBW-DLBZAZTESA-N 1 0 334.460 3.950 20 5 EHBDRO COc1cccc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433297133 1041250548 /nfs/dbraw/zinc/25/05/48/1041250548.db2.gz VKIZWILFJHGKLA-KRWDZBQOSA-N 1 0 341.411 3.553 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1csc([N+](=O)[O-])c1 ZINC000045085962 1042036963 /nfs/dbraw/zinc/03/69/63/1042036963.db2.gz NFEZXVIGWQSAQX-UHFFFAOYSA-N 1 0 331.397 3.504 20 5 EHBDRO CCCO[C@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000108392799 1042047089 /nfs/dbraw/zinc/04/70/89/1042047089.db2.gz WXGBAZRQQNUKMO-KRWDZBQOSA-N 1 0 336.432 3.645 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC000749663149 1042362382 /nfs/dbraw/zinc/36/23/82/1042362382.db2.gz NKMSEMZBQXGGCU-ROUUACIJSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCS[C@H](C)CC1 ZINC000249142573 1042533743 /nfs/dbraw/zinc/53/37/43/1042533743.db2.gz ZPILTHLLYYXTRN-VXGBXAGGSA-N 1 0 348.428 3.533 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799436 1042700586 /nfs/dbraw/zinc/70/05/86/1042700586.db2.gz ZMGDHQPYHQJVRS-BBRMVZONSA-N 1 0 334.416 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@@H](CO)c1c(F)cccc1F)CCC2 ZINC000278877604 1042809420 /nfs/dbraw/zinc/80/94/20/1042809420.db2.gz XMRMGWIFYRBOLW-SJORKVTESA-N 1 0 348.349 3.574 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000051650257 1042833946 /nfs/dbraw/zinc/83/39/46/1042833946.db2.gz VCKWOEBRSDKBAN-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1cccc(OC)c1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000511995857 1042948382 /nfs/dbraw/zinc/94/83/82/1042948382.db2.gz DCOWZNBACCPPGT-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCCCC[C@H]3CCO)o2)c1 ZINC000585767887 1043030405 /nfs/dbraw/zinc/03/04/05/1043030405.db2.gz XQHFCCFJTCYKMB-INIZCTEOSA-N 1 0 344.411 3.982 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411124 1044062894 /nfs/dbraw/zinc/06/28/94/1044062894.db2.gz DUGBDYNNZULVPX-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO C[N@@H+](Cc1ccc(F)c(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000763823644 1126877228 /nfs/dbraw/zinc/87/72/28/1126877228.db2.gz JHXJVZLJADNXEW-INIZCTEOSA-N 1 0 338.766 3.553 20 5 EHBDRO CC1CCC(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000765306759 1127596775 /nfs/dbraw/zinc/59/67/75/1127596775.db2.gz JLXDVWJGPVEXCL-UHFFFAOYSA-N 1 0 331.460 3.980 20 5 EHBDRO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)C(=O)OCC[C@H]1CCCC[N@@H+]1C ZINC000765525274 1127640394 /nfs/dbraw/zinc/64/03/94/1127640394.db2.gz CJZPAOZZUGFURQ-DLBZAZTESA-N 1 0 348.443 3.581 20 5 EHBDRO COc1cc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000301337534 1127738438 /nfs/dbraw/zinc/73/84/38/1127738438.db2.gz DPCYWWAQNWBDBB-INIZCTEOSA-N 1 0 345.399 3.836 20 5 EHBDRO Cc1cc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000301427762 1127764915 /nfs/dbraw/zinc/76/49/15/1127764915.db2.gz IHNLBXWKZGOINZ-SUMWQHHRSA-N 1 0 346.456 3.855 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000196789675 1128212098 /nfs/dbraw/zinc/21/20/98/1128212098.db2.gz JPHMBAZUJIXNPD-UHFFFAOYSA-N 1 0 342.370 3.902 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1 ZINC000326686161 1128430325 /nfs/dbraw/zinc/43/03/25/1128430325.db2.gz IUXMHICALQSZCN-GUDVDZBRSA-N 1 0 332.444 3.543 20 5 EHBDRO COc1cc(N[C@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609980 1128520284 /nfs/dbraw/zinc/52/02/84/1128520284.db2.gz BUCFYTUYAXOSQV-YOEHRIQHSA-N 1 0 341.411 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCc3c2cccc3Cl)cc1 ZINC000765848621 1128559418 /nfs/dbraw/zinc/55/94/18/1128559418.db2.gz JFKBJYMSWMPDCG-SJORKVTESA-N 1 0 332.787 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000765848651 1128559835 /nfs/dbraw/zinc/55/98/35/1128559835.db2.gz KNQCOIXCJWZVJC-DLBZAZTESA-N 1 0 332.787 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC000765849004 1128573721 /nfs/dbraw/zinc/57/37/21/1128573721.db2.gz NMGIHOQPPJCILJ-SLFFLAALSA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C1CC(C(F)(F)F)C1)C1CC1 ZINC000554119007 1128619506 /nfs/dbraw/zinc/61/95/06/1128619506.db2.gz VCBAJDOTJXCFCI-RUXDESIVSA-N 1 0 328.334 3.846 20 5 EHBDRO COCC[C@H](Cc1cccc(F)c1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123161662 1128660150 /nfs/dbraw/zinc/66/01/50/1128660150.db2.gz SHPHDCCBNCAWFA-GOSISDBHSA-N 1 0 346.402 3.514 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@@H+]1Cc1ccccc1 ZINC000301636018 1128776550 /nfs/dbraw/zinc/77/65/50/1128776550.db2.gz WRDYUQICNGYRKI-GXTWGEPZSA-N 1 0 346.818 3.718 20 5 EHBDRO CCc1ccc([C@H](CNc2ccc([N+](=O)[O-])c(C)n2)[NH+](C)C)cc1 ZINC000301646006 1128822805 /nfs/dbraw/zinc/82/28/05/1128822805.db2.gz NSFJNXDCCYBSGM-KRWDZBQOSA-N 1 0 328.416 3.575 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)C1 ZINC000338747784 1128831857 /nfs/dbraw/zinc/83/18/57/1128831857.db2.gz VAJZKJMYIIKJPS-HNNXBMFYSA-N 1 0 343.349 3.536 20 5 EHBDRO Cc1nc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651009 1128846040 /nfs/dbraw/zinc/84/60/40/1128846040.db2.gz JUODLXGCXRDQAN-GUYCJALGSA-N 1 0 346.456 3.855 20 5 EHBDRO Cc1nc(Nc2ccc(CC[NH+]3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000301679718 1128899519 /nfs/dbraw/zinc/89/95/19/1128899519.db2.gz UOGCCLAETXYICH-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO CC(C)(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000054396904 1120372282 /nfs/dbraw/zinc/37/22/82/1120372282.db2.gz PTZOHVLZOMVLQY-SFHVURJKSA-N 1 0 341.411 3.910 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCOC1 ZINC000494449503 1120561935 /nfs/dbraw/zinc/56/19/35/1120561935.db2.gz YMDIRVKLBWDJIC-FZMZJTMJSA-N 1 0 332.322 3.518 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000542497309 1120785134 /nfs/dbraw/zinc/78/51/34/1120785134.db2.gz AICKVBSQJVWZAY-CABCVRRESA-N 1 0 332.400 3.795 20 5 EHBDRO CC(C)[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[NH+]1CCCC1 ZINC000301064877 1121296087 /nfs/dbraw/zinc/29/60/87/1121296087.db2.gz HAXSIUAFONYPCS-SFHVURJKSA-N 1 0 328.416 3.675 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000193503590 1121359413 /nfs/dbraw/zinc/35/94/13/1121359413.db2.gz KAHJRMGLJQUYKZ-DOMZBBRYSA-N 1 0 345.365 3.520 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(c2cnn(C)c2)CC1 ZINC000272272247 1121509774 /nfs/dbraw/zinc/50/97/74/1121509774.db2.gz DJLQEPNXPHKXGB-CQSZACIVSA-N 1 0 328.416 3.577 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000301085570 1121515541 /nfs/dbraw/zinc/51/55/41/1121515541.db2.gz JARCRGNHQSPECW-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO COc1cccc([C@H](CNc2ccc(C)cc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301098273 1121604702 /nfs/dbraw/zinc/60/47/02/1121604702.db2.gz SATQTHWJGUYSHP-SFHVURJKSA-N 1 0 329.400 3.627 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1(C)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272475955 1121658621 /nfs/dbraw/zinc/65/86/21/1121658621.db2.gz BGCQPLOSASDSQB-MRXNPFEDSA-N 1 0 328.416 3.588 20 5 EHBDRO CCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000272565515 1121719863 /nfs/dbraw/zinc/71/98/63/1121719863.db2.gz UYUQLWGNSGAPOH-MRXNPFEDSA-N 1 0 328.416 3.588 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000194015884 1121753615 /nfs/dbraw/zinc/75/36/15/1121753615.db2.gz MRMAJWHQSSGXNB-IBGZPJMESA-N 1 0 342.395 3.723 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180133 1121797754 /nfs/dbraw/zinc/79/77/54/1121797754.db2.gz GNNJYBDKEINUEP-WFASDCNBSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000301753107 1129035829 /nfs/dbraw/zinc/03/58/29/1129035829.db2.gz VYIOCCCOXUEYNZ-LBPRGKRZSA-N 1 0 334.807 3.576 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000301166838 1122222474 /nfs/dbraw/zinc/22/24/74/1122222474.db2.gz CGIXWABQHWPYAD-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO COc1ccccc1[C@H](CNc1c(C)cccc1[N+](=O)[O-])[NH+](C)C ZINC000301203698 1122511538 /nfs/dbraw/zinc/51/15/38/1122511538.db2.gz XUNXHZFSSZJDLN-INIZCTEOSA-N 1 0 329.400 3.627 20 5 EHBDRO CN1CC[NH2+]C[C@H]1c1nc(-c2cc3ccccc3c3ccccc23)no1 ZINC001212224463 1122513329 /nfs/dbraw/zinc/51/33/29/1122513329.db2.gz MXMKPDQWEXKKBC-IBGZPJMESA-N 1 0 344.418 3.619 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154306678 1122548493 /nfs/dbraw/zinc/54/84/93/1122548493.db2.gz UJZHNCHPUPMABP-BJZITVGISA-N 1 0 326.396 3.506 20 5 EHBDRO Cc1cc(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301217130 1122741851 /nfs/dbraw/zinc/74/18/51/1122741851.db2.gz ZNWJOWLTXHKQCZ-SFHVURJKSA-N 1 0 339.439 3.880 20 5 EHBDRO CC(C)C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301784061 1129076126 /nfs/dbraw/zinc/07/61/26/1129076126.db2.gz OEOZOOLUUZUVOF-OAHLLOKOSA-N 1 0 342.443 3.923 20 5 EHBDRO CN(C/C=C\c1ccccc1[N+](=O)[O-])Cc1nc2ccccc2n1C ZINC000255460742 1129113038 /nfs/dbraw/zinc/11/30/38/1129113038.db2.gz ZOPXKWIPWQJTHK-CLFYSBASSA-N 1 0 336.395 3.627 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000007783595 1123353504 /nfs/dbraw/zinc/35/35/04/1123353504.db2.gz YYPFYSMFWSFMNZ-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609425631 1123577011 /nfs/dbraw/zinc/57/70/11/1123577011.db2.gz NMKIQEZANOCVQH-OAHLLOKOSA-N 1 0 348.447 3.679 20 5 EHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001845 1123710941 /nfs/dbraw/zinc/71/09/41/1123710941.db2.gz DSIHTARBBOQNJP-SUMWQHHRSA-N 1 0 334.416 3.862 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000130782417 1123731364 /nfs/dbraw/zinc/73/13/64/1123731364.db2.gz AIIBYIGRSPLDBX-HNAYVOBHSA-N 1 0 328.412 3.548 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000081572246 1123848254 /nfs/dbraw/zinc/84/82/54/1123848254.db2.gz QDKHKBRRLPWTCN-MRXNPFEDSA-N 1 0 349.475 3.546 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([S@](C)=O)cc1 ZINC000615724350 1123864367 /nfs/dbraw/zinc/86/43/67/1123864367.db2.gz XNSDEQWQBHETKT-ZFVPXTALSA-N 1 0 344.436 3.525 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615966694 1123919379 /nfs/dbraw/zinc/91/93/79/1123919379.db2.gz IDNVRAPCVJGOEF-GDBMZVCRSA-N 1 0 330.432 3.727 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000734839147 1131284219 /nfs/dbraw/zinc/28/42/19/1131284219.db2.gz XJMYDQCJKYSHCO-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)c2cc([N+](=O)[O-])ccc21 ZINC000618988423 1125262917 /nfs/dbraw/zinc/26/29/17/1125262917.db2.gz KJKBGWLUVALANL-VIBAHUMZSA-N 1 0 342.439 3.864 20 5 EHBDRO O=[N+]([O-])c1sccc1NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000619501077 1125356206 /nfs/dbraw/zinc/35/62/06/1125356206.db2.gz QHBMMZDSBCDBRR-UHFFFAOYSA-N 1 0 349.378 3.874 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000182940920 1125406300 /nfs/dbraw/zinc/40/63/00/1125406300.db2.gz MPLMVYJDMFRYOO-LBPRGKRZSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc(Cl)c1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000067743359 1129302067 /nfs/dbraw/zinc/30/20/67/1129302067.db2.gz OGMBXRWKKRAVRL-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247735 1129370987 /nfs/dbraw/zinc/37/09/87/1129370987.db2.gz HYTRUVCPMJZSAN-KGLIPLIRSA-N 1 0 333.432 3.598 20 5 EHBDRO O=[N+]([O-])c1ccsc1Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000301974065 1129464548 /nfs/dbraw/zinc/46/45/48/1129464548.db2.gz AJFCTARPUFHDKH-UHFFFAOYSA-N 1 0 335.454 3.949 20 5 EHBDRO CCOc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971350 1129465975 /nfs/dbraw/zinc/46/59/75/1129465975.db2.gz GFQJSYWUWVDUKL-VQIMIIECSA-N 1 0 341.411 3.851 20 5 EHBDRO CC(C)(C)Oc1cc(N2CCC[C@H]([NH+]3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000301996664 1129505452 /nfs/dbraw/zinc/50/54/52/1129505452.db2.gz UBEZHPBITMYPDD-INIZCTEOSA-N 1 0 347.459 3.837 20 5 EHBDRO C[C@H](c1ccncc1)N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091987766 1129529385 /nfs/dbraw/zinc/52/93/85/1129529385.db2.gz AIIIXDPHSOMSLE-CYBMUJFWSA-N 1 0 338.367 3.838 20 5 EHBDRO Cc1ccc([C@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N2CCCC2)o1 ZINC000154053678 1129530805 /nfs/dbraw/zinc/53/08/05/1129530805.db2.gz XTDNMJIUVQPJRB-QAPCUYQASA-N 1 0 343.427 3.984 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000328113000 1129548580 /nfs/dbraw/zinc/54/85/80/1129548580.db2.gz UYTPKRJJDIVYOW-JZXOWHBKSA-N 1 0 348.443 3.509 20 5 EHBDRO CC(C)[C@@H](O)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000123826119 1129556313 /nfs/dbraw/zinc/55/63/13/1129556313.db2.gz CVFONNKHCCEONE-WFASDCNBSA-N 1 0 334.441 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000389446736 1129574962 /nfs/dbraw/zinc/57/49/62/1129574962.db2.gz VBBZXPNYBONRHB-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC1CCOCC1 ZINC000093284287 1129582438 /nfs/dbraw/zinc/58/24/38/1129582438.db2.gz YEIYBCVWQPPOCE-UHFFFAOYSA-N 1 0 347.440 3.577 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000093387555 1129586464 /nfs/dbraw/zinc/58/64/64/1129586464.db2.gz BIQNSRBUGIDAHR-MUPIXQSSSA-N 1 0 338.407 3.590 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000735871625 1131384484 /nfs/dbraw/zinc/38/44/84/1131384484.db2.gz LZFDXLUIUBBTLI-LJQANCHMSA-N 1 0 346.402 3.753 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000390053705 1129602096 /nfs/dbraw/zinc/60/20/96/1129602096.db2.gz KWVGUEJWKBNNJK-UHFFFAOYSA-N 1 0 332.375 3.819 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154971184 1129602343 /nfs/dbraw/zinc/60/23/43/1129602343.db2.gz IINMUZQPCFBYAV-FZKQIMNGSA-N 1 0 331.391 3.687 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390557284 1129623062 /nfs/dbraw/zinc/62/30/62/1129623062.db2.gz IRQRZBLFGBWBLE-JKSUJKDBSA-N 1 0 327.428 3.766 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000330961008 1129649773 /nfs/dbraw/zinc/64/97/73/1129649773.db2.gz JMLMJWGCHJEKBS-CYBMUJFWSA-N 1 0 332.322 3.766 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000155953576 1129682479 /nfs/dbraw/zinc/68/24/79/1129682479.db2.gz WALVXTPQOCDSRE-UAGQMJEPSA-N 1 0 328.416 3.934 20 5 EHBDRO Cc1cc(N[C@H](C)C[C@@H](O)c2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302088405 1129767785 /nfs/dbraw/zinc/76/77/85/1129767785.db2.gz OJOHFICLBUSSNZ-SJKOYZFVSA-N 1 0 341.367 3.969 20 5 EHBDRO Cc1cc(NCc2cccnc2N(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302138731 1129769661 /nfs/dbraw/zinc/76/96/61/1129769661.db2.gz DWODLHFOOVWLLI-UHFFFAOYSA-N 1 0 337.383 3.525 20 5 EHBDRO COCc1ccc([C@@H]2CCCN2Cc2cc([N+](=O)[O-])ccc2OC)o1 ZINC000131141402 1129770693 /nfs/dbraw/zinc/77/06/93/1129770693.db2.gz LHCHBVNNJMFUBD-INIZCTEOSA-N 1 0 346.383 3.680 20 5 EHBDRO Cc1ccc2[nH+]ccc(N3CC[C@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1 ZINC000302795369 1129792271 /nfs/dbraw/zinc/79/22/71/1129792271.db2.gz OPDWVRGSBNGQLC-AWEZNQCLSA-N 1 0 349.394 3.537 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(F)ccc1F ZINC000056197015 1129805995 /nfs/dbraw/zinc/80/59/95/1129805995.db2.gz XPPKPPRQHOSSCX-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO Cc1nc(NC2CCC([NH+]3CCC(C)CC3)CC2)ccc1[N+](=O)[O-] ZINC000132192676 1129881160 /nfs/dbraw/zinc/88/11/60/1129881160.db2.gz XRQMTZCBJVEYMH-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO CC(C)C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCC1 ZINC000507737492 1129974130 /nfs/dbraw/zinc/97/41/30/1129974130.db2.gz AYUDULWNMOCZKH-UHFFFAOYSA-N 1 0 334.416 3.862 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509059 1129974567 /nfs/dbraw/zinc/97/45/67/1129974567.db2.gz SQGZRWBBRNFERJ-SJORKVTESA-N 1 0 328.416 3.837 20 5 EHBDRO CCOC(=O)CC(C)(C)CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429235965 1130162167 /nfs/dbraw/zinc/16/21/67/1130162167.db2.gz KLUQGGBIGWIQNO-UHFFFAOYSA-N 1 0 336.432 3.789 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173334085 1130210291 /nfs/dbraw/zinc/21/02/91/1130210291.db2.gz OMRWSIXZNSGDNF-ACJLOTCBSA-N 1 0 331.391 3.687 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173357758 1130216694 /nfs/dbraw/zinc/21/66/94/1130216694.db2.gz UAOHDMSRVSCBTH-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363551 1130219596 /nfs/dbraw/zinc/21/95/96/1130219596.db2.gz MYYMDQJYYMCLPG-YOEHRIQHSA-N 1 0 331.416 3.922 20 5 EHBDRO C[C@@H](CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000173391781 1130222271 /nfs/dbraw/zinc/22/22/71/1130222271.db2.gz FWXDUYSMEDKGFX-STQMWFEESA-N 1 0 337.420 3.549 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)C1 ZINC000766107780 1130322941 /nfs/dbraw/zinc/32/29/41/1130322941.db2.gz JMCYNWUYSIYBBU-QLPKVWCKSA-N 1 0 331.460 3.978 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000245870568 1130325168 /nfs/dbraw/zinc/32/51/68/1130325168.db2.gz LADHCOQOQBCUBU-WPPQDWHVSA-N 1 0 346.427 3.602 20 5 EHBDRO CC(C)n1cnnc1[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246191471 1130354224 /nfs/dbraw/zinc/35/42/24/1130354224.db2.gz UBSOWEIZGBFNTQ-ZBFHGGJFSA-N 1 0 343.431 3.708 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC000730454181 1130711796 /nfs/dbraw/zinc/71/17/96/1130711796.db2.gz IONRHSXAXOMGDC-CYBMUJFWSA-N 1 0 340.358 3.531 20 5 EHBDRO C[N@H+](CCNc1nc2ccc([N+](=O)[O-])cc2s1)Cc1ccccc1 ZINC000731209237 1130779055 /nfs/dbraw/zinc/77/90/55/1130779055.db2.gz NJGCJTFBMOAION-UHFFFAOYSA-N 1 0 342.424 3.748 20 5 EHBDRO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892954 1130857322 /nfs/dbraw/zinc/85/73/22/1130857322.db2.gz LDMRXZVQNJNGRD-QINHECLXSA-N 1 0 340.423 3.988 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCCOc1ccccc1)CC2 ZINC001172901611 1131885106 /nfs/dbraw/zinc/88/51/06/1131885106.db2.gz OWYJSMSRSNBHSW-SFHVURJKSA-N 1 0 340.423 3.901 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1Cc3cccc(F)c3C1)CC2 ZINC001172914465 1131903049 /nfs/dbraw/zinc/90/30/49/1131903049.db2.gz GWFHBLAYHZYLJS-MRXNPFEDSA-N 1 0 326.371 3.997 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381055 1131914092 /nfs/dbraw/zinc/91/40/92/1131914092.db2.gz SZYDYGVHTNKFKH-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO C[C@@H](C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172911306 1131918001 /nfs/dbraw/zinc/91/80/01/1131918001.db2.gz IIBRMRGPIRJTFN-KBXCAEBGSA-N 1 0 340.423 3.941 20 5 EHBDRO CC(C)[N@H+](CCCCCO)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911734 1131918016 /nfs/dbraw/zinc/91/80/16/1131918016.db2.gz FJCHCDHFGOAADN-SFHVURJKSA-N 1 0 334.460 3.715 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCCC3(CCC3)C2)c1F ZINC001173191657 1131995708 /nfs/dbraw/zinc/99/57/08/1131995708.db2.gz FORQIYVTBWHAII-ZDUSSCGKSA-N 1 0 336.407 3.940 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(=O)c1ccc(Cl)cc1 ZINC001173215787 1132001678 /nfs/dbraw/zinc/00/16/78/1132001678.db2.gz ZSRRVXZMLBSQOP-LBPRGKRZSA-N 1 0 332.787 3.652 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1nc(-c2ccccc2)cc1C[NH3+] ZINC001173215662 1132002243 /nfs/dbraw/zinc/00/22/43/1132002243.db2.gz YCXLKZHJOJMJOE-CQSZACIVSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2cc(F)ccc21 ZINC001173220329 1132004500 /nfs/dbraw/zinc/00/45/00/1132004500.db2.gz YKVCCFYUSBNFOJ-SJKOYZFVSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCc1ccc2ccccc2n1 ZINC001173220912 1132004656 /nfs/dbraw/zinc/00/46/56/1132004656.db2.gz IAVUDXQZBNWCBW-OAHLLOKOSA-N 1 0 335.407 3.906 20 5 EHBDRO COc1ccccc1C1([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173221165 1132004771 /nfs/dbraw/zinc/00/47/71/1132004771.db2.gz LBPDGEXOBHCHSQ-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc(C2([NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173222602 1132005112 /nfs/dbraw/zinc/00/51/12/1132005112.db2.gz XIVSNZXBRUZSER-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001173225012 1132005159 /nfs/dbraw/zinc/00/51/59/1132005159.db2.gz ARUOZBIDDPDJDI-NVXWUHKLSA-N 1 0 325.412 3.800 20 5 EHBDRO CCOC[C@@]12CCC[C@@H]1C[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173223758 1132005875 /nfs/dbraw/zinc/00/58/75/1132005875.db2.gz HIRYMDSRIUGPAP-WDYCEAGBSA-N 1 0 332.444 3.664 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccc(F)cn1)C1CC1 ZINC001173226653 1132006940 /nfs/dbraw/zinc/00/69/40/1132006940.db2.gz YHCSFAMQBSRJMW-XIKOKIGWSA-N 1 0 329.375 3.801 20 5 EHBDRO Cc1cncc([C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229277 1132008048 /nfs/dbraw/zinc/00/80/48/1132008048.db2.gz SEOMDEIXXWYZDX-LIRRHRJNSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC001173228604 1132008337 /nfs/dbraw/zinc/00/83/37/1132008337.db2.gz YFOYLIKIAVNTNB-AWEZNQCLSA-N 1 0 348.443 3.580 20 5 EHBDRO COc1cccnc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228796 1132008563 /nfs/dbraw/zinc/00/85/63/1132008563.db2.gz KLGGMNMMAQCISX-ACJLOTCBSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccccc1)c1cccnn1 ZINC001173231520 1132009460 /nfs/dbraw/zinc/00/94/60/1132009460.db2.gz ZZXJPVKNUUNOIY-FOIQADDNSA-N 1 0 348.406 3.695 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)c1cccnn1 ZINC001173231525 1132009593 /nfs/dbraw/zinc/00/95/93/1132009593.db2.gz ZZXJPVKNUUNOIY-QRWLVFNGSA-N 1 0 348.406 3.695 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H](O)c1cc2ccccc2o1 ZINC001173231077 1132009611 /nfs/dbraw/zinc/00/96/11/1132009611.db2.gz XDCOSKKNRDPTLE-GUYCJALGSA-N 1 0 340.379 3.595 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168978660 1132618509 /nfs/dbraw/zinc/61/85/09/1132618509.db2.gz UBCHZXFDNJQYBD-VXGBXAGGSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cc(Br)ccc2Cl)C1 ZINC001168969499 1132622373 /nfs/dbraw/zinc/62/23/73/1132622373.db2.gz FBSREAYEFKFTKJ-SKDRFNHKSA-N 1 0 347.640 3.638 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1C(F)(F)F ZINC001168990404 1132634944 /nfs/dbraw/zinc/63/49/44/1132634944.db2.gz CIQAIXNNSIHELO-VXGBXAGGSA-N 1 0 330.350 3.976 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1 ZINC001175323543 1132638942 /nfs/dbraw/zinc/63/89/42/1132638942.db2.gz OGHCTCPSKUQORJ-FQEVSTJZSA-N 1 0 336.391 3.745 20 5 EHBDRO Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169024902 1132640894 /nfs/dbraw/zinc/64/08/94/1132640894.db2.gz SHPVFCHEDHPRNL-FUHWJXTLSA-N 1 0 328.456 3.720 20 5 EHBDRO C[C@H](c1cccc(Br)c1)[N@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057842 1132646650 /nfs/dbraw/zinc/64/66/50/1132646650.db2.gz XZYGCMJLHFNDNO-LALPHHSUSA-N 1 0 341.249 3.887 20 5 EHBDRO [NH3+]Cc1cccc2c1cnn2-c1ncnc2cc3ccccc3cc21 ZINC001169188774 1132687035 /nfs/dbraw/zinc/68/70/35/1132687035.db2.gz GMZPLSNSMRFYLI-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO C[NH+](C)CCOc1cc(N[C@@H]2CCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC001169218506 1132698724 /nfs/dbraw/zinc/69/87/24/1132698724.db2.gz KZKKALOLSYJSSL-CYBMUJFWSA-N 1 0 343.374 3.525 20 5 EHBDRO C[N@H+](Cc1cccnc1[N+](=O)[O-])C1(Cc2ccccc2)CCCC1 ZINC001175945365 1132790953 /nfs/dbraw/zinc/79/09/53/1132790953.db2.gz DLSAVPOPFXUPJR-UHFFFAOYSA-N 1 0 325.412 3.977 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)o1 ZINC001169667692 1132814399 /nfs/dbraw/zinc/81/43/99/1132814399.db2.gz VBZKIDXMWBNOFB-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO [NH3+]CCc1cn(-c2ncnc3cc4ccccc4cc32)c2cccnc12 ZINC001169706299 1132829631 /nfs/dbraw/zinc/82/96/31/1132829631.db2.gz PJLOUWUKPIFBEP-UHFFFAOYSA-N 1 0 339.402 3.623 20 5 EHBDRO Cc1cc(NC(C)(C)CC[NH+](C)C)c([N+](=O)[O-])cc1Br ZINC001169718539 1132834574 /nfs/dbraw/zinc/83/45/74/1132834574.db2.gz VMDBHCZHDQOVTH-UHFFFAOYSA-N 1 0 344.253 3.808 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC001169723329 1132835901 /nfs/dbraw/zinc/83/59/01/1132835901.db2.gz BZGPQKDBIBMYKM-HNNXBMFYSA-N 1 0 347.459 3.990 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1NCc1ccc(-c3ccccn3)cc1)C[NH2+]C2 ZINC001169895036 1132888653 /nfs/dbraw/zinc/88/86/53/1132888653.db2.gz YIIMVWRIAZQESC-UHFFFAOYSA-N 1 0 346.390 3.872 20 5 EHBDRO Cc1ccc(C[NH2+][C@]2(CO)CC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC001176933654 1133011316 /nfs/dbraw/zinc/01/13/16/1133011316.db2.gz YQAYKXXMRAPHNX-XOBRGWDASA-N 1 0 340.423 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H](O)c3ccccc3)o2)cc1 ZINC001177117478 1133029821 /nfs/dbraw/zinc/02/98/21/1133029821.db2.gz WOCLFXHOLCUWMF-SFHVURJKSA-N 1 0 338.363 3.678 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H](C)C(C)(C)OC)o2)c([N+](=O)[O-])c1 ZINC001179647411 1133266865 /nfs/dbraw/zinc/26/68/65/1133266865.db2.gz ZHNBLDSWPXEYEL-GFCCVEGCSA-N 1 0 348.399 3.767 20 5 EHBDRO CCOc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC001179685326 1133270566 /nfs/dbraw/zinc/27/05/66/1133270566.db2.gz KCHOAXIPXZNWHK-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CC[C@@H](C2CC2)C1 ZINC000769514967 1133307896 /nfs/dbraw/zinc/30/78/96/1133307896.db2.gz MUZHXKUGVMVRJV-LLVKDONJSA-N 1 0 325.206 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccc3c1OCCO3)CCC2 ZINC000774241333 1133640301 /nfs/dbraw/zinc/64/03/01/1133640301.db2.gz CMSIJXRPLJSPEG-KRWDZBQOSA-N 1 0 340.379 3.533 20 5 EHBDRO Cc1cccc(C)c1C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774258242 1133647431 /nfs/dbraw/zinc/64/74/31/1133647431.db2.gz QMVKODFQOIAQFZ-SJORKVTESA-N 1 0 328.416 3.682 20 5 EHBDRO Cc1c(CN2C[C@@H]([NH+](C)C)CCc3ccccc32)cccc1[N+](=O)[O-] ZINC001182833749 1133738188 /nfs/dbraw/zinc/73/81/88/1133738188.db2.gz FPBYTJXJMDMELR-SFHVURJKSA-N 1 0 339.439 3.786 20 5 EHBDRO CC(C)([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000786160542 1133808724 /nfs/dbraw/zinc/80/87/24/1133808724.db2.gz LBAXQJURWDUTAB-UHFFFAOYSA-N 1 0 345.399 3.545 20 5 EHBDRO COC[C@H](C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC001183972755 1133883819 /nfs/dbraw/zinc/88/38/19/1133883819.db2.gz XZDJFWANUYONMA-NSHDSACASA-N 1 0 335.231 3.910 20 5 EHBDRO CC[C@@H](C[N@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000774708670 1133891680 /nfs/dbraw/zinc/89/16/80/1133891680.db2.gz YSUHSFPNLLRTKL-INIZCTEOSA-N 1 0 330.432 3.881 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCc2nc(C)ncc21 ZINC000786810894 1133909679 /nfs/dbraw/zinc/90/96/79/1133909679.db2.gz BPVIFJGZFDXWCO-YVJSUPCUSA-N 1 0 338.411 3.764 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1cccc(C)c1 ZINC000786815942 1133910521 /nfs/dbraw/zinc/91/05/21/1133910521.db2.gz OTQMEARQUJESOZ-RNYZQXAPSA-N 1 0 326.396 3.630 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1cccs1 ZINC000786813204 1133910531 /nfs/dbraw/zinc/91/05/31/1133910531.db2.gz LCEYAWZLYBTPRU-HOFZKYPUSA-N 1 0 332.425 3.557 20 5 EHBDRO C[C@H](C[C@@H]1CCOC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786925041 1133929866 /nfs/dbraw/zinc/92/98/66/1133929866.db2.gz FVPSCFRHKJRKKO-MNOVXSKESA-N 1 0 332.322 3.518 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000746671974 1133990860 /nfs/dbraw/zinc/99/08/60/1133990860.db2.gz CYRYNVPJZPODHK-SWLSCSKDSA-N 1 0 325.840 3.553 20 5 EHBDRO Cc1ccc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c([N+](=O)[O-])c1 ZINC001185252205 1134057524 /nfs/dbraw/zinc/05/75/24/1134057524.db2.gz CZWHYMIGCNYOFT-KRWDZBQOSA-N 1 0 331.460 3.996 20 5 EHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774905544 1134114209 /nfs/dbraw/zinc/11/42/09/1134114209.db2.gz QMMPREZVCNWCGA-CQSZACIVSA-N 1 0 343.383 3.874 20 5 EHBDRO Cc1cccc([C@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000788592944 1134148825 /nfs/dbraw/zinc/14/88/25/1134148825.db2.gz PLLFGWCJNRSEQY-RTBURBONSA-N 1 0 340.423 3.949 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788666077 1134158871 /nfs/dbraw/zinc/15/88/71/1134158871.db2.gz PXTYANODQMOIGH-PIGZYNQJSA-N 1 0 349.818 3.869 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1COCc2cccc(Cl)c21 ZINC000788795986 1134170415 /nfs/dbraw/zinc/17/04/15/1134170415.db2.gz CRXUHWJXIAOVQB-HNNXBMFYSA-N 1 0 332.787 3.652 20 5 EHBDRO CCC[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000788806971 1134172516 /nfs/dbraw/zinc/17/25/16/1134172516.db2.gz QVLQYCDUYRRGJU-XVGQJIODSA-N 1 0 343.427 3.730 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000789361218 1134263011 /nfs/dbraw/zinc/26/30/11/1134263011.db2.gz GBILQVVQVILIGF-OALUTQOASA-N 1 0 328.412 3.932 20 5 EHBDRO Cc1cc(N2CC[C@@H]([N@H+](C)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001186963690 1134278011 /nfs/dbraw/zinc/27/80/11/1134278011.db2.gz DQYVNQJKYWONNP-LJQANCHMSA-N 1 0 339.439 3.656 20 5 EHBDRO CC[N@H+](CC(N)=O)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000789597370 1134303978 /nfs/dbraw/zinc/30/39/78/1134303978.db2.gz ULHDKNIOLTUTFI-UHFFFAOYSA-N 1 0 326.827 3.954 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](Nc3ncc(Cl)cc3[N+](=O)[O-])C2)cc1 ZINC001187390246 1134334170 /nfs/dbraw/zinc/33/41/70/1134334170.db2.gz FMGLOCPSZNTMRQ-OAHLLOKOSA-N 1 0 346.818 3.638 20 5 EHBDRO CC(C)C[C@H]1C[N@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001187708184 1134372378 /nfs/dbraw/zinc/37/23/78/1134372378.db2.gz DIRXBOYUESFMGK-ZDUSSCGKSA-N 1 0 345.365 3.780 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790694756 1134453766 /nfs/dbraw/zinc/45/37/66/1134453766.db2.gz JUNUVSDFXLHJMM-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604452 1134581857 /nfs/dbraw/zinc/58/18/57/1134581857.db2.gz JPRXSFICEPHISE-YLJYHZDGSA-N 1 0 340.423 3.735 20 5 EHBDRO CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccccc1OC ZINC001190582185 1134722211 /nfs/dbraw/zinc/72/22/11/1134722211.db2.gz ROVKIAYDYONYFZ-CQSZACIVSA-N 1 0 346.431 3.582 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597234 1134725276 /nfs/dbraw/zinc/72/52/76/1134725276.db2.gz KXABDFKOJAHTDH-INIZCTEOSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)c([N+](=O)[O-])c1 ZINC001170296248 1134737096 /nfs/dbraw/zinc/73/70/96/1134737096.db2.gz FWDPGYIUNVKZJN-CHWSQXEVSA-N 1 0 330.384 3.591 20 5 EHBDRO COc1ccc(C[C@@H](C)n2cc(C[NH3+])c3ccccc32)c([N+](=O)[O-])c1 ZINC001170299035 1134738238 /nfs/dbraw/zinc/73/82/38/1134738238.db2.gz PSPZCKIZBXJHQZ-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(C)cn2)c([N+](=O)[O-])c1 ZINC001170306425 1134738734 /nfs/dbraw/zinc/73/87/34/1134738734.db2.gz UWYLLMMTZMRZFI-KGLIPLIRSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170304250 1134738792 /nfs/dbraw/zinc/73/87/92/1134738792.db2.gz ALHFHCZLPDLGJO-KBPBESRZSA-N 1 0 344.411 3.633 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170304462 1134739044 /nfs/dbraw/zinc/73/90/44/1134739044.db2.gz CAXIIDCAKMWZAG-WCQYABFASA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cccc(F)c2F)c([N+](=O)[O-])c1 ZINC001170304716 1134739861 /nfs/dbraw/zinc/73/98/61/1134739861.db2.gz GGAPILQMJGRDPQ-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170326928 1134748547 /nfs/dbraw/zinc/74/85/47/1134748547.db2.gz CNKVCOIRHNTKGI-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001170364309 1134756877 /nfs/dbraw/zinc/75/68/77/1134756877.db2.gz CEUFCHJGWNYZML-CQSZACIVSA-N 1 0 341.839 3.991 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001191069300 1134786262 /nfs/dbraw/zinc/78/62/62/1134786262.db2.gz GLVOZPMMMNVWSN-NWDGAFQWSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000792877650 1134809770 /nfs/dbraw/zinc/80/97/70/1134809770.db2.gz UTRKTQWYYFFOOL-OAHLLOKOSA-N 1 0 333.369 3.805 20 5 EHBDRO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC1CC[NH+](C2CCCCC2)CC1 ZINC000804531869 1135109353 /nfs/dbraw/zinc/10/93/53/1135109353.db2.gz IOCAUMDPYBQKKW-UHFFFAOYSA-N 1 0 348.403 3.712 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC001193954720 1135205713 /nfs/dbraw/zinc/20/57/13/1135205713.db2.gz LDUBLLPGWHSNBP-YQVWRLOYSA-N 1 0 332.444 3.809 20 5 EHBDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457537 1135270282 /nfs/dbraw/zinc/27/02/82/1135270282.db2.gz NVYPKEHUIDKLNS-LSDHHAIUSA-N 1 0 326.824 3.930 20 5 EHBDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457536 1135270428 /nfs/dbraw/zinc/27/04/28/1135270428.db2.gz NVYPKEHUIDKLNS-HUUCEWRRSA-N 1 0 326.824 3.930 20 5 EHBDRO CC1(C)C[N@H+](CCOc2ccccc2[N+](=O)[O-])Cc2ccccc2O1 ZINC001194818262 1135326239 /nfs/dbraw/zinc/32/62/39/1135326239.db2.gz VAUAUOFRWBFSSO-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CCCC[C@@H](C)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194874974 1135334267 /nfs/dbraw/zinc/33/42/67/1135334267.db2.gz WBSBRWUURADYBK-LLVKDONJSA-N 1 0 327.812 3.697 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)c1ccccc1 ZINC000808720502 1135720646 /nfs/dbraw/zinc/72/06/46/1135720646.db2.gz AASSFSBNYBCCNO-MJXNMMHHSA-N 1 0 326.396 3.684 20 5 EHBDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761687 1135729493 /nfs/dbraw/zinc/72/94/93/1135729493.db2.gz QNAMVDLEQMFLHH-MOPGFXCFSA-N 1 0 344.411 3.720 20 5 EHBDRO C[C@]1(Cc2cccs2)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301961 1135797171 /nfs/dbraw/zinc/79/71/71/1135797171.db2.gz ZCKWGIQDQIPLQM-ZWKOTPCHSA-N 1 0 346.452 3.787 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700888 1135869822 /nfs/dbraw/zinc/86/98/22/1135869822.db2.gz QKWABMGZFSNXGZ-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO Cc1ccc([C@@H](O)[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701710 1135874341 /nfs/dbraw/zinc/87/43/41/1135874341.db2.gz JCOUALUGGMOFFB-PXAZEXFGSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)cc1Cl ZINC000809758411 1135888027 /nfs/dbraw/zinc/88/80/27/1135888027.db2.gz MFVUIQLNSTXQAX-ZFWWWQNUSA-N 1 0 338.835 3.887 20 5 EHBDRO CCOC(=O)[C@H](C)[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809976453 1135908022 /nfs/dbraw/zinc/90/80/22/1135908022.db2.gz DTGYSXYXYBWTOF-BDAKNGLRSA-N 1 0 349.214 3.579 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Br)nc1 ZINC000810224055 1135940028 /nfs/dbraw/zinc/94/00/28/1135940028.db2.gz SPSLCPCNRLFWEW-JTQLQIEISA-N 1 0 336.189 3.603 20 5 EHBDRO C[C@H](C[C@@H]1CCOC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001201380831 1136014224 /nfs/dbraw/zinc/01/42/24/1136014224.db2.gz VZGGCVUVFCZDMO-KGLIPLIRSA-N 1 0 330.384 3.760 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)O[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810847379 1136014754 /nfs/dbraw/zinc/01/47/54/1136014754.db2.gz OHCIFOMJJGDRAO-CABCVRRESA-N 1 0 346.427 3.676 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@@H]1O ZINC000811483110 1136091426 /nfs/dbraw/zinc/09/14/26/1136091426.db2.gz BWNCBPXZKNGYLH-ZFWWWQNUSA-N 1 0 347.242 3.932 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811481759 1136091486 /nfs/dbraw/zinc/09/14/86/1136091486.db2.gz LYEBMGDYSZEUHS-UHFFFAOYSA-N 1 0 349.214 3.723 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000811474564 1136096251 /nfs/dbraw/zinc/09/62/51/1136096251.db2.gz LVQMHQZRVZDYEH-CHWSQXEVSA-N 1 0 344.242 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)cc1Cl ZINC000811512711 1136103736 /nfs/dbraw/zinc/10/37/36/1136103736.db2.gz QFSYZAZHWISVPM-MAUKXSAKSA-N 1 0 346.814 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CC1SCCS1 ZINC000850562324 1136286536 /nfs/dbraw/zinc/28/65/36/1136286536.db2.gz ZUMBMAVGWRKNOM-OCCSQVGLSA-N 1 0 338.498 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@H](c4ccccc4)C3)c2c1 ZINC000814226335 1136425697 /nfs/dbraw/zinc/42/56/97/1136425697.db2.gz VIQITTZAYISYIL-QGZVFWFLSA-N 1 0 336.395 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC000776582428 1136442218 /nfs/dbraw/zinc/44/22/18/1136442218.db2.gz QAGBUAICFGHAOT-YLJYHZDGSA-N 1 0 340.423 3.583 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000776586830 1136448817 /nfs/dbraw/zinc/44/88/17/1136448817.db2.gz ISDGNUZBTPJYCA-WOJBJXKFSA-N 1 0 338.407 3.780 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591403 1136453776 /nfs/dbraw/zinc/45/37/76/1136453776.db2.gz MECOHKIAHSLRCG-ZWKOTPCHSA-N 1 0 326.396 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H](C[NH+]3CCCC3)C2)c(C(F)(F)F)c1 ZINC000814852818 1136515587 /nfs/dbraw/zinc/51/55/87/1136515587.db2.gz QFKMPJZFHXFTFH-LBPRGKRZSA-N 1 0 343.349 3.536 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@@H+](C[C@H](O)c1cccc3ccccc31)C2 ZINC000815075798 1136547952 /nfs/dbraw/zinc/54/79/52/1136547952.db2.gz MSVGHBZUFKEYRE-NRFANRHFSA-N 1 0 348.402 3.840 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000815081445 1136548588 /nfs/dbraw/zinc/54/85/88/1136548588.db2.gz DTGZEUOQXQJNES-BLLLJJGKSA-N 1 0 326.352 3.725 20 5 EHBDRO COc1ccc(C[C@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815598755 1136616884 /nfs/dbraw/zinc/61/68/84/1136616884.db2.gz BMYHVWQQVAVYMH-KBPBESRZSA-N 1 0 343.427 3.715 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857080575 1136842716 /nfs/dbraw/zinc/84/27/16/1136842716.db2.gz IHIZPOOUYKEXPR-VHSXEESVSA-N 1 0 333.215 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CCCc2ccc(Cl)cc2)c1 ZINC000818990899 1136897922 /nfs/dbraw/zinc/89/79/22/1136897922.db2.gz RPYKNPOPWAIHJG-KRWDZBQOSA-N 1 0 334.803 3.504 20 5 EHBDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819079435 1136911947 /nfs/dbraw/zinc/91/19/47/1136911947.db2.gz ADLLOTSGZCVUBX-FUHWJXTLSA-N 1 0 348.830 3.893 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000819141573 1136913004 /nfs/dbraw/zinc/91/30/04/1136913004.db2.gz JDXVOKSQINKCSN-UXIGCNINSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(Cc3ccccc3)CCC2)c1 ZINC000819151650 1136914755 /nfs/dbraw/zinc/91/47/55/1136914755.db2.gz CZXVQLGWIIBSTM-IBGZPJMESA-N 1 0 340.423 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CCCCCc2ccc(F)cc2)c1 ZINC000819243675 1136923788 /nfs/dbraw/zinc/92/37/88/1136923788.db2.gz BKLRSAMQOPGZLA-IBGZPJMESA-N 1 0 346.402 3.770 20 5 EHBDRO CC(F)(F)c1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819331084 1136931719 /nfs/dbraw/zinc/93/17/19/1136931719.db2.gz JVVDNZONGANDJN-INIZCTEOSA-N 1 0 336.338 3.530 20 5 EHBDRO COC(=O)CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000173398693 1136999542 /nfs/dbraw/zinc/99/95/42/1136999542.db2.gz ASSXMSVBOZLZPS-KDOFPFPSSA-N 1 0 342.395 3.940 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CC4CCC3CC4)CC2)cc1 ZINC000777159363 1137090483 /nfs/dbraw/zinc/09/04/83/1137090483.db2.gz XOBZKRKIAHMUIU-JFIBYHEFSA-N 1 0 329.444 3.732 20 5 EHBDRO Cc1c(-c2noc([C@@H]3C[C@H]4CCCC[C@@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000823269647 1137092372 /nfs/dbraw/zinc/09/23/72/1137092372.db2.gz JSFHXQQXXAWJIX-XBFCOCLRSA-N 1 0 328.372 3.546 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000824799033 1137152711 /nfs/dbraw/zinc/15/27/11/1137152711.db2.gz JKIXDWQAUKMERW-LRDDRELGSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2(c3ccccc3Cl)CCC2)c1 ZINC000844351884 1137214403 /nfs/dbraw/zinc/21/44/03/1137214403.db2.gz SPYWBAUOKPDGPD-KRWDZBQOSA-N 1 0 346.814 3.951 20 5 EHBDRO OCCN1CCCC[C@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC001202513954 1137236759 /nfs/dbraw/zinc/23/67/59/1137236759.db2.gz SGMVAOWKJWJCRT-FQEVSTJZSA-N 1 0 348.490 3.929 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000120469516 1137272237 /nfs/dbraw/zinc/27/22/37/1137272237.db2.gz SMWYEFKOTCRDRF-SJKOYZFVSA-N 1 0 334.803 3.941 20 5 EHBDRO C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)F ZINC000865799913 1137312782 /nfs/dbraw/zinc/31/27/82/1137312782.db2.gz FNUPUSXLAXRHIO-AAEUAGOBSA-N 1 0 325.359 3.595 20 5 EHBDRO CCC1([NH+](C)C)CCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000866060552 1137327502 /nfs/dbraw/zinc/32/75/02/1137327502.db2.gz FXQCWGSOLCINAH-UHFFFAOYSA-N 1 0 343.374 3.507 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@@](C)(O)c1ccccc1 ZINC000846191806 1137341045 /nfs/dbraw/zinc/34/10/45/1137341045.db2.gz ZGZPNLMXKPDQDD-QMTMVMCOSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000866308199 1137344359 /nfs/dbraw/zinc/34/43/59/1137344359.db2.gz RZGVZDWSXMREDW-ZDUSSCGKSA-N 1 0 346.406 3.766 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](C)[C@](C)(O)c1ccccc1 ZINC000866383415 1137350720 /nfs/dbraw/zinc/35/07/20/1137350720.db2.gz LSPDJWYXQBNCKO-LPMFXHHGSA-N 1 0 346.402 3.551 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccnc(F)c1 ZINC000866472744 1137357554 /nfs/dbraw/zinc/35/75/54/1137357554.db2.gz DTWFQHLXRFPGKR-HOCLYGCPSA-N 1 0 329.375 3.630 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CCC1)[C@H]1CCOC1 ZINC000866509833 1137359927 /nfs/dbraw/zinc/35/99/27/1137359927.db2.gz DLAFGQQTKSLIMT-LJHODMEESA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CCC1)[C@@H]1CCOC1 ZINC000866509831 1137360042 /nfs/dbraw/zinc/36/00/42/1137360042.db2.gz DLAFGQQTKSLIMT-BJZITVGISA-N 1 0 332.444 3.711 20 5 EHBDRO COc1ncc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000866540423 1137363115 /nfs/dbraw/zinc/36/31/15/1137363115.db2.gz ONBCNKHDUXONGR-LLVKDONJSA-N 1 0 335.791 3.811 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000866539992 1137363201 /nfs/dbraw/zinc/36/32/01/1137363201.db2.gz IWZKVOTXWPFHJL-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2cn(C)c3ncccc23)cc1[N+](=O)[O-] ZINC000866571111 1137365845 /nfs/dbraw/zinc/36/58/45/1137365845.db2.gz NMGFXJNJMKZQSK-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO C[C@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308939 1137408663 /nfs/dbraw/zinc/40/86/63/1137408663.db2.gz VDKSTEAYKZWVOI-DZGCQCFKSA-N 1 0 334.416 3.537 20 5 EHBDRO C[C@@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CC[N@@H+](C2CCC2)C1 ZINC000795118812 1137490224 /nfs/dbraw/zinc/49/02/24/1137490224.db2.gz AHRZXTBNURWROE-CYBMUJFWSA-N 1 0 337.851 3.554 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872021414 1137565296 /nfs/dbraw/zinc/56/52/96/1137565296.db2.gz QJWGXRFVLFJIKY-NSHDSACASA-N 1 0 333.413 3.571 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000872024724 1137565573 /nfs/dbraw/zinc/56/55/73/1137565573.db2.gz DMSVBAHCYGUJDE-MJBXVCDLSA-N 1 0 335.473 3.594 20 5 EHBDRO C[C@@H]([NH2+]CCCCNc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032433 1137566494 /nfs/dbraw/zinc/56/64/94/1137566494.db2.gz TZSFDNOULYBPDG-CYBMUJFWSA-N 1 0 332.379 3.672 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000872039618 1137566975 /nfs/dbraw/zinc/56/69/75/1137566975.db2.gz UNLNMZFROVSPAH-GDJRKYJOSA-N 1 0 336.457 3.781 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(CO)cc1 ZINC000872082232 1137570339 /nfs/dbraw/zinc/57/03/39/1137570339.db2.gz SMDLRSWCSJCEIG-LBPRGKRZSA-N 1 0 332.425 3.660 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@](C)(O)c1ccccc1 ZINC000872082843 1137570388 /nfs/dbraw/zinc/57/03/88/1137570388.db2.gz BZMZTVNTPDFLRM-VEVIJQCQSA-N 1 0 332.375 3.681 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1SCCS1 ZINC000872087692 1137570552 /nfs/dbraw/zinc/57/05/52/1137570552.db2.gz GXFFXJBYJPQLIT-SECBINFHSA-N 1 0 330.500 3.773 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@H](O)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000872127155 1137572968 /nfs/dbraw/zinc/57/29/68/1137572968.db2.gz XIWGPWMQKZDHDE-AVGNSLFASA-N 1 0 332.425 3.745 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000872129536 1137573163 /nfs/dbraw/zinc/57/31/63/1137573163.db2.gz KNPALFQYKYCGHW-KBUPBQIOSA-N 1 0 334.416 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](OC4CCC4)CC3)nc2c1 ZINC000872281816 1137577913 /nfs/dbraw/zinc/57/79/13/1137577913.db2.gz WDVQLDAXZZJEJA-OAHLLOKOSA-N 1 0 345.399 3.660 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CNC1CC[NH+](C2CCCC2)CC1 ZINC000873069949 1137589429 /nfs/dbraw/zinc/58/94/29/1137589429.db2.gz SWHNPAOEKAMZOP-UHFFFAOYSA-N 1 0 331.460 3.708 20 5 EHBDRO CC(C)[C@H](C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876919803 1137665254 /nfs/dbraw/zinc/66/52/54/1137665254.db2.gz ZAWMNWARQCIHJL-HTWSVDAQSA-N 1 0 328.416 3.524 20 5 EHBDRO CC(C)Oc1ccc([C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876940450 1137665961 /nfs/dbraw/zinc/66/59/61/1137665961.db2.gz VHEVBFPEHHSLBU-JEYLPNPQSA-N 1 0 344.415 3.633 20 5 EHBDRO Cc1cc([C@@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C2CC2)ccc1F ZINC000877119092 1137670700 /nfs/dbraw/zinc/67/07/00/1137670700.db2.gz ACSINBDEEQRDHF-JMLCCBQJSA-N 1 0 344.390 3.683 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3C[C@H](c4ccccc4Cl)C3)C2)c1 ZINC000877554708 1137681168 /nfs/dbraw/zinc/68/11/68/1137681168.db2.gz LTLPSKOPSPHJLY-HXZBBRIXSA-N 1 0 346.818 3.684 20 5 EHBDRO COC1(C(F)(F)F)CC[NH+](Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000877592800 1137682397 /nfs/dbraw/zinc/68/23/97/1137682397.db2.gz KBJMXJVQCNMTSN-UHFFFAOYSA-N 1 0 346.349 3.755 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)[C@]12C[C@H]1CCCC2 ZINC000877686703 1137685827 /nfs/dbraw/zinc/68/58/27/1137685827.db2.gz UYJZXCNCQIZNEM-KHYOSLBOSA-N 1 0 344.459 3.517 20 5 EHBDRO CC1(C2CC2)CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878629663 1137723047 /nfs/dbraw/zinc/72/30/47/1137723047.db2.gz HSESJJMSDKVZEX-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[C@H](C)C1 ZINC000878691189 1137725268 /nfs/dbraw/zinc/72/52/68/1137725268.db2.gz LCACKYPKEMQJTG-MELADBBJSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC1CCC(C)([NH+](C)C)CC1 ZINC000879209643 1137741287 /nfs/dbraw/zinc/74/12/87/1137741287.db2.gz NEDBLAFLUZRPKW-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)[C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000883352160 1137857040 /nfs/dbraw/zinc/85/70/40/1137857040.db2.gz USLMFKYTBLYQMH-CWRNSKLLSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1c(C[NH2+]C2(c3cccc(F)c3)CCOCC2)cccc1[N+](=O)[O-] ZINC000131705918 1137859320 /nfs/dbraw/zinc/85/93/20/1137859320.db2.gz YWPLCUVGTDUZIM-UHFFFAOYSA-N 1 0 344.386 3.838 20 5 EHBDRO CCC(CC)[C@H](O)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113341551 1137912720 /nfs/dbraw/zinc/91/27/20/1137912720.db2.gz JXSMMWBHMBMELD-MRXNPFEDSA-N 1 0 349.456 3.605 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775129 1137952351 /nfs/dbraw/zinc/95/23/51/1137952351.db2.gz NBQBXQLKNNLRII-DOMZBBRYSA-N 1 0 344.415 3.949 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000884716912 1137970744 /nfs/dbraw/zinc/97/07/44/1137970744.db2.gz MPKIXXFZYCVQSR-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2c[nH]c3ccccc32)CC1 ZINC000885935328 1138026494 /nfs/dbraw/zinc/02/64/94/1138026494.db2.gz IGNSOMSTTHBMKQ-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO C[C@@H](c1ccccc1Cl)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962705 1138044634 /nfs/dbraw/zinc/04/46/34/1138044634.db2.gz DWOLRLGBZNDWPL-SJCJKPOMSA-N 1 0 334.803 3.975 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136983609 1138044959 /nfs/dbraw/zinc/04/49/59/1138044959.db2.gz FIMICOGEEJEPRP-OALUTQOASA-N 1 0 326.396 3.774 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000886127202 1138049749 /nfs/dbraw/zinc/04/97/49/1138049749.db2.gz DRDGNNCNFONLOE-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2ccnc3ccccc32)CC1 ZINC000886226709 1138061030 /nfs/dbraw/zinc/06/10/30/1138061030.db2.gz QGYWJMOYPPXYKW-UHFFFAOYSA-N 1 0 348.406 3.918 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)[C@H]3C)O2)cc1[N+](=O)[O-] ZINC000886771666 1138137366 /nfs/dbraw/zinc/13/73/66/1138137366.db2.gz LSRGLTPSSQJCQC-IHRRBPCASA-N 1 0 348.443 3.526 20 5 EHBDRO CCOCCN(CC)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000092537578 1138229339 /nfs/dbraw/zinc/22/93/39/1138229339.db2.gz YXIWMUFPWLPMJJ-UHFFFAOYSA-N 1 0 335.429 3.577 20 5 EHBDRO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000125516377 1138310840 /nfs/dbraw/zinc/31/08/40/1138310840.db2.gz IQKPIYYNIPLXTH-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000129688214 1138417497 /nfs/dbraw/zinc/41/74/97/1138417497.db2.gz GSFXZYGXQRJYEX-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2c(C3CC3)nc3sccn23)cc1 ZINC000153303434 1139130875 /nfs/dbraw/zinc/13/08/75/1139130875.db2.gz LEQSEXQRCJIKPM-UHFFFAOYSA-N 1 0 342.424 3.514 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314760 1139584662 /nfs/dbraw/zinc/58/46/62/1139584662.db2.gz WEIPAKFDUHJCKM-YHOSQGMISA-N 1 0 334.416 3.567 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H](C)c1ccccc1 ZINC000181374261 1139902318 /nfs/dbraw/zinc/90/23/18/1139902318.db2.gz MRHDUELFYRGOPN-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000182988299 1140005689 /nfs/dbraw/zinc/00/56/89/1140005689.db2.gz PUWPDZSVJJZMKS-GFCCVEGCSA-N 1 0 347.440 3.587 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(N(C)C(C)C)nc2)cc1[N+](=O)[O-] ZINC000191290606 1140451982 /nfs/dbraw/zinc/45/19/82/1140451982.db2.gz RUFRMFUCCUHWKL-OAHLLOKOSA-N 1 0 342.443 3.994 20 5 EHBDRO C[C@H](O)c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192724011 1140546288 /nfs/dbraw/zinc/54/62/88/1140546288.db2.gz HMAYABNBDWIFCQ-DJJJIMSYSA-N 1 0 326.396 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC[NH+](C3CCCC3)CC1)CCC2 ZINC000192932061 1140556378 /nfs/dbraw/zinc/55/63/78/1140556378.db2.gz RSJZRXZNEMUOLK-HXUWFJFHSA-N 1 0 343.471 3.969 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](CNC(=O)OC(C)(C)C)C1 ZINC000266552520 1140701691 /nfs/dbraw/zinc/70/16/91/1140701691.db2.gz UYUQMSWONFHLRB-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813204 1140725551 /nfs/dbraw/zinc/72/55/51/1140725551.db2.gz WTCNAEHHAMCVKG-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1cccc([N+](=O)[O-])c1 ZINC000266899163 1140735343 /nfs/dbraw/zinc/73/53/43/1140735343.db2.gz TUAYBGRJDUQEGE-OLZOCXBDSA-N 1 0 339.395 3.526 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCCSC3)cs2)c1 ZINC000267223631 1140769904 /nfs/dbraw/zinc/76/99/04/1140769904.db2.gz UBGGHFDJGSHNQN-GFCCVEGCSA-N 1 0 335.454 3.704 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000267361071 1140782188 /nfs/dbraw/zinc/78/21/88/1140782188.db2.gz IGARZAJOZRCDQQ-NVXWUHKLSA-N 1 0 348.443 3.706 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000267383656 1140785082 /nfs/dbraw/zinc/78/50/82/1140785082.db2.gz BCNQFDFVGGFRGA-OAHLLOKOSA-N 1 0 340.427 3.831 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000268867219 1141011791 /nfs/dbraw/zinc/01/17/91/1141011791.db2.gz WWAFSPCDWPYGAU-MRXNPFEDSA-N 1 0 342.395 3.779 20 5 EHBDRO COCc1cc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])ccc1OC ZINC000268906678 1141023115 /nfs/dbraw/zinc/02/31/15/1141023115.db2.gz FBDBBVZTCOSBEI-CQSZACIVSA-N 1 0 344.411 3.643 20 5 EHBDRO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCC[NH2+]C1 ZINC000269217096 1141079967 /nfs/dbraw/zinc/07/99/67/1141079967.db2.gz RADOEEXMFMZLDS-GOEBONIOSA-N 1 0 333.435 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC[C@@H]2[C@H]2CCCO2)c1 ZINC000339166174 1141515928 /nfs/dbraw/zinc/51/59/28/1141515928.db2.gz CVKREIBEBXZTMJ-HUUCEWRRSA-N 1 0 344.333 3.757 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000348961136 1141615383 /nfs/dbraw/zinc/61/53/83/1141615383.db2.gz DEKKKYYUNIHZFR-UHFFFAOYSA-N 1 0 345.418 3.818 20 5 EHBDRO C[NH+](C)CC1CCN(c2cc3ccc(Cl)nc3cc2[N+](=O)[O-])CC1 ZINC001165041993 721951245 /nfs/dbraw/zinc/95/12/45/721951245.db2.gz GORWAUIFVRKSTM-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)OCCc2ccccc21 ZINC000577546090 1014314834 /nfs/dbraw/zinc/31/48/34/1014314834.db2.gz UOUYRMZHOFJYFI-LJQANCHMSA-N 1 0 326.396 3.563 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH+]2CCC3(CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000578100692 1015090759 /nfs/dbraw/zinc/09/07/59/1015090759.db2.gz YSSLEPWLHYQIQE-HNNXBMFYSA-N 1 0 345.443 3.886 20 5 EHBDRO CCCN(Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@@H]1CCCCO1 ZINC000509341370 1015235578 /nfs/dbraw/zinc/23/55/78/1015235578.db2.gz FMZHXPUYAMQNEX-ZDUSSCGKSA-N 1 0 328.359 3.654 20 5 EHBDRO C[NH2+]Cc1cn(-c2cc(Cl)ncc2[N+](=O)[O-])c2ccc(C)cc12 ZINC001167122087 1016171285 /nfs/dbraw/zinc/17/12/85/1016171285.db2.gz ZSUBCKWIXQJQCH-UHFFFAOYSA-N 1 0 330.775 3.615 20 5 EHBDRO C[NH2+]Cc1cn(-c2nc(Cl)c(C)cc2[N+](=O)[O-])c2ccc(C)cc12 ZINC001167124059 1016191671 /nfs/dbraw/zinc/19/16/71/1016191671.db2.gz RSCXEVQEQRSKPI-UHFFFAOYSA-N 1 0 344.802 3.923 20 5 EHBDRO Cc1nc(NC[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311219128 1016386656 /nfs/dbraw/zinc/38/66/56/1016386656.db2.gz TXBUVVVIACAFPX-LJQANCHMSA-N 1 0 340.427 3.622 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152024 1016487988 /nfs/dbraw/zinc/48/79/88/1016487988.db2.gz IXEATXZKRJCMPF-KSSFIOAISA-N 1 0 341.411 3.971 20 5 EHBDRO CC(C)C[C@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430390138 1016612902 /nfs/dbraw/zinc/61/29/02/1016612902.db2.gz WZFPBILRKNTJIX-KRWDZBQOSA-N 1 0 343.383 3.699 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CS1 ZINC000414497053 1016942200 /nfs/dbraw/zinc/94/22/00/1016942200.db2.gz JOGMNYVXJDLFPB-JQWIXIFHSA-N 1 0 335.454 3.702 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CS[C@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414497268 1016942947 /nfs/dbraw/zinc/94/29/47/1016942947.db2.gz FPIXFXBTZIONCE-NEPJUHHUSA-N 1 0 348.424 3.847 20 5 EHBDRO C[C@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)(F)F ZINC000414534075 1016961343 /nfs/dbraw/zinc/96/13/43/1016961343.db2.gz WDKKRMGUAWATAR-QMMMGPOBSA-N 1 0 342.264 3.874 20 5 EHBDRO COc1ccc(C[NH2+]C2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000449102452 1032182454 /nfs/dbraw/zinc/18/24/54/1032182454.db2.gz KBLFFVUCSGLBBR-UHFFFAOYSA-N 1 0 348.443 3.963 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000449121747 1032215286 /nfs/dbraw/zinc/21/52/86/1032215286.db2.gz IVKNOMPNIZOEGW-WBMJQRKESA-N 1 0 330.359 3.778 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@@H](c2cccc(Cl)c2)C2CCCC2)c1 ZINC000538225484 1032225430 /nfs/dbraw/zinc/22/54/30/1032225430.db2.gz BZWBXCKVNPZWGJ-QGZVFWFLSA-N 1 0 348.834 3.966 20 5 EHBDRO CCc1ccc([C@H](COC)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449152785 1032256487 /nfs/dbraw/zinc/25/64/87/1032256487.db2.gz HFUYDTHQZZSBAY-BBRMVZONSA-N 1 0 332.400 3.659 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835038 1032330209 /nfs/dbraw/zinc/33/02/09/1032330209.db2.gz ZGSGKAUHUBYGMZ-DLBZAZTESA-N 1 0 333.476 3.922 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)CCCc2cccnc2)ccc1[N+](=O)[O-] ZINC000459630954 1032347104 /nfs/dbraw/zinc/34/71/04/1032347104.db2.gz BXACHXNRDUJODO-OAHLLOKOSA-N 1 0 343.427 3.890 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000449231330 1032349172 /nfs/dbraw/zinc/34/91/72/1032349172.db2.gz OLBZEQFZCQGESK-LLVKDONJSA-N 1 0 338.329 3.775 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000449269765 1032391491 /nfs/dbraw/zinc/39/14/91/1032391491.db2.gz OIODZXCGHNSEFK-LRDDRELGSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)C2 ZINC000459732183 1032436052 /nfs/dbraw/zinc/43/60/52/1032436052.db2.gz RHIYNSVHUMMTPR-RKCSUWQLSA-N 1 0 338.407 3.764 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]C1(C2CCC2)CCC1 ZINC000459770118 1032472482 /nfs/dbraw/zinc/47/24/82/1032472482.db2.gz MNXSQXIACAWFPG-UHFFFAOYSA-N 1 0 331.416 3.544 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C3CC(C)(F)C3)o2)c([N+](=O)[O-])c1 ZINC000449370830 1032485903 /nfs/dbraw/zinc/48/59/03/1032485903.db2.gz NIKKENODECQHQS-UHFFFAOYSA-N 1 0 334.347 3.844 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000449382944 1032508923 /nfs/dbraw/zinc/50/89/23/1032508923.db2.gz ZDXYJVSOKZAZSY-JTQLQIEISA-N 1 0 340.729 3.695 20 5 EHBDRO Cc1cc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449401458 1032524564 /nfs/dbraw/zinc/52/45/64/1032524564.db2.gz HCVQZJTUUPQPPN-AEFFLSMTSA-N 1 0 325.412 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCC3CCOCC3)C2)cc1 ZINC000449501929 1032678180 /nfs/dbraw/zinc/67/81/80/1032678180.db2.gz QKOZPRKALCSZSO-SFHVURJKSA-N 1 0 332.444 3.981 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@H]1C ZINC000449503707 1032687611 /nfs/dbraw/zinc/68/76/11/1032687611.db2.gz POYAAWOOLDDRTH-CXAGYDPISA-N 1 0 330.384 3.712 20 5 EHBDRO CC(C)c1ccc(CN2CCCC[C@@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057905 1017469355 /nfs/dbraw/zinc/46/93/55/1017469355.db2.gz VFAHMMGSIDBCSU-FUHWJXTLSA-N 1 0 331.460 3.682 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]([C@H]3CCOC3)C2)o1 ZINC000377237748 1017514189 /nfs/dbraw/zinc/51/41/89/1017514189.db2.gz JFZQRUOEUOTLIW-GJZGRUSLSA-N 1 0 342.395 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC([NH+]2CCCCC2)CC1 ZINC000593454848 1032707520 /nfs/dbraw/zinc/70/75/20/1032707520.db2.gz NIWZNICTSRRUOZ-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134946167 1017654417 /nfs/dbraw/zinc/65/44/17/1017654417.db2.gz FNOSIDDXGZQZIQ-CXAGYDPISA-N 1 0 349.862 3.697 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181552639 1017712606 /nfs/dbraw/zinc/71/26/06/1017712606.db2.gz PZJBGRIUOIVRTN-ZOCIIQOWSA-N 1 0 328.412 3.628 20 5 EHBDRO C[C@]1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO[C@@H]1C1CC1 ZINC000468046422 1018189061 /nfs/dbraw/zinc/18/90/61/1018189061.db2.gz CJZGNJDQRPLJFQ-MISYRCLQSA-N 1 0 344.455 3.711 20 5 EHBDRO CC(C)c1nnc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)s1 ZINC000893092611 1018447956 /nfs/dbraw/zinc/44/79/56/1018447956.db2.gz OWDGLMAOKYNUSB-UHFFFAOYSA-N 1 0 334.445 3.682 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099338 1018470289 /nfs/dbraw/zinc/47/02/89/1018470289.db2.gz LPSCNUHECWEEGT-OLZOCXBDSA-N 1 0 330.384 3.591 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)CCc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000327565939 1018477287 /nfs/dbraw/zinc/47/72/87/1018477287.db2.gz YIECZZYPPIJMGU-CYBMUJFWSA-N 1 0 342.395 3.743 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000341094354 1018524435 /nfs/dbraw/zinc/52/44/35/1018524435.db2.gz FNGORMOTMNCYLE-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000592416818 1032784264 /nfs/dbraw/zinc/78/42/64/1032784264.db2.gz AXBJGEUCLIVLBX-UHFFFAOYSA-N 1 0 331.372 3.590 20 5 EHBDRO CC(=O)c1ccc(NCCC[N@@H+](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000058666363 1032788403 /nfs/dbraw/zinc/78/84/03/1032788403.db2.gz XFZPCWSQSFWYRS-UHFFFAOYSA-N 1 0 333.432 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c(F)c1 ZINC000513087555 1018938100 /nfs/dbraw/zinc/93/81/00/1018938100.db2.gz FJCYQRQOXTWGFF-SFHVURJKSA-N 1 0 329.375 3.983 20 5 EHBDRO COc1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2C)ccc1Cl ZINC000549923232 1019119363 /nfs/dbraw/zinc/11/93/63/1019119363.db2.gz CYSCRGTZDDWFBY-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](C(C)C)[NH+]2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000513190150 1019391282 /nfs/dbraw/zinc/39/12/82/1019391282.db2.gz QLMHAIQSBBLXHD-IBGZPJMESA-N 1 0 347.459 3.966 20 5 EHBDRO CCc1ccc(C(=O)Nc2ccccc2CC[NH+](C)C)cc1[N+](=O)[O-] ZINC000275900898 1019531591 /nfs/dbraw/zinc/53/15/91/1019531591.db2.gz UDMAMFYJIPHHOX-UHFFFAOYSA-N 1 0 341.411 3.514 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]3CC[NH2+][C@@H]3C2)s1 ZINC000592432849 1032838310 /nfs/dbraw/zinc/83/83/10/1032838310.db2.gz YTLGLAWOHORDRX-CZUORRHYSA-N 1 0 343.452 3.507 20 5 EHBDRO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C1CCC(F)(F)CC1 ZINC000594046755 1032880082 /nfs/dbraw/zinc/88/00/82/1032880082.db2.gz YMXNZOVFSXOVKS-GFCCVEGCSA-N 1 0 328.359 3.777 20 5 EHBDRO C[C@H]1C[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000602476368 1032897848 /nfs/dbraw/zinc/89/78/48/1032897848.db2.gz OLGYSPIGJQYKQT-SMDDNHRTSA-N 1 0 345.365 3.528 20 5 EHBDRO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])s1 ZINC000337016024 1020541378 /nfs/dbraw/zinc/54/13/78/1020541378.db2.gz LRDMJSKOASGQSM-AWEZNQCLSA-N 1 0 334.445 3.620 20 5 EHBDRO COC(=O)C[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@H]1C ZINC000280660046 1020552554 /nfs/dbraw/zinc/55/25/54/1020552554.db2.gz BMAJPMZNGJLGHY-FQLMCAECSA-N 1 0 334.416 3.532 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413074849 1020649543 /nfs/dbraw/zinc/64/95/43/1020649543.db2.gz SHDSWMUWMBSDTO-UHFFFAOYSA-N 1 0 346.353 3.683 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)cc1[N+](=O)[O-] ZINC000449630742 1032930922 /nfs/dbraw/zinc/93/09/22/1032930922.db2.gz VPIAXJPMGUQDAP-GDBMZVCRSA-N 1 0 332.425 3.975 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCN(C)[C@H]1c1ccccc1 ZINC000581562246 1021092199 /nfs/dbraw/zinc/09/21/99/1021092199.db2.gz DYRWXNATBCUCIS-YSSFQJQWSA-N 1 0 339.439 3.999 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1CCCOC1 ZINC000507423256 1021255829 /nfs/dbraw/zinc/25/58/29/1021255829.db2.gz RFMIZDUFUACNFB-RRFJBIMHSA-N 1 0 338.473 3.870 20 5 EHBDRO CCC[C@@H](CCO)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602560215 1032972765 /nfs/dbraw/zinc/97/27/65/1032972765.db2.gz XBJAMTIBIDCLBO-NSHDSACASA-N 1 0 334.338 3.502 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1O ZINC000426374970 1021413001 /nfs/dbraw/zinc/41/30/01/1021413001.db2.gz ZKVKMLDJQKHKHF-CYBMUJFWSA-N 1 0 344.411 3.728 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CCCN(C)c2ccccc21 ZINC000449654022 1032980347 /nfs/dbraw/zinc/98/03/47/1032980347.db2.gz UTHLDUFSPLXUGM-SFHVURJKSA-N 1 0 325.412 3.964 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449653040 1032980381 /nfs/dbraw/zinc/98/03/81/1032980381.db2.gz RMKJOAIVIGBEEH-INIZCTEOSA-N 1 0 341.411 3.664 20 5 EHBDRO CCOC(C)(C)C[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000437085303 1021555685 /nfs/dbraw/zinc/55/56/85/1021555685.db2.gz ZQJOFZQNIZPSRH-ZDUSSCGKSA-N 1 0 326.462 3.870 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437108292 1021562890 /nfs/dbraw/zinc/56/28/90/1021562890.db2.gz NBLCBAVJGFWJHL-BEFAXECRSA-N 1 0 339.439 3.944 20 5 EHBDRO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)CCO2 ZINC000178146661 1021784735 /nfs/dbraw/zinc/78/47/35/1021784735.db2.gz LXGXOMWQCOFUNA-KRWDZBQOSA-N 1 0 328.368 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000142826888 1033026668 /nfs/dbraw/zinc/02/66/68/1033026668.db2.gz DZASKKSYUPASEA-AWEZNQCLSA-N 1 0 331.441 3.980 20 5 EHBDRO COc1ccc([C@H](CNc2ccccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000025777470 1022144835 /nfs/dbraw/zinc/14/48/35/1022144835.db2.gz OXFDXKIPERVXHZ-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](CO)Cc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000467419043 1022257789 /nfs/dbraw/zinc/25/77/89/1022257789.db2.gz MMVZFCDTYPYKQE-QUCCMNQESA-N 1 0 342.439 3.938 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548336452 1022375088 /nfs/dbraw/zinc/37/50/88/1022375088.db2.gz JTMBQUVGXPWYQY-CABCVRRESA-N 1 0 340.427 3.678 20 5 EHBDRO COc1ccc2c(c1)OC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000090964612 1022407182 /nfs/dbraw/zinc/40/71/82/1022407182.db2.gz BGPLKZHYDPNMBN-HIFRSBDPSA-N 1 0 342.395 3.566 20 5 EHBDRO COCC1(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000602676031 1033055065 /nfs/dbraw/zinc/05/50/65/1033055065.db2.gz PASWCXJQQAOWSP-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCOC(C)(C)C)o2)c([N+](=O)[O-])c1 ZINC000517535278 1022435204 /nfs/dbraw/zinc/43/52/04/1022435204.db2.gz GSHFXOLUGBUQJU-UHFFFAOYSA-N 1 0 348.399 3.768 20 5 EHBDRO C[C@@H](C[N+](C)(C)C)Oc1c(F)cc(Br)cc1Cl ZINC001225968157 1022443912 /nfs/dbraw/zinc/44/39/12/1022443912.db2.gz XYOJXSTYNYBHOA-QMMMGPOBSA-N 1 0 325.629 3.715 20 5 EHBDRO C[NH+](C)C1(CNC(=O)c2cc3ccccc3c3cccnc23)CCC1 ZINC000438523571 1022753586 /nfs/dbraw/zinc/75/35/86/1022753586.db2.gz MNAYFBGRAULBLF-UHFFFAOYSA-N 1 0 333.435 3.602 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000550211585 1022763961 /nfs/dbraw/zinc/76/39/61/1022763961.db2.gz HJBRODFURDXPMS-NVXWUHKLSA-N 1 0 348.443 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@@H](c4cccc(F)c4)C3)c2c1 ZINC000729469540 1022865269 /nfs/dbraw/zinc/86/52/69/1022865269.db2.gz MNQSLYDASIWGEY-OAHLLOKOSA-N 1 0 340.358 3.531 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2cccs2)C2CC2)c2c(c1)COCO2 ZINC000509568867 1023056897 /nfs/dbraw/zinc/05/68/97/1023056897.db2.gz BOIFCFZJOHMBLS-MRXNPFEDSA-N 1 0 346.408 3.764 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000602715924 1033102435 /nfs/dbraw/zinc/10/24/35/1033102435.db2.gz HWFJRWBOWXAPDS-MNOVXSKESA-N 1 0 332.322 3.613 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000509572846 1023070007 /nfs/dbraw/zinc/07/00/07/1023070007.db2.gz RTKPSLLWLUBUHV-DNVCBOLYSA-N 1 0 349.475 3.594 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003548 1023081241 /nfs/dbraw/zinc/08/12/41/1023081241.db2.gz WLQJUULOZPGUBZ-HIFRSBDPSA-N 1 0 329.375 3.981 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCO[C@@H]1CCCC[C@@H]1C ZINC000509585637 1023092374 /nfs/dbraw/zinc/09/23/74/1023092374.db2.gz KLDMDWKBFHKNNP-WMLDXEAASA-N 1 0 336.432 3.678 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)o1 ZINC000610664721 1023143753 /nfs/dbraw/zinc/14/37/53/1023143753.db2.gz CJBKLYMVHIFJKX-UHFFFAOYSA-N 1 0 345.399 3.899 20 5 EHBDRO Cc1ccc(CNC[C@@H](C(C)C)[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000518268015 1023178575 /nfs/dbraw/zinc/17/85/75/1023178575.db2.gz CIIZNVRQVZJMJB-IBGZPJMESA-N 1 0 333.476 3.749 20 5 EHBDRO C[NH+](C)CC1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC000891882821 1023230038 /nfs/dbraw/zinc/23/00/38/1023230038.db2.gz HBDBAFDUQAHYBN-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CCn1nc(C)c(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1C ZINC000602729222 1033117475 /nfs/dbraw/zinc/11/74/75/1033117475.db2.gz UXWMSHSDAPSQFJ-CSKARUKUSA-N 1 0 328.416 3.573 20 5 EHBDRO CC[C@@H](C)C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494854 1023352352 /nfs/dbraw/zinc/35/23/52/1023352352.db2.gz HIZJUVAOCIPLJF-GHMZBOCLSA-N 1 0 327.812 3.553 20 5 EHBDRO CC(C)C[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341908403 1023679943 /nfs/dbraw/zinc/67/99/43/1023679943.db2.gz PYPKUJGYCGANJR-AWEZNQCLSA-N 1 0 336.823 3.859 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1COc2c(cccc2OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000610809840 1023701156 /nfs/dbraw/zinc/70/11/56/1023701156.db2.gz VNQRRPSWMYUKQS-DOTOQJQBSA-N 1 0 342.395 3.648 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC(c2nc3ccccc3[nH]2)C1 ZINC000610847505 1023788365 /nfs/dbraw/zinc/78/83/65/1023788365.db2.gz YHWOXVIHASZCGW-UHFFFAOYSA-N 1 0 342.786 3.724 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000065202009 1023890771 /nfs/dbraw/zinc/89/07/71/1023890771.db2.gz GXGSJZBOIVCUJQ-HNNXBMFYSA-N 1 0 331.441 3.980 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H](C)C1 ZINC000248553205 1024341528 /nfs/dbraw/zinc/34/15/28/1024341528.db2.gz JLWZGJKDJNFVGR-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000327480442 1024407293 /nfs/dbraw/zinc/40/72/93/1024407293.db2.gz DORUJHFKFJCWDX-ZDUSSCGKSA-N 1 0 344.411 3.641 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H](CO)CC1CCCC1 ZINC000511010818 1024433604 /nfs/dbraw/zinc/43/36/04/1024433604.db2.gz KJIDANJTZLISEW-QXAKKESOSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310314755 1024475518 /nfs/dbraw/zinc/47/55/18/1024475518.db2.gz UVVJYXRHXVNUIT-OAHLLOKOSA-N 1 0 329.375 3.668 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000277291409 1024480044 /nfs/dbraw/zinc/48/00/44/1024480044.db2.gz ZPNWNVPCOCBGNO-NSHDSACASA-N 1 0 331.338 3.534 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2cc[nH]n2)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000435124544 1024635549 /nfs/dbraw/zinc/63/55/49/1024635549.db2.gz QLRMQOFHJLZPHC-UHFFFAOYSA-N 1 0 340.383 3.989 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000190539313 1024658756 /nfs/dbraw/zinc/65/87/56/1024658756.db2.gz LLEGSGLWGZLZNM-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOc1ncccc1Cl ZINC000539059977 1024728318 /nfs/dbraw/zinc/72/83/18/1024728318.db2.gz FNZAJBJVXHJERB-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000539074599 1024740418 /nfs/dbraw/zinc/74/04/18/1024740418.db2.gz UOOKZEPKTBIJFQ-SFHVURJKSA-N 1 0 339.439 3.772 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCc3ccc(C)cc32)c([N+](=O)[O-])cc1O ZINC000342292447 1024751648 /nfs/dbraw/zinc/75/16/48/1024751648.db2.gz OFKWFOOLIILQQV-INIZCTEOSA-N 1 0 342.395 3.785 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@@H]21 ZINC000248454664 1024767998 /nfs/dbraw/zinc/76/79/98/1024767998.db2.gz ZOMHRVPJMGIDPC-DAXOMENPSA-N 1 0 342.399 3.655 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H]([NH+]2CCCC2)C[C@H]1C ZINC000514890648 1024853490 /nfs/dbraw/zinc/85/34/90/1024853490.db2.gz LMFSDXZJNWWRAV-AEDISCFBSA-N 1 0 329.444 3.557 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@H]4CCCO4)C3)o2)c1 ZINC000895842257 1024887565 /nfs/dbraw/zinc/88/75/65/1024887565.db2.gz CXSNEHVLSPXVNY-CRAIPNDOSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)o1 ZINC000895843992 1024892149 /nfs/dbraw/zinc/89/21/49/1024892149.db2.gz KXBZGBSLIKLNMI-KBXCAEBGSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c2c(n1)CCCC2 ZINC000895831846 1024895788 /nfs/dbraw/zinc/89/57/88/1024895788.db2.gz BLTCGWCMJWSSEA-UHFFFAOYSA-N 1 0 325.412 3.775 20 5 EHBDRO Cc1ccc(CN(C)Cc2ccc(Br)cc2[N+](=O)[O-])o1 ZINC000425379070 1024933573 /nfs/dbraw/zinc/93/35/73/1024933573.db2.gz AOGOGGLPLSWRFB-UHFFFAOYSA-N 1 0 339.189 3.891 20 5 EHBDRO COc1cc(NCCCC[N@@H+]2CCCC[C@H]2C)c(F)cc1[N+](=O)[O-] ZINC000508264018 1024994445 /nfs/dbraw/zinc/99/44/45/1024994445.db2.gz JVWPBTYMNAZZNO-CYBMUJFWSA-N 1 0 339.411 3.809 20 5 EHBDRO COc1cc(NCCCC[N@@H+]2CCC[C@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000508272944 1025013203 /nfs/dbraw/zinc/01/32/03/1025013203.db2.gz WIKRUJYLQJSVEQ-ZDUSSCGKSA-N 1 0 339.411 3.667 20 5 EHBDRO CCSc1ccc(C[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000895993474 1025060406 /nfs/dbraw/zinc/06/04/06/1025060406.db2.gz BYBHXBDIXMQACI-UHFFFAOYSA-N 1 0 348.424 3.711 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)(C)C ZINC000897994137 1033266323 /nfs/dbraw/zinc/26/63/23/1033266323.db2.gz MUGYOJQCGQGKSO-KVULBXGLSA-N 1 0 343.431 3.575 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000119806435 1025246219 /nfs/dbraw/zinc/24/62/19/1025246219.db2.gz PSMXHSUJZIMJBU-AWEZNQCLSA-N 1 0 330.388 3.703 20 5 EHBDRO CC1(C)C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccco1 ZINC000602924161 1033271641 /nfs/dbraw/zinc/27/16/41/1033271641.db2.gz BGZYHAAZRWLHFN-QGZVFWFLSA-N 1 0 343.383 3.600 20 5 EHBDRO CCCC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000521317790 1025326800 /nfs/dbraw/zinc/32/68/00/1025326800.db2.gz XIVATWYZPIUYLW-HNNXBMFYSA-N 1 0 333.432 3.872 20 5 EHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606552 1025455507 /nfs/dbraw/zinc/45/55/07/1025455507.db2.gz CLJFPMMCJQSLOL-CJNGLKHVSA-N 1 0 329.400 3.913 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000119943748 1025475008 /nfs/dbraw/zinc/47/50/08/1025475008.db2.gz MRPBGOVDVNFPSE-AWEZNQCLSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3CC[C@H](O)[C@@H]3C2)s1 ZINC000544368699 1025507791 /nfs/dbraw/zinc/50/77/91/1025507791.db2.gz RUCXBYBMDPXONR-MJEQTWJJSA-N 1 0 344.436 3.526 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)Cc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000451106743 1025540523 /nfs/dbraw/zinc/54/05/23/1025540523.db2.gz YZXDWIVOEBGYIN-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451109710 1025545220 /nfs/dbraw/zinc/54/52/20/1025545220.db2.gz YMDYTUXHBZQDGG-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000436307288 1025572972 /nfs/dbraw/zinc/57/29/72/1025572972.db2.gz KIUPCLDMCZQHHO-WDEREUQCSA-N 1 0 346.353 3.541 20 5 EHBDRO C[NH+]1CCC(CCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000134268067 1025715135 /nfs/dbraw/zinc/71/51/35/1025715135.db2.gz GHGSNQUWSLOFNG-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)[NH+](C)C ZINC000439126863 1025792058 /nfs/dbraw/zinc/79/20/58/1025792058.db2.gz FXXNPQCHZPERPX-ABAIWWIYSA-N 1 0 334.807 3.747 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2C)C1 ZINC000521982338 1025852901 /nfs/dbraw/zinc/85/29/01/1025852901.db2.gz JSXQTTGSOWCTNT-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000451427332 1025968037 /nfs/dbraw/zinc/96/80/37/1025968037.db2.gz WYEZLQISHKJEBA-AWEZNQCLSA-N 1 0 332.404 3.949 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(N2CCCC2)n1 ZINC000611590950 1025989896 /nfs/dbraw/zinc/98/98/96/1025989896.db2.gz FLROOJWYZTWJNB-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000505870419 1026089942 /nfs/dbraw/zinc/08/99/42/1026089942.db2.gz WZMIACGYTYQRSO-OAHLLOKOSA-N 1 0 342.395 3.504 20 5 EHBDRO CC1CC[NH+](CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548074 1026097585 /nfs/dbraw/zinc/09/75/85/1026097585.db2.gz MIKHBQYVUQROIW-GOSISDBHSA-N 1 0 331.460 3.506 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)CCc2n[nH]c3ccccc32)cccc1[N+](=O)[O-] ZINC000478500792 1026128853 /nfs/dbraw/zinc/12/88/53/1026128853.db2.gz OEAHFKOTHVGTNN-ZDUSSCGKSA-N 1 0 338.411 3.890 20 5 EHBDRO Cc1cc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)cc([N+](=O)[O-])c1 ZINC000530632794 1026139271 /nfs/dbraw/zinc/13/92/71/1026139271.db2.gz RTRFIYNFFDVOQL-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000896950259 1026148284 /nfs/dbraw/zinc/14/82/84/1026148284.db2.gz AGEIBPUPMBFOIG-JOYOIKCWSA-N 1 0 334.363 3.987 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000530627687 1026153242 /nfs/dbraw/zinc/15/32/42/1026153242.db2.gz SPVLQULKQZSTTE-LJQANCHMSA-N 1 0 328.412 3.674 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000475158398 1026263398 /nfs/dbraw/zinc/26/33/98/1026263398.db2.gz MCLGCDHZXWWRAG-JKSUJKDBSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000339000373 1026334952 /nfs/dbraw/zinc/33/49/52/1026334952.db2.gz LRNAODBBBOLARG-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000137512790 1026369354 /nfs/dbraw/zinc/36/93/54/1026369354.db2.gz KNTSUMGVDXLVHI-CABCVRRESA-N 1 0 326.400 3.546 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274981 1026424661 /nfs/dbraw/zinc/42/46/61/1026424661.db2.gz KPRFQBBYSYBIIB-GOSISDBHSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)[C@H]1CCC[C@H](C)C1 ZINC000452066943 1026460942 /nfs/dbraw/zinc/46/09/42/1026460942.db2.gz LYTJTMFRMMBTGV-QEJZJMRPSA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)(CO)C(C)(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000531206275 1026686422 /nfs/dbraw/zinc/68/64/22/1026686422.db2.gz JGKZPLKSYLTPQF-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000161336948 1026732198 /nfs/dbraw/zinc/73/21/98/1026732198.db2.gz YNSAAFBVNGHTFA-OALUTQOASA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@@H]2[N@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542698 1026841363 /nfs/dbraw/zinc/84/13/63/1026841363.db2.gz IDABGWASBRMWFE-KRWDZBQOSA-N 1 0 347.459 3.568 20 5 EHBDRO C[N@H+](CCCOCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000384275060 1026846926 /nfs/dbraw/zinc/84/69/26/1026846926.db2.gz CZUITBHDAVWVAS-UHFFFAOYSA-N 1 0 332.375 3.773 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178644077 1027232715 /nfs/dbraw/zinc/23/27/15/1027232715.db2.gz ILYQQRIXEMUOAR-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178649086 1027269668 /nfs/dbraw/zinc/26/96/68/1027269668.db2.gz FMWNTUCLEXPFOK-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000531724499 1027271404 /nfs/dbraw/zinc/27/14/04/1027271404.db2.gz FIUAGSLUNASCLI-PNBKFKSVSA-N 1 0 345.443 3.870 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2(CO)CCCC2)c2ccccc2)c1 ZINC000186486051 1027376680 /nfs/dbraw/zinc/37/66/80/1027376680.db2.gz BFHLRWQJHVCDKS-LJQANCHMSA-N 1 0 340.423 3.827 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000548763535 1027539849 /nfs/dbraw/zinc/53/98/49/1027539849.db2.gz IKRCPWITTUMURY-UHFFFAOYSA-N 1 0 341.411 3.837 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1ccc([N+](=O)[O-])c(N)c1F ZINC000348744779 1027589413 /nfs/dbraw/zinc/58/94/13/1027589413.db2.gz SNBVCLGJNSIYLS-UHFFFAOYSA-N 1 0 346.406 3.770 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435390 1027873082 /nfs/dbraw/zinc/87/30/82/1027873082.db2.gz WJKGYXCQRINMJF-HUUCEWRRSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc2c(ccnc2N2C(C)(C)CC([NH3+])CC2(C)C)c1[N+](=O)[O-] ZINC001167625221 1027932604 /nfs/dbraw/zinc/93/26/04/1027932604.db2.gz HEXOGFSSUHDSFI-UHFFFAOYSA-N 1 0 342.443 3.936 20 5 EHBDRO Cc1cccc([C@@H]2CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000444686843 1028132979 /nfs/dbraw/zinc/13/29/79/1028132979.db2.gz UGPUFONVAGBZJM-OAHLLOKOSA-N 1 0 336.395 3.769 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])CC1(c2ccccc2)CC1 ZINC000444672112 1028143257 /nfs/dbraw/zinc/14/32/57/1028143257.db2.gz FHCYCZBPZZHFEF-UHFFFAOYSA-N 1 0 326.396 3.637 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CCCOC1 ZINC000503926253 1028217683 /nfs/dbraw/zinc/21/76/83/1028217683.db2.gz IZSNRIGTQFFNOT-HIFRSBDPSA-N 1 0 330.384 3.760 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000560907439 1028273297 /nfs/dbraw/zinc/27/32/97/1028273297.db2.gz NJMSYNYWCXHKKG-LIRRHRJNSA-N 1 0 328.412 3.850 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCC3(O)CCC3)o2)c1 ZINC000421365306 1028317436 /nfs/dbraw/zinc/31/74/36/1028317436.db2.gz BGPDDVHBVGZEHC-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000421377684 1028338548 /nfs/dbraw/zinc/33/85/48/1028338548.db2.gz HSVCSHJXXMBRQN-VDHUWJSZSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)OCCCO3)cccc1[N+](=O)[O-] ZINC000161887928 1028347330 /nfs/dbraw/zinc/34/73/30/1028347330.db2.gz VTVIJWPUEAUORB-AWEZNQCLSA-N 1 0 342.395 3.915 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000421394504 1028374617 /nfs/dbraw/zinc/37/46/17/1028374617.db2.gz XOQZVQDHXKYQLX-UONOGXRCSA-N 1 0 330.384 3.902 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000729681917 1028415276 /nfs/dbraw/zinc/41/52/76/1028415276.db2.gz ANGQPZAFIFYYBI-UHFFFAOYSA-N 1 0 343.383 3.959 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c1 ZINC000749694686 1028509946 /nfs/dbraw/zinc/50/99/46/1028509946.db2.gz XYQPBLYJLNIXMM-SJORKVTESA-N 1 0 332.787 3.559 20 5 EHBDRO CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C[NH2+]C3)cc1[N+](=O)[O-] ZINC000423692338 1028566982 /nfs/dbraw/zinc/56/69/82/1028566982.db2.gz FZIZUQNNGJSBGY-UHFFFAOYSA-N 1 0 325.368 3.574 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000347376209 1028805052 /nfs/dbraw/zinc/80/50/52/1028805052.db2.gz ZXLMWYKYWMGKIP-SCOADAFUSA-N 1 0 326.400 3.601 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+][C@@H]3CC[C@H]3O)cc2[N+](=O)[O-])cc1 ZINC000424195445 1028879088 /nfs/dbraw/zinc/87/90/88/1028879088.db2.gz DHJCCKSVRQGBMI-NVXWUHKLSA-N 1 0 344.436 3.667 20 5 EHBDRO C[C@@H]1CC[C@H]([N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592998 1028883345 /nfs/dbraw/zinc/88/33/45/1028883345.db2.gz RHUGFYJFCTXPGQ-HIFRSBDPSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(C)n1 ZINC000421891103 1028896786 /nfs/dbraw/zinc/89/67/86/1028896786.db2.gz VUXIMMYMCVSYFK-SFHVURJKSA-N 1 0 325.412 3.718 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@@H](C)N(C2CC2)C1 ZINC000504893858 1029038761 /nfs/dbraw/zinc/03/87/61/1029038761.db2.gz IQTMABBXSOMICH-KFWWJZLASA-N 1 0 349.500 3.680 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCC12CCC[NH+]1CCC2 ZINC000343082275 1029042253 /nfs/dbraw/zinc/04/22/53/1029042253.db2.gz LAOFOLLMIAMYGG-UHFFFAOYSA-N 1 0 329.322 3.654 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000504899565 1029042542 /nfs/dbraw/zinc/04/25/42/1029042542.db2.gz IUIDJWKEFYQLIH-CJNGLKHVSA-N 1 0 342.395 3.648 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(O)(CC)CC ZINC000504911170 1029054051 /nfs/dbraw/zinc/05/40/51/1029054051.db2.gz BLNLYYUFAXJHBA-CYBMUJFWSA-N 1 0 326.462 3.606 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532918386 1029068915 /nfs/dbraw/zinc/06/89/15/1029068915.db2.gz TVWJNQJALFDRQG-FDQGKXFDSA-N 1 0 345.443 3.742 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446080044 1029394045 /nfs/dbraw/zinc/39/40/45/1029394045.db2.gz QXDZAGBTSXXJCU-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cccc(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000533241785 1029503206 /nfs/dbraw/zinc/50/32/06/1029503206.db2.gz QLJNJNFEPFIOFE-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513829987 1029527640 /nfs/dbraw/zinc/52/76/40/1029527640.db2.gz NPNCCIPNULMQMY-GDBMZVCRSA-N 1 0 348.443 3.627 20 5 EHBDRO Cc1cc(-n2ccnc2)ccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152421 1029604766 /nfs/dbraw/zinc/60/47/66/1029604766.db2.gz BZULNZIOAIOQDB-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000162864597 1029617770 /nfs/dbraw/zinc/61/77/70/1029617770.db2.gz RHNOKFIFZRGXLC-HNNXBMFYSA-N 1 0 328.416 3.841 20 5 EHBDRO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271929 1029765961 /nfs/dbraw/zinc/76/59/61/1029765961.db2.gz VNGKAPBOZWYRSO-IBGZPJMESA-N 1 0 325.412 3.998 20 5 EHBDRO Cc1cc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc2cccnc12 ZINC000446839949 1029821950 /nfs/dbraw/zinc/82/19/50/1029821950.db2.gz WFCQYJBSCXFRAF-UHFFFAOYSA-N 1 0 347.378 3.618 20 5 EHBDRO COC[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000537626885 1029931824 /nfs/dbraw/zinc/93/18/24/1029931824.db2.gz HKLCSOQNMWRGGP-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO Cc1c(-c2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246612 1029973224 /nfs/dbraw/zinc/97/32/24/1029973224.db2.gz CRVLYZWHKXJQBY-WZRBSPASSA-N 1 0 330.388 3.887 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000453258967 1029991700 /nfs/dbraw/zinc/99/17/00/1029991700.db2.gz OLQCGVJUYYOPBC-JSGCOSHPSA-N 1 0 334.338 3.993 20 5 EHBDRO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CCCC1 ZINC000159428749 1030188620 /nfs/dbraw/zinc/18/86/20/1030188620.db2.gz FNXRQKQSMFLWPQ-UHFFFAOYSA-N 1 0 327.222 3.979 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453375874 1030198712 /nfs/dbraw/zinc/19/87/12/1030198712.db2.gz XNCMQKFMPIDPRC-FDQGKXFDSA-N 1 0 327.384 3.561 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cnc(C)cc2C)cc1[N+](=O)[O-] ZINC000453379455 1030204158 /nfs/dbraw/zinc/20/41/58/1030204158.db2.gz WIKGFJBEQSDYIC-AWEZNQCLSA-N 1 0 329.400 3.856 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOc1ccc(F)cc1F ZINC000531994084 1030245931 /nfs/dbraw/zinc/24/59/31/1030245931.db2.gz LCMMRQRKBBBXAV-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447507435 1030254466 /nfs/dbraw/zinc/25/44/66/1030254466.db2.gz HUDCPBKXAHSIMJ-PMACEKPBSA-N 1 0 339.439 3.865 20 5 EHBDRO CO[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447559615 1030302431 /nfs/dbraw/zinc/30/24/31/1030302431.db2.gz AEQFEGGEJQQCTL-RTBURBONSA-N 1 0 326.396 3.950 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@H]3C13CCCC3)CCC2 ZINC000447604892 1030361810 /nfs/dbraw/zinc/36/18/10/1030361810.db2.gz DSFURRBDRLNHPM-JCHJZTRSSA-N 1 0 342.439 3.910 20 5 EHBDRO C[C@H](CC(C)(C)C)[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000453606235 1030395174 /nfs/dbraw/zinc/39/51/74/1030395174.db2.gz VKZGLSOVBNMINU-CYBMUJFWSA-N 1 0 330.432 3.910 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)n1 ZINC000532217625 1030485234 /nfs/dbraw/zinc/48/52/34/1030485234.db2.gz BKWBTXMKZLTMFI-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1cc(N2CCO[C@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000447814753 1030513617 /nfs/dbraw/zinc/51/36/17/1030513617.db2.gz BEHBMQMNLCJLCR-KRWDZBQOSA-N 1 0 329.400 3.703 20 5 EHBDRO O=[N+]([O-])c1cc(CNC[C@H](c2ccccc2)[NH+]2CCCC2)cs1 ZINC000237974262 1030547274 /nfs/dbraw/zinc/54/72/74/1030547274.db2.gz NLGUNPCOAXWGBS-MRXNPFEDSA-N 1 0 331.441 3.583 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482683456 1030639098 /nfs/dbraw/zinc/63/90/98/1030639098.db2.gz YHPIYHGQCKDBTM-OAHLLOKOSA-N 1 0 338.411 3.924 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC[NH+](C2CCCC2)CC1 ZINC000160481160 1030787431 /nfs/dbraw/zinc/78/74/31/1030787431.db2.gz UHZQRHRWSUUHOS-HNNXBMFYSA-N 1 0 331.460 3.961 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccc3c(c2)OCCO3)C2CC2)cs1 ZINC000237997471 1030808138 /nfs/dbraw/zinc/80/81/38/1030808138.db2.gz VBLDAHPXLGLPMR-QGZVFWFLSA-N 1 0 346.408 3.668 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCC[C@H]1O ZINC000537687567 1030981779 /nfs/dbraw/zinc/98/17/79/1030981779.db2.gz HYTDQOLQYIBJPM-WMLDXEAASA-N 1 0 346.452 3.916 20 5 EHBDRO CCCC[N@H+](C)C[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000583904214 1031089656 /nfs/dbraw/zinc/08/96/56/1031089656.db2.gz IXWGASWADFCLBV-LBPRGKRZSA-N 1 0 349.456 3.660 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)C[NH+]1CCCCC1 ZINC000536183527 1031351518 /nfs/dbraw/zinc/35/15/18/1031351518.db2.gz ICGJFFDXLOACJH-LBPRGKRZSA-N 1 0 343.374 3.730 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000347370071 1031428550 /nfs/dbraw/zinc/42/85/50/1031428550.db2.gz URKWECPQTRDBBX-NTEUORMPSA-N 1 0 326.400 3.601 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000568531594 1031669302 /nfs/dbraw/zinc/66/93/02/1031669302.db2.gz HTKQQXQUPOZWCK-IEBWSBKVSA-N 1 0 343.402 3.614 20 5 EHBDRO O=[N+]([O-])c1ccccc1Cc1noc([C@@H]2CC[C@@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000904080167 1031711760 /nfs/dbraw/zinc/71/17/60/1031711760.db2.gz YPIAASJUTOYSIB-CFVMTHIKSA-N 1 0 342.399 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCCCC34CC[NH2+]CC4)n2)s1 ZINC000904110569 1031734638 /nfs/dbraw/zinc/73/46/38/1031734638.db2.gz XCKQUCFPYHYVEE-NSHDSACASA-N 1 0 348.428 3.734 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCO[C@@H](C)C1 ZINC000537766093 1031898745 /nfs/dbraw/zinc/89/87/45/1031898745.db2.gz CFUMNMSTUPCZEF-SOUVJXGZSA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3OCC[C@@H]3C2)s1 ZINC000584232786 1031987488 /nfs/dbraw/zinc/98/74/88/1031987488.db2.gz XWHFAMDRMNVZHO-DYVFJYSZSA-N 1 0 344.436 3.934 20 5 EHBDRO COc1ccccc1OC[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537941102 1032026932 /nfs/dbraw/zinc/02/69/32/1032026932.db2.gz IETJNCYFKUTPCW-CABCVRRESA-N 1 0 344.411 3.969 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000574690115 1033356454 /nfs/dbraw/zinc/35/64/54/1033356454.db2.gz CHEWKVRFJRELAO-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCc3cc(C)cc(C)c32)cc1[N+](=O)[O-] ZINC000594493196 1033393978 /nfs/dbraw/zinc/39/39/78/1033393978.db2.gz GMUCFCXRIWWDLR-MRXNPFEDSA-N 1 0 326.396 3.997 20 5 EHBDRO CC(C)(C)OC(=O)CCCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502224 1033404675 /nfs/dbraw/zinc/40/46/75/1033404675.db2.gz KLRDJBKCFBUCJB-HNNXBMFYSA-N 1 0 334.416 3.684 20 5 EHBDRO CC(C)(C)OC(=O)CCCC[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502225 1033404843 /nfs/dbraw/zinc/40/48/43/1033404843.db2.gz KLRDJBKCFBUCJB-OAHLLOKOSA-N 1 0 334.416 3.684 20 5 EHBDRO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CC[NH+](C)CC1 ZINC000603317355 1033544886 /nfs/dbraw/zinc/54/48/86/1033544886.db2.gz HTFHLOYWFOISNT-OAHLLOKOSA-N 1 0 347.462 3.848 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cc(F)ccc2OC(F)F)c1 ZINC000594933942 1033583140 /nfs/dbraw/zinc/58/31/40/1033583140.db2.gz AXXMAVPKOVHJPB-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccc1)[C@H](O)C(C)C ZINC000594991080 1033620953 /nfs/dbraw/zinc/62/09/53/1033620953.db2.gz ZHFWSYVYYRAZTL-RBUKOAKNSA-N 1 0 328.412 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CCCc2ccco2)c1 ZINC000594997483 1033623662 /nfs/dbraw/zinc/62/36/62/1033623662.db2.gz NFWJLICQNKMVCJ-UHFFFAOYSA-N 1 0 326.299 3.512 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000595009650 1033632023 /nfs/dbraw/zinc/63/20/23/1033632023.db2.gz ZDZLOLRTBIZGMZ-AUUYWEPGSA-N 1 0 328.412 3.930 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CO[C@H](C4CC4)C3)o2)c1 ZINC000599006390 1033639251 /nfs/dbraw/zinc/63/92/51/1033639251.db2.gz HTWYBDMZTYYTAF-KSSFIOAISA-N 1 0 328.368 3.512 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595071398 1033646857 /nfs/dbraw/zinc/64/68/57/1033646857.db2.gz YNMBCONHSCLJDT-KBXCAEBGSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C)c1ncc(C)s1 ZINC000595034325 1033655347 /nfs/dbraw/zinc/65/53/47/1033655347.db2.gz VGFYUMZYGMYGBS-JQWIXIFHSA-N 1 0 335.429 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C1CC1)[C@@H]1CCCCO1 ZINC000595044487 1033662557 /nfs/dbraw/zinc/66/25/57/1033662557.db2.gz ALYJPADQFRQXRL-IWEFOYFVSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1Cc2ccccc2[C@@H]1OC ZINC000595050781 1033667221 /nfs/dbraw/zinc/66/72/21/1033667221.db2.gz KRWHSTKCQVBWDH-WILYLXEWSA-N 1 0 342.395 3.566 20 5 EHBDRO COC1CC(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000595051524 1033667580 /nfs/dbraw/zinc/66/75/80/1033667580.db2.gz VTHXCDHEGYXAJY-LSCKAKRGSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1noc2ccccc12 ZINC000595051871 1033667979 /nfs/dbraw/zinc/66/79/79/1033667979.db2.gz WHCAFIKPRZLUIB-GFCCVEGCSA-N 1 0 341.367 3.638 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089277 1033698086 /nfs/dbraw/zinc/69/80/86/1033698086.db2.gz NBWMPSDUGGHEPQ-OXQOHEQNSA-N 1 0 340.423 3.682 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1cccc([N+](=O)[O-])c1 ZINC000599059655 1033698653 /nfs/dbraw/zinc/69/86/53/1033698653.db2.gz IUZAWLKVBIAGLS-OALUTQOASA-N 1 0 326.396 3.777 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+][C@@H]2CC[C@@H]2c2ccccc2)n1 ZINC000595088391 1033698907 /nfs/dbraw/zinc/69/89/07/1033698907.db2.gz BNEBPLJGABLBTD-TVFCKZIOSA-N 1 0 340.427 3.811 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCCOC1 ZINC000599055300 1033706826 /nfs/dbraw/zinc/70/68/26/1033706826.db2.gz DEJKBVYRMOMKDQ-CABCVRRESA-N 1 0 338.473 3.872 20 5 EHBDRO Cc1noc(C[N@H+](CCc2ccccc2)C2CCCC2)c1[N+](=O)[O-] ZINC000595297653 1033721471 /nfs/dbraw/zinc/72/14/71/1033721471.db2.gz YACSEIVBKLJPDR-UHFFFAOYSA-N 1 0 329.400 3.879 20 5 EHBDRO CC(C)C[NH+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC(C)C ZINC000046781167 1033755607 /nfs/dbraw/zinc/75/56/07/1033755607.db2.gz LXHLCLXRBIFEEM-UHFFFAOYSA-N 1 0 332.404 3.759 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2ccccc2)C(C)C)c1 ZINC000592997355 1033781510 /nfs/dbraw/zinc/78/15/10/1033781510.db2.gz YENPYNYXLKFRAY-SFHVURJKSA-N 1 0 342.395 3.868 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN(Cc1cnc2ccccc2n1)C1CC1 ZINC000595386444 1033783756 /nfs/dbraw/zinc/78/37/56/1033783756.db2.gz GYJQEXTULLLBFQ-UHFFFAOYSA-N 1 0 334.379 3.703 20 5 EHBDRO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)C[NH+]1CCCC1 ZINC000108298884 1033795260 /nfs/dbraw/zinc/79/52/60/1033795260.db2.gz AKZCXIWSABNKEX-MRXNPFEDSA-N 1 0 347.462 3.850 20 5 EHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@@H]2Oc2cccc(C)c2)c1[N+](=O)[O-] ZINC000595447680 1033814413 /nfs/dbraw/zinc/81/44/13/1033814413.db2.gz IFYVLKMQTXKTNY-HOTGVXAUSA-N 1 0 345.399 3.679 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665499 1033835810 /nfs/dbraw/zinc/83/58/10/1033835810.db2.gz KRUQTVFYVBMCOE-QUCCMNQESA-N 1 0 339.439 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]([C@H]4CCCCO4)C3)nc2c1 ZINC000595788872 1034000057 /nfs/dbraw/zinc/00/00/57/1034000057.db2.gz KLCBQPZGWDYROW-CZUORRHYSA-N 1 0 345.399 3.517 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679784 1034106600 /nfs/dbraw/zinc/10/66/00/1034106600.db2.gz OVYJVFDHZXZOJV-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000596161773 1034114440 /nfs/dbraw/zinc/11/44/40/1034114440.db2.gz KGXYYXJDIGYTGH-GFCCVEGCSA-N 1 0 327.375 3.922 20 5 EHBDRO CC[C@@H](CCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000152655153 1034124595 /nfs/dbraw/zinc/12/45/95/1034124595.db2.gz KXZJVNGBJSGSTL-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000596309295 1034165089 /nfs/dbraw/zinc/16/50/89/1034165089.db2.gz XTHSRAQWEGCKGH-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@H]([NH2+]CCCN(C)C(=O)OC(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000310075852 1034214284 /nfs/dbraw/zinc/21/42/84/1034214284.db2.gz OAUMTRFTWAEECM-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO CC(=O)c1ccc(N[C@H]2CC[N@@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596478483 1034255614 /nfs/dbraw/zinc/25/56/14/1034255614.db2.gz NXAQIWDHYXDOJG-HNNXBMFYSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NCC3CC[NH+](CC4CC4)CC3)c2c1 ZINC000596564464 1034291416 /nfs/dbraw/zinc/29/14/16/1034291416.db2.gz YZSJEJVSQYWJER-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](CC3CC3)CC2)c2ccncc21 ZINC000596564412 1034292045 /nfs/dbraw/zinc/29/20/45/1034292045.db2.gz XTCTYLZGDTZAFK-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000596650140 1034346131 /nfs/dbraw/zinc/34/61/31/1034346131.db2.gz GVVJCRAYEUMTLO-OALUTQOASA-N 1 0 337.423 3.775 20 5 EHBDRO COC[C@H](C)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000604451703 1034390308 /nfs/dbraw/zinc/39/03/08/1034390308.db2.gz LFTORMIHTLORCX-CYBMUJFWSA-N 1 0 348.374 3.898 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCn2nccc21 ZINC000601319997 1034450397 /nfs/dbraw/zinc/45/03/97/1034450397.db2.gz CJLQRRUAMZCJRW-BHYGNILZSA-N 1 0 340.427 3.627 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@]2(CO)CCc3ccccc32)cc1[N+](=O)[O-] ZINC000135885118 1034452556 /nfs/dbraw/zinc/45/25/56/1034452556.db2.gz HQWHWLMTTUFRNQ-FQEVSTJZSA-N 1 0 340.423 3.642 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000310512221 1034534211 /nfs/dbraw/zinc/53/42/11/1034534211.db2.gz PPYOKZJZQYQYAV-LSDHHAIUSA-N 1 0 349.431 3.520 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000450683047 1034682963 /nfs/dbraw/zinc/68/29/63/1034682963.db2.gz PEUVPRFNMWUCGM-MDASCCDHSA-N 1 0 328.412 3.800 20 5 EHBDRO CCC1([NH+](C)C)CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000601792561 1034751339 /nfs/dbraw/zinc/75/13/39/1034751339.db2.gz XVFPBNWIRDNYKT-UHFFFAOYSA-N 1 0 347.459 3.665 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1N1CCC(c2ncc3n2CCCC3)CC1 ZINC000278791505 1034787614 /nfs/dbraw/zinc/78/76/14/1034787614.db2.gz GYJJLNBDDUGWRB-UHFFFAOYSA-N 1 0 340.427 3.820 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cs1 ZINC000411474681 1034891757 /nfs/dbraw/zinc/89/17/57/1034891757.db2.gz LVDLVAQIZDKJQX-NSHDSACASA-N 1 0 334.397 3.602 20 5 EHBDRO Cc1cc(N(C)C2CC[NH+](CCC(F)(F)F)CC2)ccc1[N+](=O)[O-] ZINC000450947396 1034969063 /nfs/dbraw/zinc/96/90/63/1034969063.db2.gz BNLZMBJHHZPXKJ-UHFFFAOYSA-N 1 0 345.365 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593292 1035084098 /nfs/dbraw/zinc/08/40/98/1035084098.db2.gz ZMXSRVXWQQCWNQ-YJBOKZPZSA-N 1 0 348.349 3.883 20 5 EHBDRO COCC1(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000580191586 1035421534 /nfs/dbraw/zinc/42/15/34/1035421534.db2.gz OBGPXTUSMJHNGA-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](c2ccc(C)cc2)C2CC2)c1[N+](=O)[O-] ZINC000892527647 1035423986 /nfs/dbraw/zinc/42/39/86/1035423986.db2.gz VFCGHIHBHDPIIL-QGZVFWFLSA-N 1 0 342.395 3.858 20 5 EHBDRO CC(C)(C)Oc1cccc(CN[C@@H]2CCc3c2cccc3[N+](=O)[O-])n1 ZINC000580345472 1035430052 /nfs/dbraw/zinc/43/00/52/1035430052.db2.gz JTVXTPRHQNDDNI-MRXNPFEDSA-N 1 0 341.411 3.944 20 5 EHBDRO COc1cc(C)c(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000492224636 1035498505 /nfs/dbraw/zinc/49/85/05/1035498505.db2.gz JXTFZMAVNGUKAT-UHFFFAOYSA-N 1 0 344.411 3.945 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223243 1035511300 /nfs/dbraw/zinc/51/13/00/1035511300.db2.gz KJPKBMVZVVPMOW-RTBURBONSA-N 1 0 328.412 3.825 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])CC2 ZINC000492224208 1035512146 /nfs/dbraw/zinc/51/21/46/1035512146.db2.gz IWMRQGRIWLOKJO-INIZCTEOSA-N 1 0 340.423 3.986 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCCCC12CCCC2 ZINC000463451084 1035519214 /nfs/dbraw/zinc/51/92/14/1035519214.db2.gz FGTADNTVMXDIQM-INIZCTEOSA-N 1 0 345.443 3.934 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nnc(C(C)C)s1 ZINC000492243856 1035521399 /nfs/dbraw/zinc/52/13/99/1035521399.db2.gz XGDZTKUTAXAERD-UKTHLTGXSA-N 1 0 346.456 3.805 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973790 1035576594 /nfs/dbraw/zinc/57/65/94/1035576594.db2.gz ICKBADDEYGPDSH-KZULUSFZSA-N 1 0 348.374 3.608 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(CNc3ccc([N+](=O)[O-])s3)cc2)CC1 ZINC000588050473 1035680190 /nfs/dbraw/zinc/68/01/90/1035680190.db2.gz XSEDJMKFFRMPDF-UHFFFAOYSA-N 1 0 347.440 3.741 20 5 EHBDRO CC(C)[C@H](CO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000571916882 1035785675 /nfs/dbraw/zinc/78/56/75/1035785675.db2.gz LHQHDFLIEOSKDW-AWEZNQCLSA-N 1 0 334.441 3.677 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460345169 1035925218 /nfs/dbraw/zinc/92/52/18/1035925218.db2.gz FJPIQWFDCRVACV-SOUVJXGZSA-N 1 0 333.432 3.726 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](OCC)c1ccccc1 ZINC000446836209 1035925236 /nfs/dbraw/zinc/92/52/36/1035925236.db2.gz SRWQPJGKOANARJ-LJQANCHMSA-N 1 0 344.411 3.861 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@@H](c1ccccc1C)[NH+](C)C ZINC000340918891 1035930796 /nfs/dbraw/zinc/93/07/96/1035930796.db2.gz OXJKDMBPJNLDIN-BBRMVZONSA-N 1 0 345.447 3.531 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350125 1035945366 /nfs/dbraw/zinc/94/53/66/1035945366.db2.gz UWKZVLKNBSREBN-CVEARBPZSA-N 1 0 344.415 3.949 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@H]2c2ccccc2F)n1 ZINC000414186656 1035965141 /nfs/dbraw/zinc/96/51/41/1035965141.db2.gz PZNFZNUCMYOYDV-LLLHUVSDSA-N 1 0 344.390 3.560 20 5 EHBDRO CC[NH+](CC)CCSc1cc(C)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000535234384 1036215754 /nfs/dbraw/zinc/21/57/54/1036215754.db2.gz RSYDRVDXCPEXNM-UHFFFAOYSA-N 1 0 346.456 3.794 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C(C)C)[C@H](O)C(F)(F)F ZINC000589162654 1036288355 /nfs/dbraw/zinc/28/83/55/1036288355.db2.gz SIHFOKLGWQVUPA-BPNCWPANSA-N 1 0 334.338 3.502 20 5 EHBDRO Cc1nn(-c2ccccc2)cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000180228343 1036307667 /nfs/dbraw/zinc/30/76/67/1036307667.db2.gz YPQKIXISUGBLIH-AWEZNQCLSA-N 1 0 336.395 3.940 20 5 EHBDRO CC(C)c1ccc([C@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381396 1036423367 /nfs/dbraw/zinc/42/33/67/1036423367.db2.gz IHTRECUFMZVADI-GOSISDBHSA-N 1 0 328.416 3.752 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H](C)C[C@@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541568373 1036458033 /nfs/dbraw/zinc/45/80/33/1036458033.db2.gz OUOXKAPMNARPOI-SNUQEOBHSA-N 1 0 332.400 3.589 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000180446225 1036838980 /nfs/dbraw/zinc/83/89/80/1036838980.db2.gz GAZTWLLZVJYIKC-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@]12COC[C@H]1C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210535 1036861037 /nfs/dbraw/zinc/86/10/37/1036861037.db2.gz ITTOXXHLTGWVBJ-ACJLOTCBSA-N 1 0 344.436 3.792 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2ccccc2OC(F)(F)F)cs1 ZINC000237718208 1036876922 /nfs/dbraw/zinc/87/69/22/1036876922.db2.gz DSGIAEUMNOZBHF-UHFFFAOYSA-N 1 0 346.330 3.887 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601500 1036965827 /nfs/dbraw/zinc/96/58/27/1036965827.db2.gz CMFLOQUQYJZZCG-CJNGLKHVSA-N 1 0 328.416 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCCO)Cc2ccccc2)cc1Cl ZINC000761511499 1037084644 /nfs/dbraw/zinc/08/46/44/1037084644.db2.gz KZDCDTHPJGQJOC-UHFFFAOYSA-N 1 0 334.803 3.633 20 5 EHBDRO CCOc1ccccc1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761520979 1037097799 /nfs/dbraw/zinc/09/77/99/1037097799.db2.gz SHLQNHOVEVBNSZ-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO CC(C)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C(=O)Nc1ccccc1 ZINC000761519768 1037099155 /nfs/dbraw/zinc/09/91/55/1037099155.db2.gz ICBCOBXJAHEKPU-UHFFFAOYSA-N 1 0 347.802 3.755 20 5 EHBDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1(C)C ZINC000591056167 1037201938 /nfs/dbraw/zinc/20/19/38/1037201938.db2.gz FJJKKZQSZCMDLZ-LSDHHAIUSA-N 1 0 347.415 3.808 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCNc2ccccn2)c2ccccc2)c1 ZINC000493276725 1037213167 /nfs/dbraw/zinc/21/31/67/1037213167.db2.gz MEIYXIWBWFPTJM-HXUWFJFHSA-N 1 0 348.406 3.781 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[C@@H](O)C3)s2)cc1 ZINC000188808855 1037330902 /nfs/dbraw/zinc/33/09/02/1037330902.db2.gz JJUXJCVKBBVTCS-IUODEOHRSA-N 1 0 332.425 3.574 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)[C@@H](C)c1ccccc1 ZINC000595099544 1037351037 /nfs/dbraw/zinc/35/10/37/1037351037.db2.gz NPYHBOICVYYVDS-DOXZYTNZSA-N 1 0 328.412 3.718 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])CCC1 ZINC000271813976 1037360203 /nfs/dbraw/zinc/36/02/03/1037360203.db2.gz BFTJINSZGKWZBU-CVEARBPZSA-N 1 0 334.460 3.694 20 5 EHBDRO CCOc1cccc(NC[C@@H](c2cccc(F)c2)[NH+](C)C)c1[N+](=O)[O-] ZINC000542467866 1037399561 /nfs/dbraw/zinc/39/95/61/1037399561.db2.gz BTCINVQZLZJRJZ-INIZCTEOSA-N 1 0 347.390 3.847 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000271839866 1037431625 /nfs/dbraw/zinc/43/16/25/1037431625.db2.gz ZBMAQOVLQRHPLV-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)C1CCCC1 ZINC000573610108 1037628065 /nfs/dbraw/zinc/62/80/65/1037628065.db2.gz JQBJEPZEQXVYTG-LSDHHAIUSA-N 1 0 338.473 3.606 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(Cc2ccccc2[N+](=O)[O-])CC1 ZINC000030153957 1037633909 /nfs/dbraw/zinc/63/39/09/1037633909.db2.gz AQFIIXUEPOCPRL-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587417 1037708555 /nfs/dbraw/zinc/70/85/55/1037708555.db2.gz ZHWWHSHKFOILSK-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1c(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)cccc1[N+](=O)[O-] ZINC000493935274 1037732894 /nfs/dbraw/zinc/73/28/94/1037732894.db2.gz HYTXBQKSTYYNGJ-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)N(C)C(C)(C)C[NH+]1CCCCCC1 ZINC000493977711 1037740379 /nfs/dbraw/zinc/74/03/79/1037740379.db2.gz PCFMXFDGZLCEFZ-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496856 1037764350 /nfs/dbraw/zinc/76/43/50/1037764350.db2.gz OYDIBCMOXGJYFE-KSSFIOAISA-N 1 0 343.427 3.627 20 5 EHBDRO C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290496852 1037780493 /nfs/dbraw/zinc/78/04/93/1037780493.db2.gz OYDIBCMOXGJYFE-KBXCAEBGSA-N 1 0 343.427 3.627 20 5 EHBDRO C[C@@H](C[NH2+]Cc1csc(C(F)(F)F)n1)c1ccccc1[N+](=O)[O-] ZINC000897458968 1037798886 /nfs/dbraw/zinc/79/88/86/1037798886.db2.gz GUDHBMWAMAEMLW-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO C[C@H]1CCc2nc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152535250 1037852374 /nfs/dbraw/zinc/85/23/74/1037852374.db2.gz QXMXAFHCSJGUTP-LBPRGKRZSA-N 1 0 331.441 3.508 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000897463303 1037863681 /nfs/dbraw/zinc/86/36/81/1037863681.db2.gz DTIYHHKPDVFZNA-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000897466059 1037875615 /nfs/dbraw/zinc/87/56/15/1037875615.db2.gz NHYHXKZEESDOQK-CUBALJKWSA-N 1 0 338.498 3.668 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000463200471 1037886575 /nfs/dbraw/zinc/88/65/75/1037886575.db2.gz UEYNQBMGLSOFOT-KZNAEPCWSA-N 1 0 348.443 3.509 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592527486 1038026262 /nfs/dbraw/zinc/02/62/62/1038026262.db2.gz HIBCBLGAESCBOM-KOEDOTQGSA-N 1 0 330.428 3.551 20 5 EHBDRO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000540521138 1038048122 /nfs/dbraw/zinc/04/81/22/1038048122.db2.gz JGZUUZGUGVVZAI-KRWDZBQOSA-N 1 0 345.399 3.545 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C(C)(C)C)C1 ZINC000541391394 1038541686 /nfs/dbraw/zinc/54/16/86/1038541686.db2.gz VVQGTKYOYNPXSA-CQSZACIVSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1-c1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000378404938 1038592951 /nfs/dbraw/zinc/59/29/51/1038592951.db2.gz QLGYLBOYRWVUCD-CQSZACIVSA-N 1 0 336.395 3.846 20 5 EHBDRO Cc1cc(NC[C@H](C2CC2)[NH+](C)C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788120 1038610593 /nfs/dbraw/zinc/61/05/93/1038610593.db2.gz WHFSDPDYHYJLOG-CQSZACIVSA-N 1 0 331.338 3.674 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000539040663 1038649197 /nfs/dbraw/zinc/64/91/97/1038649197.db2.gz XEZWHGKOZIKPCR-CYBMUJFWSA-N 1 0 330.432 3.612 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000477856853 1038963665 /nfs/dbraw/zinc/96/36/65/1038963665.db2.gz IRVIZMNANBHEEN-BEFAXECRSA-N 1 0 334.460 3.837 20 5 EHBDRO CCC(=O)c1ccc(N[C@H]2CC[N@@H+](C3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000479970957 1038967358 /nfs/dbraw/zinc/96/73/58/1038967358.db2.gz QMSXLSUAIUKGOO-AWEZNQCLSA-N 1 0 331.416 3.616 20 5 EHBDRO COC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000488766993 1039389245 /nfs/dbraw/zinc/38/92/45/1039389245.db2.gz OSFXFVNUOPSJIN-KRWDZBQOSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCOC3)o2)c(Cl)c1 ZINC000237816786 1039433868 /nfs/dbraw/zinc/43/38/68/1039433868.db2.gz WKGHKOCGGMVQNA-LLVKDONJSA-N 1 0 336.775 3.777 20 5 EHBDRO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])c(OC)c2)C2CC2)cc1 ZINC000485749028 1039509320 /nfs/dbraw/zinc/50/93/20/1039509320.db2.gz XLEUQDUYAYALJP-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+]([C@H]3CCc4ccc(Cl)cc43)CC2)n1 ZINC000488968491 1039516279 /nfs/dbraw/zinc/51/62/79/1039516279.db2.gz ASFJMTBZWSILFG-INIZCTEOSA-N 1 0 346.818 3.769 20 5 EHBDRO CN(C)c1ncccc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309365 1039662477 /nfs/dbraw/zinc/66/24/77/1039662477.db2.gz GCXVLHHUILVJBN-SFHVURJKSA-N 1 0 340.427 3.613 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417349997 1039702673 /nfs/dbraw/zinc/70/26/73/1039702673.db2.gz NWHKSEYZJWEXTH-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO Cc1nn(C)c(C)c1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417344583 1039708889 /nfs/dbraw/zinc/70/88/89/1039708889.db2.gz SIMHVUKUNQPYGV-GOSISDBHSA-N 1 0 328.416 3.502 20 5 EHBDRO COc1cc(C[N@H+](C)CCc2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000489181958 1039712148 /nfs/dbraw/zinc/71/21/48/1039712148.db2.gz BRCOMFCWDCYKCI-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO CCc1ccc([C@H](NCC2([NH+](C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000417357838 1039717702 /nfs/dbraw/zinc/71/77/02/1039717702.db2.gz SGGXAWBEICPAAZ-GOSISDBHSA-N 1 0 343.427 3.523 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000549734241 1039745909 /nfs/dbraw/zinc/74/59/09/1039745909.db2.gz VULKIYDSCGRFKW-IAGOWNOFSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553337305 1039985376 /nfs/dbraw/zinc/98/53/76/1039985376.db2.gz FJPYNSXREXBRDB-AAEUAGOBSA-N 1 0 343.349 3.677 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145534 1040022075 /nfs/dbraw/zinc/02/20/75/1040022075.db2.gz OEFKWKVBBIYNSF-QWHCGFSZSA-N 1 0 330.388 3.828 20 5 EHBDRO CC(C)OCCC[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549861102 1040066600 /nfs/dbraw/zinc/06/66/00/1040066600.db2.gz YVOZPGGESQSMOH-UHFFFAOYSA-N 1 0 334.338 3.861 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](c1ccco1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000120280696 1040302861 /nfs/dbraw/zinc/30/28/61/1040302861.db2.gz AHDWUTUEJYNZIR-SJORKVTESA-N 1 0 331.416 3.922 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H](c1ccco1)N1CCCCC1 ZINC000072726068 1040320459 /nfs/dbraw/zinc/32/04/59/1040320459.db2.gz ADGDTRPNNYCVNE-QGZVFWFLSA-N 1 0 329.400 3.505 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787134 1040444750 /nfs/dbraw/zinc/44/47/50/1040444750.db2.gz HEDIZDDHMCMDDG-YOEHRIQHSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)N[C@H](C)C[NH+]1CCCCCC1 ZINC000479794417 1040610123 /nfs/dbraw/zinc/61/01/23/1040610123.db2.gz GIEIWWBUBJBUOE-OAHLLOKOSA-N 1 0 347.459 3.514 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCCn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000120486967 1040733742 /nfs/dbraw/zinc/73/37/42/1040733742.db2.gz FTGISPFLHXVHHT-OAHLLOKOSA-N 1 0 338.411 3.994 20 5 EHBDRO Cc1ccc([C@@H](C)C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000600155871 1040746434 /nfs/dbraw/zinc/74/64/34/1040746434.db2.gz JRIZPYXSLJJTMU-HNNXBMFYSA-N 1 0 328.416 3.540 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000500235205 1040779354 /nfs/dbraw/zinc/77/93/54/1040779354.db2.gz YPGLIILOOZPDPB-QGZVFWFLSA-N 1 0 346.402 3.551 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)CCCC2 ZINC000490864638 1040785041 /nfs/dbraw/zinc/78/50/41/1040785041.db2.gz MOUHTDGTBRFEMY-UHFFFAOYSA-N 1 0 326.396 3.772 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000123266505 1040789364 /nfs/dbraw/zinc/78/93/64/1040789364.db2.gz LPXUHNSKPJQWKN-CHWSQXEVSA-N 1 0 348.374 3.633 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000150735760 1040886225 /nfs/dbraw/zinc/88/62/25/1040886225.db2.gz SHPRGLJINCGHBX-CQSZACIVSA-N 1 0 330.388 3.799 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000555665339 1040974732 /nfs/dbraw/zinc/97/47/32/1040974732.db2.gz AYERRSPRJHJVBQ-CQSZACIVSA-N 1 0 338.407 3.959 20 5 EHBDRO C[C@@H](O)CCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000433194548 1041039241 /nfs/dbraw/zinc/03/92/41/1041039241.db2.gz NYNMIPSJEWVZBM-CYBMUJFWSA-N 1 0 348.374 3.777 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1Cc2ccccc2C1 ZINC000511658258 1041040433 /nfs/dbraw/zinc/04/04/33/1041040433.db2.gz WAQCQZNYCNSMCP-UHFFFAOYSA-N 1 0 326.396 3.593 20 5 EHBDRO CC(C)c1ccc(C(=O)NCC(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000481589555 1041106139 /nfs/dbraw/zinc/10/61/39/1041106139.db2.gz UXGHBSZMYDLTGE-UHFFFAOYSA-N 1 0 347.459 3.570 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCC[C@H]1n1cccn1 ZINC000128573394 1041153427 /nfs/dbraw/zinc/15/34/27/1041153427.db2.gz JNDSVNAWVBTNFR-LSDHHAIUSA-N 1 0 334.807 3.718 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(-c2cc[nH]n2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000433335180 1041288112 /nfs/dbraw/zinc/28/81/12/1041288112.db2.gz KLYLCCAEXMTILL-UHFFFAOYSA-N 1 0 326.356 3.603 20 5 EHBDRO C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481733647 1041308800 /nfs/dbraw/zinc/30/88/00/1041308800.db2.gz UMLWMZAQOKWUCK-ZIAGYGMSSA-N 1 0 342.395 3.995 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107071090 1041814376 /nfs/dbraw/zinc/81/43/76/1041814376.db2.gz WIEMDAXVWDXFQZ-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO CCCC[NH+]1CCC(NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000236759343 1042407050 /nfs/dbraw/zinc/40/70/50/1042407050.db2.gz RGEVPCBBRIXNQD-UHFFFAOYSA-N 1 0 325.840 3.602 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799439 1042700819 /nfs/dbraw/zinc/70/08/19/1042700819.db2.gz ZMGDHQPYHQJVRS-XJKSGUPXSA-N 1 0 334.416 3.782 20 5 EHBDRO CC[N@H+](CCc1nccs1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000159231216 1042764850 /nfs/dbraw/zinc/76/48/50/1042764850.db2.gz MZBZEVAEPSEPLJ-UHFFFAOYSA-N 1 0 325.821 3.769 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000165641111 1042865542 /nfs/dbraw/zinc/86/55/42/1042865542.db2.gz OMSMQWGUVBFUBY-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO C[C@H]1CC([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000128713657 1042868982 /nfs/dbraw/zinc/86/89/82/1042868982.db2.gz AZYCNJAXBFQCSM-RYUDHWBXSA-N 1 0 347.440 3.764 20 5 EHBDRO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000236807914 1042961344 /nfs/dbraw/zinc/96/13/44/1042961344.db2.gz LWLRTOAHYHQEEK-UHFFFAOYSA-N 1 0 342.395 3.840 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411125 1044061217 /nfs/dbraw/zinc/06/12/17/1044061217.db2.gz DUGBDYNNZULVPX-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1C)c1ccco1 ZINC000183455611 1125568036 /nfs/dbraw/zinc/56/80/36/1125568036.db2.gz NKNPWHNLNBRXOU-QGZVFWFLSA-N 1 0 331.416 3.669 20 5 EHBDRO C[N@@H+](Cc1ccc(F)c(Cl)c1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000763836376 1126882359 /nfs/dbraw/zinc/88/23/59/1126882359.db2.gz MRAWKWIKDZFDTG-MRXNPFEDSA-N 1 0 338.766 3.553 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000765335158 1127599685 /nfs/dbraw/zinc/59/96/85/1127599685.db2.gz RFXOLMYAGWNUEQ-CABCVRRESA-N 1 0 326.396 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3ccc(F)cc3F)CC2)cc1 ZINC000765461796 1127614607 /nfs/dbraw/zinc/61/46/07/1127614607.db2.gz BQEABSWQGCUQKD-UHFFFAOYSA-N 1 0 347.365 3.632 20 5 EHBDRO [NH3+]CC[C@H]1CN(c2cc3cccnc3c([N+](=O)[O-])c2)c2ccccc21 ZINC001168549492 1127714182 /nfs/dbraw/zinc/71/41/82/1127714182.db2.gz OCDPNZMDNIYEKC-AWEZNQCLSA-N 1 0 334.379 3.727 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000552250955 1127726037 /nfs/dbraw/zinc/72/60/37/1127726037.db2.gz HARGJSLVBGHGQN-IIDMSEBBSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1ccnc(NCc2ccccc2C[N@@H+](C)C(C)C)c1[N+](=O)[O-] ZINC000301309804 1127736091 /nfs/dbraw/zinc/73/60/91/1127736091.db2.gz YDZUXEUYRZNDMF-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])cc1C)[NH+](C)C ZINC000301449001 1127892564 /nfs/dbraw/zinc/89/25/64/1127892564.db2.gz RUMMKKPWIPGWLZ-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@@H]1CCN(c2cccc(F)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000301467681 1128451934 /nfs/dbraw/zinc/45/19/34/1128451934.db2.gz YLKQJZHBRWPDSK-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO Cc1ccnc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301545489 1128495813 /nfs/dbraw/zinc/49/58/13/1128495813.db2.gz OSLFSWVMLAQOJF-RDJZCZTQSA-N 1 0 340.427 3.763 20 5 EHBDRO CCOc1cc(NC2CC[NH+](C3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301566071 1128497497 /nfs/dbraw/zinc/49/74/97/1128497497.db2.gz JRHFEHGSTMFSLP-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO Cc1cnc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564053 1128497935 /nfs/dbraw/zinc/49/79/35/1128497935.db2.gz VRNPDEUWRPYHDB-WBVHZDCISA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000301599729 1128509199 /nfs/dbraw/zinc/50/91/99/1128509199.db2.gz UOTNMZGRCSCEEB-DOTOQJQBSA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCc3c2cccc3Cl)cc1 ZINC000765848618 1128559703 /nfs/dbraw/zinc/55/97/03/1128559703.db2.gz JFKBJYMSWMPDCG-DLBZAZTESA-N 1 0 332.787 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H](CC2CC2)c2ccccc2)cc1 ZINC000765845589 1128545198 /nfs/dbraw/zinc/54/51/98/1128545198.db2.gz QWJOPDIZOXKEDK-RTBURBONSA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273502868 1128570488 /nfs/dbraw/zinc/57/04/88/1128570488.db2.gz POQQCRMTQAPXLJ-WMZOPIPTSA-N 1 0 330.359 3.744 20 5 EHBDRO COc1cc(C[N@H+](C)C2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000153796151 1128690450 /nfs/dbraw/zinc/69/04/50/1128690450.db2.gz HDTSLWLXMBMSQP-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000172619122 1128736797 /nfs/dbraw/zinc/73/67/97/1128736797.db2.gz JHKLFYKYDKZEEI-WBVHZDCISA-N 1 0 347.462 3.943 20 5 EHBDRO C[C@H](Cn1ccnc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338716178 1128745240 /nfs/dbraw/zinc/74/52/40/1128745240.db2.gz MWLAMBRYZXEFTA-CYBMUJFWSA-N 1 0 342.424 3.698 20 5 EHBDRO C[C@@H](Cn1ccnc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338716740 1128745391 /nfs/dbraw/zinc/74/53/91/1128745391.db2.gz RHOOSXANEGYPTL-ZDUSSCGKSA-N 1 0 342.424 3.698 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H]([NH+]2CCCC2)[C@@H]1C ZINC000554874909 1128754172 /nfs/dbraw/zinc/75/41/72/1128754172.db2.gz OIXQBOQELHDBFT-MLHMOSTNSA-N 1 0 329.444 3.557 20 5 EHBDRO Cc1nc(NCc2ccc(C[NH+]3CCCCC3)cc2)ccc1[N+](=O)[O-] ZINC000301634835 1128783441 /nfs/dbraw/zinc/78/34/41/1128783441.db2.gz KOLFGHXRGIMUSF-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO Cc1nc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000301658439 1128846176 /nfs/dbraw/zinc/84/61/76/1128846176.db2.gz STLJMDLBCXFLLJ-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486181 1120609376 /nfs/dbraw/zinc/60/93/76/1120609376.db2.gz YPVMKENUQWEDPL-UKRRQHHQSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C(C)C ZINC000494647226 1120712300 /nfs/dbraw/zinc/71/23/00/1120712300.db2.gz HNQHBNXERLGDMX-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO Cc1cc(N2CC[C@H](C(C)(C)C)[C@@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542508633 1120855588 /nfs/dbraw/zinc/85/55/88/1120855588.db2.gz LUNDWWWSTQQVIK-YJBOKZPZSA-N 1 0 343.427 3.685 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000495045876 1120939846 /nfs/dbraw/zinc/93/98/46/1120939846.db2.gz MPAOHLUTQJDKSN-RDTXWAMCSA-N 1 0 344.386 3.991 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301057355 1121203321 /nfs/dbraw/zinc/20/33/21/1121203321.db2.gz BBYYIQWOAXWXMS-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1C[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C1 ZINC000311001842 1128975699 /nfs/dbraw/zinc/97/56/99/1128975699.db2.gz INDGZJRTCYIUPE-MSOLQXFVSA-N 1 0 337.423 3.553 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC000762634427 1121392983 /nfs/dbraw/zinc/39/29/83/1121392983.db2.gz PBBUJTREURDSHB-OALUTQOASA-N 1 0 326.396 3.855 20 5 EHBDRO CC1CC[NH+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])CC1 ZINC000301080558 1121463258 /nfs/dbraw/zinc/46/32/58/1121463258.db2.gz HOSIRKNWNQDGLJ-UHFFFAOYSA-N 1 0 340.427 3.834 20 5 EHBDRO C[N@H+](CCNc1ccc([N+](=O)[O-])c2cnccc12)C1CCCCC1 ZINC000301080932 1121464473 /nfs/dbraw/zinc/46/44/73/1121464473.db2.gz COVOBCMUGYDASA-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000194415594 1121883752 /nfs/dbraw/zinc/88/37/52/1121883752.db2.gz WMGJKKDSJSEQTO-AWEZNQCLSA-N 1 0 344.411 3.643 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000301104693 1121919601 /nfs/dbraw/zinc/91/96/01/1121919601.db2.gz VMIAJXLYRFLMSP-CHWSQXEVSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373077 1122586335 /nfs/dbraw/zinc/58/63/35/1122586335.db2.gz RYXQVYFTNQFPSG-ZNOIYHFQSA-N 1 0 344.386 3.850 20 5 EHBDRO CCCC[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H](C)CC ZINC000917436379 1122601538 /nfs/dbraw/zinc/60/15/38/1122601538.db2.gz BZTRFPQUHDPKOT-CQSZACIVSA-N 1 0 331.420 3.711 20 5 EHBDRO COc1ccc(CNC[C@@H](C(C)C)[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000609287730 1122939567 /nfs/dbraw/zinc/93/95/67/1122939567.db2.gz XSRPGSSTZJKQQP-SFHVURJKSA-N 1 0 349.475 3.594 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000556872216 1123162904 /nfs/dbraw/zinc/16/29/04/1123162904.db2.gz PGGZBOFGVJGXFS-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CC[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000556945848 1123226785 /nfs/dbraw/zinc/22/67/85/1123226785.db2.gz DKRKLIWTQHOVDQ-ZDUSSCGKSA-N 1 0 348.374 3.729 20 5 EHBDRO CCC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@@H]1CCCCO1 ZINC000609314338 1123354912 /nfs/dbraw/zinc/35/49/12/1123354912.db2.gz DNXVISRUMCSBLO-SFHVURJKSA-N 1 0 336.432 3.645 20 5 EHBDRO CC[C@@H](C[NH+]1CCCC1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609839854 1123678352 /nfs/dbraw/zinc/67/83/52/1123678352.db2.gz CGWNOJZZGPTZQR-LBPRGKRZSA-N 1 0 331.338 3.900 20 5 EHBDRO C[C@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916575 1123691636 /nfs/dbraw/zinc/69/16/36/1123691636.db2.gz YCTABOITTRVVHU-GOEBONIOSA-N 1 0 344.386 3.991 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@@H+]1C1CC1 ZINC000301820950 1129144129 /nfs/dbraw/zinc/14/41/29/1129144129.db2.gz JRTZWJMBDCHHID-MWLCHTKSSA-N 1 0 329.322 3.651 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@]2(CC=CCC2)C1 ZINC000114494589 1129152279 /nfs/dbraw/zinc/15/22/79/1129152279.db2.gz YOWJKMFTCGJXMQ-LJQANCHMSA-N 1 0 343.427 3.664 20 5 EHBDRO CC(C)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccnn1C ZINC000615943454 1123912299 /nfs/dbraw/zinc/91/22/99/1123912299.db2.gz LMXBBDDDKJKRSJ-CQSZACIVSA-N 1 0 336.823 3.511 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216826 1124100493 /nfs/dbraw/zinc/10/04/93/1124100493.db2.gz ZQJWZVYOHHMWIH-NVXWUHKLSA-N 1 0 348.443 3.632 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000078625292 1129174247 /nfs/dbraw/zinc/17/42/47/1129174247.db2.gz YUMXOCPYYNLACX-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO Cc1ccc(C)c(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000069161194 1124496342 /nfs/dbraw/zinc/49/63/42/1124496342.db2.gz MCDAEJVWTNPNNP-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO Cc1cc(NCc2ccccc2C[NH+]2CCCCC2)ncc1[N+](=O)[O-] ZINC000080597057 1124579132 /nfs/dbraw/zinc/57/91/32/1124579132.db2.gz AUUPDNRZKFRGHC-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO C[C@@H]1CCC[C@](CNc2ncnc3sc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000326557572 1124646407 /nfs/dbraw/zinc/64/64/07/1124646407.db2.gz VEQFMJFXIXHAJT-BZNIZROVSA-N 1 0 349.460 3.522 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+]C2(c3cccc(Cl)c3)CCCC2)c1 ZINC000181456438 1124854593 /nfs/dbraw/zinc/85/45/93/1124854593.db2.gz HBVUUFDAXKTUED-UHFFFAOYSA-N 1 0 334.807 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1OCCc3ccccc31)CCC2 ZINC000618571752 1125120460 /nfs/dbraw/zinc/12/04/60/1125120460.db2.gz VZQSWZPHMWSYOJ-WOJBJXKFSA-N 1 0 338.407 3.876 20 5 EHBDRO Cc1ccccc1[C@@H](CO)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984940 1125257372 /nfs/dbraw/zinc/25/73/72/1125257372.db2.gz MMBJKJBZAKRLHT-RBUKOAKNSA-N 1 0 340.423 3.949 20 5 EHBDRO CCC1(O)CCC([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000618985513 1125258005 /nfs/dbraw/zinc/25/80/05/1125258005.db2.gz CDVUUJKNKJRKOE-KZGIRGLMSA-N 1 0 332.444 3.991 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCC3)c2cc([N+](=O)[O-])ccc21 ZINC000618988421 1125263098 /nfs/dbraw/zinc/26/30/98/1125263098.db2.gz KJKBGWLUVALANL-RNJTYBCJSA-N 1 0 342.439 3.864 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000183074155 1125432362 /nfs/dbraw/zinc/43/23/62/1125432362.db2.gz PQJTYNUMOXYZAB-GHMZBOCLSA-N 1 0 346.374 3.772 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000078704597 1129185133 /nfs/dbraw/zinc/18/51/33/1129185133.db2.gz WRRBBFCFKMLGID-SJLPKXTDSA-N 1 0 331.460 3.681 20 5 EHBDRO C[C@H]1CO[C@H](c2ccccc2)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851864 1129216456 /nfs/dbraw/zinc/21/64/56/1129216456.db2.gz IFPUYHOMJJFCKJ-KXBFYZLASA-N 1 0 326.396 3.599 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C(F)(F)F ZINC000369968322 1129225135 /nfs/dbraw/zinc/22/51/35/1129225135.db2.gz YUEBOHNZJPHRLF-VXGBXAGGSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255902961 1129225552 /nfs/dbraw/zinc/22/55/52/1129225552.db2.gz TUXPZXDSCXWWDG-PKYBCLHXSA-N 1 0 326.396 3.877 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000255954898 1129237713 /nfs/dbraw/zinc/23/77/13/1129237713.db2.gz AKNAZURMVWPHPE-GZBFAFLISA-N 1 0 333.432 3.646 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301884961 1129265631 /nfs/dbraw/zinc/26/56/31/1129265631.db2.gz ZFBICBNHWZSNRL-HNNXBMFYSA-N 1 0 340.427 3.801 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000301957897 1129413599 /nfs/dbraw/zinc/41/35/99/1129413599.db2.gz NKZOLEBJPKKDLP-UHFFFAOYSA-N 1 0 346.818 3.972 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2cc(Br)ccc2[N+](=O)[O-])C1 ZINC000301989613 1129486529 /nfs/dbraw/zinc/48/65/29/1129486529.db2.gz ONAIKAYHNDNOCD-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000543458651 1129501168 /nfs/dbraw/zinc/50/11/68/1129501168.db2.gz IYJTZFSDBQKRET-CXAGYDPISA-N 1 0 334.416 3.757 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc2c(s1)CCC2 ZINC000922470743 1129541180 /nfs/dbraw/zinc/54/11/80/1129541180.db2.gz RJQOQOBPUBKUMJ-XYOKQWHBSA-N 1 0 329.425 3.733 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000154947054 1129600967 /nfs/dbraw/zinc/60/09/67/1129600967.db2.gz UUBVJQWKFHQRGD-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000922694032 1129625567 /nfs/dbraw/zinc/62/55/67/1129625567.db2.gz IZUJNGHRKJBAFU-VZFYUFDISA-N 1 0 344.333 3.698 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000338874029 1129640316 /nfs/dbraw/zinc/64/03/16/1129640316.db2.gz ZIOYMTAGLLZXFM-ZDUSSCGKSA-N 1 0 347.415 3.581 20 5 EHBDRO CCC1CCC([N@H+](C)CC(=O)Nc2c(C)cccc2[N+](=O)[O-])CC1 ZINC000330627268 1129642013 /nfs/dbraw/zinc/64/20/13/1129642013.db2.gz JWWQUEXDTKIURV-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(OCCc3ccccc3)CC2)c1 ZINC000125694991 1129710998 /nfs/dbraw/zinc/71/09/98/1129710998.db2.gz HCYVQDVASQLTPU-UHFFFAOYSA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(OCCc2ccccc2)CC1 ZINC000125773326 1129714817 /nfs/dbraw/zinc/71/48/17/1129714817.db2.gz YNKUMIBNJZFQKK-UHFFFAOYSA-N 1 0 340.423 3.819 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cnn1C ZINC000156564049 1129725264 /nfs/dbraw/zinc/72/52/64/1129725264.db2.gz RSIBRKGWBWNASG-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO Cc1cc(N2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc2[nH+]1 ZINC000302728229 1129787930 /nfs/dbraw/zinc/78/79/30/1129787930.db2.gz KRHHPBZKJNWNJN-CQSZACIVSA-N 1 0 349.394 3.537 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000303471965 1129848122 /nfs/dbraw/zinc/84/81/22/1129848122.db2.gz QWWWSXWTASTBIP-KRWDZBQOSA-N 1 0 338.473 3.971 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH2+]C(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000543506116 1129908400 /nfs/dbraw/zinc/90/84/00/1129908400.db2.gz ODUBJZFHYXZTGB-GFCCVEGCSA-N 1 0 347.440 3.817 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])CC(C)C ZINC000058621063 1129952480 /nfs/dbraw/zinc/95/24/80/1129952480.db2.gz NCRCLJWXYQRJIE-MRXNPFEDSA-N 1 0 335.448 3.966 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414158 1130054758 /nfs/dbraw/zinc/05/47/58/1130054758.db2.gz QCLLMALIXMXFJB-XUJVJEKNSA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314319 1130205738 /nfs/dbraw/zinc/20/57/38/1130205738.db2.gz XMEFPLSUFVUZGX-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000173318020 1130205850 /nfs/dbraw/zinc/20/58/50/1130205850.db2.gz GIIXNVXILQFKOL-MRXNPFEDSA-N 1 0 340.423 3.994 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173344068 1130213783 /nfs/dbraw/zinc/21/37/83/1130213783.db2.gz OYXYCPZTUGJZQX-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000173413001 1130228650 /nfs/dbraw/zinc/22/86/50/1130228650.db2.gz FWDRKQNQSAEHKG-LBPRGKRZSA-N 1 0 331.441 3.823 20 5 EHBDRO COc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173449841 1130232576 /nfs/dbraw/zinc/23/25/76/1130232576.db2.gz JYOIWEMNVIIJRR-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794893 1131082522 /nfs/dbraw/zinc/08/25/22/1131082522.db2.gz HITFVLDUVBCBSW-HZPDHXFCSA-N 1 0 349.450 3.820 20 5 EHBDRO CC1(C)SC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000282649379 1131132124 /nfs/dbraw/zinc/13/21/24/1131132124.db2.gz HQRGEWWAGZWPJP-ZDUSSCGKSA-N 1 0 335.454 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@]4(CC=CCC4)C3)c2c1 ZINC000733991507 1131179972 /nfs/dbraw/zinc/17/99/72/1131179972.db2.gz FYUQSLQCDUYBOQ-GOSISDBHSA-N 1 0 326.400 3.724 20 5 EHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742146881 1131690930 /nfs/dbraw/zinc/69/09/30/1131690930.db2.gz QUTPUKJPDRUQSA-HNNXBMFYSA-N 1 0 343.431 3.711 20 5 EHBDRO COc1cccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172899488 1131882606 /nfs/dbraw/zinc/88/26/06/1131882606.db2.gz ZUYVSTOILBLTKJ-QGZVFWFLSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](F)C(F)(F)CC1)CC2 ZINC001172907904 1131887192 /nfs/dbraw/zinc/88/71/92/1131887192.db2.gz JJPLPXJAMUCTLY-HOCLYGCPSA-N 1 0 342.361 3.911 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381102 1131914139 /nfs/dbraw/zinc/91/41/39/1131914139.db2.gz VZVFOFQIPWOCED-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H](c1ccccn1)C1CC1)CC2 ZINC001172910744 1131917414 /nfs/dbraw/zinc/91/74/14/1131917414.db2.gz CKKWPMPTBFYHKN-XLIONFOSSA-N 1 0 337.423 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](c3ccncc3)C1)CC2 ZINC001172911303 1131917462 /nfs/dbraw/zinc/91/74/62/1131917462.db2.gz SECGJTKBRZQOTF-MOPGFXCFSA-N 1 0 337.423 3.727 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccccn1 ZINC001173181875 1131992643 /nfs/dbraw/zinc/99/26/43/1131992643.db2.gz FGBPOJVIOVSWAO-JSGCOSHPSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1F ZINC001173177591 1131992719 /nfs/dbraw/zinc/99/27/19/1131992719.db2.gz VRJLECJOKBHYQW-WDEREUQCSA-N 1 0 346.349 3.699 20 5 EHBDRO CC[N@H+](Cc1ccncc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173184461 1131993931 /nfs/dbraw/zinc/99/39/31/1131993931.db2.gz NLNGUFBXLZLSFZ-CYBMUJFWSA-N 1 0 347.390 3.591 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2(CC3CC3)CC2)c1F ZINC001173181923 1131994417 /nfs/dbraw/zinc/99/44/17/1131994417.db2.gz XIMOWPULUXZSJB-GFCCVEGCSA-N 1 0 336.407 3.843 20 5 EHBDRO COc1cccc(C2([NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173219354 1132003496 /nfs/dbraw/zinc/00/34/96/1132003496.db2.gz BJRYKQNGYUGGCE-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1COc2cc(Cl)ccc21 ZINC001173218150 1132003607 /nfs/dbraw/zinc/00/36/07/1132003607.db2.gz BPYGMKORNOLFNJ-MEDUHNTESA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223482 1132005204 /nfs/dbraw/zinc/00/52/04/1132005204.db2.gz ANFJYUGABFRLNS-OXJNMPFZSA-N 1 0 339.439 3.515 20 5 EHBDRO Cc1cnccc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223349 1132005956 /nfs/dbraw/zinc/00/59/56/1132005956.db2.gz IDMLJGXGJJFAJA-IFXJQAMLSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(Cc2ccc(O)cc2)CC1 ZINC001173228339 1132007724 /nfs/dbraw/zinc/00/77/24/1132007724.db2.gz JGNOCFJWMLGYPM-CQSZACIVSA-N 1 0 326.396 3.596 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c(C[NH3+])cc2cccc(F)c21 ZINC001173230575 1132009544 /nfs/dbraw/zinc/00/95/44/1132009544.db2.gz RYDNBBVJOKOKEN-GFCCVEGCSA-N 1 0 327.359 3.951 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)c1cccs1 ZINC001173230804 1132009690 /nfs/dbraw/zinc/00/96/90/1132009690.db2.gz GQEFQAZTXISVET-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN(C)Cc1ccccc1 ZINC001173232609 1132009877 /nfs/dbraw/zinc/00/98/77/1132009877.db2.gz RWYLIRAVAFJXKM-QGZVFWFLSA-N 1 0 341.455 3.590 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1cccc(Cl)c1 ZINC001173235883 1132010911 /nfs/dbraw/zinc/01/09/11/1132010911.db2.gz VPVOLCZOKGKZGN-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)cn1 ZINC001173214483 1132014889 /nfs/dbraw/zinc/01/48/89/1132014889.db2.gz NXKRDZQJQSWWMA-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H](O)c1c(F)cccc1Cl ZINC000744448181 1132102595 /nfs/dbraw/zinc/10/25/95/1132102595.db2.gz PGKYKERJFNQIJK-CLAHSXSESA-N 1 0 344.795 3.661 20 5 EHBDRO CC[C@@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@@H]1c1ccccc1 ZINC000746382058 1132504515 /nfs/dbraw/zinc/50/45/15/1132504515.db2.gz LLHYMIIRJVZQLA-AEFFLSMTSA-N 1 0 342.443 3.881 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC001168812312 1132566895 /nfs/dbraw/zinc/56/68/95/1132566895.db2.gz IVOSZAOUNZRYCQ-HNNXBMFYSA-N 1 0 328.412 3.930 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168976734 1132617416 /nfs/dbraw/zinc/61/74/16/1132617416.db2.gz FYNVRYCASRVWKO-QJPTWQEYSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001168978151 1132618388 /nfs/dbraw/zinc/61/83/88/1132618388.db2.gz OXOJHUDHNUKMPT-DZGCQCFKSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](OCc3ccccc3)CC2)C1 ZINC001168959979 1132620390 /nfs/dbraw/zinc/62/03/90/1132620390.db2.gz YLPXHEQNOYECPN-NCXUSEDFSA-N 1 0 332.444 3.549 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1F ZINC001168986234 1132623774 /nfs/dbraw/zinc/62/37/74/1132623774.db2.gz XGQMLEIAQVXUFH-JFGNBEQYSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ccc(C(F)(F)F)cn2)C2CC2)C1 ZINC001168998091 1132627565 /nfs/dbraw/zinc/62/75/65/1132627565.db2.gz ICAZZWRNJNZZTQ-DGFSRKRXSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](OCc3ccccc3)CC2)C1 ZINC001169000659 1132628628 /nfs/dbraw/zinc/62/86/28/1132628628.db2.gz YLPXHEQNOYECPN-YRXWBPOGSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](CC2CCOCC2)c2ccccc2)C1 ZINC001169003524 1132630077 /nfs/dbraw/zinc/63/00/77/1132630077.db2.gz NWMUHWHRCGLSIZ-NZSAHSFTSA-N 1 0 332.444 3.579 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(c3noc4cc(F)ccc43)CC2)C1 ZINC001169010101 1132631883 /nfs/dbraw/zinc/63/18/83/1132631883.db2.gz AYGCUVYYDLBGPP-IUODEOHRSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037125 1132637335 /nfs/dbraw/zinc/63/73/35/1132637335.db2.gz JBPHTXISHRIDJD-KCXAZCMYSA-N 1 0 340.876 3.875 20 5 EHBDRO CC[N@H+](Cc1ccc(Br)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040064 1132637973 /nfs/dbraw/zinc/63/79/73/1132637973.db2.gz XLGICOTYVBMQIY-UKRRQHHQSA-N 1 0 341.249 3.716 20 5 EHBDRO CC1(C)C[C@@H](Nc2nc(Cl)ccc2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169146707 1132676023 /nfs/dbraw/zinc/67/60/23/1132676023.db2.gz RWYNOTJLNWXVGI-BMIGLBTASA-N 1 0 326.828 3.599 20 5 EHBDRO C[C@@H]([NH3+])c1ccn(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC001169232670 1132703594 /nfs/dbraw/zinc/70/35/94/1132703594.db2.gz ICCXLGOMIFCFDK-GFCCVEGCSA-N 1 0 340.408 3.951 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC001175688941 1132738542 /nfs/dbraw/zinc/73/85/42/1132738542.db2.gz QVIWUJIEBPVSTR-KRWDZBQOSA-N 1 0 348.443 3.632 20 5 EHBDRO CCOc1ccc(CC[N@H+](C)Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC001176832599 1133004139 /nfs/dbraw/zinc/00/41/39/1133004139.db2.gz FKCNJTZTFPDQPJ-UHFFFAOYSA-N 1 0 328.412 3.976 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765742 1133050251 /nfs/dbraw/zinc/05/02/51/1133050251.db2.gz RWZYZTWFGXRRHN-INIZCTEOSA-N 1 0 343.431 3.856 20 5 EHBDRO CCc1cc(C[NH2+][C@@H](CC)CSc2ccccc2[N+](=O)[O-])[nH]n1 ZINC000768104425 1133095593 /nfs/dbraw/zinc/09/55/93/1133095593.db2.gz KDAMLRKJGDGHEB-ZDUSSCGKSA-N 1 0 334.445 3.541 20 5 EHBDRO CCCCN1CCCC[C@H]1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC001177741715 1133098095 /nfs/dbraw/zinc/09/80/95/1133098095.db2.gz CHZLCYBMGKNVBN-KRWDZBQOSA-N 1 0 333.476 3.956 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)c1ccc(NC(N)=O)cc1 ZINC001177803793 1133104441 /nfs/dbraw/zinc/10/44/41/1133104441.db2.gz GZXAZIIKMPMXRO-CYBMUJFWSA-N 1 0 342.399 3.553 20 5 EHBDRO CCC[C@H](C)[C@H](CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179082354 1133227238 /nfs/dbraw/zinc/22/72/38/1133227238.db2.gz XLBQUFAJJXQODY-GUYCJALGSA-N 1 0 332.400 3.742 20 5 EHBDRO COc1ccc(C[NH2+]CC2CCc3ccccc3CC2)cc1[N+](=O)[O-] ZINC001179243292 1133238945 /nfs/dbraw/zinc/23/89/45/1133238945.db2.gz OOIVSDQGIPUGAN-UHFFFAOYSA-N 1 0 340.423 3.888 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc2oc(=O)[nH]c2c1 ZINC001179526114 1133256249 /nfs/dbraw/zinc/25/62/49/1133256249.db2.gz YSUKJQHOISEEDR-GHXNOFRVSA-N 1 0 339.351 3.635 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCN(c3ccc(Cl)cc3)C2)c(F)c1 ZINC001180332763 1133362744 /nfs/dbraw/zinc/36/27/44/1133362744.db2.gz SUZZUPXIGLCGPF-AWEZNQCLSA-N 1 0 349.793 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCc3cc(F)c(F)c(F)c32)cc1 ZINC001181807815 1133530945 /nfs/dbraw/zinc/53/09/45/1133530945.db2.gz JHGNLJJVBUEQFA-AWEZNQCLSA-N 1 0 336.313 3.832 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774210656 1133634496 /nfs/dbraw/zinc/63/44/96/1133634496.db2.gz GONNZKHYPPDXIX-HZPDHXFCSA-N 1 0 332.379 3.512 20 5 EHBDRO CC[C@@H](C)C[C@@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519794 1133692323 /nfs/dbraw/zinc/69/23/23/1133692323.db2.gz BQHLDDXUVRMXNI-MFKMUULPSA-N 1 0 334.338 3.500 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC000786811095 1133909561 /nfs/dbraw/zinc/90/95/61/1133909561.db2.gz ICWCOTAOROXXSH-YVGNARHYSA-N 1 0 326.396 3.841 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1cccc(C)c1 ZINC000786815940 1133910012 /nfs/dbraw/zinc/91/00/12/1133910012.db2.gz OTQMEARQUJESOZ-QLTJYVKOSA-N 1 0 326.396 3.630 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]CCc2ccc(F)c(F)c2)c1 ZINC000786818525 1133911320 /nfs/dbraw/zinc/91/13/20/1133911320.db2.gz HOJUBBVCNSPZNS-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC001184839179 1133996467 /nfs/dbraw/zinc/99/64/67/1133996467.db2.gz DIWOTZCYRAENNB-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NCCCCC[NH+]2CCCCC2)c(F)c1 ZINC001185386808 1134077019 /nfs/dbraw/zinc/07/70/19/1134077019.db2.gz HSFDQXGNVKGHLL-UHFFFAOYSA-N 1 0 327.375 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])c1 ZINC000774883955 1134091720 /nfs/dbraw/zinc/09/17/20/1134091720.db2.gz FTCFWZAMIJRFEL-ZDUSSCGKSA-N 1 0 345.330 3.632 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)C12CCCC2 ZINC000788608988 1134145518 /nfs/dbraw/zinc/14/55/18/1134145518.db2.gz HMUQSLISTCORTG-JCURWCKSSA-N 1 0 333.432 3.565 20 5 EHBDRO Cc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788607089 1134150385 /nfs/dbraw/zinc/15/03/85/1134150385.db2.gz COVPFFRJHHBNGQ-KBPBESRZSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@@H](NC[C@@H]1CCC[N@@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804146 1134171059 /nfs/dbraw/zinc/17/10/59/1134171059.db2.gz VBTXNANVUQWXDV-PBHICJAKSA-N 1 0 346.475 3.625 20 5 EHBDRO C[C@@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788817549 1134176338 /nfs/dbraw/zinc/17/63/38/1134176338.db2.gz ZIXJLSRVNGGXMK-DAIYRKSASA-N 1 0 325.412 3.948 20 5 EHBDRO C[C@H]([NH2+][C@H]1Cc2ccc(Cl)cc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788825759 1134177933 /nfs/dbraw/zinc/17/79/33/1134177933.db2.gz ZOKXQCYOEZJEII-BONVTDFDSA-N 1 0 331.803 3.648 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@H](C)c3ccccc3)CC2)c1 ZINC001187463076 1134337718 /nfs/dbraw/zinc/33/77/18/1134337718.db2.gz OEQAILYPZTZUEJ-MRXNPFEDSA-N 1 0 325.412 3.786 20 5 EHBDRO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CCO2 ZINC000790695136 1134453968 /nfs/dbraw/zinc/45/39/68/1134453968.db2.gz KODLOONWQPRSMF-KRWDZBQOSA-N 1 0 342.395 3.915 20 5 EHBDRO Cc1cccc(CCC[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC001190331431 1134683886 /nfs/dbraw/zinc/68/38/86/1134683886.db2.gz GHXFPWKFQKBBJW-UHFFFAOYSA-N 1 0 339.439 3.658 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2C[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170314371 1134745937 /nfs/dbraw/zinc/74/59/37/1134745937.db2.gz VAFJQZVOOYVCIS-JBBXEZCESA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350556 1134760608 /nfs/dbraw/zinc/76/06/08/1134760608.db2.gz BCKOBKZPJAPXAH-KSSFIOAISA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214064 1134818714 /nfs/dbraw/zinc/81/87/14/1134818714.db2.gz MAZLJVQMBFBLOU-MSOLQXFVSA-N 1 0 342.443 3.676 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC1CC[NH+](CC2CCCC2)CC1 ZINC000804389947 1135053365 /nfs/dbraw/zinc/05/33/65/1135053365.db2.gz QPEDHGMYCJJIOZ-UHFFFAOYSA-N 1 0 345.443 3.864 20 5 EHBDRO CCCCC[C@H](C)NC(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000775549925 1135060048 /nfs/dbraw/zinc/06/00/48/1135060048.db2.gz RTIPSDATMOCODV-GJZGRUSLSA-N 1 0 335.448 3.639 20 5 EHBDRO COc1c(F)cc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1[N+](=O)[O-] ZINC001170451384 1135072510 /nfs/dbraw/zinc/07/25/10/1135072510.db2.gz LJBAJLBNDDWUKN-UHFFFAOYSA-N 1 0 339.411 3.806 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000775568706 1135096213 /nfs/dbraw/zinc/09/62/13/1135096213.db2.gz PUHSZCBCSXZTRD-AWEZNQCLSA-N 1 0 328.412 3.981 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H]2CCC(C)(C)C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001193660454 1135168288 /nfs/dbraw/zinc/16/82/88/1135168288.db2.gz DJWGTQLVNJAUCD-ZFWWWQNUSA-N 1 0 336.432 3.787 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)cc1 ZINC000804812737 1135202250 /nfs/dbraw/zinc/20/22/50/1135202250.db2.gz SHZWFUFIHVRMKF-FQEVSTJZSA-N 1 0 337.423 3.697 20 5 EHBDRO CN(c1c(Cl)cc([N+](=O)[O-])cc1Cl)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000804815694 1135202983 /nfs/dbraw/zinc/20/29/83/1135202983.db2.gz YABZUFQDOPZGDU-ZACCUICWSA-N 1 0 344.242 3.963 20 5 EHBDRO C[C@](CO)([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000747529482 1135742468 /nfs/dbraw/zinc/74/24/68/1135742468.db2.gz DNBYUKCMODMRON-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO CCC(CC)[C@@H](C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)N(C)C ZINC001199170654 1135884493 /nfs/dbraw/zinc/88/44/93/1135884493.db2.gz LZCHRVRIPWXFKP-FERCGXDMSA-N 1 0 333.476 3.954 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)cc1Cl ZINC000809758408 1135887825 /nfs/dbraw/zinc/88/78/25/1135887825.db2.gz MFVUIQLNSTXQAX-DZGCQCFKSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)ccc1OC(C)C ZINC000775966001 1135906649 /nfs/dbraw/zinc/90/66/49/1135906649.db2.gz SNNZHICVXWGHRP-UHFFFAOYSA-N 1 0 344.411 3.989 20 5 EHBDRO C[C@@H](CO)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999424 1135912610 /nfs/dbraw/zinc/91/26/10/1135912610.db2.gz HLFBNPMPKMLSDK-JTQLQIEISA-N 1 0 347.242 3.885 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc2[nH]c(=O)oc21)c1cccc([N+](=O)[O-])c1 ZINC001201492834 1136028429 /nfs/dbraw/zinc/02/84/29/1136028429.db2.gz TYSALIKBOBEJAH-CQSZACIVSA-N 1 0 327.340 3.683 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@@H](C2CCOCC2)C1 ZINC001201635036 1136045181 /nfs/dbraw/zinc/04/51/81/1136045181.db2.gz XZUDRUDMSJRXDG-WBVHZDCISA-N 1 0 348.443 3.678 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cc(F)ccc1F ZINC001201692584 1136057260 /nfs/dbraw/zinc/05/72/60/1136057260.db2.gz CPIMTOQVJYLLBG-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001201692464 1136057337 /nfs/dbraw/zinc/05/73/37/1136057337.db2.gz AJVSCKVJEGZGCQ-HOCLYGCPSA-N 1 0 326.824 3.584 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1 ZINC000850444408 1136259805 /nfs/dbraw/zinc/25/98/05/1136259805.db2.gz JFUZKKSGQMVWSO-OAVHHTNSSA-N 1 0 348.374 3.515 20 5 EHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCO1 ZINC000338942166 1136435995 /nfs/dbraw/zinc/43/59/95/1136435995.db2.gz DPXQDGYYEIBTFW-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585018 1136442402 /nfs/dbraw/zinc/44/24/02/1136442402.db2.gz QXZCMFQLLSPSJU-WRWLIDTKSA-N 1 0 340.423 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](Cc3ccccc3)C2)cc1 ZINC000776582426 1136442563 /nfs/dbraw/zinc/44/25/63/1136442563.db2.gz QAGBUAICFGHAOT-XLIONFOSSA-N 1 0 340.423 3.583 20 5 EHBDRO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588185 1136446072 /nfs/dbraw/zinc/44/60/72/1136446072.db2.gz MDZFVILGWLIJNP-UPRAQXHNSA-N 1 0 344.386 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3ccc(F)cc3)CC2)cc1 ZINC000776591949 1136453115 /nfs/dbraw/zinc/45/31/15/1136453115.db2.gz MEJSCVDMXLZVSK-IBGZPJMESA-N 1 0 344.386 3.647 20 5 EHBDRO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592493 1136454372 /nfs/dbraw/zinc/45/43/72/1136454372.db2.gz OXCPKEBBPPXBKE-ZTNFWEORSA-N 1 0 340.423 3.581 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000776606657 1136470400 /nfs/dbraw/zinc/47/04/00/1136470400.db2.gz YVFFMIDYHKVJFT-RTBURBONSA-N 1 0 342.439 3.974 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]([C@H]2CCC[NH2+]C2)C1 ZINC000853016244 1136498863 /nfs/dbraw/zinc/49/88/63/1136498863.db2.gz UURTZDKTQLZAQS-KBPBESRZSA-N 1 0 339.386 3.748 20 5 EHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H](O)c1cccc2ccccc21 ZINC000815009711 1136536841 /nfs/dbraw/zinc/53/68/41/1136536841.db2.gz KRGNQRCPWUFFBK-FQEVSTJZSA-N 1 0 336.391 3.913 20 5 EHBDRO CC(C)[NH+]1CCC(C(=O)Nc2ccc([N+](=O)[O-])c3ccccc23)CC1 ZINC001135041537 1136596324 /nfs/dbraw/zinc/59/63/24/1136596324.db2.gz WDZCVMRTFIISCQ-UHFFFAOYSA-N 1 0 341.411 3.807 20 5 EHBDRO C[C@@H](OC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445443 1136596373 /nfs/dbraw/zinc/59/63/73/1136596373.db2.gz YSCJKCLJXBIIKR-RDTXWAMCSA-N 1 0 346.427 3.996 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815554951 1136609753 /nfs/dbraw/zinc/60/97/53/1136609753.db2.gz MXCOANZENPHHGS-NEPJUHHUSA-N 1 0 345.399 3.606 20 5 EHBDRO Cc1cccc(OCCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815589861 1136615952 /nfs/dbraw/zinc/61/59/52/1136615952.db2.gz FUPNIOXQOYWCAC-AWEZNQCLSA-N 1 0 329.400 3.605 20 5 EHBDRO C[C@H]([NH2+][C@H]1CSCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571058 1136617619 /nfs/dbraw/zinc/61/76/19/1136617619.db2.gz SQWRCTJLNGTEQO-ZBEGNZNMSA-N 1 0 329.425 3.816 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173329479 1136765562 /nfs/dbraw/zinc/76/55/62/1136765562.db2.gz SOGIRAZPOVOVRY-OAHLLOKOSA-N 1 0 340.427 3.831 20 5 EHBDRO CCc1ccc(C(=O)NCC2([NH+](C)C)CCCCCC2)cc1[N+](=O)[O-] ZINC001135793691 1136771404 /nfs/dbraw/zinc/77/14/04/1136771404.db2.gz JAIFNZOSYRSHOW-UHFFFAOYSA-N 1 0 347.459 3.542 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000218479806 1136819242 /nfs/dbraw/zinc/81/92/42/1136819242.db2.gz AKNAZURMVWPHPE-VNHYZAJKSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000339000371 1136825174 /nfs/dbraw/zinc/82/51/74/1136825174.db2.gz LRNAODBBBOLARG-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839897 1136895022 /nfs/dbraw/zinc/89/50/22/1136895022.db2.gz UENAJHQRQGOMMZ-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCCc2cccc(Cl)c2)cc1 ZINC000818984601 1136896656 /nfs/dbraw/zinc/89/66/56/1136896656.db2.gz IZMDBCLTDBPLLB-QGZVFWFLSA-N 1 0 334.803 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000819278116 1136930763 /nfs/dbraw/zinc/93/07/63/1136930763.db2.gz AIIUBQARSOWYNU-QGPMSJSTSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)cc1 ZINC000819333376 1136932448 /nfs/dbraw/zinc/93/24/48/1136932448.db2.gz NBLBOSVXTRODAR-HBUWYVDXSA-N 1 0 346.814 3.817 20 5 EHBDRO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000859213348 1137007808 /nfs/dbraw/zinc/00/78/08/1137007808.db2.gz WCZNAKRYYGHQBO-UHFFFAOYSA-N 1 0 349.381 3.567 20 5 EHBDRO Cc1ccc(-c2noc(C3C[C@H]4CCC[C@@H](C3)C4[NH3+])n2)cc1[N+](=O)[O-] ZINC000822722379 1137071652 /nfs/dbraw/zinc/07/16/52/1137071652.db2.gz DVIMZZFMOSZWJZ-FFMGESDNSA-N 1 0 342.399 3.574 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@](C)(O)c1ccccc1 ZINC000823590559 1137105159 /nfs/dbraw/zinc/10/51/59/1137105159.db2.gz DZJIOROMBNIBRQ-QGZVFWFLSA-N 1 0 334.803 3.588 20 5 EHBDRO CCc1nc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cs1 ZINC000866254120 1137339727 /nfs/dbraw/zinc/33/97/27/1137339727.db2.gz LYALPTDYUBAOJI-LLVKDONJSA-N 1 0 337.420 3.516 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339074434 1137346530 /nfs/dbraw/zinc/34/65/30/1137346530.db2.gz LHMHEYGRKJCKHR-QFBILLFUSA-N 1 0 340.423 3.895 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000866353246 1137348571 /nfs/dbraw/zinc/34/85/71/1137348571.db2.gz FCRGBBLKSQFHPZ-SUMWQHHRSA-N 1 0 336.407 3.604 20 5 EHBDRO COCC(C)(C)CCC[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866355983 1137348971 /nfs/dbraw/zinc/34/89/71/1137348971.db2.gz IDBPKNPABAECDP-ZDUSSCGKSA-N 1 0 326.412 3.707 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866367131 1137349994 /nfs/dbraw/zinc/34/99/94/1137349994.db2.gz GECGNVLQYNOQAE-LBTNJELSSA-N 1 0 338.423 3.706 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000866394347 1137351516 /nfs/dbraw/zinc/35/15/16/1137351516.db2.gz VWMIESWRAOCHIV-ONGXEEELSA-N 1 0 335.206 3.838 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cccc2c1CCOC2 ZINC000866479495 1137358004 /nfs/dbraw/zinc/35/80/04/1137358004.db2.gz UTLCLJAPZUUKPN-ZDUSSCGKSA-N 1 0 344.386 3.527 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CCC1)[C@H]1CCOC1 ZINC000866509832 1137359986 /nfs/dbraw/zinc/35/99/86/1137359986.db2.gz DLAFGQQTKSLIMT-DKSSEZFCSA-N 1 0 332.444 3.711 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@@H]2CCOC2)cc1[N+](=O)[O-] ZINC000866510048 1137360038 /nfs/dbraw/zinc/36/00/38/1137360038.db2.gz IQYOFOHDUPQQBX-CRFBAAHOSA-N 1 0 348.443 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCC13CCOCC3)CCC2 ZINC000866531413 1137361976 /nfs/dbraw/zinc/36/19/76/1137361976.db2.gz QDXRQXZYOCYEJU-MAUKXSAKSA-N 1 0 330.428 3.769 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000866538810 1137362885 /nfs/dbraw/zinc/36/28/85/1137362885.db2.gz WABIINUIDFLFJC-JLSDUUJJSA-N 1 0 332.444 3.568 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121154167 1137369683 /nfs/dbraw/zinc/36/96/83/1137369683.db2.gz KQFUHCNSZZNGOJ-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCO2 ZINC000772979693 1137398321 /nfs/dbraw/zinc/39/83/21/1137398321.db2.gz SPWIXCOERLWSDM-GOSISDBHSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000773048540 1137461968 /nfs/dbraw/zinc/46/19/68/1137461968.db2.gz RKHNTROEEIGFHV-IGNZVWTISA-N 1 0 332.375 3.897 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC34CCC(CC3)C4)CC2)cc1 ZINC000773105544 1137465808 /nfs/dbraw/zinc/46/58/08/1137465808.db2.gz HUGOOQQLJPETHU-UHFFFAOYSA-N 1 0 329.444 3.734 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cnn(-c2ccccc2)c1 ZINC000773116077 1137466105 /nfs/dbraw/zinc/46/61/05/1137466105.db2.gz DDGBOIQKFMWFDS-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3ccccc3OC2)c(Cl)c1 ZINC000509444569 1137467795 /nfs/dbraw/zinc/46/77/95/1137467795.db2.gz RUIYQDBIJOXMDA-AWEZNQCLSA-N 1 0 332.787 3.732 20 5 EHBDRO C[C@H]1CC[C@](CO)([N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100778 1137484670 /nfs/dbraw/zinc/48/46/70/1137484670.db2.gz VCGUXVDPVGHTRM-NHYWBVRUSA-N 1 0 346.349 3.597 20 5 EHBDRO C[C@@H]([NH2+]CCCn1cnc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872018882 1137564866 /nfs/dbraw/zinc/56/48/66/1137564866.db2.gz QMDNJVBPNYAPJQ-CYBMUJFWSA-N 1 0 342.374 3.825 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[S@](=O)C(C)(C)C ZINC000872033206 1137566628 /nfs/dbraw/zinc/56/66/28/1137566628.db2.gz BRRDNAYHDUOSCE-XFNZEKPQSA-N 1 0 344.502 3.515 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1c(C)noc1C ZINC000872035550 1137566813 /nfs/dbraw/zinc/56/68/13/1137566813.db2.gz WXAREGONOJWKLI-SNVBAGLBSA-N 1 0 335.429 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)C[C@@H](C)O ZINC000872050224 1137567955 /nfs/dbraw/zinc/56/79/55/1137567955.db2.gz XMUJDNJEAXBTDP-NEPJUHHUSA-N 1 0 326.462 3.764 20 5 EHBDRO C[C@@H]([NH2+]C1CCC(OC(F)F)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077244 1137570038 /nfs/dbraw/zinc/57/00/38/1137570038.db2.gz DGQLQKKVGAVGIE-KPPDAEKUSA-N 1 0 332.322 3.935 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(C)(C)C(C)(C)O ZINC000872077346 1137570091 /nfs/dbraw/zinc/57/00/91/1137570091.db2.gz GVGWNVDMRJWNHQ-NSHDSACASA-N 1 0 326.462 3.764 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000872128318 1137572996 /nfs/dbraw/zinc/57/29/96/1137572996.db2.gz KNPALFQYKYCGHW-ZQDZILKHSA-N 1 0 334.416 3.613 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129777 1137573071 /nfs/dbraw/zinc/57/30/71/1137573071.db2.gz RXBVVVFJLLTSGN-LSDHHAIUSA-N 1 0 341.411 3.971 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000872132552 1137573257 /nfs/dbraw/zinc/57/32/57/1137573257.db2.gz IPLUKQGJPCMHKG-XLWVJDPXSA-N 1 0 332.375 3.897 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2C[C@H](Sc3ccccc3)C2)c1 ZINC000872224852 1137576058 /nfs/dbraw/zinc/57/60/58/1137576058.db2.gz OMXSRHPGKIXPFN-ZTFGCOKTSA-N 1 0 344.436 3.541 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)cc1[N+](=O)[O-] ZINC000872262103 1137576803 /nfs/dbraw/zinc/57/68/03/1137576803.db2.gz PNIOXVMNJKSEOZ-INIZCTEOSA-N 1 0 334.416 3.527 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000873093960 1137590074 /nfs/dbraw/zinc/59/00/74/1137590074.db2.gz YAYQSCXNCZCEEG-SFHVURJKSA-N 1 0 342.439 3.795 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000873148485 1137591387 /nfs/dbraw/zinc/59/13/87/1137591387.db2.gz CMJCVTJUZQDISZ-UHFFFAOYSA-N 1 0 329.356 3.718 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cc(N)cc(F)c2)cc1[N+](=O)[O-] ZINC000873289807 1137596568 /nfs/dbraw/zinc/59/65/68/1137596568.db2.gz ZAYRJIWPBQTSPE-NSHDSACASA-N 1 0 333.363 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CCCCCCC3)CC2)cn1 ZINC000876886707 1137664508 /nfs/dbraw/zinc/66/45/08/1137664508.db2.gz YGOGWPBQSUPRFX-UHFFFAOYSA-N 1 0 332.448 3.661 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1Cl ZINC000877054918 1137668845 /nfs/dbraw/zinc/66/88/45/1137668845.db2.gz LMVIWKZUKVUTNB-GCVQQVDUSA-N 1 0 338.770 3.638 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCC[C@@H]3c3ccccc3)C2)c1 ZINC000877559303 1137681276 /nfs/dbraw/zinc/68/12/76/1137681276.db2.gz USAXMGAUYQXHCH-BOMAWHNGSA-N 1 0 340.427 3.668 20 5 EHBDRO CC1(C)[C@@H](C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)[C@@H]1c1ccccc1 ZINC000877583496 1137682058 /nfs/dbraw/zinc/68/20/58/1137682058.db2.gz JCXFSCDPCPRFHZ-RLNQZENFSA-N 1 0 340.427 3.524 20 5 EHBDRO CN1Cc2ccccc2[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000877733743 1137687226 /nfs/dbraw/zinc/68/72/26/1137687226.db2.gz YMRRMPQAAYCVJP-QGZVFWFLSA-N 1 0 331.803 3.525 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877797491 1137690283 /nfs/dbraw/zinc/69/02/83/1137690283.db2.gz VOONVPACVOOTNC-CQSZACIVSA-N 1 0 344.411 3.838 20 5 EHBDRO Cc1csc([C@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813824 1137691118 /nfs/dbraw/zinc/69/11/18/1137691118.db2.gz PKNJCVQOEWWUBX-DRDHIDPGSA-N 1 0 329.425 3.862 20 5 EHBDRO COc1cccc([C@@H]2CC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2(C)C)c1 ZINC000880284597 1137773234 /nfs/dbraw/zinc/77/32/34/1137773234.db2.gz AYJWMOSIBCLGBM-HNNXBMFYSA-N 1 0 345.399 3.668 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@](C)(CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000348276774 1137892001 /nfs/dbraw/zinc/89/20/01/1137892001.db2.gz FLIMUCGLCVUBEF-MOPGFXCFSA-N 1 0 328.412 3.586 20 5 EHBDRO CC[C@H]([NH2+]C[C@@](C)(CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000348276775 1137892021 /nfs/dbraw/zinc/89/20/21/1137892021.db2.gz FLIMUCGLCVUBEF-OALUTQOASA-N 1 0 328.412 3.586 20 5 EHBDRO CC[C@@H](C)[N@H+](C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333601 1137912726 /nfs/dbraw/zinc/91/27/26/1137912726.db2.gz KNANKBYVHHSSBI-CYBMUJFWSA-N 1 0 348.472 3.538 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000332095515 1137931454 /nfs/dbraw/zinc/93/14/54/1137931454.db2.gz DRABEGRCYVSHEI-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO CCC(CC)(CCO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000282911841 1137946360 /nfs/dbraw/zinc/94/63/60/1137946360.db2.gz GMKLSIJBVDGVCI-UHFFFAOYSA-N 1 0 349.456 3.749 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000089513288 1138200764 /nfs/dbraw/zinc/20/07/64/1138200764.db2.gz HEJREICNQOFVOL-GFCCVEGCSA-N 1 0 345.355 3.753 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000090666234 1138212741 /nfs/dbraw/zinc/21/27/41/1138212741.db2.gz UYDAIUPMRMVKTE-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO COCCCOc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000090718758 1138213224 /nfs/dbraw/zinc/21/32/24/1138213224.db2.gz BOPOXVFFEOVEEI-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO C[C@@H]([N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000091900255 1138222645 /nfs/dbraw/zinc/22/26/45/1138222645.db2.gz IFXDVSHYRFGGML-CYBMUJFWSA-N 1 0 328.416 3.616 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093337695 1138236246 /nfs/dbraw/zinc/23/62/46/1138236246.db2.gz YRTVZLRVGDYSCL-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000093946224 1138243146 /nfs/dbraw/zinc/24/31/46/1138243146.db2.gz QGBYGHWUJANWAV-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO COCCOc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123181812 1138267034 /nfs/dbraw/zinc/26/70/34/1138267034.db2.gz KCZABWNIMVDGFG-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccccc2[N+](=O)[O-])CC1 ZINC000124066283 1138278887 /nfs/dbraw/zinc/27/88/87/1138278887.db2.gz PZTGVDHJABDBNY-UHFFFAOYSA-N 1 0 334.416 3.585 20 5 EHBDRO CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOCC1 ZINC000131151401 1138498644 /nfs/dbraw/zinc/49/86/44/1138498644.db2.gz QSGGPQOKLGLLOA-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@@H](O)C1CC[NH+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000264735095 1138621292 /nfs/dbraw/zinc/62/12/92/1138621292.db2.gz QHLYZUCTZANMBH-CQSZACIVSA-N 1 0 337.419 3.539 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(F)cc2cccnc21 ZINC000338353737 1138848642 /nfs/dbraw/zinc/84/86/42/1138848642.db2.gz NGERUCJRIXSFLW-UHFFFAOYSA-N 1 0 339.370 3.957 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152569991 1139098136 /nfs/dbraw/zinc/09/81/36/1139098136.db2.gz DLYYNJPGUGGIDL-CJNGLKHVSA-N 1 0 347.415 3.540 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607043 1139143613 /nfs/dbraw/zinc/14/36/13/1139143613.db2.gz YQPOBXYELWYWTR-CVEARBPZSA-N 1 0 349.475 3.765 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316145 1139577004 /nfs/dbraw/zinc/57/70/04/1139577004.db2.gz RSGAYGHEGXUSJG-RHSMWYFYSA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178648870 1139709039 /nfs/dbraw/zinc/70/90/39/1139709039.db2.gz AZAJWVQDCZHFTD-HNNXBMFYSA-N 1 0 325.412 3.914 20 5 EHBDRO C[C@H](O)C[C@@H]1CCC[N@@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102168 1139735169 /nfs/dbraw/zinc/73/51/69/1139735169.db2.gz VGSZZPLDRXVUBH-YOEHRIQHSA-N 1 0 337.419 3.682 20 5 EHBDRO Cc1ccc(C)c(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180404364 1139831628 /nfs/dbraw/zinc/83/16/28/1139831628.db2.gz RUIUVZPDQNPBOE-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189953050 1140374063 /nfs/dbraw/zinc/37/40/63/1140374063.db2.gz YNZHTKOVVKBFOO-OAHLLOKOSA-N 1 0 347.459 3.522 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)nc21 ZINC000267453764 1140792923 /nfs/dbraw/zinc/79/29/23/1140792923.db2.gz SFISIGVRZVJYTA-ZDUSSCGKSA-N 1 0 325.368 3.938 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000267778435 1140832183 /nfs/dbraw/zinc/83/21/83/1140832183.db2.gz MRNBDJGDMBJCLB-XGNXJENSSA-N 1 0 330.388 3.663 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309598 1140918333 /nfs/dbraw/zinc/91/83/33/1140918333.db2.gz XAKOPLIAXABHPX-WBVHZDCISA-N 1 0 330.384 3.584 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776818 1140989074 /nfs/dbraw/zinc/98/90/74/1140989074.db2.gz WBSPZSVYHIVADF-GTNSWQLSSA-N 1 0 336.338 3.566 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000270020765 1141168964 /nfs/dbraw/zinc/16/89/64/1141168964.db2.gz OKTHIYRHTOCWCI-YXJHDRRASA-N 1 0 344.411 3.531 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cnn(C)c1C ZINC000271142854 1141313346 /nfs/dbraw/zinc/31/33/46/1141313346.db2.gz OTXOZOPXXPHJPB-OCCSQVGLSA-N 1 0 348.472 3.858 20 5 EHBDRO CCCCCC(=O)NC1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000271148960 1141314082 /nfs/dbraw/zinc/31/40/82/1141314082.db2.gz DRNOLAPOYZHPIT-UHFFFAOYSA-N 1 0 347.459 3.564 20 5 EHBDRO C[C@H]1C[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258093 1141335263 /nfs/dbraw/zinc/33/52/63/1141335263.db2.gz ACNPFXXMGUQUQT-STQMWFEESA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271525773 1141387885 /nfs/dbraw/zinc/38/78/85/1141387885.db2.gz QELNQHPSGUEEQR-JQFCIGGWSA-N 1 0 340.427 3.696 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CCO2 ZINC000274248416 1141489982 /nfs/dbraw/zinc/48/99/82/1141489982.db2.gz JFBNDHPBQCUNET-INIZCTEOSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137756 1141507098 /nfs/dbraw/zinc/50/70/98/1141507098.db2.gz GBVYMPDFSRTHBX-YPMHNXCESA-N 1 0 346.349 3.739 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348527562 1141546124 /nfs/dbraw/zinc/54/61/24/1141546124.db2.gz TWHSHQNAUOMCAU-SFHVURJKSA-N 1 0 339.395 3.679 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348541160 1141548598 /nfs/dbraw/zinc/54/85/98/1141548598.db2.gz QQLHZEYAMTZNLR-GOSISDBHSA-N 1 0 339.395 3.679 20 5 EHBDRO COCC(C)(C)[N@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000430149636 1014437253 /nfs/dbraw/zinc/43/72/53/1014437253.db2.gz NQBBLWFYXIDRDQ-UHFFFAOYSA-N 1 0 348.399 3.720 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C[C@@H]1CCCO1)C1CCCC1 ZINC000430215916 1015044507 /nfs/dbraw/zinc/04/45/07/1015044507.db2.gz DHZSZBAXZHFAAR-KRWDZBQOSA-N 1 0 334.416 3.527 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000126978635 1015149692 /nfs/dbraw/zinc/14/96/92/1015149692.db2.gz AUBWIOVPOSKLJU-UHFFFAOYSA-N 1 0 340.379 3.531 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccccc2OC1 ZINC000511021226 1016018680 /nfs/dbraw/zinc/01/86/80/1016018680.db2.gz ZDYNKNUJWPPMKH-YJBOKZPZSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CCCC[C@@H]2C1 ZINC000177575772 1016387041 /nfs/dbraw/zinc/38/70/41/1016387041.db2.gz HONQGCBRCMILFQ-AEGPPILISA-N 1 0 342.399 3.828 20 5 EHBDRO CCC[C@@](C)([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430387348 1016604804 /nfs/dbraw/zinc/60/48/04/1016604804.db2.gz UVMREVOWDPUAPY-GOSISDBHSA-N 1 0 343.383 3.843 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)c1ccc(F)cc1 ZINC000414526129 1016953905 /nfs/dbraw/zinc/95/39/05/1016953905.db2.gz KOHRHRNZCQJVBF-DZXKJOIRSA-N 1 0 344.386 3.503 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)c1cccnc1 ZINC000414554367 1016972022 /nfs/dbraw/zinc/97/20/22/1016972022.db2.gz GZGALAKNIOGOJA-GDNBJRDFSA-N 1 0 325.412 3.961 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3[NH2+]CC[C@H]4CCCC[C@@H]43)n2)s1 ZINC000904689495 1032184021 /nfs/dbraw/zinc/18/40/21/1032184021.db2.gz KGNKJMSUAAVPIG-GBIKHYSHSA-N 1 0 334.401 3.547 20 5 EHBDRO C[NH+](C)CCc1ccc(Nc2ccc3ncccc3c2[N+](=O)[O-])cc1 ZINC000485048190 1032275976 /nfs/dbraw/zinc/27/59/76/1032275976.db2.gz HVHHQFQXKMJRKX-UHFFFAOYSA-N 1 0 336.395 3.991 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC2(CCOCC2)CC1 ZINC000449191950 1032287722 /nfs/dbraw/zinc/28/77/22/1032287722.db2.gz XPPONXVQDMSRQT-HNNXBMFYSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000449202802 1032329077 /nfs/dbraw/zinc/32/90/77/1032329077.db2.gz GRBCIRBDSKUREC-QWJLCTJOSA-N 1 0 346.452 3.614 20 5 EHBDRO Cc1ccc2c(c1)nc(C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])n2C ZINC000449247101 1032384103 /nfs/dbraw/zinc/38/41/03/1032384103.db2.gz FDNJBGYMOUDFOY-CQSZACIVSA-N 1 0 338.411 3.511 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000449269764 1032390246 /nfs/dbraw/zinc/39/02/46/1032390246.db2.gz OIODZXCGHNSEFK-BLLLJJGKSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1cc2c(c(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)c1)O[C@H](C)C2 ZINC000449348286 1032464614 /nfs/dbraw/zinc/46/46/14/1032464614.db2.gz LIHFUPDOFJVSDE-OLZOCXBDSA-N 1 0 342.395 3.778 20 5 EHBDRO CCC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000459802959 1032482415 /nfs/dbraw/zinc/48/24/15/1032482415.db2.gz NGVCWMGEBLKUKR-QGZVFWFLSA-N 1 0 333.432 3.790 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCCCC1 ZINC000759732821 1032561727 /nfs/dbraw/zinc/56/17/27/1032561727.db2.gz JYEIVUKIRHHCQS-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000597664909 1032597978 /nfs/dbraw/zinc/59/79/78/1032597978.db2.gz AIBVAXOYSOLDKD-OAHLLOKOSA-N 1 0 345.443 3.805 20 5 EHBDRO CO[C@](C)(C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449483166 1032635439 /nfs/dbraw/zinc/63/54/39/1032635439.db2.gz GVEIBNBAKOXNGG-DNVCBOLYSA-N 1 0 328.412 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cccc4c[nH]nc43)C2)cc1 ZINC000449495749 1032662813 /nfs/dbraw/zinc/66/28/13/1032662813.db2.gz DXYNWIPEKQZGQT-MRXNPFEDSA-N 1 0 336.395 3.851 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@@H]3CCC[NH2+]C3)o2)c(Cl)c1 ZINC000414828374 1017229869 /nfs/dbraw/zinc/22/98/69/1017229869.db2.gz MESHZMXOINGJFD-GFCCVEGCSA-N 1 0 349.818 3.597 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000579934968 1017321612 /nfs/dbraw/zinc/32/16/12/1017321612.db2.gz MKYQYPUAHVDZAE-LJQANCHMSA-N 1 0 342.443 3.985 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000449507233 1032691109 /nfs/dbraw/zinc/69/11/09/1032691109.db2.gz STLDSXKLSMUSKY-CXAGYDPISA-N 1 0 330.384 3.712 20 5 EHBDRO C[C@@H](NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1)[C@H](C)[NH3+] ZINC000415013054 1017409182 /nfs/dbraw/zinc/40/91/82/1017409182.db2.gz JYXHIEIEDDZFGA-NWDGAFQWSA-N 1 0 349.818 3.866 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000290297485 1017889088 /nfs/dbraw/zinc/88/90/88/1017889088.db2.gz NICKZGQAEJBJRQ-NJSLBKSFSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](Cc1csc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000118846844 1017965948 /nfs/dbraw/zinc/96/59/48/1017965948.db2.gz SAFLQSGDAWYJIE-MRXNPFEDSA-N 1 0 334.441 3.675 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1COc2ccccc21)C1CC1 ZINC000290318014 1018158065 /nfs/dbraw/zinc/15/80/65/1018158065.db2.gz OCUSVULIGUWJPJ-WMZOPIPTSA-N 1 0 338.407 3.682 20 5 EHBDRO COc1ccc(OC)c(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468628322 1018524145 /nfs/dbraw/zinc/52/41/45/1018524145.db2.gz AWRYKXOPCPEMOE-ZROIWOOFSA-N 1 0 342.395 3.805 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371725 1018549213 /nfs/dbraw/zinc/54/92/13/1018549213.db2.gz KNYDTKVMPGRTCO-DOTOQJQBSA-N 1 0 338.473 3.970 20 5 EHBDRO O=S1(=O)CC[C@@H](C[NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000044862830 1018561794 /nfs/dbraw/zinc/56/17/94/1018561794.db2.gz DMDONXHSPCDIEF-HNNXBMFYSA-N 1 0 339.460 3.517 20 5 EHBDRO COc1ccc(CN(C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000610389645 1018706152 /nfs/dbraw/zinc/70/61/52/1018706152.db2.gz UUOLEEYDQHBSAM-CYBMUJFWSA-N 1 0 330.384 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](CCO)c1ccccc1F)CCC2 ZINC000592403942 1032799437 /nfs/dbraw/zinc/79/94/37/1032799437.db2.gz ROCHLRDRTBCCEY-RTBURBONSA-N 1 0 344.386 3.825 20 5 EHBDRO CC[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000610420480 1019022632 /nfs/dbraw/zinc/02/26/32/1019022632.db2.gz VCLSYLOLPCMMRS-DZGCQCFKSA-N 1 0 343.431 3.715 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000015128886 1019045584 /nfs/dbraw/zinc/04/55/84/1019045584.db2.gz QWHFAWMHWISTDZ-OAHLLOKOSA-N 1 0 333.819 3.833 20 5 EHBDRO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449562767 1032811565 /nfs/dbraw/zinc/81/15/65/1032811565.db2.gz NXKZAYSKBLCKSC-YQQAZPJKSA-N 1 0 342.443 3.873 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109782 1019361397 /nfs/dbraw/zinc/36/13/97/1019361397.db2.gz BJBSHLLBVDYCGK-PBHICJAKSA-N 1 0 331.416 3.922 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]3CC[NH2+][C@H]3C2)s1 ZINC000592432848 1032838447 /nfs/dbraw/zinc/83/84/47/1032838447.db2.gz YTLGLAWOHORDRX-CJNGLKHVSA-N 1 0 343.452 3.507 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000119225640 1019719038 /nfs/dbraw/zinc/71/90/38/1019719038.db2.gz UHBSGQKSPGHLDT-GYSYKLTISA-N 1 0 339.823 3.601 20 5 EHBDRO COc1cc(C[NH+](C(C)C)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182785148 1019744658 /nfs/dbraw/zinc/74/46/58/1019744658.db2.gz MXGNERASYVMOGX-UHFFFAOYSA-N 1 0 346.374 3.866 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H](C(C)C)CC1 ZINC001167425621 1019768555 /nfs/dbraw/zinc/76/85/55/1019768555.db2.gz RVBQUUDJKAERGT-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000120682826 1019945551 /nfs/dbraw/zinc/94/55/51/1019945551.db2.gz UHRNRKOKDMHKKV-KZULUSFZSA-N 1 0 330.432 3.617 20 5 EHBDRO CC(=O)c1cc(NCC2CC[NH+](CCC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000561236629 1020227986 /nfs/dbraw/zinc/22/79/86/1020227986.db2.gz WDSGRQRJVMSCLP-UHFFFAOYSA-N 1 0 347.459 3.967 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000602476366 1032897948 /nfs/dbraw/zinc/89/79/48/1032897948.db2.gz OLGYSPIGJQYKQT-RISCZKNCSA-N 1 0 345.365 3.528 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cnn(C(C)C)c2C)cc1[N+](=O)[O-] ZINC000276089594 1020599797 /nfs/dbraw/zinc/59/97/97/1020599797.db2.gz ANODQHUQYFZNNJ-GFCCVEGCSA-N 1 0 332.404 3.540 20 5 EHBDRO Cc1csc(C[C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000933127123 1020631603 /nfs/dbraw/zinc/63/16/03/1020631603.db2.gz WDUPGOLZQIRAGZ-GFCCVEGCSA-N 1 0 335.404 3.563 20 5 EHBDRO CCC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000548160616 1020764630 /nfs/dbraw/zinc/76/46/30/1020764630.db2.gz BMDGXWHHBJPVNF-GDBMZVCRSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403172 1020767660 /nfs/dbraw/zinc/76/76/60/1020767660.db2.gz UDIOURXSBPUGRQ-KSSFIOAISA-N 1 0 336.395 3.953 20 5 EHBDRO O=C(CC[NH+]1CCC(C2CCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000610393455 1020853212 /nfs/dbraw/zinc/85/32/12/1020853212.db2.gz NXGKZMRFZXTNKS-UHFFFAOYSA-N 1 0 345.443 3.826 20 5 EHBDRO COc1cccc(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])c1 ZINC000602513118 1032950863 /nfs/dbraw/zinc/95/08/63/1032950863.db2.gz ZQWXGZTWDTYGQJ-UHFFFAOYSA-N 1 0 340.301 3.912 20 5 EHBDRO C[C@H](O)CC(C)(C)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602549291 1032959038 /nfs/dbraw/zinc/95/90/38/1032959038.db2.gz AGTBVGRAMIIVPT-JTQLQIEISA-N 1 0 334.338 3.500 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(C(=O)CC(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178083220 1021194867 /nfs/dbraw/zinc/19/48/67/1021194867.db2.gz PXXXYJHGZIECHJ-GOSISDBHSA-N 1 0 347.459 3.673 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C(C)(C)O ZINC000550294933 1021478773 /nfs/dbraw/zinc/47/87/73/1021478773.db2.gz GSNBXDNUAFAJSX-INIZCTEOSA-N 1 0 334.441 3.962 20 5 EHBDRO CC[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602550983 1032986458 /nfs/dbraw/zinc/98/64/58/1032986458.db2.gz GMZAWBPYODDWMK-ZBFHGGJFSA-N 1 0 332.448 3.517 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccccc2OC)C1 ZINC000157922696 1021717986 /nfs/dbraw/zinc/71/79/86/1021717986.db2.gz UNBPSGMSOBISAB-AWEZNQCLSA-N 1 0 342.395 3.602 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000581778701 1021774377 /nfs/dbraw/zinc/77/43/77/1021774377.db2.gz OIIPHZWXRPJCOM-NSHDSACASA-N 1 0 337.326 3.750 20 5 EHBDRO CC(C)(C)C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000341454119 1021937300 /nfs/dbraw/zinc/93/73/00/1021937300.db2.gz JITAXBIFDWHLIR-MRXNPFEDSA-N 1 0 334.395 3.698 20 5 EHBDRO CC(C)[N@H+](CCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506768239 1021969031 /nfs/dbraw/zinc/96/90/31/1021969031.db2.gz STSRTJVGQUMMHA-UHFFFAOYSA-N 1 0 348.374 3.729 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCC[C@@H]3CCOC3)o2)c1 ZINC000449678284 1033026306 /nfs/dbraw/zinc/02/63/06/1033026306.db2.gz AGKBTDDUFFIMLB-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000441223907 1022076913 /nfs/dbraw/zinc/07/69/13/1022076913.db2.gz ZBUSOUCQMSXNOL-MRXNPFEDSA-N 1 0 334.416 3.637 20 5 EHBDRO CC(C)[N@H+](Cc1cnn(C2CCC2)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891625273 1022144953 /nfs/dbraw/zinc/14/49/53/1022144953.db2.gz NTADCYPGNCSDCS-UHFFFAOYSA-N 1 0 328.416 3.927 20 5 EHBDRO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140912 1022177271 /nfs/dbraw/zinc/17/72/71/1022177271.db2.gz LMSANYKSWDPYEN-VURMDHGXSA-N 1 0 330.359 3.758 20 5 EHBDRO CCC1([NH+](C)C)CCN(c2c3cc(F)ccc3ncc2[N+](=O)[O-])CC1 ZINC000894929295 1022262098 /nfs/dbraw/zinc/26/20/98/1022262098.db2.gz ICELLVQIJQOKPA-UHFFFAOYSA-N 1 0 346.406 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CC[C@@H](COc2ccccc2)C1 ZINC000780374021 1022415037 /nfs/dbraw/zinc/41/50/37/1022415037.db2.gz MHASYYGBWWBKKZ-CQSZACIVSA-N 1 0 330.359 3.635 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000602656829 1033056685 /nfs/dbraw/zinc/05/66/85/1033056685.db2.gz YNZXFUBVIRLZCU-ZFWWWQNUSA-N 1 0 344.333 3.757 20 5 EHBDRO Cc1cc(NC[C@H]2CCC[C@@H](CO)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326488645 1022581901 /nfs/dbraw/zinc/58/19/01/1022581901.db2.gz FMJWYPZSBLWFGF-UONOGXRCSA-N 1 0 329.400 3.662 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCC[C@@H]3C[C@@H]32)cc1Br ZINC000602686284 1033067341 /nfs/dbraw/zinc/06/73/41/1033067341.db2.gz BDDPIOWNPPBWPO-HDBBIHSSSA-N 1 0 331.235 3.697 20 5 EHBDRO Cc1ccccc1[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](C)CO1 ZINC000441440473 1022802833 /nfs/dbraw/zinc/80/28/33/1022802833.db2.gz QFFDFVFOIBGWQN-OXJNMPFZSA-N 1 0 340.423 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](CCO)[C@@H]2CCCc3ccccc32)cc1 ZINC000510653279 1022831356 /nfs/dbraw/zinc/83/13/56/1022831356.db2.gz YTVOHVJBMLPYAX-HXUWFJFHSA-N 1 0 340.423 3.509 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CC[C@H]3C[C@H]3C2)cc1Br ZINC000602701980 1033090024 /nfs/dbraw/zinc/09/00/24/1033090024.db2.gz GPDUZICKZPEMNF-XHNCKOQMSA-N 1 0 331.235 3.697 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CC[NH+](CC2CCCCC2)CC1 ZINC000506338096 1022951142 /nfs/dbraw/zinc/95/11/42/1022951142.db2.gz AJZFCAJQJDPLOL-POHAHGRESA-N 1 0 343.471 3.806 20 5 EHBDRO C[C@H](C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)CC(F)F ZINC000602700895 1033089445 /nfs/dbraw/zinc/08/94/45/1033089445.db2.gz OXUKBENUKJSELW-LURJTMIESA-N 1 0 343.193 3.800 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(CC(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000178366447 1023052678 /nfs/dbraw/zinc/05/26/78/1023052678.db2.gz KNENRMMANNDLNB-GFCCVEGCSA-N 1 0 345.365 3.581 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310199588 1023065853 /nfs/dbraw/zinc/06/58/53/1023065853.db2.gz BPHVEZMWXKODKW-HNNXBMFYSA-N 1 0 346.456 3.766 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000129482430 1023092573 /nfs/dbraw/zinc/09/25/73/1023092573.db2.gz CBFLGOYXQLMUOY-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO Cc1nn(C[N@@H+]2CCCC[C@@H]2Cc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC000729471722 1023118879 /nfs/dbraw/zinc/11/88/79/1023118879.db2.gz GCOSQKRKWUVCIQ-QGZVFWFLSA-N 1 0 346.406 3.602 20 5 EHBDRO CC(C)C[C@@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C ZINC000518270150 1023179769 /nfs/dbraw/zinc/17/97/69/1023179769.db2.gz XDYWENXAEHWAAN-KRWDZBQOSA-N 1 0 345.443 3.921 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H](O)C2CCC2)s1 ZINC000449738814 1033138440 /nfs/dbraw/zinc/13/84/40/1033138440.db2.gz FWSRKCLJCUKZGL-MRXNPFEDSA-N 1 0 332.425 3.574 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610809517 1023694729 /nfs/dbraw/zinc/69/47/29/1023694729.db2.gz FBMTZXALPVATNE-AWEZNQCLSA-N 1 0 329.400 3.774 20 5 EHBDRO C[C@H]1CC2(CC([NH2+]Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CO1 ZINC000897776527 1033162355 /nfs/dbraw/zinc/16/23/55/1033162355.db2.gz SBLKVCYWIXMNPM-KKJMOOEGSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@H]1CC2(CC([NH2+]Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)CO1 ZINC000897781159 1033173765 /nfs/dbraw/zinc/17/37/65/1033173765.db2.gz RDVLHKFZIJJJMK-XIWWETDGSA-N 1 0 342.395 3.902 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@H]1CC(C)(C)C ZINC000060889731 1033174675 /nfs/dbraw/zinc/17/46/75/1033174675.db2.gz AKCUIXDACWJACH-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCc1nc2c(s1)CCC2 ZINC000896841432 1023983840 /nfs/dbraw/zinc/98/38/40/1023983840.db2.gz KJOZTIZNTVMXIA-UHFFFAOYSA-N 1 0 337.832 3.526 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCC[C@H](C)C1 ZINC000449769108 1033184869 /nfs/dbraw/zinc/18/48/69/1033184869.db2.gz UKYAOSKGIQBICY-IHRRRGAJSA-N 1 0 334.416 3.766 20 5 EHBDRO Cn1cc(C[N@@H+]2CCCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000121126065 1024242573 /nfs/dbraw/zinc/24/25/73/1024242573.db2.gz QHMSBTWCIOINPD-UHFFFAOYSA-N 1 0 328.416 3.617 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C1CC1)C1CCC(C)CC1 ZINC000434664232 1024276953 /nfs/dbraw/zinc/27/69/53/1024276953.db2.gz TZTCKUNYMYFGQO-UHFFFAOYSA-N 1 0 345.443 3.885 20 5 EHBDRO CCC(C)(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000441641877 1024278786 /nfs/dbraw/zinc/27/87/86/1024278786.db2.gz FJEVRPNSCBBTTO-INIZCTEOSA-N 1 0 333.432 3.742 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](C1CCCCC1)[NH+](C)C ZINC000474161929 1024470135 /nfs/dbraw/zinc/47/01/35/1024470135.db2.gz XFSZCUAEZBXGML-GOSISDBHSA-N 1 0 335.448 3.664 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957240 1024525439 /nfs/dbraw/zinc/52/54/39/1024525439.db2.gz ZMKBBUVSXQAOEL-WFASDCNBSA-N 1 0 346.818 3.891 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(n2ccc(C)n2)CC1 ZINC000435048153 1024578078 /nfs/dbraw/zinc/57/80/78/1024578078.db2.gz GUTRYBZHJWMWLJ-QINSGFPZSA-N 1 0 340.427 3.840 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000435055008 1024584560 /nfs/dbraw/zinc/58/45/60/1024584560.db2.gz GKGPVGSPMFWEJU-FERCGXDMSA-N 1 0 339.395 3.546 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOc1ccc(Cl)cn1 ZINC000539061485 1024717334 /nfs/dbraw/zinc/71/73/34/1024717334.db2.gz MVFGYCWSXLNJCM-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000342291902 1024749874 /nfs/dbraw/zinc/74/98/74/1024749874.db2.gz JGTRVXZCUXFPLL-MRXNPFEDSA-N 1 0 347.802 3.928 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCc3ccc(C)cc32)c([N+](=O)[O-])cc1O ZINC000342292450 1024750653 /nfs/dbraw/zinc/75/06/53/1024750653.db2.gz OFKWFOOLIILQQV-MRXNPFEDSA-N 1 0 342.395 3.785 20 5 EHBDRO C[NH2+]C[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372023 1024856584 /nfs/dbraw/zinc/85/65/84/1024856584.db2.gz QEOLQUWUJLBKJC-AWEZNQCLSA-N 1 0 345.468 3.755 20 5 EHBDRO C[NH+](C)CC[C@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1 ZINC000895890108 1024945285 /nfs/dbraw/zinc/94/52/85/1024945285.db2.gz DAJOGDGEQJXCAK-AWEZNQCLSA-N 1 0 334.807 3.748 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(c3ccc(F)cn3)CC2)cc1 ZINC000602904181 1033253967 /nfs/dbraw/zinc/25/39/67/1033253967.db2.gz NEFOHJBSRATMMO-UHFFFAOYSA-N 1 0 329.375 3.551 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C[S@@](C)=O)c1ccccc1 ZINC000248617730 1025039733 /nfs/dbraw/zinc/03/97/33/1025039733.db2.gz ZLAKVNTXIXQVGM-MYXDTRPFSA-N 1 0 346.452 3.674 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](COC(F)F)C2)cc1[N+](=O)[O-] ZINC000582030517 1025057938 /nfs/dbraw/zinc/05/79/38/1025057938.db2.gz VBEKYWITMFJQMT-ZDUSSCGKSA-N 1 0 328.359 3.779 20 5 EHBDRO CC[C@H]([NH2+][C@H](CCOC)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000346810070 1025133338 /nfs/dbraw/zinc/13/33/38/1025133338.db2.gz QOTOFKVAIZUWIM-QAPCUYQASA-N 1 0 332.400 3.876 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1 ZINC000053232648 1025193265 /nfs/dbraw/zinc/19/32/65/1025193265.db2.gz KYNJOTKUFOIWAG-LJQANCHMSA-N 1 0 326.396 3.776 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])nc2)CC1 ZINC000582086275 1025224378 /nfs/dbraw/zinc/22/43/78/1025224378.db2.gz PXQWLCWDDZVJBA-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO [NH2+]=c1ccc2nc3c(cc(NC(=O)[C@H]4C[C@@H]4F)c4ccccc43)oc-2c1 ZINC001143438753 1025408355 /nfs/dbraw/zinc/40/83/55/1025408355.db2.gz RKPPXIDWIYHSPM-KBPBESRZSA-N 1 0 347.349 3.862 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896510119 1025491060 /nfs/dbraw/zinc/49/10/60/1025491060.db2.gz LCOLIIUWMBLGGM-GIYNXVAASA-N 1 0 328.349 3.968 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](Cc3nccs3)C2)ccc1[N+](=O)[O-] ZINC000934333231 1025494892 /nfs/dbraw/zinc/49/48/92/1025494892.db2.gz OIFQTJGVNQHCSH-AWEZNQCLSA-N 1 0 347.440 3.515 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccn(C)n2)CC1 ZINC000896495175 1025499611 /nfs/dbraw/zinc/49/96/11/1025499611.db2.gz IKVAQTMRKBOHFU-QINSGFPZSA-N 1 0 340.427 3.611 20 5 EHBDRO C[C@H](C(=O)Nc1ccc(C[NH+](C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000563273445 1025504156 /nfs/dbraw/zinc/50/41/56/1025504156.db2.gz PIWDZMQQEFFBNS-LBPRGKRZSA-N 1 0 345.374 3.538 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000358007796 1025659853 /nfs/dbraw/zinc/65/98/53/1025659853.db2.gz RTUKXKZOTBSOII-GOSISDBHSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000120007332 1025670742 /nfs/dbraw/zinc/67/07/42/1025670742.db2.gz ONKCJGGXBIPKMK-TZMCWYRMSA-N 1 0 346.818 3.573 20 5 EHBDRO CCN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000439694268 1025705418 /nfs/dbraw/zinc/70/54/18/1025705418.db2.gz VMTBQKJDWMPMFZ-SFHVURJKSA-N 1 0 339.439 3.943 20 5 EHBDRO C[N@H+](CCCCOc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511098000 1025761761 /nfs/dbraw/zinc/76/17/61/1025761761.db2.gz YWYQVTNSCDCKHA-UHFFFAOYSA-N 1 0 328.412 3.928 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](c3cc[nH]n3)C2)cc1[N+](=O)[O-] ZINC000121234754 1025936829 /nfs/dbraw/zinc/93/68/29/1025936829.db2.gz SRWZPNABAVQJCL-OAHLLOKOSA-N 1 0 328.416 3.821 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441488995 1026001728 /nfs/dbraw/zinc/00/17/28/1026001728.db2.gz INDGGQUCWCADKQ-KBPBESRZSA-N 1 0 336.432 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000523005622 1026276711 /nfs/dbraw/zinc/27/67/11/1026276711.db2.gz DNRGMWFHSYSYMC-INIZCTEOSA-N 1 0 344.386 3.677 20 5 EHBDRO CC(C)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCCC1 ZINC000479852696 1026856850 /nfs/dbraw/zinc/85/68/50/1026856850.db2.gz NTYGRRPIIFADKI-GOSISDBHSA-N 1 0 345.487 3.770 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000479918073 1026884797 /nfs/dbraw/zinc/88/47/97/1026884797.db2.gz BZJFNHGQTLEDHP-LJQANCHMSA-N 1 0 340.423 3.853 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430329 1026902807 /nfs/dbraw/zinc/90/28/07/1026902807.db2.gz WIDHFSHWPBAXQF-IRXDYDNUSA-N 1 0 349.475 3.594 20 5 EHBDRO Cc1nccn1CCCC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000125638206 1027103731 /nfs/dbraw/zinc/10/37/31/1027103731.db2.gz NNGRHKGISXPQDC-UHFFFAOYSA-N 1 0 328.416 3.545 20 5 EHBDRO C[C@H](CC(=O)Nc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183808554 1027111919 /nfs/dbraw/zinc/11/19/19/1027111919.db2.gz WQVWOAYOXDANLM-GFCCVEGCSA-N 1 0 347.802 3.755 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000531696892 1027216854 /nfs/dbraw/zinc/21/68/54/1027216854.db2.gz JLYDSVZCHPDLGE-GDBMZVCRSA-N 1 0 346.402 3.544 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CC[C@H](CO)CC2)c2ccccc2)c1 ZINC000453139201 1027447753 /nfs/dbraw/zinc/44/77/53/1027447753.db2.gz MKXATHSMUHLFEJ-QSFXBCCZSA-N 1 0 340.423 3.825 20 5 EHBDRO C[C@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000178660379 1027608449 /nfs/dbraw/zinc/60/84/49/1027608449.db2.gz HGHNYAOGHXQATO-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2cc(OC)c([N+](=O)[O-])cc2F)c1 ZINC000091457229 1027889439 /nfs/dbraw/zinc/88/94/39/1027889439.db2.gz VJRCZWHJAZXHJE-UHFFFAOYSA-N 1 0 347.390 3.806 20 5 EHBDRO Cc1ccc(NC(=O)C(C)(C)[C@@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000422901805 1028036705 /nfs/dbraw/zinc/03/67/05/1028036705.db2.gz CKDGTFRMVBYGFC-INIZCTEOSA-N 1 0 327.384 3.568 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444622250 1028095843 /nfs/dbraw/zinc/09/58/43/1028095843.db2.gz UXHATJRYQDJCGQ-UHFFFAOYSA-N 1 0 330.413 3.597 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648641 1028111993 /nfs/dbraw/zinc/11/19/93/1028111993.db2.gz HKHOHHZCBJCWGN-UKRRQHHQSA-N 1 0 336.395 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CCC[C@@H]3c3ccccc3)nc2c1 ZINC000444684580 1028156086 /nfs/dbraw/zinc/15/60/86/1028156086.db2.gz NDPWTPLOQVIPRX-CVEARBPZSA-N 1 0 336.395 3.897 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774637 1028262074 /nfs/dbraw/zinc/26/20/74/1028262074.db2.gz XIPOTSPPRPLUJG-HUUCEWRRSA-N 1 0 333.432 3.598 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1NCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437952 1028446014 /nfs/dbraw/zinc/44/60/14/1028446014.db2.gz URCVDPDIFXEXQY-OALUTQOASA-N 1 0 325.412 3.523 20 5 EHBDRO CCc1ccc([C@@H](NCCC[NH2+]C2CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423551675 1028513838 /nfs/dbraw/zinc/51/38/38/1028513838.db2.gz JJHMXTMFANUBTQ-IBGZPJMESA-N 1 0 343.427 3.571 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000504495213 1028675564 /nfs/dbraw/zinc/67/55/64/1028675564.db2.gz YUQFKJDEMIGUBM-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000421752132 1028752321 /nfs/dbraw/zinc/75/23/21/1028752321.db2.gz QCHPECXNPZBCAC-INIZCTEOSA-N 1 0 347.459 3.596 20 5 EHBDRO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508529782 1028792052 /nfs/dbraw/zinc/79/20/52/1028792052.db2.gz TZQFSOFKJNXXLD-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3cccnc3CC2)cc1[N+](=O)[O-] ZINC000421832674 1028824840 /nfs/dbraw/zinc/82/48/40/1028824840.db2.gz GRJDGCMMPFMPJI-PBHICJAKSA-N 1 0 325.412 3.896 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNc1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC000502903860 1028831878 /nfs/dbraw/zinc/83/18/78/1028831878.db2.gz TWJLSMGOTFYMHD-MRXNPFEDSA-N 1 0 333.432 3.864 20 5 EHBDRO Cc1cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc(C)n1 ZINC000421891093 1028897734 /nfs/dbraw/zinc/89/77/34/1028897734.db2.gz VUXIMMYMCVSYFK-GOSISDBHSA-N 1 0 325.412 3.718 20 5 EHBDRO C/C(=C/c1nc(C2([NH3+])CCCCC2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000424340375 1029016817 /nfs/dbraw/zinc/01/68/17/1029016817.db2.gz GQEHSUYZIGTGLE-QXMHVHEDSA-N 1 0 328.372 3.656 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000504899139 1029027224 /nfs/dbraw/zinc/02/72/24/1029027224.db2.gz BFDDQOUVEYHAOL-OAHLLOKOSA-N 1 0 335.448 3.520 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](OC)C(C)C ZINC000504912270 1029056586 /nfs/dbraw/zinc/05/65/86/1029056586.db2.gz SZCYTJGCKTZDLF-UKRRQHHQSA-N 1 0 326.462 3.726 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445850967 1029186068 /nfs/dbraw/zinc/18/60/68/1029186068.db2.gz XQDMPDSNEJVYQN-OAHLLOKOSA-N 1 0 345.443 3.886 20 5 EHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513819864 1029521656 /nfs/dbraw/zinc/52/16/56/1029521656.db2.gz FQBZTOVTQMRKOZ-LKCYJCQHSA-N 1 0 332.444 3.853 20 5 EHBDRO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000524894991 1029588271 /nfs/dbraw/zinc/58/82/71/1029588271.db2.gz ZHDFBNKVZALTKC-CGTJXYLNSA-N 1 0 332.444 3.929 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3(CCO)CCCC3)o2)c1 ZINC000525290010 1029781977 /nfs/dbraw/zinc/78/19/77/1029781977.db2.gz BNHXRFNPYCDOBP-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000324436002 1029831000 /nfs/dbraw/zinc/83/10/00/1029831000.db2.gz DEFTVDHTTPWSHJ-SJKOYZFVSA-N 1 0 328.368 3.778 20 5 EHBDRO CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000446922666 1029854830 /nfs/dbraw/zinc/85/48/30/1029854830.db2.gz NIEWFPZHVATVPO-SFHVURJKSA-N 1 0 328.412 3.926 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000385119473 1029859921 /nfs/dbraw/zinc/85/99/21/1029859921.db2.gz CKCBDJQYNWBZLV-LPHOPBHVSA-N 1 0 339.439 3.828 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@@H](C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453238810 1029967765 /nfs/dbraw/zinc/96/77/65/1029967765.db2.gz SWDPPRQJDSXFRK-AUUYWEPGSA-N 1 0 346.427 3.838 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453253345 1029982913 /nfs/dbraw/zinc/98/29/13/1029982913.db2.gz HZAQQAWQDJWRGB-RYUDHWBXSA-N 1 0 334.338 3.911 20 5 EHBDRO CC(C)C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)CC(C)(C)C ZINC000531888824 1029984066 /nfs/dbraw/zinc/98/40/66/1029984066.db2.gz ZVEZMCNBCKWSJV-UHFFFAOYSA-N 1 0 336.432 3.965 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192902765 1030012019 /nfs/dbraw/zinc/01/20/19/1030012019.db2.gz ZRMNDWGNGOGSDT-CWTRNNRKSA-N 1 0 342.443 3.543 20 5 EHBDRO Cc1cc(-c2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299253 1030049721 /nfs/dbraw/zinc/04/97/21/1030049721.db2.gz WZUKBQZBRLIXAJ-FRRDWIJNSA-N 1 0 330.388 3.887 20 5 EHBDRO CCC1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)COC1 ZINC000453365933 1030179586 /nfs/dbraw/zinc/17/95/86/1030179586.db2.gz LWQHXGCJURDHGL-GOSISDBHSA-N 1 0 326.396 3.700 20 5 EHBDRO CC(C)C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C1CC1 ZINC000159424449 1030195303 /nfs/dbraw/zinc/19/53/03/1030195303.db2.gz AYPNIHDCKSCLKB-UHFFFAOYSA-N 1 0 327.222 3.978 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCCO1 ZINC000482282896 1030307477 /nfs/dbraw/zinc/30/74/77/1030307477.db2.gz IOBIMOFEFKUBAZ-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)n1 ZINC000447563382 1030308663 /nfs/dbraw/zinc/30/86/63/1030308663.db2.gz PQZLMLWLMPNODL-OVYGPGRDSA-N 1 0 332.448 3.833 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(C3CC3)cc2)n1 ZINC000447603875 1030358640 /nfs/dbraw/zinc/35/86/40/1030358640.db2.gz ZDZWRZOLPJRPBJ-QZTJIDSGSA-N 1 0 340.427 3.942 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000052488267 1030362478 /nfs/dbraw/zinc/36/24/78/1030362478.db2.gz DHZPNPRAWJMVHD-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC2(CC1)OCCc1ccccc12 ZINC000453579770 1030371358 /nfs/dbraw/zinc/37/13/58/1030371358.db2.gz WDYUUVMNINZRJB-UHFFFAOYSA-N 1 0 338.407 3.659 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192601672 1030426833 /nfs/dbraw/zinc/42/68/33/1030426833.db2.gz ANUCPAJYLYVJGA-SJORKVTESA-N 1 0 345.468 3.926 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)CC[C@@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000237608017 1030440941 /nfs/dbraw/zinc/44/09/41/1030440941.db2.gz HTGICRXFOQBYEK-WMLDXEAASA-N 1 0 341.411 3.561 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)cc1[N+](=O)[O-] ZINC000160060522 1030518274 /nfs/dbraw/zinc/51/82/74/1030518274.db2.gz JXYVOZZMCNELMU-CQSZACIVSA-N 1 0 329.400 3.936 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000347361669 1030611243 /nfs/dbraw/zinc/61/12/43/1030611243.db2.gz PVULNJSFYRNFTQ-ZROIWOOFSA-N 1 0 326.400 3.601 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000447937665 1030612309 /nfs/dbraw/zinc/61/23/09/1030612309.db2.gz BOTZOZFLDKFIOY-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2nc(C)no2)CC1 ZINC000347363436 1030707945 /nfs/dbraw/zinc/70/79/45/1030707945.db2.gz QIXYCXMYPAVAHQ-JLHYYAGUSA-N 1 0 342.399 3.569 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CCCC1 ZINC000527238526 1030727819 /nfs/dbraw/zinc/72/78/19/1030727819.db2.gz KPSYTPLSIKDGJM-UHFFFAOYSA-N 1 0 334.416 3.684 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCc3ccccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000482846941 1030749098 /nfs/dbraw/zinc/74/90/98/1030749098.db2.gz VIUMTGNZROYDAR-AWEZNQCLSA-N 1 0 342.395 3.602 20 5 EHBDRO C[C@H]([NH2+]CC[C@H]1CC[C@H](C(F)(F)F)O1)c1cccc([N+](=O)[O-])c1 ZINC000926907531 1031080168 /nfs/dbraw/zinc/08/01/68/1031080168.db2.gz DSENKHUMZCNKHG-ZLKJLUDKSA-N 1 0 332.322 3.745 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000537695044 1031081834 /nfs/dbraw/zinc/08/18/34/1031081834.db2.gz WKPYBIAGIZHFQK-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000537695047 1031081864 /nfs/dbraw/zinc/08/18/64/1031081864.db2.gz WKPYBIAGIZHFQK-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@@H](Nc1cccc(OCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000325117458 1031129736 /nfs/dbraw/zinc/12/97/36/1031129736.db2.gz OZEVTJSIFJTNFW-CQSZACIVSA-N 1 0 329.400 3.708 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000537698509 1031139078 /nfs/dbraw/zinc/13/90/78/1031139078.db2.gz VUCLSPDYJCHPQR-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO CCCCCNC(=O)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000052722185 1031270561 /nfs/dbraw/zinc/27/05/61/1031270561.db2.gz ZBHJWUSOECNUMG-OAHLLOKOSA-N 1 0 347.459 3.674 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(CC(F)(F)F)CC2)c1 ZINC000551401450 1031299480 /nfs/dbraw/zinc/29/94/80/1031299480.db2.gz GRFJIPOIYUWRHF-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)C[NH+]1CCCCC1 ZINC000536183525 1031351688 /nfs/dbraw/zinc/35/16/88/1031351688.db2.gz ICGJFFDXLOACJH-GFCCVEGCSA-N 1 0 343.374 3.730 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721014 1031529177 /nfs/dbraw/zinc/52/91/77/1031529177.db2.gz ZQTCPRFYHHFFOQ-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO CCC(CC)Nc1cc[nH+]cc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000584081170 1031673950 /nfs/dbraw/zinc/67/39/50/1031673950.db2.gz KERHKCOSEAEHCV-UHFFFAOYSA-N 1 0 342.399 3.573 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487836 1033369171 /nfs/dbraw/zinc/36/91/71/1033369171.db2.gz NYBDKGJUYQAWRW-DZGCQCFKSA-N 1 0 334.445 3.508 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000898181543 1033382784 /nfs/dbraw/zinc/38/27/84/1033382784.db2.gz JQGMGRJTTMZJCV-SCLBCKFNSA-N 1 0 340.427 3.930 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)C2CCC(C)CC2)cccc1[N+](=O)[O-] ZINC000063482944 1033390721 /nfs/dbraw/zinc/39/07/21/1033390721.db2.gz IYGNGYLGGNAFBD-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc(N2CC[C@H](Cc3ccncc3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611931178 1033416959 /nfs/dbraw/zinc/41/69/59/1033416959.db2.gz YZHRDXYEVUDXCM-MRXNPFEDSA-N 1 0 348.406 3.915 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000594725399 1033505402 /nfs/dbraw/zinc/50/54/02/1033505402.db2.gz KDXXAPCETGGKBK-LJHODMEESA-N 1 0 326.396 3.818 20 5 EHBDRO Nc1cccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000594737197 1033509917 /nfs/dbraw/zinc/50/99/17/1033509917.db2.gz YRHDQUKMWQRQKQ-YJBOKZPZSA-N 1 0 325.412 3.678 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000594936901 1033586538 /nfs/dbraw/zinc/58/65/38/1033586538.db2.gz XRQOPGSSNIUTFX-LSDHHAIUSA-N 1 0 344.411 3.859 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])nc1 ZINC000598990599 1033614511 /nfs/dbraw/zinc/61/45/11/1033614511.db2.gz HLFKZLDSNUAIQF-SOFGYWHQSA-N 1 0 325.412 3.879 20 5 EHBDRO CC1(C)OC[C@H]2C[C@]21[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000598987841 1033614901 /nfs/dbraw/zinc/61/49/01/1033614901.db2.gz MFZPPOJMDURAGN-XIKOKIGWSA-N 1 0 328.368 3.512 20 5 EHBDRO Cc1cc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)ccn1 ZINC000598973515 1033618246 /nfs/dbraw/zinc/61/82/46/1033618246.db2.gz ZMCXYVNZROYFFN-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595009230 1033633399 /nfs/dbraw/zinc/63/33/99/1033633399.db2.gz FXSDNNJBQDVEFB-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000595074663 1033642090 /nfs/dbraw/zinc/64/20/90/1033642090.db2.gz SRYZRIJUYTVPAW-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCO[C@@H]2CC2(F)F)c2ccccc2)c1 ZINC000595067689 1033644940 /nfs/dbraw/zinc/64/49/40/1033644940.db2.gz GHOLBDHDTJUNRH-IAGOWNOFSA-N 1 0 348.349 3.698 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595071400 1033646414 /nfs/dbraw/zinc/64/64/14/1033646414.db2.gz YNMBCONHSCLJDT-KSSFIOAISA-N 1 0 344.411 3.950 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027126 1033648474 /nfs/dbraw/zinc/64/84/74/1033648474.db2.gz PZEJMXUMYVIQNR-CSMYWGQOSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC1C[C@H](C)O[C@@H](C)C1 ZINC000595039537 1033658022 /nfs/dbraw/zinc/65/80/22/1033658022.db2.gz QBDIEIWMOKOOHK-IHRRRGAJSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)c1cccnc1 ZINC000595042842 1033662882 /nfs/dbraw/zinc/66/28/82/1033662882.db2.gz CJNRZJPSUJZWQC-ZDUSSCGKSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccn1 ZINC000595051505 1033666850 /nfs/dbraw/zinc/66/68/50/1033666850.db2.gz VMLWRDRBQBAQMM-RDTXWAMCSA-N 1 0 325.412 3.704 20 5 EHBDRO Cn1ncc(C2CC2)c1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595075431 1033694827 /nfs/dbraw/zinc/69/48/27/1033694827.db2.gz BOAUMGBPHAHDBY-SFHVURJKSA-N 1 0 340.427 3.763 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc2cnccc21 ZINC000599097334 1033732672 /nfs/dbraw/zinc/73/26/72/1033732672.db2.gz BTIBFRCCZYXRKE-RDJZCZTQSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H](CO)C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000593676669 1033733476 /nfs/dbraw/zinc/73/34/76/1033733476.db2.gz NXECQFSBCQUROD-AWEZNQCLSA-N 1 0 344.411 3.695 20 5 EHBDRO O=[N+]([O-])c1c(NCC2CC[NH+](CC3CC3)CC2)ccc2cnccc21 ZINC000599112195 1033753148 /nfs/dbraw/zinc/75/31/48/1033753148.db2.gz VIPWKWQJKHCFAM-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489381 1033811216 /nfs/dbraw/zinc/81/12/16/1033811216.db2.gz ABBHJUKMPPXTFV-ARFHVFGLSA-N 1 0 327.384 3.659 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](C1CC1)C1CCOCC1)CCC2 ZINC000593714759 1033821290 /nfs/dbraw/zinc/82/12/90/1033821290.db2.gz AMVMKYOULKIRQO-MOPGFXCFSA-N 1 0 330.428 3.767 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC([NH2+]Cc2ccccc2)CC1 ZINC000595509197 1033836631 /nfs/dbraw/zinc/83/66/31/1033836631.db2.gz DIGWMSLMTALEFT-MRXNPFEDSA-N 1 0 339.439 3.910 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000593720188 1033844369 /nfs/dbraw/zinc/84/43/69/1033844369.db2.gz BSSLTFDLXSTDGA-BJZITVGISA-N 1 0 341.411 3.869 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843268 1033966440 /nfs/dbraw/zinc/96/64/40/1033966440.db2.gz LOIBNZDOXFXGMA-QGZVFWFLSA-N 1 0 342.395 3.819 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)c(OC)c1 ZINC000603867940 1033993923 /nfs/dbraw/zinc/99/39/23/1033993923.db2.gz DVFPMMRNSWYHBN-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2Cc2cccc(F)c2)cc1 ZINC000603893074 1034013890 /nfs/dbraw/zinc/01/38/90/1034013890.db2.gz VOMBHHSLHQEWSV-LJQANCHMSA-N 1 0 328.387 3.984 20 5 EHBDRO CC(C)CC1([NH2+][C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000595832521 1034016959 /nfs/dbraw/zinc/01/69/59/1034016959.db2.gz WPDADNVJGGCPDT-LBPRGKRZSA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@H]2CN(c3ccccc3)C[C@@H]2C1 ZINC000603905616 1034024501 /nfs/dbraw/zinc/02/45/01/1034024501.db2.gz JRYAVEBKPNFMDJ-NJAFHUGGSA-N 1 0 337.423 3.724 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](CCC3CC3)CC3CC3)o2)cc1 ZINC000595870821 1034031321 /nfs/dbraw/zinc/03/13/21/1034031321.db2.gz GQDFDDLQRIJFNK-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679259 1034108147 /nfs/dbraw/zinc/10/81/47/1034108147.db2.gz LXWQWPSQRDXMII-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604013122 1034138693 /nfs/dbraw/zinc/13/86/93/1034138693.db2.gz LZKMCUMGLRLEGW-QGZVFWFLSA-N 1 0 344.386 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2c(ccnc2N2CCCC[C@@H]([NH+]3CCCC3)C2)c1 ZINC000450326071 1034140682 /nfs/dbraw/zinc/14/06/82/1034140682.db2.gz WXUWTEIYZNMJEX-QGZVFWFLSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1cccc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)c1[N+](=O)[O-] ZINC000456265014 1034265436 /nfs/dbraw/zinc/26/54/36/1034265436.db2.gz HKYAZULDFWDAHE-QGZVFWFLSA-N 1 0 339.395 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)c2ncccc12 ZINC000596571257 1034294244 /nfs/dbraw/zinc/29/42/44/1034294244.db2.gz RPXZJNRYONJDEO-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@H](NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413038 1034299817 /nfs/dbraw/zinc/29/98/17/1034299817.db2.gz SKMDWINSCADWGZ-KBXCAEBGSA-N 1 0 345.443 3.569 20 5 EHBDRO C[C@@H]1CCC[N@@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CCO)c1 ZINC000596647171 1034346106 /nfs/dbraw/zinc/34/61/06/1034346106.db2.gz DOBQNGJLPIPZJC-OAHLLOKOSA-N 1 0 340.423 3.781 20 5 EHBDRO Nc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000596650138 1034346957 /nfs/dbraw/zinc/34/69/57/1034346957.db2.gz GVVJCRAYEUMTLO-MOPGFXCFSA-N 1 0 337.423 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000604435948 1034378227 /nfs/dbraw/zinc/37/82/27/1034378227.db2.gz OHAMOWXAWCUCHW-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2c(C)nn(CC)c2C)cc1[N+](=O)[O-] ZINC000534328676 1034403987 /nfs/dbraw/zinc/40/39/87/1034403987.db2.gz FITAHGZMOIPMLJ-LBPRGKRZSA-N 1 0 346.431 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC(CCO)CC3)s2)cc1 ZINC000534333576 1034408714 /nfs/dbraw/zinc/40/87/14/1034408714.db2.gz YUAZQNKDRVEVMR-UHFFFAOYSA-N 1 0 346.452 3.918 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000612194071 1034435878 /nfs/dbraw/zinc/43/58/78/1034435878.db2.gz XAONJTCEBBHYJJ-JXTAAOLFSA-N 1 0 338.407 3.764 20 5 EHBDRO CC[N@@H+]1CCC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000302947724 1034443004 /nfs/dbraw/zinc/44/30/04/1034443004.db2.gz NCDSONKBDKYFCK-INIZCTEOSA-N 1 0 333.435 3.602 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCCn2nccc21 ZINC000601320000 1034450385 /nfs/dbraw/zinc/45/03/85/1034450385.db2.gz CJLQRRUAMZCJRW-XIRDDKMYSA-N 1 0 340.427 3.627 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075837932 1034574765 /nfs/dbraw/zinc/57/47/65/1034574765.db2.gz OBWKOBGVEFIYNQ-INWMFGNUSA-N 1 0 342.399 3.798 20 5 EHBDRO COCC1(C2CCC2)C[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC000597195506 1034579184 /nfs/dbraw/zinc/57/91/84/1034579184.db2.gz JLGOTOMXYXMYAQ-DHDCSXOGSA-N 1 0 330.428 3.747 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1=CCSC1 ZINC000597245678 1034637914 /nfs/dbraw/zinc/63/79/14/1034637914.db2.gz MXWVIXHKMPDKIL-UHFFFAOYSA-N 1 0 330.409 3.960 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000179821472 1034660459 /nfs/dbraw/zinc/66/04/59/1034660459.db2.gz LCVYSENWHKPKHC-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C[C@H]([NH2+]CC1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000188506970 1034713027 /nfs/dbraw/zinc/71/30/27/1034713027.db2.gz LNRRBGSVGJPFQT-LBPRGKRZSA-N 1 0 345.365 3.520 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@@H](C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612408347 1034890851 /nfs/dbraw/zinc/89/08/51/1034890851.db2.gz WXOBGLJJXKKGCJ-FZKQIMNGSA-N 1 0 332.400 3.854 20 5 EHBDRO Cc1ccc(CN2CCC(C(=O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000179878457 1034918830 /nfs/dbraw/zinc/91/88/30/1034918830.db2.gz RSULEVHIGUZGIO-UHFFFAOYSA-N 1 0 338.407 3.998 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](n2ccnc2)C1 ZINC000615834452 1035028877 /nfs/dbraw/zinc/02/88/77/1035028877.db2.gz VBABGCYVUULLML-QWSHFYNQSA-N 1 0 326.400 3.532 20 5 EHBDRO COCC[N@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000065958729 1035030286 /nfs/dbraw/zinc/03/02/86/1035030286.db2.gz KNRRROHEMDNKHF-UHFFFAOYSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1cc(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000180065964 1035348749 /nfs/dbraw/zinc/34/87/49/1035348749.db2.gz VVUCCIYMEFYASC-FQEVSTJZSA-N 1 0 349.390 3.878 20 5 EHBDRO Cc1ccccc1C[N@@H+](C)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026197604 1035502562 /nfs/dbraw/zinc/50/25/62/1035502562.db2.gz NWHRDPYCMLXDLU-HNNXBMFYSA-N 1 0 341.411 3.671 20 5 EHBDRO C[N@@H+]1CC[C@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573350 1035538333 /nfs/dbraw/zinc/53/83/33/1035538333.db2.gz RJBZRLUDQCVAFT-FUHWJXTLSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1(C2CCC2)CCC1 ZINC000414172466 1035880969 /nfs/dbraw/zinc/88/09/69/1035880969.db2.gz FGHMAKNWXIXONR-ZDUSSCGKSA-N 1 0 331.416 3.624 20 5 EHBDRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000171127998 1035981193 /nfs/dbraw/zinc/98/11/93/1035981193.db2.gz MGCLZNCPVKUBRM-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000463956438 1035998423 /nfs/dbraw/zinc/99/84/23/1035998423.db2.gz ZWAJWHWSQANDCI-GJZGRUSLSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@H](C4CC4)C3)co2)cc1 ZINC000588977545 1036208217 /nfs/dbraw/zinc/20/82/17/1036208217.db2.gz ASFASFAXHVCCHY-HNNXBMFYSA-N 1 0 327.384 3.872 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687383 1036243439 /nfs/dbraw/zinc/24/34/39/1036243439.db2.gz JCIPZARFMLWMOV-DNVCBOLYSA-N 1 0 328.412 3.938 20 5 EHBDRO C[C@H](CO)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000535369501 1036404124 /nfs/dbraw/zinc/40/41/24/1036404124.db2.gz DAGZYPKVSPUMIT-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H](C)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541547138 1036427349 /nfs/dbraw/zinc/42/73/49/1036427349.db2.gz AKOHSWOOTBSXPU-SCLBCKFNSA-N 1 0 332.400 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000609132752 1036467971 /nfs/dbraw/zinc/46/79/71/1036467971.db2.gz GWLUVZYZCURWSU-HNNXBMFYSA-N 1 0 331.441 3.633 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000589519796 1036487569 /nfs/dbraw/zinc/48/75/69/1036487569.db2.gz ANUWUELLRUGZPY-BNXPMYBGSA-N 1 0 346.818 3.795 20 5 EHBDRO CCOC(=O)[C@]1(C(C)C)CC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825986 1036510864 /nfs/dbraw/zinc/51/08/64/1036510864.db2.gz IPDGKFFJYCSDMZ-KBXCAEBGSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCO[C@@H](CCc2ccccc2)C1 ZINC000541700137 1036576268 /nfs/dbraw/zinc/57/62/68/1036576268.db2.gz HXHWYXCCUWNHML-WMZOPIPTSA-N 1 0 340.423 3.989 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414317892 1036642783 /nfs/dbraw/zinc/64/27/83/1036642783.db2.gz WTKPVGJUUBZBGQ-MAUKXSAKSA-N 1 0 332.375 3.551 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414317891 1036643551 /nfs/dbraw/zinc/64/35/51/1036643551.db2.gz WTKPVGJUUBZBGQ-CRAIPNDOSA-N 1 0 332.375 3.551 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1CO ZINC000191181950 1036696578 /nfs/dbraw/zinc/69/65/78/1036696578.db2.gz ICDCRLXCZNLTPG-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1occc1C ZINC000412023677 1036729918 /nfs/dbraw/zinc/72/99/18/1036729918.db2.gz DAQWEPUSPGEONN-UHFFFAOYSA-N 1 0 345.399 3.655 20 5 EHBDRO C[C@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCOC1 ZINC000493173101 1036841079 /nfs/dbraw/zinc/84/10/79/1036841079.db2.gz CJYOKLHNHHAPCM-RBUKOAKNSA-N 1 0 326.396 3.700 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641877 1036914479 /nfs/dbraw/zinc/91/44/79/1036914479.db2.gz MRWWXEVIYQOYGL-ZIAGYGMSSA-N 1 0 333.432 3.600 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220738 1036950953 /nfs/dbraw/zinc/95/09/53/1036950953.db2.gz QUERRIOMIHKXKL-HOYKHHGWSA-N 1 0 346.452 3.963 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc3ccc(F)c(F)c3n2)cc1 ZINC000590603671 1036983206 /nfs/dbraw/zinc/98/32/06/1036983206.db2.gz YECONHUJHLSARB-UHFFFAOYSA-N 1 0 343.333 3.754 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC(OC(F)F)CC1 ZINC000590662276 1036996132 /nfs/dbraw/zinc/99/61/32/1036996132.db2.gz KVKRDJXCJHHLGZ-UHFFFAOYSA-N 1 0 344.358 3.634 20 5 EHBDRO Cc1nn(C[N@H+]2C[C@H](c3ccccc3C)C[C@@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537096 1037022499 /nfs/dbraw/zinc/02/24/99/1037022499.db2.gz IDKLLCCPWLDPFB-XJKSGUPXSA-N 1 0 328.416 3.552 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000590779907 1037047510 /nfs/dbraw/zinc/04/75/10/1037047510.db2.gz WUCIPHAGDBZHFZ-ZSZQSSIHSA-N 1 0 341.411 3.869 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCOCCc2ccccc2)cc1Cl ZINC000761523053 1037091607 /nfs/dbraw/zinc/09/16/07/1037091607.db2.gz QIPGLPFKCSBSTD-UHFFFAOYSA-N 1 0 348.830 3.987 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000386959183 1037113084 /nfs/dbraw/zinc/11/30/84/1037113084.db2.gz YUNYRCHLXIGKTE-MRXNPFEDSA-N 1 0 327.428 3.686 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000542252165 1037199606 /nfs/dbraw/zinc/19/96/06/1037199606.db2.gz VNWNGCSEMUGCLC-OAHLLOKOSA-N 1 0 331.416 3.520 20 5 EHBDRO CC[C@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000472607864 1037256824 /nfs/dbraw/zinc/25/68/24/1037256824.db2.gz DTGKJZNQAPAHBH-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@@H]1C1CC1 ZINC000542316384 1037280535 /nfs/dbraw/zinc/28/05/35/1037280535.db2.gz UHBSMFFDGTYYBX-RTBURBONSA-N 1 0 342.395 3.902 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@]3(C)CCO[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316624 1037280685 /nfs/dbraw/zinc/28/06/85/1037280685.db2.gz WUQDVDGPPMAKMV-KPZWWZAWSA-N 1 0 346.383 3.521 20 5 EHBDRO CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000271789246 1037284478 /nfs/dbraw/zinc/28/44/78/1037284478.db2.gz QGINSEXIPSTVDS-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCOC2(CCSCC2)C1 ZINC000573107566 1037289831 /nfs/dbraw/zinc/28/98/31/1037289831.db2.gz YCUYTFUWXRCYGR-CJNGLKHVSA-N 1 0 348.468 3.617 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN1CCc2ccccc2C1 ZINC000532455723 1037331239 /nfs/dbraw/zinc/33/12/39/1037331239.db2.gz HTADSNPNBKWUKU-INIZCTEOSA-N 1 0 339.439 3.612 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3n[nH]cc3C2)c2ccccc2)c1 ZINC000180949679 1037340933 /nfs/dbraw/zinc/34/09/33/1037340933.db2.gz BYSAXISKHRIREP-PXNSSMCTSA-N 1 0 348.406 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCOCC(F)(F)F)CCCC2 ZINC000591347892 1037368363 /nfs/dbraw/zinc/36/83/63/1037368363.db2.gz PPKHKDDVRCYZHR-HNNXBMFYSA-N 1 0 346.349 3.921 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462830212 1037433479 /nfs/dbraw/zinc/43/34/79/1037433479.db2.gz AWQWOQCUZOVTNW-VXGBXAGGSA-N 1 0 343.374 3.871 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000171128709 1037463461 /nfs/dbraw/zinc/46/34/61/1037463461.db2.gz AQSMIJNEXIONQE-AWEZNQCLSA-N 1 0 339.395 3.572 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2c3c(nn2C)CCCC3)cc1[N+](=O)[O-] ZINC000462876734 1037506135 /nfs/dbraw/zinc/50/61/35/1037506135.db2.gz PDKFKJIXFQHGJJ-UHFFFAOYSA-N 1 0 342.443 3.620 20 5 EHBDRO CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])c(OC)c1)[NH+]1CCCC1 ZINC000462920839 1037559892 /nfs/dbraw/zinc/55/98/92/1037559892.db2.gz WTZBMEHDPFYINT-KRWDZBQOSA-N 1 0 335.448 3.916 20 5 EHBDRO CC(C)(C)C[C@H](CO)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540148118 1037602412 /nfs/dbraw/zinc/60/24/12/1037602412.db2.gz HGEWAIGDILBKCE-OIISXLGYSA-N 1 0 334.460 3.693 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)CCC[C@H]1C ZINC000532571303 1037672641 /nfs/dbraw/zinc/67/26/41/1037672641.db2.gz LWZWJXVAISYVKV-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@@H](CC(F)(F)F)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000760903266 1037688838 /nfs/dbraw/zinc/68/88/38/1037688838.db2.gz QFPVLPSWIWODRH-LBPRGKRZSA-N 1 0 345.365 3.884 20 5 EHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587418 1037707203 /nfs/dbraw/zinc/70/72/03/1037707203.db2.gz ZHWWHSHKFOILSK-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000031582029 1037721075 /nfs/dbraw/zinc/72/10/75/1037721075.db2.gz PBNHHOQEBCGUCX-UHFFFAOYSA-N 1 0 327.812 3.553 20 5 EHBDRO CSc1ccc([C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000549938019 1037722871 /nfs/dbraw/zinc/72/28/71/1037722871.db2.gz PJYJCQWOXKOVDJ-GOSISDBHSA-N 1 0 345.468 3.709 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341203938 1037755261 /nfs/dbraw/zinc/75/52/61/1037755261.db2.gz DEEIOVIOGVSHTP-MRXNPFEDSA-N 1 0 327.384 3.583 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])C(C)C)cc1 ZINC000540344169 1037848209 /nfs/dbraw/zinc/84/82/09/1037848209.db2.gz FHNCVFDAVVKYBO-LJQANCHMSA-N 1 0 344.411 3.969 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH2+]CCn2cc([N+](=O)[O-])cn2)C(C)C)cc1 ZINC000540341860 1037848319 /nfs/dbraw/zinc/84/83/19/1037848319.db2.gz ZUOCMTWIYGFPPF-SFHVURJKSA-N 1 0 330.432 3.902 20 5 EHBDRO Cc1cccc(C2([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)c1 ZINC000592146439 1037869450 /nfs/dbraw/zinc/86/94/50/1037869450.db2.gz QAFPJOVBXZZRKN-UHFFFAOYSA-N 1 0 336.395 3.949 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000103473180 1037903044 /nfs/dbraw/zinc/90/30/44/1037903044.db2.gz PDUJOGCCHRRNHR-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)C2(CO)CC=CC2)cc1 ZINC000592175285 1037916238 /nfs/dbraw/zinc/91/62/38/1037916238.db2.gz KDBSMQFLKZABBM-LJQANCHMSA-N 1 0 338.407 3.754 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cc2n(n1)CCCC2 ZINC000592389153 1037953473 /nfs/dbraw/zinc/95/34/73/1037953473.db2.gz JCRJISMBDPSEAM-LBPRGKRZSA-N 1 0 348.834 3.674 20 5 EHBDRO C[C@H](C[NH2+]Cc1c(Cl)nc(Cl)n1C)c1ccccc1[N+](=O)[O-] ZINC000897469082 1038054890 /nfs/dbraw/zinc/05/48/90/1038054890.db2.gz CUBWCVGYKXTOIZ-SECBINFHSA-N 1 0 343.214 3.528 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)ccc1SC ZINC000058527833 1038074593 /nfs/dbraw/zinc/07/45/93/1038074593.db2.gz ATSYHUNEXOCQTE-UHFFFAOYSA-N 1 0 332.425 3.957 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C1CC1)C1CC1 ZINC000104680112 1038434165 /nfs/dbraw/zinc/43/41/65/1038434165.db2.gz YRWPWHAUTROVKU-UHFFFAOYSA-N 1 0 341.411 3.913 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000541389096 1038600640 /nfs/dbraw/zinc/60/06/40/1038600640.db2.gz NGVODROOSTVPPR-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO COc1ccc(OC)c(CCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000539046322 1038664724 /nfs/dbraw/zinc/66/47/24/1038664724.db2.gz JLXPGSDDUOVEET-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(O)CCC3)o2)c(Cl)c1 ZINC000238143743 1038670556 /nfs/dbraw/zinc/67/05/56/1038670556.db2.gz OINCFKBATZECLM-UHFFFAOYSA-N 1 0 336.775 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CCC(O)CC2)s1 ZINC000238148731 1038675146 /nfs/dbraw/zinc/67/51/46/1038675146.db2.gz IQYHDWNDCBJUBQ-UHFFFAOYSA-N 1 0 332.425 3.716 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1)CC(C)C ZINC000539105528 1038689381 /nfs/dbraw/zinc/68/93/81/1038689381.db2.gz GIRKSGLGCUDCRB-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552047524 1038914056 /nfs/dbraw/zinc/91/40/56/1038914056.db2.gz PMYBUFNFZODFLU-IIDMSEBBSA-N 1 0 342.443 3.834 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CCC[N@@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000479944143 1038921673 /nfs/dbraw/zinc/92/16/73/1038921673.db2.gz AXRUKVZLKQXLDD-AWEZNQCLSA-N 1 0 333.432 3.720 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CC(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000554140922 1038959392 /nfs/dbraw/zinc/95/93/92/1038959392.db2.gz QBLBXKSHHLMHJS-OIKLOGQESA-N 1 0 332.322 3.985 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@](C)(O)C1CCCCC1 ZINC000477856859 1038964079 /nfs/dbraw/zinc/96/40/79/1038964079.db2.gz IRVIZMNANBHEEN-KXBFYZLASA-N 1 0 334.460 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@]2(Cc3ccc(Cl)cc3)CCOC2)cc1 ZINC000500569569 1038999704 /nfs/dbraw/zinc/99/97/04/1038999704.db2.gz YRRZLFUIWCAURA-GOSISDBHSA-N 1 0 346.814 3.740 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000485453224 1039086803 /nfs/dbraw/zinc/08/68/03/1039086803.db2.gz RSTCWGCEQUDMLA-QGZVFWFLSA-N 1 0 326.396 3.593 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCO[C@H](C3CC3)C2)s1 ZINC000485694818 1039415019 /nfs/dbraw/zinc/41/50/19/1039415019.db2.gz LUPHKAIFEBSUIY-KRWDZBQOSA-N 1 0 344.436 3.934 20 5 EHBDRO Cc1ccc(CC(C)(C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000842165947 1039500154 /nfs/dbraw/zinc/50/01/54/1039500154.db2.gz IZWKVMRWXVPTRX-GOSISDBHSA-N 1 0 328.412 3.548 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1cccc(C)n1 ZINC000512516666 1039568835 /nfs/dbraw/zinc/56/88/35/1039568835.db2.gz JSOGEVHRDVDSKU-QINSGFPZSA-N 1 0 325.412 3.924 20 5 EHBDRO CO[C@H](CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000417325131 1039682232 /nfs/dbraw/zinc/68/22/32/1039682232.db2.gz DLODJEFIVCEJCP-LSDHHAIUSA-N 1 0 346.349 3.919 20 5 EHBDRO CS[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000129405673 1039768713 /nfs/dbraw/zinc/76/87/13/1039768713.db2.gz IECRKCPWFORBFN-MAUKXSAKSA-N 1 0 349.500 3.827 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(F)(F)[C@H](C)C1 ZINC000554946534 1039969058 /nfs/dbraw/zinc/96/90/58/1039969058.db2.gz VJXBSBNBRKOKBW-GFCCVEGCSA-N 1 0 328.359 3.859 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(Nc3ncc([N+](=O)[O-])cc3Cl)cccc21 ZINC000432945414 1040228038 /nfs/dbraw/zinc/22/80/38/1040228038.db2.gz RCMBTDWUZOOKIF-CQSZACIVSA-N 1 0 348.790 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000490029779 1040299753 /nfs/dbraw/zinc/29/97/53/1040299753.db2.gz YABIYBTYDKJJQW-KRWDZBQOSA-N 1 0 341.411 3.550 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000490092145 1040353161 /nfs/dbraw/zinc/35/31/61/1040353161.db2.gz YVCISCVTMHAOBR-OLMNPRSZSA-N 1 0 348.443 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H]2CCCCO2)c2ccccc2)c1 ZINC000490183781 1040372453 /nfs/dbraw/zinc/37/24/53/1040372453.db2.gz BNZLHRXEWBXDAR-OALUTQOASA-N 1 0 326.396 3.843 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000481167267 1040419175 /nfs/dbraw/zinc/41/91/75/1040419175.db2.gz GHAAAJNZKIYTBJ-KCQAQPDRSA-N 1 0 333.432 3.646 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000029278869 1040483020 /nfs/dbraw/zinc/48/30/20/1040483020.db2.gz CEYMOYMQAMEVAQ-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(OC(F)F)c(F)c2)c1 ZINC000555422415 1040560832 /nfs/dbraw/zinc/56/08/32/1040560832.db2.gz YVBSTQIWTAEAPU-UHFFFAOYSA-N 1 0 326.274 3.625 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000588492062 1040688057 /nfs/dbraw/zinc/68/80/57/1040688057.db2.gz XJQWKXHIDJBSRI-VORVDVFJSA-N 1 0 336.391 3.739 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc(C4CC4)o3)C2)cc1 ZINC000600170028 1040754907 /nfs/dbraw/zinc/75/49/07/1040754907.db2.gz VIGNWJSKSUVHCU-OAHLLOKOSA-N 1 0 327.384 3.840 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000614227381 1040765075 /nfs/dbraw/zinc/76/50/75/1040765075.db2.gz CBHODICLKBAHAL-ZWKOTPCHSA-N 1 0 336.432 3.547 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000555563090 1040835658 /nfs/dbraw/zinc/83/56/58/1040835658.db2.gz SSQTXFLWVNKWBK-WBVHZDCISA-N 1 0 348.443 3.629 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1c2cc(C)ccc2C[C@H]1C ZINC000491026979 1040873626 /nfs/dbraw/zinc/87/36/26/1040873626.db2.gz AAROUCYDRVDZLY-YJYMSZOUSA-N 1 0 326.396 3.935 20 5 EHBDRO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895306 1040897732 /nfs/dbraw/zinc/89/77/32/1040897732.db2.gz LVNYKBKOEYOYGB-GUYCJALGSA-N 1 0 328.416 3.843 20 5 EHBDRO C[C@@]1(CNCc2ccccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000311216154 1040912424 /nfs/dbraw/zinc/91/24/24/1040912424.db2.gz RVNBSEBBQMFLNT-FQEVSTJZSA-N 1 0 339.439 3.597 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)nc12 ZINC000156319653 1040975680 /nfs/dbraw/zinc/97/56/80/1040975680.db2.gz XRTHKVGQKDBSLJ-HNNXBMFYSA-N 1 0 338.411 3.753 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)cc1 ZINC000433196965 1041044693 /nfs/dbraw/zinc/04/46/93/1041044693.db2.gz OGJRZWADXVBKMV-QGZVFWFLSA-N 1 0 325.412 3.601 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCC[C@H]21 ZINC000555721465 1041060303 /nfs/dbraw/zinc/06/03/03/1041060303.db2.gz REJPPJATMIELLI-HUUCEWRRSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)cccc1[N+](=O)[O-] ZINC000453387607 1041072627 /nfs/dbraw/zinc/07/26/27/1041072627.db2.gz WGBRHJZEDLGOIX-SPYBWZPUSA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CNc1cccc2c1OCC[C@H]2[NH+](C)C ZINC000433207705 1041097089 /nfs/dbraw/zinc/09/70/89/1041097089.db2.gz RKHIYAUTJNIXMC-GOSISDBHSA-N 1 0 341.411 3.901 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000341522969 1041168939 /nfs/dbraw/zinc/16/89/39/1041168939.db2.gz HHKZBDSYEOIVEC-GFCCVEGCSA-N 1 0 349.460 3.524 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](CO)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433283868 1041233638 /nfs/dbraw/zinc/23/36/38/1041233638.db2.gz PQDKSPIUFLRMMF-ZWKOTPCHSA-N 1 0 344.386 3.780 20 5 EHBDRO CC(C)(CNc1ccnc2c1cccc2[N+](=O)[O-])C[NH+]1CCCC1 ZINC000432140695 1041641695 /nfs/dbraw/zinc/64/16/95/1041641695.db2.gz BHNPTPFLPKARGP-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO COCc1ccccc1/C=C(/C)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000511827164 1041669898 /nfs/dbraw/zinc/66/98/98/1041669898.db2.gz URYUKXBOCIUIRW-VBKFSLOCSA-N 1 0 340.423 3.977 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@H](O)c1ccc(F)cc1 ZINC000124439463 1041711511 /nfs/dbraw/zinc/71/15/11/1041711511.db2.gz WVORTLDORGJWNP-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C1CCCCCC1 ZINC000109093463 1042131667 /nfs/dbraw/zinc/13/16/67/1042131667.db2.gz DJHWWHSHFGEDQH-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO COc1cc(C[NH2+]C[C@H]2C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000111398367 1042262224 /nfs/dbraw/zinc/26/22/24/1042262224.db2.gz LLEXHFORBWKLRT-GDBMZVCRSA-N 1 0 342.395 3.505 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)O1 ZINC000511958983 1042488670 /nfs/dbraw/zinc/48/86/70/1042488670.db2.gz XALBNTBFVZTJMU-CYBMUJFWSA-N 1 0 330.384 3.854 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000165005286 1042596222 /nfs/dbraw/zinc/59/62/22/1042596222.db2.gz LYEFQXAJSBDNKV-QGZVFWFLSA-N 1 0 327.384 3.664 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)[C@@H]2CCO[C@H]21 ZINC000568585794 1042772823 /nfs/dbraw/zinc/77/28/23/1042772823.db2.gz LHTDVJVHXKBBCI-KKBVYLPWSA-N 1 0 330.428 3.720 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC000541935857 1042917218 /nfs/dbraw/zinc/91/72/18/1042917218.db2.gz NAETWWQEKLWUHA-RDJZCZTQSA-N 1 0 340.427 3.854 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000278991282 1043151435 /nfs/dbraw/zinc/15/14/35/1043151435.db2.gz DVGVTYNJLSPQTK-ROUUACIJSA-N 1 0 326.396 3.640 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1cc(F)cc([N+](=O)[O-])c1 ZINC000344203280 1043422436 /nfs/dbraw/zinc/42/24/36/1043422436.db2.gz DAUVPHJNZXKYIL-UHFFFAOYSA-N 1 0 343.358 3.582 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)c1 ZINC001167874318 1044108165 /nfs/dbraw/zinc/10/81/65/1044108165.db2.gz GVIBHVWKZKDRMK-UHFFFAOYSA-N 1 0 348.834 3.894 20 5 EHBDRO CCn1cc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000279508383 1044152239 /nfs/dbraw/zinc/15/22/39/1044152239.db2.gz NFWZYPYYPCDXHO-SNVBAGLBSA-N 1 0 342.321 3.681 20 5 EHBDRO CS(=O)(=O)C1(C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000279680555 1044403523 /nfs/dbraw/zinc/40/35/23/1044403523.db2.gz IWJSQZUKERZXNO-UHFFFAOYSA-N 1 0 339.460 3.660 20 5 EHBDRO CC[C@H]([NH2+]CCCc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000183475131 1125577579 /nfs/dbraw/zinc/57/75/79/1125577579.db2.gz KEJJMTKGWGQTPH-SFHVURJKSA-N 1 0 330.432 3.619 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C(C)(C)c1ccc(F)cc1 ZINC000072607295 1126795903 /nfs/dbraw/zinc/79/59/03/1126795903.db2.gz DWWWXPQNMIFMED-UHFFFAOYSA-N 1 0 345.374 3.506 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+]CCCO)cc1 ZINC000072713121 1126864961 /nfs/dbraw/zinc/86/49/61/1126864961.db2.gz YGNPPDRPGIUOKK-UHFFFAOYSA-N 1 0 336.775 3.513 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000552097449 1127578536 /nfs/dbraw/zinc/57/85/36/1127578536.db2.gz BXECPSGUEMJHER-JOCBIADPSA-N 1 0 332.444 3.568 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000765330380 1127598272 /nfs/dbraw/zinc/59/82/72/1127598272.db2.gz BEFIWOWWFRYWPU-RDTXWAMCSA-N 1 0 326.396 3.887 20 5 EHBDRO COc1cc(NC[C@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301381712 1127740898 /nfs/dbraw/zinc/74/08/98/1127740898.db2.gz ZPUOIWGMWODGGH-GOSISDBHSA-N 1 0 341.411 3.852 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000301382744 1127741201 /nfs/dbraw/zinc/74/12/01/1127741201.db2.gz VGTHVIIEVNFOKO-VXGBXAGGSA-N 1 0 343.374 3.729 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443890 1127919603 /nfs/dbraw/zinc/91/96/03/1127919603.db2.gz VAJAUWOWVMEJHE-WFASDCNBSA-N 1 0 332.429 3.546 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478247 1131242031 /nfs/dbraw/zinc/24/20/31/1131242031.db2.gz XXRKYODHZIPQDE-PBHICJAKSA-N 1 0 336.395 3.780 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000153532712 1128443041 /nfs/dbraw/zinc/44/30/41/1128443041.db2.gz MEVQODMAWRBQQD-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508526 1128484296 /nfs/dbraw/zinc/48/42/96/1128484296.db2.gz AQIKWZGFWHYRPZ-DOTOQJQBSA-N 1 0 340.427 3.763 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC001168632975 1128506173 /nfs/dbraw/zinc/50/61/73/1128506173.db2.gz HAGCHJYIXSQBFE-QGZVFWFLSA-N 1 0 336.338 3.993 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+]C2(c3ccc(F)cc3F)CCC2)c1 ZINC001168644585 1128601062 /nfs/dbraw/zinc/60/10/62/1128601062.db2.gz OCORPQGTFZYFEW-UHFFFAOYSA-N 1 0 348.349 3.921 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@]1(O)CCCc2ccccc21 ZINC000765875761 1128629000 /nfs/dbraw/zinc/62/90/00/1128629000.db2.gz FXMWDMAZLDXBQW-QRWLVFNGSA-N 1 0 340.423 3.778 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000921817547 1128786042 /nfs/dbraw/zinc/78/60/42/1128786042.db2.gz KTLZIMIHUWGLHY-GOSISDBHSA-N 1 0 328.416 3.832 20 5 EHBDRO COc1cc(C[NH2+]CCC(C)(C)c2ccccc2)c([N+](=O)[O-])cc1O ZINC001648911443 1120123455 /nfs/dbraw/zinc/12/34/55/1120123455.db2.gz RRSYZCAYKKCVQY-UHFFFAOYSA-N 1 0 344.411 3.767 20 5 EHBDRO Cc1c(C[NH2+]CCc2c[nH]c3cc(F)ccc23)cccc1[N+](=O)[O-] ZINC001648990322 1120337933 /nfs/dbraw/zinc/33/79/33/1120337933.db2.gz ANQYOUJNTGBCPC-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H](C)C1 ZINC000765955598 1128915690 /nfs/dbraw/zinc/91/56/90/1128915690.db2.gz AAHPZVQJWPXIDZ-VCBZYWHSSA-N 1 0 331.460 3.978 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114096 1120691137 /nfs/dbraw/zinc/69/11/37/1120691137.db2.gz MDSPIIGBWVPNLZ-KDOFPFPSSA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCCOCc1ccccc1)CC2 ZINC000542508747 1120855083 /nfs/dbraw/zinc/85/50/83/1120855083.db2.gz PMPDHCIEIIJBTL-UHFFFAOYSA-N 1 0 326.396 3.560 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000554957920 1128948845 /nfs/dbraw/zinc/94/88/45/1128948845.db2.gz GEXGWCMCZKGRGG-FUHWJXTLSA-N 1 0 345.830 3.783 20 5 EHBDRO CCCCCC[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2C)no1 ZINC000762070644 1121090182 /nfs/dbraw/zinc/09/01/82/1121090182.db2.gz FOHIHEDOJAGCBR-UHFFFAOYSA-N 1 0 332.404 3.965 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000193438393 1121285818 /nfs/dbraw/zinc/28/58/18/1121285818.db2.gz QHJRGOMKTWOFNT-CQSZACIVSA-N 1 0 340.427 3.815 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663183 1121561484 /nfs/dbraw/zinc/56/14/84/1121561484.db2.gz PXQLMBNSJXFWRQ-GOEBONIOSA-N 1 0 347.459 3.661 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2/C=C/c2ccccc2)cc1 ZINC000780400260 1121575177 /nfs/dbraw/zinc/57/51/77/1121575177.db2.gz UQZPVQNKRTVKJO-CSXIPAGWSA-N 1 0 338.407 3.806 20 5 EHBDRO CCO[C@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000194464937 1121909498 /nfs/dbraw/zinc/90/94/98/1121909498.db2.gz OEYPGYFRTITIQA-YRVHBARZSA-N 1 0 326.396 3.975 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(c3ccc([N+](=O)[O-])cc3F)C2)CC1 ZINC000301123739 1122030205 /nfs/dbraw/zinc/03/02/05/1122030205.db2.gz SBDVZJYSAWJBJY-HNNXBMFYSA-N 1 0 335.423 3.682 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301156649 1122167011 /nfs/dbraw/zinc/16/70/11/1122167011.db2.gz AMKHQXMTYIOXEX-MRXNPFEDSA-N 1 0 343.402 3.710 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000272776196 1122223942 /nfs/dbraw/zinc/22/39/42/1122223942.db2.gz UJSKAEPDIJUKJU-STQMWFEESA-N 1 0 327.384 3.965 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763395790 1122229711 /nfs/dbraw/zinc/22/97/11/1122229711.db2.gz OTSQBDAHUKZULM-IAGOWNOFSA-N 1 0 332.787 3.559 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[N@@H+](C)C(C)C ZINC000301175089 1122241811 /nfs/dbraw/zinc/24/18/11/1122241811.db2.gz FTZZYDRSTGOFOH-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000154295265 1122535842 /nfs/dbraw/zinc/53/58/42/1122535842.db2.gz WPQLBHXIDRVLQT-WWGRRREGSA-N 1 0 348.399 3.749 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000078270585 1129125139 /nfs/dbraw/zinc/12/51/39/1129125139.db2.gz DRZIBRQPZJJXJX-SUNKGSAMSA-N 1 0 339.823 3.744 20 5 EHBDRO O=[N+]([O-])c1ncccc1NCc1ccccc1C[NH+]1CCCCCC1 ZINC000609578105 1123614587 /nfs/dbraw/zinc/61/45/87/1123614587.db2.gz ORPCJZAWTNDSHW-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000067961105 1123795973 /nfs/dbraw/zinc/79/59/73/1123795973.db2.gz GKMMZXRECCOHMF-HNNXBMFYSA-N 1 0 341.411 3.925 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@H]1c1ccccc1 ZINC000301823521 1129149245 /nfs/dbraw/zinc/14/92/45/1129149245.db2.gz CMIYZSKDHAOAIF-HUUCEWRRSA-N 1 0 332.791 3.501 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2ccnn2C)C(C)C)cccc1[N+](=O)[O-] ZINC000615967232 1123919371 /nfs/dbraw/zinc/91/93/71/1123919371.db2.gz WYZHBOALTWTEIR-GDBMZVCRSA-N 1 0 330.432 3.727 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N(C)CC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000499653653 1129165027 /nfs/dbraw/zinc/16/50/27/1129165027.db2.gz OIRMRQAMHQYNHZ-UHFFFAOYSA-N 1 0 340.427 3.651 20 5 EHBDRO Cc1nc(NC(C)(C)C[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301831586 1129170298 /nfs/dbraw/zinc/17/02/98/1129170298.db2.gz SRJGOTREZDRHQE-UHFFFAOYSA-N 1 0 328.416 3.621 20 5 EHBDRO Cc1cc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000080605823 1124622630 /nfs/dbraw/zinc/62/26/30/1124622630.db2.gz IHNLBXWKZGOINZ-DYVFJYSZSA-N 1 0 346.456 3.855 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000734835298 1131284520 /nfs/dbraw/zinc/28/45/20/1131284520.db2.gz SWLWPYGJULJQCJ-UHFFFAOYSA-N 1 0 344.802 3.696 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181526293 1124917871 /nfs/dbraw/zinc/91/78/71/1124917871.db2.gz KJMWCAQLTSCKEG-SFHVURJKSA-N 1 0 341.411 3.689 20 5 EHBDRO CCN(C(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000181807767 1125046077 /nfs/dbraw/zinc/04/60/77/1125046077.db2.gz FZSCCYBVVFIMQC-HNNXBMFYSA-N 1 0 341.411 3.607 20 5 EHBDRO Cc1cc(C)cc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181809832 1125046214 /nfs/dbraw/zinc/04/62/14/1125046214.db2.gz IFSXQSWOUNQXCX-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO O=C(CC[N@H+](C1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000619716509 1125387961 /nfs/dbraw/zinc/38/79/61/1125387961.db2.gz RPPZZMDEKMGLKE-UHFFFAOYSA-N 1 0 331.416 3.721 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000735490632 1131352229 /nfs/dbraw/zinc/35/22/29/1131352229.db2.gz MBGSSGBQJUJAPX-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000182937327 1125406295 /nfs/dbraw/zinc/40/62/95/1125406295.db2.gz SSUUSRGATPSHPV-AWEZNQCLSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000182937423 1125407106 /nfs/dbraw/zinc/40/71/06/1125407106.db2.gz NOAPTCRONQZXQE-LBPRGKRZSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000183074176 1125432390 /nfs/dbraw/zinc/43/23/90/1125432390.db2.gz PQJTYNUMOXYZAB-WDEREUQCSA-N 1 0 346.374 3.772 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000114729155 1129187129 /nfs/dbraw/zinc/18/71/29/1129187129.db2.gz UOPMUACJAMYWAQ-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000255954960 1129237821 /nfs/dbraw/zinc/23/78/21/1129237821.db2.gz RBZUSPGXTIJVAZ-XNRPHZJLSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131026817 1129376482 /nfs/dbraw/zinc/37/64/82/1129376482.db2.gz YSYQPZBNUGZPQI-OLZOCXBDSA-N 1 0 330.388 3.655 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000466489444 1129489289 /nfs/dbraw/zinc/48/92/89/1129489289.db2.gz RKCFGWGKLKNRHH-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO CC[C@@H](c1ccncc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000092223840 1129537340 /nfs/dbraw/zinc/53/73/40/1129537340.db2.gz OUJFOOCZLVWJMX-SFHVURJKSA-N 1 0 329.400 3.842 20 5 EHBDRO CC[NH+]1CCC(Nc2cc(C)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000555121193 1129547625 /nfs/dbraw/zinc/54/76/25/1129547625.db2.gz FNYMAMPBZLMVBF-UHFFFAOYSA-N 1 0 331.338 3.818 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC1CC1 ZINC000922540207 1129567982 /nfs/dbraw/zinc/56/79/82/1129567982.db2.gz HFUMJVSYQWKYJL-CYBMUJFWSA-N 1 0 342.395 3.995 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802858 1129590455 /nfs/dbraw/zinc/59/04/55/1129590455.db2.gz YFWXURGDCNIZEK-WBMJQRKESA-N 1 0 346.818 3.576 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964575 1129601809 /nfs/dbraw/zinc/60/18/09/1129601809.db2.gz WOADWVKXAQVIIQ-RHSMWYFYSA-N 1 0 329.400 3.676 20 5 EHBDRO CC[C@H]([NH2+]CCCN(C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000156388368 1129713764 /nfs/dbraw/zinc/71/37/64/1129713764.db2.gz YWHBOWMMZQCTCV-AWEZNQCLSA-N 1 0 333.354 3.520 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000392747888 1129724131 /nfs/dbraw/zinc/72/41/31/1129724131.db2.gz PEFLTZRHIHJDGD-UHFFFAOYSA-N 1 0 343.402 3.853 20 5 EHBDRO COc1cc(N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081755 1129767674 /nfs/dbraw/zinc/76/76/74/1129767674.db2.gz YATLHLGMSTZHQX-HOTGVXAUSA-N 1 0 347.459 3.694 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@@H]32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092624 1129767726 /nfs/dbraw/zinc/76/77/26/1129767726.db2.gz QIXFPNXJCPLHQS-SIIHOXLZSA-N 1 0 327.384 3.821 20 5 EHBDRO Cn1cncc1CCNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000302121239 1129769099 /nfs/dbraw/zinc/76/90/99/1129769099.db2.gz DLJLNWCKMWIQML-UHFFFAOYSA-N 1 0 348.712 3.655 20 5 EHBDRO Cc1cccc(NCC2CCN(c3cc[nH+]cc3)CC2)c1[N+](=O)[O-] ZINC000302466443 1129779559 /nfs/dbraw/zinc/77/95/59/1129779559.db2.gz BPJJOGCJAQQIKS-UHFFFAOYSA-N 1 0 326.400 3.627 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN1CCc2sccc2C1 ZINC000132868851 1129905358 /nfs/dbraw/zinc/90/53/58/1129905358.db2.gz KLSYRVAPOLNORZ-AWEZNQCLSA-N 1 0 345.468 3.674 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1CN1CC2CCC1CC2 ZINC001168748813 1129919418 /nfs/dbraw/zinc/91/94/18/1129919418.db2.gz AXFAHFGBDGZDIL-UHFFFAOYSA-N 1 0 325.206 3.732 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000172864387 1130165852 /nfs/dbraw/zinc/16/58/52/1130165852.db2.gz QAQHGOUQEAQKCA-ZIAGYGMSSA-N 1 0 329.400 3.913 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc(Cn2ccnc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173314305 1130205619 /nfs/dbraw/zinc/20/56/19/1130205619.db2.gz XMEFPLSUFVUZGX-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173357745 1130216535 /nfs/dbraw/zinc/21/65/35/1130216535.db2.gz UAOHDMSRVSCBTH-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455547 1130234389 /nfs/dbraw/zinc/23/43/89/1130234389.db2.gz JWXDANVZGVWJKS-AWEZNQCLSA-N 1 0 348.424 3.881 20 5 EHBDRO CC[C@](C)([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1nccs1 ZINC000173510362 1130239356 /nfs/dbraw/zinc/23/93/56/1130239356.db2.gz GHAWCBCWCCFFBK-INIZCTEOSA-N 1 0 335.429 3.735 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCC[C@@H](O)C2)s1 ZINC000174430227 1130358233 /nfs/dbraw/zinc/35/82/33/1130358233.db2.gz URHCMONPJMGGMU-ZIAGYGMSSA-N 1 0 346.452 3.964 20 5 EHBDRO CC[N@H+](CCn1cc([N+](=O)[O-])cn1)[C@@H](C)c1cc2ccccc2o1 ZINC000174832755 1130387089 /nfs/dbraw/zinc/38/70/89/1130387089.db2.gz MGOWVQHNRDITBK-ZDUSSCGKSA-N 1 0 328.372 3.621 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731206428 1130779710 /nfs/dbraw/zinc/77/97/10/1130779710.db2.gz HHMZCYJUWOFSGY-UHFFFAOYSA-N 1 0 334.445 3.879 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000733302482 1131019133 /nfs/dbraw/zinc/01/91/33/1131019133.db2.gz XHQQQXLEQLNRGO-GFCCVEGCSA-N 1 0 334.445 3.881 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000766191864 1131072133 /nfs/dbraw/zinc/07/21/33/1131072133.db2.gz GXAZEFGYBQJYMZ-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCC3C[NH+](Cc4ccccc4)C3)ccc2c1 ZINC000716298609 1131497770 /nfs/dbraw/zinc/49/77/70/1131497770.db2.gz MNYAQPOZGGCDFQ-UHFFFAOYSA-N 1 0 348.406 3.687 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1C ZINC000740870784 1131550896 /nfs/dbraw/zinc/55/08/96/1131550896.db2.gz IMMFFGIVLRDOKA-NEPJUHHUSA-N 1 0 334.445 3.514 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154507 1131694003 /nfs/dbraw/zinc/69/40/03/1131694003.db2.gz KMEYHTLHRXOUIZ-CABCVRRESA-N 1 0 328.416 3.926 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cn(C3CCC3)cn1)CC2 ZINC001172902571 1131883790 /nfs/dbraw/zinc/88/37/90/1131883790.db2.gz AAQUCLUYQNSNQW-MRXNPFEDSA-N 1 0 340.427 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1c(F)cccc1F)CC2 ZINC001172901322 1131883808 /nfs/dbraw/zinc/88/38/08/1131883808.db2.gz HCUBOWMGCBMIDT-OAHLLOKOSA-N 1 0 346.377 3.953 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cccnc1Cl)CC2 ZINC001172902529 1131884691 /nfs/dbraw/zinc/88/46/91/1131884691.db2.gz ZINPAZZJLPJQKL-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC(OC3CCC3)CC1)CC2 ZINC001172904446 1131885809 /nfs/dbraw/zinc/88/58/09/1131885809.db2.gz NIQFQGCPRNVIQM-QGZVFWFLSA-N 1 0 344.455 3.876 20 5 EHBDRO COCc1cccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172904674 1131886871 /nfs/dbraw/zinc/88/68/71/1131886871.db2.gz ZLYLOWWXTPAEPU-LJQANCHMSA-N 1 0 340.423 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccnc(Cl)c1)CC2 ZINC001172895461 1131901853 /nfs/dbraw/zinc/90/18/53/1131901853.db2.gz DQUBDJLFOZJZHL-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](c3cccnc3)C1)CC2 ZINC001172915534 1131902939 /nfs/dbraw/zinc/90/29/39/1131902939.db2.gz OPGPJTKXIRCVRN-MOPGFXCFSA-N 1 0 337.423 3.727 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743381054 1131914962 /nfs/dbraw/zinc/91/49/62/1131914962.db2.gz SZYDYGVHTNKFKH-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH+]3CCCCCC3)CC2)c(F)c1 ZINC001173009670 1131935917 /nfs/dbraw/zinc/93/59/17/1131935917.db2.gz GTZCLIFYKKYVAO-UHFFFAOYSA-N 1 0 339.386 3.718 20 5 EHBDRO CC1(C)CC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173018623 1131937242 /nfs/dbraw/zinc/93/72/42/1131937242.db2.gz XNWJVGJGIKTZJM-UHFFFAOYSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CCCC23CCC3)c1F ZINC001173187358 1131993193 /nfs/dbraw/zinc/99/31/93/1131993193.db2.gz ZZIMVSRAOZHCIJ-WBMJQRKESA-N 1 0 336.407 3.986 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2cccc(C)n2)c1F ZINC001173188038 1131993913 /nfs/dbraw/zinc/99/39/13/1131993913.db2.gz HYLOYPCRNVIIBO-QWHCGFSZSA-N 1 0 347.390 3.728 20 5 EHBDRO CC[N@H+](Cc1cccnc1)[C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187615 1131994074 /nfs/dbraw/zinc/99/40/74/1131994074.db2.gz AVXXDVUQUZQZDR-CYBMUJFWSA-N 1 0 347.390 3.591 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)Cc2cccs2)c1F ZINC001173188543 1131994172 /nfs/dbraw/zinc/99/41/72/1131994172.db2.gz GMRNPVRCDZFWKS-NSHDSACASA-N 1 0 338.404 3.867 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](Cc2ccco2)C2CC2)c1F ZINC001173194180 1131995578 /nfs/dbraw/zinc/99/55/78/1131995578.db2.gz YIZTWHWXYOVXBG-LBPRGKRZSA-N 1 0 348.374 3.931 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOc1ccc(F)cc1 ZINC001173215224 1132000613 /nfs/dbraw/zinc/00/06/13/1132000613.db2.gz UPIZAGBDGJMKIS-AWEZNQCLSA-N 1 0 332.375 3.724 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC001173218169 1132001958 /nfs/dbraw/zinc/00/19/58/1132001958.db2.gz OQPNAKAVMMIKJA-DJCROIMJSA-N 1 0 332.350 3.950 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](O)c1cccc(Cl)c1 ZINC001173220094 1132002766 /nfs/dbraw/zinc/00/27/66/1132002766.db2.gz TYSASVRCXGDNTF-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1OC(F)F ZINC001173219088 1132003156 /nfs/dbraw/zinc/00/31/56/1132003156.db2.gz WVQMLWHNGXQBBQ-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC001173219344 1132003649 /nfs/dbraw/zinc/00/36/49/1132003649.db2.gz AZSAOGOMALHCFP-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccc(F)cc2C1 ZINC001173222920 1132005196 /nfs/dbraw/zinc/00/51/96/1132005196.db2.gz GBBXNGNCQFNVAG-FZKQIMNGSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N(C(N)=[NH2+])c1ccc(Cl)cc1 ZINC001173224232 1132005653 /nfs/dbraw/zinc/00/56/53/1132005653.db2.gz MTOASXPFDFUOGB-LLVKDONJSA-N 1 0 332.791 3.579 20 5 EHBDRO COc1ncccc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223624 1132005952 /nfs/dbraw/zinc/00/59/52/1132005952.db2.gz JGGABDJOCLZPRY-ACJLOTCBSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(CC2CC2)CCOCC1 ZINC001173223021 1132005968 /nfs/dbraw/zinc/00/59/68/1132005968.db2.gz GNRONVPSCIUEGY-HNNXBMFYSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2c(F)cc(F)cc21 ZINC001173227581 1132007590 /nfs/dbraw/zinc/00/75/90/1132007590.db2.gz HBGFFUATNRPKCL-PIGZYNQJSA-N 1 0 348.349 3.917 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230523 1132007752 /nfs/dbraw/zinc/00/77/52/1132007752.db2.gz RTWFDIAOJRDPAN-OAHLLOKOSA-N 1 0 327.428 3.797 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1CC(=O)OC(C)(C)C ZINC001173231923 1132009024 /nfs/dbraw/zinc/00/90/24/1132009024.db2.gz OXGXYWDDKSEECK-PBHICJAKSA-N 1 0 348.443 3.722 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC001173232284 1132009565 /nfs/dbraw/zinc/00/95/65/1132009565.db2.gz AGTAKDGXOQJYAH-LIRRHRJNSA-N 1 0 344.386 3.818 20 5 EHBDRO COc1ccc2c(C[NH3+])cn([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)c2c1 ZINC001173235892 1132010144 /nfs/dbraw/zinc/01/01/44/1132010144.db2.gz VRFUQCGEEYLHAN-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO CCC[N@H+](CCc1ccccn1)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234033 1132010730 /nfs/dbraw/zinc/01/07/30/1132010730.db2.gz OTFFEOSIUWUERX-INIZCTEOSA-N 1 0 327.428 3.876 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CC(C)(C)N(O)C(C)(C)C1 ZINC001173214657 1132015197 /nfs/dbraw/zinc/01/51/97/1132015197.db2.gz DJEHFMGNPOEGCM-ZDUSSCGKSA-N 1 0 335.448 3.526 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cncc(F)c1 ZINC001174293030 1132300064 /nfs/dbraw/zinc/30/00/64/1132300064.db2.gz VZEYHZWQQOOAJI-UHFFFAOYSA-N 1 0 348.381 3.778 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001168972640 1132623944 /nfs/dbraw/zinc/62/39/44/1132623944.db2.gz NNKSZHARHWLXIB-ZJUUUORDSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(n3ccc4ccccc43)CC2)C1 ZINC001169036538 1132636547 /nfs/dbraw/zinc/63/65/47/1132636547.db2.gz GKVOCDFBUNXKPS-MAUKXSAKSA-N 1 0 327.428 3.724 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037123 1132636729 /nfs/dbraw/zinc/63/67/29/1132636729.db2.gz JBPHTXISHRIDJD-DAXOMENPSA-N 1 0 340.876 3.875 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3cc(F)ccc32)C1 ZINC001169042838 1132638659 /nfs/dbraw/zinc/63/86/59/1132638659.db2.gz GIZKSRKSXZLNRF-XJKSGUPXSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(c3nc4ccccc4s3)CC2)C1 ZINC001169025914 1132640197 /nfs/dbraw/zinc/64/01/97/1132640197.db2.gz JWRPEHDFXKETNW-HIFRSBDPSA-N 1 0 345.468 3.921 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(Oc3ccccc3Cl)CC2)C1 ZINC001169024979 1132640216 /nfs/dbraw/zinc/64/02/16/1132640216.db2.gz IGCXZBCJMRNVJR-ZIAGYGMSSA-N 1 0 338.835 3.629 20 5 EHBDRO CC1(C)C[C@H](Nc2nc(Cl)ccc2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169146708 1132676339 /nfs/dbraw/zinc/67/63/39/1132676339.db2.gz RWYNOTJLNWXVGI-BONVTDFDSA-N 1 0 326.828 3.599 20 5 EHBDRO COc1ccc(Nc2ccc(C[NH+]3CCCC3)cc2)cc1[N+](=O)[O-] ZINC001176363710 1132922810 /nfs/dbraw/zinc/92/28/10/1132922810.db2.gz SRPJUAABFUJWAX-UHFFFAOYSA-N 1 0 327.384 3.943 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000804357269 1133007091 /nfs/dbraw/zinc/00/70/91/1133007091.db2.gz BPCRBLZVQBMDJU-VBQJREDUSA-N 1 0 345.443 3.639 20 5 EHBDRO NC(=O)c1ccc(C[N@@H+]2CCCCC23CCCCCC3)c([N+](=O)[O-])c1 ZINC001176960260 1133016012 /nfs/dbraw/zinc/01/60/12/1133016012.db2.gz WNSPUVGKWSOOAV-UHFFFAOYSA-N 1 0 345.443 3.773 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762598 1133048466 /nfs/dbraw/zinc/04/84/66/1133048466.db2.gz IZLCKWBJZUCAEW-WBMJQRKESA-N 1 0 331.420 3.506 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765455 1133050556 /nfs/dbraw/zinc/05/05/56/1133050556.db2.gz PJTWTYDOIGOYLT-CQSZACIVSA-N 1 0 331.420 3.650 20 5 EHBDRO C[C@@]1(Cc2ccccc2)CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936025 1133072330 /nfs/dbraw/zinc/07/23/30/1133072330.db2.gz OJGMATXFUBRMSZ-PMACEKPBSA-N 1 0 340.423 3.725 20 5 EHBDRO CC(C)(C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-])C1CC1 ZINC001179680820 1133273812 /nfs/dbraw/zinc/27/38/12/1133273812.db2.gz CSYIXLCADWQKAV-UHFFFAOYSA-N 1 0 327.222 3.883 20 5 EHBDRO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC001180332804 1133362842 /nfs/dbraw/zinc/36/28/42/1133362842.db2.gz UMTRUPSFZBQVBH-IUODEOHRSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1nn(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c2cc([N+](=O)[O-])ccc12 ZINC000770669183 1133456897 /nfs/dbraw/zinc/45/68/97/1133456897.db2.gz BQOZKNXVQIFMKS-ZDUSSCGKSA-N 1 0 328.416 3.723 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000774146912 1133622066 /nfs/dbraw/zinc/62/20/66/1133622066.db2.gz JPAKVNZKPKFYBM-XOKHGSTOSA-N 1 0 346.406 3.807 20 5 EHBDRO CCC(CC)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)SC ZINC000774207820 1133634854 /nfs/dbraw/zinc/63/48/54/1133634854.db2.gz GECJHSNUDKAMGR-ZIAGYGMSSA-N 1 0 340.493 3.786 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1 ZINC000785617298 1133732676 /nfs/dbraw/zinc/73/26/76/1133732676.db2.gz YKBGQKLCOIWYJO-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000786810996 1133909651 /nfs/dbraw/zinc/90/96/51/1133909651.db2.gz WXYWMRHKFKRCGN-FUNAXGEOSA-N 1 0 346.814 3.975 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1ccc(F)cc1 ZINC000786819385 1133911018 /nfs/dbraw/zinc/91/10/18/1133911018.db2.gz BVYCCROTPWBWHT-LMICACPXSA-N 1 0 344.386 3.635 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CNC(=O)OC(C)(C)C ZINC000786821921 1133912112 /nfs/dbraw/zinc/91/21/12/1133912112.db2.gz WOGQWPQWVIXIDB-RNQWEJQRSA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1N1CC[NH+](CCc2ccccc2)CC1 ZINC001184702844 1133977636 /nfs/dbraw/zinc/97/76/36/1133977636.db2.gz HZGTYSXXHHTLAH-UHFFFAOYSA-N 1 0 345.830 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000774880672 1134096077 /nfs/dbraw/zinc/09/60/77/1134096077.db2.gz JJLIVGUIWBXTMK-GFCCVEGCSA-N 1 0 345.330 3.632 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908572 1134116155 /nfs/dbraw/zinc/11/61/55/1134116155.db2.gz MEMMKLBYYVSNCK-MRXNPFEDSA-N 1 0 343.383 3.956 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cc1F ZINC000788486379 1134131423 /nfs/dbraw/zinc/13/14/23/1134131423.db2.gz UUOAODKQRXVKBR-IBGZPJMESA-N 1 0 344.386 3.507 20 5 EHBDRO C[C@@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788805020 1134172100 /nfs/dbraw/zinc/17/21/00/1134172100.db2.gz ZYZBDNTULNQCFE-DJSGYFEHSA-N 1 0 329.375 3.913 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000789366167 1134263631 /nfs/dbraw/zinc/26/36/31/1134263631.db2.gz MZWUVRYPOGZWQO-LIRRHRJNSA-N 1 0 328.412 3.850 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789593103 1134302760 /nfs/dbraw/zinc/30/27/60/1134302760.db2.gz LYNGSLVEDKMEBX-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO CC[NH+](CC)CC[C@@H](C)Nc1c(Br)cccc1[N+](=O)[O-] ZINC001187921604 1134400727 /nfs/dbraw/zinc/40/07/27/1134400727.db2.gz XNRYHQPMMLRCKP-LLVKDONJSA-N 1 0 344.253 3.890 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170297975 1134737943 /nfs/dbraw/zinc/73/79/43/1134737943.db2.gz XFJJXXNHNXEOPA-OAHLLOKOSA-N 1 0 340.423 3.899 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccn1 ZINC001170304720 1134739405 /nfs/dbraw/zinc/73/94/05/1134739405.db2.gz GGSBPTCSSSKXPM-CZUORRHYSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327190 1134748174 /nfs/dbraw/zinc/74/81/74/1134748174.db2.gz FMLUCGAMKMCSCZ-HNNXBMFYSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326682 1134748625 /nfs/dbraw/zinc/74/86/25/1134748625.db2.gz BOOOAQJSJARJMU-CHWSQXEVSA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170329832 1134749276 /nfs/dbraw/zinc/74/92/76/1134749276.db2.gz VLHBXYQHMYVCNF-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170354805 1134754339 /nfs/dbraw/zinc/75/43/39/1134754339.db2.gz PJHYZANXPKHFPA-CQSZACIVSA-N 1 0 346.402 3.848 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346406 1134759824 /nfs/dbraw/zinc/75/98/24/1134759824.db2.gz NMMLDMXVCYYKEB-KBXCAEBGSA-N 1 0 341.411 3.767 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@]3(C)[C@H](C2)C3(Cl)Cl)cccc1[N+](=O)[O-] ZINC000792912189 1134824120 /nfs/dbraw/zinc/82/41/20/1134824120.db2.gz YXFLRGCSLQBZJY-UONOGXRCSA-N 1 0 329.227 3.919 20 5 EHBDRO Cc1ccc(CNC2CC[NH+](C3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000747100785 1134843192 /nfs/dbraw/zinc/84/31/92/1134843192.db2.gz UMWVXPAENIOXKC-UHFFFAOYSA-N 1 0 331.460 3.790 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443599 1134868189 /nfs/dbraw/zinc/86/81/89/1134868189.db2.gz CQSRDUZQAXIRIM-DNVCBOLYSA-N 1 0 326.396 3.852 20 5 EHBDRO CC[C@@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001191531666 1134879967 /nfs/dbraw/zinc/87/99/67/1134879967.db2.gz VHJLYVCDAZBWJI-QGZVFWFLSA-N 1 0 325.412 3.825 20 5 EHBDRO CC(=O)Nc1ccc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1[N+](=O)[O-] ZINC001170451851 1135077566 /nfs/dbraw/zinc/07/75/66/1135077566.db2.gz QLNNADCIWKHHRV-UHFFFAOYSA-N 1 0 348.447 3.617 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CC(C)(C)CC(C)(C)C1 ZINC001193103514 1135101414 /nfs/dbraw/zinc/10/14/14/1135101414.db2.gz ITJVUSLWFZMZKO-UHFFFAOYSA-N 1 0 347.459 3.990 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1OC ZINC001194090213 1135230752 /nfs/dbraw/zinc/23/07/52/1135230752.db2.gz DWAGFCSWPOEFHT-HUUCEWRRSA-N 1 0 326.824 3.932 20 5 EHBDRO O=C(CN1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1F ZINC001194477775 1135276878 /nfs/dbraw/zinc/27/68/78/1135276878.db2.gz QMGIVSOFHMCRFP-HNNXBMFYSA-N 1 0 342.370 3.796 20 5 EHBDRO Cc1ccc(CC(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC001195280473 1135404591 /nfs/dbraw/zinc/40/45/91/1135404591.db2.gz UGURCVSSABAOFK-UHFFFAOYSA-N 1 0 343.383 3.922 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@@]2(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])n1 ZINC001195758874 1135461007 /nfs/dbraw/zinc/46/10/07/1135461007.db2.gz WWDQJCRDEOLTOE-KRWDZBQOSA-N 1 0 348.834 3.579 20 5 EHBDRO O=C(C[N@@H+]1CCCC[C@@H]1CC1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC001196330482 1135546684 /nfs/dbraw/zinc/54/66/84/1135546684.db2.gz ZEXPNZGIFAECCE-OAHLLOKOSA-N 1 0 331.416 3.578 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2cc([N+](=O)[O-])ccc2C(C)=O)c1 ZINC000807935457 1135587949 /nfs/dbraw/zinc/58/79/49/1135587949.db2.gz NQUJSIQXVUAIIH-UHFFFAOYSA-N 1 0 341.411 3.861 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@H](C3CCOCC3)C2)cccc1[N+](=O)[O-] ZINC001197284444 1135672623 /nfs/dbraw/zinc/67/26/23/1135672623.db2.gz JGTZNBHWWQEXDY-SFHVURJKSA-N 1 0 332.444 3.932 20 5 EHBDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809733360 1135873932 /nfs/dbraw/zinc/87/39/32/1135873932.db2.gz UBKKECQRTMXIME-BEFAXECRSA-N 1 0 342.439 3.974 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[N@@H+]3CCCC[C@H]23)o1 ZINC001199345322 1135896335 /nfs/dbraw/zinc/89/63/35/1135896335.db2.gz QDLQPASTHANODS-SJLPKXTDSA-N 1 0 341.411 3.571 20 5 EHBDRO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCC[N@H+](C)C1 ZINC000809948632 1135905302 /nfs/dbraw/zinc/90/53/02/1135905302.db2.gz IHNYHNAISLFTOO-NSHDSACASA-N 1 0 346.258 3.675 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OCCOC)cc1)c1cccc([N+](=O)[O-])c1 ZINC001201491364 1136028197 /nfs/dbraw/zinc/02/81/97/1136028197.db2.gz IRJBXCILZWKPTK-LJQANCHMSA-N 1 0 344.411 3.861 20 5 EHBDRO CO[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483477 1136092176 /nfs/dbraw/zinc/09/21/76/1136092176.db2.gz JYKADJLSOLKYEW-NWDGAFQWSA-N 1 0 333.215 3.805 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279851 1136133693 /nfs/dbraw/zinc/13/36/93/1136133693.db2.gz ZELIPEADOGLSBY-HNAYVOBHSA-N 1 0 328.412 3.938 20 5 EHBDRO C[NH+](C)CCN(c1nc2ccc([N+](=O)[O-])cc2s1)C1CCCC1 ZINC000812475603 1136213168 /nfs/dbraw/zinc/21/31/68/1136213168.db2.gz RVDPPSUKUAUULU-UHFFFAOYSA-N 1 0 334.445 3.515 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@@H](O)c2ccccc21 ZINC000850528910 1136279040 /nfs/dbraw/zinc/27/90/40/1136279040.db2.gz OEBDOXVGDXKTLM-OMWUSAIZSA-N 1 0 326.396 3.684 20 5 EHBDRO CC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCO1 ZINC000338942167 1136435757 /nfs/dbraw/zinc/43/57/57/1136435757.db2.gz DPXQDGYYEIBTFW-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577920 1136443400 /nfs/dbraw/zinc/44/34/00/1136443400.db2.gz AUNCZIKSTMFHCU-KRWDZBQOSA-N 1 0 334.803 3.804 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccc(F)c1 ZINC000776591047 1136450967 /nfs/dbraw/zinc/45/09/67/1136450967.db2.gz GIIUWOLGLOPWRV-UPRAQXHNSA-N 1 0 344.386 3.850 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591983 1136452847 /nfs/dbraw/zinc/45/28/47/1136452847.db2.gz NPISFMFRSPXBHL-NIKGAXFTSA-N 1 0 326.396 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)cc1 ZINC000852427124 1136455347 /nfs/dbraw/zinc/45/53/47/1136455347.db2.gz STCNJWMFCBFGOL-FUHWJXTLSA-N 1 0 342.395 3.839 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc2c(c1)CCCO2 ZINC000852782404 1136486487 /nfs/dbraw/zinc/48/64/87/1136486487.db2.gz PECSITJEPGEJAW-GFCCVEGCSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000815150438 1136563159 /nfs/dbraw/zinc/56/31/59/1136563159.db2.gz CLBQEFMMUSAIPN-AWEZNQCLSA-N 1 0 326.824 3.527 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555002 1136610160 /nfs/dbraw/zinc/61/01/60/1136610160.db2.gz NRBNNKZABYORFG-OLZOCXBDSA-N 1 0 329.400 3.906 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815554954 1136610339 /nfs/dbraw/zinc/61/03/39/1136610339.db2.gz MXCOANZENPHHGS-VXGBXAGGSA-N 1 0 345.399 3.606 20 5 EHBDRO C[C@@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626532 1136620955 /nfs/dbraw/zinc/62/09/55/1136620955.db2.gz GMECIVRALUKRJI-BZNIZROVSA-N 1 0 349.818 3.605 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](C)C(C)C ZINC000112659431 1136644149 /nfs/dbraw/zinc/64/41/49/1136644149.db2.gz RMHVWJFCUJPNRJ-LLVKDONJSA-N 1 0 327.812 3.553 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000776820374 1136701688 /nfs/dbraw/zinc/70/16/88/1136701688.db2.gz DKWGQXSDSUCMPO-LZWOXQAQSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H]1CC12CCSCC2 ZINC000817411224 1136805846 /nfs/dbraw/zinc/80/58/46/1136805846.db2.gz PSHVEWHFEAAXJD-LBPRGKRZSA-N 1 0 326.849 3.871 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818985128 1136897201 /nfs/dbraw/zinc/89/72/01/1136897201.db2.gz OUWANCBLAVRVKU-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000819091926 1136907288 /nfs/dbraw/zinc/90/72/88/1136907288.db2.gz OKRRUHAVUFAHKE-IBGZPJMESA-N 1 0 328.412 3.549 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000819279504 1136931075 /nfs/dbraw/zinc/93/10/75/1136931075.db2.gz MPAOCQPPHBPRMH-DKSSEZFCSA-N 1 0 344.386 3.693 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586370 1137021609 /nfs/dbraw/zinc/02/16/09/1137021609.db2.gz NNUFMVNEJLHNMS-KXBFYZLASA-N 1 0 326.396 3.639 20 5 EHBDRO C[NH+](C)C[C@@H](NCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282827204 1137021711 /nfs/dbraw/zinc/02/17/11/1137021711.db2.gz NTDGPCCRBWUGOI-CQSZACIVSA-N 1 0 339.848 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2(c3c(F)cccc3F)CCC2)cc1 ZINC000860203961 1137049430 /nfs/dbraw/zinc/04/94/30/1137049430.db2.gz VEWXKZHXOVMCHK-INIZCTEOSA-N 1 0 348.349 3.575 20 5 EHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000825299786 1137172018 /nfs/dbraw/zinc/17/20/18/1137172018.db2.gz OGIMLHYRWCZHFI-RTBURBONSA-N 1 0 347.459 3.501 20 5 EHBDRO [NH3+][C@H]1CCc2c3ccccc3n(-c3cc4cc[nH]c4c([N+](=O)[O-])c3)c2C1 ZINC001171094856 1137187010 /nfs/dbraw/zinc/18/70/10/1137187010.db2.gz QRKFHPWLGVYSIO-ZDUSSCGKSA-N 1 0 346.390 3.836 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C=C(C)C ZINC001143926530 1137213332 /nfs/dbraw/zinc/21/33/32/1137213332.db2.gz WMJYFMCSRGFGLY-UHFFFAOYSA-N 1 0 335.407 3.861 20 5 EHBDRO C[C@@H](CSc1ccccc1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362093 1137215383 /nfs/dbraw/zinc/21/53/83/1137215383.db2.gz XSEZFLYHLCEVTM-KSSFIOAISA-N 1 0 346.452 3.741 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000119969651 1137221410 /nfs/dbraw/zinc/22/14/10/1137221410.db2.gz PMDWQFCEGBLBMJ-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@H+](CC1CC1)C1CCCCC1 ZINC000794626672 1137221673 /nfs/dbraw/zinc/22/16/73/1137221673.db2.gz KUPVMHHWMUSNLV-UHFFFAOYSA-N 1 0 345.399 3.505 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000866238597 1137337831 /nfs/dbraw/zinc/33/78/31/1137337831.db2.gz PZLWRYNNLCRIBK-SUMWQHHRSA-N 1 0 348.422 3.566 20 5 EHBDRO CC(C)n1cc([C@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cn1 ZINC000866265579 1137340625 /nfs/dbraw/zinc/34/06/25/1137340625.db2.gz NVRRDDJOGDEPRN-STQMWFEESA-N 1 0 334.395 3.793 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000866421712 1137353267 /nfs/dbraw/zinc/35/32/67/1137353267.db2.gz XSFDIQHXJWAHAD-CQSZACIVSA-N 1 0 342.395 3.665 20 5 EHBDRO C[C@@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@@H+](C2CCC2)C1 ZINC000795119013 1137491728 /nfs/dbraw/zinc/49/17/28/1137491728.db2.gz BAROTQSWAZVRAH-CYBMUJFWSA-N 1 0 337.851 3.554 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CCC(C)([NH+](C)C)CC1 ZINC000871359414 1137539155 /nfs/dbraw/zinc/53/91/55/1137539155.db2.gz GGGVBQQCZWHVSK-UHFFFAOYSA-N 1 0 347.459 3.513 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCn1nc(C)cc1C ZINC000872018245 1137564690 /nfs/dbraw/zinc/56/46/90/1137564690.db2.gz KJQNYQWZAYRTMY-AWEZNQCLSA-N 1 0 348.472 3.871 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1ccncc1 ZINC000872041699 1137567179 /nfs/dbraw/zinc/56/71/79/1137567179.db2.gz KEZSFFSMZBWTDY-OLZOCXBDSA-N 1 0 331.441 3.994 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000872044047 1137567346 /nfs/dbraw/zinc/56/73/46/1137567346.db2.gz PUECNKNZWYUBFG-YUDUHTQSSA-N 1 0 336.457 3.925 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1cc(C)n[nH]1 ZINC000872049626 1137567779 /nfs/dbraw/zinc/56/77/79/1137567779.db2.gz UHWNETMYKFWAGM-JQWIXIFHSA-N 1 0 334.445 3.630 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)C[C@@H](C)O ZINC000872050227 1137567969 /nfs/dbraw/zinc/56/79/69/1137567969.db2.gz XMUJDNJEAXBTDP-VXGBXAGGSA-N 1 0 326.462 3.764 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1 ZINC000872086901 1137570629 /nfs/dbraw/zinc/57/06/29/1137570629.db2.gz CASCTAWVXQNKIH-SJCJKPOMSA-N 1 0 348.374 3.781 20 5 EHBDRO C[C@H]([NH2+]C1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000872129542 1137573103 /nfs/dbraw/zinc/57/31/03/1137573103.db2.gz LFMAGYQFAWJQTD-AWEZNQCLSA-N 1 0 347.459 3.673 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccnc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000873131023 1137590869 /nfs/dbraw/zinc/59/08/69/1137590869.db2.gz JCPPVMVKUGIFPY-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO Cc1c(C[NH2+]C(c2ccccc2)C(O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138764 1137591230 /nfs/dbraw/zinc/59/12/30/1137591230.db2.gz MPVLWTWLLQXQRF-RBUKOAKNSA-N 1 0 328.412 3.751 20 5 EHBDRO CC1(C)CO[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000873156407 1137591753 /nfs/dbraw/zinc/59/17/53/1137591753.db2.gz WMCYODAMAUXWLS-OAHLLOKOSA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]CC3(c4ccccc4)CCCC3)C2)c1 ZINC000876919312 1137665367 /nfs/dbraw/zinc/66/53/67/1137665367.db2.gz SUNNARZQVSIEEJ-UHFFFAOYSA-N 1 0 340.427 3.596 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CCC[C@H](c4ccccc4)C3)C2)c1 ZINC000877475086 1137677503 /nfs/dbraw/zinc/67/75/03/1137677503.db2.gz LTLUYUICJAVZAL-KNXWPPODSA-N 1 0 340.427 3.811 20 5 EHBDRO Cc1c(Cl)cccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000877484219 1137677877 /nfs/dbraw/zinc/67/78/77/1137677877.db2.gz XVTOZCVNOILVAS-UHFFFAOYSA-N 1 0 334.807 3.590 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(Cl)c(Cl)c3)C2)c1 ZINC000877630891 1137683624 /nfs/dbraw/zinc/68/36/24/1137683624.db2.gz OKCYCRXHNSNEDN-UHFFFAOYSA-N 1 0 341.198 3.591 20 5 EHBDRO CC(C)(C)OC1CCC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000877683188 1137685767 /nfs/dbraw/zinc/68/57/67/1137685767.db2.gz ZYLOSNKEUNZSJO-UHFFFAOYSA-N 1 0 347.415 3.952 20 5 EHBDRO CC(C)(C)c1ccc(C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)s1 ZINC000877805150 1137690369 /nfs/dbraw/zinc/69/03/69/1137690369.db2.gz KNNFLDCKXOPMHG-UHFFFAOYSA-N 1 0 334.445 3.644 20 5 EHBDRO Cc1csc([C@H]2CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813826 1137690967 /nfs/dbraw/zinc/69/09/67/1137690967.db2.gz PKNJCVQOEWWUBX-VOKGJARPSA-N 1 0 329.425 3.862 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827759 1137692433 /nfs/dbraw/zinc/69/24/33/1137692433.db2.gz OQNCLXKJNSNZEU-UTWWPYJBSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@@H](C1CC1)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877929850 1137695991 /nfs/dbraw/zinc/69/59/91/1137695991.db2.gz ORXHGQGFQSOOQG-VIFPVBQESA-N 1 0 336.779 3.529 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH+]2CCC3(CC3)CC2)o1 ZINC000878317507 1137710822 /nfs/dbraw/zinc/71/08/22/1137710822.db2.gz RZHPJXQNJQPQJK-UHFFFAOYSA-N 1 0 348.790 3.674 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC[C@@H](C)C1 ZINC000878691185 1137725223 /nfs/dbraw/zinc/72/52/23/1137725223.db2.gz LCACKYPKEMQJTG-HZSPNIEDSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H](NCc1cc(F)ccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880097376 1137768017 /nfs/dbraw/zinc/76/80/17/1137768017.db2.gz PWPPIANEMCFYQV-SECBINFHSA-N 1 0 343.280 3.999 20 5 EHBDRO COCc1c(C)cc(C)c(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1C ZINC000882897546 1137837265 /nfs/dbraw/zinc/83/72/65/1137837265.db2.gz LWDROETVGWKYTO-UHFFFAOYSA-N 1 0 328.412 3.956 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1CCC2(CCC2)O1)C1CC1 ZINC000883356420 1137857220 /nfs/dbraw/zinc/85/72/20/1137857220.db2.gz NLBXLAAKNAOKMR-DLBZAZTESA-N 1 0 330.428 3.607 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000120892292 1137953349 /nfs/dbraw/zinc/95/33/49/1137953349.db2.gz USEULXKZIHDBAB-CYBMUJFWSA-N 1 0 328.368 3.607 20 5 EHBDRO O=[N+]([O-])c1cnc(NC2CC[NH+](C3CCC3)CC2)c2ccccc21 ZINC000884524125 1137962146 /nfs/dbraw/zinc/96/21/46/1137962146.db2.gz PKCUTGQNEJKSML-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC000884582468 1137963752 /nfs/dbraw/zinc/96/37/52/1137963752.db2.gz DCZCZRKOFRRWHQ-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO CO[C@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000886057878 1138036402 /nfs/dbraw/zinc/03/64/02/1138036402.db2.gz ZZJUWEJYGYUSDR-CABCVRRESA-N 1 0 326.824 3.728 20 5 EHBDRO COc1ccccc1[C@@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886310345 1138066446 /nfs/dbraw/zinc/06/64/46/1138066446.db2.gz JWXBOGMCQZVIHG-OAHLLOKOSA-N 1 0 341.411 3.768 20 5 EHBDRO CC(C)[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cnn(C)c1 ZINC000886586522 1138099753 /nfs/dbraw/zinc/09/97/53/1138099753.db2.gz TUCBESSFPVBYQA-MRXNPFEDSA-N 1 0 336.823 3.511 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc(C(=O)N(C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000124046055 1138278420 /nfs/dbraw/zinc/27/84/20/1138278420.db2.gz KRLWWRKTKRWQEQ-GOSISDBHSA-N 1 0 341.411 3.538 20 5 EHBDRO CCC[C@@H]([NH2+]CC[S@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424625 1138357298 /nfs/dbraw/zinc/35/72/98/1138357298.db2.gz TZWCMGNELWAFEP-IVZQSRNASA-N 1 0 326.462 3.573 20 5 EHBDRO O=C(CC[NH2+][C@@H](c1cccs1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000336967963 1138437412 /nfs/dbraw/zinc/43/74/12/1138437412.db2.gz AGEVQRFKNFNFSZ-QGZVFWFLSA-N 1 0 345.424 3.726 20 5 EHBDRO C[C@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000301489400 1138566612 /nfs/dbraw/zinc/56/66/12/1138566612.db2.gz RKFAIELMNNVEKE-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570211 1139098450 /nfs/dbraw/zinc/09/84/50/1139098450.db2.gz DLYYNJPGUGGIDL-CZUORRHYSA-N 1 0 347.415 3.540 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C[NH+](C)C)ccc2C)c1 ZINC000177340319 1139614096 /nfs/dbraw/zinc/61/40/96/1139614096.db2.gz DHZWOWXEHUNHOQ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000179403297 1139755283 /nfs/dbraw/zinc/75/52/83/1139755283.db2.gz UGEZCLIIXUHIFY-LLVKDONJSA-N 1 0 335.791 3.893 20 5 EHBDRO Cc1cnn([C@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760526 1139991006 /nfs/dbraw/zinc/99/10/06/1139991006.db2.gz CXSDBPBANURGEM-RDJZCZTQSA-N 1 0 328.416 3.806 20 5 EHBDRO CC1(C)OCc2cc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)ccc2O1 ZINC000187334831 1140250404 /nfs/dbraw/zinc/25/04/04/1140250404.db2.gz QFCXVVWFLDUMMJ-UHFFFAOYSA-N 1 0 342.395 3.572 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000192633107 1140541423 /nfs/dbraw/zinc/54/14/23/1140541423.db2.gz KJMAVHWFWCEMQZ-KRWDZBQOSA-N 1 0 330.359 3.910 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccsc1)[NH+](C)C ZINC000266973708 1140745610 /nfs/dbraw/zinc/74/56/10/1140745610.db2.gz MUDFIWMOCZYOAH-INIZCTEOSA-N 1 0 335.429 3.518 20 5 EHBDRO COc1ccc([C@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000269640038 1141130639 /nfs/dbraw/zinc/13/06/39/1141130639.db2.gz BXKFPZSCBVPUQJ-RTBURBONSA-N 1 0 344.411 3.624 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687371 1141135376 /nfs/dbraw/zinc/13/53/76/1141135376.db2.gz TVZMAYBXGOUAOA-MSOLQXFVSA-N 1 0 330.359 3.604 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCC[C@@H]1O ZINC000270170608 1141187947 /nfs/dbraw/zinc/18/79/47/1141187947.db2.gz UGPBAVRPUOMXHN-QAPCUYQASA-N 1 0 337.419 3.539 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccncc1 ZINC000271136735 1141312667 /nfs/dbraw/zinc/31/26/67/1141312667.db2.gz NIKXHEMQDUAYGN-HNNXBMFYSA-N 1 0 331.441 3.693 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1CCOCC1 ZINC000271167025 1141317172 /nfs/dbraw/zinc/31/71/72/1141317172.db2.gz SWPQOAPNEPCVSP-DZGCQCFKSA-N 1 0 338.473 3.870 20 5 EHBDRO Cn1cc(C[NH2+]C2C(C)(C)C2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000349133449 1141643176 /nfs/dbraw/zinc/64/31/76/1141643176.db2.gz UZZXRVHQANGCHS-UHFFFAOYSA-N 1 0 328.416 3.520 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccccc1 ZINC000097466711 219026398 /nfs/dbraw/zinc/02/63/98/219026398.db2.gz ZITYVUMSOWUFGH-GOSISDBHSA-N 1 0 336.395 3.858 20 5 EHBDRO CC[NH+](CC)C1CCN(c2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC001165054291 722002634 /nfs/dbraw/zinc/00/26/34/722002634.db2.gz VZDNXPZBFJGEKV-UHFFFAOYSA-N 1 0 347.246 3.607 20 5 EHBDRO CCC1(O)CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000536662168 1032078813 /nfs/dbraw/zinc/07/88/13/1032078813.db2.gz PDBZIXQLKKFAHC-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOc1cccc(F)c1)C1CC1 ZINC000537992330 1032084786 /nfs/dbraw/zinc/08/47/86/1032084786.db2.gz UBLZAKBRBITCSU-GOSISDBHSA-N 1 0 344.386 3.724 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C1[C@@H](C)CCC[C@@H]1C ZINC000557594302 1014221377 /nfs/dbraw/zinc/22/13/77/1014221377.db2.gz YMKOBWHYVBPCOJ-STQMWFEESA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)C[C@H]([NH3+])c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000339391236 1014325216 /nfs/dbraw/zinc/32/52/16/1014325216.db2.gz AAHYHUYZMSRWRW-ZDUSSCGKSA-N 1 0 332.404 3.988 20 5 EHBDRO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302045563 1014945030 /nfs/dbraw/zinc/94/50/30/1014945030.db2.gz KILYNVKOMMVPCN-NEPJUHHUSA-N 1 0 338.839 3.708 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN(C)Cc1ccc(Cl)s1 ZINC000430215116 1015034056 /nfs/dbraw/zinc/03/40/56/1015034056.db2.gz BSOXJHQAOPYVAY-UHFFFAOYSA-N 1 0 326.805 3.950 20 5 EHBDRO CC(=O)N1CC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000339762407 1015657746 /nfs/dbraw/zinc/65/77/46/1015657746.db2.gz HUNQPRZUTPSSSP-FZKQIMNGSA-N 1 0 339.395 3.743 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)n1 ZINC000247132418 1016597551 /nfs/dbraw/zinc/59/75/51/1016597551.db2.gz VPEOTBVGWDMZPF-XJKSGUPXSA-N 1 0 346.456 3.855 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)CC[C@@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000189929002 1016781034 /nfs/dbraw/zinc/78/10/34/1016781034.db2.gz ZZCCUGAZLFJOPE-INIZCTEOSA-N 1 0 347.459 3.665 20 5 EHBDRO COc1ccc(C)cc1CC[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449069496 1032151777 /nfs/dbraw/zinc/15/17/77/1032151777.db2.gz XLJBYFATVAHFTM-HNNXBMFYSA-N 1 0 328.412 3.675 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)O1 ZINC000414512836 1016946564 /nfs/dbraw/zinc/94/65/64/1016946564.db2.gz JCPYWWNMTZYQRM-VNHYZAJKSA-N 1 0 330.384 3.758 20 5 EHBDRO C[C@H](CC[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000376651105 1016953881 /nfs/dbraw/zinc/95/38/81/1016953881.db2.gz JOMDNCHTNUZNQL-OAHLLOKOSA-N 1 0 328.416 3.622 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414531015 1016960904 /nfs/dbraw/zinc/96/09/04/1016960904.db2.gz RFZFRXRGWSDRCT-MRXNPFEDSA-N 1 0 346.402 3.723 20 5 EHBDRO Cc1csc(CCCC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])n1 ZINC000449116029 1032209008 /nfs/dbraw/zinc/20/90/08/1032209008.db2.gz JTGFAJNPYIVFCP-ZDUSSCGKSA-N 1 0 333.457 3.903 20 5 EHBDRO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc([C@H]([NH3+])CC(C)C)no1 ZINC000414626516 1017077440 /nfs/dbraw/zinc/07/74/40/1017077440.db2.gz YDWDRRHQFYDRDI-UKRRQHHQSA-N 1 0 332.404 3.760 20 5 EHBDRO COc1ccc([C@H](C)C[N@@H+]2CCc3c(cccc3[N+](=O)[O-])C2)cc1 ZINC000538279536 1032267077 /nfs/dbraw/zinc/26/70/77/1032267077.db2.gz KEMYBECXNGQSGT-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO C[C@H](COCc1ccccc1)[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449176131 1032268670 /nfs/dbraw/zinc/26/86/70/1032268670.db2.gz SCVSYEHTKFDIQX-HZPDHXFCSA-N 1 0 328.412 3.721 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@H]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC000449191526 1032285949 /nfs/dbraw/zinc/28/59/49/1032285949.db2.gz KJJMSHAOGXBERW-INIZCTEOSA-N 1 0 346.818 3.670 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])nc21 ZINC000449180090 1032294108 /nfs/dbraw/zinc/29/41/08/1032294108.db2.gz YACASDBFFVGIQQ-CQSZACIVSA-N 1 0 339.395 3.808 20 5 EHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609980 1032326669 /nfs/dbraw/zinc/32/66/69/1032326669.db2.gz KAEMWYLJRDKTIT-SJKOYZFVSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622518 1032334366 /nfs/dbraw/zinc/33/43/66/1032334366.db2.gz YKHNGMOLPDLXTB-PXAZEXFGSA-N 1 0 330.388 3.703 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)CCCc2cccnc2)c([N+](=O)[O-])cc1F ZINC000459644198 1032367593 /nfs/dbraw/zinc/36/75/93/1032367593.db2.gz WHHMFOMSHZDVOE-ZDUSSCGKSA-N 1 0 347.390 3.639 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH2+][C@H]3CCC[C@@H]4C[C@@H]43)o2)c1 ZINC000459788933 1032474835 /nfs/dbraw/zinc/47/48/35/1032474835.db2.gz RARAWLITNKZWIK-KCXAZCMYSA-N 1 0 327.384 3.571 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000449335512 1032470845 /nfs/dbraw/zinc/47/08/45/1032470845.db2.gz JEXVFVTXSZMQQL-HOCLYGCPSA-N 1 0 343.402 3.533 20 5 EHBDRO CCC[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000459802957 1032482470 /nfs/dbraw/zinc/48/24/70/1032482470.db2.gz NGVCWMGEBLKUKR-KRWDZBQOSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000449367960 1032483086 /nfs/dbraw/zinc/48/30/86/1032483086.db2.gz AKXXTMGYWPMCGR-HYXAFXHYSA-N 1 0 330.428 3.625 20 5 EHBDRO [NH3+][C@H]1CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000414648269 1017096462 /nfs/dbraw/zinc/09/64/62/1017096462.db2.gz AUMZFTGJZWYFQO-AWEZNQCLSA-N 1 0 347.802 3.574 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000449379146 1032505628 /nfs/dbraw/zinc/50/56/28/1032505628.db2.gz GWMMPMDAULUGDD-VGVVRCBHSA-N 1 0 332.322 3.555 20 5 EHBDRO CO[C@@](C)(C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449484542 1032634262 /nfs/dbraw/zinc/63/42/62/1032634262.db2.gz MTGPUWAZPZPPKZ-RQMBKDMJSA-N 1 0 326.396 3.759 20 5 EHBDRO C[NH2+]C[C@H]1CCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414658911 1017108068 /nfs/dbraw/zinc/10/80/68/1017108068.db2.gz KKJHHDZZPOMKCL-CYBMUJFWSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H](C[NH3+])N(C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414668093 1017117651 /nfs/dbraw/zinc/11/76/51/1017117651.db2.gz YPFYHMQAGKQTEB-LBPRGKRZSA-N 1 0 349.818 3.820 20 5 EHBDRO COCc1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502975 1032685085 /nfs/dbraw/zinc/68/50/85/1032685085.db2.gz SKXOIUCLSDJHTH-HNNXBMFYSA-N 1 0 330.384 3.714 20 5 EHBDRO CC1(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]CC1 ZINC000414936312 1017331479 /nfs/dbraw/zinc/33/14/79/1017331479.db2.gz GUTGJIOCQWHRBA-UHFFFAOYSA-N 1 0 349.818 3.740 20 5 EHBDRO C[C@@H]1[NH2+]CCC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414951486 1017352321 /nfs/dbraw/zinc/35/23/21/1017352321.db2.gz JBUJSQUPLGQWKD-LRDDRELGSA-N 1 0 331.441 3.553 20 5 EHBDRO C[C@H](c1ccccc1)N1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000176835330 1017480132 /nfs/dbraw/zinc/48/01/32/1017480132.db2.gz LCHMBGLOCYKIQB-APWZRJJASA-N 1 0 339.439 3.562 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000610281963 1017615078 /nfs/dbraw/zinc/61/50/78/1017615078.db2.gz OLFSPAKKHCNUOI-INIZCTEOSA-N 1 0 345.830 3.959 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000177365919 1017646094 /nfs/dbraw/zinc/64/60/94/1017646094.db2.gz CJPBOGXAAATUHE-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000177481607 1017678989 /nfs/dbraw/zinc/67/89/89/1017678989.db2.gz OKSOUZHUSCNGTL-KKUMJFAQSA-N 1 0 341.411 3.704 20 5 EHBDRO [NH3+]Cc1cnc2c(ccn2-c2ncnc3cc4ccccc4cc32)c1 ZINC001167308620 1017756137 /nfs/dbraw/zinc/75/61/37/1017756137.db2.gz SXSAJQUBIJMSBE-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO Cc1cc(NC(=O)N[C@H](CCC[NH3+])c2ccccc2)ccc1[N+](=O)[O-] ZINC000415421326 1018001737 /nfs/dbraw/zinc/00/17/37/1018001737.db2.gz UOGMCDASSKKJMR-MRXNPFEDSA-N 1 0 342.399 3.505 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000574200716 1032738415 /nfs/dbraw/zinc/73/84/15/1032738415.db2.gz DWIHXFTUGXXKOY-DHZHZOJOSA-N 1 0 325.412 3.806 20 5 EHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410597 1018933302 /nfs/dbraw/zinc/93/33/02/1018933302.db2.gz VJCAACNBIZWXAK-JQWIXIFHSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H]1[C@@H](C)[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000419379860 1019008654 /nfs/dbraw/zinc/00/86/54/1019008654.db2.gz XEZWWNMHLYQYCG-HZSPNIEDSA-N 1 0 329.400 3.769 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CO)C2CCCC2)s1 ZINC000580367075 1019201006 /nfs/dbraw/zinc/20/10/06/1019201006.db2.gz LXVXRPDHPFKLEZ-MRXNPFEDSA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[C@@H](CO)C1 ZINC000579628286 1019329634 /nfs/dbraw/zinc/32/96/34/1019329634.db2.gz MLLFPJVMIRFMDO-MJQMVNBJSA-N 1 0 346.471 3.694 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000580519534 1019539974 /nfs/dbraw/zinc/53/99/74/1019539974.db2.gz CBJVEBXAEINEIS-GOSISDBHSA-N 1 0 328.416 3.595 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)Cc1cccn1C ZINC000129334447 1019560204 /nfs/dbraw/zinc/56/02/04/1019560204.db2.gz LARSQFOMRDUEHQ-UHFFFAOYSA-N 1 0 325.368 3.825 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1 ZINC000610452221 1019833495 /nfs/dbraw/zinc/83/34/95/1019833495.db2.gz YRUMEWZXMUFDBU-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182955972 1019852780 /nfs/dbraw/zinc/85/27/80/1019852780.db2.gz NQERNQCGGRZCJV-RYUDHWBXSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000449614109 1032887494 /nfs/dbraw/zinc/88/74/94/1032887494.db2.gz FKMLUPXBNCALDY-FOMSVSHPSA-N 1 0 339.395 3.513 20 5 EHBDRO C[N@H+](CCc1nccs1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602482026 1032911488 /nfs/dbraw/zinc/91/14/88/1032911488.db2.gz FDSBDDBGDIPKSU-UHFFFAOYSA-N 1 0 345.346 3.745 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)CNc1ncc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000413117166 1020700214 /nfs/dbraw/zinc/70/02/14/1020700214.db2.gz IMFPPPKNNHNPQJ-LBPRGKRZSA-N 1 0 332.379 3.670 20 5 EHBDRO COc1cc(NC[C@H](C)[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000361029389 1020891346 /nfs/dbraw/zinc/89/13/46/1020891346.db2.gz HBDLOIFIXAANJD-AWEZNQCLSA-N 1 0 329.400 3.536 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCc2cccs2)cc1Br ZINC000602503906 1032938876 /nfs/dbraw/zinc/93/88/76/1032938876.db2.gz OJLFYHAISAUHHC-UHFFFAOYSA-N 1 0 347.259 3.813 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+]C(C)(C)c1ccccc1 ZINC000507367084 1021219722 /nfs/dbraw/zinc/21/97/22/1021219722.db2.gz BPZHMOMBZKADHK-UHFFFAOYSA-N 1 0 341.411 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@@H]4C3)CC2)cn1 ZINC000602555419 1032970532 /nfs/dbraw/zinc/97/05/32/1032970532.db2.gz HMKWHFGXXWDWTI-ZMSDIMECSA-N 1 0 344.459 3.517 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000602561171 1032973834 /nfs/dbraw/zinc/97/38/34/1032973834.db2.gz DJICJUUYNGPHAP-LLVKDONJSA-N 1 0 339.317 3.902 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000602568627 1032979228 /nfs/dbraw/zinc/97/92/28/1032979228.db2.gz LBHVEMXLOMOYKP-CYBMUJFWSA-N 1 0 344.333 3.805 20 5 EHBDRO C[C@H](CC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414897591 1021517061 /nfs/dbraw/zinc/51/70/61/1021517061.db2.gz RWGCAALBHGRHMM-GFCCVEGCSA-N 1 0 349.818 3.867 20 5 EHBDRO COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2C)[NH+](C)C)c1 ZINC000097262012 1021637585 /nfs/dbraw/zinc/63/75/85/1021637585.db2.gz MDTJFJBZLOWBLK-SFHVURJKSA-N 1 0 329.400 3.627 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC2CC[NH+](CC3CCCC3)CC2)c1 ZINC000519710267 1021642368 /nfs/dbraw/zinc/64/23/68/1021642368.db2.gz LHBDVAZXIQKENE-UHFFFAOYSA-N 1 0 333.432 3.670 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602582216 1033002286 /nfs/dbraw/zinc/00/22/86/1033002286.db2.gz MFRCTUALILCRFT-FZMZJTMJSA-N 1 0 332.322 3.518 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000023898976 1021885379 /nfs/dbraw/zinc/88/53/79/1021885379.db2.gz JTGIGLKKIQHWSM-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO C[C@@H]1CCCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000187517764 1022277032 /nfs/dbraw/zinc/27/70/32/1022277032.db2.gz ILFORVQHCLXOQP-CQSZACIVSA-N 1 0 328.416 3.617 20 5 EHBDRO COc1cc2c(cc1Cl)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC2 ZINC000550111961 1022472724 /nfs/dbraw/zinc/47/27/24/1022472724.db2.gz HEAUDCWBKUVPBN-UHFFFAOYSA-N 1 0 346.814 3.858 20 5 EHBDRO CC(C)(C)C[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000341594821 1022473435 /nfs/dbraw/zinc/47/34/35/1022473435.db2.gz NTFOVXBMSZHTJD-KRWDZBQOSA-N 1 0 343.427 3.524 20 5 EHBDRO COc1cc(CN2CCC[C@@H]2c2cccc(C)n2)c([N+](=O)[O-])cc1F ZINC000184237912 1022605166 /nfs/dbraw/zinc/60/51/66/1022605166.db2.gz WDLBTQRSIZCYDN-MRXNPFEDSA-N 1 0 345.374 3.783 20 5 EHBDRO CC(C)(C)[C@H]1CCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602695070 1033076938 /nfs/dbraw/zinc/07/69/38/1033076938.db2.gz WGVJKGKGWLJMLT-DLBZAZTESA-N 1 0 346.475 3.763 20 5 EHBDRO CCN(CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CCC(F)(F)F ZINC000426069265 1022808182 /nfs/dbraw/zinc/80/81/82/1022808182.db2.gz IELTUDLOBZBDLE-LBPRGKRZSA-N 1 0 333.354 3.520 20 5 EHBDRO Cc1ncc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684815 1033084692 /nfs/dbraw/zinc/08/46/92/1033084692.db2.gz IQIBPTJSJWHWRW-RHSMWYFYSA-N 1 0 340.427 3.942 20 5 EHBDRO Cc1ncc([C@@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684814 1033085135 /nfs/dbraw/zinc/08/51/35/1033085135.db2.gz IQIBPTJSJWHWRW-PBHICJAKSA-N 1 0 340.427 3.942 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CC[C@@H]3C[C@@H]3C2)cc1Br ZINC000602701979 1033090261 /nfs/dbraw/zinc/09/02/61/1033090261.db2.gz GPDUZICKZPEMNF-IWSPIJDZSA-N 1 0 331.235 3.697 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602705604 1033093398 /nfs/dbraw/zinc/09/33/98/1033093398.db2.gz NOCHQDPTUQDILF-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@H]1C[C@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944939 1022958043 /nfs/dbraw/zinc/95/80/43/1022958043.db2.gz HRKYYBAYAJVPBA-NWDGAFQWSA-N 1 0 349.818 3.738 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@@H]1CCCOC1 ZINC000602720248 1033105829 /nfs/dbraw/zinc/10/58/29/1033105829.db2.gz FRRBUOCBJWIPMT-NSHDSACASA-N 1 0 332.322 3.520 20 5 EHBDRO Cc1[nH]nc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc12 ZINC000507173577 1023174108 /nfs/dbraw/zinc/17/41/08/1023174108.db2.gz OAAKNKVPBRGBEM-UHFFFAOYSA-N 1 0 339.399 3.585 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507233864 1023207099 /nfs/dbraw/zinc/20/70/99/1023207099.db2.gz PPZXYOSDYYOSFS-LIRRHRJNSA-N 1 0 326.396 3.902 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCCC23CC3)cc1Br ZINC000602727569 1033114733 /nfs/dbraw/zinc/11/47/33/1033114733.db2.gz CXGBFVXPAGRRDW-JTQLQIEISA-N 1 0 331.235 3.841 20 5 EHBDRO CCc1ccc(C(=O)NCCCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000471930647 1023307587 /nfs/dbraw/zinc/30/75/87/1023307587.db2.gz AUGXNNHHCXEBRV-UHFFFAOYSA-N 1 0 347.459 3.543 20 5 EHBDRO Cc1cc(Cc2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957897 1023475770 /nfs/dbraw/zinc/47/57/70/1023475770.db2.gz RLZMSMCAIJCYDB-MCIONIFRSA-N 1 0 344.415 3.811 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610809664 1023695296 /nfs/dbraw/zinc/69/52/96/1023695296.db2.gz LYGFUOHVPVCPQX-CQSZACIVSA-N 1 0 329.400 3.774 20 5 EHBDRO CC[C@@H]([NH2+]CCN1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000610805568 1023702348 /nfs/dbraw/zinc/70/23/48/1023702348.db2.gz AFZDRRKMAWGCOT-LJQANCHMSA-N 1 0 325.412 3.651 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+][C@H]2C[C@@H](O)C2)cc1 ZINC000449749391 1033165143 /nfs/dbraw/zinc/16/51/43/1033165143.db2.gz PCFDCMHSAQOPBN-OKILXGFUSA-N 1 0 348.786 3.653 20 5 EHBDRO CC(C)([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)c(Cl)c1 ZINC000176224430 1023899810 /nfs/dbraw/zinc/89/98/10/1023899810.db2.gz PVGIZMDRWVDWOL-UHFFFAOYSA-N 1 0 343.214 3.623 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610996949 1023993360 /nfs/dbraw/zinc/99/33/60/1023993360.db2.gz OLHBDIGMWGEXPY-CQSZACIVSA-N 1 0 334.416 3.711 20 5 EHBDRO C[C@@H](CC[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)OCc1ccccc1 ZINC000475021390 1024023379 /nfs/dbraw/zinc/02/33/79/1024023379.db2.gz BSSARDGNFJLFJH-INIZCTEOSA-N 1 0 340.423 3.948 20 5 EHBDRO C[NH+](C)CC[C@@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000895319936 1024282096 /nfs/dbraw/zinc/28/20/96/1024282096.db2.gz KEUBWPUNEUDKKN-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO CC[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)CO ZINC000430081371 1024339296 /nfs/dbraw/zinc/33/92/96/1024339296.db2.gz DKRKLIWTQHOVDQ-CYBMUJFWSA-N 1 0 348.374 3.729 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000434953034 1024523515 /nfs/dbraw/zinc/52/35/15/1024523515.db2.gz YHGOYIGCBSGTRN-ZDUSSCGKSA-N 1 0 338.795 3.731 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCCc3c(C)cccc32)c1[N+](=O)[O-] ZINC000895463149 1024534318 /nfs/dbraw/zinc/53/43/18/1024534318.db2.gz JMAAYRLWFDCXDS-INIZCTEOSA-N 1 0 342.395 3.785 20 5 EHBDRO COc1ccccc1N1CC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000119617214 1024547838 /nfs/dbraw/zinc/54/78/38/1024547838.db2.gz QPKHYCVZTDYLAN-HOCLYGCPSA-N 1 0 341.411 3.533 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(n2ccc(C)n2)CC1 ZINC000435048152 1024576804 /nfs/dbraw/zinc/57/68/04/1024576804.db2.gz GUTRYBZHJWMWLJ-NTCAYCPXSA-N 1 0 340.427 3.840 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccnn1-c1ccccc1 ZINC000467330109 1024664926 /nfs/dbraw/zinc/66/49/26/1024664926.db2.gz NJTBEPAFAWAGTL-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCC2(CCC2)O1 ZINC000895677913 1024710314 /nfs/dbraw/zinc/71/03/14/1024710314.db2.gz TXEYKAFEIQFBTK-ZDUSSCGKSA-N 1 0 344.333 3.805 20 5 EHBDRO COCC[C@@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000507942949 1024789558 /nfs/dbraw/zinc/78/95/58/1024789558.db2.gz VZONIMICYHLMPF-OAHLLOKOSA-N 1 0 343.427 3.877 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cs1 ZINC000602888061 1033235797 /nfs/dbraw/zinc/23/57/97/1033235797.db2.gz OVOJCPROQNASFJ-AWEZNQCLSA-N 1 0 340.408 3.589 20 5 EHBDRO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@H]1CCCOC1 ZINC000119708320 1024928025 /nfs/dbraw/zinc/92/80/25/1024928025.db2.gz GKMNAGPRWYLMSM-CYBMUJFWSA-N 1 0 347.440 3.577 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039195 1025072856 /nfs/dbraw/zinc/07/28/56/1025072856.db2.gz CNZJESPUWZGWOK-ZBFHGGJFSA-N 1 0 347.459 3.693 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000274353294 1025145252 /nfs/dbraw/zinc/14/52/52/1025145252.db2.gz GQCNEQWFPWUJHX-SJCJKPOMSA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896227664 1025261683 /nfs/dbraw/zinc/26/16/83/1025261683.db2.gz NUNQXHYFWUEOTB-PKXJPQMGSA-N 1 0 344.308 3.974 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]CC[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000237382997 1025324893 /nfs/dbraw/zinc/32/48/93/1025324893.db2.gz QSENHAYSZXHSKT-CQSZACIVSA-N 1 0 346.452 3.915 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158055467 1025334011 /nfs/dbraw/zinc/33/40/11/1025334011.db2.gz WLACQYAJHGHZNQ-MRXNPFEDSA-N 1 0 326.396 3.635 20 5 EHBDRO COc1cccc(NC2CC[NH+](C3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000185512613 1025372183 /nfs/dbraw/zinc/37/21/83/1025372183.db2.gz SNDCSAFBCRPSTG-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2ccn(C)n2)C1 ZINC000896493848 1025497708 /nfs/dbraw/zinc/49/77/08/1025497708.db2.gz WOBMZGKROULLQA-JBXOJTMHSA-N 1 0 340.427 3.611 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000185673822 1025583989 /nfs/dbraw/zinc/58/39/89/1025583989.db2.gz HTMFUXLZDZNUQL-HNAYVOBHSA-N 1 0 327.428 3.684 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000274633386 1025621648 /nfs/dbraw/zinc/62/16/48/1025621648.db2.gz RVLSXPIWRHCPEB-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO COc1cccc(CCC[N@H+](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000511093133 1025648092 /nfs/dbraw/zinc/64/80/92/1025648092.db2.gz CGYATIPKBXPVLL-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[N@@H+](C(C)(C)C)CC1 ZINC000530342005 1025680031 /nfs/dbraw/zinc/68/00/31/1025680031.db2.gz AHZCBQOJCFWJOV-DTQAZKPQSA-N 1 0 331.460 3.804 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425544179 1025703997 /nfs/dbraw/zinc/70/39/97/1025703997.db2.gz BTSWTBKYIUCRHH-KSSFIOAISA-N 1 0 330.428 3.937 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425544178 1025704473 /nfs/dbraw/zinc/70/44/73/1025704473.db2.gz BTSWTBKYIUCRHH-KDOFPFPSSA-N 1 0 330.428 3.937 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425559236 1025753512 /nfs/dbraw/zinc/75/35/12/1025753512.db2.gz ZBIRJJJWWAJTCR-KRWDZBQOSA-N 1 0 334.391 3.515 20 5 EHBDRO Cc1c(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000478492138 1026126831 /nfs/dbraw/zinc/12/68/31/1026126831.db2.gz QAKYUTZICIBWQC-UHFFFAOYSA-N 1 0 348.443 3.893 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000451955078 1026415020 /nfs/dbraw/zinc/41/50/20/1026415020.db2.gz ZDSBMXLMGAWUKL-HNNXBMFYSA-N 1 0 336.432 3.562 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000530974896 1026449029 /nfs/dbraw/zinc/44/90/29/1026449029.db2.gz KWUWBEAFNYNQDY-VPZZIHKRSA-N 1 0 342.395 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3ncccc3O)s2)cc1 ZINC000475331538 1026483159 /nfs/dbraw/zinc/48/31/59/1026483159.db2.gz GWKIMEPBWSICTM-UHFFFAOYSA-N 1 0 341.392 3.714 20 5 EHBDRO CCc1ccc([C@@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000463062978 1026510249 /nfs/dbraw/zinc/51/02/49/1026510249.db2.gz ZZKBUQHJSORGLI-QGZVFWFLSA-N 1 0 328.416 3.575 20 5 EHBDRO C[C@H]1CCC[N@H+](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000511156698 1026561129 /nfs/dbraw/zinc/56/11/29/1026561129.db2.gz ACZBOZVJDITGQB-INIZCTEOSA-N 1 0 347.462 3.850 20 5 EHBDRO COCc1cccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158516875 1026589799 /nfs/dbraw/zinc/58/97/99/1026589799.db2.gz ZTXUQWVQEOEINM-LJQANCHMSA-N 1 0 340.423 3.852 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000186435608 1026888774 /nfs/dbraw/zinc/88/87/74/1026888774.db2.gz HUIPULZLAVBCSN-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)C1CC1 ZINC000127074401 1027271973 /nfs/dbraw/zinc/27/19/73/1027271973.db2.gz JUFXAVBGJBBFGM-QZTJIDSGSA-N 1 0 344.455 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCCCC3)C2)c2cccnc21 ZINC000413257482 1027393276 /nfs/dbraw/zinc/39/32/76/1027393276.db2.gz AWTAQAHOAFEEDY-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)Nc1ncc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000413292036 1027454283 /nfs/dbraw/zinc/45/42/83/1027454283.db2.gz LFQKDRSSFBFVBL-MLGOLLRUSA-N 1 0 332.379 3.541 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000323832339 1027465395 /nfs/dbraw/zinc/46/53/95/1027465395.db2.gz IHIBYFHFRUWGNA-RBUKOAKNSA-N 1 0 327.428 3.938 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@]3(C2)CCCOC3)o1 ZINC000342833960 1027553013 /nfs/dbraw/zinc/55/30/13/1027553013.db2.gz CZJREJQVWDEFPJ-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@]3(C2)CCCOC3)o1 ZINC000342833961 1027554387 /nfs/dbraw/zinc/55/43/87/1027554387.db2.gz CZJREJQVWDEFPJ-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178656770 1027613633 /nfs/dbraw/zinc/61/36/33/1027613633.db2.gz HRKWAPPXAAMQAH-NVXWUHKLSA-N 1 0 325.412 3.914 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078562434 1027964878 /nfs/dbraw/zinc/96/48/78/1027964878.db2.gz NGACTHWTNBYZHC-GFCCVEGCSA-N 1 0 345.365 3.782 20 5 EHBDRO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCC[C@H]1C ZINC000444667680 1028140203 /nfs/dbraw/zinc/14/02/03/1028140203.db2.gz YYNKLRLIPJNARU-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCC[C@@H]1C ZINC000444667682 1028140422 /nfs/dbraw/zinc/14/04/22/1028140422.db2.gz YYNKLRLIPJNARU-WMLDXEAASA-N 1 0 333.432 3.742 20 5 EHBDRO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCC[C@@H]1C ZINC000444677650 1028148105 /nfs/dbraw/zinc/14/81/05/1028148105.db2.gz QAQYSSVWMJBBAW-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000503862665 1028174073 /nfs/dbraw/zinc/17/40/73/1028174073.db2.gz YLHMRTLSDUGYMZ-MPKXVKKWSA-N 1 0 344.358 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCO[C@@]3(CCSC3)C1)CCC2 ZINC000248997108 1028189642 /nfs/dbraw/zinc/18/96/42/1028189642.db2.gz PILMHKXSNSXJHL-OLMNPRSZSA-N 1 0 348.468 3.617 20 5 EHBDRO COCC[C@@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000502433131 1028198101 /nfs/dbraw/zinc/19/81/01/1028198101.db2.gz HADIDYOVOXODTB-SWLSCSKDSA-N 1 0 346.349 3.908 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444747555 1028236288 /nfs/dbraw/zinc/23/62/88/1028236288.db2.gz AKZFWPPVAXBZGO-CQSZACIVSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H](N[C@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284200 1028324080 /nfs/dbraw/zinc/32/40/80/1028324080.db2.gz WPNATHNSKKNLCX-SMDDNHRTSA-N 1 0 331.441 3.711 20 5 EHBDRO C[C@@H](NCC1([NH3+])CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423318226 1028349485 /nfs/dbraw/zinc/34/94/85/1028349485.db2.gz DDRUNAKYKKDRCS-GFCCVEGCSA-N 1 0 331.441 3.855 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@H]2CCO[C@@H]21 ZINC000130295866 1028373264 /nfs/dbraw/zinc/37/32/64/1028373264.db2.gz SDHAOCBRJSFQAQ-DZLVSBGCSA-N 1 0 344.455 3.709 20 5 EHBDRO CCc1ccc([C@H](N[C@H]2CC[NH2+][C@@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423391995 1028404626 /nfs/dbraw/zinc/40/46/26/1028404626.db2.gz XGKVZPGMNQXDAP-ZUEVXXBESA-N 1 0 343.427 3.570 20 5 EHBDRO CSc1ccccc1[C@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000440627056 1028473476 /nfs/dbraw/zinc/47/34/76/1028473476.db2.gz HQIYMHCBMVXGBY-LBPRGKRZSA-N 1 0 345.424 3.606 20 5 EHBDRO C[N@H+](CCCOc1ccc(F)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000523702130 1028557426 /nfs/dbraw/zinc/55/74/26/1028557426.db2.gz SEYOXQMXRQZEGA-UHFFFAOYSA-N 1 0 332.375 3.677 20 5 EHBDRO O=C(CCC[NH2+]Cc1ccccc1[N+](=O)[O-])Nc1ccc(Cl)cc1 ZINC000237754712 1028664051 /nfs/dbraw/zinc/66/40/51/1028664051.db2.gz OIUVUEJYEJVTIB-UHFFFAOYSA-N 1 0 347.802 3.757 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3COCC[C@H]32)cs1 ZINC000286194386 1028824657 /nfs/dbraw/zinc/82/46/57/1028824657.db2.gz XPXLXOAMKCQETG-BRWVUGGUSA-N 1 0 344.436 3.661 20 5 EHBDRO [NH3+][C@@H]1CCCC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000424366437 1029028875 /nfs/dbraw/zinc/02/88/75/1029028875.db2.gz IUXMLIPKIQVCPM-HZPDHXFCSA-N 1 0 349.818 3.868 20 5 EHBDRO C[C@H](Cc1ccccc1F)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583170354 1029109138 /nfs/dbraw/zinc/10/91/38/1029109138.db2.gz VSJLFQAHUWHWAP-CYBMUJFWSA-N 1 0 341.386 3.979 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000533287918 1029578977 /nfs/dbraw/zinc/57/89/77/1029578977.db2.gz HXCXQPCZHWCHCZ-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000533290613 1029584079 /nfs/dbraw/zinc/58/40/79/1029584079.db2.gz LVBLZEGHPBBNCO-INIZCTEOSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@]1(O)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428446994 1029689721 /nfs/dbraw/zinc/68/97/21/1029689721.db2.gz KXUKPVKLURFERH-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCOCCc1ccccc1)C2 ZINC000536005096 1029725395 /nfs/dbraw/zinc/72/53/95/1029725395.db2.gz XYOGKHHPPXWKBL-UHFFFAOYSA-N 1 0 340.423 3.602 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756600 1029906606 /nfs/dbraw/zinc/90/66/06/1029906606.db2.gz NBDYRMSMXFYLAL-ZBFHGGJFSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2)CC2(O)CCCC2)c1 ZINC000531888792 1029983226 /nfs/dbraw/zinc/98/32/26/1029983226.db2.gz CQPRSIYTARRAIU-UHFFFAOYSA-N 1 0 340.423 3.902 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192902801 1030011768 /nfs/dbraw/zinc/01/17/68/1030011768.db2.gz ZRMNDWGNGOGSDT-BUXKBTBVSA-N 1 0 342.443 3.543 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H](C)CC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453309405 1030080366 /nfs/dbraw/zinc/08/03/66/1030080366.db2.gz DUXWJMBWUJKUBT-FZKQIMNGSA-N 1 0 346.427 3.979 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000531948106 1030118988 /nfs/dbraw/zinc/11/89/88/1030118988.db2.gz AJGCZOVUFRRYHC-KXBFYZLASA-N 1 0 327.428 3.857 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000531953823 1030126800 /nfs/dbraw/zinc/12/68/00/1030126800.db2.gz VWMLFFARAZKOKO-GJZGRUSLSA-N 1 0 325.412 3.697 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000245870650 1030273488 /nfs/dbraw/zinc/27/34/88/1030273488.db2.gz LBOPCOLJZKIQAC-FAYQHZLMSA-N 1 0 347.459 3.637 20 5 EHBDRO CCc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447539785 1030273675 /nfs/dbraw/zinc/27/36/75/1030273675.db2.gz HKRXPMXYBWFWJM-QZTJIDSGSA-N 1 0 342.443 3.670 20 5 EHBDRO Cc1cccnc1OC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000429720121 1030375345 /nfs/dbraw/zinc/37/53/45/1030375345.db2.gz DXNQOIFCFIMZPI-UHFFFAOYSA-N 1 0 341.411 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCCC[C@@H]1n1cccn1)CCC2 ZINC000192923777 1030472528 /nfs/dbraw/zinc/47/25/28/1030472528.db2.gz QTJXKUZZAZMUDR-QYZOEREBSA-N 1 0 340.427 3.942 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)[NH+]2[C@H](C)CC[C@H]2C)n1 ZINC000526954270 1030504304 /nfs/dbraw/zinc/50/43/04/1030504304.db2.gz DPUKKFPPBRUGII-UPJWGTAASA-N 1 0 330.388 3.887 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293453 1030527099 /nfs/dbraw/zinc/52/70/99/1030527099.db2.gz YJTYSAOZKAVYHG-IBGZPJMESA-N 1 0 326.396 3.767 20 5 EHBDRO C[C@@H]([NH2+]CCN(C)Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000160107079 1030540548 /nfs/dbraw/zinc/54/05/48/1030540548.db2.gz LCRNVSNLWSTBSO-CQSZACIVSA-N 1 0 331.391 3.517 20 5 EHBDRO C[C@@H]([NH2+]Cc1cncn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000527074814 1030627268 /nfs/dbraw/zinc/62/72/68/1030627268.db2.gz LWNSAQSZJCAYJW-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO C/C(=C/c1nc(-c2ccn3c[nH+]cc3c2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000447959186 1030629527 /nfs/dbraw/zinc/62/95/27/1030629527.db2.gz NDFOXMNUTRZDTF-WQLSENKSSA-N 1 0 347.334 3.853 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](CC(C)C)C1 ZINC001168147705 1030927256 /nfs/dbraw/zinc/92/72/56/1030927256.db2.gz WXUHJTLVPUAJPD-INIZCTEOSA-N 1 0 347.459 3.990 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC000483120923 1030967282 /nfs/dbraw/zinc/96/72/82/1030967282.db2.gz LIYIKLDITHDVLR-LBPRGKRZSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCOC2)ccc1Oc1ccccc1Cl ZINC000178996020 1031057693 /nfs/dbraw/zinc/05/76/93/1031057693.db2.gz GRXPWEWJFOTMSU-ZDUSSCGKSA-N 1 0 348.786 3.919 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483254981 1031068561 /nfs/dbraw/zinc/06/85/61/1031068561.db2.gz IWTQSZFLWAFKHE-KGLIPLIRSA-N 1 0 333.432 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)c(F)c2)cc1 ZINC000111158867 1031446747 /nfs/dbraw/zinc/44/67/47/1031446747.db2.gz ACHGRISYVCTKIL-UHFFFAOYSA-N 1 0 339.164 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](CO)CC1CCCC1)CCC2 ZINC000343590945 1031524446 /nfs/dbraw/zinc/52/44/46/1031524446.db2.gz HNCSSTBRWKMDBG-HNAYVOBHSA-N 1 0 332.444 3.751 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[C@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000904092981 1031743296 /nfs/dbraw/zinc/74/32/96/1031743296.db2.gz FVGYLUZJHAMCKA-WQVCFCJDSA-N 1 0 342.399 3.937 20 5 EHBDRO Cc1cccc(NC(=O)C[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000584147720 1031811730 /nfs/dbraw/zinc/81/17/30/1031811730.db2.gz ZCPSCFFHVJPXBP-AWEZNQCLSA-N 1 0 341.411 3.719 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000248540692 1031908822 /nfs/dbraw/zinc/90/88/22/1031908822.db2.gz BKIHHQNVFDFWMQ-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(C)Oc1ccc([C@H](O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173422230 1033314972 /nfs/dbraw/zinc/31/49/72/1033314972.db2.gz HGABEKULIADHPE-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Cc3nccs3)C2)cc1Cl ZINC000898071743 1033324781 /nfs/dbraw/zinc/32/47/81/1033324781.db2.gz RNYMPCPEUXLUNI-LBPRGKRZSA-N 1 0 337.832 3.769 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485924 1033367305 /nfs/dbraw/zinc/36/73/05/1033367305.db2.gz TZRWEYUWGDVNRN-ZFWWWQNUSA-N 1 0 334.445 3.508 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490669 1033395041 /nfs/dbraw/zinc/39/50/41/1033395041.db2.gz PFCFJCIYYQESEE-ACJLOTCBSA-N 1 0 349.394 3.514 20 5 EHBDRO Cc1nn(-c2ccccc2)cc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505737 1033406278 /nfs/dbraw/zinc/40/62/78/1033406278.db2.gz XOEKJJIXBYQPJN-LJQANCHMSA-N 1 0 348.406 3.866 20 5 EHBDRO CCC[NH2+]Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000061003458 1033418893 /nfs/dbraw/zinc/41/88/93/1033418893.db2.gz KCNZPQIQAOFLDC-UHFFFAOYSA-N 1 0 330.384 3.682 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])n1cc(C[N@H+](C)C2CCCCC2)nn1 ZINC000603220882 1033439192 /nfs/dbraw/zinc/43/91/92/1033439192.db2.gz WNFWWTWQOAGCLH-CQSZACIVSA-N 1 0 343.431 3.560 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460344888 1033525585 /nfs/dbraw/zinc/52/55/85/1033525585.db2.gz CSKNBSXEHHOWJM-ZNMIVQPWSA-N 1 0 333.432 3.870 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293223 1033574108 /nfs/dbraw/zinc/57/41/08/1033574108.db2.gz TUIYLQZGPKCQBV-UKRRQHHQSA-N 1 0 348.472 3.816 20 5 EHBDRO Cc1ccccc1C[C@@H](CO)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000466918992 1033598008 /nfs/dbraw/zinc/59/80/08/1033598008.db2.gz WSJLYKWLMJBWQE-SFHVURJKSA-N 1 0 342.439 3.720 20 5 EHBDRO COCc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595010162 1033605745 /nfs/dbraw/zinc/60/57/45/1033605745.db2.gz HWKMBQJQPYUFAH-CYBMUJFWSA-N 1 0 330.384 3.601 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000595020172 1033612281 /nfs/dbraw/zinc/61/22/81/1033612281.db2.gz VJRHPSRTIHJJPJ-DJJJIMSYSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000595021345 1033614878 /nfs/dbraw/zinc/61/48/78/1033614878.db2.gz CGIPJXJLLIWKQT-UONOGXRCSA-N 1 0 334.416 3.746 20 5 EHBDRO COCc1csc(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000594987214 1033621652 /nfs/dbraw/zinc/62/16/52/1033621652.db2.gz XMUDGAQMNDJMCO-MLPAPPSSSA-N 1 0 332.425 3.996 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3ccc(OC)c([N+](=O)[O-])c3)CCC2)c1 ZINC000594997140 1033624499 /nfs/dbraw/zinc/62/44/99/1033624499.db2.gz HUIVQZXLDOHFKP-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCc3c(C)cccc32)c([N+](=O)[O-])cc1O ZINC000595000483 1033626698 /nfs/dbraw/zinc/62/66/98/1033626698.db2.gz JSXLRHUVAXBOTJ-INIZCTEOSA-N 1 0 342.395 3.785 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CO[C@H](C4CC4)C3)s2)cc1 ZINC000599008173 1033643506 /nfs/dbraw/zinc/64/35/06/1033643506.db2.gz VMZUXMUAUUOHMO-PBHICJAKSA-N 1 0 344.436 3.980 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)nn(C)c1C ZINC000595027285 1033648297 /nfs/dbraw/zinc/64/82/97/1033648297.db2.gz RCFNLXUZXYPLGE-ZBEGNZNMSA-N 1 0 346.431 3.756 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000595038539 1033657211 /nfs/dbraw/zinc/65/72/11/1033657211.db2.gz LGFZDNPJFSEKDU-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](n2cccn2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000599054983 1033691261 /nfs/dbraw/zinc/69/12/61/1033691261.db2.gz DWKBXCUQCFGNHK-SMDDNHRTSA-N 1 0 342.321 3.554 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000595107345 1033693079 /nfs/dbraw/zinc/69/30/79/1033693079.db2.gz XQHALRXPDFYOHM-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO COCc1csc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000595079317 1033696905 /nfs/dbraw/zinc/69/69/05/1033696905.db2.gz WDJGTSAZDKKGOP-ZDUSSCGKSA-N 1 0 334.441 3.914 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])OC)c1 ZINC000599058766 1033698047 /nfs/dbraw/zinc/69/80/47/1033698047.db2.gz UZNOHCOSIILPBV-HKUYNNGSSA-N 1 0 342.395 3.568 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2C[C@@H](O)C23CCC3)c2ccccc2)c1 ZINC000595088859 1033699279 /nfs/dbraw/zinc/69/92/79/1033699279.db2.gz DYDPPYUBRFPYHZ-IPMKNSEASA-N 1 0 338.407 3.577 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000595460799 1033819951 /nfs/dbraw/zinc/81/99/51/1033819951.db2.gz IATYEZGVVILLBY-QGZVFWFLSA-N 1 0 332.375 3.583 20 5 EHBDRO CC[C@H](CNc1ccc(Br)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000608855958 1033933856 /nfs/dbraw/zinc/93/38/56/1033933856.db2.gz VIDPACPUDCHSNU-GFCCVEGCSA-N 1 0 342.237 3.644 20 5 EHBDRO C[C@H](CO)[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670814 1033942373 /nfs/dbraw/zinc/94/23/73/1033942373.db2.gz DNPVLWXDCHTWLD-ABAIWWIYSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](c3ccccc3)[C@H](CO)C2)cccc1[N+](=O)[O-] ZINC000595748881 1033978974 /nfs/dbraw/zinc/97/89/74/1033978974.db2.gz YQMFXYDHYOQFGP-RBUKOAKNSA-N 1 0 340.423 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]([C@H]3CCCCO3)C2)cc1 ZINC000595788258 1033997899 /nfs/dbraw/zinc/99/78/99/1033997899.db2.gz HOEYLHIGZDOHEK-QFBILLFUSA-N 1 0 348.443 3.645 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000595867733 1034031489 /nfs/dbraw/zinc/03/14/89/1034031489.db2.gz PPARPGSDZLBPJF-UONOGXRCSA-N 1 0 347.415 3.546 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC[N@H+](CC2CCCCC2)CC1 ZINC000603932097 1034041616 /nfs/dbraw/zinc/04/16/16/1034041616.db2.gz BZMWUXTXLZEEOE-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2(C)C)c1[N+](=O)[O-] ZINC000599630710 1034056729 /nfs/dbraw/zinc/05/67/29/1034056729.db2.gz UWUDZXQGHKNUBJ-AWEZNQCLSA-N 1 0 333.363 3.798 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000596099816 1034061722 /nfs/dbraw/zinc/06/17/22/1034061722.db2.gz XQLOKWPXDWFOIR-VXGBXAGGSA-N 1 0 348.369 3.843 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690700 1034094088 /nfs/dbraw/zinc/09/40/88/1034094088.db2.gz PGUAFRYWOSCHOY-PYLYLYNFSA-N 1 0 342.399 3.823 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000599679260 1034107069 /nfs/dbraw/zinc/10/70/69/1034107069.db2.gz LXWQWPSQRDXMII-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000152609086 1034109892 /nfs/dbraw/zinc/10/98/92/1034109892.db2.gz VISOGMDMFVDTIL-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000152609191 1034139950 /nfs/dbraw/zinc/13/99/50/1034139950.db2.gz VISOGMDMFVDTIL-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO Cc1c(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)cccc1[N+](=O)[O-] ZINC000456264421 1034262838 /nfs/dbraw/zinc/26/28/38/1034262838.db2.gz NHQHMHIXHNGEEW-GOSISDBHSA-N 1 0 339.395 3.704 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000456340355 1034335632 /nfs/dbraw/zinc/33/56/32/1034335632.db2.gz XYYIOWQNQQZAAW-MRXNPFEDSA-N 1 0 339.395 3.704 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649650 1034346147 /nfs/dbraw/zinc/34/61/47/1034346147.db2.gz DRMFZBROZBTYLG-SJCJKPOMSA-N 1 0 341.411 3.914 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCn2nccc21 ZINC000601321343 1034452187 /nfs/dbraw/zinc/45/21/87/1034452187.db2.gz PUXHRNJXDYUSMJ-KGLIPLIRSA-N 1 0 346.456 3.787 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000310496136 1034526289 /nfs/dbraw/zinc/52/62/89/1034526289.db2.gz GIQUYUQGCDHJDN-CABCVRRESA-N 1 0 349.431 3.520 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](Cc1ccccc1)N(C)C ZINC000534529344 1034646932 /nfs/dbraw/zinc/64/69/32/1034646932.db2.gz FJLRGMSKRCAPEL-QFBILLFUSA-N 1 0 341.455 3.727 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000162242436 1034796135 /nfs/dbraw/zinc/79/61/35/1034796135.db2.gz WUCVMDIFLDIMQQ-AWEZNQCLSA-N 1 0 338.411 3.912 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)C1CCCC1 ZINC000172170616 1034848602 /nfs/dbraw/zinc/84/86/02/1034848602.db2.gz ZWAXAGOWODDEBL-MNOVXSKESA-N 1 0 339.823 3.744 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC2(O)CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612409826 1034904106 /nfs/dbraw/zinc/90/41/06/1034904106.db2.gz UAIQJCBQCUIPIV-GOSISDBHSA-N 1 0 344.411 3.734 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](CC/C=C\c3ccccc3)CC2)n1 ZINC000450887581 1034917633 /nfs/dbraw/zinc/91/76/33/1034917633.db2.gz YJJVXEYQENKDAP-YWEYNIOJSA-N 1 0 326.400 3.532 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000310635234 1035036987 /nfs/dbraw/zinc/03/69/87/1035036987.db2.gz BKFBUAMSYJDZAP-XJKSGUPXSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nn(C)c2ccccc12 ZINC000612829303 1035251362 /nfs/dbraw/zinc/25/13/62/1035251362.db2.gz VDTYAYGUOSFOBV-AWEZNQCLSA-N 1 0 338.411 3.592 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000580469640 1035439722 /nfs/dbraw/zinc/43/97/22/1035439722.db2.gz BGKDOBMFDBQNMP-GOEBONIOSA-N 1 0 334.416 3.587 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCO1 ZINC000581085215 1035472425 /nfs/dbraw/zinc/47/24/25/1035472425.db2.gz OYDJXRVYOKSGKH-UONOGXRCSA-N 1 0 332.322 3.661 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000414095010 1035485564 /nfs/dbraw/zinc/48/55/64/1035485564.db2.gz PGMGHFSLBKJRPV-HNNXBMFYSA-N 1 0 343.427 3.542 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc2c(c1)OCCO2 ZINC000540705186 1035585806 /nfs/dbraw/zinc/58/58/06/1035585806.db2.gz CCOJGKLUWWAYMX-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO CC[C@H](C)[N@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592925 1035649046 /nfs/dbraw/zinc/64/90/46/1035649046.db2.gz KXJKTUIYUOBWSH-JTQLQIEISA-N 1 0 332.347 3.825 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCO1 ZINC000511504781 1035905735 /nfs/dbraw/zinc/90/57/35/1035905735.db2.gz AMEBYCYLYMQKHH-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[N@@H+]1CC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155413 1035919348 /nfs/dbraw/zinc/91/93/48/1035919348.db2.gz FJFVBIMQLOFCHF-UZLBHIALSA-N 1 0 339.439 3.616 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(Br)o1 ZINC000549408276 1035922345 /nfs/dbraw/zinc/92/23/45/1035922345.db2.gz MROHXTJEZDJOIB-UHFFFAOYSA-N 1 0 339.189 3.625 20 5 EHBDRO CCOc1cc(C[N@H+](Cc2cccnc2)C(C)C)ccc1[N+](=O)[O-] ZINC000492558435 1035979470 /nfs/dbraw/zinc/97/94/70/1035979470.db2.gz LUOHWDCWVGATFW-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO CCNC(=O)N1CC[C@@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000760708321 1036059207 /nfs/dbraw/zinc/05/92/07/1036059207.db2.gz ZAKVEJSVTZXWHP-GOSISDBHSA-N 1 0 347.462 3.886 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000414226164 1036149008 /nfs/dbraw/zinc/14/90/08/1036149008.db2.gz TVBKIFIIEVSRRZ-IRWQIABSSA-N 1 0 326.396 3.866 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@H](C)CCSCC)ccc1[N+](=O)[O-] ZINC000492721853 1036230376 /nfs/dbraw/zinc/23/03/76/1036230376.db2.gz LQBHTZCCRJZGHQ-CYBMUJFWSA-N 1 0 326.462 3.957 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200175 1036306308 /nfs/dbraw/zinc/30/63/08/1036306308.db2.gz VQUVAWFZZFZSGV-RRWQFYAYSA-N 1 0 330.428 3.747 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(Cl)cc1 ZINC000589284651 1036339233 /nfs/dbraw/zinc/33/92/33/1036339233.db2.gz NZQLJZIQCOKGDL-WMZOPIPTSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1csnn1 ZINC000414293527 1036495007 /nfs/dbraw/zinc/49/50/07/1036495007.db2.gz CYPFUKIPSPWTGU-OBJOEFQTSA-N 1 0 332.429 3.508 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742944 1036600139 /nfs/dbraw/zinc/60/01/39/1036600139.db2.gz KHVSPHNMVGDLFF-BVUBDWEXSA-N 1 0 338.473 3.808 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCCO)Cc1cccc(Cl)c1 ZINC000541772556 1036643192 /nfs/dbraw/zinc/64/31/92/1036643192.db2.gz GGUOSXOCQGZQAV-UHFFFAOYSA-N 1 0 348.830 3.941 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCc2nccs2)c2ccccc2)c1 ZINC000180341610 1036697132 /nfs/dbraw/zinc/69/71/32/1036697132.db2.gz IZQYZRRDFVRULJ-GOSISDBHSA-N 1 0 339.420 3.973 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@@H]1CO ZINC000191181965 1036697370 /nfs/dbraw/zinc/69/73/70/1036697370.db2.gz ICDCRLXCZNLTPG-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000464838370 1036853197 /nfs/dbraw/zinc/85/31/97/1036853197.db2.gz VLLSUFCBEVSJAC-BEFAXECRSA-N 1 0 326.396 3.599 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000539524260 1036860496 /nfs/dbraw/zinc/86/04/96/1036860496.db2.gz FVHFUUPMNVBXEU-IMMZDGJCSA-N 1 0 348.468 3.642 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000191413489 1036959376 /nfs/dbraw/zinc/95/93/76/1036959376.db2.gz HNNRCMCZFAJQDL-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC[C@H]1CCCC[N@H+]1C ZINC000760792869 1037074302 /nfs/dbraw/zinc/07/43/02/1037074302.db2.gz LYRFKZYGNIRCQX-CYBMUJFWSA-N 1 0 340.807 3.588 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc(OC)cc1 ZINC000180771964 1037180176 /nfs/dbraw/zinc/18/01/76/1037180176.db2.gz PHHFTGSTPLUPFN-QGZVFWFLSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ncc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000271780377 1037212636 /nfs/dbraw/zinc/21/26/36/1037212636.db2.gz KRIJNGGYBGMVFB-LLVKDONJSA-N 1 0 335.791 3.811 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000493279387 1037216033 /nfs/dbraw/zinc/21/60/33/1037216033.db2.gz YLMCVQXNCPTWLI-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@H](C4CCC4)C3)co2)cc1 ZINC000591063379 1037225525 /nfs/dbraw/zinc/22/55/25/1037225525.db2.gz SFICJGCAMYKMMA-HNNXBMFYSA-N 1 0 327.384 3.872 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000452081440 1037288952 /nfs/dbraw/zinc/28/89/52/1037288952.db2.gz JWCIBXMJBKVDOW-OAHLLOKOSA-N 1 0 336.432 3.631 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2Nc2cc3c(c[nH+]2)CCCC3)n1 ZINC000462941439 1037565111 /nfs/dbraw/zinc/56/51/11/1037565111.db2.gz DHUJOCSONMBALH-CVEARBPZSA-N 1 0 341.415 3.661 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN(C)Cc1ccc(F)cc1 ZINC000532550555 1037595833 /nfs/dbraw/zinc/59/58/33/1037595833.db2.gz QNWOESULDKDMHB-HNNXBMFYSA-N 1 0 345.418 3.825 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000532551550 1037602934 /nfs/dbraw/zinc/60/29/34/1037602934.db2.gz VTCIVONPLRXUSE-MAUKXSAKSA-N 1 0 328.412 3.812 20 5 EHBDRO C[NH2+]Cc1ccccc1NC(=O)N[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000415907237 1037617494 /nfs/dbraw/zinc/61/74/94/1037617494.db2.gz AVANBFVJKJARJM-ZDUSSCGKSA-N 1 0 342.399 3.505 20 5 EHBDRO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@H]1COc2ccccc2O1 ZINC000341175020 1037701503 /nfs/dbraw/zinc/70/15/03/1037701503.db2.gz DXAYNTJGGYELTE-CQSZACIVSA-N 1 0 348.786 3.520 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000493909827 1037706028 /nfs/dbraw/zinc/70/60/28/1037706028.db2.gz XRISIRVLRWSOIX-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO CC[C@@H](O)CCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494003999 1037762970 /nfs/dbraw/zinc/76/29/70/1037762970.db2.gz NJAOAEYCPAZWEV-MOPGFXCFSA-N 1 0 328.412 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)o1 ZINC000249858042 1037768160 /nfs/dbraw/zinc/76/81/60/1037768160.db2.gz QJUCHUPTKQSBCL-JCKWVBRZSA-N 1 0 328.368 3.512 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)CC2 ZINC000760930196 1037848225 /nfs/dbraw/zinc/84/82/25/1037848225.db2.gz YCIPZNCHBDIRNR-UHFFFAOYSA-N 1 0 346.814 3.858 20 5 EHBDRO Cc1nc2ccccc2nc1C[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897465573 1037876026 /nfs/dbraw/zinc/87/60/26/1037876026.db2.gz XNUOXRYTJSYXNW-CYBMUJFWSA-N 1 0 336.395 3.740 20 5 EHBDRO C[C@H](C[NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897465735 1037876092 /nfs/dbraw/zinc/87/60/92/1037876092.db2.gz HKVWYUZZSSWIGZ-MRXNPFEDSA-N 1 0 339.439 3.957 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000463200465 1037886390 /nfs/dbraw/zinc/88/63/90/1037886390.db2.gz UEYNQBMGLSOFOT-KSZLIROESA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCOCC2CC2)c2ccccc2)c1 ZINC000492122229 1038004348 /nfs/dbraw/zinc/00/43/48/1038004348.db2.gz KLOUHMTWAAJBLF-IBGZPJMESA-N 1 0 326.396 3.700 20 5 EHBDRO CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549999399 1038012290 /nfs/dbraw/zinc/01/22/90/1038012290.db2.gz DQLZZBPNTWFTKM-HNNXBMFYSA-N 1 0 346.349 3.741 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111347 1038106623 /nfs/dbraw/zinc/10/66/23/1038106623.db2.gz OUIJSUANTCOZSD-IUODEOHRSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000467555821 1038472440 /nfs/dbraw/zinc/47/24/40/1038472440.db2.gz WGYDZDRXDWJOPA-UHFFFAOYSA-N 1 0 328.412 3.942 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccccc1-n1cccn1 ZINC000539040340 1038649256 /nfs/dbraw/zinc/64/92/56/1038649256.db2.gz OQJHAZKVUJWXQT-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO CC[C@@]1(CO)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000190214075 1038697341 /nfs/dbraw/zinc/69/73/41/1038697341.db2.gz QRXPFWSASVQAFD-LJQANCHMSA-N 1 0 344.411 3.839 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959426 1038697383 /nfs/dbraw/zinc/69/73/83/1038697383.db2.gz PLTVMAQXRFUFKC-CRAIPNDOSA-N 1 0 329.375 3.900 20 5 EHBDRO CC(C)[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(C)(C)O ZINC000477864388 1038975335 /nfs/dbraw/zinc/97/53/35/1038975335.db2.gz ZMYMEEDRUSSHMM-LESCRADOSA-N 1 0 334.460 3.691 20 5 EHBDRO C[C@@H](C[NH2+]C[C@H](O)c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000905643369 1039025760 /nfs/dbraw/zinc/02/57/60/1039025760.db2.gz LGJOPDWSSQEFEC-SJCJKPOMSA-N 1 0 334.803 3.675 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])[nH]1 ZINC000488465427 1039205955 /nfs/dbraw/zinc/20/59/55/1039205955.db2.gz OHIZDSVDFHALTP-MJBXVCDLSA-N 1 0 345.447 3.898 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000488587556 1039287716 /nfs/dbraw/zinc/28/77/16/1039287716.db2.gz PSHNWRIKIOULOJ-CYBMUJFWSA-N 1 0 328.368 3.907 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCSC1 ZINC000279934488 1039603636 /nfs/dbraw/zinc/60/36/36/1039603636.db2.gz JAMUPYSOECYOKJ-CHWSQXEVSA-N 1 0 326.487 3.808 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC[NH+](CC3CC3)CC1)CCCC2 ZINC000417323085 1039680641 /nfs/dbraw/zinc/68/06/41/1039680641.db2.gz NXGJLNSJBJVNBL-HXUWFJFHSA-N 1 0 343.471 3.826 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C1CCN(C3CC3)CC1)CCCC2 ZINC000417325528 1039682379 /nfs/dbraw/zinc/68/23/79/1039682379.db2.gz QUPYHZKXGOECOY-LJQANCHMSA-N 1 0 329.444 3.579 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000893301354 1039682482 /nfs/dbraw/zinc/68/24/82/1039682482.db2.gz AMAFNNISKLVNNI-LBPRGKRZSA-N 1 0 326.824 3.527 20 5 EHBDRO CO[C@@H](CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000417325129 1039683001 /nfs/dbraw/zinc/68/30/01/1039683001.db2.gz DLODJEFIVCEJCP-GJZGRUSLSA-N 1 0 346.349 3.919 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H]2C[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000417337556 1039695400 /nfs/dbraw/zinc/69/54/00/1039695400.db2.gz JCEZGDJNFGXXSH-KWCYVHTRSA-N 1 0 332.425 3.947 20 5 EHBDRO C[C@H]1[C@@H]([NH+]2CCCC2)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553359186 1040006135 /nfs/dbraw/zinc/00/61/35/1040006135.db2.gz WGLIGYZKEBPAQG-FZMZJTMJSA-N 1 0 343.349 3.677 20 5 EHBDRO Cn1ncc2ccc(C[NH2+][C@H]3CCCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000567533246 1040088019 /nfs/dbraw/zinc/08/80/19/1040088019.db2.gz DAOLORKRMNKMLU-SFHVURJKSA-N 1 0 336.395 3.649 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893320986 1040253818 /nfs/dbraw/zinc/25/38/18/1040253818.db2.gz WQJQPUKDDMFUKM-HUUCEWRRSA-N 1 0 326.824 3.932 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[N@@H+](C2CCCC2)CC1 ZINC000490013331 1040307190 /nfs/dbraw/zinc/30/71/90/1040307190.db2.gz LTXJJGGAWCTLAJ-MRXNPFEDSA-N 1 0 331.460 3.915 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555233453 1040321980 /nfs/dbraw/zinc/32/19/80/1040321980.db2.gz WKUIJPWLPQMIHI-CCKFTAQKSA-N 1 0 326.396 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](CCO)CC3CC3)s2)cc1 ZINC000092505871 1040335119 /nfs/dbraw/zinc/33/51/19/1040335119.db2.gz ZSPXIHNLKPKCOG-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO C[C@H]1C[C@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@@H+]1Cc1ccccc1 ZINC000511649213 1040398854 /nfs/dbraw/zinc/39/88/54/1040398854.db2.gz WCRKZIVYPNTJCS-RDJZCZTQSA-N 1 0 340.427 3.702 20 5 EHBDRO C[N@H+](CCSCCOc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000433018997 1040465487 /nfs/dbraw/zinc/46/54/87/1040465487.db2.gz HQKMFUSGGJRQGM-UHFFFAOYSA-N 1 0 346.452 3.839 20 5 EHBDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000433025969 1040490220 /nfs/dbraw/zinc/49/02/20/1040490220.db2.gz NJHPGRRHCAXDPG-CQSZACIVSA-N 1 0 340.427 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547909 1040588179 /nfs/dbraw/zinc/58/81/79/1040588179.db2.gz RICQBXKFDCFDEG-INIZCTEOSA-N 1 0 329.375 3.810 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cnc(-c3ccco3)s2)cc1[N+](=O)[O-] ZINC000486969893 1040591586 /nfs/dbraw/zinc/59/15/86/1040591586.db2.gz QYJYKMYDHAEBCV-UHFFFAOYSA-N 1 0 345.380 3.610 20 5 EHBDRO CC[C@H]1C[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487163795 1040746120 /nfs/dbraw/zinc/74/61/20/1040746120.db2.gz SPOZOAQKHOEQDO-NHYWBVRUSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000487183894 1040756402 /nfs/dbraw/zinc/75/64/02/1040756402.db2.gz FFZIJHSPJLPDJL-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371468 1040791797 /nfs/dbraw/zinc/79/17/97/1040791797.db2.gz MXYURLXIVJSOIU-CMPLNLGQSA-N 1 0 344.358 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000491057275 1040894891 /nfs/dbraw/zinc/89/48/91/1040894891.db2.gz KQYGJOSRMWHAJD-SFHVURJKSA-N 1 0 331.460 3.683 20 5 EHBDRO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000105895310 1040897254 /nfs/dbraw/zinc/89/72/54/1040897254.db2.gz LVNYKBKOEYOYGB-SUMWQHHRSA-N 1 0 328.416 3.843 20 5 EHBDRO Cn1cc(C[NH2+]C[C@H]2CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000555638828 1040942115 /nfs/dbraw/zinc/94/21/15/1040942115.db2.gz HKDRCJOWQKNVGK-MRXNPFEDSA-N 1 0 342.443 3.911 20 5 EHBDRO C[C@H]1CCC[N@H+](CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000566683304 1041176917 /nfs/dbraw/zinc/17/69/17/1041176917.db2.gz GTMQOXLOGDZYSX-SWLSCSKDSA-N 1 0 345.365 3.520 20 5 EHBDRO CC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CC1(C)C ZINC000419315164 1041276003 /nfs/dbraw/zinc/27/60/03/1041276003.db2.gz JIDMINXPSNGAFP-KBPBESRZSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000111034298 1041704068 /nfs/dbraw/zinc/70/40/68/1041704068.db2.gz ARWMWLMUTWFEGU-SFHVURJKSA-N 1 0 341.411 3.925 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072394 1041814566 /nfs/dbraw/zinc/81/45/66/1041814566.db2.gz BZGFPRFSLOUBKH-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H]1CCC[N@H+](CCNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000108086462 1042005618 /nfs/dbraw/zinc/00/56/18/1042005618.db2.gz ILRYCXKYUWEKNW-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NCc1cccc(C[NH+]2CCCC2)c1 ZINC000025502839 1042186768 /nfs/dbraw/zinc/18/67/68/1042186768.db2.gz DEKYWUFHWLOFCW-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO Cc1nc2c(s1)[C@H]([N@H+](C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111310249 1042261416 /nfs/dbraw/zinc/26/14/16/1042261416.db2.gz WBRVFBJVABDQKY-MRXNPFEDSA-N 1 0 347.440 3.748 20 5 EHBDRO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](CO)C(C)(C)C ZINC000093821753 1042544730 /nfs/dbraw/zinc/54/47/30/1042544730.db2.gz BCDXHMYCIYELMF-OAHLLOKOSA-N 1 0 349.456 3.557 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799438 1042700763 /nfs/dbraw/zinc/70/07/63/1042700763.db2.gz ZMGDHQPYHQJVRS-CZUORRHYSA-N 1 0 334.416 3.782 20 5 EHBDRO COc1cc(NCCC[NH+](C(C)C)C(C)C)c([N+](=O)[O-])cc1F ZINC000343927498 1042851906 /nfs/dbraw/zinc/85/19/06/1042851906.db2.gz SUQLXKUQCGXBFO-UHFFFAOYSA-N 1 0 327.400 3.663 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc(NC(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000165662654 1042876488 /nfs/dbraw/zinc/87/64/88/1042876488.db2.gz OWCKUPGOCUVNMB-LJQANCHMSA-N 1 0 341.411 3.837 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)C1 ZINC000568872037 1042900276 /nfs/dbraw/zinc/90/02/76/1042900276.db2.gz QRKMGVKYDCXPRY-SWLSCSKDSA-N 1 0 345.365 3.520 20 5 EHBDRO CC(C)c1ccc(CN(C)CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000007905835 1042924362 /nfs/dbraw/zinc/92/43/62/1042924362.db2.gz GNHUOVCXEBQERH-UHFFFAOYSA-N 1 0 341.411 3.789 20 5 EHBDRO COc1ccc([C@@H](C[NH+]2CCCC2)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000302030550 1042966948 /nfs/dbraw/zinc/96/69/48/1042966948.db2.gz BSWCGORKYGBGTI-GOSISDBHSA-N 1 0 341.411 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC3CC(O)C3)s2)cc1 ZINC000432363090 1043002971 /nfs/dbraw/zinc/00/29/71/1043002971.db2.gz SDJPLIJDIHJQBL-UHFFFAOYSA-N 1 0 332.425 3.574 20 5 EHBDRO COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000512050874 1043043669 /nfs/dbraw/zinc/04/36/69/1043043669.db2.gz FGBMPQNCMKFKQD-PTNGSMBKSA-N 1 0 326.396 3.934 20 5 EHBDRO Cc1ccccc1CN(C)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728895802 1043492396 /nfs/dbraw/zinc/49/23/96/1043492396.db2.gz IAPONGYLHUQORW-UHFFFAOYSA-N 1 0 336.395 3.856 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@H]3C2)c([N+](=O)[O-])cc1OC ZINC000344342316 1043691381 /nfs/dbraw/zinc/69/13/81/1043691381.db2.gz CWRAQAABAOESNC-KCQAQPDRSA-N 1 0 334.416 3.670 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000279669987 1044389673 /nfs/dbraw/zinc/38/96/73/1044389673.db2.gz NEGIUXHGCZGLFH-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068978 1127569962 /nfs/dbraw/zinc/56/99/62/1127569962.db2.gz UUHLSDBARMJYBS-DLBZAZTESA-N 1 0 346.456 3.570 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)c(Cl)c1 ZINC000301285504 1127728686 /nfs/dbraw/zinc/72/86/86/1127728686.db2.gz QKIMPSGCYLJJEO-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000301426065 1127742557 /nfs/dbraw/zinc/74/25/57/1127742557.db2.gz PBMBNLHBQZRWOB-LRDDRELGSA-N 1 0 332.429 3.546 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cnn3ccccc23)c2cc([N+](=O)[O-])ccc21 ZINC000552318893 1127749249 /nfs/dbraw/zinc/74/92/49/1127749249.db2.gz AEDZFXWWHNABQN-KRWDZBQOSA-N 1 0 336.395 3.755 20 5 EHBDRO Cc1ccncc1CCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000347576119 1128112651 /nfs/dbraw/zinc/11/26/51/1128112651.db2.gz AGYNTOSOGJQRNQ-UHFFFAOYSA-N 1 0 325.412 3.895 20 5 EHBDRO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000091080482 1128445777 /nfs/dbraw/zinc/44/57/77/1128445777.db2.gz JKNSKHPVHJHOQZ-QGZVFWFLSA-N 1 0 344.415 3.541 20 5 EHBDRO Cc1cc(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)ncc1[N+](=O)[O-] ZINC000301470379 1128468192 /nfs/dbraw/zinc/46/81/92/1128468192.db2.gz IUNCBBYXONFTSU-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO O=[N+]([O-])c1c(NC2CC[NH+](C3CCCCC3)CC2)nc2sccn21 ZINC000301482099 1128473322 /nfs/dbraw/zinc/47/33/22/1128473322.db2.gz SWQULMVOOFUAIO-UHFFFAOYSA-N 1 0 349.460 3.513 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNCc1ccccc1N(C)CC ZINC001649118029 1128489186 /nfs/dbraw/zinc/48/91/86/1128489186.db2.gz VPVZBGWKZQLWNL-UHFFFAOYSA-N 1 0 343.427 3.739 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C1CC(C(F)(F)F)C1)C1CC1 ZINC000554119006 1128619602 /nfs/dbraw/zinc/61/96/02/1128619602.db2.gz VCBAJDOTJXCFCI-JXQTWKCFSA-N 1 0 328.334 3.846 20 5 EHBDRO CC[N@H+](CC(C)C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737679 1128661382 /nfs/dbraw/zinc/66/13/82/1128661382.db2.gz JAKKLFPIYPWRSH-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2cccc(OCc3ccccn3)c2)c1 ZINC001648813838 1120046667 /nfs/dbraw/zinc/04/66/67/1120046667.db2.gz BJWHEFYTQFMCST-UHFFFAOYSA-N 1 0 349.390 3.859 20 5 EHBDRO CCOC[C@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000494226010 1120507352 /nfs/dbraw/zinc/50/73/52/1120507352.db2.gz DYCHRYALBVGZOQ-HNNXBMFYSA-N 1 0 343.427 3.877 20 5 EHBDRO Cc1ccnc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c1[N+](=O)[O-] ZINC000301685433 1128921334 /nfs/dbraw/zinc/92/13/34/1128921334.db2.gz VKBVJBFHRMFPRX-INIZCTEOSA-N 1 0 346.475 3.779 20 5 EHBDRO CC1(C)CN(c2ccsc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000609193630 1120543049 /nfs/dbraw/zinc/54/30/49/1120543049.db2.gz VVRKXMNPVUVHTB-UHFFFAOYSA-N 1 0 331.441 3.757 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000542497319 1120785232 /nfs/dbraw/zinc/78/52/32/1120785232.db2.gz AICKVBSQJVWZAY-GJZGRUSLSA-N 1 0 332.400 3.795 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069267 1120887743 /nfs/dbraw/zinc/88/77/43/1120887743.db2.gz FHHNAQQESBYAAP-IBGZPJMESA-N 1 0 342.443 3.545 20 5 EHBDRO C[C@@H](CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])[NH+](C)C ZINC000914771012 1120981303 /nfs/dbraw/zinc/98/13/03/1120981303.db2.gz KVODNIOMCGMFGL-ZETCQYMHSA-N 1 0 325.718 3.629 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001626016617 1120981626 /nfs/dbraw/zinc/98/16/26/1120981626.db2.gz WJUBDFNFGUMIKG-MRXNPFEDSA-N 1 0 347.459 3.596 20 5 EHBDRO Cc1cccc(NC(=O)CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153234122 1121159506 /nfs/dbraw/zinc/15/95/06/1121159506.db2.gz NCPBFESPFIYDQL-UHFFFAOYSA-N 1 0 339.395 3.506 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000762616354 1121383564 /nfs/dbraw/zinc/38/35/64/1121383564.db2.gz SAARJDZHKLXKCW-ZLGCAGECSA-N 1 0 336.482 3.577 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[NH+]1CCCC1 ZINC000076664772 1121515522 /nfs/dbraw/zinc/51/55/22/1121515522.db2.gz IBZZYYJYSXVFDV-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000301108095 1121924583 /nfs/dbraw/zinc/92/45/83/1121924583.db2.gz JGHCCQGBUUGAMB-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001168521058 1122346268 /nfs/dbraw/zinc/34/62/68/1122346268.db2.gz YGHAYXAGCBQWPI-OAHLLOKOSA-N 1 0 333.432 3.872 20 5 EHBDRO COCC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(C)c(C)c1 ZINC000917148015 1122539284 /nfs/dbraw/zinc/53/92/84/1122539284.db2.gz UEXQUBFXMWRZGM-UHFFFAOYSA-N 1 0 328.412 3.860 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCC[C@H]1n1cccn1 ZINC000128573754 1122628142 /nfs/dbraw/zinc/62/81/42/1122628142.db2.gz JNDSVNAWVBTNFR-HUUCEWRRSA-N 1 0 334.807 3.718 20 5 EHBDRO CC[C@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000556203756 1122874086 /nfs/dbraw/zinc/87/40/86/1122874086.db2.gz ZGBHLTWEOBESOX-ZVZYQTTQSA-N 1 0 342.443 3.976 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@@H]3CCCO3)o2)cc1 ZINC000556620408 1123063714 /nfs/dbraw/zinc/06/37/14/1123063714.db2.gz ZXHACWCQRLSJRR-HKUYNNGSSA-N 1 0 342.395 3.998 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1c(F)cncc1F ZINC000556916374 1123200757 /nfs/dbraw/zinc/20/07/57/1123200757.db2.gz IDLJTEXNDQOAPZ-RYUDHWBXSA-N 1 0 335.354 3.940 20 5 EHBDRO C[C@H](CNc1cccc(F)c1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000919963679 1123248645 /nfs/dbraw/zinc/24/86/45/1123248645.db2.gz SLQLWQXCSMGWPT-CYBMUJFWSA-N 1 0 329.375 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCCCC[NH+]2CCCC2)c2nonc21 ZINC000920337742 1123358796 /nfs/dbraw/zinc/35/87/96/1123358796.db2.gz LSKVNNJJZVBHJS-UHFFFAOYSA-N 1 0 347.419 3.589 20 5 EHBDRO Cc1cc(C(=O)NCCCCCCC[NH+]2CCCC2)cc([N+](=O)[O-])c1 ZINC000921088912 1123463814 /nfs/dbraw/zinc/46/38/14/1123463814.db2.gz SSHJYTQWAOUJST-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000609354280 1123553727 /nfs/dbraw/zinc/55/37/27/1123553727.db2.gz NLXOCADLNIOGCH-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccco2)C1 ZINC000609539971 1123607399 /nfs/dbraw/zinc/60/73/99/1123607399.db2.gz LLPGIGRHURUTHB-CQSZACIVSA-N 1 0 330.384 3.965 20 5 EHBDRO CC[NH+](CC)C[C@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000609599654 1123620056 /nfs/dbraw/zinc/62/00/56/1123620056.db2.gz KDURSFLHHHYQTI-ZDUSSCGKSA-N 1 0 348.472 3.538 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)NCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000609599653 1123620286 /nfs/dbraw/zinc/62/02/86/1123620286.db2.gz KDURSFLHHHYQTI-CYBMUJFWSA-N 1 0 348.472 3.538 20 5 EHBDRO CC[NH+](CC)CC(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000609762780 1123663138 /nfs/dbraw/zinc/66/31/38/1123663138.db2.gz UFWDAAQJTKJTJT-UHFFFAOYSA-N 1 0 343.383 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)cc1 ZINC000064550905 1123667186 /nfs/dbraw/zinc/66/71/86/1123667186.db2.gz DZASKKSYUPASEA-CQSZACIVSA-N 1 0 331.441 3.980 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000064550906 1123667333 /nfs/dbraw/zinc/66/73/33/1123667333.db2.gz QXGQXLVYXKBFRA-CQSZACIVSA-N 1 0 331.441 3.980 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccn2CCC(C)C)cc1[N+](=O)[O-] ZINC000610007499 1123712984 /nfs/dbraw/zinc/71/29/84/1123712984.db2.gz CGZGUHPQFCFXLR-UHFFFAOYSA-N 1 0 331.416 3.741 20 5 EHBDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090809972 1123792877 /nfs/dbraw/zinc/79/28/77/1123792877.db2.gz AULIWBRBFQQTJP-AEFFLSMTSA-N 1 0 334.460 3.549 20 5 EHBDRO Cc1ccccc1CN(C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000007845532 1123836248 /nfs/dbraw/zinc/83/62/48/1123836248.db2.gz VKYDLYXEWJSRQN-UHFFFAOYSA-N 1 0 347.802 3.627 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301832638 1129174309 /nfs/dbraw/zinc/17/43/09/1129174309.db2.gz RNUWMXXDAVTEGA-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO COCCOc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000163008123 1125022213 /nfs/dbraw/zinc/02/22/13/1125022213.db2.gz XAFUKKDTUZZGLJ-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)NCCC2=CCCCC2)cc1[N+](=O)[O-] ZINC000181830405 1125053838 /nfs/dbraw/zinc/05/38/38/1125053838.db2.gz DIUVRPXWYROJJS-OAHLLOKOSA-N 1 0 345.443 3.561 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCCCc2ccccc2)n1 ZINC000618562226 1125112795 /nfs/dbraw/zinc/11/27/95/1125112795.db2.gz SNWGVVJJTGOPKS-MSOLQXFVSA-N 1 0 342.443 3.888 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](C)c1ccsc1 ZINC000619783150 1125404293 /nfs/dbraw/zinc/40/42/93/1125404293.db2.gz OXEBECVTTRICMQ-GFCCVEGCSA-N 1 0 333.413 3.644 20 5 EHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000183084358 1125435409 /nfs/dbraw/zinc/43/54/09/1125435409.db2.gz MGBRKBGLKXYKQT-UWVGGRQHSA-N 1 0 332.347 3.729 20 5 EHBDRO Cn1cc(C[NH2+]C/C=C\c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000255869441 1129213811 /nfs/dbraw/zinc/21/38/11/1129213811.db2.gz IEXMXWHEIKZOFN-YVMONPNESA-N 1 0 348.406 3.798 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000078989346 1129220442 /nfs/dbraw/zinc/22/04/42/1129220442.db2.gz YFZSZBYULWLLHS-CHWSQXEVSA-N 1 0 328.368 3.778 20 5 EHBDRO COc1cc(NC[C@@H](c2cccs2)[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC000301870696 1129252081 /nfs/dbraw/zinc/25/20/81/1129252081.db2.gz PEFDJGXKFYZDLQ-ZDUSSCGKSA-N 1 0 339.392 3.519 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894155 1129289859 /nfs/dbraw/zinc/28/98/59/1129289859.db2.gz WWEOAMCRNSXCSQ-YOEHRIQHSA-N 1 0 346.818 3.809 20 5 EHBDRO CC(C)([NH2+]Cc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000080347065 1129348189 /nfs/dbraw/zinc/34/81/89/1129348189.db2.gz OGWMMABKNZSOIK-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000530461422 1129382924 /nfs/dbraw/zinc/38/29/24/1129382924.db2.gz CLMRHAKFKBBUQV-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1cc(NCC2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000301947781 1129400427 /nfs/dbraw/zinc/40/04/27/1129400427.db2.gz ATSTXXFMDMBZQE-UHFFFAOYSA-N 1 0 326.400 3.627 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@]2(C)CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543400008 1129460621 /nfs/dbraw/zinc/46/06/21/1129460621.db2.gz SPSZYAYTNANOBL-MOPGFXCFSA-N 1 0 344.411 3.998 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(c3cccc(F)c3[N+](=O)[O-])C2)CC1 ZINC000301977648 1129466057 /nfs/dbraw/zinc/46/60/57/1129466057.db2.gz FZOWOWBVJJKXAH-HNNXBMFYSA-N 1 0 335.423 3.682 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000466474248 1129477587 /nfs/dbraw/zinc/47/75/87/1129477587.db2.gz NYDMXKXUPSXYKC-BLLLJJGKSA-N 1 0 326.824 3.789 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000543458654 1129501179 /nfs/dbraw/zinc/50/11/79/1129501179.db2.gz IYJTZFSDBQKRET-SUMWQHHRSA-N 1 0 334.416 3.757 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nc2c(s1)CCC2 ZINC000922470740 1129540981 /nfs/dbraw/zinc/54/09/81/1129540981.db2.gz RJQOQOBPUBKUMJ-WQLSENKSSA-N 1 0 329.425 3.733 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000328112998 1129548339 /nfs/dbraw/zinc/54/83/39/1129548339.db2.gz UYTPKRJJDIVYOW-JFIYKMOQSA-N 1 0 348.443 3.509 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000390073640 1129602458 /nfs/dbraw/zinc/60/24/58/1129602458.db2.gz PNQKEHRAOVMWGH-UHFFFAOYSA-N 1 0 328.412 3.722 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc(OC)c([N+](=O)[O-])c3)C2)cc1 ZINC000155214828 1129619610 /nfs/dbraw/zinc/61/96/10/1129619610.db2.gz HVUKIXAKCTWXNN-MRXNPFEDSA-N 1 0 342.395 3.602 20 5 EHBDRO CC(C)[C@@H](C)NC(=O)C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000331276514 1129658881 /nfs/dbraw/zinc/65/88/81/1129658881.db2.gz QXOVRYXMMYBKEP-HUUCEWRRSA-N 1 0 347.459 3.529 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196365 1129805471 /nfs/dbraw/zinc/80/54/71/1129805471.db2.gz FOXLQVNSTPQZSJ-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1cccc(Cl)c1 ZINC000056197509 1129806810 /nfs/dbraw/zinc/80/68/10/1129806810.db2.gz DMLHTGSJHQGWEP-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509142646 1129842246 /nfs/dbraw/zinc/84/22/46/1129842246.db2.gz UNFBVSMUCLIZEF-HZPDHXFCSA-N 1 0 328.359 3.556 20 5 EHBDRO CC[N@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000132094325 1129875755 /nfs/dbraw/zinc/87/57/55/1129875755.db2.gz SVPOATPLILJMFJ-OAHLLOKOSA-N 1 0 341.411 3.752 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000163022466 1129916097 /nfs/dbraw/zinc/91/60/97/1129916097.db2.gz DSWMIKYBYNOFEG-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO CCc1ccc(NC(=O)c2ccc(-n3ccnc3)c([N+](=O)[O-])c2)cc1 ZINC000031814534 1129964342 /nfs/dbraw/zinc/96/43/42/1129964342.db2.gz XUZRPIBBIAJTOE-UHFFFAOYSA-N 1 0 336.351 3.595 20 5 EHBDRO COC[C@H]1CCCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000466632228 1129993704 /nfs/dbraw/zinc/99/37/04/1129993704.db2.gz DZGUBOPKZJJVNT-AWEZNQCLSA-N 1 0 329.400 3.704 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414160 1130054977 /nfs/dbraw/zinc/05/49/77/1130054977.db2.gz QCLLMALIXMXFJB-HUBLWGQQSA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878117 1130178035 /nfs/dbraw/zinc/17/80/35/1130178035.db2.gz JYAIVDKNIFZNSQ-CHWSQXEVSA-N 1 0 337.420 3.501 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(C[NH+](C)C)c1 ZINC000173612113 1130259602 /nfs/dbraw/zinc/25/96/02/1130259602.db2.gz NZHZWIHWERJOSC-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1cccc(OCC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429246538 1130321778 /nfs/dbraw/zinc/32/17/78/1130321778.db2.gz RZQSFVFSBRZXFF-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO CC[N@@H+]1CC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245907099 1130330223 /nfs/dbraw/zinc/33/02/23/1130330223.db2.gz FJFVBIMQLOFCHF-OXQOHEQNSA-N 1 0 339.439 3.616 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H]2CCCC[C@H]2O)c2ccccc2)c1 ZINC000246045049 1130338248 /nfs/dbraw/zinc/33/82/48/1130338248.db2.gz XMNBZJCSZPKVEB-DFQSSKMNSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[C@@H](O)C2)s1 ZINC000174430242 1130358446 /nfs/dbraw/zinc/35/84/46/1130358446.db2.gz URHCMONPJMGGMU-UONOGXRCSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1ccc(OCCC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429253869 1130394541 /nfs/dbraw/zinc/39/45/41/1130394541.db2.gz COJOOBPBVNOREB-UHFFFAOYSA-N 1 0 344.411 3.897 20 5 EHBDRO CCCC[NH+]1CCC(Nc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731206256 1130779676 /nfs/dbraw/zinc/77/96/76/1130779676.db2.gz CMHUQTKDYYNRKI-UHFFFAOYSA-N 1 0 334.445 3.881 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794895 1131082178 /nfs/dbraw/zinc/08/21/78/1131082178.db2.gz HITFVLDUVBCBSW-JKSUJKDBSA-N 1 0 349.450 3.820 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000766194134 1131161092 /nfs/dbraw/zinc/16/10/92/1131161092.db2.gz QBTXFGHERFRWBB-MRXNPFEDSA-N 1 0 329.356 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cc(F)cnc1Cl)CC2 ZINC001172898419 1131882196 /nfs/dbraw/zinc/88/21/96/1131882196.db2.gz AOAQMIYGJIQESB-OAHLLOKOSA-N 1 0 349.793 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cc(F)cnc1Cl)CC2 ZINC001172898418 1131883127 /nfs/dbraw/zinc/88/31/27/1131883127.db2.gz AOAQMIYGJIQESB-HNNXBMFYSA-N 1 0 349.793 3.820 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(N)c1 ZINC001172901024 1131883601 /nfs/dbraw/zinc/88/36/01/1131883601.db2.gz FPIHSXCJOGHPQF-SCLBCKFNSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cncn1C1CCC1)CC2 ZINC001172902704 1131884827 /nfs/dbraw/zinc/88/48/27/1131884827.db2.gz BOQKJUSYNMTTFJ-INIZCTEOSA-N 1 0 340.427 3.554 20 5 EHBDRO Cc1nc(C)c(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)s1 ZINC001172901593 1131885382 /nfs/dbraw/zinc/88/53/82/1131885382.db2.gz OHFMTZIITAPKQF-OAHLLOKOSA-N 1 0 331.441 3.705 20 5 EHBDRO COc1ccc(CC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172901900 1131885391 /nfs/dbraw/zinc/88/53/91/1131885391.db2.gz RDVKLZVRCBBFDN-SFHVURJKSA-N 1 0 340.423 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1Cc3ccccc3C1)CC2 ZINC001172905182 1131886411 /nfs/dbraw/zinc/88/64/11/1131886411.db2.gz RFPKLVBGFFSTRE-FQEVSTJZSA-N 1 0 336.435 3.847 20 5 EHBDRO COCc1cccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172904673 1131886600 /nfs/dbraw/zinc/88/66/00/1131886600.db2.gz ZLYLOWWXTPAEPU-IBGZPJMESA-N 1 0 340.423 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOc1ccccc1)CC2 ZINC001172896614 1131900672 /nfs/dbraw/zinc/90/06/72/1131900672.db2.gz PSGLTMSFHLONHG-QGZVFWFLSA-N 1 0 326.396 3.511 20 5 EHBDRO CC(C)([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172896712 1131902781 /nfs/dbraw/zinc/90/27/81/1131902781.db2.gz RKNCEOKUZYBXJF-KRWDZBQOSA-N 1 0 325.412 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](c3cccnc3)C1)CC2 ZINC001172915536 1131902853 /nfs/dbraw/zinc/90/28/53/1131902853.db2.gz OPGPJTKXIRCVRN-RBUKOAKNSA-N 1 0 337.423 3.727 20 5 EHBDRO CCOCC1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912461 1131917431 /nfs/dbraw/zinc/91/74/31/1131917431.db2.gz ABJPBCAZCCEYCK-SFHVURJKSA-N 1 0 332.444 3.591 20 5 EHBDRO CC1CC([N@H+](C)C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173010799 1131935873 /nfs/dbraw/zinc/93/58/73/1131935873.db2.gz ZHZKTMLQXYYVRR-UHFFFAOYSA-N 1 0 339.386 3.572 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)c1F ZINC001173175503 1131991627 /nfs/dbraw/zinc/99/16/27/1131991627.db2.gz CWLYHCJBMQBZIC-RYUDHWBXSA-N 1 0 348.374 3.730 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)CC2CC(F)(F)C2)c1F ZINC001173195473 1131996244 /nfs/dbraw/zinc/99/62/44/1131996244.db2.gz GONQWSJOSQRWBM-JTQLQIEISA-N 1 0 346.349 3.651 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1OC(F)F ZINC001173219087 1132002968 /nfs/dbraw/zinc/00/29/68/1132002968.db2.gz WVQMLWHNGXQBBQ-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001173219586 1132003257 /nfs/dbraw/zinc/00/32/57/1132003257.db2.gz DOQUWDGPIXOBRQ-KSSFIOAISA-N 1 0 348.443 3.627 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1COc2cc(Cl)ccc21 ZINC001173218148 1132003288 /nfs/dbraw/zinc/00/32/88/1132003288.db2.gz BPYGMKORNOLFNJ-BZNIZROVSA-N 1 0 332.787 3.903 20 5 EHBDRO CCOC(=O)C[C@H]1CC[C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173218584 1132003644 /nfs/dbraw/zinc/00/36/44/1132003644.db2.gz KSFZWLWFMICYMR-DJIMGWMZSA-N 1 0 348.443 3.627 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC001173224927 1132005525 /nfs/dbraw/zinc/00/55/25/1132005525.db2.gz PGIKUXPQWHFQPA-XIKOKIGWSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1cc([C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccn1 ZINC001173227430 1132006554 /nfs/dbraw/zinc/00/65/54/1132006554.db2.gz FPWLZHAKFSBJNM-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001173225939 1132007104 /nfs/dbraw/zinc/00/71/04/1132007104.db2.gz GTJQWEGJIAHDJY-OXQOHEQNSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC(C)(C)O2)CC1 ZINC001173230246 1132008029 /nfs/dbraw/zinc/00/80/29/1132008029.db2.gz DHPZJLPYUUWPDE-OAHLLOKOSA-N 1 0 332.444 3.949 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2cccnc2)CC1 ZINC001173231896 1132008724 /nfs/dbraw/zinc/00/87/24/1132008724.db2.gz OQYDKXVEZLTKOS-HNNXBMFYSA-N 1 0 325.412 3.800 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2cccnc2)CC1 ZINC001173231898 1132009067 /nfs/dbraw/zinc/00/90/67/1132009067.db2.gz OQYDKXVEZLTKOS-OAHLLOKOSA-N 1 0 325.412 3.800 20 5 EHBDRO COc1cc2c(cc1C)C[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173234338 1132010825 /nfs/dbraw/zinc/01/08/25/1132010825.db2.gz OEPDJNZOCKTGJP-RDTXWAMCSA-N 1 0 340.423 3.600 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC001173209518 1132012733 /nfs/dbraw/zinc/01/27/33/1132012733.db2.gz CODLRWXCVJHJKV-SJCJKPOMSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1ccc2c(c1)OCCO2 ZINC001173210063 1132012812 /nfs/dbraw/zinc/01/28/12/1132012812.db2.gz HKSYQPFEJRHBTL-KGLIPLIRSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OC(F)F)c1 ZINC001173211542 1132013819 /nfs/dbraw/zinc/01/38/19/1132013819.db2.gz SNBHOUDNIQQILN-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173213552 1132015379 /nfs/dbraw/zinc/01/53/79/1132015379.db2.gz GFOQYYLZURQKGN-RDTXWAMCSA-N 1 0 340.423 3.682 20 5 EHBDRO O=C(C[NH+]1C2CCCC1CCC2)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000744406287 1132090176 /nfs/dbraw/zinc/09/01/76/1132090176.db2.gz HQUMSDWWEUQIJI-UHFFFAOYSA-N 1 0 337.807 3.594 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000744437182 1132093268 /nfs/dbraw/zinc/09/32/68/1132093268.db2.gz JNGPPJGCDCFSEH-OAHLLOKOSA-N 1 0 328.416 3.784 20 5 EHBDRO NC(=O)c1cccc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)c1 ZINC001174059772 1132211556 /nfs/dbraw/zinc/21/15/56/1132211556.db2.gz XCUPHMIZPABAOT-UHFFFAOYSA-N 1 0 328.375 3.813 20 5 EHBDRO [NH3+]CCN(c1ccc(-c2ccc([N+](=O)[O-])cc2)cc1)c1cccnc1 ZINC001168837735 1132576202 /nfs/dbraw/zinc/57/62/02/1132576202.db2.gz KOYGHZZXKAODCT-UHFFFAOYSA-N 1 0 334.379 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](C[C@H]2CCC3(CCC3)CO2)C2CC2)cc1 ZINC001168860546 1132582652 /nfs/dbraw/zinc/58/26/52/1132582652.db2.gz YSHPWNXVTLLPTJ-GOSISDBHSA-N 1 0 330.428 3.909 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039022 1132638508 /nfs/dbraw/zinc/63/85/08/1132638508.db2.gz MPANHCCZJQYBLO-AAEUAGOBSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040026 1132638553 /nfs/dbraw/zinc/63/85/53/1132638553.db2.gz XCAHBRMZIXAPMC-AAEUAGOBSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048729 1132641512 /nfs/dbraw/zinc/64/15/12/1132641512.db2.gz BCEVZSGTKCSIOT-GXFFZTMASA-N 1 0 329.227 3.797 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](N2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052014 1132642846 /nfs/dbraw/zinc/64/28/46/1132642846.db2.gz FOHUXDDFXMMXCI-GXTWGEPZSA-N 1 0 329.425 3.571 20 5 EHBDRO C[C@@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001169396211 1132745763 /nfs/dbraw/zinc/74/57/63/1132745763.db2.gz PZCBRPNEPHZTLG-LLVKDONJSA-N 1 0 327.222 3.979 20 5 EHBDRO CC(C)C1(C)CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169508288 1132773546 /nfs/dbraw/zinc/77/35/46/1132773546.db2.gz WVMMSMVZOPXYQY-CQSZACIVSA-N 1 0 333.432 3.680 20 5 EHBDRO COCC[C@H](c1ccccc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000767118572 1132951024 /nfs/dbraw/zinc/95/10/24/1132951024.db2.gz JRUUFSDTNLXWHP-GOSISDBHSA-N 1 0 326.396 3.731 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1C[C@@H]2CCC[C@@H]2C1 ZINC001176874617 1133006459 /nfs/dbraw/zinc/00/64/59/1133006459.db2.gz PBTYUGCOCDKWPR-PHIMTYICSA-N 1 0 325.206 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000767726984 1133043704 /nfs/dbraw/zinc/04/37/04/1133043704.db2.gz FDNFOJUCNAQCTG-OAHLLOKOSA-N 1 0 332.787 3.601 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC001178370352 1133160209 /nfs/dbraw/zinc/16/02/09/1133160209.db2.gz YEJWJTRKEDTNRY-QGZVFWFLSA-N 1 0 342.395 3.779 20 5 EHBDRO CC(C)CC[C@@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179154646 1133232347 /nfs/dbraw/zinc/23/23/47/1133232347.db2.gz ZTDZYDJUPUQYAD-AWEZNQCLSA-N 1 0 332.400 3.742 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246256 1133250837 /nfs/dbraw/zinc/25/08/37/1133250837.db2.gz YOWMXNWIGUYFLE-QUCCMNQESA-N 1 0 340.423 3.991 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cc(F)ccc2N(C)C)cc1[N+](=O)[O-] ZINC001179830199 1133287073 /nfs/dbraw/zinc/28/70/73/1133287073.db2.gz MOVODZMEYSFYFP-GFCCVEGCSA-N 1 0 347.390 3.659 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3cccc(C4CC4)c3)CC2)c1 ZINC001180253840 1133351108 /nfs/dbraw/zinc/35/11/08/1133351108.db2.gz UDDAAQCLMJPEQS-UHFFFAOYSA-N 1 0 337.423 3.794 20 5 EHBDRO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC001180332806 1133362731 /nfs/dbraw/zinc/36/27/31/1133362731.db2.gz UMTRUPSFZBQVBH-WFASDCNBSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1nn(C[N@H+]2CC[C@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670938 1133457927 /nfs/dbraw/zinc/45/79/27/1133457927.db2.gz UUMJLEBWSMXHCG-ZDUSSCGKSA-N 1 0 328.416 3.723 20 5 EHBDRO CCOc1ccc(Cl)cc1CN(CC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC001181463431 1133490563 /nfs/dbraw/zinc/49/05/63/1133490563.db2.gz ANLSQLPIHCIWTK-UHFFFAOYSA-N 1 0 349.818 3.612 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000774146897 1133622199 /nfs/dbraw/zinc/62/21/99/1133622199.db2.gz JPAKVNZKPKFYBM-COXVUDFISA-N 1 0 346.406 3.807 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cccc1[N+](=O)[O-] ZINC000774382857 1133667689 /nfs/dbraw/zinc/66/76/89/1133667689.db2.gz VMHZMFSPWGQSNB-QGZVFWFLSA-N 1 0 341.367 3.979 20 5 EHBDRO Cc1ccc([C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000774408866 1133673060 /nfs/dbraw/zinc/67/30/60/1133673060.db2.gz JRCZJJBTCHYNBN-RTBURBONSA-N 1 0 326.396 3.678 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517581 1133702865 /nfs/dbraw/zinc/70/28/65/1133702865.db2.gz HNBGPFDUYJUPOT-RVKKMQEKSA-N 1 0 347.459 3.583 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(Cl)nc2)cc(C(F)(F)F)c1 ZINC000785523298 1133716910 /nfs/dbraw/zinc/71/69/10/1133716910.db2.gz YPAIUTKGUXRGNC-UHFFFAOYSA-N 1 0 345.708 3.952 20 5 EHBDRO Cc1ccnc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC001183596794 1133832014 /nfs/dbraw/zinc/83/20/14/1133832014.db2.gz CQRNYCIEBJSXAU-QAPCUYQASA-N 1 0 325.412 3.799 20 5 EHBDRO Cc1ccnc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC001183596796 1133832175 /nfs/dbraw/zinc/83/21/75/1133832175.db2.gz CQRNYCIEBJSXAU-YJBOKZPZSA-N 1 0 325.412 3.799 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)O1 ZINC001183980439 1133884781 /nfs/dbraw/zinc/88/47/81/1133884781.db2.gz ANMQVEWQWBCDSO-LBPRGKRZSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CC[C@H](C2CC2)O1 ZINC001184056396 1133890861 /nfs/dbraw/zinc/89/08/61/1133890861.db2.gz POGKVHYCZSAZBK-TZMCWYRMSA-N 1 0 345.226 3.949 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC000786811093 1133909606 /nfs/dbraw/zinc/90/96/06/1133909606.db2.gz ICWCOTAOROXXSH-IPJDOKCGSA-N 1 0 326.396 3.841 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc2c1OCCO2 ZINC000786815417 1133909979 /nfs/dbraw/zinc/90/99/79/1133909979.db2.gz SJQMVCNKDDOMBM-UVTDQMKNSA-N 1 0 340.379 3.559 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1ccc(F)cc1 ZINC000786819382 1133911271 /nfs/dbraw/zinc/91/12/71/1133911271.db2.gz BVYCCROTPWBWHT-CPPNXCSESA-N 1 0 344.386 3.635 20 5 EHBDRO C[C@H](OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877272 1133916029 /nfs/dbraw/zinc/91/60/29/1133916029.db2.gz CDKQUPUZLPHLKS-GUYCJALGSA-N 1 0 332.400 3.606 20 5 EHBDRO C[C@H](OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879808 1133923521 /nfs/dbraw/zinc/92/35/21/1133923521.db2.gz DVQCHOSYMBRABG-SUMWQHHRSA-N 1 0 332.400 3.606 20 5 EHBDRO Cc1cc(N2CCC[N@H+](Cc3ccc(C)cc3)CC2)c([N+](=O)[O-])s1 ZINC001184681128 1133981009 /nfs/dbraw/zinc/98/10/09/1133981009.db2.gz KQWSRLBKFOTBRO-UHFFFAOYSA-N 1 0 345.468 3.985 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666696 1133986315 /nfs/dbraw/zinc/98/63/15/1133986315.db2.gz PBLPFCQSVRFIDM-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C[C@H]2CCCO2)cc1F ZINC000788479665 1134130632 /nfs/dbraw/zinc/13/06/32/1134130632.db2.gz ZLXQAMVHWAKAGX-QGZVFWFLSA-N 1 0 344.386 3.915 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC001185775487 1134131604 /nfs/dbraw/zinc/13/16/04/1134131604.db2.gz QERDDIRMVBMERO-MWLCHTKSSA-N 1 0 329.322 3.651 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788609361 1134145460 /nfs/dbraw/zinc/14/54/60/1134145460.db2.gz HRSGIICIROAYLN-GTNSWQLSSA-N 1 0 349.818 3.869 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688721 1134157661 /nfs/dbraw/zinc/15/76/61/1134157661.db2.gz GTQQPQPTWQVQQF-FMTVUPSXSA-N 1 0 347.390 3.743 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccc(C)cc1 ZINC000775016696 1134212369 /nfs/dbraw/zinc/21/23/69/1134212369.db2.gz TVKBSXJESCWMTI-XZGNNNQISA-N 1 0 326.396 3.630 20 5 EHBDRO CCC[N@H+](CC)C[C@@H](C)Nc1cccc(Br)c1[N+](=O)[O-] ZINC001186602626 1134238917 /nfs/dbraw/zinc/23/89/17/1134238917.db2.gz QWQCYZJBPNBSEV-LLVKDONJSA-N 1 0 344.253 3.890 20 5 EHBDRO CC(C)(CNc1nc2ccc([N+](=O)[O-])cc2s1)C[NH+]1CCCC1 ZINC000790818433 1134470844 /nfs/dbraw/zinc/47/08/44/1134470844.db2.gz KTBLJPVGCHEFIG-UHFFFAOYSA-N 1 0 334.445 3.738 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CC2 ZINC000790995907 1134491056 /nfs/dbraw/zinc/49/10/56/1134491056.db2.gz OYQGJMJPQYKTLD-OAHLLOKOSA-N 1 0 348.834 3.673 20 5 EHBDRO CC[C@@](C)([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000775389787 1134703308 /nfs/dbraw/zinc/70/33/08/1134703308.db2.gz HBEHNSPECMIUGB-LJQANCHMSA-N 1 0 341.411 3.757 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC001170295223 1134736442 /nfs/dbraw/zinc/73/64/42/1134736442.db2.gz BGEWFZOKNNJLRS-INIZCTEOSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170297797 1134738289 /nfs/dbraw/zinc/73/82/89/1134738289.db2.gz SGXVNXAAYPWVPN-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CC2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170324136 1134747629 /nfs/dbraw/zinc/74/76/29/1134747629.db2.gz ORKBEKRURYQQAT-CQSZACIVSA-N 1 0 340.423 3.539 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330109 1134749011 /nfs/dbraw/zinc/74/90/11/1134749011.db2.gz YVPDKJGSVZBVNA-OAHLLOKOSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170343521 1134758408 /nfs/dbraw/zinc/75/84/08/1134758408.db2.gz PYKSLRZDNFEHHG-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO CO[C@@H]1[C@@H](C)[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397970 1134764660 /nfs/dbraw/zinc/76/46/60/1134764660.db2.gz BWVPFEYDSAIGLM-AFAVFJNCSA-N 1 0 336.432 3.531 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](CC2CC2)c2ccccc2)c1 ZINC000775422872 1134769634 /nfs/dbraw/zinc/76/96/34/1134769634.db2.gz LWNJUQXRFFWMJB-OALUTQOASA-N 1 0 326.396 3.759 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)NC2CCCCCCC2)cc1[N+](=O)[O-] ZINC000775550250 1135059823 /nfs/dbraw/zinc/05/98/23/1135059823.db2.gz XCDHVXDGHMPFGL-OAHLLOKOSA-N 1 0 347.459 3.783 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1)CC1CC1 ZINC000804590734 1135127861 /nfs/dbraw/zinc/12/78/61/1135127861.db2.gz MEVMCZRKAJGPNE-UHFFFAOYSA-N 1 0 346.475 3.515 20 5 EHBDRO C[C@]1(CNc2ccc(N)cc2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1 ZINC000804624237 1135145131 /nfs/dbraw/zinc/14/51/31/1135145131.db2.gz KKFYTIQWDCEFMQ-LJQANCHMSA-N 1 0 340.427 3.644 20 5 EHBDRO CC[C@H](C[N@H+](CC)CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001193594112 1135155870 /nfs/dbraw/zinc/15/58/70/1135155870.db2.gz PMYGRNUIPMSJDT-MRXNPFEDSA-N 1 0 330.432 3.615 20 5 EHBDRO Cc1cc(N2CCc3c(Br)ccc([N+](=O)[O-])c3C2)cc[nH+]1 ZINC000804703542 1135179715 /nfs/dbraw/zinc/17/97/15/1135179715.db2.gz PFAKMKNGMWRXEA-UHFFFAOYSA-N 1 0 348.200 3.623 20 5 EHBDRO CCOC(=O)C1=C(N=c2[nH]c3ccccc3c3ccccc32)CC[NH2+]C1 ZINC001170521555 1135534583 /nfs/dbraw/zinc/53/45/83/1135534583.db2.gz JDWCMCGOBIINHB-UHFFFAOYSA-N 1 0 347.418 3.610 20 5 EHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@@H](O)c1ccc(C)cc1 ZINC000747531226 1135744043 /nfs/dbraw/zinc/74/40/43/1135744043.db2.gz SVYTUTIBLDVKCU-GOSISDBHSA-N 1 0 332.375 3.598 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870916 1135833634 /nfs/dbraw/zinc/83/36/34/1135833634.db2.gz OWKKFTWLKSKOBC-GOEBONIOSA-N 1 0 326.824 3.932 20 5 EHBDRO CC(C)c1ccc2c(c1)CC[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845362 1135860187 /nfs/dbraw/zinc/86/01/87/1135860187.db2.gz ZKYHRQHJZABMAR-FQEVSTJZSA-N 1 0 340.423 3.810 20 5 EHBDRO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000809946434 1135903324 /nfs/dbraw/zinc/90/33/24/1135903324.db2.gz DOMZWWIBEFOCJG-CYBMUJFWSA-N 1 0 344.242 3.570 20 5 EHBDRO O=[N+]([O-])c1cc(O)cc(Nc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001201222695 1135999588 /nfs/dbraw/zinc/99/95/88/1135999588.db2.gz PIXNMOKNPYXPTH-UHFFFAOYSA-N 1 0 343.383 3.519 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000776173127 1136021078 /nfs/dbraw/zinc/02/10/78/1136021078.db2.gz ZGNNRSXZXZQAAP-IAGOWNOFSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCO[C@H](C4CC4)C3)o2)cc1 ZINC001201910621 1136074231 /nfs/dbraw/zinc/07/42/31/1136074231.db2.gz HTPNTPMMZMDIRY-BEFAXECRSA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccnc(Cl)c1Cl ZINC000811481958 1136091539 /nfs/dbraw/zinc/09/15/39/1136091539.db2.gz PXXLPFYJEFSTFI-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO Cc1csc(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000811473846 1136096024 /nfs/dbraw/zinc/09/60/24/1136096024.db2.gz OHRRIKXNPZQYDM-UHFFFAOYSA-N 1 0 346.239 3.999 20 5 EHBDRO CC(C)(C)C[C@H](O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480005 1136097274 /nfs/dbraw/zinc/09/72/74/1136097274.db2.gz PUCMUOFKTVWYGQ-NSHDSACASA-N 1 0 335.231 3.788 20 5 EHBDRO CC(C)c1ccc(CC[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776270247 1136124381 /nfs/dbraw/zinc/12/43/81/1136124381.db2.gz BENBAWSCJKLFET-LJQANCHMSA-N 1 0 328.412 3.584 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCc2cccc3ccccc32)cc1 ZINC000776276959 1136130557 /nfs/dbraw/zinc/13/05/57/1136130557.db2.gz MJSFAVGXONQEEO-FQEVSTJZSA-N 1 0 336.391 3.614 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279853 1136133580 /nfs/dbraw/zinc/13/35/80/1136133580.db2.gz ZELIPEADOGLSBY-KXBFYZLASA-N 1 0 328.412 3.938 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H](C)[C@H](O)c1cccc(O)c1 ZINC001170675578 1136197905 /nfs/dbraw/zinc/19/79/05/1136197905.db2.gz MJNDBWUPNNEYKO-YWZLYKJASA-O 1 0 329.464 3.523 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812850652 1136261182 /nfs/dbraw/zinc/26/11/82/1136261182.db2.gz XTGQUSPTOIHAER-IFXJQAMLSA-N 1 0 344.411 3.547 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000852095894 1136433272 /nfs/dbraw/zinc/43/32/72/1136433272.db2.gz GGYWRUZKXGAUQT-LSDHHAIUSA-N 1 0 347.459 3.530 20 5 EHBDRO C[C@]1(c2ccccc2)CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584563 1136442583 /nfs/dbraw/zinc/44/25/83/1136442583.db2.gz MYFGNYYSFWLFEQ-UXHICEINSA-N 1 0 340.423 3.682 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776577922 1136443407 /nfs/dbraw/zinc/44/34/07/1136443407.db2.gz AUNCZIKSTMFHCU-QGZVFWFLSA-N 1 0 334.803 3.804 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)ccc1Cl ZINC000852759446 1136483680 /nfs/dbraw/zinc/48/36/80/1136483680.db2.gz PHZXCCGWGPIGML-CALCHBBNSA-N 1 0 336.819 3.641 20 5 EHBDRO CCc1ccc([C@@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640971 1136487540 /nfs/dbraw/zinc/48/75/40/1136487540.db2.gz ZHQBTRJMNPRNFW-QUCCMNQESA-N 1 0 340.423 3.680 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567824 1136612271 /nfs/dbraw/zinc/61/22/71/1136612271.db2.gz NDIOHSMAGJNYPL-LLVKDONJSA-N 1 0 335.791 3.560 20 5 EHBDRO C[C@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626533 1136620841 /nfs/dbraw/zinc/62/08/41/1136620841.db2.gz GMECIVRALUKRJI-MEDUHNTESA-N 1 0 349.818 3.605 20 5 EHBDRO C[C@@H]1CCC[C@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660470 1136746139 /nfs/dbraw/zinc/74/61/39/1136746139.db2.gz FURJEYKQAJZKCY-OTYXRUKQSA-N 1 0 333.215 3.542 20 5 EHBDRO CC1CC[NH+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)CC1 ZINC000338986163 1136752594 /nfs/dbraw/zinc/75/25/94/1136752594.db2.gz MIHKYQCJQSWDMQ-UHFFFAOYSA-N 1 0 340.427 3.834 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3cccnc3CC2)c1 ZINC000817580312 1136823505 /nfs/dbraw/zinc/82/35/05/1136823505.db2.gz IFICVBWAHOADHG-AWEZNQCLSA-N 1 0 331.803 3.680 20 5 EHBDRO [NH3+][C@@H](CCc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCCCC1 ZINC000818378621 1136876662 /nfs/dbraw/zinc/87/66/62/1136876662.db2.gz UGOWDJLDZYHAFA-HNNXBMFYSA-N 1 0 344.415 3.875 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(Sc3ccccc3)CC2)c1 ZINC000819047780 1136902009 /nfs/dbraw/zinc/90/20/09/1136902009.db2.gz ZXCFHPQTCJONDC-QGZVFWFLSA-N 1 0 344.436 3.543 20 5 EHBDRO Cc1oc2ccccc2c1CC[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819234728 1136927493 /nfs/dbraw/zinc/92/74/93/1136927493.db2.gz ZXJCTHPAIIEUAH-GOSISDBHSA-N 1 0 340.379 3.515 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000819262128 1136929507 /nfs/dbraw/zinc/92/95/07/1136929507.db2.gz RNTWRDMXAYOSDN-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000858358623 1136961485 /nfs/dbraw/zinc/96/14/85/1136961485.db2.gz HCRLIUZBUHWICB-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1cccc([C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000858363684 1136961925 /nfs/dbraw/zinc/96/19/25/1136961925.db2.gz YGTGFWNQPCFANW-RTBURBONSA-N 1 0 328.412 3.924 20 5 EHBDRO C[C@H]([NH2+][C@@H](c1ccccn1)C1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858483978 1136972167 /nfs/dbraw/zinc/97/21/67/1136972167.db2.gz GBNVLZCAUWCQOS-KPZWWZAWSA-N 1 0 326.400 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000820663846 1137000332 /nfs/dbraw/zinc/00/03/32/1137000332.db2.gz DERFGBNYRUMRSH-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820670575 1137000362 /nfs/dbraw/zinc/00/03/62/1137000362.db2.gz RFEFBIPEOMDFIZ-LLVKDONJSA-N 1 0 329.803 3.555 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585271 1137021487 /nfs/dbraw/zinc/02/14/87/1137021487.db2.gz MMZIJTMMDVNQFC-BEFAXECRSA-N 1 0 326.396 3.639 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)C1 ZINC000339032783 1137127050 /nfs/dbraw/zinc/12/70/50/1137127050.db2.gz IOGRPSCRPZBSQM-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO CCc1nc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057480 1137163713 /nfs/dbraw/zinc/16/37/13/1137163713.db2.gz PFEDLNFGUIUIQL-CZUORRHYSA-N 1 0 329.400 3.646 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC[C@H]1CCOC1 ZINC000825144147 1137167165 /nfs/dbraw/zinc/16/71/65/1137167165.db2.gz LUYZFUDFWAPOOG-JTQLQIEISA-N 1 0 333.215 3.808 20 5 EHBDRO C[C@@H]([NH2+]CC[C@H]1CCc2ccccc2N1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000844925528 1137263245 /nfs/dbraw/zinc/26/32/45/1137263245.db2.gz QZAVDOHYRDNRPG-CZUORRHYSA-N 1 0 340.427 3.645 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3c(Cl)nccc3[N+](=O)[O-])c2c1 ZINC001171165444 1137276866 /nfs/dbraw/zinc/27/68/66/1137276866.db2.gz IJXUBXXOCFNHQE-NSHDSACASA-N 1 0 344.802 3.785 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@]34CCC[C@H]3OCC4)cs2)c1 ZINC000865860332 1137317233 /nfs/dbraw/zinc/31/72/33/1137317233.db2.gz VZORWVVOYKESJH-WBVHZDCISA-N 1 0 345.424 3.520 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000866312631 1137344898 /nfs/dbraw/zinc/34/48/98/1137344898.db2.gz PHJZMFOJXLNVKV-KPZWWZAWSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1COCc2ccccc21 ZINC000866377092 1137350400 /nfs/dbraw/zinc/35/04/00/1137350400.db2.gz SEAVQSCHZHYFFR-PXAZEXFGSA-N 1 0 330.359 3.526 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000121153978 1137369641 /nfs/dbraw/zinc/36/96/41/1137369641.db2.gz KQFUHCNSZZNGOJ-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)c1 ZINC000846979770 1137381912 /nfs/dbraw/zinc/38/19/12/1137381912.db2.gz QQXVZXLDBLFXKX-CYBMUJFWSA-N 1 0 331.803 3.941 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CC[C@@](C[NH3+])(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000870989963 1137517394 /nfs/dbraw/zinc/51/73/94/1137517394.db2.gz SKYVGVLGNCSZDE-IBGZPJMESA-N 1 0 347.459 3.555 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017574 1137564708 /nfs/dbraw/zinc/56/47/08/1137564708.db2.gz CJEZCOYSCCEICF-SMDDNHRTSA-N 1 0 337.420 3.749 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)cn1 ZINC000872021413 1137565207 /nfs/dbraw/zinc/56/52/07/1137565207.db2.gz QJWGXRFVLFJIKY-LLVKDONJSA-N 1 0 333.413 3.571 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCc2c1cnn2C ZINC000872021234 1137565286 /nfs/dbraw/zinc/56/52/86/1137565286.db2.gz OQRMTYYFUGJCPI-NHYWBVRUSA-N 1 0 346.456 3.778 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023195 1137565395 /nfs/dbraw/zinc/56/53/95/1137565395.db2.gz CZRCRVJCVPEKQF-KGLIPLIRSA-N 1 0 337.489 3.699 20 5 EHBDRO C[C@@H]([NH2+]CCc1nn(C)c2ccccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872062059 1137569015 /nfs/dbraw/zinc/56/90/15/1137569015.db2.gz CLEKBINAMMXCSB-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO Cc1ccc([C@H](O)[C@H](C)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872071397 1137569646 /nfs/dbraw/zinc/56/96/46/1137569646.db2.gz OLXMXHOWNFZBJX-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ncccc1C ZINC000872076211 1137570018 /nfs/dbraw/zinc/57/00/18/1137570018.db2.gz JOFLIFWDHVLCNT-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129596 1137573062 /nfs/dbraw/zinc/57/30/62/1137573062.db2.gz REMXLQIKFZEWMM-OLZOCXBDSA-N 1 0 345.374 3.802 20 5 EHBDRO CCC(CC)(C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000872226371 1137576061 /nfs/dbraw/zinc/57/60/61/1137576061.db2.gz IOURTAPEKRPVKU-ZDUSSCGKSA-N 1 0 334.338 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H](O)c2c(Cl)cccc2Cl)c1 ZINC000124239545 1137583550 /nfs/dbraw/zinc/58/35/50/1137583550.db2.gz OUQGMTXYCZQJHC-AWEZNQCLSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1c(C[NH2+]Cc2cnccc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000873140029 1137591123 /nfs/dbraw/zinc/59/11/23/1137591123.db2.gz IUZQMYAYHPIZOE-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746571 1137608252 /nfs/dbraw/zinc/60/82/52/1137608252.db2.gz HJDYQJLKPRJTHQ-PIGZYNQJSA-N 1 0 336.338 3.566 20 5 EHBDRO C[C@H](Cc1ccco1)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000876917362 1137665360 /nfs/dbraw/zinc/66/53/60/1137665360.db2.gz ROLVQHJZPKMSCU-MRVPVSSYSA-N 1 0 345.218 3.733 20 5 EHBDRO CSCC[C@@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000877054829 1137668820 /nfs/dbraw/zinc/66/88/20/1137668820.db2.gz IAJSMLQYRGUBLA-SSDOTTSWSA-N 1 0 339.280 3.650 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CCC[C@H](c4ccccc4)C3)C2)c1 ZINC000877475089 1137677587 /nfs/dbraw/zinc/67/75/87/1137677587.db2.gz LTLUYUICJAVZAL-VYMRPNJYSA-N 1 0 340.427 3.811 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CC2(Cl)Cl)cc(C(F)(F)F)c1 ZINC000877482585 1137677871 /nfs/dbraw/zinc/67/78/71/1137677871.db2.gz DAOZGKFCOHUVHF-SECBINFHSA-N 1 0 343.132 3.897 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878054896 1137700849 /nfs/dbraw/zinc/70/08/49/1137700849.db2.gz NAHCIYHOLCLRLE-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878114434 1137702881 /nfs/dbraw/zinc/70/28/81/1137702881.db2.gz XHQVBZPJCIPHBR-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC3(C2)CCCCC3)o1 ZINC000878133950 1137703729 /nfs/dbraw/zinc/70/37/29/1137703729.db2.gz DTGWCZSLANJCBI-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO CCC(C)(C)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878245748 1137708560 /nfs/dbraw/zinc/70/85/60/1137708560.db2.gz FZXQLYGCBUYVNU-UHFFFAOYSA-N 1 0 338.795 3.919 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)ccc1C ZINC000878354795 1137712292 /nfs/dbraw/zinc/71/22/92/1137712292.db2.gz BCQZKCRZFMEJCC-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@H]1CCC[C@@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507751 1137718320 /nfs/dbraw/zinc/71/83/20/1137718320.db2.gz JPBFLDWDBDHSSH-CABZTGNLSA-N 1 0 336.779 3.576 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000881822060 1137816024 /nfs/dbraw/zinc/81/60/24/1137816024.db2.gz XFOJMSOFLSASFF-LZWOXQAQSA-N 1 0 345.443 3.639 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H]([NH+]2[C@H](C)CC[C@H]2C)C1 ZINC000881822058 1137816055 /nfs/dbraw/zinc/81/60/55/1137816055.db2.gz XFOJMSOFLSASFF-FMKPAKJESA-N 1 0 345.443 3.639 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000130534985 1137839153 /nfs/dbraw/zinc/83/91/53/1137839153.db2.gz YSPCJVOLBCMNEU-ROUUACIJSA-N 1 0 344.411 3.768 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2C[C@@H](COC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000883319496 1137854644 /nfs/dbraw/zinc/85/46/44/1137854644.db2.gz DQULFWFLSGWRFJ-FRIZHTMISA-N 1 0 344.411 3.854 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000132569106 1137867393 /nfs/dbraw/zinc/86/73/93/1137867393.db2.gz LCAVRYHJNIQMPG-CABCVRRESA-N 1 0 326.487 3.874 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC(C)(C)C1 ZINC000112702265 1137909538 /nfs/dbraw/zinc/90/95/38/1137909538.db2.gz UPAWDMAJTXLQFP-LBPRGKRZSA-N 1 0 330.388 3.828 20 5 EHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432289 1137930209 /nfs/dbraw/zinc/93/02/09/1137930209.db2.gz GGIQPPGTYDMNQX-OAHLLOKOSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H](C1CCCCC1)[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332195440 1137935223 /nfs/dbraw/zinc/93/52/23/1137935223.db2.gz YXKBCJDDGSZQTA-ZDUSSCGKSA-N 1 0 334.416 3.862 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208716 1137935672 /nfs/dbraw/zinc/93/56/72/1137935672.db2.gz FRHQGQKCWPCWQJ-GOSISDBHSA-N 1 0 336.432 3.773 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCOC1 ZINC000119740316 1137944233 /nfs/dbraw/zinc/94/42/33/1137944233.db2.gz RSLBQMHZIVOLNM-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000120272304 1137948066 /nfs/dbraw/zinc/94/80/66/1137948066.db2.gz ZMBRXYGVOYHCBP-KBXCAEBGSA-N 1 0 344.411 3.686 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775385 1137952455 /nfs/dbraw/zinc/95/24/55/1137952455.db2.gz NBQBXQLKNNLRII-IUODEOHRSA-N 1 0 344.415 3.949 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC000884485959 1137961126 /nfs/dbraw/zinc/96/11/26/1137961126.db2.gz LELORHUYXRWRLO-NSHDSACASA-N 1 0 331.338 3.534 20 5 EHBDRO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO[C@@H]1c1ccccc1 ZINC000885973468 1138029479 /nfs/dbraw/zinc/02/94/79/1138029479.db2.gz SXRSJVMZDUQPHW-SJLPKXTDSA-N 1 0 341.411 3.590 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)s1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136891885 1138044091 /nfs/dbraw/zinc/04/40/91/1138044091.db2.gz LSQYWOWBFJVGMB-CQSZACIVSA-N 1 0 340.832 3.865 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@@H]2CCc3cccnc32)cc(C(F)(F)F)c1 ZINC000886601526 1138100758 /nfs/dbraw/zinc/10/07/58/1138100758.db2.gz VQNSCPZRWHQBCO-CQSZACIVSA-N 1 0 337.301 3.786 20 5 EHBDRO C[C@@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000886707614 1138120519 /nfs/dbraw/zinc/12/05/19/1138120519.db2.gz MGMYBSFQZSLCBK-QAPCUYQASA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000085635949 1138184982 /nfs/dbraw/zinc/18/49/82/1138184982.db2.gz NNLOHHJBPYDXRP-HNNXBMFYSA-N 1 0 348.447 3.550 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000090846002 1138213936 /nfs/dbraw/zinc/21/39/36/1138213936.db2.gz IFCMZLUCTZYZJM-ZDUSSCGKSA-N 1 0 330.432 3.612 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093337696 1138236132 /nfs/dbraw/zinc/23/61/32/1138236132.db2.gz YRTVZLRVGDYSCL-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(=O)oc2ccc3ccccc3c12)C1CCOCC1 ZINC000125365728 1138306760 /nfs/dbraw/zinc/30/67/60/1138306760.db2.gz NQLGCKCWZCSJCS-CQSZACIVSA-N 1 0 337.419 3.851 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@H]1c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000336970638 1138438119 /nfs/dbraw/zinc/43/81/19/1138438119.db2.gz OPXYFUMUXOSQLC-QGZVFWFLSA-N 1 0 339.395 3.761 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)O[C@H](C)C2 ZINC000132099971 1138562071 /nfs/dbraw/zinc/56/20/71/1138562071.db2.gz XVXCKEPGDHDXSJ-OLZOCXBDSA-N 1 0 342.395 3.778 20 5 EHBDRO COCCC1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000151168524 1139014422 /nfs/dbraw/zinc/01/44/22/1139014422.db2.gz UVQQCCBDSHSYPO-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2csc(CC)n2)cc1[N+](=O)[O-] ZINC000153503017 1139139698 /nfs/dbraw/zinc/13/96/98/1139139698.db2.gz KPKPCUJLVSRWTC-LBPRGKRZSA-N 1 0 349.456 3.906 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178689232 1139712311 /nfs/dbraw/zinc/71/23/11/1139712311.db2.gz JMNYCNNIRYWATC-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CCc1cccc(C)c1NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180453498 1139835189 /nfs/dbraw/zinc/83/51/89/1139835189.db2.gz FAZFPJFQEIIPMX-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO CC1(CNC(=O)c2cc3ccccc3c3cccnc23)CC[NH2+]CC1 ZINC000181287166 1139897630 /nfs/dbraw/zinc/89/76/30/1139897630.db2.gz HDWACOMZGDSWLW-UHFFFAOYSA-N 1 0 333.435 3.508 20 5 EHBDRO COCCc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000181392472 1139903317 /nfs/dbraw/zinc/90/33/17/1139903317.db2.gz IYPCUJFIDMAOEI-RYUDHWBXSA-N 1 0 349.456 3.960 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCN(c2nccs2)CC1 ZINC000182693073 1139986761 /nfs/dbraw/zinc/98/67/61/1139986761.db2.gz DLINWJOSWTVKKN-AWEZNQCLSA-N 1 0 346.456 3.633 20 5 EHBDRO Cc1nc(C[C@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744534 1139989576 /nfs/dbraw/zinc/98/95/76/1139989576.db2.gz BWLNLPPWYBNUAD-DZGCQCFKSA-N 1 0 344.415 3.610 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185466091 1140151453 /nfs/dbraw/zinc/15/14/53/1140151453.db2.gz ZNODVLBQGPZHQX-MRXNPFEDSA-N 1 0 340.423 3.948 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000186731995 1140219318 /nfs/dbraw/zinc/21/93/18/1140219318.db2.gz YGJRJHUWAACWGL-NWDGAFQWSA-N 1 0 335.429 3.904 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1nccs1 ZINC000186749622 1140220324 /nfs/dbraw/zinc/22/03/24/1140220324.db2.gz JTFXKNWRNZKHDK-SWLSCSKDSA-N 1 0 331.441 3.766 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CCC(CC[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000189796881 1140364059 /nfs/dbraw/zinc/36/40/59/1140364059.db2.gz BZAOLKMRCCXENJ-UHFFFAOYSA-N 1 0 347.459 3.522 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189951318 1140374346 /nfs/dbraw/zinc/37/43/46/1140374346.db2.gz VUBOLPFYLSTQKL-OAHLLOKOSA-N 1 0 347.459 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1-n1cccn1)CCC2 ZINC000192776029 1140550751 /nfs/dbraw/zinc/55/07/51/1140550751.db2.gz NHEVFABUKILYRK-LJQANCHMSA-N 1 0 348.406 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192972125 1140557064 /nfs/dbraw/zinc/55/70/64/1140557064.db2.gz SLTVPAZFZXURIX-QGZVFWFLSA-N 1 0 327.340 3.670 20 5 EHBDRO C[C@H]1C[C@@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000193466586 1140577222 /nfs/dbraw/zinc/57/72/22/1140577222.db2.gz QSFUNHPZOXRQHC-YOEHRIQHSA-N 1 0 340.427 3.642 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460860 1140793774 /nfs/dbraw/zinc/79/37/74/1140793774.db2.gz VBFIZNNVCDHYPJ-OLZOCXBDSA-N 1 0 339.395 3.526 20 5 EHBDRO CC(C)C[C@@H](CCO)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268998701 1141042887 /nfs/dbraw/zinc/04/28/87/1141042887.db2.gz UIVKENVXZYNXNC-QAPCUYQASA-N 1 0 334.460 3.550 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000269386767 1141102403 /nfs/dbraw/zinc/10/24/03/1141102403.db2.gz WKCQGZFHHTUAMZ-UKRRQHHQSA-N 1 0 336.457 3.690 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000270377923 1141214897 /nfs/dbraw/zinc/21/48/97/1141214897.db2.gz MLNQSXXYNVMLGQ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000270649532 1141250571 /nfs/dbraw/zinc/25/05/71/1141250571.db2.gz LRAQIMPFZIQLSA-UKRRQHHQSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891853 1141280855 /nfs/dbraw/zinc/28/08/55/1141280855.db2.gz PGJQAJVQSXMVLO-OCCSQVGLSA-N 1 0 341.415 3.531 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C1CCOCC1 ZINC000271167028 1141317433 /nfs/dbraw/zinc/31/74/33/1141317433.db2.gz SWPQOAPNEPCVSP-HIFRSBDPSA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCCc1nccs1 ZINC000271480083 1141377324 /nfs/dbraw/zinc/37/73/24/1141377324.db2.gz KEZLKEXDVRXDME-GOEBONIOSA-N 1 0 345.468 3.985 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575521 1141521040 /nfs/dbraw/zinc/52/10/40/1141521040.db2.gz VOGCUFNGAHPJMZ-JQWIXIFHSA-N 1 0 344.358 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOc1cccc(F)c1)C1CC1 ZINC000537992332 1032084000 /nfs/dbraw/zinc/08/40/00/1032084000.db2.gz UBLZAKBRBITCSU-SFHVURJKSA-N 1 0 344.386 3.724 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000339389571 1014324115 /nfs/dbraw/zinc/32/41/15/1014324115.db2.gz HAPKDJFQSOAJIH-LLVKDONJSA-N 1 0 332.385 3.905 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)CCCOc1ccccc1 ZINC000430193494 1014758211 /nfs/dbraw/zinc/75/82/11/1014758211.db2.gz GJKHORGFDUMNFI-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000430204539 1014895337 /nfs/dbraw/zinc/89/53/37/1014895337.db2.gz ROEGBBYGOODGJC-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C(=O)c2ccccc2)CC1 ZINC000183248753 1125487248 /nfs/dbraw/zinc/48/72/48/1125487248.db2.gz UZYSGBQEAJPTOM-UHFFFAOYSA-N 1 0 338.407 3.998 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)C2CC2)cc1 ZINC000430217708 1015076525 /nfs/dbraw/zinc/07/65/25/1015076525.db2.gz KEPVSMXEYCLUPD-LJQANCHMSA-N 1 0 342.395 3.853 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000120615075 1015708651 /nfs/dbraw/zinc/70/86/51/1015708651.db2.gz RDNIXPKNXFWRFW-OLZOCXBDSA-N 1 0 330.432 3.535 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCCC[C@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000246963170 1016235226 /nfs/dbraw/zinc/23/52/26/1016235226.db2.gz HXFMPCRKEDGZKZ-QILLFSRXSA-N 1 0 328.416 3.934 20 5 EHBDRO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])[C@H]1COc2ccccc21 ZINC000120878325 1016721890 /nfs/dbraw/zinc/72/18/90/1016721890.db2.gz LARZKMXODTXFAZ-SMDDNHRTSA-N 1 0 332.787 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]3CCO)s2)cc1 ZINC000189930322 1016779806 /nfs/dbraw/zinc/77/98/06/1016779806.db2.gz TYNAQHVGLPAPHP-SUMWQHHRSA-N 1 0 346.452 3.964 20 5 EHBDRO CCC[N@H+](CC(C)C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC001167256270 1016786052 /nfs/dbraw/zinc/78/60/52/1016786052.db2.gz UTBAJTVJUIFGCI-LBPRGKRZSA-N 1 0 341.839 3.943 20 5 EHBDRO C[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414527023 1016953982 /nfs/dbraw/zinc/95/39/82/1016953982.db2.gz QDYTWONPHIAEPQ-DOMZBBRYSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)O1 ZINC000414515914 1016949305 /nfs/dbraw/zinc/94/93/05/1016949305.db2.gz OCSJDXOHGSVJNY-IPYPFGDCSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2[NH2+]CC[C@H]3CCCC[C@H]32)n1 ZINC000904604344 1032154367 /nfs/dbraw/zinc/15/43/67/1032154367.db2.gz QEYCSSCYRNESIC-DAXOMENPSA-N 1 0 342.399 3.794 20 5 EHBDRO CC(C)c1nc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000449111456 1032191810 /nfs/dbraw/zinc/19/18/10/1032191810.db2.gz MCJXDMMIIXUATJ-ZDUSSCGKSA-N 1 0 333.457 3.938 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449092738 1032200854 /nfs/dbraw/zinc/20/08/54/1032200854.db2.gz UBKMEZABGSLWHQ-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000449121746 1032216574 /nfs/dbraw/zinc/21/65/74/1032216574.db2.gz IVKNOMPNIZOEGW-MLGOLLRUSA-N 1 0 330.359 3.778 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)c1 ZINC000538225482 1032225250 /nfs/dbraw/zinc/22/52/50/1032225250.db2.gz BZWBXCKVNPZWGJ-KRWDZBQOSA-N 1 0 348.834 3.966 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1cnn(C)c1)C(C)(C)C ZINC000449176345 1032268011 /nfs/dbraw/zinc/26/80/11/1032268011.db2.gz MPTJEJBNQDSOJR-GUYCJALGSA-N 1 0 330.432 3.636 20 5 EHBDRO COc1ccc2c(c1)OC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000536842917 1032338674 /nfs/dbraw/zinc/33/86/74/1032338674.db2.gz BDCZPCICLMFIKW-HIFRSBDPSA-N 1 0 342.395 3.566 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000459645382 1032367131 /nfs/dbraw/zinc/36/71/31/1032367131.db2.gz GKDWITWLUBHBKE-NEPJUHHUSA-N 1 0 331.441 3.822 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000536879381 1032384740 /nfs/dbraw/zinc/38/47/40/1032384740.db2.gz XKDXALCGYWGAGK-KRWDZBQOSA-N 1 0 344.386 3.853 20 5 EHBDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449277671 1032396532 /nfs/dbraw/zinc/39/65/32/1032396532.db2.gz GMIWZSQLXNWQMH-RHSMWYFYSA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@@H](CCO)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449355535 1032493203 /nfs/dbraw/zinc/49/32/03/1032493203.db2.gz AJYZOYWENFODEC-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCC(C)(F)F)o2)c([N+](=O)[O-])c1 ZINC000449355412 1032494317 /nfs/dbraw/zinc/49/43/17/1032494317.db2.gz ZAOHCBDOLQADBO-UHFFFAOYSA-N 1 0 340.326 3.998 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115608 1032526992 /nfs/dbraw/zinc/52/69/92/1032526992.db2.gz JJLYBMYQDDQGJM-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H](C)CCCCO)o2)c([N+](=O)[O-])c1 ZINC000449424172 1032539633 /nfs/dbraw/zinc/53/96/33/1032539633.db2.gz CWOBWYLWAYPPTB-ZDUSSCGKSA-N 1 0 348.399 3.504 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537173943 1032547620 /nfs/dbraw/zinc/54/76/20/1032547620.db2.gz POFZTQJOPBDIPY-LSDHHAIUSA-N 1 0 347.459 3.639 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)NCCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537176987 1032548523 /nfs/dbraw/zinc/54/85/23/1032548523.db2.gz INDSVDABLPQOJA-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO CC[C@@H]1CCC[C@H]1C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000449432965 1032549526 /nfs/dbraw/zinc/54/95/26/1032549526.db2.gz KEGVHMDELQWCKD-UWWQBHOKSA-N 1 0 342.443 3.834 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090771179 1032593964 /nfs/dbraw/zinc/59/39/64/1032593964.db2.gz PYWXQVHFQFZKOP-KDOFPFPSSA-N 1 0 326.396 3.759 20 5 EHBDRO C[C@@H]1CCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1 ZINC000761234301 1032609707 /nfs/dbraw/zinc/60/97/07/1032609707.db2.gz KVNVPTVIVFDGBW-CQSZACIVSA-N 1 0 326.400 3.553 20 5 EHBDRO CO[C@](C)(C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449483167 1032634527 /nfs/dbraw/zinc/63/45/27/1032634527.db2.gz GVEIBNBAKOXNGG-HNAYVOBHSA-N 1 0 328.412 3.677 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000449494102 1032659362 /nfs/dbraw/zinc/65/93/62/1032659362.db2.gz GFXIFHWQHFFRBN-GUYCJALGSA-N 1 0 330.384 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnn4ccccc34)C2)cc1 ZINC000449501190 1032681752 /nfs/dbraw/zinc/68/17/52/1032681752.db2.gz PGAWOHGJYQDMGZ-MRXNPFEDSA-N 1 0 336.395 3.622 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnn(C)c1 ZINC000610272988 1017160310 /nfs/dbraw/zinc/16/03/10/1017160310.db2.gz AAWMXZPJIMWJIG-LBPRGKRZSA-N 1 0 342.424 3.908 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])c1 ZINC000892757369 1017336490 /nfs/dbraw/zinc/33/64/90/1017336490.db2.gz HNCMGAKZMCRMAX-LBPRGKRZSA-N 1 0 346.383 3.559 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415029630 1017426760 /nfs/dbraw/zinc/42/67/60/1017426760.db2.gz DZORXKQEHMJVGO-QGZVFWFLSA-N 1 0 341.411 3.877 20 5 EHBDRO CC(C)n1ccc(C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000468033498 1017526548 /nfs/dbraw/zinc/52/65/48/1017526548.db2.gz LFRLHAYFFYHUJE-GFCCVEGCSA-N 1 0 336.823 3.746 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000177479471 1017679186 /nfs/dbraw/zinc/67/91/86/1017679186.db2.gz YSCUYAHJWPQHCF-ZNMIVQPWSA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000177481556 1017679515 /nfs/dbraw/zinc/67/95/15/1017679515.db2.gz OKSOUZHUSCNGTL-KFWWJZLASA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@@H]1CCN(c2ccc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000610284396 1017685586 /nfs/dbraw/zinc/68/55/86/1017685586.db2.gz YCRPVESVRYBZPC-CQSZACIVSA-N 1 0 331.441 3.757 20 5 EHBDRO CC1(C)CCC[C@@]1(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000583637540 1017922879 /nfs/dbraw/zinc/92/28/79/1017922879.db2.gz YYBTYAOXLYTFIM-LJQANCHMSA-N 1 0 344.411 3.886 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1COc2ccccc21)C1CC1 ZINC000290317980 1018146886 /nfs/dbraw/zinc/14/68/86/1018146886.db2.gz OCUSVULIGUWJPJ-AEFFLSMTSA-N 1 0 338.407 3.682 20 5 EHBDRO COc1cc(F)cc(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1 ZINC000468615717 1018220195 /nfs/dbraw/zinc/22/01/95/1018220195.db2.gz QWURKSHBXWYRHV-MLPAPPSSSA-N 1 0 330.359 3.936 20 5 EHBDRO CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610345616 1018360311 /nfs/dbraw/zinc/36/03/11/1018360311.db2.gz ICCAWGSJZNPUML-HIFRSBDPSA-N 1 0 332.400 3.742 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701342 1018412781 /nfs/dbraw/zinc/41/27/81/1018412781.db2.gz NYZJDRWXYNBZSV-IUODEOHRSA-N 1 0 348.447 3.626 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000560847585 1018615020 /nfs/dbraw/zinc/61/50/20/1018615020.db2.gz NYDKDSIZEAASEK-IINYFYTJSA-N 1 0 341.839 3.990 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075194 1018999295 /nfs/dbraw/zinc/99/92/95/1018999295.db2.gz XGALUINHRBIZIA-BXUZGUMPSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433518 1019126551 /nfs/dbraw/zinc/12/65/51/1019126551.db2.gz PJCFFHQZCSWPFS-OXQOHEQNSA-N 1 0 339.439 3.862 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000274341530 1019336772 /nfs/dbraw/zinc/33/67/72/1019336772.db2.gz DEFTVDHTTPWSHJ-PXAZEXFGSA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]4CC[NH2+][C@@H]4C3)s2)cc1 ZINC000592432485 1032838687 /nfs/dbraw/zinc/83/86/87/1032838687.db2.gz LDEJTRDHFIQZND-CXAGYDPISA-N 1 0 343.452 3.507 20 5 EHBDRO Cc1nc2c(o1)CCC[C@@H]2[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000926113192 1019652292 /nfs/dbraw/zinc/65/22/92/1019652292.db2.gz NABLIGBAJMOMIQ-ZDUSSCGKSA-N 1 0 335.791 3.754 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+](C[C@H]1CCOC1)C1CC1 ZINC000602439514 1032888523 /nfs/dbraw/zinc/88/85/23/1032888523.db2.gz HJAZHRCYOYJJIN-LLVKDONJSA-N 1 0 344.333 3.615 20 5 EHBDRO CCC(C)(C)[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732768 1020295218 /nfs/dbraw/zinc/29/52/18/1020295218.db2.gz MLFOGKKNULEIAK-MRXNPFEDSA-N 1 0 334.416 3.862 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1Cn1cccn1 ZINC000581141733 1020471580 /nfs/dbraw/zinc/47/15/80/1020471580.db2.gz BBPPKVXKXWXBFH-IBGZPJMESA-N 1 0 348.406 3.617 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169794 1020499399 /nfs/dbraw/zinc/49/93/99/1020499399.db2.gz MGICBUAQHOGBFX-DYVFJYSZSA-N 1 0 328.416 3.515 20 5 EHBDRO CC[N@H+](C)Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000126318019 1020571243 /nfs/dbraw/zinc/57/12/43/1020571243.db2.gz VWJNIAWBRMLAEL-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413062970 1020636728 /nfs/dbraw/zinc/63/67/28/1020636728.db2.gz QOMXWSRKSMCIER-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488555 1032918550 /nfs/dbraw/zinc/91/85/50/1032918550.db2.gz ZHKFHFQPDXPOKO-NWDGAFQWSA-N 1 0 336.823 3.606 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413089405 1020665245 /nfs/dbraw/zinc/66/52/45/1020665245.db2.gz BISQKMVJRSZSLM-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO CC[C@H](CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)[NH+]1CCCC1 ZINC000581315204 1020676875 /nfs/dbraw/zinc/67/68/75/1020676875.db2.gz VQPBSINOEVVULO-HIFRSBDPSA-N 1 0 345.365 3.662 20 5 EHBDRO CCC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000548160128 1020770526 /nfs/dbraw/zinc/77/05/26/1020770526.db2.gz VIBKWHSLTSCVHG-YOEHRIQHSA-N 1 0 333.432 3.506 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)n1 ZINC000360870463 1020846008 /nfs/dbraw/zinc/84/60/08/1020846008.db2.gz ILZWXTJIFMIPQM-RDJZCZTQSA-N 1 0 340.427 3.763 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCCCCn1cccn1)C1CC1 ZINC000135219440 1020903688 /nfs/dbraw/zinc/90/36/88/1020903688.db2.gz SURYNDPLLKFCQT-UHFFFAOYSA-N 1 0 328.416 3.626 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000537966236 1021025325 /nfs/dbraw/zinc/02/53/25/1021025325.db2.gz AJTKVLNNIOLZTB-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000439255050 1021301151 /nfs/dbraw/zinc/30/11/51/1021301151.db2.gz FSBDQVXNNDQMTN-IBGZPJMESA-N 1 0 328.412 3.758 20 5 EHBDRO C[C@@H](CCC(C)(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602559715 1032974053 /nfs/dbraw/zinc/97/40/53/1032974053.db2.gz ZXPWHCLCRZTGPI-AWEZNQCLSA-N 1 0 334.464 3.763 20 5 EHBDRO COC(=O)c1csc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000602564891 1032974756 /nfs/dbraw/zinc/97/47/56/1032974756.db2.gz WGNNJCRMXVVBJB-LLVKDONJSA-N 1 0 334.397 3.602 20 5 EHBDRO CCS[C@@H]1CCC[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567746 1032977360 /nfs/dbraw/zinc/97/73/60/1032977360.db2.gz KUHCFNCHZQNZDN-WCQYABFASA-N 1 0 335.429 3.890 20 5 EHBDRO C[NH2+][C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000262074229 1021505555 /nfs/dbraw/zinc/50/55/55/1021505555.db2.gz SJQOEKCPOUGJMO-AWEZNQCLSA-N 1 0 331.441 3.507 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000519777753 1021683252 /nfs/dbraw/zinc/68/32/52/1021683252.db2.gz IFVGYFLFLBJPJD-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)cc1 ZINC000602614903 1033011062 /nfs/dbraw/zinc/01/10/62/1033011062.db2.gz AVTPYTYVZCYRDS-HKUYNNGSSA-N 1 0 326.396 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000602613064 1033028100 /nfs/dbraw/zinc/02/81/00/1033028100.db2.gz MWCUPWQCNUZDRC-PKOBYXMFSA-N 1 0 344.386 3.786 20 5 EHBDRO CCOC1CC(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602647527 1033034588 /nfs/dbraw/zinc/03/45/88/1033034588.db2.gz TUXHYBFIGUYVJA-UHFFFAOYSA-N 1 0 346.349 3.908 20 5 EHBDRO CC(C)SCC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602653457 1033037829 /nfs/dbraw/zinc/03/78/29/1033037829.db2.gz IBDDNMOWCNHCPY-UHFFFAOYSA-N 1 0 339.280 3.650 20 5 EHBDRO CCC1CCC([N@H+](C)Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000506180297 1022405687 /nfs/dbraw/zinc/40/56/87/1022405687.db2.gz UAUOBXAVHHEUTA-UHFFFAOYSA-N 1 0 334.416 3.862 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936042 1022472231 /nfs/dbraw/zinc/47/22/31/1022472231.db2.gz VDSZQKCASXEWDV-RDJZCZTQSA-N 1 0 326.396 3.852 20 5 EHBDRO CC(C)(C)C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000341594823 1022474373 /nfs/dbraw/zinc/47/43/73/1022474373.db2.gz NTFOVXBMSZHTJD-QGZVFWFLSA-N 1 0 343.427 3.524 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H](C(=O)NC(C)C)C2)cccc1[N+](=O)[O-] ZINC000124776227 1022575442 /nfs/dbraw/zinc/57/54/42/1022575442.db2.gz QKVUGRDRFCSEPD-HRCADAONSA-N 1 0 347.459 3.637 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000430819335 1022724200 /nfs/dbraw/zinc/72/42/00/1022724200.db2.gz BJFMVZSJXAONIX-CRAIPNDOSA-N 1 0 347.459 3.534 20 5 EHBDRO CCN(CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)CCC(F)(F)F ZINC000426049866 1022753436 /nfs/dbraw/zinc/75/34/36/1022753436.db2.gz KBEMTYHJCSKOIS-CYBMUJFWSA-N 1 0 347.381 3.828 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000602683536 1033083153 /nfs/dbraw/zinc/08/31/53/1033083153.db2.gz CUHSZNJHPLOGEY-CQSZACIVSA-N 1 0 346.349 3.861 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000058933016 1033085810 /nfs/dbraw/zinc/08/58/10/1033085810.db2.gz ONAJWPBSGHYVJG-GOSISDBHSA-N 1 0 330.359 3.950 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccccn1 ZINC000602707369 1033095749 /nfs/dbraw/zinc/09/57/49/1033095749.db2.gz UOAQMHQGZZTLHE-NSHDSACASA-N 1 0 339.317 3.902 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000366701814 1023138652 /nfs/dbraw/zinc/13/86/52/1023138652.db2.gz ZLTCBUYUWHETKZ-RDTXWAMCSA-N 1 0 325.412 3.741 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000506443610 1023155051 /nfs/dbraw/zinc/15/50/51/1023155051.db2.gz MHADDOPQRMYUNC-QGZVFWFLSA-N 1 0 343.427 3.771 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441489004 1023209081 /nfs/dbraw/zinc/20/90/81/1023209081.db2.gz INDGGQUCWCADKQ-ZIAGYGMSSA-N 1 0 336.432 3.881 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2COC)CC1 ZINC000178386042 1023224387 /nfs/dbraw/zinc/22/43/87/1023224387.db2.gz NKBXEOSRGGSDOO-UHFFFAOYSA-N 1 0 349.475 3.690 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H](C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000341807626 1023354278 /nfs/dbraw/zinc/35/42/78/1023354278.db2.gz KESQCHOXCXWSDU-SNVBAGLBSA-N 1 0 332.347 3.681 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@H](CC)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276919131 1023364431 /nfs/dbraw/zinc/36/44/31/1023364431.db2.gz OTSMUFOWEABRRF-MRXNPFEDSA-N 1 0 329.400 3.972 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc([N+](=O)[O-])c(C(C)=O)c1)c1ccco1 ZINC000341933146 1023706384 /nfs/dbraw/zinc/70/63/84/1023706384.db2.gz VGBCOAJYPGEJIX-QGZVFWFLSA-N 1 0 345.399 3.885 20 5 EHBDRO CC[C@@](C)(COc1ncccc1Cl)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000610932612 1023884351 /nfs/dbraw/zinc/88/43/51/1023884351.db2.gz BCCBQAWQRVAPMY-KRWDZBQOSA-N 1 0 349.818 3.981 20 5 EHBDRO CC(C)C[C@@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000602807567 1033181062 /nfs/dbraw/zinc/18/10/62/1033181062.db2.gz WGDXCDRJBXAFFV-OAHLLOKOSA-N 1 0 336.823 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H](CC4CC4)C3)o2)c1 ZINC000550422501 1024195761 /nfs/dbraw/zinc/19/57/61/1024195761.db2.gz LYFWELVGRCCSSF-OAHLLOKOSA-N 1 0 341.411 3.914 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000178486288 1024324802 /nfs/dbraw/zinc/32/48/02/1024324802.db2.gz LCWOLDXQYVEULQ-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000110039896 1024414670 /nfs/dbraw/zinc/41/46/70/1024414670.db2.gz KENCLFPOBWUGIG-KRWDZBQOSA-N 1 0 328.416 3.793 20 5 EHBDRO COCC[N@H+](C)CC[C@@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000505582721 1024536834 /nfs/dbraw/zinc/53/68/34/1024536834.db2.gz VNMSJVXCUCVPEO-QGZVFWFLSA-N 1 0 343.427 3.716 20 5 EHBDRO CC[NH+]1CCC(CCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000538937524 1024624481 /nfs/dbraw/zinc/62/44/81/1024624481.db2.gz ZLALEBDOBVMLPV-UHFFFAOYSA-N 1 0 343.374 3.730 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)[C@H]1CCCC[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000342278778 1024700581 /nfs/dbraw/zinc/70/05/81/1024700581.db2.gz FTLXXHFCXIBESF-WBAXXEDZSA-N 1 0 347.459 3.673 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000342292400 1024751572 /nfs/dbraw/zinc/75/15/72/1024751572.db2.gz ZGLLIFJQKUWJFM-ZQMJAJRESA-N 1 0 346.814 3.627 20 5 EHBDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000383552215 1024771951 /nfs/dbraw/zinc/77/19/51/1024771951.db2.gz XLBPNVTTZOQZLF-HZPDHXFCSA-N 1 0 327.428 3.766 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cnc(CC(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000895834589 1024900382 /nfs/dbraw/zinc/90/03/82/1024900382.db2.gz UOKJWCGSBDTMPY-UHFFFAOYSA-N 1 0 345.346 3.754 20 5 EHBDRO COc1cc(NCCCC[NH+]2CCC(C)CC2)c(F)cc1[N+](=O)[O-] ZINC000508279530 1025002227 /nfs/dbraw/zinc/00/22/27/1025002227.db2.gz NQAZIALKCMFCNZ-UHFFFAOYSA-N 1 0 339.411 3.667 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000157714639 1025093256 /nfs/dbraw/zinc/09/32/56/1025093256.db2.gz FLPBSXYHGHUNQB-MRAWALMUSA-N 1 0 334.416 3.602 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(Nc2ccccn2)CC1 ZINC000896197723 1025229014 /nfs/dbraw/zinc/22/90/14/1025229014.db2.gz FIMSYUXVVQXXIV-ALCCZGGFSA-N 1 0 338.411 3.580 20 5 EHBDRO COC(=O)[C@@H](CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000425460236 1025364128 /nfs/dbraw/zinc/36/41/28/1025364128.db2.gz QPJRHSJKKDTYKY-KDOFPFPSSA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346993831 1025396951 /nfs/dbraw/zinc/39/69/51/1025396951.db2.gz BAYSOFGYSZEQME-BBRMVZONSA-N 1 0 329.400 3.557 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCCO2)o1 ZINC000551826590 1025475075 /nfs/dbraw/zinc/47/50/75/1025475075.db2.gz NTAARYCJMYRPON-IEBWSBKVSA-N 1 0 342.395 3.998 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113922 1025521427 /nfs/dbraw/zinc/52/14/27/1025521427.db2.gz SPCNAGMJLLIOHY-DYVFJYSZSA-N 1 0 329.400 3.557 20 5 EHBDRO Cc1cnccc1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000582178742 1025523996 /nfs/dbraw/zinc/52/39/96/1025523996.db2.gz QPYHKUXFIZJWCI-SFHVURJKSA-N 1 0 325.412 3.720 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478213 1025659355 /nfs/dbraw/zinc/65/93/55/1025659355.db2.gz HEEKVOKEPUDIPW-TZMCWYRMSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCN(C2CCCCC2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000443079942 1025709863 /nfs/dbraw/zinc/70/98/63/1025709863.db2.gz POGBIIRXJQUZNM-KDOFPFPSSA-N 1 0 345.443 3.569 20 5 EHBDRO CCOC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474921285 1025858706 /nfs/dbraw/zinc/85/87/06/1025858706.db2.gz BRZGPVLFIBFAKE-DZGCQCFKSA-N 1 0 326.824 3.586 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000451355444 1025861616 /nfs/dbraw/zinc/86/16/16/1025861616.db2.gz VCNMCLQGFCRNPC-NUJGCVRESA-N 1 0 348.443 3.509 20 5 EHBDRO CO[C@@]1(C)C[C@@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000451490103 1026033896 /nfs/dbraw/zinc/03/38/96/1026033896.db2.gz OLPHBNZNNAQIGH-QAPCUYQASA-N 1 0 345.399 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCc3ccncc3)C2)cc1 ZINC000451554170 1026107625 /nfs/dbraw/zinc/10/76/25/1026107625.db2.gz ZLMWIOHUZWTCRB-GOSISDBHSA-N 1 0 325.412 3.802 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000530627686 1026153802 /nfs/dbraw/zinc/15/38/02/1026153802.db2.gz SPVLQULKQZSTTE-IBGZPJMESA-N 1 0 328.412 3.674 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000127106296 1026276073 /nfs/dbraw/zinc/27/60/73/1026276073.db2.gz RPUUPARSWPUYLX-OAHLLOKOSA-N 1 0 343.427 3.812 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCCC[C@@H]1C ZINC000339002300 1026333100 /nfs/dbraw/zinc/33/31/00/1026333100.db2.gz KQMWYBSRTFEJKY-UONOGXRCSA-N 1 0 328.416 3.818 20 5 EHBDRO COCc1cccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158516727 1026590072 /nfs/dbraw/zinc/59/00/72/1026590072.db2.gz ZTXUQWVQEOEINM-IBGZPJMESA-N 1 0 340.423 3.852 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301467750 1026816212 /nfs/dbraw/zinc/81/62/12/1026816212.db2.gz MNDSRTXERPWYHR-GFCCVEGCSA-N 1 0 331.338 3.534 20 5 EHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000531379276 1026845777 /nfs/dbraw/zinc/84/57/77/1026845777.db2.gz ZOHWILYIOYCHLE-LJQANCHMSA-N 1 0 325.412 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc2nccc(N3CC[C@@H](Cc4nccs4)C3)c2c1 ZINC000897279633 1026879365 /nfs/dbraw/zinc/87/93/65/1026879365.db2.gz VHRHPPFKRODIBR-LBPRGKRZSA-N 1 0 340.408 3.669 20 5 EHBDRO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@H](C)C2)cc1OC ZINC001167602807 1027009294 /nfs/dbraw/zinc/00/92/94/1027009294.db2.gz QFMDWKXLGQLWAC-KGLIPLIRSA-N 1 0 336.432 3.870 20 5 EHBDRO C[C@H]1COCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000277826143 1027065058 /nfs/dbraw/zinc/06/50/58/1027065058.db2.gz LIPAXUMUQNHJBQ-LRDDRELGSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCN(Cc2ccccc2)C1 ZINC000531692629 1027190588 /nfs/dbraw/zinc/19/05/88/1027190588.db2.gz REIQFWMWJYFPSN-WMZOPIPTSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000543907459 1027291109 /nfs/dbraw/zinc/29/11/09/1027291109.db2.gz PVBSDAWFUDAVAI-ZVZYQTTQSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]([NH3+])c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000420205283 1027387522 /nfs/dbraw/zinc/38/75/22/1027387522.db2.gz ISPFKMTZEUDFRN-SECBINFHSA-N 1 0 340.305 3.640 20 5 EHBDRO COCCC1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC1 ZINC000475492828 1027415795 /nfs/dbraw/zinc/41/57/95/1027415795.db2.gz NCSUKBBTTNTMDA-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO O=[N+]([O-])c1cnc(NCCCCC[NH+]2CCCC2)c(C(F)(F)F)c1 ZINC000413295591 1027457684 /nfs/dbraw/zinc/45/76/84/1027457684.db2.gz JHLYHFYQEWHZEA-UHFFFAOYSA-N 1 0 346.353 3.687 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])cc1 ZINC000276337132 1027538205 /nfs/dbraw/zinc/53/82/05/1027538205.db2.gz LWUMNELBPAQCLS-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000178682080 1027871503 /nfs/dbraw/zinc/87/15/03/1027871503.db2.gz UKFYRGGLGSHUPF-WSYIQSFVSA-N 1 0 347.459 3.637 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccnc2c1cccc2[N+](=O)[O-] ZINC001167626268 1027992454 /nfs/dbraw/zinc/99/24/54/1027992454.db2.gz CEJJIGOPSMRGNI-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@@H]1CCCC[C@H]1C ZINC000444677652 1028147062 /nfs/dbraw/zinc/14/70/62/1028147062.db2.gz QAQYSSVWMJBBAW-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)n[nH]1 ZINC000518838462 1028243758 /nfs/dbraw/zinc/24/37/58/1028243758.db2.gz VCTPJMIMOQZGMJ-UHFFFAOYSA-N 1 0 336.395 3.659 20 5 EHBDRO COC[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000582956680 1028365395 /nfs/dbraw/zinc/36/53/95/1028365395.db2.gz LXGGUHJSJDLOOT-LJQANCHMSA-N 1 0 328.412 3.895 20 5 EHBDRO C[C@H]([NH2+]CCc1cc(C(F)(F)F)ccn1)c1ccc([N+](=O)[O-])cc1 ZINC000293735128 1028438671 /nfs/dbraw/zinc/43/86/71/1028438671.db2.gz OTIZEZFTRAXGLK-NSHDSACASA-N 1 0 339.317 3.902 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2ncc[nH]2)C1 ZINC000347376206 1028804180 /nfs/dbraw/zinc/80/41/80/1028804180.db2.gz ZXLMWYKYWMGKIP-DNXIFWLFSA-N 1 0 326.400 3.601 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCSC1 ZINC000504900073 1029026910 /nfs/dbraw/zinc/02/69/10/1029026910.db2.gz QTGAXAVQQNQULG-OLZOCXBDSA-N 1 0 326.487 3.951 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3cc(C)ccc23)cc1[N+](=O)[O-] ZINC000237389049 1029131912 /nfs/dbraw/zinc/13/19/12/1029131912.db2.gz AUKRXMKXSHJGJQ-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000445888356 1029211608 /nfs/dbraw/zinc/21/16/08/1029211608.db2.gz UMVBBBVEFLHZPL-CQSZACIVSA-N 1 0 334.338 3.930 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288261 1029581028 /nfs/dbraw/zinc/58/10/28/1029581028.db2.gz WUFPQVPSYZPABD-OCCSQVGLSA-N 1 0 333.432 3.741 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000583391099 1029755070 /nfs/dbraw/zinc/75/50/70/1029755070.db2.gz KJQLQCICDWTYES-RDTXWAMCSA-N 1 0 341.386 3.590 20 5 EHBDRO C[C@@H]1CCN(Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000525268990 1029777242 /nfs/dbraw/zinc/77/72/42/1029777242.db2.gz CABIVGVJMHDWAW-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@@H](c4ccccc4)C3)nc2c1 ZINC000446843949 1029824396 /nfs/dbraw/zinc/82/43/96/1029824396.db2.gz CZQQWEVGXWGGLT-HUUCEWRRSA-N 1 0 336.395 3.897 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248213 1029883713 /nfs/dbraw/zinc/88/37/13/1029883713.db2.gz IVWJELPYHMRMLP-WBMJQRKESA-N 1 0 345.399 3.932 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898178 1030010645 /nfs/dbraw/zinc/01/06/45/1030010645.db2.gz KSSDLKKTMKGZMD-SFHVURJKSA-N 1 0 328.416 3.547 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+]C(C)(C)CCO)cc1[N+](=O)[O-] ZINC000525695463 1030038658 /nfs/dbraw/zinc/03/86/58/1030038658.db2.gz GTRURJKJZLTIAK-UHFFFAOYSA-N 1 0 343.427 3.613 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1cccs1 ZINC000441249809 1030132306 /nfs/dbraw/zinc/13/23/06/1030132306.db2.gz PEBLJRJWVVTFKZ-UHFFFAOYSA-N 1 0 336.413 3.566 20 5 EHBDRO CC[C@@H](O)[C@@H](CC)[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000453380887 1030161195 /nfs/dbraw/zinc/16/11/95/1030161195.db2.gz RTAKCAIZKOYDRP-UMVBOHGHSA-N 1 0 326.462 3.605 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(C)cn2)cc1[N+](=O)[O-] ZINC000453406265 1030214810 /nfs/dbraw/zinc/21/48/10/1030214810.db2.gz CKQVUUFYAIHHEU-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239741 1030219192 /nfs/dbraw/zinc/21/91/92/1030219192.db2.gz GKSFSNBNEKGUKY-DOMZBBRYSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])nc1 ZINC000453413604 1030227414 /nfs/dbraw/zinc/22/74/14/1030227414.db2.gz HZWQMSZAHPOVFG-LPHOPBHVSA-N 1 0 339.439 3.842 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC(C)(C)OC1(C)C ZINC000482157695 1030235211 /nfs/dbraw/zinc/23/52/11/1030235211.db2.gz NBXKFPJVEXNMRK-MRXNPFEDSA-N 1 0 336.432 3.818 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509103 1030258202 /nfs/dbraw/zinc/25/82/02/1030258202.db2.gz LUISUPNLAKOLBL-HNAYVOBHSA-N 1 0 331.460 3.826 20 5 EHBDRO Cc1ccc([C@H](C)C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447538418 1030273302 /nfs/dbraw/zinc/27/33/02/1030273302.db2.gz CAWQFZHYUPKJIB-BPQIPLTHSA-N 1 0 342.443 3.977 20 5 EHBDRO Cc1cc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)ccc1F ZINC000447542963 1030277425 /nfs/dbraw/zinc/27/74/25/1030277425.db2.gz QDKJSHINROOMMG-HOTGVXAUSA-N 1 0 332.379 3.512 20 5 EHBDRO Cc1cc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)ccc1F ZINC000447542965 1030277886 /nfs/dbraw/zinc/27/78/86/1030277886.db2.gz QDKJSHINROOMMG-JKSUJKDBSA-N 1 0 332.379 3.512 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCSCC(F)(F)F)CCC2 ZINC000447584609 1030318531 /nfs/dbraw/zinc/31/85/31/1030318531.db2.gz GRCCCZHFJYTHOA-ZDUSSCGKSA-N 1 0 334.363 3.857 20 5 EHBDRO Cc1cccc(C)c1CC[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447587232 1030322670 /nfs/dbraw/zinc/32/26/70/1030322670.db2.gz QNJSDEWREJIVPC-QZTJIDSGSA-N 1 0 342.443 3.724 20 5 EHBDRO CCC(CC)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(=O)OC ZINC000447593575 1030330614 /nfs/dbraw/zinc/33/06/14/1030330614.db2.gz SZKIDYCCALEWCR-MRXNPFEDSA-N 1 0 334.416 3.541 20 5 EHBDRO COCC1([NH2+]Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)CC1 ZINC000532213222 1030483040 /nfs/dbraw/zinc/48/30/40/1030483040.db2.gz ZQFCQDVZCOUZBG-UHFFFAOYSA-N 1 0 341.411 3.631 20 5 EHBDRO COc1ccccc1OCC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000527288452 1030772105 /nfs/dbraw/zinc/77/21/05/1030772105.db2.gz BPPCNPDYBQBDAA-NTCAYCPXSA-N 1 0 342.395 3.675 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483104657 1030961287 /nfs/dbraw/zinc/96/12/87/1030961287.db2.gz WFNIHZOTBLRRRZ-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCC2(O)CCC2)c2ccccc2)c1 ZINC000551570958 1031464365 /nfs/dbraw/zinc/46/43/65/1031464365.db2.gz JWKSXWPGXWLIDN-GOSISDBHSA-N 1 0 326.396 3.579 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](Cn1cccn1)c1ccccc1 ZINC000594494828 1033395651 /nfs/dbraw/zinc/39/56/51/1033395651.db2.gz INDCIBFLRFCGIP-MOPGFXCFSA-N 1 0 348.406 3.810 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000594514241 1033419279 /nfs/dbraw/zinc/41/92/79/1033419279.db2.gz IVUIOYYNMDCSSR-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H](c2ccco2)N2CCCCC2)cc1[N+](=O)[O-] ZINC000061013492 1033436380 /nfs/dbraw/zinc/43/63/80/1033436380.db2.gz PRCSRDZNEOAQCR-SFHVURJKSA-N 1 0 343.427 3.813 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594603455 1033448219 /nfs/dbraw/zinc/44/82/19/1033448219.db2.gz VJSZVSRQCIOUKG-NVXWUHKLSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@H](COc1c(F)cccc1F)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000594972961 1033578763 /nfs/dbraw/zinc/57/87/63/1033578763.db2.gz GEQVBUJANOMSAZ-SNVBAGLBSA-N 1 0 340.301 3.569 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc(C(F)(F)F)nn2C)cc1[N+](=O)[O-] ZINC000594935842 1033585763 /nfs/dbraw/zinc/58/57/63/1033585763.db2.gz HTCUTNKSXKSWOO-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@]34C[C@@H]3CCC4)o2)c([N+](=O)[O-])c1 ZINC000594954059 1033596106 /nfs/dbraw/zinc/59/61/06/1033596106.db2.gz XAOQAXVFQHTVPK-SGTLLEGYSA-N 1 0 328.368 3.896 20 5 EHBDRO COC1CC(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000594961063 1033601015 /nfs/dbraw/zinc/60/10/15/1033601015.db2.gz DSURKWGMXORXOI-UHFFFAOYSA-N 1 0 330.384 3.760 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1COc2ccc(C)cc21 ZINC000595022884 1033616370 /nfs/dbraw/zinc/61/63/70/1033616370.db2.gz QDWJLKHZQJMGCF-LRDDRELGSA-N 1 0 328.368 3.696 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](c1cccs1)N(C)C ZINC000595002904 1033628610 /nfs/dbraw/zinc/62/86/10/1033628610.db2.gz BEKHWQSRNHYPAX-IUODEOHRSA-N 1 0 349.456 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CO[C@@H](C4CC4)C3)o2)cc1 ZINC000599007612 1033640788 /nfs/dbraw/zinc/64/07/88/1033640788.db2.gz QPLRZCUXFOCPRO-RDTXWAMCSA-N 1 0 328.368 3.512 20 5 EHBDRO C/C=C\C[NH2+]Cc1ccc(OCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000599005727 1033640911 /nfs/dbraw/zinc/64/09/11/1033640911.db2.gz PRUHWFVGXPJXQD-ARJAWSKDSA-N 1 0 342.395 3.848 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595069812 1033646060 /nfs/dbraw/zinc/64/60/60/1033646060.db2.gz SGRBXTQTUJZJGD-LIRRHRJNSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000595036174 1033658431 /nfs/dbraw/zinc/65/84/31/1033658431.db2.gz QBDCSNNACBSUJF-KZULUSFZSA-N 1 0 327.384 3.800 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)(C)C(F)F ZINC000595046560 1033663076 /nfs/dbraw/zinc/66/30/76/1033663076.db2.gz AMDPXQODNAADNP-JTQLQIEISA-N 1 0 325.359 3.888 20 5 EHBDRO COC1CC(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000595051528 1033667146 /nfs/dbraw/zinc/66/71/46/1033667146.db2.gz VTHXCDHEGYXAJY-XPJGSDBHSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C1CCC(OC(F)F)CC1 ZINC000595053636 1033667339 /nfs/dbraw/zinc/66/73/39/1033667339.db2.gz XFVWARWKBIPBEI-XSRFYTQQSA-N 1 0 344.358 3.804 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000595084702 1033698759 /nfs/dbraw/zinc/69/87/59/1033698759.db2.gz HZJVCVFHWGDSHY-AYOQOUSVSA-N 1 0 342.443 3.780 20 5 EHBDRO C[C@H](CO)C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000593676900 1033732725 /nfs/dbraw/zinc/73/27/25/1033732725.db2.gz OYOJVMRYKAZSCD-CQSZACIVSA-N 1 0 344.411 3.695 20 5 EHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441565 1033806675 /nfs/dbraw/zinc/80/66/75/1033806675.db2.gz WTMIGHUIDWQKQX-HZPDHXFCSA-N 1 0 329.400 3.782 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCC[C@@H]2CCO)c2ccccc2)c1 ZINC000188027218 1033808548 /nfs/dbraw/zinc/80/85/48/1033808548.db2.gz VPDMOKMWYWYCRC-CDHQVMDDSA-N 1 0 340.423 3.825 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000593021267 1033834349 /nfs/dbraw/zinc/83/43/49/1033834349.db2.gz SQJBMTWAJDWSKS-MRXNPFEDSA-N 1 0 328.368 3.622 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000595509003 1033836486 /nfs/dbraw/zinc/83/64/86/1033836486.db2.gz DRPYMXCBRWLUMM-QFYYESIMSA-N 1 0 336.388 3.588 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552526 1033859254 /nfs/dbraw/zinc/85/92/54/1033859254.db2.gz MKHKUVMUYIXOSW-KRWDZBQOSA-N 1 0 333.363 3.628 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748158 1033979065 /nfs/dbraw/zinc/97/90/65/1033979065.db2.gz QDVUYDDMEIMJJK-HHXXYDBFSA-N 1 0 340.423 3.754 20 5 EHBDRO CC[NH+](CC)CCOc1ccccc1CNc1ccccc1[N+](=O)[O-] ZINC000603857026 1033983210 /nfs/dbraw/zinc/98/32/10/1033983210.db2.gz MOZOOAISVAJSFK-UHFFFAOYSA-N 1 0 343.427 3.928 20 5 EHBDRO Cc1cccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])c(C)c3)CC2)c1 ZINC000603840284 1033985016 /nfs/dbraw/zinc/98/50/16/1033985016.db2.gz ZXSMSIUNULRNIF-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cnccc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000596061579 1034064398 /nfs/dbraw/zinc/06/43/98/1034064398.db2.gz GMXZDQCPKXMNHA-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO O=[N+]([O-])c1cc(NC2CC[NH+](C3CC3)CC2)ccc1C(F)(F)F ZINC000596067176 1034068018 /nfs/dbraw/zinc/06/80/18/1034068018.db2.gz USOSMRWWCGMIGQ-UHFFFAOYSA-N 1 0 329.322 3.652 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000596168108 1034116590 /nfs/dbraw/zinc/11/65/90/1034116590.db2.gz KREUFOZHKROQKL-SMDDNHRTSA-N 1 0 343.349 3.534 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596276779 1034139281 /nfs/dbraw/zinc/13/92/81/1034139281.db2.gz DQFFUZHXQAMSEY-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000596596800 1034311537 /nfs/dbraw/zinc/31/15/37/1034311537.db2.gz FYHNXRIRSBHVBR-ZDUSSCGKSA-N 1 0 328.416 3.772 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000604427980 1034376141 /nfs/dbraw/zinc/37/61/41/1034376141.db2.gz MVWJWWGIEUPJTK-KRWDZBQOSA-N 1 0 342.395 3.645 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435879 1034379313 /nfs/dbraw/zinc/37/93/13/1034379313.db2.gz CJFQXNNXBGLRGE-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000534337071 1034433096 /nfs/dbraw/zinc/43/30/96/1034433096.db2.gz VRDMHWPQXVGSRW-UHFFFAOYSA-N 1 0 328.416 3.616 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCn2nccc21 ZINC000601321342 1034452711 /nfs/dbraw/zinc/45/27/11/1034452711.db2.gz PUXHRNJXDYUSMJ-KBPBESRZSA-N 1 0 346.456 3.787 20 5 EHBDRO C[NH+](C)CCCC1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000179698831 1034576377 /nfs/dbraw/zinc/57/63/77/1034576377.db2.gz JGDHZUMCCNUFIL-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000364577251 1034702081 /nfs/dbraw/zinc/70/20/81/1034702081.db2.gz JCHZBQAHTWWLRU-CZUORRHYSA-N 1 0 328.416 3.580 20 5 EHBDRO C[C@@H](c1cccs1)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411172609 1034799590 /nfs/dbraw/zinc/79/95/90/1034799590.db2.gz MOAFNVXGEYGAGI-LBPRGKRZSA-N 1 0 333.413 3.678 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425153 1034847980 /nfs/dbraw/zinc/84/79/80/1034847980.db2.gz FQUKDQQPUXBILH-UXLLHSPISA-N 1 0 347.459 3.673 20 5 EHBDRO COc1ccc([C@H](C[NH+]2CCCC2)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000612449918 1034946652 /nfs/dbraw/zinc/94/66/52/1034946652.db2.gz KDCKBWMICORTQN-HNNXBMFYSA-N 1 0 347.440 3.914 20 5 EHBDRO COc1ccc(OCCC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000548935523 1034997107 /nfs/dbraw/zinc/99/71/07/1034997107.db2.gz NNBOBZKRNSWBHZ-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1OC(F)F ZINC000580095559 1035406050 /nfs/dbraw/zinc/40/60/50/1035406050.db2.gz YMDLIHBTHQIUPQ-AWEZNQCLSA-N 1 0 334.322 3.973 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000066371848 1035419540 /nfs/dbraw/zinc/41/95/40/1035419540.db2.gz CNUJOGHWTQSFEA-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1ccccc1[C@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580624241 1035444451 /nfs/dbraw/zinc/44/44/51/1035444451.db2.gz PEEQURKBMSAKHA-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO C[C@H](c1cccc(Nc2ccccc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000511452447 1035458706 /nfs/dbraw/zinc/45/87/06/1035458706.db2.gz BMZLOYPVZRPMDX-CQSZACIVSA-N 1 0 327.384 3.732 20 5 EHBDRO CC(C)(C)c1cnc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000580873282 1035465599 /nfs/dbraw/zinc/46/55/99/1035465599.db2.gz JGNZBOHFRCGHNU-UHFFFAOYSA-N 1 0 335.429 3.517 20 5 EHBDRO CC(C)[N@H+](C)CCCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581256256 1035482361 /nfs/dbraw/zinc/48/23/61/1035482361.db2.gz YDWCWHVAHRQZPV-CQSZACIVSA-N 1 0 333.354 3.518 20 5 EHBDRO COC[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000540617153 1035507714 /nfs/dbraw/zinc/50/77/14/1035507714.db2.gz BMQZDPYYMXNTSS-YXMMZVCTSA-N 1 0 330.359 3.724 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CSC[C@H]1C ZINC000571528590 1035545217 /nfs/dbraw/zinc/54/52/17/1035545217.db2.gz YSVKVPSZRMFLAC-UPJWGTAASA-N 1 0 326.487 3.807 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000075864701 1035568453 /nfs/dbraw/zinc/56/84/53/1035568453.db2.gz WJHHZNSPTXQYAA-MRXNPFEDSA-N 1 0 344.386 3.773 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000156680522 1035587545 /nfs/dbraw/zinc/58/75/45/1035587545.db2.gz CUPFSVKKBXKUHA-AWEZNQCLSA-N 1 0 329.400 3.938 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000457106742 1035744451 /nfs/dbraw/zinc/74/44/51/1035744451.db2.gz DOPNOKPWUPVVMU-KRWDZBQOSA-N 1 0 347.462 3.943 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)nc1C ZINC000414169722 1035867465 /nfs/dbraw/zinc/86/74/65/1035867465.db2.gz RYMIYBVBMYKEDH-SFHVURJKSA-N 1 0 325.412 3.718 20 5 EHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])c(OCC)c1)C[C@@H]1CCCCO1 ZINC000492531541 1035933346 /nfs/dbraw/zinc/93/33/46/1035933346.db2.gz FZLVYITZVFEUIC-INIZCTEOSA-N 1 0 336.432 3.775 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056197234 1036138748 /nfs/dbraw/zinc/13/87/48/1036138748.db2.gz AXLNYAHKWDMCJO-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113837 1036258200 /nfs/dbraw/zinc/25/82/00/1036258200.db2.gz ZOXJYGLTYCGZAP-RISCZKNCSA-N 1 0 343.349 3.534 20 5 EHBDRO CC(C)c1ccc(CN2C[C@@H]([NH+]3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000589188635 1036296786 /nfs/dbraw/zinc/29/67/86/1036296786.db2.gz DPHTWEYOGBJMSA-WBVHZDCISA-N 1 0 331.460 3.777 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000589300212 1036330487 /nfs/dbraw/zinc/33/04/87/1036330487.db2.gz DZPLUVRBFZUSFE-BMGDILEWSA-N 1 0 330.428 3.998 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@@H](C)O[C@H]1C ZINC000414284051 1036437593 /nfs/dbraw/zinc/43/75/93/1036437593.db2.gz QAPSHSNUPNXBCV-CBBWQLFWSA-N 1 0 338.473 3.869 20 5 EHBDRO CCc1ccc(C(=O)Nc2cc(C)cc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000535418392 1036457455 /nfs/dbraw/zinc/45/74/55/1036457455.db2.gz BWFGZCJKDZOWJH-UHFFFAOYSA-N 1 0 341.411 3.780 20 5 EHBDRO CCOC(=O)[C@@]1(C(C)C)CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825987 1036509310 /nfs/dbraw/zinc/50/93/10/1036509310.db2.gz IPDGKFFJYCSDMZ-KDOFPFPSSA-N 1 0 334.416 3.567 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000541691067 1036563678 /nfs/dbraw/zinc/56/36/78/1036563678.db2.gz URABNAIBUJMKBI-VPZZIHKRSA-N 1 0 342.395 3.646 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCO2 ZINC000152750925 1036632113 /nfs/dbraw/zinc/63/21/13/1036632113.db2.gz GGOFEIYYJQXRFE-QWHCGFSZSA-N 1 0 328.368 3.778 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000057128338 1036708421 /nfs/dbraw/zinc/70/84/21/1036708421.db2.gz GLPPPXYZJUPUQE-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO COC[C@@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590175601 1036800597 /nfs/dbraw/zinc/80/05/97/1036800597.db2.gz WVNIMZSIBHPFMF-GFCCVEGCSA-N 1 0 346.349 3.862 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000414350213 1036883008 /nfs/dbraw/zinc/88/30/08/1036883008.db2.gz QGHJLRJELNHNGK-CZUORRHYSA-N 1 0 329.375 3.663 20 5 EHBDRO CC(C)(C)[NH+]1CCC(NCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000892630771 1036916550 /nfs/dbraw/zinc/91/65/50/1036916550.db2.gz DDYUBTBCHHFYTB-UHFFFAOYSA-N 1 0 325.840 3.601 20 5 EHBDRO C[N@H+](CCc1cccs1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089906438 1036938767 /nfs/dbraw/zinc/93/87/67/1036938767.db2.gz CZRWVWRMIDOXAP-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOC(C)(C)C ZINC000539625281 1037000762 /nfs/dbraw/zinc/00/07/62/1037000762.db2.gz MEJGVIXRXVLJOX-CYBMUJFWSA-N 1 0 326.462 3.870 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2ccnc2)c1 ZINC000180662573 1037054533 /nfs/dbraw/zinc/05/45/33/1037054533.db2.gz HBQKZSHTYOOIGS-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N1CCCCC1 ZINC000761515144 1037092640 /nfs/dbraw/zinc/09/26/40/1037092640.db2.gz IEWOVVNDVAYNIM-UHFFFAOYSA-N 1 0 325.840 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCOc2ccccc2F)cc1Cl ZINC000761521013 1037098121 /nfs/dbraw/zinc/09/81/21/1037098121.db2.gz IBGCHBPZRGCQAB-UHFFFAOYSA-N 1 0 338.766 3.946 20 5 EHBDRO C[C@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443217771 1037222213 /nfs/dbraw/zinc/22/22/13/1037222213.db2.gz DOOIJPBCNHJQAK-FRRDWIJNSA-N 1 0 330.388 3.502 20 5 EHBDRO CC(C)Oc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000271789243 1037271207 /nfs/dbraw/zinc/27/12/07/1037271207.db2.gz QGINSEXIPSTVDS-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800026 1037295720 /nfs/dbraw/zinc/29/57/20/1037295720.db2.gz PESJYSWBMYYIKQ-GTNSWQLSSA-N 1 0 336.338 3.566 20 5 EHBDRO CN(Cc1ccccc1[N+](=O)[O-])C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110238 1037326111 /nfs/dbraw/zinc/32/61/11/1037326111.db2.gz QCZWISMDYHIKNP-GOSISDBHSA-N 1 0 339.439 3.549 20 5 EHBDRO CC(C)[NH2+]CCCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000591577295 1037514246 /nfs/dbraw/zinc/51/42/46/1037514246.db2.gz MULQTVPQRGEWFU-IBGZPJMESA-N 1 0 327.428 3.662 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000532476518 1037515723 /nfs/dbraw/zinc/51/57/23/1037515723.db2.gz LPGMTLNGKDPTAY-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053805 1037531084 /nfs/dbraw/zinc/53/10/84/1037531084.db2.gz FQUKDQQPUXBILH-YQQAZPJKSA-N 1 0 347.459 3.673 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532547500 1037562779 /nfs/dbraw/zinc/56/27/79/1037562779.db2.gz VLFQJQOZSSRCIN-NVXWUHKLSA-N 1 0 328.412 3.812 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccsc2[N+](=O)[O-])CC1 ZINC000591821602 1037637596 /nfs/dbraw/zinc/63/75/96/1037637596.db2.gz XBJVXHSTMYGALH-GFCCVEGCSA-N 1 0 332.429 3.689 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000415919952 1037656875 /nfs/dbraw/zinc/65/68/75/1037656875.db2.gz NVLNAZYMNRBCMV-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO C[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1cccc2[nH]ccc21 ZINC000494036828 1037789478 /nfs/dbraw/zinc/78/94/78/1037789478.db2.gz HCZOLUXXEJIRLE-UHFFFAOYSA-N 1 0 325.368 3.587 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CCC(F)(F)F)[C@H]1CC[C@H](O)CC1 ZINC000592131041 1037844456 /nfs/dbraw/zinc/84/44/56/1037844456.db2.gz RIMZARAUNFQSDB-HDJSIYSDSA-N 1 0 346.349 3.653 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3c(F)cccc3[N+](=O)[O-])C2)cc1 ZINC000103473181 1037902953 /nfs/dbraw/zinc/90/29/53/1037902953.db2.gz PDUJOGCCHRRNHR-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(OC(C)C)nc1 ZINC000468645104 1037938191 /nfs/dbraw/zinc/93/81/91/1037938191.db2.gz KHWZDCMMOBEBBF-DHDCSXOGSA-N 1 0 341.411 3.970 20 5 EHBDRO CC(C)(C)OC(=O)[C@@H]1CC[C@H]([NH2+]C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000592378501 1037950481 /nfs/dbraw/zinc/95/04/81/1037950481.db2.gz BDHFZSNLIKDHCI-DODUIYEKSA-N 1 0 346.427 3.708 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180721 1038150032 /nfs/dbraw/zinc/15/00/32/1038150032.db2.gz AHQOCJHQLSNDQH-GJZGRUSLSA-N 1 0 328.416 3.636 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCCc2occc21 ZINC000341439284 1038318959 /nfs/dbraw/zinc/31/89/59/1038318959.db2.gz HPNQJNXOZOUWKA-BLLLJJGKSA-N 1 0 343.383 3.572 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000538777197 1038524055 /nfs/dbraw/zinc/52/40/55/1038524055.db2.gz GYDSSDMWSRYHII-STQMWFEESA-N 1 0 332.425 3.980 20 5 EHBDRO CC(C)(C)C[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000341468471 1038752111 /nfs/dbraw/zinc/75/21/11/1038752111.db2.gz ZRSJYXHGEKFQKZ-HNNXBMFYSA-N 1 0 334.395 3.698 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000552051772 1038896295 /nfs/dbraw/zinc/89/62/95/1038896295.db2.gz GGKXFYAEYHHQNG-CYBMUJFWSA-N 1 0 339.395 3.545 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2cccc(OC)c2[N+](=O)[O-])CC1 ZINC000185213374 1039046294 /nfs/dbraw/zinc/04/62/94/1039046294.db2.gz FZPWEUUMVVWUIN-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)sc1C ZINC000192964537 1039082688 /nfs/dbraw/zinc/08/26/88/1039082688.db2.gz KOLRPKVSXYEMCE-MRXNPFEDSA-N 1 0 331.441 3.878 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000552250957 1039092591 /nfs/dbraw/zinc/09/25/91/1039092591.db2.gz HARGJSLVBGHGQN-RVKKMQEKSA-N 1 0 342.443 3.834 20 5 EHBDRO CC(C)(CNc1ccc([N+](=O)[O-])cc1OC(F)F)C[NH+]1CCCC1 ZINC000478048004 1039169539 /nfs/dbraw/zinc/16/95/39/1039169539.db2.gz PJUUAOOQDAOTQS-UHFFFAOYSA-N 1 0 343.374 3.730 20 5 EHBDRO CCC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000552300178 1039169893 /nfs/dbraw/zinc/16/98/93/1039169893.db2.gz ZKWIKHOYMONOID-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1C ZINC000893280643 1039177937 /nfs/dbraw/zinc/17/79/37/1039177937.db2.gz ZAPOFBJWBNLBAU-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574442 1039265080 /nfs/dbraw/zinc/26/50/80/1039265080.db2.gz YGFBWZCWWISFPM-MRXNPFEDSA-N 1 0 344.386 3.807 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000366071905 1039344784 /nfs/dbraw/zinc/34/47/84/1039344784.db2.gz GIAJHDZAIJJKRB-IMJJTQAJSA-N 1 0 328.416 3.705 20 5 EHBDRO COc1cc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)ccc1SC ZINC000554834979 1039809722 /nfs/dbraw/zinc/80/97/22/1039809722.db2.gz OPEACWLQLVVKOG-UHFFFAOYSA-N 1 0 346.452 4.000 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](Cc2ccccc2)CN(C)C)cccc1[N+](=O)[O-] ZINC000480884734 1040131703 /nfs/dbraw/zinc/13/17/03/1040131703.db2.gz UUZLWSGVTWUBHR-FUHWJXTLSA-N 1 0 341.455 3.727 20 5 EHBDRO COc1cc(C[NH2+]CC2CC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000128487138 1040194004 /nfs/dbraw/zinc/19/40/04/1040194004.db2.gz ZRBZFENGUCNFLR-UHFFFAOYSA-N 1 0 342.395 3.682 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490014983 1040308730 /nfs/dbraw/zinc/30/87/30/1040308730.db2.gz RVVIVBWBBQUZCD-QGZVFWFLSA-N 1 0 326.396 3.668 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCC1=CCCCC1 ZINC000500041167 1040365517 /nfs/dbraw/zinc/36/55/17/1040365517.db2.gz WOXWCOAKNWXFKF-CQSZACIVSA-N 1 0 331.416 3.792 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH2+][C@H]3CC4CCC3CC4)o2)c1 ZINC000432989872 1040382707 /nfs/dbraw/zinc/38/27/07/1040382707.db2.gz VQJHZQGAFHXXNX-KVULBXGLSA-N 1 0 341.411 3.961 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]([NH+]2[C@H](C)CC[C@H]2C)C1 ZINC000490309110 1040490916 /nfs/dbraw/zinc/49/09/16/1040490916.db2.gz SMQHYRDCWDFNQD-VQHPVUNQSA-N 1 0 331.460 3.993 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCS1 ZINC000600156519 1040751380 /nfs/dbraw/zinc/75/13/80/1040751380.db2.gz QPMNRJKPVCKYKI-ZDUSSCGKSA-N 1 0 334.363 3.989 20 5 EHBDRO O=C(N[C@@H]1CC[N@@H+]2CCCC[C@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355743 1040767972 /nfs/dbraw/zinc/76/79/72/1040767972.db2.gz WCDDTPNNRMXCRJ-WOJBJXKFSA-N 1 0 345.446 3.745 20 5 EHBDRO COC(=O)[C@@H](C)C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509797031 1040837333 /nfs/dbraw/zinc/83/73/33/1040837333.db2.gz AWQSZADUVQETRQ-LBPRGKRZSA-N 1 0 348.424 3.564 20 5 EHBDRO COc1cc(C[NH2+]C2CCCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000491020268 1040866608 /nfs/dbraw/zinc/86/66/08/1040866608.db2.gz MIXSYRYSKPZVDA-UHFFFAOYSA-N 1 0 344.358 3.670 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000433167573 1040956385 /nfs/dbraw/zinc/95/63/85/1040956385.db2.gz JFZTXAWZNHACLK-MRXNPFEDSA-N 1 0 327.384 3.511 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000044532211 1040969515 /nfs/dbraw/zinc/96/95/15/1040969515.db2.gz VZZBCSVHLNUSEI-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCCC[C@@H]1n1cccn1 ZINC000128573982 1041143514 /nfs/dbraw/zinc/14/35/14/1041143514.db2.gz JNDSVNAWVBTNFR-CABCVRRESA-N 1 0 334.807 3.718 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181640796 1041162714 /nfs/dbraw/zinc/16/27/14/1041162714.db2.gz YSZIYQCISRUMFY-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507302 1041395175 /nfs/dbraw/zinc/39/51/75/1041395175.db2.gz BDSDDNUMFNHJTO-SNVBAGLBSA-N 1 0 329.322 3.571 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([N@H+](C)CCOc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111310251 1042259531 /nfs/dbraw/zinc/25/95/31/1042259531.db2.gz WBRVFBJVABDQKY-INIZCTEOSA-N 1 0 347.440 3.748 20 5 EHBDRO Cc1nc2c(s1)[C@H]([N@H+](C)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111312367 1042260923 /nfs/dbraw/zinc/26/09/23/1042260923.db2.gz IVMKGCAFDLAYOZ-MRXNPFEDSA-N 1 0 331.441 3.912 20 5 EHBDRO Cc1c(C[NH2+]Cc2cccc(Br)c2)cccc1[N+](=O)[O-] ZINC000048818738 1042419644 /nfs/dbraw/zinc/41/96/44/1042419644.db2.gz RBQHPRZRVYFHGA-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO CC[N@H+](CCc1nccs1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000159202660 1042692779 /nfs/dbraw/zinc/69/27/79/1042692779.db2.gz UMAPCNHVMFSEPW-UHFFFAOYSA-N 1 0 349.456 3.903 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)c1OC ZINC000342122385 1042816146 /nfs/dbraw/zinc/81/61/46/1042816146.db2.gz BRLQPRQWZICQFC-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO CO[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)(C)C ZINC000072925501 1042877998 /nfs/dbraw/zinc/87/79/98/1042877998.db2.gz PETZGJPDXFZNKE-OAHLLOKOSA-N 1 0 349.456 3.869 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000432327147 1042908389 /nfs/dbraw/zinc/90/83/89/1042908389.db2.gz FNHZWIWNBDOPJJ-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2cccnc2)C1 ZINC000569481323 1043005031 /nfs/dbraw/zinc/00/50/31/1043005031.db2.gz CWDUFETWSRFAOS-INIZCTEOSA-N 1 0 341.411 3.767 20 5 EHBDRO CCOC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000072975803 1043373024 /nfs/dbraw/zinc/37/30/24/1043373024.db2.gz IGWHMTPZNAEAIY-OAHLLOKOSA-N 1 0 336.432 3.631 20 5 EHBDRO Cn1cc(C[NH2+][C@@H]2CCc3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279174831 1043505824 /nfs/dbraw/zinc/50/58/24/1043505824.db2.gz RCRQTVQLESIGJN-LJQANCHMSA-N 1 0 348.406 3.772 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178544022 1043635580 /nfs/dbraw/zinc/63/55/80/1043635580.db2.gz DNNMZXOSQKHVHP-KUHUBIRLSA-N 1 0 340.423 3.759 20 5 EHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239361 1043639081 /nfs/dbraw/zinc/63/90/81/1043639081.db2.gz JWOLGSLRJKRMCZ-LALPHHSUSA-N 1 0 330.388 3.874 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344321937 1043661175 /nfs/dbraw/zinc/66/11/75/1043661175.db2.gz GDSISAWILKIQDB-ZDUSSCGKSA-N 1 0 338.791 3.579 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CC[C@@H](c4ccccc4)C3)c2)cc1 ZINC000728899651 1043716059 /nfs/dbraw/zinc/71/60/59/1043716059.db2.gz KJHDMFZDWITBAS-GOSISDBHSA-N 1 0 348.406 3.905 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@@H]3C3CCC3)c2)cc1 ZINC000728900957 1043854232 /nfs/dbraw/zinc/85/42/32/1043854232.db2.gz YREVQRCTAYXKDK-GOSISDBHSA-N 1 0 326.400 3.680 20 5 EHBDRO C[C@H](Cc1ccsc1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765260300 1127589693 /nfs/dbraw/zinc/58/96/93/1127589693.db2.gz JLQRUIBDEXNKQT-CQSZACIVSA-N 1 0 345.468 3.846 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000765333904 1127599598 /nfs/dbraw/zinc/59/95/98/1127599598.db2.gz NAEMEIGYMGQGHH-HUUCEWRRSA-N 1 0 326.396 3.805 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C[S@](C)=O)cc1 ZINC000552317878 1127749105 /nfs/dbraw/zinc/74/91/05/1127749105.db2.gz JWEQKVYLLIKZAQ-SHACYNPGSA-N 1 0 346.452 3.633 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccnc(N2CCCC2)c1 ZINC000131433481 1127827377 /nfs/dbraw/zinc/82/73/77/1127827377.db2.gz YVRNKMMRSKYMOU-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC001168600736 1128278392 /nfs/dbraw/zinc/27/83/92/1128278392.db2.gz BPUAJVOEDRBUHZ-KBPBESRZSA-N 1 0 331.338 3.898 20 5 EHBDRO Cc1cnc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000301458496 1128344582 /nfs/dbraw/zinc/34/45/82/1128344582.db2.gz SWDNJQQDXFLCME-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO C[C@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000301554966 1128497122 /nfs/dbraw/zinc/49/71/22/1128497122.db2.gz ICXPBAWNVXSAHO-ONGXEEELSA-N 1 0 329.322 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844705 1128547145 /nfs/dbraw/zinc/54/71/45/1128547145.db2.gz HXFKTPKBPJGEMF-JKSUJKDBSA-N 1 0 348.399 3.594 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765844787 1128547291 /nfs/dbraw/zinc/54/72/91/1128547291.db2.gz JIFDQOJVDGGCCS-ZUSMLRIVSA-N 1 0 344.386 3.681 20 5 EHBDRO CCCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765849373 1128572870 /nfs/dbraw/zinc/57/28/70/1128572870.db2.gz PSXURBSZZYBFME-AUUYWEPGSA-N 1 0 344.411 3.768 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@]2(O)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765879842 1128637138 /nfs/dbraw/zinc/63/71/38/1128637138.db2.gz UJNOGAAQOBSQHQ-QRWLVFNGSA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000091469780 1128669664 /nfs/dbraw/zinc/66/96/64/1128669664.db2.gz BMNOFLLWALTFIG-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@H]3COCC[C@H]3C2)cc1 ZINC000921781167 1128756659 /nfs/dbraw/zinc/75/66/59/1128756659.db2.gz XIGZRTQREOANFF-OKZBNKHCSA-N 1 0 332.444 3.712 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000301647352 1128839106 /nfs/dbraw/zinc/83/91/06/1128839106.db2.gz IHUVHKJOSYHKSK-PBHICJAKSA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCCCC[NH+]1CCCC1 ZINC000338754972 1128871854 /nfs/dbraw/zinc/87/18/54/1128871854.db2.gz JDYAAWMLQUOMLN-UHFFFAOYSA-N 1 0 346.353 3.687 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988978 1128917059 /nfs/dbraw/zinc/91/70/59/1128917059.db2.gz WEDXLGORCGBLBB-ZIAGYGMSSA-N 1 0 345.374 3.733 20 5 EHBDRO CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000494439045 1120566512 /nfs/dbraw/zinc/56/65/12/1120566512.db2.gz YRBSBBGJNZNADX-HZPDHXFCSA-N 1 0 332.425 3.572 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@](C)(Cc1ccccc1)[C@@H](C)O ZINC000191715994 1120689911 /nfs/dbraw/zinc/68/99/11/1120689911.db2.gz SFUQEZHDIVPNSD-UZLBHIALSA-N 1 0 342.439 3.623 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000495024772 1120932616 /nfs/dbraw/zinc/93/26/16/1120932616.db2.gz FQHRYYHYNCUWHZ-LJHODMEESA-N 1 0 326.396 3.841 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000915212086 1121248801 /nfs/dbraw/zinc/24/88/01/1121248801.db2.gz WUCOZMWPKWMARR-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@H]12 ZINC000915209645 1121253052 /nfs/dbraw/zinc/25/30/52/1121253052.db2.gz LXKJZHXWDJDXRQ-XYPHTWIQSA-N 1 0 328.416 3.803 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000495690200 1121359028 /nfs/dbraw/zinc/35/90/28/1121359028.db2.gz LHVNGPVBXDOFKJ-CYBMUJFWSA-N 1 0 343.383 3.932 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724053 1128994301 /nfs/dbraw/zinc/99/43/01/1128994301.db2.gz OOUGQRCVZABZGV-AAEUAGOBSA-N 1 0 343.349 3.534 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272486283 1121662538 /nfs/dbraw/zinc/66/25/38/1121662538.db2.gz CWKOAYYZKWWHSW-QGZVFWFLSA-N 1 0 328.416 3.588 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC1CCC([NH+]2CCCCC2)CC1 ZINC000301738169 1129013616 /nfs/dbraw/zinc/01/36/16/1129013616.db2.gz ISGURAHNJGSRJD-UHFFFAOYSA-N 1 0 338.839 3.852 20 5 EHBDRO CCC1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000125315103 1122312034 /nfs/dbraw/zinc/31/20/34/1122312034.db2.gz DTYLMBOHBXEYKO-UHFFFAOYSA-N 1 0 328.416 3.617 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2c(C)cccc2[N+](=O)[O-])C1 ZINC000194676707 1122838102 /nfs/dbraw/zinc/83/81/02/1122838102.db2.gz RNEZYQLAUCUERC-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO COCC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCC1 ZINC000556408254 1122967017 /nfs/dbraw/zinc/96/70/17/1122967017.db2.gz SYZLAWNGNOCARU-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO Cc1c(CN2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cccc1[N+](=O)[O-] ZINC000498911743 1123112461 /nfs/dbraw/zinc/11/24/61/1123112461.db2.gz QEPZMWXAKMHBMB-SFHVURJKSA-N 1 0 345.487 3.847 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000007783632 1123353578 /nfs/dbraw/zinc/35/35/78/1123353578.db2.gz JRUPGCONNROUFJ-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccccc1F ZINC000064350040 1123574458 /nfs/dbraw/zinc/57/44/58/1123574458.db2.gz ULCAZPCTBDPLJK-GOSISDBHSA-N 1 0 332.375 3.678 20 5 EHBDRO CCC[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000077942010 1123590256 /nfs/dbraw/zinc/59/02/56/1123590256.db2.gz KYSVRARZPLOSDW-UHFFFAOYSA-N 1 0 333.435 3.556 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672478 1123636425 /nfs/dbraw/zinc/63/64/25/1123636425.db2.gz CGFYWZZDTLYOOJ-RDJZCZTQSA-N 1 0 326.396 3.852 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000195667930 1123712170 /nfs/dbraw/zinc/71/21/70/1123712170.db2.gz CNGODGJDBLVLMC-LJQANCHMSA-N 1 0 326.396 3.887 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000195667928 1123712413 /nfs/dbraw/zinc/71/24/13/1123712413.db2.gz CNGODGJDBLVLMC-IBGZPJMESA-N 1 0 326.396 3.887 20 5 EHBDRO CC[C@@](C)(CO)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610088850 1123728714 /nfs/dbraw/zinc/72/87/14/1123728714.db2.gz GDXJAGYNOPZCJZ-IBGZPJMESA-N 1 0 343.427 3.613 20 5 EHBDRO Cc1ccccc1CN(C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000007845489 1123836166 /nfs/dbraw/zinc/83/61/66/1123836166.db2.gz VFWNIOHBADLWEV-UHFFFAOYSA-N 1 0 347.802 3.627 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([S@@](C)=O)cc1 ZINC000615724348 1123863721 /nfs/dbraw/zinc/86/37/21/1123863721.db2.gz XNSDEQWQBHETKT-ONDWKUSTSA-N 1 0 344.436 3.525 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H]1CCCc2c1cnn2C ZINC000615835120 1123884499 /nfs/dbraw/zinc/88/44/99/1123884499.db2.gz PURRORKVIFRPAP-MDNBWPLSSA-N 1 0 340.427 3.741 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccnn1C ZINC000615966867 1123919369 /nfs/dbraw/zinc/91/93/69/1123919369.db2.gz KPPLDTDTTPLLTH-NVXWUHKLSA-N 1 0 344.459 3.679 20 5 EHBDRO CCC[C@]1(COC)CCC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000618550629 1125106288 /nfs/dbraw/zinc/10/62/88/1125106288.db2.gz LPNFHXVSOTUMAN-QGZVFWFLSA-N 1 0 333.388 3.517 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569436 1125363914 /nfs/dbraw/zinc/36/39/14/1125363914.db2.gz CKBYRUPCGACMKL-FCLVOEFKSA-N 1 0 332.444 3.746 20 5 EHBDRO C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000182933175 1125397115 /nfs/dbraw/zinc/39/71/15/1125397115.db2.gz WCHZJMQDDGBQHU-GFCCVEGCSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccsc1 ZINC000619782813 1125404230 /nfs/dbraw/zinc/40/42/30/1125404230.db2.gz KNCWQCHNIUAIAN-VIFPVBQESA-N 1 0 339.804 3.599 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000182939541 1125406468 /nfs/dbraw/zinc/40/64/68/1125406468.db2.gz LLWABCWMWRCLCK-NSHDSACASA-N 1 0 339.823 3.745 20 5 EHBDRO CC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845872 1129189236 /nfs/dbraw/zinc/18/92/36/1129189236.db2.gz TXXGTEDYCCIEBF-IEBWSBKVSA-N 1 0 339.395 3.655 20 5 EHBDRO C[C@@H]1CO[C@H](c2ccccc2)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851863 1129216514 /nfs/dbraw/zinc/21/65/14/1129216514.db2.gz IFPUYHOMJJFCKJ-BEFAXECRSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000255953226 1129237120 /nfs/dbraw/zinc/23/71/20/1129237120.db2.gz KASPWZFZLAGOTM-NTZNESFSSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccco1 ZINC000069070384 1129420647 /nfs/dbraw/zinc/42/06/47/1129420647.db2.gz LRCPGGBATQZETI-CYBMUJFWSA-N 1 0 331.372 3.518 20 5 EHBDRO C[NH+](C)CCCC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000123634197 1129444163 /nfs/dbraw/zinc/44/41/63/1129444163.db2.gz WRQATBMMQNCLDN-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cn(C)nc2C2CCCC2)cc1[N+](=O)[O-] ZINC000922317335 1129462756 /nfs/dbraw/zinc/46/27/56/1129462756.db2.gz ZJWHHWWNPUCEDH-UHFFFAOYSA-N 1 0 328.416 3.584 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC(C)(C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543405420 1129469024 /nfs/dbraw/zinc/46/90/24/1129469024.db2.gz RRMRFGSHXPURSM-GOSISDBHSA-N 1 0 346.427 3.838 20 5 EHBDRO C[C@@H]1CCC[C@](CNc2ncc([N+](=O)[O-])cc2Cl)([NH+](C)C)C1 ZINC000317839092 1129475943 /nfs/dbraw/zinc/47/59/43/1129475943.db2.gz QTULVHQYBCDBLD-ABAIWWIYSA-N 1 0 326.828 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2OCCc3sccc32)c(Cl)c1 ZINC000922438816 1129532385 /nfs/dbraw/zinc/53/23/85/1129532385.db2.gz UGKOFWVNAWZWHP-AWEZNQCLSA-N 1 0 338.816 3.713 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC1CCOCC1 ZINC000093284640 1129582757 /nfs/dbraw/zinc/58/27/57/1129582757.db2.gz FIZBUIZHSOGPIA-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CN(Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000389826713 1129591208 /nfs/dbraw/zinc/59/12/08/1129591208.db2.gz RTMDDHFJTJUPFC-DNVCBOLYSA-N 1 0 339.439 3.513 20 5 EHBDRO C[C@H]([NH2+][C@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000389865029 1129592589 /nfs/dbraw/zinc/59/25/89/1129592589.db2.gz KMRRIXCTNHMWSU-GUXCAODWSA-N 1 0 339.439 3.766 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])nc1 ZINC000390849047 1129638518 /nfs/dbraw/zinc/63/85/18/1129638518.db2.gz HVQFYKDTGNBKTI-QGZVFWFLSA-N 1 0 340.427 3.702 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000331055544 1129652107 /nfs/dbraw/zinc/65/21/07/1129652107.db2.gz KRXXFRBYACFKCV-GJZGRUSLSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000331280990 1129658844 /nfs/dbraw/zinc/65/88/44/1129658844.db2.gz UPNMSOQLMODUQD-GJZGRUSLSA-N 1 0 347.459 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](CCCCO)C3CC3)o2)cc1 ZINC000125687793 1129710473 /nfs/dbraw/zinc/71/04/73/1129710473.db2.gz FXBNYBDXQZCGCZ-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000392391473 1129712262 /nfs/dbraw/zinc/71/22/62/1129712262.db2.gz VBOZPBKQUYNEOX-NSHDSACASA-N 1 0 346.353 3.685 20 5 EHBDRO COc1cc(N2CCC[C@H](C[N@@H+]3CCCC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081759 1129767124 /nfs/dbraw/zinc/76/71/24/1129767124.db2.gz YATLHLGMSTZHQX-JKSUJKDBSA-N 1 0 347.459 3.694 20 5 EHBDRO C[NH+](C)CC1(CNc2ccc([N+](=O)[O-])c3cnccc23)CCCC1 ZINC000302153222 1129770793 /nfs/dbraw/zinc/77/07/93/1129770793.db2.gz LJZUPELETGCLAD-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000056197507 1129805751 /nfs/dbraw/zinc/80/57/51/1129805751.db2.gz DMLHTGSJHQGWEP-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303532714 1129852848 /nfs/dbraw/zinc/85/28/48/1129852848.db2.gz GEDUDFAOOCLTPT-HNAYVOBHSA-N 1 0 343.427 3.744 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000543559400 1129973671 /nfs/dbraw/zinc/97/36/71/1129973671.db2.gz SDIRMULNCVVHAI-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@H]1C ZINC001307590582 1130099946 /nfs/dbraw/zinc/09/99/46/1130099946.db2.gz WDZVJQAAZWTGDU-WDEREUQCSA-N 1 0 327.222 3.835 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(Br)cs2)cc1 ZINC000040675950 1130243212 /nfs/dbraw/zinc/24/32/12/1130243212.db2.gz QAAAUHROGMULDD-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000174035580 1130332070 /nfs/dbraw/zinc/33/20/70/1130332070.db2.gz VWUMAMSIEOMUAZ-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(C(F)(F)F)CC2)cc1 ZINC000174190439 1130340442 /nfs/dbraw/zinc/34/04/42/1130340442.db2.gz MJQLGBYFLXZFDN-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000246801333 1130413507 /nfs/dbraw/zinc/41/35/07/1130413507.db2.gz ABTVUTXBCLRPPT-WDVBMNPBSA-N 1 0 332.425 3.744 20 5 EHBDRO CN(CC[N@H+](C)C1CCCCC1)c1ccc2ncccc2c1[N+](=O)[O-] ZINC000732568010 1130936715 /nfs/dbraw/zinc/93/67/15/1130936715.db2.gz XXOWRQMJCQBHDV-UHFFFAOYSA-N 1 0 342.443 3.844 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172901171 1131884325 /nfs/dbraw/zinc/88/43/25/1131884325.db2.gz KIZOVSIVXMSBFK-FUHWJXTLSA-N 1 0 325.412 3.978 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172902060 1131884630 /nfs/dbraw/zinc/88/46/30/1131884630.db2.gz UNLDIVVCJKSTFC-SUMWQHHRSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1noc3ccccc13)CC2 ZINC001172903244 1131885956 /nfs/dbraw/zinc/88/59/56/1131885956.db2.gz PUQLVUGEVLNJOI-HNNXBMFYSA-N 1 0 337.379 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905332 1131886045 /nfs/dbraw/zinc/88/60/45/1131886045.db2.gz RFKALELCSMBZLM-GOEBONIOSA-N 1 0 342.361 3.911 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172906506 1131887497 /nfs/dbraw/zinc/88/74/97/1131887497.db2.gz XPADBEGXROXLEU-YOEHRIQHSA-N 1 0 332.444 3.637 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCc3sccc3C1)CC2 ZINC001172905585 1131888177 /nfs/dbraw/zinc/88/81/77/1131888177.db2.gz SKLLJOKPGJYYOP-INIZCTEOSA-N 1 0 328.437 3.962 20 5 EHBDRO CC1(C)C[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(C)(C)O1 ZINC001172921913 1131905505 /nfs/dbraw/zinc/90/55/05/1131905505.db2.gz VQELJXGVTBJUDW-INIZCTEOSA-N 1 0 332.444 3.732 20 5 EHBDRO Cc1cc([C@@H]2CCC[N@@H+]2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910416 1131916366 /nfs/dbraw/zinc/91/63/66/1131916366.db2.gz ZFIDFAGNRXRWQF-APWZRJJASA-N 1 0 341.411 3.976 20 5 EHBDRO CO[C@H]1CCC[C@@H]2C[N@@H+]([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910552 1131917608 /nfs/dbraw/zinc/91/76/08/1131917608.db2.gz LVERWRJPTAWPSX-UMGGQSCQSA-N 1 0 344.455 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1Cc3cnc(Cl)cc3C1)CC2 ZINC001172912786 1131917911 /nfs/dbraw/zinc/91/79/11/1131917911.db2.gz MHUCWHPRULWBNT-INIZCTEOSA-N 1 0 343.814 3.906 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccc(F)cc2)c1F ZINC001173174905 1131991623 /nfs/dbraw/zinc/99/16/23/1131991623.db2.gz FXBMUSOCRGZHSA-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H]3CCC[C@H]3C2)c1F ZINC001173178276 1131991936 /nfs/dbraw/zinc/99/19/36/1131991936.db2.gz ACFXDYLKKMQTEN-IHRRRGAJSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C/C=C/c2ccccc2)c1F ZINC001173178187 1131991998 /nfs/dbraw/zinc/99/19/98/1131991998.db2.gz JVEAPKCGBVMMBU-VIIAAUOXSA-N 1 0 344.386 3.977 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)CCc2ccccc2)c1F ZINC001173184524 1131993473 /nfs/dbraw/zinc/99/34/73/1131993473.db2.gz NPXLCFKPNODJKY-AWEZNQCLSA-N 1 0 346.402 3.848 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC(SC)CC2)c1F ZINC001173189541 1131995745 /nfs/dbraw/zinc/99/57/45/1131995745.db2.gz KPDZSMBUYSXHQU-NSHDSACASA-N 1 0 342.436 3.501 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1cccc(Cl)c1 ZINC001173215580 1132000883 /nfs/dbraw/zinc/00/08/83/1132000883.db2.gz WXVWOOJUGUFYGK-ZDUSSCGKSA-N 1 0 334.803 3.848 20 5 EHBDRO COC(=O)c1cccc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173216532 1132002053 /nfs/dbraw/zinc/00/20/53/1132002053.db2.gz CPKYOPAXZRMSSS-KGLIPLIRSA-N 1 0 342.395 3.663 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC001173215663 1132002325 /nfs/dbraw/zinc/00/23/25/1132002325.db2.gz YEPMTIHBEOPFSG-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2cccc(Cl)c2)COC1 ZINC001173219235 1132002896 /nfs/dbraw/zinc/00/28/96/1132002896.db2.gz ZKMIVWYYJNDVRM-ZDUSSCGKSA-N 1 0 346.814 3.695 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOCc1ccccc1 ZINC001173218936 1132003162 /nfs/dbraw/zinc/00/31/62/1132003162.db2.gz UCGNAQXWCZXWGO-INIZCTEOSA-N 1 0 328.412 3.722 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(Br)o1 ZINC001173219330 1132003530 /nfs/dbraw/zinc/00/35/30/1132003530.db2.gz AXOVZLBDAVIZLS-SNVBAGLBSA-N 1 0 339.189 3.671 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccccc1)C1(O)CCC1 ZINC001173222292 1132004156 /nfs/dbraw/zinc/00/41/56/1132004156.db2.gz WAUOIXKZRWPRIX-HNAYVOBHSA-N 1 0 340.423 3.772 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2cc(F)cc(F)c21 ZINC001173220256 1132004557 /nfs/dbraw/zinc/00/45/57/1132004557.db2.gz WSXKNVDYUIYDLT-BZNIZROVSA-N 1 0 348.349 3.917 20 5 EHBDRO CCOC[C@@]12CCC[C@@H]1C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173223756 1132005605 /nfs/dbraw/zinc/00/56/05/1132005605.db2.gz HIRYMDSRIUGPAP-SUMDDJOVSA-N 1 0 332.444 3.664 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173227325 1132006195 /nfs/dbraw/zinc/00/61/95/1132006195.db2.gz PUSWDKZEMUHNAO-HNNXBMFYSA-N 1 0 348.443 3.581 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173227217 1132006205 /nfs/dbraw/zinc/00/62/05/1132006205.db2.gz OKJKPBKIJVXAOS-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2ccc(F)cc2)C1 ZINC001173227263 1132007214 /nfs/dbraw/zinc/00/72/14/1132007214.db2.gz PAWLSDDAARZWTF-KUHUBIRLSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227931 1132007671 /nfs/dbraw/zinc/00/76/71/1132007671.db2.gz SPMVACWSVHGVDQ-OXJNMPFZSA-N 1 0 339.439 3.515 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001173227872 1132007861 /nfs/dbraw/zinc/00/78/61/1132007861.db2.gz SFKVVKZDQFDNCA-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cncc1-c1cccc(C[NH3+])c1 ZINC001173229644 1132008587 /nfs/dbraw/zinc/00/85/87/1132008587.db2.gz OKXIVWVFWHHJBH-AWEZNQCLSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCOC2(C)C)CC1 ZINC001173231473 1132008772 /nfs/dbraw/zinc/00/87/72/1132008772.db2.gz LKVFIAFTYONITM-HNNXBMFYSA-N 1 0 332.444 3.807 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1cccc2ccoc21 ZINC001173230864 1132009715 /nfs/dbraw/zinc/00/97/15/1132009715.db2.gz VQXUXZKTWQSAQQ-CQSZACIVSA-N 1 0 340.379 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](C[C@@H]2CCC3(CCC3)CO2)C2CC2)cc1 ZINC001168860550 1132582452 /nfs/dbraw/zinc/58/24/52/1132582452.db2.gz YSHPWNXVTLLPTJ-SFHVURJKSA-N 1 0 330.428 3.909 20 5 EHBDRO CC(C)Oc1cccc(C[N@H+](C)CCOc2ccccc2[N+](=O)[O-])c1 ZINC001168884826 1132596585 /nfs/dbraw/zinc/59/65/85/1132596585.db2.gz GMPZKCRQYPZMPG-UHFFFAOYSA-N 1 0 344.411 3.893 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C(F)(F)F)c1 ZINC001168986251 1132620169 /nfs/dbraw/zinc/62/01/69/1132620169.db2.gz XJBSDVFBOJWEHN-FZMZJTMJSA-N 1 0 330.350 3.976 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C(F)(F)F)c1 ZINC001168986253 1132620277 /nfs/dbraw/zinc/62/02/77/1132620277.db2.gz XJBSDVFBOJWEHN-RISCZKNCSA-N 1 0 330.350 3.976 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cc1C(F)(F)F ZINC001168998270 1132627355 /nfs/dbraw/zinc/62/73/55/1132627355.db2.gz KQKGINDPYZQTCD-STQMWFEESA-N 1 0 346.349 3.639 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@H](C[N+](=O)[O-])C3)cc2)cc1 ZINC001168986752 1132634650 /nfs/dbraw/zinc/63/46/50/1132634650.db2.gz YYYFULWHEGITOK-QFBILLFUSA-N 1 0 340.423 3.897 20 5 EHBDRO CC1(C)C[C@@H](Nc2nc(Cl)ccc2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169146709 1132676332 /nfs/dbraw/zinc/67/63/32/1132676332.db2.gz RWYNOTJLNWXVGI-MEBBXXQBSA-N 1 0 326.828 3.599 20 5 EHBDRO CCC1(CC)C[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)CCS1 ZINC000767480647 1133009201 /nfs/dbraw/zinc/00/92/01/1133009201.db2.gz UYOGWNYVTRLFMR-UHFFFAOYSA-N 1 0 334.445 3.510 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)COc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC001177463524 1133065276 /nfs/dbraw/zinc/06/52/76/1133065276.db2.gz BJORVFPWXUMRDR-HNNXBMFYSA-N 1 0 344.411 3.777 20 5 EHBDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178558035 1133181220 /nfs/dbraw/zinc/18/12/20/1133181220.db2.gz WZZVXNVXEDJJGQ-QWRGUYRKSA-N 1 0 327.222 3.883 20 5 EHBDRO O=C1CC[C@@H]2C[N@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769204911 1133244174 /nfs/dbraw/zinc/24/41/74/1133244174.db2.gz BGTUFCXCKIOOAP-GOSISDBHSA-N 1 0 330.431 3.800 20 5 EHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000769483385 1133289506 /nfs/dbraw/zinc/28/95/06/1133289506.db2.gz MNSYVIMCBYMZKI-LQOHYYORSA-N 1 0 340.423 3.972 20 5 EHBDRO Cc1cccc(OCCC[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1C ZINC001181390938 1133487326 /nfs/dbraw/zinc/48/73/26/1133487326.db2.gz OOOJWLPAKPPELZ-UHFFFAOYSA-N 1 0 328.412 3.813 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC001184053648 1133891027 /nfs/dbraw/zinc/89/10/27/1133891027.db2.gz BZNMYUWNMXDZJB-TXJVSEOTSA-N 1 0 344.455 3.853 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC001185097809 1134028253 /nfs/dbraw/zinc/02/82/53/1134028253.db2.gz DRHFDBUCSVYPNG-GFCCVEGCSA-N 1 0 349.460 3.666 20 5 EHBDRO O=C(O[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120048 1134080632 /nfs/dbraw/zinc/08/06/32/1134080632.db2.gz PQAPPXSIVUFZQG-OCCSQVGLSA-N 1 0 346.408 3.593 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000788575968 1134147145 /nfs/dbraw/zinc/14/71/45/1134147145.db2.gz INPGIBXGHYKTFB-ROUUACIJSA-N 1 0 326.396 3.640 20 5 EHBDRO C[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000788665098 1134158802 /nfs/dbraw/zinc/15/88/02/1134158802.db2.gz MJYXBUJODXXPNT-VXGBXAGGSA-N 1 0 349.818 3.949 20 5 EHBDRO C[C@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665579 1134159071 /nfs/dbraw/zinc/15/90/71/1134159071.db2.gz OWKPNIUPRGXQBN-LBPRGKRZSA-N 1 0 325.368 3.817 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788666074 1134159206 /nfs/dbraw/zinc/15/92/06/1134159206.db2.gz PXTYANODQMOIGH-GTNSWQLSSA-N 1 0 349.818 3.869 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc[nH]c(=O)c1 ZINC000788797044 1134170479 /nfs/dbraw/zinc/17/04/79/1134170479.db2.gz VHXRGADGBVOTAA-VIFPVBQESA-N 1 0 341.289 3.565 20 5 EHBDRO CC(C)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000788795636 1134170493 /nfs/dbraw/zinc/17/04/93/1134170493.db2.gz AOYODKVMERTDQM-MJXNMMHHSA-N 1 0 343.427 3.586 20 5 EHBDRO CC[C@H]1C[N@H+](CC)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186440829 1134213204 /nfs/dbraw/zinc/21/32/04/1134213204.db2.gz GKBXHFFZYMOGNK-LBPRGKRZSA-N 1 0 331.338 3.534 20 5 EHBDRO Cc1cc(N2CC[NH2+][C@@H](c3ccc(Cl)cc3)C2)c([N+](=O)[O-])s1 ZINC001187931639 1134401792 /nfs/dbraw/zinc/40/17/92/1134401792.db2.gz LHBNOVHRESVZSJ-CYBMUJFWSA-N 1 0 337.832 3.769 20 5 EHBDRO CCOC(=O)NC1CCC([NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000790747734 1134461637 /nfs/dbraw/zinc/46/16/37/1134461637.db2.gz QJJMJIDQWNEXOU-VMBOVVBDSA-N 1 0 349.431 3.693 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775370111 1134672384 /nfs/dbraw/zinc/67/23/84/1134672384.db2.gz LAABKVIHKKQADN-HOCLYGCPSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(F)cc(F)c2)c([N+](=O)[O-])c1 ZINC001170294797 1134736000 /nfs/dbraw/zinc/73/60/00/1134736000.db2.gz CRWVJGMJZHAATQ-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170306258 1134736120 /nfs/dbraw/zinc/73/61/20/1134736120.db2.gz TZURYEOLWKHPBX-CQSZACIVSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C/C=C/c2ccccc2)c([N+](=O)[O-])c1 ZINC001170297893 1134738253 /nfs/dbraw/zinc/73/82/53/1134738253.db2.gz VEOMCKLMMGAVEX-RZIFZGNASA-N 1 0 326.396 3.837 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170304252 1134739074 /nfs/dbraw/zinc/73/90/74/1134739074.db2.gz ALHFHCZLPDLGJO-UONOGXRCSA-N 1 0 344.411 3.633 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cccc(F)c2C)c([N+](=O)[O-])c1 ZINC001170305594 1134739411 /nfs/dbraw/zinc/73/94/11/1134739411.db2.gz NOFGZPOJKBIQEI-LBPRGKRZSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170305435 1134739638 /nfs/dbraw/zinc/73/96/38/1134739638.db2.gz KNVKLFREFNMOEZ-OAHLLOKOSA-N 1 0 344.411 3.593 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cnc(C(C)C)s2)c([N+](=O)[O-])c1 ZINC001170318896 1134746636 /nfs/dbraw/zinc/74/66/36/1134746636.db2.gz RZIICYFEPIOZRE-GFCCVEGCSA-N 1 0 349.456 3.904 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C(C)(C)Cc2ccncc2)c([N+](=O)[O-])c1 ZINC001170323381 1134747746 /nfs/dbraw/zinc/74/77/46/1134747746.db2.gz JGUXLSZLNNIGAK-CQSZACIVSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335423 1134752404 /nfs/dbraw/zinc/75/24/04/1134752404.db2.gz NJLDVJRMBWOYMQ-FPMFFAJLSA-N 1 0 340.370 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCCc2ccccn2)c([N+](=O)[O-])c1 ZINC001170306618 1134752509 /nfs/dbraw/zinc/75/25/09/1134752509.db2.gz YWKXNQVASKAIAF-HNNXBMFYSA-N 1 0 343.427 3.542 20 5 EHBDRO CC[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000792876148 1134809870 /nfs/dbraw/zinc/80/98/70/1134809870.db2.gz LTNFZUREULUJHB-QGZVFWFLSA-N 1 0 329.356 3.918 20 5 EHBDRO C[C@@H](Cc1ccsc1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001191406898 1134860798 /nfs/dbraw/zinc/86/07/98/1134860798.db2.gz CKYJFZOJBHHPNK-ZDUSSCGKSA-N 1 0 347.440 3.548 20 5 EHBDRO C[C@H](Cc1ccsc1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001191406897 1134861172 /nfs/dbraw/zinc/86/11/72/1134861172.db2.gz CKYJFZOJBHHPNK-CYBMUJFWSA-N 1 0 347.440 3.548 20 5 EHBDRO C[C@@]1(CNc2ccc(N)cc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000804684316 1135168443 /nfs/dbraw/zinc/16/84/43/1135168443.db2.gz ZACZVWLSURGYDV-IBGZPJMESA-N 1 0 340.427 3.501 20 5 EHBDRO CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001194090214 1135230721 /nfs/dbraw/zinc/23/07/21/1135230721.db2.gz DWAGFCSWPOEFHT-LSDHHAIUSA-N 1 0 326.824 3.932 20 5 EHBDRO CCCCO[C@@H]1C[C@@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1(C)C ZINC001194190025 1135241001 /nfs/dbraw/zinc/24/10/01/1135241001.db2.gz JDDQCCXHHOTNDL-IAGOWNOFSA-N 1 0 336.432 3.677 20 5 EHBDRO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC001194615576 1135299324 /nfs/dbraw/zinc/29/93/24/1135299324.db2.gz HSMJJXOOUIFJJP-HNNXBMFYSA-N 1 0 341.411 3.671 20 5 EHBDRO CCCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@@H](C)C1 ZINC001194714598 1135311158 /nfs/dbraw/zinc/31/11/58/1135311158.db2.gz IWFYJJRIKUUNMX-RHSMWYFYSA-N 1 0 347.459 3.875 20 5 EHBDRO CC(C)(C)OC(=O)CC[C@@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC001195233619 1135389444 /nfs/dbraw/zinc/38/94/44/1135389444.db2.gz KDHWGDORZBMWJR-HNNXBMFYSA-N 1 0 348.443 3.929 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1ccccc1)[NH+](C)C ZINC000807916421 1135589108 /nfs/dbraw/zinc/58/91/08/1135589108.db2.gz SXGLPDJVBLOVAC-SFHVURJKSA-N 1 0 327.384 3.512 20 5 EHBDRO CCC1(CC)CCCN1CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC001197514989 1135697214 /nfs/dbraw/zinc/69/72/14/1135697214.db2.gz WIJOWHKJHHBEKC-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001197514741 1135697347 /nfs/dbraw/zinc/69/73/47/1135697347.db2.gz RVSQUXKNMUJQAU-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO C[C@@H](COCC1CCCCC1)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC001197992436 1135764400 /nfs/dbraw/zinc/76/44/00/1135764400.db2.gz YOVNTJWUZFNERP-HNNXBMFYSA-N 1 0 336.432 3.549 20 5 EHBDRO C[C@@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCO2 ZINC001198260398 1135787723 /nfs/dbraw/zinc/78/77/23/1135787723.db2.gz JOTKBNYGWXYULP-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO [NH3+]CCN(Cc1csc2ccccc12)c1ccc([N+](=O)[O-])cc1 ZINC000809734765 1135874472 /nfs/dbraw/zinc/87/44/72/1135874472.db2.gz KUSOIRVFQUAFEO-UHFFFAOYSA-N 1 0 327.409 3.775 20 5 EHBDRO CCOC(=O)[C@H](C)[C@@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809976456 1135908241 /nfs/dbraw/zinc/90/82/41/1135908241.db2.gz DTGYSXYXYBWTOF-RKDXNWHRSA-N 1 0 349.214 3.579 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(Nc3cc(O)cc([N+](=O)[O-])c3)cc2)CC1 ZINC001201224425 1136000137 /nfs/dbraw/zinc/00/01/37/1136000137.db2.gz NLMVPWBHDPMWQT-UHFFFAOYSA-N 1 0 343.383 3.517 20 5 EHBDRO COc1ccc(OC)c(CCC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC001201856884 1136066889 /nfs/dbraw/zinc/06/68/89/1136066889.db2.gz CJBYUFOGDWBCRA-UHFFFAOYSA-N 1 0 344.411 3.643 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001201910614 1136074336 /nfs/dbraw/zinc/07/43/36/1136074336.db2.gz HRPWUMHHXYBUIZ-INIZCTEOSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000811474566 1136096633 /nfs/dbraw/zinc/09/66/33/1136096633.db2.gz LVQMHQZRVZDYEH-QWHCGFSZSA-N 1 0 344.242 3.618 20 5 EHBDRO CCC(CC)[C@@H](O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480732 1136097545 /nfs/dbraw/zinc/09/75/45/1136097545.db2.gz DMQQJJHVHFRMJQ-ZDUSSCGKSA-N 1 0 335.231 3.788 20 5 EHBDRO C[C@@H](c1cccc(Cl)c1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274960 1136129200 /nfs/dbraw/zinc/12/92/00/1136129200.db2.gz DYSRNZCYUMMEPZ-YVEFUNNKSA-N 1 0 334.803 3.975 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280113 1136135170 /nfs/dbraw/zinc/13/51/70/1136135170.db2.gz ZVIKIQHRUIEEBB-RBUKOAKNSA-N 1 0 326.396 3.774 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C[C@H](O)c1ccccc1 ZINC000850442018 1136259240 /nfs/dbraw/zinc/25/92/40/1136259240.db2.gz JRAKJLXVSXCYGZ-GLJUWKHASA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583105 1136441973 /nfs/dbraw/zinc/44/19/73/1136441973.db2.gz WJNYXEAIAMOZGM-YJBOKZPZSA-N 1 0 346.814 3.771 20 5 EHBDRO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585345 1136442205 /nfs/dbraw/zinc/44/22/05/1136442205.db2.gz WASMTHCBEOFIGG-SCLBCKFNSA-N 1 0 348.830 3.845 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2Cc2ccccc2)cc1 ZINC000776581261 1136444894 /nfs/dbraw/zinc/44/48/94/1136444894.db2.gz GEQAPSOUFLUXIZ-UXHICEINSA-N 1 0 340.423 3.725 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585597 1136448385 /nfs/dbraw/zinc/44/83/85/1136448385.db2.gz XLQDYMPCSRELSD-IUODEOHRSA-N 1 0 349.456 3.649 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000852446603 1136456737 /nfs/dbraw/zinc/45/67/37/1136456737.db2.gz KPUVLNYUFWGKRN-ROUUACIJSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Cl ZINC000776604312 1136465886 /nfs/dbraw/zinc/46/58/86/1136465886.db2.gz BJXARYKNWFNZHX-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO CC1(C)C[C@]1([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000852772707 1136484988 /nfs/dbraw/zinc/48/49/88/1136484988.db2.gz QAHNOMXCYZZGJW-MJGOQNOKSA-N 1 0 326.396 3.543 20 5 EHBDRO Cc1cc(N2CCC[C@@H](C[NH+](C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000814836280 1136513767 /nfs/dbraw/zinc/51/37/67/1136513767.db2.gz MUBZWCYETRHFBH-LBPRGKRZSA-N 1 0 345.365 3.700 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000853185619 1136515152 /nfs/dbraw/zinc/51/51/52/1136515152.db2.gz IVGDLWRFNXRJPZ-ZDUSSCGKSA-N 1 0 325.359 3.597 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000814909441 1136523718 /nfs/dbraw/zinc/52/37/18/1136523718.db2.gz LMNYJUWOWWITNQ-OAHLLOKOSA-N 1 0 343.349 3.536 20 5 EHBDRO C[C@H](OC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445440 1136596132 /nfs/dbraw/zinc/59/61/32/1136596132.db2.gz YSCJKCLJXBIIKR-KBXCAEBGSA-N 1 0 346.427 3.996 20 5 EHBDRO Cc1cccc(OC[C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815563454 1136611169 /nfs/dbraw/zinc/61/11/69/1136611169.db2.gz CKFNSZVDMWPBMJ-KBPBESRZSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@@H]([NH2+]CCOc1cccc(Cl)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815568038 1136611707 /nfs/dbraw/zinc/61/17/07/1136611707.db2.gz SUTLBLULXWHDEV-LLVKDONJSA-N 1 0 335.791 3.560 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CSCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571055 1136617498 /nfs/dbraw/zinc/61/74/98/1136617498.db2.gz SQWRCTJLNGTEQO-BDJLRTHQSA-N 1 0 329.425 3.816 20 5 EHBDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815622347 1136620381 /nfs/dbraw/zinc/62/03/81/1136620381.db2.gz SDONHKYZRIIPGQ-UBHSHLNASA-N 1 0 329.375 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](CO)C2CCCCC2)cc1Cl ZINC000816650201 1136744652 /nfs/dbraw/zinc/74/46/52/1136744652.db2.gz XWYFUFJWQDBZIH-AWEZNQCLSA-N 1 0 326.824 3.527 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000114508388 1136799672 /nfs/dbraw/zinc/79/96/72/1136799672.db2.gz HVUFHKABTXRLFS-LJQANCHMSA-N 1 0 328.412 3.716 20 5 EHBDRO [NH3+][C@H](CCc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCCCC1 ZINC000818378622 1136876536 /nfs/dbraw/zinc/87/65/36/1136876536.db2.gz UGOWDJLDZYHAFA-OAHLLOKOSA-N 1 0 344.415 3.875 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(Cc3ccccc3)CCC2)c1 ZINC000819151651 1136914595 /nfs/dbraw/zinc/91/45/95/1136914595.db2.gz CZXVQLGWIIBSTM-LJQANCHMSA-N 1 0 340.423 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(c3ccccc3Cl)CC2)c1 ZINC000819195568 1136922162 /nfs/dbraw/zinc/92/21/62/1136922162.db2.gz GFUQJMBXNXFISJ-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO CC[C@H](CCc1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000858363325 1136961765 /nfs/dbraw/zinc/96/17/65/1136961765.db2.gz SOENBGMELSHLOS-IEBWSBKVSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@]1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H]2C[C@H]2C1 ZINC000858538901 1136977139 /nfs/dbraw/zinc/97/71/39/1136977139.db2.gz YUCPDLABTOYJDT-QWHZDKJVSA-N 1 0 329.444 3.589 20 5 EHBDRO C[C@@H]([NH2+]CCC1CN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000859230976 1137009043 /nfs/dbraw/zinc/00/90/43/1137009043.db2.gz OZQSMGUKJMAKQO-CYBMUJFWSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830159 1137033609 /nfs/dbraw/zinc/03/36/09/1137033609.db2.gz NECOVKJHNUFIMG-NMSKTSORSA-N 1 0 333.215 3.803 20 5 EHBDRO CC(=O)c1ccc(NCCCC[NH+]2CCC(C)CC2)c([N+](=O)[O-])c1 ZINC000339037394 1137143694 /nfs/dbraw/zinc/14/36/94/1137143694.db2.gz XMYYFRFFNPKAAH-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO CC[C@@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000824661329 1137147226 /nfs/dbraw/zinc/14/72/26/1137147226.db2.gz VTKZQMWBGXLCCE-WWRUEGTHSA-N 1 0 349.431 3.501 20 5 EHBDRO C[C@@H](CSc1ccccc1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362091 1137215423 /nfs/dbraw/zinc/21/54/23/1137215423.db2.gz XSEZFLYHLCEVTM-KBXCAEBGSA-N 1 0 346.452 3.741 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](O)c1ccccc1 ZINC000794615711 1137221002 /nfs/dbraw/zinc/22/10/02/1137221002.db2.gz YKNDHJGUHULSKO-QZTJIDSGSA-N 1 0 332.375 3.582 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH+]3CCCCC3)CC2)c(C(F)F)c1 ZINC000865450841 1137284839 /nfs/dbraw/zinc/28/48/39/1137284839.db2.gz HHYGXBNEEMGHRF-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO CC(C)([NH2+][C@@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000865577492 1137296338 /nfs/dbraw/zinc/29/63/38/1137296338.db2.gz LAFNIRPRLHXEDY-OAHLLOKOSA-N 1 0 325.412 3.762 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@]12C[C@@H]1CCCC2 ZINC000865702948 1137305221 /nfs/dbraw/zinc/30/52/21/1137305221.db2.gz AQZFKBFJNFNNMW-XLWVJDPXSA-N 1 0 332.400 3.520 20 5 EHBDRO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)F ZINC000865799915 1137312874 /nfs/dbraw/zinc/31/28/74/1137312874.db2.gz FNUPUSXLAXRHIO-DGCLKSJQSA-N 1 0 325.359 3.595 20 5 EHBDRO CCc1cnc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866274696 1137341827 /nfs/dbraw/zinc/34/18/27/1137341827.db2.gz QRVPQKSXJILAOS-NSHDSACASA-N 1 0 337.420 3.516 20 5 EHBDRO CN(Cc1ccc2c(c1)C[NH2+]CC2)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000846217671 1137341981 /nfs/dbraw/zinc/34/19/81/1137341981.db2.gz KYHWKEXZMIMEMM-UHFFFAOYSA-N 1 0 345.830 3.526 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1(CCO)CCCCC1 ZINC000866280627 1137342320 /nfs/dbraw/zinc/34/23/20/1137342320.db2.gz XDZWYMIVAVXVGH-AWEZNQCLSA-N 1 0 338.423 3.587 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](C)c1c(F)cncc1F ZINC000866356293 1137348786 /nfs/dbraw/zinc/34/87/86/1137348786.db2.gz CKFSMWCKXZILDQ-NXEZZACHSA-N 1 0 339.317 3.689 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866367130 1137349958 /nfs/dbraw/zinc/34/99/58/1137349958.db2.gz GECGNVLQYNOQAE-HBUWYVDXSA-N 1 0 338.423 3.706 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC2(CO1)CCOCC2)c1cccc([N+](=O)[O-])c1 ZINC000866532241 1137362089 /nfs/dbraw/zinc/36/20/89/1137362089.db2.gz VNLDBMDUIJSDIJ-ROUUACIJSA-N 1 0 348.443 3.611 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H]1CC2(CO1)CCOCC2)c1cccc([N+](=O)[O-])c1 ZINC000866532242 1137362206 /nfs/dbraw/zinc/36/22/06/1137362206.db2.gz VNLDBMDUIJSDIJ-ZWKOTPCHSA-N 1 0 348.443 3.611 20 5 EHBDRO Cn1cc([C@@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2(C)C)cn1 ZINC000846929736 1137375891 /nfs/dbraw/zinc/37/58/91/1137375891.db2.gz YNANJUZRYFUKFU-HNNXBMFYSA-N 1 0 348.834 3.607 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1ccc2cnccc2c1[N+](=O)[O-] ZINC001171304100 1137406545 /nfs/dbraw/zinc/40/65/45/1137406545.db2.gz DTGKQOLJUICTCF-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000795080008 1137454766 /nfs/dbraw/zinc/45/47/66/1137454766.db2.gz HXHRDJSXTXLDDT-UHFFFAOYSA-N 1 0 349.479 3.576 20 5 EHBDRO C[C@H]1CN(Cc2cc([N+](=O)[O-])ccc2Cl)CC[N@@H+](C2CCC2)C1 ZINC000795118818 1137490307 /nfs/dbraw/zinc/49/03/07/1137490307.db2.gz AHRZXTBNURWROE-ZDUSSCGKSA-N 1 0 337.851 3.554 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171804857 1137513434 /nfs/dbraw/zinc/51/34/34/1137513434.db2.gz JMGFYLVOCLVSPE-GOEBONIOSA-N 1 0 345.443 3.824 20 5 EHBDRO C/C(=C\c1nc(C2C[C@H]3CC[C@@H](C2)[NH2+]3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000871797351 1137558625 /nfs/dbraw/zinc/55/86/25/1137558625.db2.gz KVGKRLXOVGATEF-OKEYKJPBSA-N 1 0 340.383 3.536 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019552 1137564895 /nfs/dbraw/zinc/56/48/95/1137564895.db2.gz WSBBIQQDKAHOTF-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042353 1137567278 /nfs/dbraw/zinc/56/72/78/1137567278.db2.gz BUBHINSOYIXJBU-JTNHKYCSSA-N 1 0 338.404 3.958 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1SCCS1 ZINC000872087694 1137570652 /nfs/dbraw/zinc/57/06/52/1137570652.db2.gz GXFFXJBYJPQLIT-VIFPVBQESA-N 1 0 330.500 3.773 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](OC2CCC2)CC1 ZINC000872275582 1137577179 /nfs/dbraw/zinc/57/71/79/1137577179.db2.gz HTXCNZVTDKQIDF-QGZVFWFLSA-N 1 0 334.416 3.527 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H](O)c2c(Cl)cccc2Cl)c1 ZINC000124239760 1137583646 /nfs/dbraw/zinc/58/36/46/1137583646.db2.gz OUQGMTXYCZQJHC-CQSZACIVSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000873113775 1137590294 /nfs/dbraw/zinc/59/02/94/1137590294.db2.gz KKZPZMZJHAMWBG-MRXNPFEDSA-N 1 0 342.443 3.636 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000124748820 1137608397 /nfs/dbraw/zinc/60/83/97/1137608397.db2.gz RROCBMYABDHJTK-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000125441425 1137634557 /nfs/dbraw/zinc/63/45/57/1137634557.db2.gz PIXRFKBFQPJWCE-RBUKOAKNSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)(C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(Cl)cc1 ZINC000876957916 1137666291 /nfs/dbraw/zinc/66/62/91/1137666291.db2.gz LHKGZLQPZZUFMU-UHFFFAOYSA-N 1 0 348.834 3.716 20 5 EHBDRO CC1(C)CC[C@@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000877021094 1137667788 /nfs/dbraw/zinc/66/77/88/1137667788.db2.gz OTUZFAMOJBOZIL-WTNGLUPJSA-N 1 0 340.427 3.897 20 5 EHBDRO Cc1ncc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])s1 ZINC000877115282 1137670479 /nfs/dbraw/zinc/67/04/79/1137670479.db2.gz KJTHCMNRFXCFHO-UHFFFAOYSA-N 1 0 345.346 3.711 20 5 EHBDRO CN(CCCCCC[NH3+])C(=O)c1cc2ccccc2c2cccnc12 ZINC000877439479 1137676256 /nfs/dbraw/zinc/67/62/56/1137676256.db2.gz LFOCQAUDHLHGRI-UHFFFAOYSA-N 1 0 335.451 3.979 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000877675004 1137685448 /nfs/dbraw/zinc/68/54/48/1137685448.db2.gz UJDMGYXCPKTPOB-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC(C)(O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000877835567 1137692885 /nfs/dbraw/zinc/69/28/85/1137692885.db2.gz UALYJWKLMSSAPP-CQSZACIVSA-N 1 0 346.452 3.916 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878043961 1137700582 /nfs/dbraw/zinc/70/05/82/1137700582.db2.gz GLRAVLKGQKOFCT-UHFFFAOYSA-N 1 0 332.404 3.949 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCOCC3)CO2)cc1[N+](=O)[O-] ZINC000878371850 1137713259 /nfs/dbraw/zinc/71/32/59/1137713259.db2.gz SFKPWSSTBIUMON-RDJZCZTQSA-N 1 0 348.443 3.530 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]2CCCC[C@H]21 ZINC000878398810 1137714261 /nfs/dbraw/zinc/71/42/61/1137714261.db2.gz DMVRHLXQHOMSCM-VNHYZAJKSA-N 1 0 342.399 3.655 20 5 EHBDRO CC1([NH+]2CCCCC2)CCN(Cc2ccc([N+](=O)[O-])c(F)c2)CC1 ZINC000879952136 1137763030 /nfs/dbraw/zinc/76/30/30/1137763030.db2.gz SLKZZZQTWGYHGW-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000880075641 1137767472 /nfs/dbraw/zinc/76/74/72/1137767472.db2.gz DSIIPYNTHOUHII-GFCCVEGCSA-N 1 0 332.404 3.759 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(C(F)(F)F)nc1 ZINC000880102847 1137768335 /nfs/dbraw/zinc/76/83/35/1137768335.db2.gz FVAVUVWCXAMFNZ-VIFPVBQESA-N 1 0 343.280 3.999 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@@H]1CCCOC1 ZINC000880466729 1137779442 /nfs/dbraw/zinc/77/94/42/1137779442.db2.gz QLOUJWZVKYIATD-RHSMWYFYSA-N 1 0 336.432 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)c2c(F)cccc2F)C2CC2)cc1 ZINC000130709376 1137841197 /nfs/dbraw/zinc/84/11/97/1137841197.db2.gz FLZKMFJTCYMOJQ-KRWDZBQOSA-N 1 0 348.349 3.571 20 5 EHBDRO COC[C@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883320094 1137854652 /nfs/dbraw/zinc/85/46/52/1137854652.db2.gz ARHPVMOLUINKSY-DKSSEZFCSA-N 1 0 326.396 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C[C@H]1CCCSC1 ZINC001202618677 1137887494 /nfs/dbraw/zinc/88/74/94/1137887494.db2.gz KYDDRIBJTCJNKP-SNVBAGLBSA-N 1 0 345.262 3.590 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000112990614 1137911126 /nfs/dbraw/zinc/91/11/26/1137911126.db2.gz IHTYXISFERVODF-OAHLLOKOSA-N 1 0 337.419 3.805 20 5 EHBDRO CCOCCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113324349 1137912665 /nfs/dbraw/zinc/91/26/65/1137912665.db2.gz LIUVMVDPIXRRHS-UHFFFAOYSA-N 1 0 335.429 3.625 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000115630547 1137922694 /nfs/dbraw/zinc/92/26/94/1137922694.db2.gz BNDOTOOUHMRKQY-AWEZNQCLSA-N 1 0 342.395 3.929 20 5 EHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000331849606 1137922731 /nfs/dbraw/zinc/92/27/31/1137922731.db2.gz CURAICFXJMVQFA-XGUBFFRZSA-N 1 0 338.477 3.539 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@@]2(CO[C@@H](C)C2)O1)c1cccc([N+](=O)[O-])c1 ZINC000886761906 1138134077 /nfs/dbraw/zinc/13/40/77/1138134077.db2.gz MZYXBBVEIJDQEN-UDTPNQRGSA-N 1 0 348.443 3.752 20 5 EHBDRO CCOC[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093838650 1138241650 /nfs/dbraw/zinc/24/16/50/1138241650.db2.gz LPGNCMNLBWFXSX-CYBMUJFWSA-N 1 0 347.440 3.577 20 5 EHBDRO Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])cc1 ZINC000128798237 1138398213 /nfs/dbraw/zinc/39/82/13/1138398213.db2.gz LTOCEMQZSLJCLU-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC([NH+]2CCCCC2)CC1 ZINC000264795097 1138641600 /nfs/dbraw/zinc/64/16/00/1138641600.db2.gz BMPKPVXHRAEMQK-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[NH+]1CCC2(CCN2C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000889226201 1139180903 /nfs/dbraw/zinc/18/09/03/1139180903.db2.gz XFCKXMZSBMKHAL-UHFFFAOYSA-N 1 0 345.446 3.698 20 5 EHBDRO C[C@@H]([N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1(C)CC1 ZINC000177254080 1139607966 /nfs/dbraw/zinc/60/79/66/1139607966.db2.gz ZEIQNZJWYHELPT-CYBMUJFWSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000179139929 1139738228 /nfs/dbraw/zinc/73/82/28/1139738228.db2.gz QSXLGQPTBGGAEI-JOQOYGCGSA-N 1 0 342.443 3.699 20 5 EHBDRO CCCO[C@@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184212049 1140087452 /nfs/dbraw/zinc/08/74/52/1140087452.db2.gz ISEQKVCMBONILZ-CQSZACIVSA-N 1 0 340.395 3.524 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@H](C)C1 ZINC000187991362 1140279631 /nfs/dbraw/zinc/27/96/31/1140279631.db2.gz LJGJAQVSCLQIHB-STQMWFEESA-N 1 0 330.388 3.828 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000191483096 1140466292 /nfs/dbraw/zinc/46/62/92/1140466292.db2.gz ZHUVLNUQVZBHRJ-OAHLLOKOSA-N 1 0 330.432 3.827 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000192133595 1140505492 /nfs/dbraw/zinc/50/54/92/1140505492.db2.gz RPRSQONPXYFASI-QZTJIDSGSA-N 1 0 348.349 3.535 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192628792 1140540999 /nfs/dbraw/zinc/54/09/99/1140540999.db2.gz DVXOGHSAEZTIPQ-LJQANCHMSA-N 1 0 339.395 3.720 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000193388516 1140574089 /nfs/dbraw/zinc/57/40/89/1140574089.db2.gz MTZMPQZTTSWUSN-UHFFFAOYSA-N 1 0 340.427 3.562 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1ccco1 ZINC000266141089 1140645849 /nfs/dbraw/zinc/64/58/49/1140645849.db2.gz HFQMTTPYLOZJTA-GFCCVEGCSA-N 1 0 341.314 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1C[C@@H](O)c1cccs1 ZINC000267441944 1140791941 /nfs/dbraw/zinc/79/19/41/1140791941.db2.gz IDZVVRPXWQOADD-GDBMZVCRSA-N 1 0 332.425 3.744 20 5 EHBDRO COC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000267460903 1140793853 /nfs/dbraw/zinc/79/38/53/1140793853.db2.gz VCADPKMLQAGOFP-ZDUSSCGKSA-N 1 0 343.383 3.666 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633868 1141129633 /nfs/dbraw/zinc/12/96/33/1141129633.db2.gz GNBCBKDESGSINQ-IAGOWNOFSA-N 1 0 330.384 3.839 20 5 EHBDRO COc1ccc([C@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000269640037 1141130567 /nfs/dbraw/zinc/13/05/67/1141130567.db2.gz BXKFPZSCBVPUQJ-RBUKOAKNSA-N 1 0 344.411 3.624 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000271372710 1141353586 /nfs/dbraw/zinc/35/35/86/1141353586.db2.gz GYWIGXLFIAWLKY-JOQOYGCGSA-N 1 0 336.432 3.848 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@H](O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000271427354 1141363980 /nfs/dbraw/zinc/36/39/80/1141363980.db2.gz BICFHHVWECBMQF-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000271551737 1141395743 /nfs/dbraw/zinc/39/57/43/1141395743.db2.gz VAENYYACNCBKAS-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000271562461 1141398335 /nfs/dbraw/zinc/39/83/35/1141398335.db2.gz WBJNJPDVSNYGHO-ZIAGYGMSSA-N 1 0 330.384 3.760 20 5 EHBDRO Nc1c(F)c(N[C@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000348727367 1141571590 /nfs/dbraw/zinc/57/15/90/1141571590.db2.gz DRDNBQSUJWSTDQ-OAHLLOKOSA-N 1 0 344.390 3.565 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CSc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 ZINC000579711999 1014247539 /nfs/dbraw/zinc/24/75/39/1014247539.db2.gz LNTPFDMAMBXQGY-SWLSCSKDSA-N 1 0 330.409 3.799 20 5 EHBDRO CC(C)([NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000339499343 1014595020 /nfs/dbraw/zinc/59/50/20/1014595020.db2.gz FMPBAWWAZLQRTJ-HNNXBMFYSA-N 1 0 347.440 3.928 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000430211395 1014992020 /nfs/dbraw/zinc/99/20/20/1014992020.db2.gz IXSFNSREXVINNZ-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000579868707 1015576712 /nfs/dbraw/zinc/57/67/12/1015576712.db2.gz HAESZOZHJYCHOQ-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO C[NH2+]Cc1cn(-c2nccc(Cl)c2[N+](=O)[O-])c2ccc(C)cc12 ZINC001167122068 1016171642 /nfs/dbraw/zinc/17/16/42/1016171642.db2.gz ZKIDKVYHTWCOIW-UHFFFAOYSA-N 1 0 330.775 3.615 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@@H]2CCO)s1 ZINC000189977530 1016819448 /nfs/dbraw/zinc/81/94/48/1016819448.db2.gz FBGZJOKKGZLXHE-CJNGLKHVSA-N 1 0 346.452 3.964 20 5 EHBDRO CCOCc1ccccc1C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449068216 1032152303 /nfs/dbraw/zinc/15/23/03/1032152303.db2.gz AOPHNJLOXVBBQI-OAHLLOKOSA-N 1 0 328.412 3.852 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)O1 ZINC000414523196 1016950921 /nfs/dbraw/zinc/95/09/21/1016950921.db2.gz YAYBXJLDQCPTRX-MGPQQGTHSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1c2ccccc2oc1[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)C(C)C ZINC000538159944 1032181601 /nfs/dbraw/zinc/18/16/01/1032181601.db2.gz OCAVZHYDQOGSLR-KRWDZBQOSA-N 1 0 342.399 3.833 20 5 EHBDRO COCc1cc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000449121063 1032215103 /nfs/dbraw/zinc/21/51/03/1032215103.db2.gz FWRZITQATFUUPF-ZDUSSCGKSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(OC(F)F)c1 ZINC000449135610 1032233473 /nfs/dbraw/zinc/23/34/73/1032233473.db2.gz QKHOULNNXLDVDQ-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N[C@@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000538276642 1032264684 /nfs/dbraw/zinc/26/46/84/1032264684.db2.gz LHNNXHWUCZCBSQ-JKSUJKDBSA-N 1 0 349.475 3.885 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1cnn(C)c1)C(C)(C)C ZINC000449176346 1032269799 /nfs/dbraw/zinc/26/97/99/1032269799.db2.gz MPTJEJBNQDSOJR-SUMWQHHRSA-N 1 0 330.432 3.636 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000538390209 1032335067 /nfs/dbraw/zinc/33/50/67/1032335067.db2.gz OLSBDYNCDYJTMM-INIZCTEOSA-N 1 0 333.432 3.532 20 5 EHBDRO COCC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000278750288 1032338378 /nfs/dbraw/zinc/33/83/78/1032338378.db2.gz NXLKRPVWGIRNRB-DLBZAZTESA-N 1 0 330.384 3.933 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)CCCc2cccnc2)c([N+](=O)[O-])cc1F ZINC000459644197 1032366469 /nfs/dbraw/zinc/36/64/69/1032366469.db2.gz WHHMFOMSHZDVOE-CYBMUJFWSA-N 1 0 347.390 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CSCCc3ccccc32)cc1 ZINC000536866851 1032367202 /nfs/dbraw/zinc/36/72/02/1032367202.db2.gz APFSCUNQGSWZDP-GOSISDBHSA-N 1 0 344.436 3.594 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000459691619 1032418595 /nfs/dbraw/zinc/41/85/95/1032418595.db2.gz GKOPOHHWGWPRAH-WMLDXEAASA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CN(C)C)c1ccc(F)cc1 ZINC000449329704 1032442218 /nfs/dbraw/zinc/44/22/18/1032442218.db2.gz IYTCLTOXUYBEGL-KDOFPFPSSA-N 1 0 345.418 3.557 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000449330402 1032441833 /nfs/dbraw/zinc/44/18/33/1032441833.db2.gz KZZMKAXMGAUWBV-GUYCJALGSA-N 1 0 348.830 3.893 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459753414 1032447546 /nfs/dbraw/zinc/44/75/46/1032447546.db2.gz MBAJSWIJUAMVNB-BHMPTGKFSA-N 1 0 344.455 3.871 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+]C2(C3CCC3)CCC2)cccc1[N+](=O)[O-] ZINC000459767932 1032471345 /nfs/dbraw/zinc/47/13/45/1032471345.db2.gz LPRDDSCOOZDTMR-UHFFFAOYSA-N 1 0 331.416 3.544 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC1 ZINC000459803689 1032482046 /nfs/dbraw/zinc/48/20/46/1032482046.db2.gz NXAGBNWPQCQUQR-OAHLLOKOSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000449382945 1032509261 /nfs/dbraw/zinc/50/92/61/1032509261.db2.gz ZDXYJVSOKZAZSY-SNVBAGLBSA-N 1 0 340.729 3.695 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449484316 1032634789 /nfs/dbraw/zinc/63/47/89/1032634789.db2.gz GGYQYEDPHOJTEF-GOSISDBHSA-N 1 0 342.443 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000574062115 1032710564 /nfs/dbraw/zinc/71/05/64/1032710564.db2.gz IAISOWFPBSIYNV-QGZVFWFLSA-N 1 0 328.416 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CC[C@@H](c3cccnc3)C2)c1 ZINC000574204682 1032737342 /nfs/dbraw/zinc/73/73/42/1032737342.db2.gz GCLNTBKBAHQHSJ-CYBMUJFWSA-N 1 0 349.337 3.581 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000415490356 1018093604 /nfs/dbraw/zinc/09/36/04/1018093604.db2.gz YCPCKGBUJKZJKR-ZDUSSCGKSA-N 1 0 342.399 3.553 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NC[C@@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000415689168 1018398250 /nfs/dbraw/zinc/39/82/50/1018398250.db2.gz CQTOIBLONXCGCX-OLZOCXBDSA-N 1 0 348.447 3.531 20 5 EHBDRO C[C@H](c1ccc(F)cc1F)N1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866483 1018544189 /nfs/dbraw/zinc/54/41/89/1018544189.db2.gz AJWDMJSBDYDBJB-YPMHNXCESA-N 1 0 348.353 3.515 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000468632520 1018566739 /nfs/dbraw/zinc/56/67/39/1018566739.db2.gz SVMBTVOEVRUOJP-YVGNARHYSA-N 1 0 326.396 3.925 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1OC(F)F ZINC000580095560 1018637152 /nfs/dbraw/zinc/63/71/52/1018637152.db2.gz YMDLIHBTHQIUPQ-CQSZACIVSA-N 1 0 334.322 3.973 20 5 EHBDRO CC(C)C[C@H](CO)[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000580129034 1018685715 /nfs/dbraw/zinc/68/57/15/1018685715.db2.gz INKSPUQPYNGCRV-MRXNPFEDSA-N 1 0 332.400 3.694 20 5 EHBDRO CC[C@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000610420481 1019021728 /nfs/dbraw/zinc/02/17/28/1019021728.db2.gz VCLSYLOLPCMMRS-HIFRSBDPSA-N 1 0 343.431 3.715 20 5 EHBDRO CC[C@@H](N[C@H](C)c1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000610420482 1019023538 /nfs/dbraw/zinc/02/35/38/1019023538.db2.gz VCLSYLOLPCMMRS-UKRRQHHQSA-N 1 0 343.431 3.715 20 5 EHBDRO Cc1cc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000610430987 1019084568 /nfs/dbraw/zinc/08/45/68/1019084568.db2.gz VDDVJXJIOBELDD-KRWDZBQOSA-N 1 0 340.427 3.937 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000236950872 1019085500 /nfs/dbraw/zinc/08/55/00/1019085500.db2.gz XDQGLIRFMYYEOV-HNNXBMFYSA-N 1 0 328.368 3.607 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433519 1019126369 /nfs/dbraw/zinc/12/63/69/1019126369.db2.gz PJCFFHQZCSWPFS-UZLBHIALSA-N 1 0 339.439 3.862 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN(C3CC3)C3CC[NH2+]CC3)o2)c1 ZINC000592424343 1032812567 /nfs/dbraw/zinc/81/25/67/1032812567.db2.gz IUISZSDRZLNGHG-UHFFFAOYSA-N 1 0 341.411 3.571 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000092687372 1032813562 /nfs/dbraw/zinc/81/35/62/1032813562.db2.gz JTVYJOZBYRUZQC-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO COc1ccc(OCC[N@H+]([C@@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119133418 1019451712 /nfs/dbraw/zinc/45/17/12/1019451712.db2.gz QPZHTXTVZZUHAD-ZDUSSCGKSA-N 1 0 346.383 3.801 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC3(CO)CC3)s2)cc1 ZINC000449577242 1032836647 /nfs/dbraw/zinc/83/66/47/1032836647.db2.gz DDQXDPVAXUHZDB-UHFFFAOYSA-N 1 0 332.425 3.576 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000513455770 1019691521 /nfs/dbraw/zinc/69/15/21/1019691521.db2.gz NOKGISOKMQSRGP-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000182584997 1019713990 /nfs/dbraw/zinc/71/39/90/1019713990.db2.gz OWXKCQDNMMPWJA-HNNXBMFYSA-N 1 0 347.802 3.588 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccccc1Cl ZINC000345146477 1020011055 /nfs/dbraw/zinc/01/10/55/1020011055.db2.gz PZTCHFBGWNERAR-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000157805687 1032869804 /nfs/dbraw/zinc/86/98/04/1032869804.db2.gz JPQYBCYHDZQECN-MRXNPFEDSA-N 1 0 326.396 3.901 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCC[C@H]1O ZINC000581158833 1020493445 /nfs/dbraw/zinc/49/34/45/1020493445.db2.gz ILFTVQNOHPQZMC-HZPDHXFCSA-N 1 0 332.425 3.669 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3C)C2)c1 ZINC000449619939 1032906756 /nfs/dbraw/zinc/90/67/56/1032906756.db2.gz RLYXDXXLRJSBCZ-QAQDUYKDSA-N 1 0 326.396 3.948 20 5 EHBDRO CC1(C)CCC([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602552005 1032967997 /nfs/dbraw/zinc/96/79/97/1032967997.db2.gz RBTHTXNPKOOBTO-UHFFFAOYSA-N 1 0 332.448 3.517 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)[nH]c1C(C)C ZINC000894867910 1021531570 /nfs/dbraw/zinc/53/15/70/1021531570.db2.gz FGUHRNBPMBCSKG-LBPRGKRZSA-N 1 0 345.399 3.684 20 5 EHBDRO CC[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602550976 1032986905 /nfs/dbraw/zinc/98/69/05/1032986905.db2.gz GMZAWBPYODDWMK-GDBMZVCRSA-N 1 0 332.448 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3C[C@@H]3C3CCCCC3)CC2)cn1 ZINC000602590536 1032988264 /nfs/dbraw/zinc/98/82/64/1032988264.db2.gz VXEJFQUPNHIYIA-QZTJIDSGSA-N 1 0 344.459 3.517 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000157905549 1021590073 /nfs/dbraw/zinc/59/00/73/1021590073.db2.gz PXAGZTZSMKBNNC-MRXNPFEDSA-N 1 0 345.468 3.822 20 5 EHBDRO Cc1nc2ccccn2c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000507168490 1021661806 /nfs/dbraw/zinc/66/18/06/1021661806.db2.gz DCCGEUCHLUTAJD-UHFFFAOYSA-N 1 0 338.411 3.962 20 5 EHBDRO CC[NH+](CC)[C@H](C)CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000519760130 1021675289 /nfs/dbraw/zinc/67/52/89/1021675289.db2.gz PPQBIYYUCBTLQS-BXUZGUMPSA-N 1 0 333.354 3.518 20 5 EHBDRO COCCOc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909989 1021694274 /nfs/dbraw/zinc/69/42/74/1021694274.db2.gz IEYAESSKZUICAS-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCCO2 ZINC000090910174 1021694428 /nfs/dbraw/zinc/69/44/28/1021694428.db2.gz JEQQTEVPYVALCO-GOSISDBHSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnc2)cc1 ZINC000090909963 1021694466 /nfs/dbraw/zinc/69/44/66/1021694466.db2.gz RYXYIEJAGYJFHC-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)c1 ZINC000090910182 1021694541 /nfs/dbraw/zinc/69/45/41/1021694541.db2.gz WKUQHDNZVNBUFY-XLIONFOSSA-N 1 0 340.423 3.895 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1ncnc2sc([N+](=O)[O-])cc21 ZINC000287053574 1021754314 /nfs/dbraw/zinc/75/43/14/1021754314.db2.gz RZVUARHNHUVSKG-LLVKDONJSA-N 1 0 337.449 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3C[C@H](c4cccc(F)c4)C3)nc2c1 ZINC000602646691 1033038781 /nfs/dbraw/zinc/03/87/81/1033038781.db2.gz STPMZEQVLTYOEG-MQMHXKEQSA-N 1 0 341.342 3.911 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CC1(c2ccccn2)CCC1 ZINC000894426062 1022270212 /nfs/dbraw/zinc/27/02/12/1022270212.db2.gz BFVZJXMBVQVDHH-UHFFFAOYSA-N 1 0 331.803 3.855 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C(C3CCC3)C3CCC3)CC2)cn1 ZINC000602654448 1033054509 /nfs/dbraw/zinc/05/45/09/1033054509.db2.gz MHFNMJSDWHRATJ-UHFFFAOYSA-N 1 0 344.459 3.517 20 5 EHBDRO CCC(O)(CC)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000471827847 1022453806 /nfs/dbraw/zinc/45/38/06/1022453806.db2.gz SCCJTWNNPKACSU-UHFFFAOYSA-N 1 0 332.400 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC3CCCCCC3)CC2)cn1 ZINC000602674141 1033052156 /nfs/dbraw/zinc/05/21/56/1033052156.db2.gz FKCZOLZTRSEINW-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO COCCC1(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC000548359833 1022488118 /nfs/dbraw/zinc/48/81/18/1022488118.db2.gz GUFQXQUMXUWHTL-UHFFFAOYSA-N 1 0 336.432 3.550 20 5 EHBDRO CC(=O)c1ccc(NCCCCC[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000517661660 1022543409 /nfs/dbraw/zinc/54/34/09/1022543409.db2.gz CLGJJBZJDYLVJO-UHFFFAOYSA-N 1 0 333.432 3.866 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC/C=C\c1ccccc1[N+](=O)[O-] ZINC000438347241 1022585748 /nfs/dbraw/zinc/58/57/48/1022585748.db2.gz FTTFIWJOJVWKBU-YFHOEESVSA-N 1 0 325.412 3.824 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000430819336 1022725043 /nfs/dbraw/zinc/72/50/43/1022725043.db2.gz BJFMVZSJXAONIX-MAUKXSAKSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]C2CC3(CCC3)C2)cc1Br ZINC000602704807 1033092106 /nfs/dbraw/zinc/09/21/06/1033092106.db2.gz JTLPFIJEAPRTQN-UHFFFAOYSA-N 1 0 331.235 3.841 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000509578312 1023076088 /nfs/dbraw/zinc/07/60/88/1023076088.db2.gz HFKSEQCLGDTGAR-LDLUMPKVSA-N 1 0 348.349 3.916 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000449721384 1033108232 /nfs/dbraw/zinc/10/82/32/1033108232.db2.gz JUFAXTCOCDCSNS-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(OCC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000276836627 1023152751 /nfs/dbraw/zinc/15/27/51/1023152751.db2.gz BSDONSJGNPIMKP-UHFFFAOYSA-N 1 0 336.432 3.631 20 5 EHBDRO CCC1(C)CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000507164822 1023157730 /nfs/dbraw/zinc/15/77/30/1023157730.db2.gz LUWXBNFSKMZDAV-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000507233862 1023207773 /nfs/dbraw/zinc/20/77/73/1023207773.db2.gz PPZXYOSDYYOSFS-KUHUBIRLSA-N 1 0 326.396 3.902 20 5 EHBDRO Cc1cc(Cc2noc([C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957895 1023475624 /nfs/dbraw/zinc/47/56/24/1023475624.db2.gz RLZMSMCAIJCYDB-IHRRRGAJSA-N 1 0 344.415 3.811 20 5 EHBDRO CC[C@H](C)[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341879444 1023513514 /nfs/dbraw/zinc/51/35/14/1023513514.db2.gz UVISNGHERZHEDH-XHDPSFHLSA-N 1 0 336.823 3.859 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCN(CC(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000610806981 1023694969 /nfs/dbraw/zinc/69/49/69/1023694969.db2.gz MGSFSQCYULCMHW-MRXNPFEDSA-N 1 0 341.402 3.755 20 5 EHBDRO CO[C@@H](C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC001167499040 1024214537 /nfs/dbraw/zinc/21/45/37/1024214537.db2.gz AZDZRKJWOWACGW-IBGZPJMESA-N 1 0 348.443 3.643 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H]2CC[C@@H](O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000474105948 1024226415 /nfs/dbraw/zinc/22/64/15/1024226415.db2.gz MFKNMYFWSRVABI-URKNILKWSA-N 1 0 344.411 3.590 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCOCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000538277013 1024279720 /nfs/dbraw/zinc/27/97/20/1024279720.db2.gz WUJGRVSMYGWRGH-INIZCTEOSA-N 1 0 344.411 3.649 20 5 EHBDRO CCc1ccc([C@@H](NCC[N@H+](C)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544357427 1024339037 /nfs/dbraw/zinc/33/90/37/1024339037.db2.gz MLMZGAVJHKGAJE-IBGZPJMESA-N 1 0 345.443 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](c4cccnc4)C3)nc2c1 ZINC000602857403 1033212398 /nfs/dbraw/zinc/21/23/98/1033212398.db2.gz VZHRRYOYPXWILR-AWEZNQCLSA-N 1 0 338.367 3.511 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCCC[NH+]1CCCCC1 ZINC000514517283 1024531401 /nfs/dbraw/zinc/53/14/01/1024531401.db2.gz HCYNBYWNMPDZEU-UHFFFAOYSA-N 1 0 331.338 3.902 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372450 1024857368 /nfs/dbraw/zinc/85/73/68/1024857368.db2.gz RHEHSJHGXYMHCN-VXGBXAGGSA-N 1 0 349.818 3.677 20 5 EHBDRO C[NH2+]C[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000435371619 1024857759 /nfs/dbraw/zinc/85/77/59/1024857759.db2.gz OABUPUAUYZRSOP-CQSZACIVSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC000897973554 1033248672 /nfs/dbraw/zinc/24/86/72/1033248672.db2.gz VLQNURQCZFLQEH-ICXUMSERSA-N 1 0 332.444 3.853 20 5 EHBDRO COc1ccc(C[NH+]2CCC(c3ccc(F)cn3)CC2)cc1[N+](=O)[O-] ZINC000602904811 1033254760 /nfs/dbraw/zinc/25/47/60/1033254760.db2.gz OKNZOIQHVJLMJW-UHFFFAOYSA-N 1 0 345.374 3.517 20 5 EHBDRO O=C(NC[C@H]1CCC[N@@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000435771462 1025130793 /nfs/dbraw/zinc/13/07/93/1025130793.db2.gz VOHYUQIXEQIWJC-QGZVFWFLSA-N 1 0 346.431 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCCN(c2ccc(F)c(F)c2)CC1 ZINC000551449755 1025322358 /nfs/dbraw/zinc/32/23/58/1025322358.db2.gz PEDLZNCOZGCGQP-UHFFFAOYSA-N 1 0 347.365 3.585 20 5 EHBDRO C[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000521402551 1025371442 /nfs/dbraw/zinc/37/14/42/1025371442.db2.gz POBDRATUUDVHJT-ZDUSSCGKSA-N 1 0 329.375 3.593 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493849 1025496769 /nfs/dbraw/zinc/49/67/69/1025496769.db2.gz WOBMZGKROULLQA-JMPLCFMRSA-N 1 0 340.427 3.611 20 5 EHBDRO Cc1cccc(C)c1NC(=O)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451108562 1025545276 /nfs/dbraw/zinc/54/52/76/1025545276.db2.gz WVVGGYJSGINCDM-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451109709 1025545634 /nfs/dbraw/zinc/54/56/34/1025545634.db2.gz YMDYTUXHBZQDGG-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccc2c(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3F)cn(C)c2c1 ZINC000436412501 1025689789 /nfs/dbraw/zinc/68/97/89/1025689789.db2.gz GMGQKZLXZHVSJJ-UHFFFAOYSA-N 1 0 341.386 3.866 20 5 EHBDRO CC(C)c1ccc(CNC[C@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000521821380 1025708112 /nfs/dbraw/zinc/70/81/12/1025708112.db2.gz OBKSBDAQOMJQEO-LJQANCHMSA-N 1 0 333.476 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](COc3ccccc3)C2)cc1 ZINC000505818686 1025718681 /nfs/dbraw/zinc/71/86/81/1025718681.db2.gz KDSWHZGGDOHJEX-QGZVFWFLSA-N 1 0 326.396 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC4(C3)CCCCC4)n2)cc1 ZINC000130021883 1025779668 /nfs/dbraw/zinc/77/96/68/1025779668.db2.gz JYTDTJRZLKBINA-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO CCC[N@H+](CC)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000516074595 1025955165 /nfs/dbraw/zinc/95/51/65/1025955165.db2.gz UADBDYRUEWRGAA-CQSZACIVSA-N 1 0 333.354 3.520 20 5 EHBDRO CC[C@@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475127549 1026221433 /nfs/dbraw/zinc/22/14/33/1026221433.db2.gz IXGDLWOALZFNEE-SFHVURJKSA-N 1 0 330.384 3.592 20 5 EHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@@H](COC)Cc1ccccc1 ZINC000531105061 1026572369 /nfs/dbraw/zinc/57/23/69/1026572369.db2.gz KUZVLGIOOKZOHT-MRXNPFEDSA-N 1 0 334.441 3.736 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1CC(OCc2ccccc2)C1 ZINC000546657110 1026615380 /nfs/dbraw/zinc/61/53/80/1026615380.db2.gz HYZZOOOMXGUENG-POHAHGRESA-N 1 0 338.407 3.945 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](OCCCc3ccccc3)C2)cc1 ZINC000531211145 1026690012 /nfs/dbraw/zinc/69/00/12/1026690012.db2.gz ZADSHXPRMDNMBS-FQEVSTJZSA-N 1 0 340.423 3.819 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2cnn(CC3CCC3)c2)cc1[N+](=O)[O-] ZINC000934562822 1026816810 /nfs/dbraw/zinc/81/68/10/1026816810.db2.gz PLYYLPLCPCHDPL-CQSZACIVSA-N 1 0 328.416 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCCCCC3)cc2)cn1 ZINC000582690032 1026936270 /nfs/dbraw/zinc/93/62/70/1026936270.db2.gz PKMTZGAGSDGSBC-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO C[C@@H](NC(=O)OC(C)(C)C)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310435249 1027004763 /nfs/dbraw/zinc/00/47/63/1027004763.db2.gz OFOAGBQALWHMSP-XQQFMLRXSA-N 1 0 337.420 3.547 20 5 EHBDRO C[C@H]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1ccc([N+](=O)[O-])cc1 ZINC000582707209 1027006334 /nfs/dbraw/zinc/00/63/34/1027006334.db2.gz OXWXLIYLMKZHOL-JTQLQIEISA-N 1 0 334.759 3.828 20 5 EHBDRO CC(C)[NH+](CCCNc1ncnc2sc([N+](=O)[O-])cc21)C(C)C ZINC000342787825 1027051650 /nfs/dbraw/zinc/05/16/50/1027051650.db2.gz MSLIVHUUYLNVNZ-UHFFFAOYSA-N 1 0 337.449 3.520 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676537 1027192612 /nfs/dbraw/zinc/19/26/12/1027192612.db2.gz AHCIWVCVONQCCL-HRCADAONSA-N 1 0 347.459 3.673 20 5 EHBDRO CC[NH+]1CCC(CCNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413183865 1027230896 /nfs/dbraw/zinc/23/08/96/1027230896.db2.gz ZYXCHAMZROCQNF-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000531724500 1027270949 /nfs/dbraw/zinc/27/09/49/1027270949.db2.gz FIUAGSLUNASCLI-WBTNSWJXSA-N 1 0 345.443 3.870 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000543907456 1027307437 /nfs/dbraw/zinc/30/74/37/1027307437.db2.gz PVBSDAWFUDAVAI-LESCRADOSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127705035 1027347762 /nfs/dbraw/zinc/34/77/62/1027347762.db2.gz XSIABJYVBMFKRT-CZUORRHYSA-N 1 0 330.384 3.590 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000453169083 1027487494 /nfs/dbraw/zinc/48/74/94/1027487494.db2.gz FPECSZXZKROHQL-CYBMUJFWSA-N 1 0 340.379 3.533 20 5 EHBDRO C[C@@H](C[NH+]1CCCCC1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000097489799 1027563997 /nfs/dbraw/zinc/56/39/97/1027563997.db2.gz VVLJVIBZPVFWFL-INIZCTEOSA-N 1 0 347.462 3.992 20 5 EHBDRO C[C@@H]1CCCC[C@H]1OCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597567 1027599908 /nfs/dbraw/zinc/59/99/08/1027599908.db2.gz TWHRJGOLANLOIW-MLGOLLRUSA-N 1 0 326.824 3.933 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)N(C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000178681947 1027870782 /nfs/dbraw/zinc/87/07/82/1027870782.db2.gz DMZTVNLMJGKQPM-HUUCEWRRSA-N 1 0 335.448 3.588 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000503576728 1027920831 /nfs/dbraw/zinc/92/08/31/1027920831.db2.gz HCAJYPKXDJXXOD-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccc(NC(=O)C(C)(C)[C@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000422901806 1028036285 /nfs/dbraw/zinc/03/62/85/1028036285.db2.gz CKDGTFRMVBYGFC-MRXNPFEDSA-N 1 0 327.384 3.568 20 5 EHBDRO Cc1cnc(NC[C@H](c2cccs2)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000078625694 1028045064 /nfs/dbraw/zinc/04/50/64/1028045064.db2.gz NJUUNXDRHCJUGS-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648908 1028111480 /nfs/dbraw/zinc/11/14/80/1028111480.db2.gz OUZKRECSXAJAKA-CJNGLKHVSA-N 1 0 336.395 3.849 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Oc2c(C)cccc2[N+](=O)[O-])o1 ZINC000760018467 1028268120 /nfs/dbraw/zinc/26/81/20/1028268120.db2.gz QQCWGVFNVQYFKJ-UHFFFAOYSA-N 1 0 332.356 3.557 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](N)c1ccccc1 ZINC000423231341 1028296074 /nfs/dbraw/zinc/29/60/74/1028296074.db2.gz ATJJXOJRWLWFCJ-HZPDHXFCSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@@H]1C[C@H](CO)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358471 1028309136 /nfs/dbraw/zinc/30/91/36/1028309136.db2.gz BZTHAJCRWQMSRS-KGLIPLIRSA-N 1 0 346.452 3.774 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC([NH3+])(CC)CC ZINC000423287905 1028326032 /nfs/dbraw/zinc/32/60/32/1028326032.db2.gz PEVHAWXOHCJRNT-ZDUSSCGKSA-N 1 0 325.478 3.573 20 5 EHBDRO CCc1ccccc1[C@@H](N)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498600 1028464537 /nfs/dbraw/zinc/46/45/37/1028464537.db2.gz IHTHBDVDRFCBNK-KDOFPFPSSA-N 1 0 327.428 3.816 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615675 1028483968 /nfs/dbraw/zinc/48/39/68/1028483968.db2.gz ZTVQYZUBZNPVGL-RBSFLKMASA-N 1 0 335.423 3.571 20 5 EHBDRO C[C@H](O)C[C@H](C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000077425812 1028483918 /nfs/dbraw/zinc/48/39/18/1028483918.db2.gz RYYMVUVQCGRQEI-STQMWFEESA-N 1 0 334.441 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](n3ncc4ccccc43)C2)cc1F ZINC000366969948 1028489602 /nfs/dbraw/zinc/48/96/02/1028489602.db2.gz OSFQMSUUZDBSBH-OAHLLOKOSA-N 1 0 340.358 3.531 20 5 EHBDRO [NH3+]C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CCCC1 ZINC000423957960 1028714334 /nfs/dbraw/zinc/71/43/34/1028714334.db2.gz LXNHVGFYIYHRCC-IBGZPJMESA-N 1 0 333.435 3.635 20 5 EHBDRO C[C@H](NC(=O)CC[C@H]([NH3+])CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000424103369 1028785960 /nfs/dbraw/zinc/78/59/60/1028785960.db2.gz SHRLHILEYVPKSH-YOEHRIQHSA-N 1 0 347.459 3.850 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)cc1F ZINC000421900054 1028916138 /nfs/dbraw/zinc/91/61/38/1028916138.db2.gz NKGMBDDMHKRLAP-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO CCOc1ccc([C@H](C)NCC2([NH+](C)C)CCCC2)cc1[N+](=O)[O-] ZINC000504899086 1029027852 /nfs/dbraw/zinc/02/78/52/1029027852.db2.gz AKCLYCXKCNELGQ-AWEZNQCLSA-N 1 0 335.448 3.519 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000504899564 1029041664 /nfs/dbraw/zinc/04/16/64/1029041664.db2.gz IUIDJWKEFYQLIH-BBRMVZONSA-N 1 0 342.395 3.648 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000504905780 1029049815 /nfs/dbraw/zinc/04/98/15/1029049815.db2.gz NQTWNWUKXBPGFC-OAHLLOKOSA-N 1 0 337.464 3.763 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCS1 ZINC000504912507 1029056022 /nfs/dbraw/zinc/05/60/22/1029056022.db2.gz WYPPPKRQWILUMS-STQMWFEESA-N 1 0 326.487 3.951 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@@H]3C2(C)C)cc1[N+](=O)[O-] ZINC000504927512 1029074422 /nfs/dbraw/zinc/07/44/22/1029074422.db2.gz PYEHTHXKGRACLH-KYABYICQSA-N 1 0 348.443 3.848 20 5 EHBDRO C[C@H]([NH3+])c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000414803468 1029195388 /nfs/dbraw/zinc/19/53/88/1029195388.db2.gz JJYQALDWLQUJIO-JTQLQIEISA-N 1 0 337.326 3.828 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000124410085 1029218372 /nfs/dbraw/zinc/21/83/72/1029218372.db2.gz NDCOBTXKBWNKAC-VFVRVIDISA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446080043 1029392783 /nfs/dbraw/zinc/39/27/83/1029392783.db2.gz QXDZAGBTSXXJCU-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513825674 1029524274 /nfs/dbraw/zinc/52/42/74/1029524274.db2.gz HPNKTRREZDITDW-AYBZRNKSSA-N 1 0 339.439 3.922 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428442187 1029624099 /nfs/dbraw/zinc/62/40/99/1029624099.db2.gz SVQRGYCXVJVQES-YRVHBARZSA-N 1 0 340.423 3.957 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000192501293 1029714785 /nfs/dbraw/zinc/71/47/85/1029714785.db2.gz XUHDVFXPOZBDCB-LJQANCHMSA-N 1 0 339.395 3.583 20 5 EHBDRO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271803 1029768287 /nfs/dbraw/zinc/76/82/87/1029768287.db2.gz RUVNFWYNTYLZFP-LJQANCHMSA-N 1 0 325.412 3.998 20 5 EHBDRO C[C@@H](CCc1cccc(F)c1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446845087 1029824152 /nfs/dbraw/zinc/82/41/52/1029824152.db2.gz XSZUFRJKQYKGAP-LBPRGKRZSA-N 1 0 342.374 3.721 20 5 EHBDRO Cc1ccc2cc(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)ccc2n1 ZINC000446844173 1029824330 /nfs/dbraw/zinc/82/43/30/1029824330.db2.gz FGYGRLKCCRXMJV-UHFFFAOYSA-N 1 0 347.378 3.618 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCC1CCOCC1)C1CC1 ZINC000453237201 1029961323 /nfs/dbraw/zinc/96/13/23/1029961323.db2.gz PBPYURXGVMYOEA-SFHVURJKSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Br)c([N+](=O)[O-])c1)c1cccnc1 ZINC000035012996 1029963935 /nfs/dbraw/zinc/96/39/35/1029963935.db2.gz IAMMIMHIDKUOLM-SNVBAGLBSA-N 1 0 336.189 3.603 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000453288107 1030030778 /nfs/dbraw/zinc/03/07/78/1030030778.db2.gz JVLMHPCXGWAEIC-RDJZCZTQSA-N 1 0 328.412 3.812 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000531948105 1030119365 /nfs/dbraw/zinc/11/93/65/1030119365.db2.gz AJGCZOVUFRRYHC-HNAYVOBHSA-N 1 0 327.428 3.857 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453340608 1030124968 /nfs/dbraw/zinc/12/49/68/1030124968.db2.gz HTONLBSJZHMMRX-NZSAHSFTSA-N 1 0 341.411 3.951 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)n1 ZINC000481977713 1030143685 /nfs/dbraw/zinc/14/36/85/1030143685.db2.gz PGOWAPYKFRUVBK-MRXNPFEDSA-N 1 0 346.475 3.779 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000453382651 1030161290 /nfs/dbraw/zinc/16/12/90/1030161290.db2.gz SVOXZYSTKDXSCS-ZSZQSSIHSA-N 1 0 341.411 3.869 20 5 EHBDRO C[NH+](C)C[C@@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574590 1030169811 /nfs/dbraw/zinc/16/98/11/1030169811.db2.gz DPBUGARPYHYUIA-QZTJIDSGSA-N 1 0 343.402 3.614 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCC[C@H]1n1cccn1 ZINC000531980803 1030197856 /nfs/dbraw/zinc/19/78/56/1030197856.db2.gz PTMUYALCELTAAG-JCGIZDLHSA-N 1 0 328.416 3.934 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000441268172 1030212413 /nfs/dbraw/zinc/21/24/13/1030212413.db2.gz YADADBSJLUBKHC-CYBMUJFWSA-N 1 0 348.374 3.814 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163240033 1030218861 /nfs/dbraw/zinc/21/88/61/1030218861.db2.gz GKSFSNBNEKGUKY-SWLSCSKDSA-N 1 0 330.388 3.703 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447510738 1030257119 /nfs/dbraw/zinc/25/71/19/1030257119.db2.gz ZWRTZLUNNKEYEY-IBGZPJMESA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000052468070 1030281208 /nfs/dbraw/zinc/28/12/08/1030281208.db2.gz GJPWHWJVWHFGMJ-UHFFFAOYSA-N 1 0 342.395 3.559 20 5 EHBDRO CC(C)C[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000042380910 1030382783 /nfs/dbraw/zinc/38/27/83/1030382783.db2.gz SWDDRERKMXIQKX-UHFFFAOYSA-N 1 0 347.462 3.802 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000482445320 1030425306 /nfs/dbraw/zinc/42/53/06/1030425306.db2.gz JASZHMCRXFRUCJ-LJQANCHMSA-N 1 0 339.439 3.772 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192601711 1030426240 /nfs/dbraw/zinc/42/62/40/1030426240.db2.gz ANUCPAJYLYVJGA-DLBZAZTESA-N 1 0 345.468 3.926 20 5 EHBDRO C[C@@H](CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729481 1030441407 /nfs/dbraw/zinc/44/14/07/1030441407.db2.gz NWROGQFDYQHODM-DOTOQJQBSA-N 1 0 340.427 3.670 20 5 EHBDRO COc1ccc2oc(C[NH2+]CCc3ccccc3[N+](=O)[O-])cc2c1 ZINC000482602421 1030575257 /nfs/dbraw/zinc/57/52/57/1030575257.db2.gz ITWLAEHSKBNSBJ-UHFFFAOYSA-N 1 0 326.352 3.682 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409855 1030740323 /nfs/dbraw/zinc/74/03/23/1030740323.db2.gz SVSCQPVYFFNTKP-HKUYNNGSSA-N 1 0 341.411 3.733 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409856 1030740531 /nfs/dbraw/zinc/74/05/31/1030740531.db2.gz SVSCQPVYFFNTKP-IEBWSBKVSA-N 1 0 341.411 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000237998261 1030807281 /nfs/dbraw/zinc/80/72/81/1030807281.db2.gz RAYICCUTZMGKKD-IBGZPJMESA-N 1 0 340.379 3.607 20 5 EHBDRO C[C@H](O)[C@@](C)(C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000249247045 1030887997 /nfs/dbraw/zinc/88/79/97/1030887997.db2.gz BCXDKHVPXRUYSK-TWOQFEAHSA-N 1 0 342.439 3.875 20 5 EHBDRO CCc1cnc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130425120 1031169805 /nfs/dbraw/zinc/16/98/05/1031169805.db2.gz RBRGPCFVHIFYJZ-HNNXBMFYSA-N 1 0 331.441 3.725 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[C@@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000904092980 1031743430 /nfs/dbraw/zinc/74/34/30/1031743430.db2.gz FVGYLUZJHAMCKA-RCBQFDQVSA-N 1 0 342.399 3.937 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000475744575 1031834957 /nfs/dbraw/zinc/83/49/57/1031834957.db2.gz RBVXSTGVJDEZRJ-BPLDGKMQSA-N 1 0 333.432 3.598 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@@H]1CCCCO1 ZINC000783642329 1031881498 /nfs/dbraw/zinc/88/14/98/1031881498.db2.gz SHMANFCSQLOORD-HNNXBMFYSA-N 1 0 326.824 3.933 20 5 EHBDRO CC(C)OC1CCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000536647692 1032056262 /nfs/dbraw/zinc/05/62/62/1032056262.db2.gz IYYROASEUJVKNU-UHFFFAOYSA-N 1 0 344.358 3.586 20 5 EHBDRO COc1ccc2c(c1)OCC[C@H]2[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594496547 1033398906 /nfs/dbraw/zinc/39/89/06/1033398906.db2.gz NEUCNGRPPBDALG-DLBZAZTESA-N 1 0 340.379 3.704 20 5 EHBDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594496549 1033400255 /nfs/dbraw/zinc/40/02/55/1033400255.db2.gz NEUCNGRPPBDALG-IRXDYDNUSA-N 1 0 340.379 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)cc1OC(F)F ZINC000594597682 1033444551 /nfs/dbraw/zinc/44/45/51/1033444551.db2.gz DXMKCTXRFCIURB-CHWSQXEVSA-N 1 0 341.358 3.625 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)ccc2ncccc21 ZINC000594598790 1033445651 /nfs/dbraw/zinc/44/56/51/1033445651.db2.gz HYBMALIREUWTBL-NVXWUHKLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc2ncccc21 ZINC000594598793 1033447044 /nfs/dbraw/zinc/44/70/44/1033447044.db2.gz HYBMALIREUWTBL-RDJZCZTQSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1ccc(C[NH2+]Cc2csc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000598963721 1033599310 /nfs/dbraw/zinc/59/93/10/1033599310.db2.gz OVTCODRDPIBSCW-UHFFFAOYSA-N 1 0 346.330 3.974 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC000595014985 1033608909 /nfs/dbraw/zinc/60/89/09/1033608909.db2.gz XFVJYXOFUGNZFS-KBPBESRZSA-N 1 0 344.411 3.981 20 5 EHBDRO COc1cccc([C@@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])OC)c1 ZINC000598986458 1033612406 /nfs/dbraw/zinc/61/24/06/1033612406.db2.gz AGIPPNRHAXPGSX-MBNRZODZSA-N 1 0 342.395 3.594 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1(F)F ZINC000594988100 1033622473 /nfs/dbraw/zinc/62/24/73/1033622473.db2.gz YVZFLTTZVMEFIB-AWEZNQCLSA-N 1 0 339.367 3.853 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC1CC1 ZINC000598975203 1033624119 /nfs/dbraw/zinc/62/41/19/1033624119.db2.gz TWJBIRPZBBHJNP-CYBMUJFWSA-N 1 0 342.395 3.995 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)ccc1C ZINC000595008056 1033630227 /nfs/dbraw/zinc/63/02/27/1033630227.db2.gz OZKHZXRSPUFJTK-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cccc(OC)c1 ZINC000595066511 1033644738 /nfs/dbraw/zinc/64/47/38/1033644738.db2.gz ICASTSIRBLXQOK-MSOLQXFVSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000595029139 1033650459 /nfs/dbraw/zinc/65/04/59/1033650459.db2.gz HSTKJNZWZGSJOZ-HZCDGDGTSA-N 1 0 346.427 3.602 20 5 EHBDRO COC(=O)CC1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000599030571 1033659659 /nfs/dbraw/zinc/65/96/59/1033659659.db2.gz JKTFIUKFIVESQC-HLIUYOAVSA-N 1 0 334.416 3.676 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCO[C@H](C(C)C)C1 ZINC000595040269 1033660641 /nfs/dbraw/zinc/66/06/41/1033660641.db2.gz FUZXKXGKHPWZDU-VBQJREDUSA-N 1 0 336.432 3.705 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000599044669 1033671973 /nfs/dbraw/zinc/67/19/73/1033671973.db2.gz RYDJUNZYWTUKPW-QMTHXVAHSA-N 1 0 332.322 3.661 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H]1CC(=O)N(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595105927 1033690994 /nfs/dbraw/zinc/69/09/94/1033690994.db2.gz URJXTFQERVEXMG-RHSMWYFYSA-N 1 0 347.459 3.673 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc3occc3c2)n1 ZINC000595075811 1033696291 /nfs/dbraw/zinc/69/62/91/1033696291.db2.gz YZXFZNLAQKAOTO-HZPDHXFCSA-N 1 0 340.383 3.811 20 5 EHBDRO C/C(=C\C(=O)Nc1ccc(-n2ccnc2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000783862028 1033697379 /nfs/dbraw/zinc/69/73/79/1033697379.db2.gz CPXRJPQXRJDMJZ-WYMLVPIESA-N 1 0 348.362 3.823 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000595083759 1033699228 /nfs/dbraw/zinc/69/92/28/1033699228.db2.gz CAMGBAPOOJLOKC-QGTPRVQTSA-N 1 0 342.443 3.699 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061200 1033701592 /nfs/dbraw/zinc/70/15/92/1033701592.db2.gz LDFZZNHRJRCCIY-UGSOOPFHSA-N 1 0 330.384 3.642 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078559572 1033707481 /nfs/dbraw/zinc/70/74/81/1033707481.db2.gz NBHUPPCGJWDACD-LBPRGKRZSA-N 1 0 345.365 3.782 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)[C@@H](C[NH3+])CCC2 ZINC000595254347 1033712829 /nfs/dbraw/zinc/71/28/29/1033712829.db2.gz MXFUUTNSQDSHPU-OAHLLOKOSA-N 1 0 339.395 3.534 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)C1CC1 ZINC000599073229 1033715726 /nfs/dbraw/zinc/71/57/26/1033715726.db2.gz FZISCXQZCBIZTK-RBUKOAKNSA-N 1 0 343.471 3.522 20 5 EHBDRO CC(C)(O)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595421724 1033796408 /nfs/dbraw/zinc/79/64/08/1033796408.db2.gz BVDJEILCOVHPJO-UHFFFAOYSA-N 1 0 332.375 3.507 20 5 EHBDRO Cc1noc(C[NH2+]C2(Cc3ccccc3)CCCCC2)c1[N+](=O)[O-] ZINC000595438266 1033804048 /nfs/dbraw/zinc/80/40/48/1033804048.db2.gz FLIFXDBRGRDYCV-UHFFFAOYSA-N 1 0 329.400 3.926 20 5 EHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441563 1033805502 /nfs/dbraw/zinc/80/55/02/1033805502.db2.gz WTMIGHUIDWQKQX-HOTGVXAUSA-N 1 0 329.400 3.782 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000595467663 1033821884 /nfs/dbraw/zinc/82/18/84/1033821884.db2.gz SPTZADJTEBLXAR-JFIYKMOQSA-N 1 0 336.407 3.640 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C2(c3ccccc3)CCC2)c1 ZINC000593019694 1033822213 /nfs/dbraw/zinc/82/22/13/1033822213.db2.gz KNMGGEROBBRCOG-UHFFFAOYSA-N 1 0 340.379 3.550 20 5 EHBDRO Cc1c(CN2CCC([NH2+]Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000595512683 1033836376 /nfs/dbraw/zinc/83/63/76/1033836376.db2.gz ZLEKJXGABXKYIU-UHFFFAOYSA-N 1 0 339.439 3.657 20 5 EHBDRO O=[N+]([O-])c1c(NC2CCC([NH+]3CCCCC3)CC2)nc2sccn21 ZINC000080247907 1033937770 /nfs/dbraw/zinc/93/77/70/1033937770.db2.gz UDTRQYJDNCPNEZ-UHFFFAOYSA-N 1 0 349.460 3.513 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2cccnc2[N+](=O)[O-])c2cccs2)CC1 ZINC000603839149 1033951818 /nfs/dbraw/zinc/95/18/18/1033951818.db2.gz YALBIQKYPHTVRO-OAHLLOKOSA-N 1 0 346.456 3.936 20 5 EHBDRO Cc1c(CN2C[C@@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976015 1033970664 /nfs/dbraw/zinc/97/06/64/1033970664.db2.gz KRQPAHPXSNRLEN-LIRRHRJNSA-N 1 0 326.396 3.865 20 5 EHBDRO Cc1ccccc1OCCC[N@@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603869887 1033996127 /nfs/dbraw/zinc/99/61/27/1033996127.db2.gz WNQFCGNCVDQBHE-UHFFFAOYSA-N 1 0 344.411 3.683 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CC1(C)C ZINC000595909472 1034025212 /nfs/dbraw/zinc/02/52/12/1034025212.db2.gz OLRVGBRNXHMSRK-AAEUAGOBSA-N 1 0 330.388 3.684 20 5 EHBDRO Cc1noc(CS[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020527 1034060157 /nfs/dbraw/zinc/06/01/57/1034060157.db2.gz LFBZDOVVEUTLMM-OAHLLOKOSA-N 1 0 347.440 3.789 20 5 EHBDRO O=[N+]([O-])c1cc(N2CC[C@H](C[NH+]3CCCC3)C2)ccc1C(F)(F)F ZINC000596134170 1034088026 /nfs/dbraw/zinc/08/80/26/1034088026.db2.gz DWIWFLSRDPSJFQ-GFCCVEGCSA-N 1 0 343.349 3.536 20 5 EHBDRO COc1cc(N[C@H]2CC[N@@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336136 1034178919 /nfs/dbraw/zinc/17/89/19/1034178919.db2.gz NAYWQKQIFSODNZ-JTQLQIEISA-N 1 0 327.812 3.542 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000179375755 1034258238 /nfs/dbraw/zinc/25/82/38/1034258238.db2.gz IIRXERFSJJUMLV-VXGBXAGGSA-N 1 0 347.440 3.951 20 5 EHBDRO Cn1ncc2c1CC(C)(C)CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000596598081 1034312534 /nfs/dbraw/zinc/31/25/34/1034312534.db2.gz ACCNPHDOFIALJL-UHFFFAOYSA-N 1 0 348.834 3.566 20 5 EHBDRO CCC[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000061555030 1034351918 /nfs/dbraw/zinc/35/19/18/1034351918.db2.gz CSTSXLPYEAJGEG-UHFFFAOYSA-N 1 0 336.395 3.947 20 5 EHBDRO CC[C@@H](CCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152668626 1034352272 /nfs/dbraw/zinc/35/22/72/1034352272.db2.gz BWHYFNRSDPOGOS-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000604435297 1034378126 /nfs/dbraw/zinc/37/81/26/1034378126.db2.gz CGCHEFXYVMOJKL-SFHVURJKSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)s1 ZINC000604472614 1034386546 /nfs/dbraw/zinc/38/65/46/1034386546.db2.gz GXGSJZBOIVCUJQ-OAHLLOKOSA-N 1 0 331.441 3.980 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CCOCC1 ZINC000534345543 1034418701 /nfs/dbraw/zinc/41/87/01/1034418701.db2.gz FWHRGNKVUJXLNZ-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO CC(=O)c1ccc(NC[C@]2([NH+](C)C)CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000060452381 1034543156 /nfs/dbraw/zinc/54/31/56/1034543156.db2.gz SGKXHURWVMWBHO-UGSOOPFHSA-N 1 0 333.432 3.720 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000179688686 1034563550 /nfs/dbraw/zinc/56/35/50/1034563550.db2.gz UREWIFKZSVNDNA-GFCCVEGCSA-N 1 0 331.441 3.823 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3COC[C@H]3C2)s1 ZINC000597231203 1034614247 /nfs/dbraw/zinc/61/42/47/1034614247.db2.gz OHBOIKSYPMEDCS-UONOGXRCSA-N 1 0 344.436 3.792 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](c2ccccc2)C(C)C)c1[N+](=O)[O-] ZINC000892482354 1034720027 /nfs/dbraw/zinc/72/00/27/1034720027.db2.gz VCKWURGLKWCPMF-INIZCTEOSA-N 1 0 330.384 3.796 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3cccc(Cl)c3)CC2)cc1 ZINC000139007144 1034868245 /nfs/dbraw/zinc/86/82/45/1034868245.db2.gz VHZPHJAAWBXJJI-UHFFFAOYSA-N 1 0 345.830 3.613 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C2CCOCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407823 1034889994 /nfs/dbraw/zinc/88/99/94/1034889994.db2.gz TZWHRLHKQSHFCP-SFHVURJKSA-N 1 0 330.384 3.608 20 5 EHBDRO CN(CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2cccs2)on1 ZINC000548934038 1034998578 /nfs/dbraw/zinc/99/85/78/1034998578.db2.gz NZQOFZBUGWRXMM-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2C[C@@H](O)C[C@H]2c2ccccc2)c(Cl)c1 ZINC000411927680 1035077642 /nfs/dbraw/zinc/07/76/42/1035077642.db2.gz SQCFBAMUSNDDLZ-RDJZCZTQSA-N 1 0 332.787 3.556 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(C)c1 ZINC000414084989 1035465449 /nfs/dbraw/zinc/46/54/49/1035465449.db2.gz XUKDASNNYJOJSA-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1ccnc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338233 1035526644 /nfs/dbraw/zinc/52/66/44/1035526644.db2.gz LUXLRCNWWDHECX-BBRMVZONSA-N 1 0 346.456 3.855 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[N@@H+](C3CCCC3)CC2)ccc1Cl ZINC000178020695 1035532189 /nfs/dbraw/zinc/53/21/89/1035532189.db2.gz VVGPFLMZAKDPFL-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCN(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000511478036 1035544722 /nfs/dbraw/zinc/54/47/22/1035544722.db2.gz NFDWQWZJDLYMBM-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCCc2ccsc23)cc1 ZINC000492290524 1035581760 /nfs/dbraw/zinc/58/17/60/1035581760.db2.gz KSGHSVYZJGWLHQ-UHFFFAOYSA-N 1 0 344.436 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)OCCO2 ZINC000540705185 1035585658 /nfs/dbraw/zinc/58/56/58/1035585658.db2.gz CCOJGKLUWWAYMX-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000588232508 1035831949 /nfs/dbraw/zinc/83/19/49/1035831949.db2.gz KJZUWEUZFHUZKN-XJKSGUPXSA-N 1 0 348.830 3.983 20 5 EHBDRO CCOC[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180152591 1035851317 /nfs/dbraw/zinc/85/13/17/1035851317.db2.gz CUJTXZVKEWATMC-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cc(C4CC4)no3)C2)cc1 ZINC000595527662 1035921449 /nfs/dbraw/zinc/92/14/49/1035921449.db2.gz WOQMFCSVBDBRIG-HNNXBMFYSA-N 1 0 327.384 3.840 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347102 1035927970 /nfs/dbraw/zinc/92/79/70/1035927970.db2.gz IKFXEFGSWKAAAK-HZPDHXFCSA-N 1 0 344.415 3.949 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@H]2c2ccccc2F)n1 ZINC000414186663 1035964217 /nfs/dbraw/zinc/96/42/17/1035964217.db2.gz PZNFZNUCMYOYDV-QMCVQRASSA-N 1 0 344.390 3.560 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000463956437 1035998083 /nfs/dbraw/zinc/99/80/83/1035998083.db2.gz ZWAJWHWSQANDCI-GASCZTMLSA-N 1 0 348.447 3.596 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000492585517 1036034393 /nfs/dbraw/zinc/03/43/93/1036034393.db2.gz XKNZVVZGKOWCSN-GFCCVEGCSA-N 1 0 344.367 3.573 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492729410 1036219961 /nfs/dbraw/zinc/21/99/61/1036219961.db2.gz RZJOUGZHSMDSFA-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000589281440 1036340665 /nfs/dbraw/zinc/34/06/65/1036340665.db2.gz HFNRDCVUDKWDCV-DNVCBOLYSA-N 1 0 337.423 3.793 20 5 EHBDRO CCc1ccc(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000026223578 1036394093 /nfs/dbraw/zinc/39/40/93/1036394093.db2.gz SROWMJDKJAUPPI-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO CCCC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000541593967 1036478567 /nfs/dbraw/zinc/47/85/67/1036478567.db2.gz KEIRFBLHRWHHLJ-QGZVFWFLSA-N 1 0 333.432 3.790 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000589519800 1036487815 /nfs/dbraw/zinc/48/78/15/1036487815.db2.gz ANUWUELLRUGZPY-KYTCBBFDSA-N 1 0 346.818 3.795 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCc2nccs2)c2ccccc2)c1 ZINC000180341589 1036698180 /nfs/dbraw/zinc/69/81/80/1036698180.db2.gz IZQYZRRDFVRULJ-SFHVURJKSA-N 1 0 339.420 3.973 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464778439 1036772887 /nfs/dbraw/zinc/77/28/87/1036772887.db2.gz QBOFURIBEFVLSQ-GOSISDBHSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414339783 1036795359 /nfs/dbraw/zinc/79/53/59/1036795359.db2.gz GBYWZGINMBZHKU-XJKSGUPXSA-N 1 0 329.375 3.663 20 5 EHBDRO C[N@H+](CCc1ccccc1)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089886155 1036836593 /nfs/dbraw/zinc/83/65/93/1036836593.db2.gz PLCKDHOGIAIISC-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000180446207 1036840244 /nfs/dbraw/zinc/84/02/44/1036840244.db2.gz GAZTWLLZVJYIKC-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO CCc1cccc(C)c1NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180453480 1036862311 /nfs/dbraw/zinc/86/23/11/1036862311.db2.gz FAZFPJFQEIIPMX-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCC[C@@H](CO)C2)c2ccccc2)c1 ZINC000414349936 1036878234 /nfs/dbraw/zinc/87/82/34/1036878234.db2.gz YMSJVTQQTLLYKO-XFQXTVEOSA-N 1 0 340.423 3.825 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](c2ccc(C)cc2)[NH+](C)C)c1 ZINC000462374382 1036907140 /nfs/dbraw/zinc/90/71/40/1036907140.db2.gz GMLSORJYRDWDSK-GOSISDBHSA-N 1 0 329.400 3.627 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000152857528 1037000403 /nfs/dbraw/zinc/00/04/03/1037000403.db2.gz OXMLZPNPKKFNHV-HUUCEWRRSA-N 1 0 335.448 3.519 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCc2cscn2)c2ccccc2)c1 ZINC000180790839 1037188920 /nfs/dbraw/zinc/18/89/20/1037188920.db2.gz ZDYAGHLFCHXPQP-GOSISDBHSA-N 1 0 339.420 3.973 20 5 EHBDRO COc1ncc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000271780381 1037214617 /nfs/dbraw/zinc/21/46/17/1037214617.db2.gz KRIJNGGYBGMVFB-NSHDSACASA-N 1 0 335.791 3.811 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000008339136 1037240779 /nfs/dbraw/zinc/24/07/79/1037240779.db2.gz CKIWPXGOPYOACI-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193042390 1037300194 /nfs/dbraw/zinc/30/01/94/1037300194.db2.gz VUUBRQOPDPFNOA-GOSISDBHSA-N 1 0 341.411 3.689 20 5 EHBDRO CO[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000188821065 1037342103 /nfs/dbraw/zinc/34/21/03/1037342103.db2.gz KOSXVWGRUAYTFQ-UHOSZYNNSA-N 1 0 326.396 3.841 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)Cc2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000462735770 1037342580 /nfs/dbraw/zinc/34/25/80/1037342580.db2.gz DOQPPKSHHPLGFZ-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO CC[NH+](CC)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491384610 1037438145 /nfs/dbraw/zinc/43/81/45/1037438145.db2.gz UQFYQZZVOHXSIX-LJQANCHMSA-N 1 0 327.428 3.616 20 5 EHBDRO CCO[C@@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000575881359 1037441851 /nfs/dbraw/zinc/44/18/51/1037441851.db2.gz OTZCCHYYFJZEKP-HKUYNNGSSA-N 1 0 326.396 3.950 20 5 EHBDRO C=Cc1ccc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000462819379 1037442516 /nfs/dbraw/zinc/44/25/16/1037442516.db2.gz LVYWFZAXJVFUBL-ZWKOTPCHSA-N 1 0 340.427 3.750 20 5 EHBDRO COCCc1nc(C)c([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271859628 1037522785 /nfs/dbraw/zinc/52/27/85/1037522785.db2.gz ZFADGJPYQDCYKB-VXGBXAGGSA-N 1 0 349.456 3.960 20 5 EHBDRO CCOc1cc(C[NH2+][C@H]2CCCc3c(O)cccc32)ccc1[N+](=O)[O-] ZINC000493741486 1037591876 /nfs/dbraw/zinc/59/18/76/1037591876.db2.gz XKPCEKYGNJWJGN-INIZCTEOSA-N 1 0 342.395 3.866 20 5 EHBDRO CSc1cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)ccn1 ZINC000540136327 1037609555 /nfs/dbraw/zinc/60/95/55/1037609555.db2.gz NJXMKDPIPZAESW-MRXNPFEDSA-N 1 0 343.452 3.823 20 5 EHBDRO COc1cc(CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)ccc1Cl ZINC000549928137 1037641221 /nfs/dbraw/zinc/64/12/21/1037641221.db2.gz WOPOGNWCZLYPBD-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)N[C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000415936459 1037681067 /nfs/dbraw/zinc/68/10/67/1037681067.db2.gz WHPHQZIKTCEZRA-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO CCCC[C@H]1CCC[C@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000491822864 1037692012 /nfs/dbraw/zinc/69/20/12/1037692012.db2.gz YAEQLTOPMBTXQJ-LSDHHAIUSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H](C[NH2+]Cc1ncc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000897463302 1037864078 /nfs/dbraw/zinc/86/40/78/1037864078.db2.gz DTIYHHKPDVFZNA-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO CCOCOc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000897463921 1037868901 /nfs/dbraw/zinc/86/89/01/1037868901.db2.gz CPOZHBXMGFXHSZ-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO CC(C)CCC[C@H](C)NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000540378801 1037887514 /nfs/dbraw/zinc/88/75/14/1037887514.db2.gz DSISLHFZIBTWAR-GJZGRUSLSA-N 1 0 335.448 3.576 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000341286208 1037902857 /nfs/dbraw/zinc/90/28/57/1037902857.db2.gz JVXBPPYCRDTKOV-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592181457 1037909348 /nfs/dbraw/zinc/90/93/48/1037909348.db2.gz DLFZCJVOKWRBFE-HNNXBMFYSA-N 1 0 348.443 3.773 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000784396701 1037919472 /nfs/dbraw/zinc/91/94/72/1037919472.db2.gz CSIBABXVHPNHCH-IBGZPJMESA-N 1 0 346.402 3.897 20 5 EHBDRO COCCOc1cccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897469155 1038059714 /nfs/dbraw/zinc/05/97/14/1038059714.db2.gz FCTVKHNNJBZJRS-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000540589773 1038117020 /nfs/dbraw/zinc/11/70/20/1038117020.db2.gz KHZTWIRIZCOFCT-IBGZPJMESA-N 1 0 339.395 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000540599202 1038131026 /nfs/dbraw/zinc/13/10/26/1038131026.db2.gz UENCDRSSRFFDOD-SOFGYWHQSA-N 1 0 338.407 3.904 20 5 EHBDRO COc1ccc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000468654886 1038346686 /nfs/dbraw/zinc/34/66/86/1038346686.db2.gz CZUPLDULZXPQIB-NTEUORMPSA-N 1 0 342.395 3.805 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000538745613 1038511366 /nfs/dbraw/zinc/51/13/66/1038511366.db2.gz KFBXSKVIODDLME-GASCZTMLSA-N 1 0 347.459 3.513 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@H](O)Cc1ccccc1 ZINC000539050224 1038654202 /nfs/dbraw/zinc/65/42/02/1038654202.db2.gz HKVCNBDAQXMGNB-YZVOILCLSA-N 1 0 328.412 3.546 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCNC(=O)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000539088786 1038677336 /nfs/dbraw/zinc/67/73/36/1038677336.db2.gz ZIEZUOCBXLDHJY-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2cccc(F)c2)N(C)C)cc1[N+](=O)[O-] ZINC000479847521 1038807330 /nfs/dbraw/zinc/80/73/30/1038807330.db2.gz BQWDGSOQROSHRD-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000552250958 1039093950 /nfs/dbraw/zinc/09/39/50/1039093950.db2.gz HARGJSLVBGHGQN-VKJFTORMSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905854956 1039159186 /nfs/dbraw/zinc/15/91/86/1039159186.db2.gz YMDYTUXHBZQDGG-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@@H]1C ZINC000478209355 1039289994 /nfs/dbraw/zinc/28/99/94/1039289994.db2.gz QJXRUOQAJHUSFM-PZROIBLQSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)cc1[N+](=O)[O-] ZINC000480276678 1039373207 /nfs/dbraw/zinc/37/32/07/1039373207.db2.gz HUXATSLBNYDUIL-DYVFJYSZSA-N 1 0 333.457 3.918 20 5 EHBDRO Cc1c(C[NH2+]Cc2cn(C)nc2C2CCCCC2)cccc1[N+](=O)[O-] ZINC000480487671 1039612282 /nfs/dbraw/zinc/61/22/82/1039612282.db2.gz NZQGNIYDRMYOTA-UHFFFAOYSA-N 1 0 342.443 3.974 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)c(C)o1 ZINC000417301334 1039642977 /nfs/dbraw/zinc/64/29/77/1039642977.db2.gz BIYXWACJPGJVHJ-GOSISDBHSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCc1ccccn1)CCCC2 ZINC000417306460 1039657631 /nfs/dbraw/zinc/65/76/31/1039657631.db2.gz CYJGVJIUZLOAPZ-LJQANCHMSA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCOC1CCOCC1)CCCC2 ZINC000417311564 1039666573 /nfs/dbraw/zinc/66/65/73/1039666573.db2.gz PFNRGTGYAWCUNB-LJQANCHMSA-N 1 0 348.443 3.538 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCC1 ZINC000893301351 1039682076 /nfs/dbraw/zinc/68/20/76/1039682076.db2.gz AMAFNNISKLVNNI-GFCCVEGCSA-N 1 0 326.824 3.527 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(OC)CCCCC2)cc1[N+](=O)[O-] ZINC000480716179 1039943629 /nfs/dbraw/zinc/94/36/29/1039943629.db2.gz QPAUISXSUMUKRS-AWEZNQCLSA-N 1 0 336.432 3.993 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCC(F)(F)[C@@H](C)C1 ZINC000554946535 1039967362 /nfs/dbraw/zinc/96/73/62/1039967362.db2.gz VJXBSBNBRKOKBW-LBPRGKRZSA-N 1 0 328.359 3.859 20 5 EHBDRO Cc1cc(C)c(NC(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000178639731 1040142545 /nfs/dbraw/zinc/14/25/45/1040142545.db2.gz CAYFXJFVXQFDQT-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000027284839 1040158476 /nfs/dbraw/zinc/15/84/76/1040158476.db2.gz OIRKKXQVLBCPMW-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO Cc1ccc2nc(C[NH2+][C@H](C)CCc3ccccc3[N+](=O)[O-])cn2c1 ZINC000555122570 1040182902 /nfs/dbraw/zinc/18/29/02/1040182902.db2.gz WIXOVGNWUNYMQX-OAHLLOKOSA-N 1 0 338.411 3.662 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@H]34)s2)cc1 ZINC000190331584 1040329494 /nfs/dbraw/zinc/32/94/94/1040329494.db2.gz ZUNOSBVKTMFHBL-ZACQAIPSSA-N 1 0 344.436 3.980 20 5 EHBDRO C[NH+](C)[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130763 1040364778 /nfs/dbraw/zinc/36/47/78/1040364778.db2.gz OJAKAUPAAHNFTQ-PMACEKPBSA-N 1 0 339.439 3.614 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000479581128 1040402855 /nfs/dbraw/zinc/40/28/55/1040402855.db2.gz RGBALOZMLPGJPE-HOTGVXAUSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1cc2cccnc2c([N+](=O)[O-])c1 ZINC001167752317 1040833669 /nfs/dbraw/zinc/83/36/69/1040833669.db2.gz DYDKKCOKJGHGPT-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000555584064 1040879848 /nfs/dbraw/zinc/87/98/48/1040879848.db2.gz ZGNNDZNUISQMIW-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@@H](COc1ccc(F)cc1F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481541308 1041038228 /nfs/dbraw/zinc/03/82/28/1041038228.db2.gz HUEOIWWLQXKFDN-RYUDHWBXSA-N 1 0 336.338 3.991 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCC[C@H]21 ZINC000555721020 1041042788 /nfs/dbraw/zinc/04/27/88/1041042788.db2.gz FJQLBDLEXLWSPX-CABCVRRESA-N 1 0 342.399 3.655 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000432170862 1041688780 /nfs/dbraw/zinc/68/87/80/1041688780.db2.gz WGTATXRPQXIDEG-UHFFFAOYSA-N 1 0 346.818 3.972 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1CCC(F)(F)CC1 ZINC000500433063 1041697563 /nfs/dbraw/zinc/69/75/63/1041697563.db2.gz MYGCYDMVWKTWHC-UHFFFAOYSA-N 1 0 328.359 3.909 20 5 EHBDRO Cc1nc(C)c([C@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874915 1041788448 /nfs/dbraw/zinc/78/84/48/1041788448.db2.gz MKILCEHEACYJLG-LBPRGKRZSA-N 1 0 335.429 3.740 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070110 1041813102 /nfs/dbraw/zinc/81/31/02/1041813102.db2.gz UVIVOMFVYMNLDJ-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO COc1cc(C[NH2+]C[C@@H]2C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000111398364 1042262186 /nfs/dbraw/zinc/26/21/86/1042262186.db2.gz LLEXHFORBWKLRT-GOEBONIOSA-N 1 0 342.395 3.505 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C1(c2ccccc2)CCC1 ZINC000104665005 1042263149 /nfs/dbraw/zinc/26/31/49/1042263149.db2.gz VJCBCIFRFMJCHC-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000544609789 1042478590 /nfs/dbraw/zinc/47/85/90/1042478590.db2.gz POLFFBDLRDNAOX-ACJLOTCBSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000164986437 1042584789 /nfs/dbraw/zinc/58/47/89/1042584789.db2.gz FPLFIEVOEKAFII-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+]C2(CO)CC2)cc1 ZINC000120354303 1042651843 /nfs/dbraw/zinc/65/18/43/1042651843.db2.gz ODAXYFLDNBOAFR-UHFFFAOYSA-N 1 0 348.786 3.655 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000432328561 1042911558 /nfs/dbraw/zinc/91/15/58/1042911558.db2.gz KUTIHXSCQDXRSZ-MRXNPFEDSA-N 1 0 342.424 3.919 20 5 EHBDRO Cc1[nH+]c2c(n1Cc1cc([N+](=O)[O-])ccc1OC(C)C)CCCC2 ZINC000569065521 1042937159 /nfs/dbraw/zinc/93/71/59/1042937159.db2.gz NDXMMYXKMLFVJH-UHFFFAOYSA-N 1 0 329.400 3.814 20 5 EHBDRO Cc1ccc2c(c1)OCCC[C@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000344099806 1043248791 /nfs/dbraw/zinc/24/87/91/1043248791.db2.gz YQLHTLIDTAQKDY-QGZVFWFLSA-N 1 0 326.396 3.949 20 5 EHBDRO Cc1cc(C[C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000279114934 1043373508 /nfs/dbraw/zinc/37/35/08/1043373508.db2.gz PMSDKPHVTNPSSR-PIGZYNQJSA-N 1 0 328.416 3.570 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000344443699 1044012791 /nfs/dbraw/zinc/01/27/91/1044012791.db2.gz USYSLMYISKFYIT-SFHVURJKSA-N 1 0 328.412 3.932 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000183370869 1125544616 /nfs/dbraw/zinc/54/46/16/1125544616.db2.gz PUEUHYLRAIGBCX-GOSISDBHSA-N 1 0 340.423 3.942 20 5 EHBDRO Cc1nn(C[N@@H+](C)C[C@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965542 1127559871 /nfs/dbraw/zinc/55/98/71/1127559871.db2.gz YBPJLEBKLLPBNC-AWEZNQCLSA-N 1 0 338.411 3.946 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068981 1127569951 /nfs/dbraw/zinc/56/99/51/1127569951.db2.gz UUHLSDBARMJYBS-IRXDYDNUSA-N 1 0 346.456 3.570 20 5 EHBDRO Cc1ccnc(NC[C@H](c2ccco2)[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000301283921 1127733332 /nfs/dbraw/zinc/73/33/32/1127733332.db2.gz LGCNAOAIEPHXJK-CQSZACIVSA-N 1 0 330.388 3.530 20 5 EHBDRO Cc1cnc(NCc2ccccc2C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000301432281 1127889057 /nfs/dbraw/zinc/88/90/57/1127889057.db2.gz JGSFUCJTEHVNCN-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000765765537 1128004464 /nfs/dbraw/zinc/00/44/64/1128004464.db2.gz GKRNYIAPJPBSNJ-OLZOCXBDSA-N 1 0 331.441 3.678 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000765765535 1128004489 /nfs/dbraw/zinc/00/44/89/1128004489.db2.gz GKRNYIAPJPBSNJ-CHWSQXEVSA-N 1 0 331.441 3.678 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-])c1nccs1 ZINC000273134351 1128444198 /nfs/dbraw/zinc/44/41/98/1128444198.db2.gz UISXJBQKVMEFIA-JTQLQIEISA-N 1 0 325.821 3.940 20 5 EHBDRO O=[N+]([O-])c1cnc(NC2CC[NH+](C3CCCCC3)CC2)c(Cl)c1 ZINC000301462736 1128451424 /nfs/dbraw/zinc/45/14/24/1128451424.db2.gz FLUCWBIJKWPPGA-UHFFFAOYSA-N 1 0 338.839 3.852 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000273291615 1128476156 /nfs/dbraw/zinc/47/61/56/1128476156.db2.gz SINBBXJGHXTPLJ-SOUVJXGZSA-N 1 0 336.432 3.849 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000301604783 1128516526 /nfs/dbraw/zinc/51/65/26/1128516526.db2.gz MBHKVWZMQVUBKR-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCc3c2cccc3Cl)cc1 ZINC000765848619 1128559631 /nfs/dbraw/zinc/55/96/31/1128559631.db2.gz JFKBJYMSWMPDCG-IAGOWNOFSA-N 1 0 332.787 3.559 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765844778 1128547116 /nfs/dbraw/zinc/54/71/16/1128547116.db2.gz JIFDQOJVDGGCCS-HQOQDVMHSA-N 1 0 344.386 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844692 1128547404 /nfs/dbraw/zinc/54/74/04/1128547404.db2.gz HXFKTPKBPJGEMF-CVEARBPZSA-N 1 0 348.399 3.594 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@]2(O)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000765879119 1128636166 /nfs/dbraw/zinc/63/61/66/1128636166.db2.gz UAJXXOHBBPDZSO-QRWLVFNGSA-N 1 0 340.423 3.778 20 5 EHBDRO C[C@@H](C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000554279120 1128636513 /nfs/dbraw/zinc/63/65/13/1128636513.db2.gz FELCITXMSFYHBP-HOTGVXAUSA-N 1 0 328.412 3.581 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000554358212 1128641381 /nfs/dbraw/zinc/64/13/81/1128641381.db2.gz BFPGJRZUJXIBSH-ZFWWWQNUSA-N 1 0 348.830 3.983 20 5 EHBDRO Cc1nc(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301633305 1128779871 /nfs/dbraw/zinc/77/98/71/1128779871.db2.gz DHDBCYHDJKPFOH-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000109841421 1120126901 /nfs/dbraw/zinc/12/69/01/1120126901.db2.gz KBCYZTGSJDEXQM-OAHLLOKOSA-N 1 0 344.411 3.545 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](C)N1CCc2ccccc21 ZINC001649000085 1120342783 /nfs/dbraw/zinc/34/27/83/1120342783.db2.gz WPQVQZHPSYLAFR-OAHLLOKOSA-N 1 0 339.439 3.752 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C)C1Cc2ccccc2C1 ZINC000609193764 1120543059 /nfs/dbraw/zinc/54/30/59/1120543059.db2.gz CGCCVFXKRCZMAA-UHFFFAOYSA-N 1 0 340.423 3.981 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000542539532 1120964943 /nfs/dbraw/zinc/96/49/43/1120964943.db2.gz SLSMBTWPTDMUJB-CABCVRRESA-N 1 0 341.411 3.705 20 5 EHBDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145106 1121125376 /nfs/dbraw/zinc/12/53/76/1121125376.db2.gz SYHRRDHGJLWWOI-AWEZNQCLSA-N 1 0 326.400 3.680 20 5 EHBDRO O=C(C[N@H+](C1CC1)C1CCCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000064808018 1128965024 /nfs/dbraw/zinc/96/50/24/1128965024.db2.gz QGKVCRROFRHWDY-UHFFFAOYSA-N 1 0 337.807 3.594 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000301073255 1121359971 /nfs/dbraw/zinc/35/99/71/1121359971.db2.gz FXYKJVWGMBUTBN-QGZVFWFLSA-N 1 0 344.371 3.526 20 5 EHBDRO C[N@H+](CCSc1nc2sccn2c1[N+](=O)[O-])Cc1ccccc1 ZINC000193744480 1121602771 /nfs/dbraw/zinc/60/27/71/1121602771.db2.gz LFBPDEOADSTHJV-UHFFFAOYSA-N 1 0 348.453 3.528 20 5 EHBDRO C[C@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000301100703 1121692432 /nfs/dbraw/zinc/69/24/32/1121692432.db2.gz PWEYWRIDVFFBNL-LLVKDONJSA-N 1 0 335.404 3.654 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180124 1121798140 /nfs/dbraw/zinc/79/81/40/1121798140.db2.gz GNNJYBDKEINUEP-DOMZBBRYSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000301730714 1129011788 /nfs/dbraw/zinc/01/17/88/1129011788.db2.gz DEQNGRVOVZUEIG-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1cccc2c1OCO2)c1cccc([N+](=O)[O-])c1 ZINC000194401451 1121873908 /nfs/dbraw/zinc/87/39/08/1121873908.db2.gz HHKZSSIIPDFURV-MRXNPFEDSA-N 1 0 328.368 3.955 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2ncc(Cl)cc2[N+](=O)[O-])c1 ZINC000301746012 1129023348 /nfs/dbraw/zinc/02/33/48/1129023348.db2.gz PDZVWBQZXVZMKJ-UHFFFAOYSA-N 1 0 334.807 3.707 20 5 EHBDRO C[N@@H+](Cc1ccccc1)CC1CCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000301139047 1122096823 /nfs/dbraw/zinc/09/68/23/1122096823.db2.gz BTVGCSAJWBZHRA-UHFFFAOYSA-N 1 0 339.439 3.943 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1C ZINC000916575985 1122201672 /nfs/dbraw/zinc/20/16/72/1122201672.db2.gz GDIVFOCCNNNBII-NTZNESFSSA-N 1 0 339.823 3.601 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000154523898 1122684408 /nfs/dbraw/zinc/68/44/08/1122684408.db2.gz YUPFFDOWCOLJII-OALUTQOASA-N 1 0 344.386 3.898 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000556064288 1122801528 /nfs/dbraw/zinc/80/15/28/1122801528.db2.gz XSGIIMASFDARPO-LJQANCHMSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H](C)CSC)o2)c([N+](=O)[O-])c1 ZINC000130702847 1123255970 /nfs/dbraw/zinc/25/59/70/1123255970.db2.gz AEFPCGQUVHZHKG-LLVKDONJSA-N 1 0 336.413 3.705 20 5 EHBDRO CC(C)COc1ccc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609466565 1123586028 /nfs/dbraw/zinc/58/60/28/1123586028.db2.gz MNOOUIRKKQRGOB-UHFFFAOYSA-N 1 0 344.411 3.798 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000609489643 1123591702 /nfs/dbraw/zinc/59/17/02/1123591702.db2.gz XLDAFUBPWGBZHZ-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC000609513747 1123597365 /nfs/dbraw/zinc/59/73/65/1123597365.db2.gz JMBOTTYTFRXTOS-UHFFFAOYSA-N 1 0 341.411 3.682 20 5 EHBDRO C[C@@](O)(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000609564531 1123609803 /nfs/dbraw/zinc/60/98/03/1123609803.db2.gz UWAUIUXMEMXHCU-QGZVFWFLSA-N 1 0 332.425 3.574 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000615837652 1123885292 /nfs/dbraw/zinc/88/52/92/1123885292.db2.gz SNGNOTOVPMBHPH-JVCXIRSZSA-N 1 0 337.423 3.958 20 5 EHBDRO Cc1cc(N2CCC[C@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047986 1129158654 /nfs/dbraw/zinc/15/86/54/1129158654.db2.gz LHFGRVBYLMKKKU-LSDHHAIUSA-N 1 0 341.411 3.704 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCC[C@@H]2O)ccc1Oc1ccc(F)cc1 ZINC000237997152 1123938688 /nfs/dbraw/zinc/93/86/88/1123938688.db2.gz NTZDPXYQQSYGBI-RDJZCZTQSA-N 1 0 346.358 3.529 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ncccc2[N+](=O)[O-])CC1 ZINC000301256582 1124974190 /nfs/dbraw/zinc/97/41/90/1124974190.db2.gz AHXUDCURQCHAEW-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]Cc2ccc(O)cc2)cc(C(F)(F)F)c1 ZINC000618824704 1125205511 /nfs/dbraw/zinc/20/55/11/1125205511.db2.gz CJCWYIRURSWGHB-UHFFFAOYSA-N 1 0 326.274 3.609 20 5 EHBDRO C/C(=C/c1ccccc1)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000618821793 1125211196 /nfs/dbraw/zinc/21/11/96/1125211196.db2.gz FGNBEXIXGBHIIU-SQFISAMPSA-N 1 0 326.400 3.532 20 5 EHBDRO Cc1cc(C(=O)Nc2ccccc2Nc2cc[nH+]cc2)ccc1[N+](=O)[O-] ZINC000619581440 1125368082 /nfs/dbraw/zinc/36/80/82/1125368082.db2.gz FFLVESCFNCLULX-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H](C)c1ccsc1 ZINC000619754272 1125395134 /nfs/dbraw/zinc/39/51/34/1125395134.db2.gz FJORAUWNBPPQAM-VXGBXAGGSA-N 1 0 333.413 3.724 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000619895225 1125425106 /nfs/dbraw/zinc/42/51/06/1125425106.db2.gz RWTGHAKYJROUJW-MRXNPFEDSA-N 1 0 333.435 3.602 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCCC[C@H]1C ZINC000255958938 1129237790 /nfs/dbraw/zinc/23/77/90/1129237790.db2.gz JNCDXEFWSBVTQP-DYVFJYSZSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H]2SCCc3ccccc32)cc1[N+](=O)[O-] ZINC000530913240 1129395854 /nfs/dbraw/zinc/39/58/54/1129395854.db2.gz DRJGWSRMTUTWCK-GOSISDBHSA-N 1 0 344.436 3.724 20 5 EHBDRO COc1ccc(C2(C[NH2+]Cc3ccccc3[N+](=O)[O-])CCC2)cc1 ZINC000543413663 1129474151 /nfs/dbraw/zinc/47/41/51/1129474151.db2.gz ZGNZVQQYNRSWAX-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000327948569 1129539731 /nfs/dbraw/zinc/53/97/31/1129539731.db2.gz BLZQUFXLEHCQSE-KZNAEPCWSA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2nc(-c3ccccn3)cs2)cs1 ZINC000123936632 1129567228 /nfs/dbraw/zinc/56/72/28/1129567228.db2.gz LRHDTWNJPUOIGI-UHFFFAOYSA-N 1 0 346.437 3.507 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000124409657 1129604934 /nfs/dbraw/zinc/60/49/34/1129604934.db2.gz NDCOBTXKBWNKAC-VBHSOAQHSA-N 1 0 332.375 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000281116682 1129703658 /nfs/dbraw/zinc/70/36/58/1129703658.db2.gz XFGUYLVWYCAWSQ-NXHRZFHOSA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000392391472 1129712317 /nfs/dbraw/zinc/71/23/17/1129712317.db2.gz VBOZPBKQUYNEOX-LLVKDONJSA-N 1 0 346.353 3.685 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000302045155 1129765373 /nfs/dbraw/zinc/76/53/73/1129765373.db2.gz KBSQJRWITPWVGM-UHFFFAOYSA-N 1 0 343.374 3.729 20 5 EHBDRO Cc1cc(N[C@@H]2CCN(c3ccccn3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092075 1129767762 /nfs/dbraw/zinc/76/77/62/1129767762.db2.gz QAAYOFWGKYLXGO-CQSZACIVSA-N 1 0 349.394 3.537 20 5 EHBDRO CCOc1ncccc1CNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000302191890 1129772442 /nfs/dbraw/zinc/77/24/42/1129772442.db2.gz RIFOHNISPUEPFI-UHFFFAOYSA-N 1 0 338.367 3.857 20 5 EHBDRO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000302929130 1129798968 /nfs/dbraw/zinc/79/89/68/1129798968.db2.gz CEVBNYYVYRGOJT-AWEZNQCLSA-N 1 0 328.416 3.677 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196834 1129805969 /nfs/dbraw/zinc/80/59/69/1129805969.db2.gz VJEGJRHJRRZYOX-GJZGRUSLSA-N 1 0 341.411 3.687 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[NH+](C3CCC3)C3CCC3)n2)cc1 ZINC000429122183 1129830822 /nfs/dbraw/zinc/83/08/22/1129830822.db2.gz OIUAFYFOXDNZQU-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000303532715 1129852429 /nfs/dbraw/zinc/85/24/29/1129852429.db2.gz GEDUDFAOOCLTPT-KXBFYZLASA-N 1 0 343.427 3.744 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000509150390 1129856640 /nfs/dbraw/zinc/85/66/40/1129856640.db2.gz GULYXGOBSOWCAO-INIZCTEOSA-N 1 0 349.450 3.822 20 5 EHBDRO Cn1cc2c(n1)CCC[C@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000282480945 1129928069 /nfs/dbraw/zinc/92/80/69/1129928069.db2.gz QEQNPZGYILVDSL-AEFFLSMTSA-N 1 0 340.427 3.718 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H]2CCC[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000245508721 1130224182 /nfs/dbraw/zinc/22/41/82/1130224182.db2.gz SMTSRYDHQNRPOY-CWRNSKLLSA-N 1 0 335.448 3.517 20 5 EHBDRO COc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173449855 1130232522 /nfs/dbraw/zinc/23/25/22/1130232522.db2.gz JYOIWEMNVIIJRR-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CO)CC2CCCC2)o1 ZINC000509447826 1130649851 /nfs/dbraw/zinc/64/98/51/1130649851.db2.gz LGZREPFBIWEQNQ-OAHLLOKOSA-N 1 0 344.411 3.886 20 5 EHBDRO C[C@@H]1CO[C@H](c2ccccc2)[C@@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000731893300 1130854097 /nfs/dbraw/zinc/85/40/97/1130854097.db2.gz OYQRGHFUBZRXCT-CLCXKQKWSA-N 1 0 326.396 3.945 20 5 EHBDRO Cc1ccc(NC(=S)Nc2ccc([N+](=O)[O-])cc2)c(C[NH+](C)C)c1 ZINC000733750838 1131075898 /nfs/dbraw/zinc/07/58/98/1131075898.db2.gz CDKKFZOKKGFUGF-UHFFFAOYSA-N 1 0 344.440 3.774 20 5 EHBDRO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000740881779 1131552315 /nfs/dbraw/zinc/55/23/15/1131552315.db2.gz CWSQXBYFLXWXKI-OIISXLGYSA-N 1 0 336.407 3.759 20 5 EHBDRO [NH3+]Cc1cc2ccncc2n1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899691 1131882474 /nfs/dbraw/zinc/88/24/74/1131882474.db2.gz DZOHRZXCRUYARZ-INIZCTEOSA-N 1 0 336.395 3.523 20 5 EHBDRO CC(C)([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172904616 1131886458 /nfs/dbraw/zinc/88/64/58/1131886458.db2.gz YVYKCIWQEURQFY-INIZCTEOSA-N 1 0 325.412 3.762 20 5 EHBDRO COc1ccc(F)c(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172905588 1131888361 /nfs/dbraw/zinc/88/83/61/1131888361.db2.gz SFZKKBUWQKNZPL-MRXNPFEDSA-N 1 0 344.386 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1ccc(F)cc1)CC2 ZINC001172896104 1131901684 /nfs/dbraw/zinc/90/16/84/1131901684.db2.gz LXOQBLAUZRUSHP-SFHVURJKSA-N 1 0 328.387 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCOc3ccccc31)CC2 ZINC001172896409 1131901977 /nfs/dbraw/zinc/90/19/77/1131901977.db2.gz OZNYYLXNDVKZSI-QFBILLFUSA-N 1 0 338.407 3.956 20 5 EHBDRO C[C@H]1CCC[C@H]1[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173004982 1131934553 /nfs/dbraw/zinc/93/45/53/1131934553.db2.gz AFJQHGPZMLRZFH-MEDUHNTESA-N 1 0 339.386 3.620 20 5 EHBDRO CCCC[N@H+](CC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014611 1131935763 /nfs/dbraw/zinc/93/57/63/1131935763.db2.gz UKRINLGAQAHHCK-UHFFFAOYSA-N 1 0 341.402 3.964 20 5 EHBDRO CC[C@H]1CCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173017870 1131935815 /nfs/dbraw/zinc/93/58/15/1131935815.db2.gz LFGSABICPCNFGD-LBPRGKRZSA-N 1 0 339.386 3.716 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccnc1 ZINC001173187728 1131993890 /nfs/dbraw/zinc/99/38/90/1131993890.db2.gz GHQUYVQTUKQQAQ-DOMZBBRYSA-N 1 0 347.390 3.809 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCN(C)c1ccccc1 ZINC001173214901 1132000680 /nfs/dbraw/zinc/00/06/80/1132000680.db2.gz RIVAYFYXTOOOKS-INIZCTEOSA-N 1 0 327.428 3.642 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173215791 1132001654 /nfs/dbraw/zinc/00/16/54/1132001654.db2.gz ZUSGWNKVKYRVIJ-CABCVRRESA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)[C@H](O)c1ccc(Cl)cc1 ZINC001173220159 1132004220 /nfs/dbraw/zinc/00/42/20/1132004220.db2.gz VAXNFGMHZZTCCP-VBHSOAQHSA-N 1 0 348.830 3.891 20 5 EHBDRO COc1cccc(CC2([NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173223323 1132005038 /nfs/dbraw/zinc/00/50/38/1132005038.db2.gz ICVHWUJMTOPTRV-HNNXBMFYSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001173225013 1132005797 /nfs/dbraw/zinc/00/57/97/1132005797.db2.gz ARUOZBIDDPDJDI-RDJZCZTQSA-N 1 0 325.412 3.800 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227938 1132008133 /nfs/dbraw/zinc/00/81/33/1132008133.db2.gz SPMVACWSVHGVDQ-UZLBHIALSA-N 1 0 339.439 3.515 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](CC(=O)OC(C)(C)C)C1 ZINC001173230818 1132009079 /nfs/dbraw/zinc/00/90/79/1132009079.db2.gz GXZQIZWNHXLRFP-GOEBONIOSA-N 1 0 348.443 3.580 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccnc1C(F)(F)F ZINC001173235686 1132009989 /nfs/dbraw/zinc/00/99/89/1132009989.db2.gz ULSPYULDVOHGAR-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173233364 1132010366 /nfs/dbraw/zinc/01/03/66/1132010366.db2.gz VTFBUPDVICOUTP-CQSZACIVSA-N 1 0 326.396 3.593 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3)cc2F)CC1 ZINC001174478738 1132382100 /nfs/dbraw/zinc/38/21/00/1132382100.db2.gz YNGDFKNUOIIAQP-UHFFFAOYSA-N 1 0 344.390 3.619 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860260 1132582966 /nfs/dbraw/zinc/58/29/66/1132582966.db2.gz VYKFJNJSGUQUPC-MAUKXSAKSA-N 1 0 346.427 3.539 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC001168977447 1132617479 /nfs/dbraw/zinc/61/74/79/1132617479.db2.gz JXKSUMCIPSFVQT-IEBWSBKVSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)C1 ZINC001168978204 1132618330 /nfs/dbraw/zinc/61/83/30/1132618330.db2.gz PTRAKQDYFAKPFR-ZFWWWQNUSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCCCCCCCCCCCO)C1 ZINC001168983796 1132619078 /nfs/dbraw/zinc/61/90/78/1132619078.db2.gz LFBNOWTZPWLROY-ZWKOTPCHSA-N 1 0 328.497 3.915 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cc(-c3cccc(Cl)c3)no2)C1 ZINC001168983826 1132619188 /nfs/dbraw/zinc/61/91/88/1132619188.db2.gz LKUZYDACGKWBNH-FZMZJTMJSA-N 1 0 335.791 3.530 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)c(Cl)c2)C1 ZINC001168971832 1132623436 /nfs/dbraw/zinc/62/34/36/1132623436.db2.gz LNTJDJRETYFTJH-WDEREUQCSA-N 1 0 336.741 3.894 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168996539 1132626483 /nfs/dbraw/zinc/62/64/83/1132626483.db2.gz VQQPYZZNIBOFRD-GLQYFDAESA-N 1 0 341.249 3.935 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(OC(F)(F)F)cc1 ZINC001168986677 1132633552 /nfs/dbraw/zinc/63/35/52/1132633552.db2.gz YGHBOMBLAWUNNW-WZRBSPASSA-N 1 0 332.322 3.681 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@@H](C[N+](=O)[O-])C3)cc2)cc1 ZINC001168986753 1132634752 /nfs/dbraw/zinc/63/47/52/1132634752.db2.gz YYYFULWHEGITOK-VQIMIIECSA-N 1 0 340.423 3.897 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048728 1132641812 /nfs/dbraw/zinc/64/18/12/1132641812.db2.gz BCEVZSGTKCSIOT-GWCFXTLKSA-N 1 0 329.227 3.797 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cc3cnccc3o2)cc1[N+](=O)[O-] ZINC001175638580 1132719859 /nfs/dbraw/zinc/71/98/59/1132719859.db2.gz ODPKVKGYHYKNHT-NSHDSACASA-N 1 0 327.340 3.595 20 5 EHBDRO CC(C)(C)c1ccc(N2CCCc3ccc(C[NH3+])nc32)c([N+](=O)[O-])c1 ZINC001169592457 1132791076 /nfs/dbraw/zinc/79/10/76/1132791076.db2.gz TXIDYTLVZJXAHF-UHFFFAOYSA-N 1 0 340.427 3.830 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC001176029167 1132824371 /nfs/dbraw/zinc/82/43/71/1132824371.db2.gz RKAORQOISIOIOT-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234818 1132883536 /nfs/dbraw/zinc/88/35/36/1132883536.db2.gz IOYLJBAHHHHOKK-AWEZNQCLSA-N 1 0 343.452 3.920 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC001177337178 1133056051 /nfs/dbraw/zinc/05/60/51/1133056051.db2.gz AEUNFEIZGFEBIP-LJQANCHMSA-N 1 0 345.418 3.743 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483359 1133068882 /nfs/dbraw/zinc/06/88/82/1133068882.db2.gz ONTXXKCKZVKPKE-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cc1[N+](=O)[O-] ZINC001178326107 1133159975 /nfs/dbraw/zinc/15/99/75/1133159975.db2.gz AAALKHYVXBAHNB-UHFFFAOYSA-N 1 0 349.774 3.797 20 5 EHBDRO COc1cc(C)c(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC001178326294 1133160043 /nfs/dbraw/zinc/16/00/43/1133160043.db2.gz IHHPDHGBNPFUST-UHFFFAOYSA-N 1 0 349.818 3.601 20 5 EHBDRO OCCO[C@@H]1CCC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769384871 1133274338 /nfs/dbraw/zinc/27/43/38/1133274338.db2.gz XRFKCKXJMHNSDF-LJQANCHMSA-N 1 0 335.447 3.966 20 5 EHBDRO CNC(=O)[C@H]1CCC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769402992 1133277115 /nfs/dbraw/zinc/27/71/15/1133277115.db2.gz GEZAAXMJSYDNEU-SFHVURJKSA-N 1 0 332.447 3.951 20 5 EHBDRO OCCCCN1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000769396183 1133286844 /nfs/dbraw/zinc/28/68/44/1133286844.db2.gz XIRKJBQTBOKEJD-UHFFFAOYSA-N 1 0 348.490 3.883 20 5 EHBDRO COc1ccc(C2(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)CCC2)cc1 ZINC001180301707 1133353412 /nfs/dbraw/zinc/35/34/12/1133353412.db2.gz QMCOGJQNQZHDEF-UHFFFAOYSA-N 1 0 340.423 3.857 20 5 EHBDRO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@H]1CCCC[C@@H]1O ZINC001180332803 1133362589 /nfs/dbraw/zinc/36/25/89/1133362589.db2.gz UMTRUPSFZBQVBH-DOMZBBRYSA-N 1 0 346.349 3.597 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc2c1NCCC2 ZINC001181697321 1133518622 /nfs/dbraw/zinc/51/86/22/1133518622.db2.gz HWONGCZLVVAIMP-UHFFFAOYSA-N 1 0 325.412 3.627 20 5 EHBDRO O=C(CCc1c2ccccc2cc2ccccc21)N1CC[N@@H+]2CC[C@@H]2C1 ZINC001182413877 1133656896 /nfs/dbraw/zinc/65/68/96/1133656896.db2.gz RRIHCINPEGFQDL-LJQANCHMSA-N 1 0 344.458 3.842 20 5 EHBDRO CC[C@H](C)C[C@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519792 1133692405 /nfs/dbraw/zinc/69/24/05/1133692405.db2.gz BQHLDDXUVRMXNI-GXFFZTMASA-N 1 0 334.338 3.500 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC001183642015 1133835081 /nfs/dbraw/zinc/83/50/81/1133835081.db2.gz GPWIVYTYVWSTGB-IZOMPHCZSA-N 1 0 344.455 3.853 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1ccccc1)[NH+](C)C ZINC000786558931 1133874628 /nfs/dbraw/zinc/87/46/28/1133874628.db2.gz BVHLGSCPHZHRNW-GOSISDBHSA-N 1 0 327.384 3.512 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccccc1)[NH+](C)C ZINC000786558935 1133875067 /nfs/dbraw/zinc/87/50/67/1133875067.db2.gz BVHLGSCPHZHRNW-SFHVURJKSA-N 1 0 327.384 3.512 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1cccs1 ZINC000786813200 1133910550 /nfs/dbraw/zinc/91/05/50/1133910550.db2.gz LCEYAWZLYBTPRU-GQPJMJRUSA-N 1 0 332.425 3.557 20 5 EHBDRO CC(C)[C@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccnn1C ZINC000788074888 1134076809 /nfs/dbraw/zinc/07/68/09/1134076809.db2.gz GPXJTEVHVBBJHU-AWEZNQCLSA-N 1 0 336.823 3.511 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886607 1134099984 /nfs/dbraw/zinc/09/99/84/1134099984.db2.gz WGAZCGAXJHFDSH-CZUORRHYSA-N 1 0 341.367 3.881 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000788578528 1134146899 /nfs/dbraw/zinc/14/68/99/1134146899.db2.gz BAUJLTYBDKJIQD-OALUTQOASA-N 1 0 340.423 3.949 20 5 EHBDRO C[C@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000788582854 1134147802 /nfs/dbraw/zinc/14/78/02/1134147802.db2.gz NRFUHZXHOARHPZ-WMZOPIPTSA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788690197 1134157561 /nfs/dbraw/zinc/15/75/61/1134157561.db2.gz WMUOIXXBLGRIEG-LLVKDONJSA-N 1 0 348.472 3.824 20 5 EHBDRO C[C@@H]([NH2+]CC1(C)Cc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694940 1134163608 /nfs/dbraw/zinc/16/36/08/1134163608.db2.gz XWLYPGOUSBUPAS-CYBMUJFWSA-N 1 0 325.412 3.633 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cc[nH]c(=O)c1 ZINC000788797042 1134170356 /nfs/dbraw/zinc/17/03/56/1134170356.db2.gz VHXRGADGBVOTAA-SECBINFHSA-N 1 0 341.289 3.565 20 5 EHBDRO C[C@H]([NH2+][C@H]1C[C@H](c2cccc(F)c2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788805021 1134172495 /nfs/dbraw/zinc/17/24/95/1134172495.db2.gz ZYZBDNTULNQCFE-PJODQICGSA-N 1 0 329.375 3.913 20 5 EHBDRO C[NH2+]C1(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC001186479102 1134220058 /nfs/dbraw/zinc/22/00/58/1134220058.db2.gz MHPQZZCMZAKZNP-UHFFFAOYSA-N 1 0 337.729 3.821 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(-n3ccnc3)c(F)c2)cccc1[N+](=O)[O-] ZINC000790999905 1134491149 /nfs/dbraw/zinc/49/11/49/1134491149.db2.gz PJHGZMMZWLKKQP-UHFFFAOYSA-N 1 0 340.358 3.518 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606109 1134582747 /nfs/dbraw/zinc/58/27/47/1134582747.db2.gz QMDFJUOFNRJTQX-YLJYHZDGSA-N 1 0 340.423 3.735 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775371661 1134675124 /nfs/dbraw/zinc/67/51/24/1134675124.db2.gz OUNKCLWCLPPAAA-HZPDHXFCSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(Cl)cc2)c([N+](=O)[O-])c1 ZINC001170291914 1134734743 /nfs/dbraw/zinc/73/47/43/1134734743.db2.gz GZKHLWNOEPSLKF-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170297196 1134737727 /nfs/dbraw/zinc/73/77/27/1134737727.db2.gz LVSLTJLJJGAMNS-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCc3ncccc32)c([N+](=O)[O-])c1 ZINC001170304668 1134738777 /nfs/dbraw/zinc/73/87/77/1134738777.db2.gz DSXIZLGAOUYCMH-SCLBCKFNSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170328776 1134749444 /nfs/dbraw/zinc/74/94/44/1134749444.db2.gz MHWFYAAUODDHSD-GFCCVEGCSA-N 1 0 328.359 3.656 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170354468 1134753816 /nfs/dbraw/zinc/75/38/16/1134753816.db2.gz LSFDCRUSIABEIC-AWEZNQCLSA-N 1 0 346.402 3.848 20 5 EHBDRO CC[C@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000792876147 1134809439 /nfs/dbraw/zinc/80/94/39/1134809439.db2.gz LTNFZUREULUJHB-KRWDZBQOSA-N 1 0 329.356 3.918 20 5 EHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443600 1134867449 /nfs/dbraw/zinc/86/74/49/1134867449.db2.gz CQSRDUZQAXIRIM-HNAYVOBHSA-N 1 0 326.396 3.852 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)[C@H](O)c1ccccc1 ZINC000793235940 1134880593 /nfs/dbraw/zinc/88/05/93/1134880593.db2.gz IBNXUBHYQKBDJR-RTBURBONSA-N 1 0 328.412 3.895 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](c1ccc(Cl)cc1)C1CCC1 ZINC001192781125 1135054497 /nfs/dbraw/zinc/05/44/97/1135054497.db2.gz RQZQBGOOOFDHST-QGZVFWFLSA-N 1 0 348.834 3.884 20 5 EHBDRO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)Nc1ccc(N)cc1[N+](=O)[O-] ZINC000804620748 1135143556 /nfs/dbraw/zinc/14/35/56/1135143556.db2.gz UJYWJDXANQMESV-SFHVURJKSA-N 1 0 342.443 3.746 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C12CCCCC2 ZINC001194092426 1135231775 /nfs/dbraw/zinc/23/17/75/1135231775.db2.gz OZJZPMZDXYNHMU-IAGOWNOFSA-N 1 0 336.407 3.951 20 5 EHBDRO CCCCC[C@@H]1CCCC[N@@H+]1Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC001196329083 1135546133 /nfs/dbraw/zinc/54/61/33/1135546133.db2.gz KZTXKRFUMCOYPX-MRXNPFEDSA-N 1 0 333.432 3.629 20 5 EHBDRO CCC(CC)CCC[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC001196505886 1135570979 /nfs/dbraw/zinc/57/09/79/1135570979.db2.gz IGXPUFXAHCRKKB-UHFFFAOYSA-N 1 0 335.448 3.990 20 5 EHBDRO C[C@@H](C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001197600014 1135713393 /nfs/dbraw/zinc/71/33/93/1135713393.db2.gz BXQWTLHQFPLKGR-NSHDSACASA-N 1 0 341.839 3.801 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1COc2ccccc2[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728427 1135723634 /nfs/dbraw/zinc/72/36/34/1135723634.db2.gz DUCARYJTAXLGNT-SCTDSRPQSA-N 1 0 342.395 3.520 20 5 EHBDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761689 1135729036 /nfs/dbraw/zinc/72/90/36/1135729036.db2.gz QNAMVDLEQMFLHH-RBUKOAKNSA-N 1 0 344.411 3.720 20 5 EHBDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809733362 1135873546 /nfs/dbraw/zinc/87/35/46/1135873546.db2.gz UBKKECQRTMXIME-DNVCBOLYSA-N 1 0 342.439 3.974 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000809747576 1135884654 /nfs/dbraw/zinc/88/46/54/1135884654.db2.gz CUXPBGZCSCZFMK-IBGZPJMESA-N 1 0 328.412 3.932 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[N@@H+]3CCCC[C@H]23)o1 ZINC001199345321 1135896594 /nfs/dbraw/zinc/89/65/94/1135896594.db2.gz QDLQPASTHANODS-FUHWJXTLSA-N 1 0 341.411 3.571 20 5 EHBDRO COCc1c(C)cc(C)c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1C ZINC001199580810 1135912482 /nfs/dbraw/zinc/91/24/82/1135912482.db2.gz ATJWORDHPABUOP-UHFFFAOYSA-N 1 0 328.412 3.956 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000810006294 1135912880 /nfs/dbraw/zinc/91/28/80/1135912880.db2.gz IONOOZLGSUXEGB-SJLPKXTDSA-N 1 0 345.830 3.783 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC001201512720 1136031404 /nfs/dbraw/zinc/03/14/04/1136031404.db2.gz UXXKUNWBAJHYAO-UHFFFAOYSA-N 1 0 344.459 3.866 20 5 EHBDRO C[C@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@H]1O ZINC000811483108 1136091283 /nfs/dbraw/zinc/09/12/83/1136091283.db2.gz BWNCBPXZKNGYLH-UKRRQHHQSA-N 1 0 347.242 3.932 20 5 EHBDRO CCC[C@H](CCO)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811481854 1136091480 /nfs/dbraw/zinc/09/14/80/1136091480.db2.gz OMPYTPXBSUOJET-SNVBAGLBSA-N 1 0 335.231 3.790 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000811474565 1136096440 /nfs/dbraw/zinc/09/64/40/1136096440.db2.gz LVQMHQZRVZDYEH-OLZOCXBDSA-N 1 0 344.242 3.618 20 5 EHBDRO Cc1c(F)cc([N+](=O)[O-])cc1-n1c(-c2ccccc2)cnc1[C@H](C)[NH3+] ZINC001170687052 1136248624 /nfs/dbraw/zinc/24/86/24/1136248624.db2.gz BXMRXRGEOOWEAD-LBPRGKRZSA-N 1 0 340.358 3.915 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC000850426980 1136256955 /nfs/dbraw/zinc/25/69/55/1136256955.db2.gz JHUHGMUYAYWTPT-OLZOCXBDSA-N 1 0 330.384 3.508 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1COc2ccccc2C1 ZINC000850428998 1136257081 /nfs/dbraw/zinc/25/70/81/1136257081.db2.gz WNHDYTVWHTWLRC-KGLIPLIRSA-N 1 0 342.395 3.505 20 5 EHBDRO COC(=O)CC(C)(C)C[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000850444017 1136259715 /nfs/dbraw/zinc/25/97/15/1136259715.db2.gz HAGYGOVIXCGNEQ-LLVKDONJSA-N 1 0 342.823 3.706 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c1ccccc1 ZINC000850477245 1136266971 /nfs/dbraw/zinc/26/69/71/1136266971.db2.gz RVHFBJJGKQXJLT-CKFHNAJUSA-N 1 0 344.411 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](O)c2ccc(Cl)cc2)c(Cl)c1 ZINC000813796126 1136364129 /nfs/dbraw/zinc/36/41/29/1136364129.db2.gz ABKKXODVLVSOEC-OAHLLOKOSA-N 1 0 341.194 3.725 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@H](O)c1ccccc1 ZINC000851832826 1136412006 /nfs/dbraw/zinc/41/20/06/1136412006.db2.gz DXRBVBHQSGKEDX-IEBWSBKVSA-N 1 0 344.386 3.822 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587824 1136447429 /nfs/dbraw/zinc/44/74/29/1136447429.db2.gz OVMJBAXDFKHCDC-LIRRHRJNSA-N 1 0 326.396 3.854 20 5 EHBDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606606 1136470556 /nfs/dbraw/zinc/47/05/56/1136470556.db2.gz YJSCDWIOZNNSBX-KDOFPFPSSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[N@H+](CCOc1ccccc1OC)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000852727678 1136480354 /nfs/dbraw/zinc/48/03/54/1136480354.db2.gz OHAZRPAMVHVGNB-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc2c(c1)CCCO2 ZINC000852779277 1136485697 /nfs/dbraw/zinc/48/56/97/1136485697.db2.gz BHISHSLEVMGEEJ-LBPRGKRZSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814641787 1136488576 /nfs/dbraw/zinc/48/85/76/1136488576.db2.gz LEGZXNDZYLDQDG-HKUYNNGSSA-N 1 0 326.396 3.508 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC([NH+]2CCCCC2)CC1 ZINC000853189600 1136516265 /nfs/dbraw/zinc/51/62/65/1136516265.db2.gz UZSSMESGNSVKLI-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]Cc3ccccc3)CC2)c(F)c1 ZINC000853657076 1136553477 /nfs/dbraw/zinc/55/34/77/1136553477.db2.gz MFIIUSAKZIZAKD-UHFFFAOYSA-N 1 0 347.365 3.632 20 5 EHBDRO COc1ccc(C2([NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1 ZINC000815605274 1136622504 /nfs/dbraw/zinc/62/25/04/1136622504.db2.gz PTMDUPZEGQPLJX-GFCCVEGCSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774781 1136661280 /nfs/dbraw/zinc/66/12/80/1136661280.db2.gz OKJBUSBDADPSKT-KSZLIROESA-N 1 0 340.427 3.715 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818961472 1136891708 /nfs/dbraw/zinc/89/17/08/1136891708.db2.gz QPELBPNAKDMCSX-DLBZAZTESA-N 1 0 344.411 3.833 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CCCc2cccc(Cl)c2)c1 ZINC000818985436 1136897094 /nfs/dbraw/zinc/89/70/94/1136897094.db2.gz SSFSZUOPIASGEL-KRWDZBQOSA-N 1 0 334.803 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(Sc3ccccc3)CC2)cc1 ZINC000819045665 1136901989 /nfs/dbraw/zinc/90/19/89/1136901989.db2.gz GBKHZZZEHDKIMI-KRWDZBQOSA-N 1 0 344.436 3.543 20 5 EHBDRO Cc1ccc(SC[C@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819238627 1136923456 /nfs/dbraw/zinc/92/34/56/1136923456.db2.gz LBAGTXNWNKOSTL-KSSFIOAISA-N 1 0 346.452 3.707 20 5 EHBDRO COC(=O)CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000173398715 1136999780 /nfs/dbraw/zinc/99/97/80/1136999780.db2.gz ASSXMSVBOZLZPS-RDTXWAMCSA-N 1 0 342.395 3.940 20 5 EHBDRO C[NH+](C)C[C@H](NCc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282827202 1137021778 /nfs/dbraw/zinc/02/17/78/1137021778.db2.gz NTDGPCCRBWUGOI-AWEZNQCLSA-N 1 0 339.848 3.702 20 5 EHBDRO Cc1c(-c2noc([C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000823269645 1137092556 /nfs/dbraw/zinc/09/25/56/1137092556.db2.gz JSFHXQQXXAWJIX-UBHSHLNASA-N 1 0 328.372 3.546 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)c1 ZINC000824696057 1137148718 /nfs/dbraw/zinc/14/87/18/1137148718.db2.gz GWWMZPCYPOIPOE-UAGQMJEPSA-N 1 0 338.835 3.764 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000120469123 1137272140 /nfs/dbraw/zinc/27/21/40/1137272140.db2.gz SMWYEFKOTCRDRF-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@@H]3CCSC3)cs2)c1 ZINC000865654739 1137302221 /nfs/dbraw/zinc/30/22/21/1137302221.db2.gz UHTGBNQOPOAPKW-GFCCVEGCSA-N 1 0 349.481 3.951 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCCCC3)C2)c(C(F)F)c1 ZINC000865747025 1137308313 /nfs/dbraw/zinc/30/83/13/1137308313.db2.gz MWQNCZWIJIEUJV-UHFFFAOYSA-N 1 0 325.359 3.961 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)c1OC ZINC000865787328 1137311816 /nfs/dbraw/zinc/31/18/16/1137311816.db2.gz LVIAWMJDOBGGLS-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000866238591 1137337979 /nfs/dbraw/zinc/33/79/79/1137337979.db2.gz PZLWRYNNLCRIBK-CXAGYDPISA-N 1 0 348.422 3.566 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@](C)(O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000846185657 1137340400 /nfs/dbraw/zinc/34/04/00/1137340400.db2.gz CENYXRQJMSFMIH-DOXZYTNZSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000866310500 1137344618 /nfs/dbraw/zinc/34/46/18/1137344618.db2.gz FAMKZKDPBLVWFO-SRCQZFHVSA-N 1 0 338.423 3.848 20 5 EHBDRO CCCC[C@@](CC)(Nc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C(=O)OCC ZINC001171230864 1137355106 /nfs/dbraw/zinc/35/51/06/1137355106.db2.gz IGHOSZCHNXZSHN-GOSISDBHSA-N 1 0 349.431 3.512 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121153820 1137369699 /nfs/dbraw/zinc/36/96/99/1137369699.db2.gz KQFUHCNSZZNGOJ-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cc3c([nH]c2=O)CCCC3)cc1[N+](=O)[O-] ZINC000866640897 1137371990 /nfs/dbraw/zinc/37/19/90/1137371990.db2.gz MQZTVLOZSPPGGV-ZDUSSCGKSA-N 1 0 341.411 3.733 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(C(=O)OC(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000772976266 1137393137 /nfs/dbraw/zinc/39/31/37/1137393137.db2.gz FMCVUHTWCWNSRI-KRWDZBQOSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308940 1137408521 /nfs/dbraw/zinc/40/85/21/1137408521.db2.gz VDKSTEAYKZWVOI-HIFRSBDPSA-N 1 0 334.416 3.537 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CCOCC2 ZINC000282758882 1137446065 /nfs/dbraw/zinc/44/60/65/1137446065.db2.gz OEAROGONXBJEIM-QAPCUYQASA-N 1 0 332.444 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)n1 ZINC000773092188 1137464732 /nfs/dbraw/zinc/46/47/32/1137464732.db2.gz ZMUOVSBHWZSAFF-CJNGLKHVSA-N 1 0 329.375 3.630 20 5 EHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000773116725 1137466083 /nfs/dbraw/zinc/46/60/83/1137466083.db2.gz FWAQLNMVZLDGCW-SFHVURJKSA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@@H]23)cc1[N+](=O)[O-] ZINC000773134445 1137467593 /nfs/dbraw/zinc/46/75/93/1137467593.db2.gz JJMKOPUAKZLINO-ZCDTZLGTSA-N 1 0 338.498 3.933 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000511038755 1137471357 /nfs/dbraw/zinc/47/13/57/1137471357.db2.gz VDXMIRCFIUIVRT-GDBMZVCRSA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000511021224 1137471424 /nfs/dbraw/zinc/47/14/24/1137471424.db2.gz ZDYNKNUJWPPMKH-MAUKXSAKSA-N 1 0 340.423 3.899 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC001171713674 1137505739 /nfs/dbraw/zinc/50/57/39/1137505739.db2.gz KNEDPLMDQOCIDF-SJCJKPOMSA-N 1 0 345.374 3.802 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1ccccc1 ZINC000872015991 1137564630 /nfs/dbraw/zinc/56/46/30/1137564630.db2.gz AXVJNURBWLPKFO-LRDDRELGSA-N 1 0 332.425 3.701 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019554 1137564892 /nfs/dbraw/zinc/56/48/92/1137564892.db2.gz WSBBIQQDKAHOTF-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872034226 1137566646 /nfs/dbraw/zinc/56/66/46/1137566646.db2.gz MOZPHXNHKWGBJP-NSHDSACASA-N 1 0 333.319 3.535 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000872051181 1137568071 /nfs/dbraw/zinc/56/80/71/1137568071.db2.gz IGGJNRZVGWKIKO-PWXJCGIASA-N 1 0 342.461 3.764 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@]12CCC[C@H]1OCC2 ZINC000872315884 1137578463 /nfs/dbraw/zinc/57/84/63/1137578463.db2.gz AROXSUHGIJVNED-OCCSQVGLSA-N 1 0 331.199 3.703 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(C)([NH+]2CCCCC2)CC1 ZINC000872661782 1137582534 /nfs/dbraw/zinc/58/25/34/1137582534.db2.gz CBRKUMXGOJNSIV-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(OC(C)(C)C)nc2)cccc1[N+](=O)[O-] ZINC000873103053 1137590251 /nfs/dbraw/zinc/59/02/51/1137590251.db2.gz SHBVBFUYBBSBKL-UHFFFAOYSA-N 1 0 329.400 3.765 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746817 1137608323 /nfs/dbraw/zinc/60/83/23/1137608323.db2.gz HJDYQJLKPRJTHQ-APPDUMDISA-N 1 0 336.338 3.566 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130842 1137671033 /nfs/dbraw/zinc/67/10/33/1137671033.db2.gz OQNCLXKJNSNZEU-MZFXBISCSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1 ZINC000877829078 1137692677 /nfs/dbraw/zinc/69/26/77/1137692677.db2.gz VDSNTPCUCGZRSS-NSHDSACASA-N 1 0 339.317 3.902 20 5 EHBDRO CC(C)C[NH+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC(C)C ZINC000877951592 1137696902 /nfs/dbraw/zinc/69/69/02/1137696902.db2.gz XOYGTQGOBHSSLJ-UHFFFAOYSA-N 1 0 332.404 3.759 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966239 1137697360 /nfs/dbraw/zinc/69/73/60/1137697360.db2.gz DXQYDBVYFMXNAO-OLZOCXBDSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H](c1cccs1)N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000877971338 1137697666 /nfs/dbraw/zinc/69/76/66/1137697666.db2.gz VRQMNZXZBWPOMA-LLVKDONJSA-N 1 0 344.396 3.899 20 5 EHBDRO CCC(CC)[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000878037398 1137700235 /nfs/dbraw/zinc/70/02/35/1137700235.db2.gz UIMRGSUBAONDNI-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO CC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC1CC1 ZINC000878097775 1137702214 /nfs/dbraw/zinc/70/22/14/1137702214.db2.gz NYJHNFVSVMKJCB-UHFFFAOYSA-N 1 0 336.779 3.530 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419435 1137715043 /nfs/dbraw/zinc/71/50/43/1137715043.db2.gz FDTGRPKWLDKNLW-ZFWWWQNUSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[C@@H](C)C1 ZINC000878691191 1137725276 /nfs/dbraw/zinc/72/52/76/1137725276.db2.gz LCACKYPKEMQJTG-RDBSUJKOSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000130272345 1137835750 /nfs/dbraw/zinc/83/57/50/1137835750.db2.gz CSKXPJNVCXATBV-YVEFUNNKSA-N 1 0 334.803 3.941 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H]2CCCc3nc(C)sc32)cc1[N+](=O)[O-] ZINC000111312373 1137904233 /nfs/dbraw/zinc/90/42/33/1137904233.db2.gz MHCBZZDZCJEMDK-AWEZNQCLSA-N 1 0 347.440 3.878 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000332208718 1137935806 /nfs/dbraw/zinc/93/58/06/1137935806.db2.gz FRHQGQKCWPCWQJ-SFHVURJKSA-N 1 0 336.432 3.773 20 5 EHBDRO Cc1cc(N2CCC[C@@H](c3ncccn3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000884711551 1137970115 /nfs/dbraw/zinc/97/01/15/1137970115.db2.gz RGSYIHHSKRVVFV-CQSZACIVSA-N 1 0 349.394 3.625 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC000884717077 1137970778 /nfs/dbraw/zinc/97/07/78/1137970778.db2.gz RITJZTAMJRBDEX-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CO[C@@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000886057881 1138036453 /nfs/dbraw/zinc/03/64/53/1138036453.db2.gz ZZJUWEJYGYUSDR-LSDHHAIUSA-N 1 0 326.824 3.728 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CC[C@@]3(CO[C@H](C)C3)O2)cc1[N+](=O)[O-] ZINC000886333430 1138068545 /nfs/dbraw/zinc/06/85/45/1138068545.db2.gz IJHZSSOPARUFMP-IDHHARJASA-N 1 0 348.443 3.534 20 5 EHBDRO CC(C)C1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000075833597 1138129027 /nfs/dbraw/zinc/12/90/27/1138129027.db2.gz LTKYHUIEWJMCJY-UHFFFAOYSA-N 1 0 330.388 3.513 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCC4(CCC4)C3)o2)c1 ZINC000123495474 1138270838 /nfs/dbraw/zinc/27/08/38/1138270838.db2.gz NMPDCIKZQAXANS-UHFFFAOYSA-N 1 0 327.384 3.668 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@H](C(F)(F)F)C1 ZINC000129721080 1138419533 /nfs/dbraw/zinc/41/95/33/1138419533.db2.gz KVVBBJBNAKBJKK-NWDGAFQWSA-N 1 0 332.322 3.814 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1 ZINC000337247771 1138507837 /nfs/dbraw/zinc/50/78/37/1138507837.db2.gz IJPQXFMEWMTGIE-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](Cc2ccccn2)c2cccnc2)cc1 ZINC000338203901 1138786421 /nfs/dbraw/zinc/78/64/21/1138786421.db2.gz QMRLGTDPLZFBLJ-FQEVSTJZSA-N 1 0 348.406 3.501 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(CO)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000178564082 1139704518 /nfs/dbraw/zinc/70/45/18/1139704518.db2.gz RKPLBUGCWWTDTD-SFHVURJKSA-N 1 0 332.375 3.857 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2nc(C)sc21 ZINC000178730074 1139715467 /nfs/dbraw/zinc/71/54/67/1139715467.db2.gz NVLVOIWKDNJKRF-CYBMUJFWSA-N 1 0 333.413 3.536 20 5 EHBDRO CC[N@H+](Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000180101690 1139809051 /nfs/dbraw/zinc/80/90/51/1139809051.db2.gz IXJHWCPPPSLQNG-UHFFFAOYSA-N 1 0 348.321 3.529 20 5 EHBDRO Cc1cnn([C@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000182760509 1139990882 /nfs/dbraw/zinc/99/08/82/1139990882.db2.gz CXSDBPBANURGEM-WBVHZDCISA-N 1 0 328.416 3.806 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000191266994 1140450053 /nfs/dbraw/zinc/45/00/53/1140450053.db2.gz DBIYJCAFZASNQB-ZDUSSCGKSA-N 1 0 330.432 3.748 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000191337259 1140455774 /nfs/dbraw/zinc/45/57/74/1140455774.db2.gz PVAMCVRTXHYSRM-UHFFFAOYSA-N 1 0 348.447 3.551 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCS1 ZINC000192184970 1140509626 /nfs/dbraw/zinc/50/96/26/1140509626.db2.gz HMXQZDDVVWSQDP-GFCCVEGCSA-N 1 0 333.413 3.577 20 5 EHBDRO Cc1nc(NCc2ccc(C[NH+]3CCCC3)cc2)ccc1[N+](=O)[O-] ZINC000268498416 1140947902 /nfs/dbraw/zinc/94/79/02/1140947902.db2.gz PPXDPLCAYODCBE-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](Cc2ccco2)C2CCCC2)c1 ZINC000269629389 1141129921 /nfs/dbraw/zinc/12/99/21/1141129921.db2.gz DUKDFKAULIORRT-SFHVURJKSA-N 1 0 330.384 3.666 20 5 EHBDRO CC[N@H+](CCc1nccs1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000269894103 1141155015 /nfs/dbraw/zinc/15/50/15/1141155015.db2.gz BXDBVXYTWLMVBE-UHFFFAOYSA-N 1 0 325.821 3.769 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000270376851 1141214698 /nfs/dbraw/zinc/21/46/98/1141214698.db2.gz LZTYQTHQKXRLEM-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137751 1141507289 /nfs/dbraw/zinc/50/72/89/1141507289.db2.gz GBVYMPDFSRTHBX-AAEUAGOBSA-N 1 0 346.349 3.739 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccncc2)CC1 ZINC000348907182 1141607485 /nfs/dbraw/zinc/60/74/85/1141607485.db2.gz WIJRWZCBWQHIKX-UHFFFAOYSA-N 1 0 341.411 3.768 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000348933316 1141611575 /nfs/dbraw/zinc/61/15/75/1141611575.db2.gz IJHKYDYNXBETFK-OJNOIJSXSA-N 1 0 339.395 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(CCN2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726433 217108872 /nfs/dbraw/zinc/10/88/72/217108872.db2.gz BXRSZSNPJVLACZ-LJQANCHMSA-N 1 0 345.487 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(F)c3cccnc23)cc1 ZINC000151774970 1032059220 /nfs/dbraw/zinc/05/92/20/1032059220.db2.gz KHPPDUBDKCYSRK-UHFFFAOYSA-N 1 0 325.343 3.614 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000430160269 1014484922 /nfs/dbraw/zinc/48/49/22/1014484922.db2.gz FWIYKJFUIJRHTA-KAPURRDVSA-N 1 0 330.428 3.747 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCCn2ccnc2C)cc1[N+](=O)[O-] ZINC000153972885 1014721147 /nfs/dbraw/zinc/72/11/47/1014721147.db2.gz RZPMTPUPWPVGFK-AWEZNQCLSA-N 1 0 346.431 3.629 20 5 EHBDRO C[C@H](c1ccc2c(c1)CCC2)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000459424941 1032110086 /nfs/dbraw/zinc/11/00/86/1032110086.db2.gz KYQALCPGAXESMB-CQSZACIVSA-N 1 0 340.427 3.678 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(F)(F)F)C1(C)C ZINC000430242914 1015207694 /nfs/dbraw/zinc/20/76/94/1015207694.db2.gz YYTRFVYBVVVZBM-ZDUSSCGKSA-N 1 0 332.322 3.766 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCC1 ZINC000339729732 1015612705 /nfs/dbraw/zinc/61/27/05/1015612705.db2.gz OFGOQSGTIANXQI-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO C[NH2+]Cc1cn(-c2cc(Cl)cc([N+](=O)[O-])n2)c2ccc(C)cc12 ZINC001167122735 1016172550 /nfs/dbraw/zinc/17/25/50/1016172550.db2.gz AWAJQRKFOLJGNP-UHFFFAOYSA-N 1 0 330.775 3.615 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC001167122481 1016177257 /nfs/dbraw/zinc/17/72/57/1016177257.db2.gz IPOXKASFUYCFFY-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cnccc2C(C)(C)C)cc1[N+](=O)[O-] ZINC000414496977 1016942172 /nfs/dbraw/zinc/94/21/72/1016942172.db2.gz JKZPHTVWYVDMRE-UHFFFAOYSA-N 1 0 329.400 3.586 20 5 EHBDRO COC1([C@@H](C)[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1 ZINC000414523527 1016952466 /nfs/dbraw/zinc/95/24/66/1016952466.db2.gz IKPAYFIDDIORLV-CYBMUJFWSA-N 1 0 330.384 3.902 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000414531012 1016962120 /nfs/dbraw/zinc/96/21/20/1016962120.db2.gz RFZFRXRGWSDRCT-INIZCTEOSA-N 1 0 346.402 3.723 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000181520295 1017021526 /nfs/dbraw/zinc/02/15/26/1017021526.db2.gz VWSBSWCPKBGUDX-GJZGRUSLSA-N 1 0 341.411 3.705 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000449108045 1032188516 /nfs/dbraw/zinc/18/85/16/1032188516.db2.gz SAVWBDGMGFOZQC-QAPCUYQASA-N 1 0 345.443 3.792 20 5 EHBDRO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc([C@@H]([NH3+])CC(C)C)no1 ZINC000414626515 1017078092 /nfs/dbraw/zinc/07/80/92/1017078092.db2.gz YDWDRRHQFYDRDI-HIFRSBDPSA-N 1 0 332.404 3.760 20 5 EHBDRO CCSc1cc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449257602 1032365053 /nfs/dbraw/zinc/36/50/53/1032365053.db2.gz JNTDUFKMZMXMPR-CYBMUJFWSA-N 1 0 331.441 3.823 20 5 EHBDRO C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459651213 1032374409 /nfs/dbraw/zinc/37/44/09/1032374409.db2.gz OWOFNCQZZAXCHM-HOSRBBHYSA-N 1 0 329.425 3.904 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000536883247 1032388499 /nfs/dbraw/zinc/38/84/99/1032388499.db2.gz UTFFSYDUVNCISI-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO CC[C@H](C)c1nnc([C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000449288414 1032406689 /nfs/dbraw/zinc/40/66/89/1032406689.db2.gz ZUHNWHBRFYTESK-AVGNSLFASA-N 1 0 331.420 3.508 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000459693042 1032417961 /nfs/dbraw/zinc/41/79/61/1032417961.db2.gz HFPIKBIHEJWGSF-ZDUSSCGKSA-N 1 0 332.787 3.514 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CCC[C@@H]4C[C@@H]43)cs2)c1 ZINC000459773071 1032461285 /nfs/dbraw/zinc/46/12/85/1032461285.db2.gz SIQFSHVJTSWNGI-XFBWCDHKSA-N 1 0 329.425 3.997 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)cc1[N+](=O)[O-] ZINC000449350548 1032465837 /nfs/dbraw/zinc/46/58/37/1032465837.db2.gz MGCDZHJPSILCHL-MRXNPFEDSA-N 1 0 330.359 3.910 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449433207 1032549089 /nfs/dbraw/zinc/54/90/89/1032549089.db2.gz LEKSDSYLYWPJLW-KYJSFNMBSA-N 1 0 342.443 3.834 20 5 EHBDRO CC[C@@H]1CCC[C@H]1C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000449432962 1032549830 /nfs/dbraw/zinc/54/98/30/1032549830.db2.gz KEGVHMDELQWCKD-HFTRVMKXSA-N 1 0 342.443 3.834 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090770665 1032594284 /nfs/dbraw/zinc/59/42/84/1032594284.db2.gz WZBVLHODUZRSMB-KDOFPFPSSA-N 1 0 326.396 3.759 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CCO1 ZINC000449490899 1032652596 /nfs/dbraw/zinc/65/25/96/1032652596.db2.gz DLSCYYDWQPGERD-GPMSIDNRSA-N 1 0 334.460 3.957 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1F ZINC000593065101 1032666074 /nfs/dbraw/zinc/66/60/74/1032666074.db2.gz SLZXFHSFUSRKHM-INIZCTEOSA-N 1 0 345.374 3.722 20 5 EHBDRO CC(C)(C)n1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501158 1032680643 /nfs/dbraw/zinc/68/06/43/1032680643.db2.gz PARZJEHSTJVMKI-KRWDZBQOSA-N 1 0 342.443 3.926 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCCC[NH2+]C3)s2)cc1 ZINC000415064680 1017484302 /nfs/dbraw/zinc/48/43/02/1017484302.db2.gz DKRZTBMSGUVSSB-CQSZACIVSA-N 1 0 331.441 3.555 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1-n1cccn1 ZINC000177298009 1017609806 /nfs/dbraw/zinc/60/98/06/1017609806.db2.gz PZTVVQVDOBQIKN-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H]1CCN(c2ccsc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000610284381 1017656038 /nfs/dbraw/zinc/65/60/38/1017656038.db2.gz QGTQGPAUBOPQOQ-AWEZNQCLSA-N 1 0 331.441 3.757 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1Cn1cccn1)c1cccc([N+](=O)[O-])c1 ZINC000120188337 1017996380 /nfs/dbraw/zinc/99/63/80/1017996380.db2.gz YPSVTCXAMCSWNU-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO C[C@@]1(CNc2ncc([N+](=O)[O-])s2)CCC[N@@H+]1Cc1ccccc1 ZINC000336943108 1018007077 /nfs/dbraw/zinc/00/70/77/1018007077.db2.gz ZYFIVQNCDMLZCD-INIZCTEOSA-N 1 0 332.429 3.518 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1 ZINC000275678464 1018080299 /nfs/dbraw/zinc/08/02/99/1018080299.db2.gz YPYZXVINCDPESJ-IPMKNSEASA-N 1 0 326.396 3.554 20 5 EHBDRO COc1cc(NCC2CC[NH+](CCC(C)C)CC2)ccc1[N+](=O)[O-] ZINC000431847725 1018119815 /nfs/dbraw/zinc/11/98/15/1018119815.db2.gz MANAKCIQJIRPQE-UHFFFAOYSA-N 1 0 335.448 3.773 20 5 EHBDRO C[C@]1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO[C@H]1C1CC1 ZINC000468046424 1018186905 /nfs/dbraw/zinc/18/69/05/1018186905.db2.gz CJZGNJDQRPLJFQ-YZGWKJHDSA-N 1 0 344.455 3.711 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])c1 ZINC000110210905 1018357446 /nfs/dbraw/zinc/35/74/46/1018357446.db2.gz OVLPYNHUZJJMEG-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000594017504 1032788356 /nfs/dbraw/zinc/78/83/56/1032788356.db2.gz GLUILJNWCSXNHH-OAHLLOKOSA-N 1 0 345.374 3.803 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000610420560 1019024409 /nfs/dbraw/zinc/02/44/09/1019024409.db2.gz RZCJLPGKCDXRCC-DOMZBBRYSA-N 1 0 347.365 3.803 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182324813 1019060282 /nfs/dbraw/zinc/06/02/82/1019060282.db2.gz YORGVNMUQIDBNN-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO C[N@@H+]1CC[C@@H](CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000729264092 1019252383 /nfs/dbraw/zinc/25/23/83/1019252383.db2.gz VLWZLZMESYOENG-QMMMGPOBSA-N 1 0 337.729 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2(c3ccc(Cl)cc3)CCC2)c1 ZINC000178869054 1019320457 /nfs/dbraw/zinc/32/04/57/1019320457.db2.gz CUNTVCPTAMIOQG-KRWDZBQOSA-N 1 0 346.814 3.951 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CCO2 ZINC000274341533 1019429677 /nfs/dbraw/zinc/42/96/77/1019429677.db2.gz DEFTVDHTTPWSHJ-SJCJKPOMSA-N 1 0 328.368 3.778 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1cccc([N+](=O)[O-])c1 ZINC000610451270 1019771368 /nfs/dbraw/zinc/77/13/68/1019771368.db2.gz KOVXXJPJVVQJAI-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3scnc3C3CC3)c2c1 ZINC000579876422 1020038118 /nfs/dbraw/zinc/03/81/18/1020038118.db2.gz BIHXIQRMNCLVEG-UHFFFAOYSA-N 1 0 342.424 3.742 20 5 EHBDRO CCC[C@@H](C)[N@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070681 1020058874 /nfs/dbraw/zinc/05/88/74/1020058874.db2.gz NERQALGUEKEALP-SNVBAGLBSA-N 1 0 332.347 3.825 20 5 EHBDRO Cc1cc(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)ccc1[N+](=O)[O-] ZINC000345884617 1020575141 /nfs/dbraw/zinc/57/51/41/1020575141.db2.gz LRABALIJSQKRNT-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO CCC(=O)c1ccc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000280725637 1020613571 /nfs/dbraw/zinc/61/35/71/1020613571.db2.gz MRNMDIYUFPWTPU-MRXNPFEDSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000426308142 1021227900 /nfs/dbraw/zinc/22/79/00/1021227900.db2.gz UVHWLXQKYWGESB-ZBFHGGJFSA-N 1 0 343.402 3.972 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+](C(C)C)C1CCCCC1 ZINC000120850656 1021282109 /nfs/dbraw/zinc/28/21/09/1021282109.db2.gz LJMGXASIQUDDCV-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC(C[NH+]3CCCCCC3)CC2)cs1 ZINC000054175033 1021295362 /nfs/dbraw/zinc/29/53/62/1021295362.db2.gz ZDMGTDMETJLCDB-UHFFFAOYSA-N 1 0 337.489 3.744 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000157378995 1021297230 /nfs/dbraw/zinc/29/72/30/1021297230.db2.gz SBNHNGQHAIMOPJ-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC1(CCO)CCCC1 ZINC000602560720 1032973714 /nfs/dbraw/zinc/97/37/14/1032973714.db2.gz LKCRVBBICLMAFJ-UHFFFAOYSA-N 1 0 346.349 3.646 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000337348540 1021421635 /nfs/dbraw/zinc/42/16/35/1021421635.db2.gz ZAVGYHWMVLGANT-RDJZCZTQSA-N 1 0 341.411 3.814 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC[N@H+](CC2CCCCC2)CC1 ZINC000505916310 1021445533 /nfs/dbraw/zinc/44/55/33/1021445533.db2.gz AIXOTVMNLMOLOW-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO CCC[C@H]([NH2+][C@H](CO)Cc1cccc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000467410714 1021456092 /nfs/dbraw/zinc/45/60/92/1021456092.db2.gz JUKADGWYVKSDLC-ICSRJNTNSA-N 1 0 342.439 3.938 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601389 1032995733 /nfs/dbraw/zinc/99/57/33/1032995733.db2.gz KSACGIJXUOUYTI-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602582217 1033002372 /nfs/dbraw/zinc/00/23/72/1033002372.db2.gz MFRCTUALILCRFT-RISCZKNCSA-N 1 0 332.322 3.518 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)Nc2ccc3c(c2)C[NH2+]C3)cc1[N+](=O)[O-] ZINC000449667199 1033005956 /nfs/dbraw/zinc/00/59/56/1033005956.db2.gz QSERCOBORVLXDY-UHFFFAOYSA-N 1 0 339.395 3.748 20 5 EHBDRO CC[C@H](CO)[NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000520145352 1021962936 /nfs/dbraw/zinc/96/29/36/1021962936.db2.gz LVKDISHKAWRZAJ-OAHLLOKOSA-N 1 0 346.452 3.915 20 5 EHBDRO CCCC[N@H+](CC)Cc1cccc(CNc2c([N+](=O)[O-])ncn2C)c1 ZINC000471749847 1021975015 /nfs/dbraw/zinc/97/50/15/1021975015.db2.gz VYSUVYIOYZAXCI-UHFFFAOYSA-N 1 0 345.447 3.562 20 5 EHBDRO CC(C)OCCCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602604107 1033022731 /nfs/dbraw/zinc/02/27/31/1033022731.db2.gz WPBLYSCQNHZENC-UHFFFAOYSA-N 1 0 334.338 3.908 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1cccc(Cl)c1 ZINC000016632093 1033030604 /nfs/dbraw/zinc/03/06/04/1033030604.db2.gz RFTYQXBHGGCFGC-GFCCVEGCSA-N 1 0 347.802 3.707 20 5 EHBDRO CCc1ccc([C@@H](NC[C@H](C)C[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000425941610 1022325195 /nfs/dbraw/zinc/32/51/95/1022325195.db2.gz CBYDUJPNXICIAY-LIRRHRJNSA-N 1 0 345.443 3.627 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187564713 1022338443 /nfs/dbraw/zinc/33/84/43/1022338443.db2.gz NNPPACQJHLSKBS-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO CC(=O)c1cc(NCCCC[N@H+]2CCCC[C@H]2C)ccc1[N+](=O)[O-] ZINC000341568001 1022346594 /nfs/dbraw/zinc/34/65/94/1022346594.db2.gz UNPQRKXFBCNXTN-CQSZACIVSA-N 1 0 333.432 3.864 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000602656822 1033056021 /nfs/dbraw/zinc/05/60/21/1033056021.db2.gz YNZXFUBVIRLZCU-DZGCQCFKSA-N 1 0 344.333 3.757 20 5 EHBDRO CCC1(CC)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000438508046 1022746660 /nfs/dbraw/zinc/74/66/60/1022746660.db2.gz XKIGWDOPDKKYQE-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO COCC[C@@H](Cc1cccc(F)c1)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000477746534 1022770220 /nfs/dbraw/zinc/77/02/20/1022770220.db2.gz YLRLZMUIKKRKML-SFHVURJKSA-N 1 0 346.402 3.780 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000438541925 1022796489 /nfs/dbraw/zinc/79/64/89/1022796489.db2.gz RZRCXGISBNDTCE-CMPLNLGQSA-N 1 0 344.358 3.526 20 5 EHBDRO CCN(CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CCC(F)(F)F ZINC000426078912 1022857844 /nfs/dbraw/zinc/85/78/44/1022857844.db2.gz OHVZLEBHLDISPM-ZDUSSCGKSA-N 1 0 347.381 3.828 20 5 EHBDRO CC[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000506378894 1023038310 /nfs/dbraw/zinc/03/83/10/1023038310.db2.gz GMQFXNJPEAGILE-HNNXBMFYSA-N 1 0 332.425 3.934 20 5 EHBDRO CCC(CC)[C@H](CNCc1ccc(C)c([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000518269843 1023179670 /nfs/dbraw/zinc/17/96/70/1023179670.db2.gz ORLHNEQVZRMQFK-IBGZPJMESA-N 1 0 333.476 3.893 20 5 EHBDRO CC(C)C[C@H](CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+](C)C ZINC000518270151 1023180273 /nfs/dbraw/zinc/18/02/73/1023180273.db2.gz XDYWENXAEHWAAN-QGZVFWFLSA-N 1 0 345.443 3.921 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475572 1023239492 /nfs/dbraw/zinc/23/94/92/1023239492.db2.gz XZOSWXDIZVTYQY-CVEARBPZSA-N 1 0 349.450 3.820 20 5 EHBDRO CCC1([NH+](C)C)CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000602740569 1033128978 /nfs/dbraw/zinc/12/89/78/1033128978.db2.gz WUUXVFUZUGEMHL-SSZFMOIBSA-N 1 0 331.460 3.804 20 5 EHBDRO CCC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000548488237 1023502693 /nfs/dbraw/zinc/50/26/93/1023502693.db2.gz QDMBNENUXHYSIK-HUUCEWRRSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[C@H](C)[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341879443 1023513896 /nfs/dbraw/zinc/51/38/96/1023513896.db2.gz UVISNGHERZHEDH-NHYWBVRUSA-N 1 0 336.823 3.859 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000610809794 1023694636 /nfs/dbraw/zinc/69/46/36/1023694636.db2.gz GDXAVGHLCZEZNZ-DZGCQCFKSA-N 1 0 342.395 3.566 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000610805603 1023702025 /nfs/dbraw/zinc/70/20/25/1023702025.db2.gz WDUQEIZOMMOCIB-OAHLLOKOSA-N 1 0 325.412 3.570 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc([N+](=O)[O-])c(C(C)=O)c1)c1ccco1 ZINC000341933145 1023706431 /nfs/dbraw/zinc/70/64/31/1023706431.db2.gz VGBCOAJYPGEJIX-KRWDZBQOSA-N 1 0 345.399 3.885 20 5 EHBDRO Cc1cc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)ccc1C[NH+](C)C ZINC000458313744 1023916505 /nfs/dbraw/zinc/91/65/05/1023916505.db2.gz JQNWWUUUJXLCFL-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449754978 1033172227 /nfs/dbraw/zinc/17/22/27/1033172227.db2.gz LGODNOWIOREHSQ-SAABIXHNSA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1cccc(Cl)c1Cl ZINC000602803767 1033175772 /nfs/dbraw/zinc/17/57/72/1033175772.db2.gz DJXZDOYCAFDMRO-SECBINFHSA-N 1 0 343.214 3.757 20 5 EHBDRO CC(C)(C)C[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769839 1033182942 /nfs/dbraw/zinc/18/29/42/1033182942.db2.gz COYCVBHBQCCXKR-CYBMUJFWSA-N 1 0 334.416 3.719 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CC(C)C)C1CCCC1 ZINC000434902163 1024493265 /nfs/dbraw/zinc/49/32/65/1024493265.db2.gz AZLHKJKQGASNJG-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2CSC2)ccc1Oc1ccc(F)cc1 ZINC000895422823 1024497596 /nfs/dbraw/zinc/49/75/96/1024497596.db2.gz PHAGAZFGPCVTGS-UHFFFAOYSA-N 1 0 348.399 3.979 20 5 EHBDRO Cc1cccc(C)c1[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893819 1024501110 /nfs/dbraw/zinc/50/11/10/1024501110.db2.gz MUWINFAPGHEBSM-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc2c(c1)CCO2)c1cccc([N+](=O)[O-])c1 ZINC000342261339 1024606343 /nfs/dbraw/zinc/60/63/43/1024606343.db2.gz AVWNIITYQFKPRM-SFHVURJKSA-N 1 0 326.396 3.813 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc2c(c1)CCO2)c1cccc([N+](=O)[O-])c1 ZINC000342261334 1024606533 /nfs/dbraw/zinc/60/65/33/1024606533.db2.gz AVWNIITYQFKPRM-GOSISDBHSA-N 1 0 326.396 3.813 20 5 EHBDRO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000895658153 1024694825 /nfs/dbraw/zinc/69/48/25/1024694825.db2.gz IDCJCQICACGPKC-XSZJWBAASA-N 1 0 326.396 3.710 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000895666925 1024713873 /nfs/dbraw/zinc/71/38/73/1024713873.db2.gz YXNUBHYQDDVDER-CQSZACIVSA-N 1 0 348.786 3.740 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000539074598 1024740195 /nfs/dbraw/zinc/74/01/95/1024740195.db2.gz UOOKZEPKTBIJFQ-GOSISDBHSA-N 1 0 339.439 3.772 20 5 EHBDRO Cc1c(C[N@H+](C)CCCOc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000520784024 1024770326 /nfs/dbraw/zinc/77/03/26/1024770326.db2.gz JTRWYUBSGZZAOA-UHFFFAOYSA-N 1 0 332.375 3.943 20 5 EHBDRO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c2ccccc21 ZINC000185386675 1024919839 /nfs/dbraw/zinc/91/98/39/1024919839.db2.gz HJCAWOAVLUTHCW-LBPRGKRZSA-N 1 0 344.802 3.949 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346608292 1024948475 /nfs/dbraw/zinc/94/84/75/1024948475.db2.gz PEWDRAOJZHFCDF-QAPCUYQASA-N 1 0 332.400 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)cc2F)c1C ZINC000897972536 1033248795 /nfs/dbraw/zinc/24/87/95/1033248795.db2.gz RLNPEBIRQHXNDS-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2ccccc2[nH]c1=O ZINC000511068314 1025205805 /nfs/dbraw/zinc/20/58/05/1025205805.db2.gz ZLJVHMCHIFDJMS-UHFFFAOYSA-N 1 0 337.379 3.523 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000574530522 1033274354 /nfs/dbraw/zinc/27/43/54/1033274354.db2.gz BORYFPCPGXLAQG-LJQANCHMSA-N 1 0 348.406 3.617 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000346933795 1025326347 /nfs/dbraw/zinc/32/63/47/1025326347.db2.gz CHCUDDXEEFWGOF-ZWKOTPCHSA-N 1 0 348.830 3.893 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000436293313 1025556856 /nfs/dbraw/zinc/55/68/56/1025556856.db2.gz CSOHZFVCSWQACI-IIYDPXPESA-N 1 0 346.427 3.639 20 5 EHBDRO Cc1cc(C)cc(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451101776 1025562724 /nfs/dbraw/zinc/56/27/24/1025562724.db2.gz ABUODKWRQMRYMB-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000436307283 1025572382 /nfs/dbraw/zinc/57/23/82/1025572382.db2.gz KIUPCLDMCZQHHO-GHMZBOCLSA-N 1 0 346.353 3.541 20 5 EHBDRO CSc1ccccc1[C@H](C)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000281834557 1025579706 /nfs/dbraw/zinc/57/97/06/1025579706.db2.gz YAJSZAADHYBZRL-LRDDRELGSA-N 1 0 332.425 3.701 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436319135 1025582584 /nfs/dbraw/zinc/58/25/84/1025582584.db2.gz QPWCQKGTEGIZRN-LLVKDONJSA-N 1 0 346.353 3.541 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451153819 1025607987 /nfs/dbraw/zinc/60/79/87/1025607987.db2.gz JFQYNTXUIBMCDN-UHFFFAOYSA-N 1 0 338.835 3.765 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1)N(C)C ZINC000442997127 1025640018 /nfs/dbraw/zinc/64/00/18/1025640018.db2.gz YZNSVQYINLHLBN-KXBFYZLASA-N 1 0 327.428 3.684 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)N(C)C ZINC000443004422 1025656139 /nfs/dbraw/zinc/65/61/39/1025656139.db2.gz DCUCOYVGOFRNTM-JXFKEZNVSA-N 1 0 341.455 3.993 20 5 EHBDRO CC(C)c1ccc(CNC[C@@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000521821379 1025709789 /nfs/dbraw/zinc/70/97/89/1025709789.db2.gz OBKSBDAQOMJQEO-IBGZPJMESA-N 1 0 333.476 3.928 20 5 EHBDRO C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000439130073 1025790466 /nfs/dbraw/zinc/79/04/66/1025790466.db2.gz RTBBPLUDRQJGBJ-XHDPSFHLSA-N 1 0 334.807 3.747 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCCC[C@H]2O)s1 ZINC000074371284 1025918924 /nfs/dbraw/zinc/91/89/24/1025918924.db2.gz CMMIPSNUZWRCMZ-GDBMZVCRSA-N 1 0 332.425 3.716 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1CCC(C(C)C)CC1 ZINC000444217659 1025931103 /nfs/dbraw/zinc/93/11/03/1025931103.db2.gz WJSASXDYTJEMBK-UHFFFAOYSA-N 1 0 333.432 3.600 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@H+](Cc2ccccc2)C2CCCCC2)n1 ZINC000478439749 1026103347 /nfs/dbraw/zinc/10/33/47/1026103347.db2.gz YTZPMEUGXMNAKG-UHFFFAOYSA-N 1 0 328.416 3.626 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])nc2)cc1 ZINC000338999656 1026332293 /nfs/dbraw/zinc/33/22/93/1026332293.db2.gz ISLHUAMZGWXMMO-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO Cc1cc(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)ccc1[N+](=O)[O-] ZINC000530872375 1026373920 /nfs/dbraw/zinc/37/39/20/1026373920.db2.gz OVHRPKJDBJQBCB-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO Cc1ccccc1-n1nccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000475223033 1026400558 /nfs/dbraw/zinc/40/05/58/1026400558.db2.gz FDMHOJPEQZXXHN-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cc1[N+](=O)[O-] ZINC000530974895 1026448455 /nfs/dbraw/zinc/44/84/55/1026448455.db2.gz KWUWBEAFNYNQDY-VLXJIEOASA-N 1 0 342.395 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2cccs2)C2(CO)CCC2)cc1 ZINC000452060798 1026470556 /nfs/dbraw/zinc/47/05/56/1026470556.db2.gz NGZQBVGYJFYZHX-KRWDZBQOSA-N 1 0 346.452 3.692 20 5 EHBDRO Cc1cc(NC[C@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302161331 1026504708 /nfs/dbraw/zinc/50/47/08/1026504708.db2.gz JXKIVLIEOZGPKL-SFHVURJKSA-N 1 0 341.342 3.736 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](CCCO)[C@H]2CCCc3ccccc32)c1 ZINC000531164424 1026639123 /nfs/dbraw/zinc/63/91/23/1026639123.db2.gz NZMKIVXXADUGGY-FQEVSTJZSA-N 1 0 340.423 3.857 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@@]3(C2)OCc2ccccc23)c1 ZINC000186438475 1026901875 /nfs/dbraw/zinc/90/18/75/1026901875.db2.gz JTYPHWYMYWUGND-SFHVURJKSA-N 1 0 344.798 3.880 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]CC[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000237546418 1026905065 /nfs/dbraw/zinc/90/50/65/1026905065.db2.gz QSENHAYSZXHSKT-AWEZNQCLSA-N 1 0 346.452 3.915 20 5 EHBDRO C[C@@]1(CO)CCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237477195 1026957902 /nfs/dbraw/zinc/95/79/02/1026957902.db2.gz YKUBOZWVUIBTKS-ROUUACIJSA-N 1 0 346.452 3.964 20 5 EHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501150418 1027099498 /nfs/dbraw/zinc/09/94/98/1027099498.db2.gz MPIVSGKYQNWVTE-CQSZACIVSA-N 1 0 333.432 3.824 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000183808540 1027111038 /nfs/dbraw/zinc/11/10/38/1027111038.db2.gz WQVWOAYOXDANLM-LBPRGKRZSA-N 1 0 347.802 3.755 20 5 EHBDRO COCC1([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CC1 ZINC000531701805 1027225008 /nfs/dbraw/zinc/22/50/08/1027225008.db2.gz JXMRIAAQBBCFJI-UHFFFAOYSA-N 1 0 346.358 3.795 20 5 EHBDRO C[NH+](C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccco1 ZINC000729629932 1027372068 /nfs/dbraw/zinc/37/20/68/1027372068.db2.gz QXKCHFIQCXWOQY-GFCCVEGCSA-N 1 0 332.385 3.512 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178652627 1027374505 /nfs/dbraw/zinc/37/45/05/1027374505.db2.gz BUWFDUQOMSHNAZ-PKOBYXMFSA-N 1 0 328.412 3.802 20 5 EHBDRO Cc1cc(N2CCC3(CC[NH2+]C3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000420262025 1027423494 /nfs/dbraw/zinc/42/34/94/1027423494.db2.gz QYWJFRZIQQJBNA-UHFFFAOYSA-N 1 0 343.349 3.502 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000420621018 1027662016 /nfs/dbraw/zinc/66/20/16/1027662016.db2.gz CHMKPEXBBGVOAA-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO Cc1sc(C(=O)NC[C@H]([NH3+])c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000151981080 1027694516 /nfs/dbraw/zinc/69/45/16/1027694516.db2.gz YVAZMZNQGCFDCO-AWEZNQCLSA-N 1 0 347.440 3.518 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(Cc2cccs2)[C@H]2C=C[C@H](CO)C2)c1 ZINC000347330984 1027710894 /nfs/dbraw/zinc/71/08/94/1027710894.db2.gz HXZWHAHNRKNKHR-HOTGVXAUSA-N 1 0 344.436 3.596 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC1(O)CCCCC1 ZINC000513786667 1027712614 /nfs/dbraw/zinc/71/26/14/1027712614.db2.gz LBYWRKCHBHLHBS-RDJZCZTQSA-N 1 0 332.444 3.591 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CC1(O)CCCCC1 ZINC000513786666 1027713008 /nfs/dbraw/zinc/71/30/08/1027713008.db2.gz LBYWRKCHBHLHBS-NVXWUHKLSA-N 1 0 332.444 3.591 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000178682898 1027870863 /nfs/dbraw/zinc/87/08/63/1027870863.db2.gz RLQIJHSZSDBTOM-FZKCQIBNSA-N 1 0 347.459 3.732 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](CC(F)(F)F)C1 ZINC000420941970 1027883998 /nfs/dbraw/zinc/88/39/98/1027883998.db2.gz GODBTWNUYPXGPV-NSHDSACASA-N 1 0 332.322 3.768 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@H](CC(F)F)c2ccccc2)c1 ZINC000421000854 1027980291 /nfs/dbraw/zinc/98/02/91/1027980291.db2.gz WOCSYYYPPLEVJL-MRXNPFEDSA-N 1 0 336.338 3.960 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648909 1028111460 /nfs/dbraw/zinc/11/14/60/1028111460.db2.gz OUZKRECSXAJAKA-CZUORRHYSA-N 1 0 336.395 3.849 20 5 EHBDRO C[N@H+](CCc1ccc(Cl)cc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444650158 1028113243 /nfs/dbraw/zinc/11/32/43/1028113243.db2.gz NTJVKZQISMTLGS-UHFFFAOYSA-N 1 0 344.802 3.799 20 5 EHBDRO COCc1ccccc1/C=C(/C)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000509972475 1028137871 /nfs/dbraw/zinc/13/78/71/1028137871.db2.gz QLTNZFGCNJJCSO-PTNGSMBKSA-N 1 0 326.396 3.934 20 5 EHBDRO Cc1cc(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2)ccc1F ZINC000444743892 1028228994 /nfs/dbraw/zinc/22/89/94/1028228994.db2.gz NGEPAXDKRHNRDS-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@@H](C(C)C)C1 ZINC000444749216 1028235159 /nfs/dbraw/zinc/23/51/59/1028235159.db2.gz QOPYCIOTSDTLHZ-OAHLLOKOSA-N 1 0 333.432 3.600 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)c1ccc2c(c1)CCC2 ZINC000178728900 1028377689 /nfs/dbraw/zinc/37/76/89/1028377689.db2.gz OSOVBAYUJVYRMD-CYBMUJFWSA-N 1 0 326.396 3.943 20 5 EHBDRO [NH3+][C@@H]1CCC[C@@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374185 1028380134 /nfs/dbraw/zinc/38/01/34/1028380134.db2.gz HZADJUBNGGCULX-ZHALLVOQSA-N 1 0 325.412 3.544 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(COC)CCC1 ZINC000502593388 1028410501 /nfs/dbraw/zinc/41/05/01/1028410501.db2.gz CIFSZMQURHTYIM-CQSZACIVSA-N 1 0 338.473 3.872 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615672 1028484262 /nfs/dbraw/zinc/48/42/62/1028484262.db2.gz ZTVQYZUBZNPVGL-KFWWJZLASA-N 1 0 335.423 3.571 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+][C@H](CO)c1ccccc1 ZINC000130206703 1028776525 /nfs/dbraw/zinc/77/65/25/1028776525.db2.gz QVVRQNNWCZEGAY-NZSAHSFTSA-N 1 0 340.423 3.629 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H](CO)c1ccccc1 ZINC000130209002 1028777648 /nfs/dbraw/zinc/77/76/48/1028777648.db2.gz QVVRQNNWCZEGAY-YTQUADARSA-N 1 0 340.423 3.629 20 5 EHBDRO C[C@H]1CC[C@H]([N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429593000 1028882767 /nfs/dbraw/zinc/88/27/67/1028882767.db2.gz RHUGFYJFCTXPGQ-ZFWWWQNUSA-N 1 0 329.400 3.913 20 5 EHBDRO CO[C@H]1C[C@H]2C[C@@H]([NH2+]CCCCc3ccc([N+](=O)[O-])cc3)C[C@H]2C1 ZINC000424307722 1028988754 /nfs/dbraw/zinc/98/87/54/1028988754.db2.gz YCZNFASKDSYMDJ-LRNSACPNSA-N 1 0 332.444 3.711 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000504900447 1029025948 /nfs/dbraw/zinc/02/59/48/1029025948.db2.gz YDVQJCLQMRLQPN-OWCLPIDISA-N 1 0 349.500 3.682 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000504900445 1029027516 /nfs/dbraw/zinc/02/75/16/1029027516.db2.gz YDVQJCLQMRLQPN-BZUAXINKSA-N 1 0 349.500 3.682 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000532970068 1029119503 /nfs/dbraw/zinc/11/95/03/1029119503.db2.gz UKWAFLRJDVOPSI-AWEZNQCLSA-N 1 0 339.823 3.697 20 5 EHBDRO O=C(C[N@H+](CC1CC1)C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000532955036 1029121978 /nfs/dbraw/zinc/12/19/78/1029121978.db2.gz OSYXTCFKXVMIEX-UHFFFAOYSA-N 1 0 331.416 3.578 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC4(CCCC4)C3)n2)cc1 ZINC000615000609 1029213194 /nfs/dbraw/zinc/21/31/94/1029213194.db2.gz JFTPDDPYDZWCJA-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO COc1cc(C[NH2+][C@@H](CC(F)(F)F)C(C)C)c([N+](=O)[O-])cc1F ZINC000445903592 1029224474 /nfs/dbraw/zinc/22/44/74/1029224474.db2.gz MBADSPAJHVKEBI-NSHDSACASA-N 1 0 338.301 3.809 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCCC(C)(C)C1 ZINC000446075583 1029391876 /nfs/dbraw/zinc/39/18/76/1029391876.db2.gz ZONLGULYEGXGSR-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192492635 1029708768 /nfs/dbraw/zinc/70/87/68/1029708768.db2.gz GGZIGXVNTFJLLM-CYBMUJFWSA-N 1 0 338.477 3.532 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnn(C)c1 ZINC000525183403 1029733054 /nfs/dbraw/zinc/73/30/54/1029733054.db2.gz IQFGEVVGWBAJGD-LBPRGKRZSA-N 1 0 342.424 3.908 20 5 EHBDRO C[C@@]1(c2ccccc2)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446715755 1029768711 /nfs/dbraw/zinc/76/87/11/1029768711.db2.gz FDWDGULNQNHVQD-LJQANCHMSA-N 1 0 337.379 3.900 20 5 EHBDRO Cc1ccc(C2CC([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)cc1 ZINC000446829631 1029813410 /nfs/dbraw/zinc/81/34/10/1029813410.db2.gz JZGQICMPBLRQSN-UHFFFAOYSA-N 1 0 336.395 3.815 20 5 EHBDRO Cc1cc2[nH]c(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2c(C)c1 ZINC000446841174 1029822300 /nfs/dbraw/zinc/82/23/00/1029822300.db2.gz MVGPPNALQUUNLR-UHFFFAOYSA-N 1 0 349.394 3.859 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@H](Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000533820159 1029879685 /nfs/dbraw/zinc/87/96/85/1029879685.db2.gz UACJZUQGTUBNNV-CQSZACIVSA-N 1 0 349.337 3.795 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000120258082 1029929462 /nfs/dbraw/zinc/92/94/62/1029929462.db2.gz UKFOADFITYVAEJ-LIRRHRJNSA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H](Cc2ccccc2)C1 ZINC000525636776 1029987996 /nfs/dbraw/zinc/98/79/96/1029987996.db2.gz LJVIFZZPLRZQQS-QGZVFWFLSA-N 1 0 326.396 3.538 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272894 1030039158 /nfs/dbraw/zinc/03/91/58/1030039158.db2.gz VXJHWFBFDQRZTJ-MFKMUULPSA-N 1 0 338.795 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCOC3(CCC3)C1)CCC2 ZINC000453308527 1030079988 /nfs/dbraw/zinc/07/99/88/1030079988.db2.gz CQYAHZQDBMGJPG-KDOFPFPSSA-N 1 0 330.428 3.911 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000531941470 1030109854 /nfs/dbraw/zinc/10/98/54/1030109854.db2.gz OPSREFARAYTPFC-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO Cc1cccc(C[NH+]2CCN([C@@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000441263283 1030189679 /nfs/dbraw/zinc/18/96/79/1030189679.db2.gz QQAYEBKEFGMGAX-KRWDZBQOSA-N 1 0 339.439 3.782 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCC1 ZINC000583604380 1030266191 /nfs/dbraw/zinc/26/61/91/1030266191.db2.gz MWXQUWDIQZVKFA-RBUKOAKNSA-N 1 0 331.460 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1ccc(F)cc1)CCC2 ZINC000447542928 1030278498 /nfs/dbraw/zinc/27/84/98/1030278498.db2.gz KNKPDLZMNUBRJI-GOSISDBHSA-N 1 0 330.359 3.780 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+][C@@H]2CCSC2)cc1[N+](=O)[O-] ZINC000525997685 1030294160 /nfs/dbraw/zinc/29/41/60/1030294160.db2.gz QWWHOOGYQNSOHF-OAHLLOKOSA-N 1 0 343.452 3.958 20 5 EHBDRO CO[C@@H](CC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000447598302 1030337347 /nfs/dbraw/zinc/33/73/47/1030337347.db2.gz HOEUVHTWEINCNG-KGLIPLIRSA-N 1 0 332.322 3.529 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865112 1030399521 /nfs/dbraw/zinc/39/95/21/1030399521.db2.gz LXZZZZREEDBHIW-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2ccccc21 ZINC000520428109 1030499668 /nfs/dbraw/zinc/49/96/68/1030499668.db2.gz KXXGAQUGLQZWQR-CYBMUJFWSA-N 1 0 325.368 3.847 20 5 EHBDRO CCc1ccc(-c2nc(-c3ccn4c[nH+]cc4c3)no2)cc1[N+](=O)[O-] ZINC000447967683 1030616329 /nfs/dbraw/zinc/61/63/29/1030616329.db2.gz ZTTDOQFBCAXLDU-UHFFFAOYSA-N 1 0 335.323 3.522 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCCCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000448022173 1030653833 /nfs/dbraw/zinc/65/38/33/1030653833.db2.gz MUIZICMQJXARAO-SFHVURJKSA-N 1 0 332.400 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[N@H+](CCCCOc1ccccc1)C2 ZINC000527116961 1030662898 /nfs/dbraw/zinc/66/28/98/1030662898.db2.gz NPDGGGXOWCBWHX-UHFFFAOYSA-N 1 0 326.396 3.812 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000482881636 1030787790 /nfs/dbraw/zinc/78/77/90/1030787790.db2.gz DQYMNIKSRBDWAP-LLVKDONJSA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000249197428 1030796570 /nfs/dbraw/zinc/79/65/70/1030796570.db2.gz RPMZEGXHOQCSJL-NJZAAPMLSA-N 1 0 346.349 3.729 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cn2ccccc2n1 ZINC000550918196 1030799203 /nfs/dbraw/zinc/79/92/03/1030799203.db2.gz YYWTXKXHCWOUNJ-GFCCVEGCSA-N 1 0 344.802 3.789 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000160559052 1030854966 /nfs/dbraw/zinc/85/49/66/1030854966.db2.gz JFFNETKOKOLSJX-CQSZACIVSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@@H+]1C ZINC000343436000 1030868033 /nfs/dbraw/zinc/86/80/33/1030868033.db2.gz LJGSGCBFLROKBB-AUUYWEPGSA-N 1 0 333.435 3.601 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026207664 1031000327 /nfs/dbraw/zinc/00/03/27/1031000327.db2.gz MPETWIJSCVZCBP-OAHLLOKOSA-N 1 0 341.411 3.671 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1)c1cccc([N+](=O)[O-])c1 ZINC000926916311 1031272771 /nfs/dbraw/zinc/27/27/71/1031272771.db2.gz PGQBFGOODABKHJ-ZLKJLUDKSA-N 1 0 332.322 3.745 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H](C[NH+]3CCCC3)C2)cc1C(F)(F)F ZINC000161100290 1031319805 /nfs/dbraw/zinc/31/98/05/1031319805.db2.gz NJMBGDJYMLOYDE-GFCCVEGCSA-N 1 0 343.349 3.536 20 5 EHBDRO CC[C@H](N[C@H]1CC[N@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807234 1031342221 /nfs/dbraw/zinc/34/22/21/1031342221.db2.gz LZSWMABKDKUVPZ-HKUYNNGSSA-N 1 0 331.460 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](CO)CC1CCCC1)CCC2 ZINC000343590926 1031526039 /nfs/dbraw/zinc/52/60/39/1031526039.db2.gz HNCSSTBRWKMDBG-BEFAXECRSA-N 1 0 332.444 3.751 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000475721012 1031529953 /nfs/dbraw/zinc/52/99/53/1031529953.db2.gz ZQTCPRFYHHFFOQ-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCCCC34CC[NH2+]CC4)n2)c1 ZINC000904081588 1031714540 /nfs/dbraw/zinc/71/45/40/1031714540.db2.gz NNCXRWGWXIBVMC-HNNXBMFYSA-N 1 0 342.399 3.672 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000537771230 1031905773 /nfs/dbraw/zinc/90/57/73/1031905773.db2.gz HSDXGJFPZTUPLC-KGLIPLIRSA-N 1 0 330.384 3.760 20 5 EHBDRO COc1ccccc1OC[C@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537941104 1032025527 /nfs/dbraw/zinc/02/55/27/1032025527.db2.gz IETJNCYFKUTPCW-HUUCEWRRSA-N 1 0 344.411 3.969 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCOc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000537955279 1032043834 /nfs/dbraw/zinc/04/38/34/1032043834.db2.gz PMRAHJWXHSXHRD-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO C[C@@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000173439599 1033333359 /nfs/dbraw/zinc/33/33/59/1033333359.db2.gz HCVPCBLNLDGWEO-WBMJQRKESA-N 1 0 349.431 3.549 20 5 EHBDRO C[C@H]([NH2+][C@H](CNC(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000173439614 1033334016 /nfs/dbraw/zinc/33/40/16/1033334016.db2.gz HCVPCBLNLDGWEO-BLLLJJGKSA-N 1 0 349.431 3.549 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000594516717 1033422605 /nfs/dbraw/zinc/42/26/05/1033422605.db2.gz CWGJDTPVHJNWLK-GUYCJALGSA-N 1 0 346.814 3.601 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000594515335 1033423073 /nfs/dbraw/zinc/42/30/73/1033423073.db2.gz NVSQIRPVUHDZFX-ACJLOTCBSA-N 1 0 325.412 3.933 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cn1nc(C)c2ccc([N+](=O)[O-])cc21 ZINC000761289203 1033500084 /nfs/dbraw/zinc/50/00/84/1033500084.db2.gz DHUDKSQQBDRODN-UHFFFAOYSA-N 1 0 344.440 3.837 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923929 1033546503 /nfs/dbraw/zinc/54/65/03/1033546503.db2.gz HADRBSBWYULAQS-AUUYWEPGSA-N 1 0 342.395 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(OC3CC3)c2F)cc1 ZINC000594921678 1033546608 /nfs/dbraw/zinc/54/66/08/1033546608.db2.gz QUURDIJYOIPAAY-UHFFFAOYSA-N 1 0 330.359 3.607 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925205 1033547037 /nfs/dbraw/zinc/54/70/37/1033547037.db2.gz MQHKISIOULAGEG-CABCVRRESA-N 1 0 344.411 3.859 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@@H]1CCN(c2ccccc2Cl)C1 ZINC000594953817 1033595429 /nfs/dbraw/zinc/59/54/29/1033595429.db2.gz IBMXQMKAGYYIKU-AWEZNQCLSA-N 1 0 345.830 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H](CO)C3CCC3)s2)cc1 ZINC000594955846 1033595832 /nfs/dbraw/zinc/59/58/32/1033595832.db2.gz FPPATGYGSNGLHL-MRXNPFEDSA-N 1 0 332.425 3.574 20 5 EHBDRO COC1CC(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000594965233 1033603784 /nfs/dbraw/zinc/60/37/84/1033603784.db2.gz STPXPVBNKAEQMS-UHFFFAOYSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cccnc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000595067168 1033643558 /nfs/dbraw/zinc/64/35/58/1033643558.db2.gz KEEJTMZBNQZZMU-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000595040282 1033661469 /nfs/dbraw/zinc/66/14/69/1033661469.db2.gz GFVISMQTUSFHDW-UONOGXRCSA-N 1 0 334.416 3.603 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599019259 1033667178 /nfs/dbraw/zinc/66/71/78/1033667178.db2.gz CRISEDJTJZXVDK-GOSISDBHSA-N 1 0 327.384 3.548 20 5 EHBDRO C[C@H](O)[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000595103981 1033690853 /nfs/dbraw/zinc/69/08/53/1033690853.db2.gz PWURQELHDJSDDA-MJXNMMHHSA-N 1 0 326.396 3.684 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nccn1C ZINC000595108458 1033694023 /nfs/dbraw/zinc/69/40/23/1033694023.db2.gz QBQXWKHEEMIVBY-OLZOCXBDSA-N 1 0 334.445 3.550 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599058116 1033698683 /nfs/dbraw/zinc/69/86/83/1033698683.db2.gz REFXUFPBAQFOMR-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]1Cc1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000595084704 1033699254 /nfs/dbraw/zinc/69/92/54/1033699254.db2.gz HZJVCVFHWGDSHY-SNRMKQJTSA-N 1 0 342.443 3.780 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061970 1033701111 /nfs/dbraw/zinc/70/11/11/1033701111.db2.gz MXIKLEZSXSQVJS-KUHUBIRLSA-N 1 0 344.411 3.950 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])nc1 ZINC000599068339 1033710533 /nfs/dbraw/zinc/71/05/33/1033710533.db2.gz NGFGRHOMNYDFDW-INIZCTEOSA-N 1 0 325.412 3.853 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000595351751 1033776320 /nfs/dbraw/zinc/77/63/20/1033776320.db2.gz NRIJTCDZSHPPRJ-INIZCTEOSA-N 1 0 329.400 3.879 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599164702 1033779930 /nfs/dbraw/zinc/77/99/30/1033779930.db2.gz KDAZBASUXXDAEY-HNNXBMFYSA-N 1 0 331.416 3.616 20 5 EHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441567 1033805381 /nfs/dbraw/zinc/80/53/81/1033805381.db2.gz WTMIGHUIDWQKQX-JKSUJKDBSA-N 1 0 329.400 3.782 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000550665498 1033834964 /nfs/dbraw/zinc/83/49/64/1033834964.db2.gz KRUQTVFYVBMCOE-ICSRJNTNSA-N 1 0 339.439 3.562 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCCC12CCCCC2 ZINC000595603637 1033918319 /nfs/dbraw/zinc/91/83/19/1033918319.db2.gz ITQUHCPPMXDPAZ-INIZCTEOSA-N 1 0 345.443 3.934 20 5 EHBDRO Cc1nccc([C@H]2CCC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834320 1033958870 /nfs/dbraw/zinc/95/88/70/1033958870.db2.gz QNUWPUOEJHIVET-CJNGLKHVSA-N 1 0 326.400 3.634 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000603859573 1033984536 /nfs/dbraw/zinc/98/45/36/1033984536.db2.gz CHFJCKHRSGXOMX-HUUCEWRRSA-N 1 0 342.443 3.923 20 5 EHBDRO COCC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(C)cc1C ZINC000603894826 1034015256 /nfs/dbraw/zinc/01/52/56/1034015256.db2.gz VDJYZFDGZJOBMM-UHFFFAOYSA-N 1 0 328.412 3.860 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594354 1034034540 /nfs/dbraw/zinc/03/45/40/1034034540.db2.gz GGPISTBYGQZJIB-CPUCHLNUSA-N 1 0 348.443 3.956 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000599642111 1034066795 /nfs/dbraw/zinc/06/67/95/1034066795.db2.gz ZYCAGQDQAVWOMV-QGZVFWFLSA-N 1 0 341.411 3.551 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Nc2cc[nH]c(=O)c2[N+](=O)[O-])cc1 ZINC000596080909 1034073540 /nfs/dbraw/zinc/07/35/40/1034073540.db2.gz PMGOPXZSZYGHPK-CYBMUJFWSA-N 1 0 342.399 3.813 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cnccc1C(F)(F)F ZINC000596118300 1034081744 /nfs/dbraw/zinc/08/17/44/1034081744.db2.gz VTMDYEKFCLBENL-CQSZACIVSA-N 1 0 337.301 3.786 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC=CO3)o2)c([N+](=O)[O-])c1 ZINC000780569754 1034125094 /nfs/dbraw/zinc/12/50/94/1034125094.db2.gz IQMCQQBATOEFGP-AWEZNQCLSA-N 1 0 344.367 3.646 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783667508 1034244211 /nfs/dbraw/zinc/24/42/11/1034244211.db2.gz RHXDPQNGYPVGEP-ZDUSSCGKSA-N 1 0 338.791 3.579 20 5 EHBDRO C[C@@H](NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413041 1034298940 /nfs/dbraw/zinc/29/89/40/1034298940.db2.gz SKMDWINSCADWGZ-RDTXWAMCSA-N 1 0 345.443 3.569 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000604484499 1034387736 /nfs/dbraw/zinc/38/77/36/1034387736.db2.gz XTIZHPBZDJBEGL-INIZCTEOSA-N 1 0 328.368 3.516 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](COC)C(C)C ZINC000534329516 1034403685 /nfs/dbraw/zinc/40/36/85/1034403685.db2.gz AZRZRRZRFZCPRM-KBPBESRZSA-N 1 0 326.462 3.726 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2c(C)nn(CC)c2C)cc1[N+](=O)[O-] ZINC000534328675 1034403709 /nfs/dbraw/zinc/40/37/09/1034403709.db2.gz FITAHGZMOIPMLJ-GFCCVEGCSA-N 1 0 346.431 3.678 20 5 EHBDRO CC[N@H+](CCCNC(=O)c1cccc(C)c1[N+](=O)[O-])C1CCCCC1 ZINC000593252378 1034476769 /nfs/dbraw/zinc/47/67/69/1034476769.db2.gz YDHDUAGXVXUSQC-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO C[C@H]1C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H](C)C1O ZINC000597207652 1034592332 /nfs/dbraw/zinc/59/23/32/1034592332.db2.gz ZUQOUALIVUGADK-STQMWFEESA-N 1 0 346.452 3.772 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CNc2ccccc2C1 ZINC000593314352 1034627817 /nfs/dbraw/zinc/62/78/17/1034627817.db2.gz DFYSZVQOQMDPCQ-RHSMWYFYSA-N 1 0 325.412 3.542 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000451961646 1034634070 /nfs/dbraw/zinc/63/40/70/1034634070.db2.gz DUUZEKKEGVTDSL-KRWDZBQOSA-N 1 0 336.457 3.713 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@@H]3OCCC[C@@H]23)c2ccccc2)c1 ZINC000251436082 1034646738 /nfs/dbraw/zinc/64/67/38/1034646738.db2.gz AVFBLVKAOMQSFP-ZGXWSNOMSA-N 1 0 338.407 3.841 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC[C@@H](C)C1 ZINC000480613168 1034679432 /nfs/dbraw/zinc/67/94/32/1034679432.db2.gz MMCWZXDCVREWJW-MDZRGWNJSA-N 1 0 345.487 3.626 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000450683044 1034682749 /nfs/dbraw/zinc/68/27/49/1034682749.db2.gz PEUVPRFNMWUCGM-CCKFTAQKSA-N 1 0 328.412 3.800 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC[C@H]1C ZINC000480622396 1034694515 /nfs/dbraw/zinc/69/45/15/1034694515.db2.gz XYWCUHSQXJTGRH-JTDSTZFVSA-N 1 0 345.487 3.768 20 5 EHBDRO COCC[C@@H](c1ccccc1)[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548928394 1034900790 /nfs/dbraw/zinc/90/07/90/1034900790.db2.gz QBLXSTUKZZYGEG-IBGZPJMESA-N 1 0 328.412 3.847 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000167501274 1034939478 /nfs/dbraw/zinc/93/94/78/1034939478.db2.gz KGDZGDHGYZQDTE-TZMCWYRMSA-N 1 0 347.365 3.803 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000463447791 1035514665 /nfs/dbraw/zinc/51/46/65/1035514665.db2.gz ZTZGDDGMTKVSNN-QGZVFWFLSA-N 1 0 345.443 3.934 20 5 EHBDRO Cc1ccnc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c1[N+](=O)[O-] ZINC000078338235 1035523699 /nfs/dbraw/zinc/52/36/99/1035523699.db2.gz LUXLRCNWWDHECX-CJNGLKHVSA-N 1 0 346.456 3.855 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CSC[C@@H]1C ZINC000571528591 1035544908 /nfs/dbraw/zinc/54/49/08/1035544908.db2.gz YSVKVPSZRMFLAC-XQQFMLRXSA-N 1 0 326.487 3.807 20 5 EHBDRO C[C@@H](C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000588214986 1035825151 /nfs/dbraw/zinc/82/51/51/1035825151.db2.gz WDWKSDOGXADMAB-GJZGRUSLSA-N 1 0 346.402 3.720 20 5 EHBDRO CCOc1cc(C[NH2+]C2(c3ccc(F)cc3)CC2)ccc1[N+](=O)[O-] ZINC000492531624 1035934461 /nfs/dbraw/zinc/93/44/61/1035934461.db2.gz GOCPPYLKVMALJG-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000414204104 1036051455 /nfs/dbraw/zinc/05/14/55/1036051455.db2.gz ZYNOUJYWGAZQSE-HIFRSBDPSA-N 1 0 326.396 3.730 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H](O)C1CC1 ZINC000589197041 1036304410 /nfs/dbraw/zinc/30/44/10/1036304410.db2.gz VGJGAQJHJOCOTR-INIZCTEOSA-N 1 0 332.425 3.526 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC(O)(CC)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541549006 1036441846 /nfs/dbraw/zinc/44/18/46/1036441846.db2.gz KTSUDCVOBBQCPH-GOSISDBHSA-N 1 0 346.427 3.980 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000572898100 1036531868 /nfs/dbraw/zinc/53/18/68/1036531868.db2.gz LFBMXHPQLLNHKW-BFUOFWGJSA-N 1 0 341.411 3.901 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCc2ccncc2)c2ccccc2)c1 ZINC000493074924 1036640763 /nfs/dbraw/zinc/64/07/63/1036640763.db2.gz AJDAXAIHVORJBE-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO C[C@@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCOC1 ZINC000493173100 1036842944 /nfs/dbraw/zinc/84/29/44/1036842944.db2.gz CJYOKLHNHHAPCM-OALUTQOASA-N 1 0 326.396 3.700 20 5 EHBDRO C[C@H]1CC[C@@]2(CC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169927 1036916924 /nfs/dbraw/zinc/91/69/24/1036916924.db2.gz VLZICBROBABZKZ-SCLBCKFNSA-N 1 0 349.406 3.575 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC([NH+]3CCCCC3)CC2)cc1Cl ZINC000761507033 1037076494 /nfs/dbraw/zinc/07/64/94/1037076494.db2.gz RMIOMSYBPPOVOP-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO [NH3+]CCCN(Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1F ZINC000761535036 1037117820 /nfs/dbraw/zinc/11/78/20/1037117820.db2.gz VWWVDMVZINLBGT-UHFFFAOYSA-N 1 0 337.782 3.743 20 5 EHBDRO CC[C@@H](O)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850729 1037280764 /nfs/dbraw/zinc/28/07/64/1037280764.db2.gz OVBWTWHPUMFJCJ-YRVHBARZSA-N 1 0 340.423 3.881 20 5 EHBDRO CCCOc1ccc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000188795877 1037296152 /nfs/dbraw/zinc/29/61/52/1037296152.db2.gz JMGXVHZENORVRI-UHFFFAOYSA-N 1 0 344.411 3.990 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000386376619 1037318978 /nfs/dbraw/zinc/31/89/78/1037318978.db2.gz SONDOXPHDAAXQS-KRWDZBQOSA-N 1 0 340.427 3.704 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2CCOCC2)s1 ZINC000171052168 1037431744 /nfs/dbraw/zinc/43/17/44/1037431744.db2.gz PUIBOMJHRANWEJ-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ncccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000181322354 1037510066 /nfs/dbraw/zinc/51/00/66/1037510066.db2.gz CPJSDHXGGNPSCI-HNNXBMFYSA-N 1 0 335.791 3.763 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCOC1 ZINC000462879861 1037510027 /nfs/dbraw/zinc/51/00/27/1037510027.db2.gz ZXISFSIMGZXSBO-AWEZNQCLSA-N 1 0 330.384 3.854 20 5 EHBDRO Cc1c(C[NH+]2CC(Cc3ccc(F)c(F)c3)C2)cccc1[N+](=O)[O-] ZINC000760900583 1037691458 /nfs/dbraw/zinc/69/14/58/1037691458.db2.gz FUDPSENJIIVINT-UHFFFAOYSA-N 1 0 332.350 3.856 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cccc([N+](=O)[O-])c2C)c1 ZINC000031589027 1037712834 /nfs/dbraw/zinc/71/28/34/1037712834.db2.gz JLZHSGASADOWIY-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC000046072853 1037744087 /nfs/dbraw/zinc/74/40/87/1037744087.db2.gz JVCGPOLEUDUFEE-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO CC[C@@H](O)CCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004002 1037766804 /nfs/dbraw/zinc/76/68/04/1037766804.db2.gz NJAOAEYCPAZWEV-RTBURBONSA-N 1 0 328.412 3.825 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000463200739 1037892269 /nfs/dbraw/zinc/89/22/69/1037892269.db2.gz UEYNQBMGLSOFOT-RCCFBDPRSA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CC=CC2)cc1 ZINC000592175284 1037916394 /nfs/dbraw/zinc/91/63/94/1037916394.db2.gz KDBSMQFLKZABBM-IBGZPJMESA-N 1 0 338.407 3.754 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCOc2ncccc2Cl)cccc1[N+](=O)[O-] ZINC000090408353 1038055060 /nfs/dbraw/zinc/05/50/60/1038055060.db2.gz IECHRIIOOCRNIS-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000467553706 1038365004 /nfs/dbraw/zinc/36/50/04/1038365004.db2.gz KHEJSCKKFSNPGU-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000538745614 1038510469 /nfs/dbraw/zinc/51/04/69/1038510469.db2.gz KFBXSKVIODDLME-GJZGRUSLSA-N 1 0 347.459 3.513 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000538777196 1038524182 /nfs/dbraw/zinc/52/41/82/1038524182.db2.gz GYDSSDMWSRYHII-QWHCGFSZSA-N 1 0 332.425 3.980 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)[C@H](C(C)C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000488052307 1038809557 /nfs/dbraw/zinc/80/95/57/1038809557.db2.gz CAAVDNCDDZIRIV-QAPCUYQASA-N 1 0 347.459 3.591 20 5 EHBDRO COc1cccc(C2=CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000479929175 1038906625 /nfs/dbraw/zinc/90/66/25/1038906625.db2.gz UKROUWJSVBBEET-UHFFFAOYSA-N 1 0 338.407 3.935 20 5 EHBDRO C[C@H](C[C@@H](O)c1cccs1)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268736 1038910815 /nfs/dbraw/zinc/91/08/15/1038910815.db2.gz YMZXDHSOBBCZGY-QMTHXVAHSA-N 1 0 340.832 3.912 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852335 1039156602 /nfs/dbraw/zinc/15/66/02/1039156602.db2.gz IIBVOHNXKMBGOF-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000488555052 1039266893 /nfs/dbraw/zinc/26/68/93/1039266893.db2.gz OUOXMRAVOCFHFY-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO CC[C@@](C)(O)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000111384852 1039309460 /nfs/dbraw/zinc/30/94/60/1039309460.db2.gz ADXPENOTQWCUJG-GOSISDBHSA-N 1 0 348.374 3.777 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cc1 ZINC000278827705 1039369328 /nfs/dbraw/zinc/36/93/28/1039369328.db2.gz UONXRRIKROOTIK-UHFFFAOYSA-N 1 0 340.301 3.912 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCSC1 ZINC000279934500 1039604611 /nfs/dbraw/zinc/60/46/11/1039604611.db2.gz JAMUPYSOECYOKJ-STQMWFEESA-N 1 0 326.487 3.808 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192827547 1039944358 /nfs/dbraw/zinc/94/43/58/1039944358.db2.gz PSZPQTGZAHGQFE-DJJJIMSYSA-N 1 0 326.396 3.899 20 5 EHBDRO O=C(CCCC[NH+]1CCCC1)N1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000912653158 1040069187 /nfs/dbraw/zinc/06/91/87/1040069187.db2.gz NXTYCLBMLIAEAG-UHFFFAOYSA-N 1 0 345.443 3.530 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(Nc3ncc(Cl)cc3[N+](=O)[O-])cccc21 ZINC000432927120 1040195471 /nfs/dbraw/zinc/19/54/71/1040195471.db2.gz GASUSMYISVCPIF-CYBMUJFWSA-N 1 0 348.790 3.772 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(Nc2cccc3c2OCC[C@@H]3[NH+](C)C)n1 ZINC000432926895 1040196401 /nfs/dbraw/zinc/19/64/01/1040196401.db2.gz DRGIWJWHWCUESW-HNNXBMFYSA-N 1 0 342.399 3.735 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000553582849 1040217658 /nfs/dbraw/zinc/21/76/58/1040217658.db2.gz DQHMWRIYWBDODN-LLVKDONJSA-N 1 0 332.231 3.822 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490064887 1040330185 /nfs/dbraw/zinc/33/01/85/1040330185.db2.gz IWGNVUAITJYTMZ-QGZVFWFLSA-N 1 0 341.411 3.550 20 5 EHBDRO CC[N@H+](CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490191575 1040395521 /nfs/dbraw/zinc/39/55/21/1040395521.db2.gz UQENBBDXYNAWED-FQEVSTJZSA-N 1 0 339.439 3.758 20 5 EHBDRO COc1cccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000479578216 1040401281 /nfs/dbraw/zinc/40/12/81/1040401281.db2.gz LHECTNYAYGBTRR-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)s1 ZINC000190350477 1040501583 /nfs/dbraw/zinc/50/15/83/1040501583.db2.gz ZKLSYVXIEAAJSM-FRFSOERESA-N 1 0 344.436 3.980 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@@H]1O ZINC000555420387 1040556859 /nfs/dbraw/zinc/55/68/59/1040556859.db2.gz GXVWRWVKWOIUED-NHYWBVRUSA-N 1 0 346.349 3.597 20 5 EHBDRO CC(C)(CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000174577733 1040696692 /nfs/dbraw/zinc/69/66/92/1040696692.db2.gz UYYJMHLNFIRKGK-UHFFFAOYSA-N 1 0 338.791 3.759 20 5 EHBDRO COC1(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCCC1 ZINC000487196871 1040783297 /nfs/dbraw/zinc/78/32/97/1040783297.db2.gz ZGPSCQGZNPNOTJ-UHFFFAOYSA-N 1 0 332.322 3.662 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000600198325 1040817917 /nfs/dbraw/zinc/81/79/17/1040817917.db2.gz WMOWPLBDTPRTQR-GOEBONIOSA-N 1 0 348.443 3.703 20 5 EHBDRO COc1cc(N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000569775644 1040821232 /nfs/dbraw/zinc/82/12/32/1040821232.db2.gz CSOANMCTILDFHS-ACJLOTCBSA-N 1 0 329.400 3.707 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)c(Cl)c1 ZINC000600213456 1040834401 /nfs/dbraw/zinc/83/44/01/1040834401.db2.gz GESTWNZQBMORMP-CYBMUJFWSA-N 1 0 332.787 3.943 20 5 EHBDRO CC[C@@H](CCO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000123873990 1041016066 /nfs/dbraw/zinc/01/60/66/1041016066.db2.gz KBDWTVNKJQANGH-HNNXBMFYSA-N 1 0 348.374 3.777 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1CCC(O)(c2ccccc2)CC1 ZINC000760650589 1041053858 /nfs/dbraw/zinc/05/38/58/1041053858.db2.gz RWOKTKPQEJACEK-UHFFFAOYSA-N 1 0 340.423 3.823 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCCN(c2ccccc2)C1 ZINC000433201789 1041055838 /nfs/dbraw/zinc/05/58/38/1041055838.db2.gz YFJFBHXVKIOZEK-KRWDZBQOSA-N 1 0 339.439 3.909 20 5 EHBDRO O=[N+]([O-])c1ccc(S[C@H]2CCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000425289225 1041098078 /nfs/dbraw/zinc/09/80/78/1041098078.db2.gz ZCYUOCBMWBBVOP-INIZCTEOSA-N 1 0 329.425 3.747 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000453431313 1041102565 /nfs/dbraw/zinc/10/25/65/1041102565.db2.gz RKMSSNWIIALXGQ-ZIAGYGMSSA-N 1 0 336.432 3.849 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1 ZINC000150062049 1041108344 /nfs/dbraw/zinc/10/83/44/1041108344.db2.gz ZHQICSHGJHCXHA-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO CC(=O)c1cc(NCCCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000587257384 1041168233 /nfs/dbraw/zinc/16/82/33/1041168233.db2.gz OBXUWRGXZJIHDH-HUUCEWRRSA-N 1 0 347.459 3.967 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072393 1041815089 /nfs/dbraw/zinc/81/50/89/1041815089.db2.gz BZGFPRFSLOUBKH-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC000893492970 1042267275 /nfs/dbraw/zinc/26/72/75/1042267275.db2.gz VTNINXYAFXSJNP-ZDUSSCGKSA-N 1 0 348.834 3.717 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@H](O)Cc1ccccc1 ZINC000253354801 1042557140 /nfs/dbraw/zinc/55/71/40/1042557140.db2.gz MPMYGZNRVADRHH-PNHOKKKMSA-N 1 0 340.423 3.554 20 5 EHBDRO COc1ccccc1CCC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000541872387 1042758536 /nfs/dbraw/zinc/75/85/36/1042758536.db2.gz RHQZIUHCCTUWQG-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)[C@H]1CCCC[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000342278777 1042847125 /nfs/dbraw/zinc/84/71/25/1042847125.db2.gz FTLXXHFCXIBESF-JLSDUUJJSA-N 1 0 347.459 3.673 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000165623041 1042862304 /nfs/dbraw/zinc/86/23/04/1042862304.db2.gz DSABYEHEDZEQJQ-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2c3ccccc3C[C@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000279212568 1043579024 /nfs/dbraw/zinc/57/90/24/1043579024.db2.gz YGIUYBGAWFPMRI-OTWHNJEPSA-N 1 0 338.407 3.565 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209997 1044161048 /nfs/dbraw/zinc/16/10/48/1044161048.db2.gz BQBYPBXYTWTOGL-AEFFLSMTSA-N 1 0 331.460 3.681 20 5 EHBDRO COc1cccc(C2([NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000453162231 1044402176 /nfs/dbraw/zinc/40/21/76/1044402176.db2.gz GEPMJZWFNJRKLT-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000512339693 1044793407 /nfs/dbraw/zinc/79/34/07/1044793407.db2.gz YWJJPHKOHTULBF-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO Cc1c(C[NH2+][C@@](C)(CO)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC001655736641 1126256026 /nfs/dbraw/zinc/25/60/26/1126256026.db2.gz QLVSNIWNRRTUCV-GOSISDBHSA-N 1 0 348.830 3.640 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072746574 1126871988 /nfs/dbraw/zinc/87/19/88/1126871988.db2.gz WUIUWBHSLTUBGM-RBUKOAKNSA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000072756341 1126874594 /nfs/dbraw/zinc/87/45/94/1126874594.db2.gz BQZRLDMKRMGCIG-MOPGFXCFSA-N 1 0 326.396 3.913 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879385 1127081974 /nfs/dbraw/zinc/08/19/74/1127081974.db2.gz MQYGOFPBLUKSJB-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000552066371 1127554182 /nfs/dbraw/zinc/55/41/82/1127554182.db2.gz HLFFBLRRIVSLCI-YQYZPQCESA-N 1 0 342.443 3.832 20 5 EHBDRO Cc1nn(C[N@H+](C)CCc2ccccc2F)c2ccc([N+](=O)[O-])cc12 ZINC000764990606 1127560990 /nfs/dbraw/zinc/56/09/90/1127560990.db2.gz ZKNNXNPFCUGEAA-UHFFFAOYSA-N 1 0 342.374 3.524 20 5 EHBDRO C[C@@H](Cc1ccsc1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765260299 1127589704 /nfs/dbraw/zinc/58/97/04/1127589704.db2.gz JLQRUIBDEXNKQT-AWEZNQCLSA-N 1 0 345.468 3.846 20 5 EHBDRO C[C@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000552225228 1127723282 /nfs/dbraw/zinc/72/32/82/1127723282.db2.gz DXQIURAFJTZACS-AWEZNQCLSA-N 1 0 345.468 3.849 20 5 EHBDRO COc1cc(NC[C@@H](C)[N@@H+]2CCc3sccc3C2)ccc1[N+](=O)[O-] ZINC000301340984 1127738233 /nfs/dbraw/zinc/73/82/33/1127738233.db2.gz FQLRPFOXRQGIQL-GFCCVEGCSA-N 1 0 347.440 3.524 20 5 EHBDRO COc1cc(NC[C@H](c2ccc(C)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301351473 1127739589 /nfs/dbraw/zinc/73/95/89/1127739589.db2.gz IZHYBZHJRHHGLU-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc(C)cc1[N+](=O)[O-])[NH+](C)C ZINC000301434295 1127890181 /nfs/dbraw/zinc/89/01/81/1127890181.db2.gz ILAYJTQNDAOOOV-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1oc(C(C)(C)C)cc1C[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC001649111728 1128290083 /nfs/dbraw/zinc/29/00/83/1128290083.db2.gz BBJVTTDVVXWQAQ-UHFFFAOYSA-N 1 0 332.400 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2cc3cc(Cl)cnc3o2)cc1 ZINC001649111932 1128291111 /nfs/dbraw/zinc/29/11/11/1128291111.db2.gz GKMCIWWILJAAPI-UHFFFAOYSA-N 1 0 347.758 3.558 20 5 EHBDRO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000091080481 1128445813 /nfs/dbraw/zinc/44/58/13/1128445813.db2.gz JKNSKHPVHJHOQZ-KRWDZBQOSA-N 1 0 344.415 3.541 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301572544 1128499208 /nfs/dbraw/zinc/49/92/08/1128499208.db2.gz YSJKTOHZIMEZHZ-RDJZCZTQSA-N 1 0 340.427 3.763 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000153696203 1128616677 /nfs/dbraw/zinc/61/66/77/1128616677.db2.gz DBPXUVZAXQVLQP-NSHDSACASA-N 1 0 349.456 3.960 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCCCN2CC)cc1[N+](=O)[O-] ZINC000153723587 1128655159 /nfs/dbraw/zinc/65/51/59/1128655159.db2.gz JAKUJWWHJAJSBM-HOCLYGCPSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cc(NC[C@@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])cc1F ZINC000301623145 1128763704 /nfs/dbraw/zinc/76/37/04/1128763704.db2.gz OMXJVYJYVSEULO-ZDUSSCGKSA-N 1 0 339.392 3.519 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542929863 1128856123 /nfs/dbraw/zinc/85/61/23/1128856123.db2.gz GYBBSAGJJOBKQV-CQSZACIVSA-N 1 0 325.840 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H]2C[NH+]2CCCCC2)c(Cl)c1 ZINC000542931052 1128864182 /nfs/dbraw/zinc/86/41/82/1128864182.db2.gz CLYMZDHLGLETGW-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO COC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCC1 ZINC000494514640 1120575410 /nfs/dbraw/zinc/57/54/10/1120575410.db2.gz YFSFMPXJWGSPNJ-OAHLLOKOSA-N 1 0 346.349 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@@H]3C13CCC3)CCC2 ZINC000193067633 1120887621 /nfs/dbraw/zinc/88/76/21/1120887621.db2.gz CHCJRZSZSMLRPZ-HPBDAGMYSA-N 1 0 328.412 3.519 20 5 EHBDRO COc1cc(C[NH2+][C@H](Cc2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000542541362 1120974478 /nfs/dbraw/zinc/97/44/78/1120974478.db2.gz OCWMNSBLDNNJLK-QGZVFWFLSA-N 1 0 326.396 3.714 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)O1 ZINC000495369460 1121140055 /nfs/dbraw/zinc/14/00/55/1121140055.db2.gz RXAUPQMPFBXKGB-AWEZNQCLSA-N 1 0 326.824 3.726 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C(C)(C)O1 ZINC000495369461 1121140348 /nfs/dbraw/zinc/14/03/48/1121140348.db2.gz RXAUPQMPFBXKGB-CQSZACIVSA-N 1 0 326.824 3.726 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@H](Cc2ccccc2)C2CC2)c1 ZINC000495517200 1121246084 /nfs/dbraw/zinc/24/60/84/1121246084.db2.gz QJTJIMXPYNPKPA-LJQANCHMSA-N 1 0 326.396 3.585 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@H]2CCCC[C@@H]12 ZINC000915209641 1121253120 /nfs/dbraw/zinc/25/31/20/1121253120.db2.gz LXKJZHXWDJDXRQ-COXVUDFISA-N 1 0 328.416 3.803 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000301062977 1121283809 /nfs/dbraw/zinc/28/38/09/1121283809.db2.gz FZCTVHKICNWDJB-UHFFFAOYSA-N 1 0 345.365 3.923 20 5 EHBDRO C[C@@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000301100705 1121692334 /nfs/dbraw/zinc/69/23/34/1121692334.db2.gz PWEYWRIDVFFBNL-NSHDSACASA-N 1 0 335.404 3.654 20 5 EHBDRO Cc1cc2ncc([C@H](C)[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)c(C)n2n1 ZINC000193903239 1121727572 /nfs/dbraw/zinc/72/75/72/1121727572.db2.gz HSLJZSXPKWQIBO-OLZOCXBDSA-N 1 0 339.399 3.666 20 5 EHBDRO CCCn1c2ccccc2nc1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000194416369 1121884323 /nfs/dbraw/zinc/88/43/23/1121884323.db2.gz WXBLOVDAFIGOGK-UHFFFAOYSA-N 1 0 338.411 3.687 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCOC2CCCC2)cc1[N+](=O)[O-] ZINC000153400698 1122080094 /nfs/dbraw/zinc/08/00/94/1122080094.db2.gz JAINYPQWSUYVGE-CQSZACIVSA-N 1 0 336.432 3.993 20 5 EHBDRO Cc1ccc([C@@H](CNc2cccc(F)c2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000301164351 1122218436 /nfs/dbraw/zinc/21/84/36/1122218436.db2.gz UXXLEXVUUCABAQ-OAHLLOKOSA-N 1 0 333.363 3.884 20 5 EHBDRO Cc1cccc(NC(=O)C[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000556162143 1122849970 /nfs/dbraw/zinc/84/99/70/1122849970.db2.gz IOYLJKHELNBHNU-GJZGRUSLSA-N 1 0 341.411 3.971 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@H]3CCCO3)o2)cc1 ZINC000556620411 1123063560 /nfs/dbraw/zinc/06/35/60/1123063560.db2.gz ZXHACWCQRLSJRR-PKOBYXMFSA-N 1 0 342.395 3.998 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCc3ccccc3C2)cc1 ZINC000609314421 1123363326 /nfs/dbraw/zinc/36/33/26/1123363326.db2.gz FSFZSXNVTHXGKB-UHFFFAOYSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](c3ccccc3F)C2)cc1 ZINC000609323420 1123475259 /nfs/dbraw/zinc/47/52/59/1123475259.db2.gz JDYCDTVLGDZHGX-HNNXBMFYSA-N 1 0 344.386 3.992 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])s1)c1ccsc1 ZINC000195508676 1123494638 /nfs/dbraw/zinc/49/46/38/1123494638.db2.gz MNOLYUWELUCEJI-LLVKDONJSA-N 1 0 326.447 3.608 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CC[N@@H+](C3CCCC3)C2)ccc2ncccc21 ZINC000301235809 1123642834 /nfs/dbraw/zinc/64/28/34/1123642834.db2.gz LTGRFQPKRPTWTE-ZDUSSCGKSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916480 1123692047 /nfs/dbraw/zinc/69/20/47/1123692047.db2.gz RKWFYLWZHTWTCX-MRXNPFEDSA-N 1 0 344.386 3.677 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[nH]n1 ZINC000610009929 1123712636 /nfs/dbraw/zinc/71/26/36/1123712636.db2.gz FPFLLYXVXVFQRQ-UHFFFAOYSA-N 1 0 328.397 3.645 20 5 EHBDRO O=[N+]([O-])c1cccnc1NCc1ccccc1C[NH+]1CCCCCC1 ZINC000301245443 1123758834 /nfs/dbraw/zinc/75/88/34/1123758834.db2.gz PVMOKORZQYCZPE-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccnn1C ZINC000615966869 1123919304 /nfs/dbraw/zinc/91/93/04/1123919304.db2.gz KPPLDTDTTPLLTH-WBVHZDCISA-N 1 0 344.459 3.679 20 5 EHBDRO Cc1cc(N2CCC[C@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047984 1129158545 /nfs/dbraw/zinc/15/85/45/1129158545.db2.gz LHFGRVBYLMKKKU-GJZGRUSLSA-N 1 0 341.411 3.704 20 5 EHBDRO Cc1cc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)ncc1[N+](=O)[O-] ZINC000080585017 1124543965 /nfs/dbraw/zinc/54/39/65/1124543965.db2.gz RGKNRXDMKYUSDP-HNNXBMFYSA-N 1 0 330.388 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCN1Cc3ccccc3C1)CCC2 ZINC000618566868 1125113848 /nfs/dbraw/zinc/11/38/48/1125113848.db2.gz MBXKKBLMUWMTJI-HXUWFJFHSA-N 1 0 337.423 3.578 20 5 EHBDRO CC(C)Sc1ccc([C@@H](C)[NH2+]CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000182095925 1125154538 /nfs/dbraw/zinc/15/45/38/1125154538.db2.gz VHVLKUPNGQWAAV-CYBMUJFWSA-N 1 0 334.445 3.643 20 5 EHBDRO C[C@H](C(=O)Nc1cccc(C[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182644333 1125348822 /nfs/dbraw/zinc/34/88/22/1125348822.db2.gz CLHKKHHYGPSZDA-LBPRGKRZSA-N 1 0 345.374 3.538 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569529 1125363692 /nfs/dbraw/zinc/36/36/92/1125363692.db2.gz FMHJDRJJZXLORY-FCLVOEFKSA-N 1 0 332.444 3.746 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCCc2cccnc21 ZINC000619611522 1125372446 /nfs/dbraw/zinc/37/24/46/1125372446.db2.gz PAWMDMXHZZLXDA-OAHLLOKOSA-N 1 0 331.803 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCCc3cccnc32)cc1 ZINC000619611308 1125372588 /nfs/dbraw/zinc/37/25/88/1125372588.db2.gz IQROYADFKCSKOI-GOSISDBHSA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)C2)cc1C(F)(F)F ZINC000301860185 1129213927 /nfs/dbraw/zinc/21/39/27/1129213927.db2.gz SWYHGKKBMUJHQC-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000301947782 1129402713 /nfs/dbraw/zinc/40/27/13/1129402713.db2.gz YFGJWLMTZLTRNF-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@H]([C@@H]3CCOC3)C2)c(Cl)c1 ZINC000466363638 1129403736 /nfs/dbraw/zinc/40/37/36/1129403736.db2.gz FPOACOBPVHBUCW-NWANDNLSSA-N 1 0 338.835 3.933 20 5 EHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000466424986 1129442081 /nfs/dbraw/zinc/44/20/81/1129442081.db2.gz YOQMRELAWLRZEJ-UKRRQHHQSA-N 1 0 328.416 3.521 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@](C)(O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402053 1129462355 /nfs/dbraw/zinc/46/23/55/1129462355.db2.gz CQRNSIXWRXWOBL-QZTJIDSGSA-N 1 0 332.400 3.590 20 5 EHBDRO CC(C)C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301972130 1129465895 /nfs/dbraw/zinc/46/58/95/1129465895.db2.gz HHWGDOSVLYSOAV-HNNXBMFYSA-N 1 0 342.443 3.923 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000301994992 1129505344 /nfs/dbraw/zinc/50/53/44/1129505344.db2.gz HERAOQYGKIYAOJ-HNNXBMFYSA-N 1 0 342.443 3.620 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000154108370 1129532999 /nfs/dbraw/zinc/53/29/99/1129532999.db2.gz UWYIQTSPHZSTGJ-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000327948564 1129539703 /nfs/dbraw/zinc/53/97/03/1129539703.db2.gz BLZQUFXLEHCQSE-KSZLIROESA-N 1 0 348.443 3.509 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000327948567 1129539942 /nfs/dbraw/zinc/53/99/42/1129539942.db2.gz BLZQUFXLEHCQSE-KURKYZTESA-N 1 0 348.443 3.509 20 5 EHBDRO CCC[N@@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC1CC1 ZINC000154686726 1129580296 /nfs/dbraw/zinc/58/02/96/1129580296.db2.gz XNKREUQTQGKJDU-UHFFFAOYSA-N 1 0 328.416 3.617 20 5 EHBDRO COCc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000124375013 1129601793 /nfs/dbraw/zinc/60/17/93/1129601793.db2.gz YEYNQAKNFXBGKY-IBGZPJMESA-N 1 0 340.423 3.852 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000155064392 1129610230 /nfs/dbraw/zinc/61/02/30/1129610230.db2.gz DKXCNFMJRDSZBC-OAHLLOKOSA-N 1 0 342.395 3.602 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922680885 1129621915 /nfs/dbraw/zinc/62/19/15/1129621915.db2.gz ZICBUZAPNBDVJD-SLUZZZFTSA-N 1 0 344.333 3.698 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H](OC(F)F)C3)o2)cc1 ZINC000555368696 1129639561 /nfs/dbraw/zinc/63/95/61/1129639561.db2.gz XWJWIEOTCJTOPW-AWEZNQCLSA-N 1 0 338.310 3.668 20 5 EHBDRO CCc1noc([C@@H]2CC[C@H]([NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC000922861573 1129696746 /nfs/dbraw/zinc/69/67/46/1129696746.db2.gz DRDUHGCYTBGNGK-KGLIPLIRSA-N 1 0 344.415 3.583 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc3c(c2)OCCCO3)cccc1[N+](=O)[O-] ZINC000393097009 1129735989 /nfs/dbraw/zinc/73/59/89/1129735989.db2.gz WUQKKMCHZCCCFJ-AWEZNQCLSA-N 1 0 342.395 3.915 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000302027466 1129763940 /nfs/dbraw/zinc/76/39/40/1129763940.db2.gz QWDHZPCKWBZPBO-AWEZNQCLSA-N 1 0 328.416 3.595 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)c(Cl)cc1N1CC[NH+]2CCC1CC2 ZINC000302737280 1129789061 /nfs/dbraw/zinc/78/90/61/1129789061.db2.gz BMNBDZCQXMZVTK-UHFFFAOYSA-N 1 0 349.740 3.551 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196360 1129805827 /nfs/dbraw/zinc/80/58/27/1129805827.db2.gz FOXLQVNSTPQZSJ-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1 ZINC000056197309 1129806006 /nfs/dbraw/zinc/80/60/06/1129806006.db2.gz HPESGXKJIMDFPN-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000056196913 1129806312 /nfs/dbraw/zinc/80/63/12/1129806312.db2.gz VNCSBLGHKWVGPV-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]C[C@H]1CCCC1(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000557341206 1129992281 /nfs/dbraw/zinc/99/22/81/1129992281.db2.gz BRVUJBMZIOCNSY-NVXWUHKLSA-N 1 0 342.443 3.834 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Nc2ccc(F)cc2)CC1 ZINC000008380205 1130059507 /nfs/dbraw/zinc/05/95/07/1130059507.db2.gz XYURUHHVBDHKSR-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000173306238 1130204615 /nfs/dbraw/zinc/20/46/15/1130204615.db2.gz NOCZQMWYWQILOU-KBPBESRZSA-N 1 0 345.468 3.754 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000173306270 1130204732 /nfs/dbraw/zinc/20/47/32/1130204732.db2.gz NOCZQMWYWQILOU-UONOGXRCSA-N 1 0 345.468 3.754 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245446192 1130208966 /nfs/dbraw/zinc/20/89/66/1130208966.db2.gz ZOENFVFMFGQBDH-LBTNJELSSA-N 1 0 339.395 3.615 20 5 EHBDRO Cc1cccc([C@@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245448543 1130209568 /nfs/dbraw/zinc/20/95/68/1130209568.db2.gz MXTWDYUMFMDDLD-GDBMZVCRSA-N 1 0 326.400 3.546 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[N@@H+](C3CCCC3)CC2)c1 ZINC000738335967 1131466821 /nfs/dbraw/zinc/46/68/21/1131466821.db2.gz WTEXYZUSNNRJIG-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000740881340 1131553107 /nfs/dbraw/zinc/55/31/07/1131553107.db2.gz AJXPUBJYJHEEDN-TZMCWYRMSA-N 1 0 325.840 3.553 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172902059 1131884801 /nfs/dbraw/zinc/88/48/01/1131884801.db2.gz UNLDIVVCJKSTFC-GUYCJALGSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCCCCCCCO)CC2 ZINC001172903392 1131886589 /nfs/dbraw/zinc/88/65/89/1131886589.db2.gz QRVOZFFEFXGFPY-SFHVURJKSA-N 1 0 334.460 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@H]3[C@H](CCC3(F)F)C1)CC2 ZINC001172903966 1131886879 /nfs/dbraw/zinc/88/68/79/1131886879.db2.gz KIIAWMAOPPVHMG-VYDXJSESSA-N 1 0 336.382 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCc3c(O)cccc3C1)CC2 ZINC001172908243 1131888163 /nfs/dbraw/zinc/88/81/63/1131888163.db2.gz LEXIJFRXLPLXAW-KRWDZBQOSA-N 1 0 338.407 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOc1ccccc1)CC2 ZINC001172896612 1131900929 /nfs/dbraw/zinc/90/09/29/1131900929.db2.gz PSGLTMSFHLONHG-KRWDZBQOSA-N 1 0 326.396 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(F)cc1F)CC2 ZINC001172896043 1131901258 /nfs/dbraw/zinc/90/12/58/1131901258.db2.gz LFDLWZQPIMRGJC-MRXNPFEDSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CC(Oc3ccccc3)C1)CC2 ZINC001172914299 1131902879 /nfs/dbraw/zinc/90/28/79/1131902879.db2.gz GNOAZHQGRNBIOF-QGZVFWFLSA-N 1 0 338.407 3.605 20 5 EHBDRO C[N@H+](CC(=O)c1ccccc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918682 1131904643 /nfs/dbraw/zinc/90/46/43/1131904643.db2.gz CBIVEOBDTBXJOS-GOSISDBHSA-N 1 0 338.407 3.657 20 5 EHBDRO CC(C)(C)OC(=O)CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910738 1131917507 /nfs/dbraw/zinc/91/75/07/1131917507.db2.gz CFWSSGVAFNOCDK-INIZCTEOSA-N 1 0 348.443 3.554 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000743855407 1131987855 /nfs/dbraw/zinc/98/78/55/1131987855.db2.gz OGNLWGNAOBSDNU-AWEZNQCLSA-N 1 0 325.840 3.554 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccc(C)s2)c1F ZINC001173174770 1131990726 /nfs/dbraw/zinc/99/07/26/1131990726.db2.gz BESPKVCROYREHV-SNVBAGLBSA-N 1 0 338.404 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2ccccc2)c1F ZINC001173175069 1131991582 /nfs/dbraw/zinc/99/15/82/1131991582.db2.gz JXHCEEPDIKTUDO-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2ccc(C)cn2)c1F ZINC001173187670 1131993741 /nfs/dbraw/zinc/99/37/41/1131993741.db2.gz FFDZESAXMUPUPD-QWHCGFSZSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2ccc(N)cc2)c1F ZINC001173194226 1131995286 /nfs/dbraw/zinc/99/52/86/1131995286.db2.gz YVTRNBMZEFBYPD-NEPJUHHUSA-N 1 0 347.390 3.607 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1C[C@H]1c1ccc(F)c(F)c1 ZINC001173218173 1132003500 /nfs/dbraw/zinc/00/35/00/1132003500.db2.gz OQPNAKAVMMIKJA-GEWABHDNSA-N 1 0 332.350 3.950 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC001173223946 1132005121 /nfs/dbraw/zinc/00/51/21/1132005121.db2.gz CAVFRWBIEAQEEN-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1([C@H]2CCOC(C)(C)C2)CC1 ZINC001173224922 1132005280 /nfs/dbraw/zinc/00/52/80/1132005280.db2.gz IFVWBDPKMRAYDH-ZBFHGGJFSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(Cc2ccccn2)CCC1 ZINC001173225598 1132007208 /nfs/dbraw/zinc/00/72/08/1132007208.db2.gz SPEIGYBEPTUSDG-HNNXBMFYSA-N 1 0 325.412 3.676 20 5 EHBDRO Cc1ccnc(C2(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173230186 1132008353 /nfs/dbraw/zinc/00/83/53/1132008353.db2.gz ROHBEDQEKNMKFV-HNNXBMFYSA-N 1 0 325.412 3.551 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC(C)(C)O2)CC1 ZINC001173230241 1132008582 /nfs/dbraw/zinc/00/85/82/1132008582.db2.gz DHPZJLPYUUWPDE-HNNXBMFYSA-N 1 0 332.444 3.949 20 5 EHBDRO COc1ccc2c(c1)c(C[NH3+])cn2[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234581 1132010853 /nfs/dbraw/zinc/01/08/53/1132010853.db2.gz POMRDAIVYUGIMF-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC001173209522 1132013111 /nfs/dbraw/zinc/01/31/11/1132013111.db2.gz CODLRWXCVJHJKV-YVEFUNNKSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1ccc(Cl)cc1 ZINC001173210392 1132013668 /nfs/dbraw/zinc/01/36/68/1132013668.db2.gz KHNHESJRAVQZGV-CYBMUJFWSA-N 1 0 334.803 3.848 20 5 EHBDRO Cc1ccccc1OCCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173214544 1132014929 /nfs/dbraw/zinc/01/49/29/1132014929.db2.gz OUWNQUMHGKIMHM-INIZCTEOSA-N 1 0 328.412 3.893 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(F)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746026305 1132350259 /nfs/dbraw/zinc/35/02/59/1132350259.db2.gz GAGYUDFHIVDUCM-UHFFFAOYSA-N 1 0 342.374 3.952 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CCC1CC1)CC1CC1 ZINC001174826969 1132473492 /nfs/dbraw/zinc/47/34/92/1132473492.db2.gz OQSJRSPOMZSOST-UHFFFAOYSA-N 1 0 345.443 3.744 20 5 EHBDRO CC[C@@H]1c2ccccc2CC[N@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000738240910 1132552138 /nfs/dbraw/zinc/55/21/38/1132552138.db2.gz DTURCMOOENIOMF-GOSISDBHSA-N 1 0 336.395 3.911 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2CC[C@H](OCc3ccccc3)CC2)C1 ZINC001168959978 1132620235 /nfs/dbraw/zinc/62/02/35/1132620235.db2.gz YLPXHEQNOYECPN-AKHDSKFASA-N 1 0 332.444 3.549 20 5 EHBDRO CC(C)(C)OC(=O)Nc1cccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001168961180 1132620424 /nfs/dbraw/zinc/62/04/24/1132620424.db2.gz HPEKCSNGWSTCTF-HUUCEWRRSA-N 1 0 349.431 3.569 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)s1 ZINC001168966026 1132621606 /nfs/dbraw/zinc/62/16/06/1132621606.db2.gz FWBLGBCXOXSBIH-GUBZILKMSA-N 1 0 333.251 3.607 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cc(Br)ccc2Cl)C1 ZINC001168969494 1132622141 /nfs/dbraw/zinc/62/21/41/1132622141.db2.gz FBSREAYEFKFTKJ-CABZTGNLSA-N 1 0 347.640 3.638 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001168972630 1132623668 /nfs/dbraw/zinc/62/36/68/1132623668.db2.gz NNKSZHARHWLXIB-UWVGGRQHSA-N 1 0 336.741 3.894 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1-n1c2cc(Cl)ccc2nc1CCC[NH3+] ZINC001168995623 1132625872 /nfs/dbraw/zinc/62/58/72/1132625872.db2.gz KLDCONBFEILSPB-UHFFFAOYSA-N 1 0 344.802 3.787 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1C(F)(F)F ZINC001168998269 1132627297 /nfs/dbraw/zinc/62/72/97/1132627297.db2.gz KQKGINDPYZQTCD-QWHCGFSZSA-N 1 0 346.349 3.639 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168988318 1132634456 /nfs/dbraw/zinc/63/44/56/1132634456.db2.gz QVVVSYMNGGFUEZ-BXUZGUMPSA-N 1 0 341.249 3.719 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1C(F)(F)F ZINC001168990400 1132634677 /nfs/dbraw/zinc/63/46/77/1132634677.db2.gz CIQAIXNNSIHELO-NWDGAFQWSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2ccc(O)cc2)C1 ZINC001168989846 1132635045 /nfs/dbraw/zinc/63/50/45/1132635045.db2.gz XBMQGDMXRUARBO-DKSSEZFCSA-N 1 0 326.396 3.517 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030292 1132635481 /nfs/dbraw/zinc/63/54/81/1132635481.db2.gz YCUIASDNTPVIHF-IEBWSBKVSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(Cc3ccc(F)cc3F)CC2)C1 ZINC001169039098 1132637863 /nfs/dbraw/zinc/63/78/63/1132637863.db2.gz NBJRDLMOCQYCNO-WMLDXEAASA-N 1 0 338.398 3.665 20 5 EHBDRO CC[N@H+](Cc1ccc(Br)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040065 1132638319 /nfs/dbraw/zinc/63/83/19/1132638319.db2.gz XLGICOTYVBMQIY-ZFWWWQNUSA-N 1 0 341.249 3.716 20 5 EHBDRO CC[N@H+](Cc1ccc(Br)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169040063 1132638325 /nfs/dbraw/zinc/63/83/25/1132638325.db2.gz XLGICOTYVBMQIY-HIFRSBDPSA-N 1 0 341.249 3.716 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039025 1132638620 /nfs/dbraw/zinc/63/86/20/1132638620.db2.gz MPANHCCZJQYBLO-WCQYABFASA-N 1 0 328.334 3.509 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1c(Cl)nccc1[N+](=O)[O-] ZINC001169684181 1132819786 /nfs/dbraw/zinc/81/97/86/1132819786.db2.gz HBUKPAKVVDQPKP-LBPRGKRZSA-N 1 0 332.791 3.883 20 5 EHBDRO COc1nc(C)c(N2CCC[C@H]([NH3+])c3cc(C)ccc32)cc1[N+](=O)[O-] ZINC001169699388 1132826472 /nfs/dbraw/zinc/82/64/72/1132826472.db2.gz XKPJWZUOCZWCSC-AWEZNQCLSA-N 1 0 342.399 3.547 20 5 EHBDRO C[NH+](C)CCC(C)(C)Nc1nc(-c2ccccc2)ccc1[N+](=O)[O-] ZINC001169711916 1132831326 /nfs/dbraw/zinc/83/13/26/1132831326.db2.gz UVENKQNCORGZKM-UHFFFAOYSA-N 1 0 328.416 3.799 20 5 EHBDRO CCCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1c(C)oc(C)c1C ZINC001176365773 1132923554 /nfs/dbraw/zinc/92/35/54/1132923554.db2.gz VFEUOZOWQBZBID-UHFFFAOYSA-N 1 0 348.447 3.920 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000804351539 1132984642 /nfs/dbraw/zinc/98/46/42/1132984642.db2.gz BYPNHNBQJLPXNV-AWEZNQCLSA-N 1 0 333.432 3.721 20 5 EHBDRO COc1cc(C[NH2+]CCc2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1O ZINC001177117053 1133029142 /nfs/dbraw/zinc/02/91/42/1133029142.db2.gz GSENDUDBNCDRNC-UHFFFAOYSA-N 1 0 344.411 3.765 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)c1ccc(NC(N)=O)cc1 ZINC001177803794 1133104490 /nfs/dbraw/zinc/10/44/90/1133104490.db2.gz GZXAZIIKMPMXRO-ZDUSSCGKSA-N 1 0 342.399 3.553 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2nc(C)sc21 ZINC001178285812 1133153088 /nfs/dbraw/zinc/15/30/88/1133153088.db2.gz UAVDNWVGVFRJSA-CQSZACIVSA-N 1 0 347.440 3.926 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768555192 1133155370 /nfs/dbraw/zinc/15/53/70/1133155370.db2.gz OCMHGKBYLOKVAI-ZDUSSCGKSA-N 1 0 334.803 3.631 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2C[C@H](O)C23CCC3)s1 ZINC001179154601 1133231853 /nfs/dbraw/zinc/23/18/53/1133231853.db2.gz YLJZFRCPLDHBQA-IRXDYDNUSA-N 1 0 344.436 3.716 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC001179579053 1133261177 /nfs/dbraw/zinc/26/11/77/1133261177.db2.gz IDVDBVLOZKGBLX-GUYCJALGSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1cc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c(C)o1 ZINC000769482817 1133288205 /nfs/dbraw/zinc/28/82/05/1133288205.db2.gz IYZFJJYQHOGMFO-UHFFFAOYSA-N 1 0 330.384 3.848 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccc4c(c3)OCO4)CC2)ccc1Cl ZINC000769934320 1133368879 /nfs/dbraw/zinc/36/88/79/1133368879.db2.gz RHZQPESIECCAMO-UHFFFAOYSA-N 1 0 346.770 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1COc3ccccc3C1)CCC2 ZINC000774140141 1133613881 /nfs/dbraw/zinc/61/38/81/1133613881.db2.gz RRULJFDDOBJHAY-AUUYWEPGSA-N 1 0 338.407 3.813 20 5 EHBDRO CC(C)(C)[C@@H](Cn1ccnc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133926 1133620646 /nfs/dbraw/zinc/62/06/46/1133620646.db2.gz JRHLCGWLNROLLS-QZTJIDSGSA-N 1 0 342.443 3.873 20 5 EHBDRO CC(C)(C)[C@H](Cn1ccnc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133927 1133620705 /nfs/dbraw/zinc/62/07/05/1133620705.db2.gz JRHLCGWLNROLLS-ROUUACIJSA-N 1 0 342.443 3.873 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774210653 1133634528 /nfs/dbraw/zinc/63/45/28/1133634528.db2.gz GONNZKHYPPDXIX-HOTGVXAUSA-N 1 0 332.379 3.512 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000774411879 1133673175 /nfs/dbraw/zinc/67/31/75/1133673175.db2.gz SMRTXRYOIYWLMX-OALUTQOASA-N 1 0 328.412 3.924 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CCc2nsc3ccccc23)cc1 ZINC001183074185 1133762080 /nfs/dbraw/zinc/76/20/80/1133762080.db2.gz CJMGJBACYJDBTH-UHFFFAOYSA-N 1 0 327.409 3.579 20 5 EHBDRO CC[C@@H](CSC)[N@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774640340 1133815360 /nfs/dbraw/zinc/81/53/60/1133815360.db2.gz RDBITTDCCDSFMF-NSHDSACASA-N 1 0 342.852 3.629 20 5 EHBDRO CC[C@H](C[N@H+](CC)Cn1nc(C)c([N+](=O)[O-])c1C)c1ccccc1 ZINC000774708672 1133891337 /nfs/dbraw/zinc/89/13/37/1133891337.db2.gz YSUHSFPNLLRTKL-MRXNPFEDSA-N 1 0 330.432 3.881 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000786811115 1133909264 /nfs/dbraw/zinc/90/92/64/1133909264.db2.gz IVWCLOOLGHFLLF-LCYFTJDESA-N 1 0 327.340 3.696 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC000786810890 1133909746 /nfs/dbraw/zinc/90/97/46/1133909746.db2.gz BPVIFJGZFDXWCO-FUNAXGEOSA-N 1 0 338.411 3.764 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1ccsc1 ZINC000786815968 1133910033 /nfs/dbraw/zinc/91/00/33/1133910033.db2.gz UQPVFLACUUUXLE-YJJOXIQCSA-N 1 0 332.425 3.557 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000786822068 1133911532 /nfs/dbraw/zinc/91/15/32/1133911532.db2.gz ZMVLHPBHVRQJNK-UVTDQMKNSA-N 1 0 341.367 3.739 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746663010 1133974822 /nfs/dbraw/zinc/97/48/22/1133974822.db2.gz KSZTYLKIVUECOB-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@@H](C[NH+]1CCCCC1)Nc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001184801979 1133992214 /nfs/dbraw/zinc/99/22/14/1133992214.db2.gz FAGBUUVJEDFYEM-NSHDSACASA-N 1 0 331.338 3.900 20 5 EHBDRO CC(C)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccnn1C ZINC000788265828 1134103049 /nfs/dbraw/zinc/10/30/49/1134103049.db2.gz KCUXCITZXHOGEJ-ZDUSSCGKSA-N 1 0 336.823 3.511 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@H+](CC2CCCC2)C1 ZINC001185565154 1134107213 /nfs/dbraw/zinc/10/72/13/1134107213.db2.gz ISLJTFBYVJEQHO-MRXNPFEDSA-N 1 0 340.427 3.819 20 5 EHBDRO Cc1cccc2c(CC[NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)c[nH]c21 ZINC000788612998 1134151701 /nfs/dbraw/zinc/15/17/01/1134151701.db2.gz NUGDQCIDAHEEMS-ZDUSSCGKSA-N 1 0 338.411 3.860 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788777870 1134173850 /nfs/dbraw/zinc/17/38/50/1134173850.db2.gz QHPMSYYJDMCITF-UKRRQHHQSA-N 1 0 333.432 3.710 20 5 EHBDRO CC[C@H](C)[NH+]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC001186452190 1134214395 /nfs/dbraw/zinc/21/43/95/1134214395.db2.gz OLWIPPNXOMDCLS-LBPRGKRZSA-N 1 0 348.834 3.717 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])CC2 ZINC000790995904 1134491220 /nfs/dbraw/zinc/49/12/20/1134491220.db2.gz OYQGJMJPQYKTLD-HNNXBMFYSA-N 1 0 348.834 3.673 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](CC(C)C)C2CCCC2)c1 ZINC001190571890 1134719558 /nfs/dbraw/zinc/71/95/58/1134719558.db2.gz QYIJYHWBTZPQFS-UHFFFAOYSA-N 1 0 334.416 3.782 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCOc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170295669 1134737529 /nfs/dbraw/zinc/73/75/29/1134737529.db2.gz DJWGDHRSANTRRX-HNNXBMFYSA-N 1 0 344.411 3.511 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170297826 1134738194 /nfs/dbraw/zinc/73/81/94/1134738194.db2.gz SWGXZHYUDPJZBH-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001170312737 1134744646 /nfs/dbraw/zinc/74/46/46/1134744646.db2.gz HLJLZRFJLPBMMW-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170318944 1134746522 /nfs/dbraw/zinc/74/65/22/1134746522.db2.gz SYCITEZXIIWNRJ-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c1 ZINC001191075713 1134788401 /nfs/dbraw/zinc/78/84/01/1134788401.db2.gz CLXJFNCSLIKQJW-WWGRRREGSA-N 1 0 332.400 3.534 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792909801 1134822652 /nfs/dbraw/zinc/82/26/52/1134822652.db2.gz OZJDRHWDGDUFFF-KGLIPLIRSA-N 1 0 345.226 3.619 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)[C@H](O)c1ccccc1 ZINC000793235939 1134880860 /nfs/dbraw/zinc/88/08/60/1134880860.db2.gz IBNXUBHYQKBDJR-RBUKOAKNSA-N 1 0 328.412 3.895 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000793238147 1134886267 /nfs/dbraw/zinc/88/62/67/1134886267.db2.gz OAQYAIVUXXLFTE-IEBWSBKVSA-N 1 0 328.412 3.895 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789196 1134923870 /nfs/dbraw/zinc/92/38/70/1134923870.db2.gz GKABKYFLPKOGBC-WMLDXEAASA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000775549867 1135061273 /nfs/dbraw/zinc/06/12/73/1135061273.db2.gz QKEJCUVAGAGOHR-FZKQIMNGSA-N 1 0 332.375 3.735 20 5 EHBDRO Cc1c[nH+]ccc1N1CCc2c(Br)ccc([N+](=O)[O-])c2C1 ZINC000804703489 1135179568 /nfs/dbraw/zinc/17/95/68/1135179568.db2.gz MWCWJXUJLYPPMC-UHFFFAOYSA-N 1 0 348.200 3.623 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[NH+]1CCC(C)CC1 ZINC000807927222 1135591555 /nfs/dbraw/zinc/59/15/55/1135591555.db2.gz WUPXMVBBZPPZEE-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO C[C@]1(C2CCCCC2)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001197238023 1135663970 /nfs/dbraw/zinc/66/39/70/1135663970.db2.gz CQLCQDPPPVFUCT-GOSISDBHSA-N 1 0 331.416 3.578 20 5 EHBDRO C=CS(=O)(=O)Nc1cc2[nH+]c3cc(N(C)C)ccc3cc2cc1C ZINC001198620543 1135843054 /nfs/dbraw/zinc/84/30/54/1135843054.db2.gz MNNNCPDFEDCEBG-UHFFFAOYSA-N 1 0 341.436 3.648 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700320 1135869087 /nfs/dbraw/zinc/86/90/87/1135869087.db2.gz CPTYFTGQFHIUPE-OCCSQVGLSA-N 1 0 326.824 3.764 20 5 EHBDRO C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809732344 1135873960 /nfs/dbraw/zinc/87/39/60/1135873960.db2.gz BZQCJFGINLBMGJ-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[NH+](C2CCC2)CC1 ZINC000809945889 1135903128 /nfs/dbraw/zinc/90/31/28/1135903128.db2.gz GIAKNRUYSBZXHG-UHFFFAOYSA-N 1 0 344.242 3.572 20 5 EHBDRO Cc1c(C[NH2+]CCc2csc(C(C)(C)C)n2)cccc1[N+](=O)[O-] ZINC001201803552 1136064189 /nfs/dbraw/zinc/06/41/89/1136064189.db2.gz VSAUIXBOOLYHSF-UHFFFAOYSA-N 1 0 333.457 3.990 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2ccccc2Br)cc1[N+](=O)[O-] ZINC001202233731 1136118136 /nfs/dbraw/zinc/11/81/36/1136118136.db2.gz OQFNOCCHUNPABS-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccccc2)CC2CCC2)cc1 ZINC000776275053 1136129260 /nfs/dbraw/zinc/12/92/60/1136129260.db2.gz FVHQKPVRPOBJFF-FQEVSTJZSA-N 1 0 340.423 3.931 20 5 EHBDRO CC(C)(C)c1ccc(CC[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776279152 1136134978 /nfs/dbraw/zinc/13/49/78/1136134978.db2.gz XLNFZEDSEKFIDE-LJQANCHMSA-N 1 0 342.439 3.758 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000850385615 1136247407 /nfs/dbraw/zinc/24/74/07/1136247407.db2.gz IOHUZHCFRMLPPH-FUHWJXTLSA-N 1 0 325.412 3.799 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812849005 1136260810 /nfs/dbraw/zinc/26/08/10/1136260810.db2.gz NSPWHADXAJSQLL-AUUYWEPGSA-N 1 0 344.411 3.547 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470242 1136265409 /nfs/dbraw/zinc/26/54/09/1136265409.db2.gz ZVKFZCPSWDFQDQ-FZKQIMNGSA-N 1 0 344.411 3.550 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1C[C@H](O)c2ccccc21)C1CC1 ZINC000850529609 1136279468 /nfs/dbraw/zinc/27/94/68/1136279468.db2.gz SKJJBFZAERGAPY-NSHGMRRFSA-N 1 0 338.407 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCN(c3ccccc3F)C2)cc1Cl ZINC000814178678 1136412351 /nfs/dbraw/zinc/41/23/51/1136412351.db2.gz ZHWLJEPMPXZVIH-CYBMUJFWSA-N 1 0 349.793 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000776583343 1136441931 /nfs/dbraw/zinc/44/19/31/1136441931.db2.gz DNXJTSNBXZBCOU-IAGOWNOFSA-N 1 0 330.384 3.839 20 5 EHBDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585277 1136442615 /nfs/dbraw/zinc/44/26/15/1136442615.db2.gz SXEMQMUQDHNZJK-ACWOFJMJSA-N 1 0 344.386 3.645 20 5 EHBDRO CCOc1ccccc1[C@H](CC)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605469 1136473477 /nfs/dbraw/zinc/47/34/77/1136473477.db2.gz KXPJUJBOXLGKSM-ROUUACIJSA-N 1 0 344.411 3.768 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)C1 ZINC000814909698 1136523637 /nfs/dbraw/zinc/52/36/37/1136523637.db2.gz PJALSZQRMZKFCN-HNNXBMFYSA-N 1 0 344.242 3.824 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCC3CC[NH+](CC4CC4)CC3)sc2c1 ZINC000853986115 1136578666 /nfs/dbraw/zinc/57/86/66/1136578666.db2.gz ZIDTYMSOOMWYSR-UHFFFAOYSA-N 1 0 346.456 3.738 20 5 EHBDRO Cc1ccc(OC[C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815570711 1136617855 /nfs/dbraw/zinc/61/78/55/1136617855.db2.gz KSOVYIOUMWPGCC-KBPBESRZSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575556 1136618403 /nfs/dbraw/zinc/61/84/03/1136618403.db2.gz UXRYTOVBRRQBDJ-STQMWFEESA-N 1 0 329.400 3.555 20 5 EHBDRO C[C@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815613474 1136618805 /nfs/dbraw/zinc/61/88/05/1136618805.db2.gz OFHDIQQSMRLIDH-NSHDSACASA-N 1 0 332.379 3.551 20 5 EHBDRO C[C@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815632520 1136621960 /nfs/dbraw/zinc/62/19/60/1136621960.db2.gz PNRDZLPSELPRKX-PJODQICGSA-N 1 0 329.375 3.913 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000857080573 1136842644 /nfs/dbraw/zinc/84/26/44/1136842644.db2.gz IHIZPOOUYKEXPR-NXEZZACHSA-N 1 0 333.215 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(c3cccc(Cl)c3)CC2)c1 ZINC000819091961 1136907895 /nfs/dbraw/zinc/90/78/95/1136907895.db2.gz OXTUDJRAGGOFQA-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819079437 1136911781 /nfs/dbraw/zinc/91/17/81/1136911781.db2.gz ADLLOTSGZCVUBX-SJLPKXTDSA-N 1 0 348.830 3.893 20 5 EHBDRO CC[C@@H](CSc1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819187131 1136921217 /nfs/dbraw/zinc/92/12/17/1136921217.db2.gz BIBJOGSTFWVAHE-YJBOKZPZSA-N 1 0 346.452 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCC[C@H](c3ccccc3)C2)c1 ZINC000819262741 1136929847 /nfs/dbraw/zinc/92/98/47/1136929847.db2.gz OBZLSYDBNXJGFB-XKGZKEIXSA-N 1 0 340.423 3.944 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000819314999 1136934704 /nfs/dbraw/zinc/93/47/04/1136934704.db2.gz PIFBMZGEAWDRSV-RBUKOAKNSA-N 1 0 326.396 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCCC34CC4)CC2)cc1 ZINC000858594658 1136981739 /nfs/dbraw/zinc/98/17/39/1136981739.db2.gz RNKGBZYXBVZOOY-OAHLLOKOSA-N 1 0 329.444 3.734 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339015952 1136996078 /nfs/dbraw/zinc/99/60/78/1136996078.db2.gz YOGKFQOFRKQYIP-AWEZNQCLSA-N 1 0 345.365 3.530 20 5 EHBDRO Cc1ccc(-c2noc([C@@H]3C[C@H]4CCCC[C@@H]4[NH2+]3)n2)cc1[N+](=O)[O-] ZINC000822722364 1137071668 /nfs/dbraw/zinc/07/16/68/1137071668.db2.gz DFNTVGKTJDIVMK-XBFCOCLRSA-N 1 0 328.372 3.546 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccncc3)C2)cc1Cl ZINC000824952901 1137158880 /nfs/dbraw/zinc/15/88/80/1137158880.db2.gz FNDGMPKHZJDGOL-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO [NH3+][C@H]1CCc2c3ccccc3n(-c3cc([N+](=O)[O-])cc4cc[nH]c43)c2C1 ZINC001171093614 1137185408 /nfs/dbraw/zinc/18/54/08/1137185408.db2.gz LHLCEMPWKAZQKF-ZDUSSCGKSA-N 1 0 346.390 3.836 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)ccc1[N+](=O)[O-] ZINC000844439015 1137223007 /nfs/dbraw/zinc/22/30/07/1137223007.db2.gz HKAZSTVOMRKYCA-OAHLLOKOSA-N 1 0 326.343 3.615 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000845470615 1137293937 /nfs/dbraw/zinc/29/39/37/1137293937.db2.gz HCVWJIYERGGGGR-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[N@H+](CC1CC1)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865576389 1137296451 /nfs/dbraw/zinc/29/64/51/1137296451.db2.gz LDKVOAJMPVUPLL-ZDUSSCGKSA-N 1 0 339.386 3.701 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(Cl)cc1NC1CC[NH+](C2CCC2)CC1 ZINC000845560360 1137297873 /nfs/dbraw/zinc/29/78/73/1137297873.db2.gz DLCTYNWAUGHNLY-UHFFFAOYSA-N 1 0 327.787 3.816 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866262912 1137340297 /nfs/dbraw/zinc/34/02/97/1137340297.db2.gz ILBREAIQASKRNC-SNVBAGLBSA-N 1 0 337.420 3.571 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@@](C)(O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000846185659 1137340577 /nfs/dbraw/zinc/34/05/77/1137340577.db2.gz CENYXRQJMSFMIH-QMTMVMCOSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@](C)(O)c1ccccc1 ZINC000846191300 1137340874 /nfs/dbraw/zinc/34/08/74/1137340874.db2.gz XOIADQDQWYXZBL-KPOBHBOGSA-N 1 0 340.423 3.858 20 5 EHBDRO CSc1cc(C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])ccn1 ZINC000866289055 1137343040 /nfs/dbraw/zinc/34/30/40/1137343040.db2.gz UPPGSMARFUBUEH-LLVKDONJSA-N 1 0 335.404 3.572 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000772982453 1137409933 /nfs/dbraw/zinc/40/99/33/1137409933.db2.gz VZTXGVAXMXHRNJ-QGZVFWFLSA-N 1 0 345.355 3.623 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000773048546 1137461962 /nfs/dbraw/zinc/46/19/62/1137461962.db2.gz RKHNTROEEIGFHV-OCBCSQNSSA-N 1 0 332.375 3.897 20 5 EHBDRO [NH3+]C[C@@H]1COc2ccccc2N1c1ncnc2cc3ccccc3cc21 ZINC001171392464 1137469390 /nfs/dbraw/zinc/46/93/90/1137469390.db2.gz KUOICAJADJCRMU-MRXNPFEDSA-N 1 0 342.402 3.641 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000715138466 1137476214 /nfs/dbraw/zinc/47/62/14/1137476214.db2.gz UVAGRAGAKPIUBG-YDHLFZDLSA-N 1 0 349.431 3.549 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CC[C@](C[NH3+])(C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000870989964 1137517453 /nfs/dbraw/zinc/51/74/53/1137517453.db2.gz SKYVGVLGNCSZDE-LJQANCHMSA-N 1 0 347.459 3.555 20 5 EHBDRO C[C@H]([NH2+]CCCn1cnc2ccccc21)c1c(F)cccc1[N+](=O)[O-] ZINC000872018883 1137564923 /nfs/dbraw/zinc/56/49/23/1137564923.db2.gz QMDNJVBPNYAPJQ-ZDUSSCGKSA-N 1 0 342.374 3.825 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020787 1137565025 /nfs/dbraw/zinc/56/50/25/1137565025.db2.gz KKPINGGUGNTMOU-CABCVRRESA-N 1 0 343.402 3.911 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CN[C@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023198 1137565403 /nfs/dbraw/zinc/56/54/03/1137565403.db2.gz CZRCRVJCVPEKQF-ZIAGYGMSSA-N 1 0 337.489 3.699 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1c2ccccc2C[C@@H]1O ZINC000872029028 1137566182 /nfs/dbraw/zinc/56/61/82/1137566182.db2.gz VBRLAHITHNETHM-DPZKZMLUSA-N 1 0 344.436 3.626 20 5 EHBDRO C[C@H](C[C@@H](O)c1cccs1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042361 1137567248 /nfs/dbraw/zinc/56/72/48/1137567248.db2.gz BUBHINSOYIXJBU-UHIISALHSA-N 1 0 338.404 3.958 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872060526 1137568944 /nfs/dbraw/zinc/56/89/44/1137568944.db2.gz QNSLLYCXFQRXLY-QWHCGFSZSA-N 1 0 336.363 3.625 20 5 EHBDRO C[C@H]([NH2+]CCc1cn(C)c2ncccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872090806 1137570689 /nfs/dbraw/zinc/57/06/89/1137570689.db2.gz DMXBJKOBDBNACL-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872275580 1137577189 /nfs/dbraw/zinc/57/71/89/1137577189.db2.gz HTXCNZVTDKQIDF-KRWDZBQOSA-N 1 0 334.416 3.527 20 5 EHBDRO CCCCCn1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)n1 ZINC000873098838 1137590196 /nfs/dbraw/zinc/59/01/96/1137590196.db2.gz BPDOVQURDDICPV-UHFFFAOYSA-N 1 0 330.432 3.888 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000873112501 1137590366 /nfs/dbraw/zinc/59/03/66/1137590366.db2.gz USYRADCJKPPWMK-INIZCTEOSA-N 1 0 330.359 3.964 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1 ZINC000873185504 1137593099 /nfs/dbraw/zinc/59/30/99/1137593099.db2.gz WVELAPWKDNXJKI-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO OCC[NH2+]C1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000873215593 1137594162 /nfs/dbraw/zinc/59/41/62/1137594162.db2.gz DOBIXGQFICUMRY-UHFFFAOYSA-N 1 0 334.463 3.539 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124487798 1137598149 /nfs/dbraw/zinc/59/81/49/1137598149.db2.gz BIURVZYWJAMPQP-UUWFMWQGSA-N 1 0 332.375 3.897 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)C ZINC000877024925 1137667990 /nfs/dbraw/zinc/66/79/90/1137667990.db2.gz SPXZAUYLEQSZCZ-JMLCCBQJSA-N 1 0 328.416 3.790 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130843 1137671025 /nfs/dbraw/zinc/67/10/25/1137671025.db2.gz OQNCLXKJNSNZEU-SASJJMKUSA-N 1 0 328.349 3.968 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000877472316 1137677379 /nfs/dbraw/zinc/67/73/79/1137677379.db2.gz PNEYRPNOQYOTEO-VERVWZFWSA-N 1 0 328.349 3.716 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CC[C@H](c4cccc(F)c4)C3)C2)c1 ZINC000877491347 1137678401 /nfs/dbraw/zinc/67/84/01/1137678401.db2.gz JENPXBAWEMCIFC-DFULUXCASA-N 1 0 344.390 3.560 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000877797519 1137690197 /nfs/dbraw/zinc/69/01/97/1137690197.db2.gz WGRMGYJVAMTLQV-OAHLLOKOSA-N 1 0 344.411 3.838 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000130535394 1137839163 /nfs/dbraw/zinc/83/91/63/1137839163.db2.gz YSPCJVOLBCMNEU-ZWKOTPCHSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)F ZINC000883259587 1137851117 /nfs/dbraw/zinc/85/11/17/1137851117.db2.gz RHDHQCBQOPYYMK-NWDGAFQWSA-N 1 0 330.379 3.546 20 5 EHBDRO COc1cc(C[NH2+]CC[C@H]2CCCC2(F)F)c([N+](=O)[O-])cc1OC ZINC000883267137 1137851653 /nfs/dbraw/zinc/85/16/53/1137851653.db2.gz UPKLISHUPAMNLM-GFCCVEGCSA-N 1 0 344.358 3.527 20 5 EHBDRO C[C@H](NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708409 1137917868 /nfs/dbraw/zinc/91/78/68/1137917868.db2.gz BWGDENVWHVUCBW-KSSFIOAISA-N 1 0 345.443 3.569 20 5 EHBDRO CC[C@H]1C[C@H](C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000332116799 1137932313 /nfs/dbraw/zinc/93/23/13/1137932313.db2.gz KIYKYZDVUBZFPB-WBVHZDCISA-N 1 0 348.443 3.643 20 5 EHBDRO C[C@H]1SCCN(Cc2cccnc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000886014440 1138032117 /nfs/dbraw/zinc/03/21/17/1138032117.db2.gz HQRKTEWTVFTWIH-CJNGLKHVSA-N 1 0 329.425 3.668 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c(C[NH+](C)C)c1 ZINC000137083237 1138046011 /nfs/dbraw/zinc/04/60/11/1138046011.db2.gz BZYMFQBGNNJAJZ-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000886777001 1138138860 /nfs/dbraw/zinc/13/88/60/1138138860.db2.gz VNSYUSWOIUSDMU-SUMWQHHRSA-N 1 0 333.432 3.567 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@](C)(O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000090890992 1138214108 /nfs/dbraw/zinc/21/41/08/1138214108.db2.gz LMDOECBMQZHYIC-SCLBCKFNSA-N 1 0 332.375 3.601 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000124729189 1138293750 /nfs/dbraw/zinc/29/37/50/1138293750.db2.gz RGDXIMALXZBQFY-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000126819139 1138339526 /nfs/dbraw/zinc/33/95/26/1138339526.db2.gz UULBELXAWSEJFO-OAHLLOKOSA-N 1 0 342.443 3.995 20 5 EHBDRO C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1n1ccnc1 ZINC000129758601 1138421230 /nfs/dbraw/zinc/42/12/30/1138421230.db2.gz VOSRONDVTTYQQS-WBMJQRKESA-N 1 0 334.807 3.528 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000130521309 1138460091 /nfs/dbraw/zinc/46/00/91/1138460091.db2.gz BEWGPCRDPQMALN-LESCRADOSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccnc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000131434185 1138517701 /nfs/dbraw/zinc/51/77/01/1138517701.db2.gz URFWTKQVABHLPB-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(OC)c(O)c1)c1cccc([N+](=O)[O-])c1 ZINC000178410057 1139692407 /nfs/dbraw/zinc/69/24/07/1139692407.db2.gz LXVYBAVTXRGUAG-INIZCTEOSA-N 1 0 330.384 3.940 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000181814084 1139933696 /nfs/dbraw/zinc/93/36/96/1139933696.db2.gz ZDVJKFSSXJUOQA-GFCCVEGCSA-N 1 0 346.358 3.680 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCc3sccc32)c([N+](=O)[O-])cc1O ZINC000183789532 1140058401 /nfs/dbraw/zinc/05/84/01/1140058401.db2.gz JOSARYBZAFAQOA-GFCCVEGCSA-N 1 0 334.397 3.538 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120638 1140503854 /nfs/dbraw/zinc/50/38/54/1140503854.db2.gz GCZYCLLWXAZZHM-AEFFLSMTSA-N 1 0 348.349 3.801 20 5 EHBDRO C[C@H]1C[C@@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192460164 1140534287 /nfs/dbraw/zinc/53/42/87/1140534287.db2.gz BFEMBQSIUVIRLB-ZFWWWQNUSA-N 1 0 346.456 3.541 20 5 EHBDRO COCc1cccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192678547 1140544611 /nfs/dbraw/zinc/54/46/11/1140544611.db2.gz LXWPLRADDPXRPJ-LJQANCHMSA-N 1 0 326.396 3.908 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000266141155 1140646052 /nfs/dbraw/zinc/64/60/52/1140646052.db2.gz HHIXPLFBBRKPCE-HOTGVXAUSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899164 1140735325 /nfs/dbraw/zinc/73/53/25/1140735325.db2.gz TUAYBGRJDUQEGE-QWHCGFSZSA-N 1 0 339.395 3.526 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC1CC[NH+](C2CCCC2)CC1 ZINC000267209850 1140768997 /nfs/dbraw/zinc/76/89/97/1140768997.db2.gz QKFCSWHVGGTRQX-UHFFFAOYSA-N 1 0 333.432 3.560 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000270924541 1141283389 /nfs/dbraw/zinc/28/33/89/1141283389.db2.gz GUZWWGGPNDCTBU-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC([NH+]2CCCCC2)CC1 ZINC000271034495 1141297831 /nfs/dbraw/zinc/29/78/31/1141297831.db2.gz IYIGOEPWJZWXTA-SOFGYWHQSA-N 1 0 329.444 3.558 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(CC)CCOCC2)cc1[N+](=O)[O-] ZINC000271195495 1141323176 /nfs/dbraw/zinc/32/31/76/1141323176.db2.gz YIMCZJCSLYWTRG-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000271548378 1141395039 /nfs/dbraw/zinc/39/50/39/1141395039.db2.gz LXOIEWHQHCRWNL-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO CC(C)([NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccc([N+](=O)[O-])cc1 ZINC000339499344 1014595428 /nfs/dbraw/zinc/59/54/28/1014595428.db2.gz FMPBAWWAZLQRTJ-OAHLLOKOSA-N 1 0 347.440 3.928 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@]1(C)CCCc2ccccc21 ZINC000430207428 1014936332 /nfs/dbraw/zinc/93/63/32/1014936332.db2.gz ZPSKPMXVOYYQCR-LJQANCHMSA-N 1 0 326.396 3.945 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000430216300 1015040685 /nfs/dbraw/zinc/04/06/85/1015040685.db2.gz FCZXOWMJYURMRP-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000449065958 1032111361 /nfs/dbraw/zinc/11/13/61/1032111361.db2.gz XTLQZAKZLUIORB-QAPCUYQASA-N 1 0 343.427 3.546 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H]1CCO ZINC000275145591 1016093966 /nfs/dbraw/zinc/09/39/66/1016093966.db2.gz UGNYDZRTFKUALJ-KFWWJZLASA-N 1 0 338.473 3.606 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432159 1016241664 /nfs/dbraw/zinc/24/16/64/1016241664.db2.gz RDKJEEDLWGEHKI-STQMWFEESA-N 1 0 336.823 3.569 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CC[NH+](CC2CC2)CC1 ZINC000340219657 1016720186 /nfs/dbraw/zinc/72/01/86/1016720186.db2.gz JRJOGKVUQCATPF-UHFFFAOYSA-N 1 0 345.446 3.556 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CC2(c3ccccc3)CC2)n1 ZINC000472641067 1016919988 /nfs/dbraw/zinc/91/99/88/1016919988.db2.gz ZPLJKMCXSMCHDY-SJORKVTESA-N 1 0 340.427 3.596 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CS1 ZINC000414497046 1016942663 /nfs/dbraw/zinc/94/26/63/1016942663.db2.gz JOGMNYVXJDLFPB-CMPLNLGQSA-N 1 0 335.454 3.702 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCOCC2)[C@@H]1C(C)C ZINC000414526633 1016954212 /nfs/dbraw/zinc/95/42/12/1016954212.db2.gz LLHGRXDTXZQQQL-SFHVURJKSA-N 1 0 348.443 3.631 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000336893098 1017066271 /nfs/dbraw/zinc/06/62/71/1017066271.db2.gz TUJJSUUAKHSBCP-KRWDZBQOSA-N 1 0 342.395 3.649 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449071757 1032160068 /nfs/dbraw/zinc/16/00/68/1032160068.db2.gz OMYSDCWDVJKJLL-KGLIPLIRSA-N 1 0 341.411 3.835 20 5 EHBDRO CCOCc1ccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449074309 1032162656 /nfs/dbraw/zinc/16/26/56/1032162656.db2.gz KJGOAONQEOEFBT-OAHLLOKOSA-N 1 0 328.412 3.852 20 5 EHBDRO CC(C)c1ccc([C@H]([NH3+])CNCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000414847464 1017237770 /nfs/dbraw/zinc/23/77/70/1017237770.db2.gz OTBAWPVXMXTVLQ-GOSISDBHSA-N 1 0 331.391 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3[NH2+]CC[C@H]4CCCC[C@H]43)n2)s1 ZINC000904689496 1032182930 /nfs/dbraw/zinc/18/29/30/1032182930.db2.gz KGNKJMSUAAVPIG-GIPNMCIBSA-N 1 0 334.401 3.547 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2ccccc2n1 ZINC000449107658 1032187717 /nfs/dbraw/zinc/18/77/17/1032187717.db2.gz NKXFIKWJRCUPTJ-OAHLLOKOSA-N 1 0 335.407 3.906 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000538188646 1032207170 /nfs/dbraw/zinc/20/71/70/1032207170.db2.gz UHZBDPBBBMGCBO-OAHLLOKOSA-N 1 0 336.338 3.993 20 5 EHBDRO Cc1cc(NCC2CC[NH+](Cc3cccs3)CC2)ncc1[N+](=O)[O-] ZINC000074744853 1032213218 /nfs/dbraw/zinc/21/32/18/1032213218.db2.gz WMUWRXRGIJEXAS-UHFFFAOYSA-N 1 0 346.456 3.684 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1ccccc1[N+](=O)[O-] ZINC000538198639 1032213858 /nfs/dbraw/zinc/21/38/58/1032213858.db2.gz RNHZBLYSZYJBIB-QWHCGFSZSA-N 1 0 339.395 3.891 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000538277519 1032264654 /nfs/dbraw/zinc/26/46/54/1032264654.db2.gz RWNBSGVMUSYZHB-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO CCCCn1cc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000449204197 1032306504 /nfs/dbraw/zinc/30/65/04/1032306504.db2.gz LPRLAUAWRZTNNE-AWEZNQCLSA-N 1 0 330.432 3.621 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC3(C2)CCOCC3)s1 ZINC000459619201 1032333229 /nfs/dbraw/zinc/33/32/29/1032333229.db2.gz LOZKNMZWKZJABA-UHFFFAOYSA-N 1 0 344.436 3.936 20 5 EHBDRO COCC1CCC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000449228774 1032347613 /nfs/dbraw/zinc/34/76/13/1032347613.db2.gz VMZZKCYTWMPKMY-UHFFFAOYSA-N 1 0 326.824 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000536860765 1032358561 /nfs/dbraw/zinc/35/85/61/1032358561.db2.gz AKUCOFQGPJSOKN-MRXNPFEDSA-N 1 0 348.399 3.939 20 5 EHBDRO COc1cc(C)ccc1[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000536861850 1032360805 /nfs/dbraw/zinc/36/08/05/1032360805.db2.gz DSCGGCMCAZBWOA-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO CCSc1cc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449257603 1032364423 /nfs/dbraw/zinc/36/44/23/1032364423.db2.gz JNTDUFKMZMXMPR-ZDUSSCGKSA-N 1 0 331.441 3.823 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCCc1cccnc1 ZINC000459650946 1032372383 /nfs/dbraw/zinc/37/23/83/1032372383.db2.gz ONDCQVBBVVHFBG-JKSUJKDBSA-N 1 0 327.428 3.922 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])CCO2 ZINC000449246757 1032384556 /nfs/dbraw/zinc/38/45/56/1032384556.db2.gz DSBOXZMELJADHW-DYVFJYSZSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000449333724 1032445523 /nfs/dbraw/zinc/44/55/23/1032445523.db2.gz VQPWHYFTEWTGGC-HIFRSBDPSA-N 1 0 348.830 3.545 20 5 EHBDRO CC[C@@](C)(C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449470467 1032588817 /nfs/dbraw/zinc/58/88/17/1032588817.db2.gz AQWRMRMAQGOVKG-INIZCTEOSA-N 1 0 335.429 3.623 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000449472428 1032592437 /nfs/dbraw/zinc/59/24/37/1032592437.db2.gz AEFMRSXFNQMXMU-JKSUJKDBSA-N 1 0 332.444 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@H]3CC[C@@H](C2)[NH2+]3)s1 ZINC000414664622 1017114627 /nfs/dbraw/zinc/11/46/27/1017114627.db2.gz TWGOTFJAMGEPSY-KGLIPLIRSA-N 1 0 343.452 3.650 20 5 EHBDRO CC(C)[C@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000610271361 1017159050 /nfs/dbraw/zinc/15/90/50/1017159050.db2.gz KEMSLDWQNQAZTI-INIZCTEOSA-N 1 0 334.441 3.820 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2c1CCCC2 ZINC000290245939 1017178418 /nfs/dbraw/zinc/17/84/18/1017178418.db2.gz VEQOGESLZHNJCB-CYBMUJFWSA-N 1 0 329.400 3.573 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH3+])CNCc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000414847467 1017238916 /nfs/dbraw/zinc/23/89/16/1017238916.db2.gz OTBAWPVXMXTVLQ-SFHVURJKSA-N 1 0 331.391 3.647 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)N1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000181541403 1017424501 /nfs/dbraw/zinc/42/45/01/1017424501.db2.gz ACOMFFROJININW-FSZRXZPDSA-N 1 0 347.459 3.529 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CCCC[NH2+]C2)s1 ZINC000415071380 1017505157 /nfs/dbraw/zinc/50/51/57/1017505157.db2.gz SVHQJVOOHUUQGI-ZDUSSCGKSA-N 1 0 331.441 3.555 20 5 EHBDRO Cc1cc(N2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000610281961 1017614159 /nfs/dbraw/zinc/61/41/59/1017614159.db2.gz MKQYVOBZIOYWDA-GOSISDBHSA-N 1 0 325.412 3.614 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000155454420 1017727047 /nfs/dbraw/zinc/72/70/47/1017727047.db2.gz ZPFITNNZMISURD-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO CC[C@H](C)C[N@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022473 1017779243 /nfs/dbraw/zinc/77/92/43/1017779243.db2.gz ZXMMVFXIQQVCLL-JTQLQIEISA-N 1 0 332.347 3.683 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000341030992 1017923864 /nfs/dbraw/zinc/92/38/64/1017923864.db2.gz BXNKDRPBDAPPDM-SFHVURJKSA-N 1 0 341.411 3.973 20 5 EHBDRO C[C@]1(CNc2ncc([N+](=O)[O-])s2)CCC[N@@H+]1Cc1ccccc1 ZINC000336943109 1018000188 /nfs/dbraw/zinc/00/01/88/1018000188.db2.gz ZYFIVQNCDMLZCD-MRXNPFEDSA-N 1 0 332.429 3.518 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H](C)O ZINC000449533522 1032742967 /nfs/dbraw/zinc/74/29/67/1032742967.db2.gz BEPUVCSXLRTWLQ-MEBBXXQBSA-N 1 0 338.791 3.757 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@@H](CCO)c1ccccc1 ZINC000893012395 1018156207 /nfs/dbraw/zinc/15/62/07/1018156207.db2.gz FTTFGACUMAUDME-CQSZACIVSA-N 1 0 334.803 3.504 20 5 EHBDRO C[C@]1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO[C@H]1C1CC1 ZINC000468046423 1018187432 /nfs/dbraw/zinc/18/74/32/1018187432.db2.gz CJZGNJDQRPLJFQ-YSIASYRMSA-N 1 0 344.455 3.711 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)c1c(C)noc1C ZINC000468615156 1018229645 /nfs/dbraw/zinc/22/96/45/1018229645.db2.gz KKYXIUJVSNCIKQ-YQCJOKCJSA-N 1 0 329.400 3.996 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCSCC(F)(F)F ZINC000468615137 1018229858 /nfs/dbraw/zinc/22/98/58/1018229858.db2.gz KFHRCRFXUZJWAY-YRNVUSSQSA-N 1 0 334.363 3.883 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000101595378 1018373378 /nfs/dbraw/zinc/37/33/78/1018373378.db2.gz XXPYTQGJBHDHNL-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CC(C)[C@@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC000602287842 1032770705 /nfs/dbraw/zinc/77/07/05/1032770705.db2.gz IHKHWMSSBDKNRW-QGZVFWFLSA-N 1 0 348.447 3.617 20 5 EHBDRO CC(C)[C@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCCCC1 ZINC000602290166 1032771784 /nfs/dbraw/zinc/77/17/84/1032771784.db2.gz UXJCVKVMKXUNHZ-KRWDZBQOSA-N 1 0 348.447 3.617 20 5 EHBDRO C[N@H+](CCCn1ccnc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000290397733 1018583647 /nfs/dbraw/zinc/58/36/47/1018583647.db2.gz JFOKOEZGYGUYKL-UHFFFAOYSA-N 1 0 340.383 3.573 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000594019409 1032789226 /nfs/dbraw/zinc/78/92/26/1032789226.db2.gz KKXOSOVYSIVDNN-SWLSCSKDSA-N 1 0 345.374 3.802 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(N3CCCC3)nc2)cccc1[N+](=O)[O-] ZINC000151044313 1019056705 /nfs/dbraw/zinc/05/67/05/1019056705.db2.gz IDMYMHIVNJCVMD-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO CC(C)C(C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000557393535 1032845373 /nfs/dbraw/zinc/84/53/73/1032845373.db2.gz TVCMMQFLLXUGMP-SFHVURJKSA-N 1 0 344.459 3.936 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(CO)CCCC1 ZINC000471619259 1020074448 /nfs/dbraw/zinc/07/44/48/1020074448.db2.gz OMKFOZDPBRCZFG-AWEZNQCLSA-N 1 0 338.473 3.608 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000156828294 1020476157 /nfs/dbraw/zinc/47/61/57/1020476157.db2.gz AGTTUMXUGMGUMC-MRXNPFEDSA-N 1 0 349.337 3.552 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1CC(C(C)(C)C)C1 ZINC000581205722 1020518105 /nfs/dbraw/zinc/51/81/05/1020518105.db2.gz OQGXKLOMRFEMSW-DNOWBOINSA-N 1 0 333.432 3.726 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCO[C@@H](c2cccs2)C1 ZINC000449631427 1032934918 /nfs/dbraw/zinc/93/49/18/1032934918.db2.gz WKCBWYKTBXSMBA-GDBMZVCRSA-N 1 0 332.425 3.975 20 5 EHBDRO CC(C)N(C)c1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cn1 ZINC000348670263 1021046559 /nfs/dbraw/zinc/04/65/59/1021046559.db2.gz INCJICMSFPCOPW-UHFFFAOYSA-N 1 0 342.443 3.509 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000507430726 1021261742 /nfs/dbraw/zinc/26/17/42/1021261742.db2.gz UILNLJHBDMYBEA-BURFUSLBSA-N 1 0 332.444 3.711 20 5 EHBDRO C[N@@H+]1C[C@@H]2CCN(C(=O)c3ccc4cc5ccccc5cc4c3)[C@@H]2C1 ZINC001270141102 1021382421 /nfs/dbraw/zinc/38/24/21/1021382421.db2.gz QWEMMZBZECXKAZ-PZJWPPBQSA-N 1 0 330.431 3.769 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568336 1032978909 /nfs/dbraw/zinc/97/89/09/1032978909.db2.gz JXSMLSXVAOWTEP-INIZCTEOSA-N 1 0 332.448 3.517 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)(C)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000518780001 1021539140 /nfs/dbraw/zinc/53/91/40/1021539140.db2.gz AJTAAXDYTQBPRJ-UHFFFAOYSA-N 1 0 328.412 3.979 20 5 EHBDRO CCN1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000518771714 1021544691 /nfs/dbraw/zinc/54/46/91/1021544691.db2.gz RHWHKDYSAGRNQJ-MRXNPFEDSA-N 1 0 345.468 3.897 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3C[C@H]3C3CCCCC3)CC2)cn1 ZINC000602590538 1032988923 /nfs/dbraw/zinc/98/89/23/1032988923.db2.gz VXEJFQUPNHIYIA-ZWKOTPCHSA-N 1 0 344.459 3.517 20 5 EHBDRO CC(C)(CO)[C@@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000602583649 1033004322 /nfs/dbraw/zinc/00/43/22/1033004322.db2.gz SMWWPQHGVJLMBL-IBGZPJMESA-N 1 0 342.439 3.529 20 5 EHBDRO O=C(Nc1ccc(-n2ccnc2)cc1)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000023889516 1021812818 /nfs/dbraw/zinc/81/28/18/1021812818.db2.gz YOAZWPMRJCBUGW-UHFFFAOYSA-N 1 0 342.742 3.686 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1CCC(C)(C)CC1 ZINC000438486182 1022025661 /nfs/dbraw/zinc/02/56/61/1022025661.db2.gz OPWWYXHLHMXQEB-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178238408 1022251112 /nfs/dbraw/zinc/25/11/12/1022251112.db2.gz YZDNLWJKJQPGAV-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC(C)(C)[C@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000550079251 1022362403 /nfs/dbraw/zinc/36/24/03/1022362403.db2.gz KSBMYMARPMGBNT-WMLDXEAASA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@H](Cn1cccn1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517538018 1022422192 /nfs/dbraw/zinc/42/21/92/1022422192.db2.gz DDCDWWCHSWLPJB-CYBMUJFWSA-N 1 0 342.424 3.698 20 5 EHBDRO CCc1cccc(Cl)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425967595 1022503612 /nfs/dbraw/zinc/50/36/12/1022503612.db2.gz OTLDOHAMIXOQAR-UHFFFAOYSA-N 1 0 348.834 3.844 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000438481643 1022704058 /nfs/dbraw/zinc/70/40/58/1022704058.db2.gz YEGPUUPBQJKGLR-ZDUSSCGKSA-N 1 0 348.321 3.528 20 5 EHBDRO CCC1(CC)CC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438507904 1022745134 /nfs/dbraw/zinc/74/51/34/1022745134.db2.gz LBMBGYFPYHUHHJ-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000058933018 1033086225 /nfs/dbraw/zinc/08/62/25/1033086225.db2.gz ONAJWPBSGHYVJG-SFHVURJKSA-N 1 0 330.359 3.950 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000075740995 1033093283 /nfs/dbraw/zinc/09/32/83/1033093283.db2.gz UPNMSOQLMODUQD-HUUCEWRRSA-N 1 0 347.459 3.530 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1cccc(Cl)c1 ZINC000509568811 1023057041 /nfs/dbraw/zinc/05/70/41/1023057041.db2.gz KCLPEZLRNVFLLB-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO COc1cc(C[N@H+](C)CCCc2ccccc2)c([N+](=O)[O-])cc1OC ZINC000507159033 1023153398 /nfs/dbraw/zinc/15/33/98/1023153398.db2.gz GJFBHRXXXZAZHM-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO COCC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000507158412 1023153525 /nfs/dbraw/zinc/15/35/25/1023153525.db2.gz DSFBVEDEOPQHMG-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510792468 1023168616 /nfs/dbraw/zinc/16/86/16/1023168616.db2.gz RQZZLBLFAKBXHR-LBPRGKRZSA-N 1 0 326.265 3.940 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCN(C3CC3)C2)s1 ZINC000518274322 1023185126 /nfs/dbraw/zinc/18/51/26/1023185126.db2.gz VBVGRHCUVKJMRK-ZDUSSCGKSA-N 1 0 343.452 3.650 20 5 EHBDRO CCOc1ccccc1CC[NH2+]Cc1cc([N+](=O)[O-])ccc1OCC ZINC000518275324 1023186769 /nfs/dbraw/zinc/18/67/69/1023186769.db2.gz FBKCKHJEYBTIIP-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000477856857 1023223094 /nfs/dbraw/zinc/22/30/94/1023223094.db2.gz IRVIZMNANBHEEN-HNAYVOBHSA-N 1 0 334.460 3.837 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475574 1023240017 /nfs/dbraw/zinc/24/00/17/1023240017.db2.gz XZOSWXDIZVTYQY-HOTGVXAUSA-N 1 0 349.450 3.820 20 5 EHBDRO CC(C)([NH2+]CCc1noc2ccccc21)c1ccccc1[N+](=O)[O-] ZINC000593991663 1033116091 /nfs/dbraw/zinc/11/60/91/1033116091.db2.gz GOVIYXCMXWFOKK-UHFFFAOYSA-N 1 0 325.368 3.803 20 5 EHBDRO COc1ccc(C[NH+]2CCC(Cc3nccs3)CC2)cc1[N+](=O)[O-] ZINC000602735777 1033126594 /nfs/dbraw/zinc/12/65/94/1033126594.db2.gz XTGSTIGTTWCQDA-UHFFFAOYSA-N 1 0 347.440 3.515 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548486538 1023494702 /nfs/dbraw/zinc/49/47/02/1023494702.db2.gz PVMQKAXYMRJARI-BLLLJJGKSA-N 1 0 334.416 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H]3C[C@H]3C3CC3)cs2)c1 ZINC000449739411 1033141136 /nfs/dbraw/zinc/14/11/36/1033141136.db2.gz ABJCLXWXPGKZAW-BBRMVZONSA-N 1 0 329.425 3.854 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])cc1C)c1ccsc1 ZINC000341913002 1023673393 /nfs/dbraw/zinc/67/33/93/1023673393.db2.gz AWJZMQZHBAYRPV-OAHLLOKOSA-N 1 0 334.445 3.855 20 5 EHBDRO Cc1csc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000610799040 1023687041 /nfs/dbraw/zinc/68/70/41/1023687041.db2.gz VCBPBXWAMLFQKJ-OAHLLOKOSA-N 1 0 331.441 3.513 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000610809796 1023694659 /nfs/dbraw/zinc/69/46/59/1023694659.db2.gz GDXAVGHLCZEZNZ-UKRRQHHQSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC([NH+]4CCCCC4)CC3)ccc2c1 ZINC000277072297 1023742120 /nfs/dbraw/zinc/74/21/20/1023742120.db2.gz IWWKVOIVQCUJLO-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccccc1[C@H](C)[N@@H+](Cc1c([N+](=O)[O-])ncn1C)CC(C)C ZINC000342067408 1023816517 /nfs/dbraw/zinc/81/65/17/1023816517.db2.gz SITALTKDSACGOS-HNNXBMFYSA-N 1 0 330.432 3.856 20 5 EHBDRO CCO[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000610930449 1023877513 /nfs/dbraw/zinc/87/75/13/1023877513.db2.gz HRVWIZYAIPLIKF-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1COc2c(C)cccc2C1 ZINC000574444251 1033169805 /nfs/dbraw/zinc/16/98/05/1033169805.db2.gz ZCVHFXRXRINQRB-ZBFHGGJFSA-N 1 0 326.396 3.866 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000065202258 1023891462 /nfs/dbraw/zinc/89/14/62/1023891462.db2.gz PGYYOFYOGWMALW-KRWDZBQOSA-N 1 0 325.412 3.919 20 5 EHBDRO CCOc1ccccc1C[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000065223094 1023986056 /nfs/dbraw/zinc/98/60/56/1023986056.db2.gz FAVGFJWRCLQEDN-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CO[C@H](C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000514078273 1024109506 /nfs/dbraw/zinc/10/95/06/1024109506.db2.gz IRMHRCOOWJIESN-GOSISDBHSA-N 1 0 346.814 3.994 20 5 EHBDRO CC1=NO[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000895311362 1024269287 /nfs/dbraw/zinc/26/92/87/1024269287.db2.gz PPBMEMBZOGWEDB-AWEZNQCLSA-N 1 0 331.397 3.578 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000320358383 1024322861 /nfs/dbraw/zinc/32/28/61/1024322861.db2.gz MIQUXUDRGXVUBY-LLVKDONJSA-N 1 0 331.338 3.756 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000430112698 1024380560 /nfs/dbraw/zinc/38/05/60/1024380560.db2.gz DZMVXDRVKUWYJT-AWFASNGWSA-N 1 0 343.471 3.660 20 5 EHBDRO C/C(=C/c1ccccc1)C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737319 1024499518 /nfs/dbraw/zinc/49/95/18/1024499518.db2.gz VVQCPKXQVUSWFV-JBXOJTMHSA-N 1 0 338.411 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(OCC3CCCC3)CC2)cc1 ZINC000434908096 1024500049 /nfs/dbraw/zinc/50/00/49/1024500049.db2.gz WVWKWXVCZKSWAD-UHFFFAOYSA-N 1 0 348.443 3.645 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957237 1024526066 /nfs/dbraw/zinc/52/60/66/1024526066.db2.gz ZMKBBUVSXQAOEL-DOMZBBRYSA-N 1 0 346.818 3.891 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C1CC(F)(F)C1 ZINC000895610405 1024658678 /nfs/dbraw/zinc/65/86/78/1024658678.db2.gz AKCAYJPOUSTTQF-QMMMGPOBSA-N 1 0 349.175 3.881 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1C)c1cccc([N+](=O)[O-])c1 ZINC000342285714 1024729031 /nfs/dbraw/zinc/72/90/31/1024729031.db2.gz MNRCSERHCISGMR-KRWDZBQOSA-N 1 0 341.411 3.891 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000548617234 1024755384 /nfs/dbraw/zinc/75/53/84/1024755384.db2.gz IGZKMIPZMIDRIN-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO C[NH2+]C[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000435372024 1024855893 /nfs/dbraw/zinc/85/58/93/1024855893.db2.gz QEOLQUWUJLBKJC-CQSZACIVSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395020 1024881520 /nfs/dbraw/zinc/88/15/20/1024881520.db2.gz NUSAJONQPWLZPL-BDJLRTHQSA-N 1 0 349.818 3.677 20 5 EHBDRO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@@H]1[NH3+] ZINC000435395023 1024882953 /nfs/dbraw/zinc/88/29/53/1024882953.db2.gz NUSAJONQPWLZPL-ZBEGNZNMSA-N 1 0 349.818 3.677 20 5 EHBDRO CC[C@@H]([NH2+]CCCc1nc(C(C)C)no1)c1cccc([N+](=O)[O-])c1 ZINC000178516349 1024907828 /nfs/dbraw/zinc/90/78/28/1024907828.db2.gz LKPDDQINLOJZFS-OAHLLOKOSA-N 1 0 332.404 3.775 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000594097490 1033252651 /nfs/dbraw/zinc/25/26/51/1033252651.db2.gz OCERZEONHCOTMW-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000274353293 1025097756 /nfs/dbraw/zinc/09/77/56/1025097756.db2.gz GQCNEQWFPWUJHX-PXAZEXFGSA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCc1ccc(F)c(F)c1F ZINC000544366680 1025199698 /nfs/dbraw/zinc/19/96/98/1025199698.db2.gz YUACYNZAAKNPTH-HYXAFXHYSA-N 1 0 336.313 3.858 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)cnn1C ZINC000294588076 1025242398 /nfs/dbraw/zinc/24/23/98/1025242398.db2.gz MXFRNCIMSWODPC-SECBINFHSA-N 1 0 342.321 3.506 20 5 EHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606572 1025456150 /nfs/dbraw/zinc/45/61/50/1025456150.db2.gz CLJFPMMCJQSLOL-XJKSGUPXSA-N 1 0 329.400 3.913 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)[nH]c1C(C)C ZINC000896509463 1025491775 /nfs/dbraw/zinc/49/17/75/1025491775.db2.gz FGUHRNBPMBCSKG-GFCCVEGCSA-N 1 0 345.399 3.684 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451100302 1025561403 /nfs/dbraw/zinc/56/14/03/1025561403.db2.gz RXTRETPABOGACJ-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)NCc1csc([N+](=O)[O-])c1)[NH+](C)C ZINC000443012254 1025662637 /nfs/dbraw/zinc/66/26/37/1025662637.db2.gz IQYHPLFWDOGUSL-SUMWQHHRSA-N 1 0 333.457 3.746 20 5 EHBDRO CCN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000439694267 1025711930 /nfs/dbraw/zinc/71/19/30/1025711930.db2.gz VMTBQKJDWMPMFZ-GOSISDBHSA-N 1 0 339.439 3.943 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H](c1ccccc1)N(C)C ZINC000248647447 1025775987 /nfs/dbraw/zinc/77/59/87/1025775987.db2.gz SZBXIRMHOUOCJR-QMTMVMCOSA-N 1 0 327.428 3.937 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000896950262 1026147770 /nfs/dbraw/zinc/14/77/70/1026147770.db2.gz AGEIBPUPMBFOIG-SKDRFNHKSA-N 1 0 334.363 3.987 20 5 EHBDRO COc1ccc2c(c1)CN([C@H](C)c1ccccc1[N+](=O)[O-])CCO2 ZINC000451641540 1026197698 /nfs/dbraw/zinc/19/76/98/1026197698.db2.gz IHZRYBABSDRSAS-CYBMUJFWSA-N 1 0 328.368 3.559 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375800 1026540562 /nfs/dbraw/zinc/54/05/62/1026540562.db2.gz UYKRTHWMFDLMEE-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1Br ZINC000127877361 1026600564 /nfs/dbraw/zinc/60/05/64/1026600564.db2.gz SSNAPJUIWJTLLG-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000520058782 1026712568 /nfs/dbraw/zinc/71/25/68/1026712568.db2.gz YYTAKNUEFDFEIT-GOSISDBHSA-N 1 0 330.359 3.950 20 5 EHBDRO O=C(CC[NH2+][C@@H](c1ccccc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000128025909 1026836390 /nfs/dbraw/zinc/83/63/90/1026836390.db2.gz KELJRUUZBJKPQI-IBGZPJMESA-N 1 0 339.395 3.664 20 5 EHBDRO C[C@@]1(CO)CCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237476973 1026956426 /nfs/dbraw/zinc/95/64/26/1026956426.db2.gz QHJPJQVJCUMEGX-ROUUACIJSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178641136 1026990252 /nfs/dbraw/zinc/99/02/52/1026990252.db2.gz PFXCUAFBSXJOHN-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178641122 1026990814 /nfs/dbraw/zinc/99/08/14/1026990814.db2.gz PFXCUAFBSXJOHN-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC[C@@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)C2)cc1OC ZINC001167602809 1027009239 /nfs/dbraw/zinc/00/92/39/1027009239.db2.gz QFMDWKXLGQLWAC-ZIAGYGMSSA-N 1 0 336.432 3.870 20 5 EHBDRO CC(C)[C@H](c1ccccc1Cl)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472247234 1027035345 /nfs/dbraw/zinc/03/53/45/1027035345.db2.gz CKRJVOTVOGVBIR-MRXNPFEDSA-N 1 0 336.823 3.774 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCSC2(CCCCC2)C1 ZINC001167608597 1027389155 /nfs/dbraw/zinc/38/91/55/1027389155.db2.gz OJBSMNMRCMOXSI-UHFFFAOYSA-N 1 0 336.457 3.855 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000127184649 1027410408 /nfs/dbraw/zinc/41/04/08/1027410408.db2.gz PQFAGUJBIFAYQB-CQSZACIVSA-N 1 0 329.400 3.504 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000783592552 1027539070 /nfs/dbraw/zinc/53/90/70/1027539070.db2.gz IMKJYSHHKSHSJV-MRXNPFEDSA-N 1 0 347.846 3.511 20 5 EHBDRO C[C@H]1CCCC[C@@H]1OCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597566 1027591699 /nfs/dbraw/zinc/59/16/99/1027591699.db2.gz TWHRJGOLANLOIW-LRDDRELGSA-N 1 0 326.824 3.933 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000475552298 1027602761 /nfs/dbraw/zinc/60/27/61/1027602761.db2.gz CGGYQYUEQNRFPN-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@H](C)C[NH+]1CCCCCC1 ZINC000475575015 1027682075 /nfs/dbraw/zinc/68/20/75/1027682075.db2.gz YPKXFYHGJLCIKC-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@H]1C(C)(C)C ZINC000533428499 1027864756 /nfs/dbraw/zinc/86/47/56/1027864756.db2.gz VQKGHSRLEZVXDS-INIZCTEOSA-N 1 0 333.432 3.742 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2cc([N+](=O)[O-])ccc2n1 ZINC001167623886 1027877721 /nfs/dbraw/zinc/87/77/21/1027877721.db2.gz AHFUHUNLUNXJKR-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000178689689 1027991791 /nfs/dbraw/zinc/99/17/91/1027991791.db2.gz DIPWNNQXAKAFNW-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO [NH3+][C@@H]1CCC[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000423374186 1028379536 /nfs/dbraw/zinc/37/95/36/1028379536.db2.gz HZADJUBNGGCULX-ZIFCJYIRSA-N 1 0 325.412 3.544 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000909612106 1028392363 /nfs/dbraw/zinc/39/23/63/1028392363.db2.gz FQDHRTSSDXSTQS-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[NH2+]Cc1cccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)c1 ZINC000237240362 1028560174 /nfs/dbraw/zinc/56/01/74/1028560174.db2.gz CTJPVVUUYRSRHB-UHFFFAOYSA-N 1 0 341.411 3.864 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000268842393 1028630361 /nfs/dbraw/zinc/63/03/61/1028630361.db2.gz FUPDCOXCKQTLEM-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO COc1cccc(C2(C[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CC2)c1 ZINC000514820525 1028720783 /nfs/dbraw/zinc/72/07/83/1028720783.db2.gz SEUFBDYTIBULNQ-UHFFFAOYSA-N 1 0 326.396 3.733 20 5 EHBDRO CCc1cnc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130205700 1028774898 /nfs/dbraw/zinc/77/48/98/1028774898.db2.gz ITRJXHVQWXGCOR-MRXNPFEDSA-N 1 0 345.468 3.767 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000504899702 1029041798 /nfs/dbraw/zinc/04/17/98/1029041798.db2.gz KREMBSNONXPZEH-CYBMUJFWSA-N 1 0 348.374 3.862 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(O)CCCCCC2)cc1[N+](=O)[O-] ZINC000504899842 1029041887 /nfs/dbraw/zinc/04/18/87/1029041887.db2.gz NIEZBUFNOGDPLB-CQSZACIVSA-N 1 0 336.432 3.729 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CN(C2CC2)C[C@@H]1C ZINC000504917995 1029044264 /nfs/dbraw/zinc/04/42/64/1029044264.db2.gz FPQJHFGDIQLHGA-SQWLQELKSA-N 1 0 349.500 3.538 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2CCC(OC)CC2)cc1[N+](=O)[O-] ZINC000504912300 1029054354 /nfs/dbraw/zinc/05/43/54/1029054354.db2.gz UBTPIKYODKDKMD-HLIUYOAVSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(C2(O)CCC2)CC1 ZINC000897527416 1029062288 /nfs/dbraw/zinc/06/22/88/1029062288.db2.gz LUGZXSDNVZBHLN-UHFFFAOYSA-N 1 0 345.226 3.686 20 5 EHBDRO COc1cccc(NC2CCN(Cc3csc([N+](=O)[O-])c3)CC2)c1 ZINC000110036612 1029090239 /nfs/dbraw/zinc/09/02/39/1029090239.db2.gz PIKNKHJORYTMMZ-UHFFFAOYSA-N 1 0 347.440 3.741 20 5 EHBDRO COc1cc(C[NH2+]CC(C)(C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000237126731 1029155737 /nfs/dbraw/zinc/15/57/37/1029155737.db2.gz WBRNICGYAWQYFA-UHFFFAOYSA-N 1 0 344.411 3.679 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H]1CCC[C@H]1c1ccccc1 ZINC000446002926 1029320002 /nfs/dbraw/zinc/32/00/02/1029320002.db2.gz OGVJPFSYRMWMMC-IRXDYDNUSA-N 1 0 326.396 3.900 20 5 EHBDRO COc1cccc(CCC[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)c1 ZINC000446737239 1029784830 /nfs/dbraw/zinc/78/48/30/1029784830.db2.gz YXAWZMBJTBDGNN-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525409897 1029838870 /nfs/dbraw/zinc/83/88/70/1029838870.db2.gz WRJHQJGHRPQAEU-RCCFBDPRSA-N 1 0 332.444 3.663 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@@H](CCCc2ccccc2)C1 ZINC000441181640 1029880104 /nfs/dbraw/zinc/88/01/04/1029880104.db2.gz SQEWJVZXVMZLKH-QGZVFWFLSA-N 1 0 342.443 3.563 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c(F)c1 ZINC000728567593 1029891378 /nfs/dbraw/zinc/89/13/78/1029891378.db2.gz VWRBULONQDHPBT-OAHLLOKOSA-N 1 0 335.423 3.826 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441185392 1029917613 /nfs/dbraw/zinc/91/76/13/1029917613.db2.gz ZRAATVJVHHVDCU-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NCC1([NH+](C)C)CCCCCC1 ZINC000525642847 1030007165 /nfs/dbraw/zinc/00/71/65/1030007165.db2.gz IIYOJLCKPCKXBN-UHFFFAOYSA-N 1 0 335.448 3.808 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C1CCN(C(=O)OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000186752409 1030068041 /nfs/dbraw/zinc/06/80/41/1030068041.db2.gz HRFBDDHIDQYCFK-CXAGYDPISA-N 1 0 349.431 3.502 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2ccccc2F)c([N+](=O)[O-])c1 ZINC000441234415 1030085319 /nfs/dbraw/zinc/08/53/19/1030085319.db2.gz NTPIAGPVRRGXNB-CYBMUJFWSA-N 1 0 348.374 3.814 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000531953825 1030126147 /nfs/dbraw/zinc/12/61/47/1030126147.db2.gz VWMLFFARAZKOKO-LSDHHAIUSA-N 1 0 325.412 3.697 20 5 EHBDRO COC(=O)c1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000482081143 1030200824 /nfs/dbraw/zinc/20/08/24/1030200824.db2.gz KOHZKSYNEONSAS-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccccc2Cl)n1 ZINC000447522966 1030244458 /nfs/dbraw/zinc/24/44/58/1030244458.db2.gz ROJVTWQVKILMPV-GJZGRUSLSA-N 1 0 334.807 3.718 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447510739 1030257884 /nfs/dbraw/zinc/25/78/84/1030257884.db2.gz ZWRTZLUNNKEYEY-LJQANCHMSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447513082 1030260669 /nfs/dbraw/zinc/26/06/69/1030260669.db2.gz SOFRRUCLHNFPER-OIISXLGYSA-N 1 0 328.416 3.668 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000447535830 1030270735 /nfs/dbraw/zinc/27/07/35/1030270735.db2.gz IRTNWQOHTKQGDF-JKSUJKDBSA-N 1 0 332.379 3.512 20 5 EHBDRO CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000026154221 1030630751 /nfs/dbraw/zinc/63/07/51/1030630751.db2.gz LHIHIRKXOXGEGW-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO COc1ccccc1OCC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000527288453 1030772849 /nfs/dbraw/zinc/77/28/49/1030772849.db2.gz BPPCNPDYBQBDAA-QINSGFPZSA-N 1 0 342.395 3.675 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1(O)CCCCCC1)C1CC1 ZINC000483149671 1031003615 /nfs/dbraw/zinc/00/36/15/1031003615.db2.gz GNTVKTNRSVJCDS-QGZVFWFLSA-N 1 0 332.444 3.591 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000448366173 1031020242 /nfs/dbraw/zinc/02/02/42/1031020242.db2.gz KPCZKMFZAOUKIJ-MRXNPFEDSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@@H]3CCCS3)cs2)c1 ZINC000152610711 1031117018 /nfs/dbraw/zinc/11/70/18/1031117018.db2.gz YORYIQAYIFXVFF-AWEZNQCLSA-N 1 0 335.454 3.704 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916529 1031275044 /nfs/dbraw/zinc/27/50/44/1031275044.db2.gz QDUBSAUDZWPPOT-WDMOLILDSA-N 1 0 332.322 3.745 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C1CCCCC1 ZINC000483739070 1031311917 /nfs/dbraw/zinc/31/19/17/1031311917.db2.gz FGCCXXRUUMGCOI-KBPBESRZSA-N 1 0 333.432 3.870 20 5 EHBDRO COc1cc(C[NH2+][C@@]2(C)CCCc3ccccc32)ccc1[N+](=O)[O-] ZINC000483752879 1031319688 /nfs/dbraw/zinc/31/96/88/1031319688.db2.gz FDQVXSKSXWYELI-IBGZPJMESA-N 1 0 326.396 3.945 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+]([C@@H](C)c2ccccc2)C1 ZINC000536183625 1031351535 /nfs/dbraw/zinc/35/15/35/1031351535.db2.gz SQSBDIFZYDRUFS-HOCLYGCPSA-N 1 0 326.400 3.546 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161242912 1031426776 /nfs/dbraw/zinc/42/67/76/1031426776.db2.gz WRIXLILWBLKQTR-RISCZKNCSA-N 1 0 343.349 3.534 20 5 EHBDRO CC(C)CC[C@](C)(O)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484137814 1031477118 /nfs/dbraw/zinc/47/71/18/1031477118.db2.gz UBYWTDDZHQEGEO-MJGOQNOKSA-N 1 0 334.460 3.693 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000584102629 1031736249 /nfs/dbraw/zinc/73/62/49/1031736249.db2.gz YUCZYGWHGHBBQX-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO CC[N@H+](CCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1)CC1CC1 ZINC000537826370 1031943750 /nfs/dbraw/zinc/94/37/50/1031943750.db2.gz XSIXXYZEMQTVIJ-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000537887529 1031990802 /nfs/dbraw/zinc/99/08/02/1031990802.db2.gz WLZWAQKBORMIFO-CRAIPNDOSA-N 1 0 343.427 3.743 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000537887532 1031990993 /nfs/dbraw/zinc/99/09/93/1031990993.db2.gz WLZWAQKBORMIFO-YJBOKZPZSA-N 1 0 343.427 3.743 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000537950702 1032035917 /nfs/dbraw/zinc/03/59/17/1032035917.db2.gz JDKHDIVXJUXJAW-AUUYWEPGSA-N 1 0 325.412 3.741 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000537952478 1032038541 /nfs/dbraw/zinc/03/85/41/1032038541.db2.gz HRXVENAVKWPPQG-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H](COCC(F)(F)F)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278699055 1032054420 /nfs/dbraw/zinc/05/44/20/1032054420.db2.gz KVQLHVRKUBJWIX-YGRLFVJLSA-N 1 0 332.322 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCC=CCCC3)CC2)cn1 ZINC000898031549 1033295246 /nfs/dbraw/zinc/29/52/46/1033295246.db2.gz FNLGFOGVVLQWFT-INIZCTEOSA-N 1 0 344.459 3.685 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](CCCO)c1ccccc1 ZINC000594495264 1033397287 /nfs/dbraw/zinc/39/72/87/1033397287.db2.gz PGAZEJVJZSRJQS-QZTJIDSGSA-N 1 0 326.396 3.686 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505832 1033406294 /nfs/dbraw/zinc/40/62/94/1033406294.db2.gz BPQJMDDVSWVTON-ZWNOBZJWSA-N 1 0 332.322 3.529 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ncc(C)cc1C ZINC000594519212 1033425319 /nfs/dbraw/zinc/42/53/19/1033425319.db2.gz FGFCKFRCYUHCJW-GDNBJRDFSA-N 1 0 325.412 3.842 20 5 EHBDRO C[N@H+](CCC(=O)Nc1cccc(Cl)c1)Cc1ccccc1[N+](=O)[O-] ZINC000026349233 1033525652 /nfs/dbraw/zinc/52/56/52/1033525652.db2.gz RNSBZVBYUHTGCH-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO COCc1csc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000594919751 1033544266 /nfs/dbraw/zinc/54/42/66/1033544266.db2.gz AFLRZMXIILJTRE-UHFFFAOYSA-N 1 0 334.441 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccc3c(c1)CCO3)CCC2 ZINC000574834631 1033556663 /nfs/dbraw/zinc/55/66/63/1033556663.db2.gz IVZPHPGRYJELJF-LJQANCHMSA-N 1 0 338.407 3.739 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H]2C[C@H](c3ccccc3)CO2)cc1[N+](=O)[O-] ZINC000594974751 1033579667 /nfs/dbraw/zinc/57/96/67/1033579667.db2.gz HXZZQQYXDMXLRA-ROUUACIJSA-N 1 0 326.396 3.566 20 5 EHBDRO COCc1csc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000594955625 1033595344 /nfs/dbraw/zinc/59/53/44/1033595344.db2.gz RCEAHGRQRJLNTE-UHFFFAOYSA-N 1 0 345.424 3.616 20 5 EHBDRO CC1(C)OC[C@@H]2C[C@@]21[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000598986600 1033611447 /nfs/dbraw/zinc/61/14/47/1033611447.db2.gz DFMBOEGIRWIPJH-SCLBCKFNSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000595000225 1033626549 /nfs/dbraw/zinc/62/65/49/1033626549.db2.gz HWDXZNAIIIXRLV-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[NH+](C)C ZINC000603438474 1033630905 /nfs/dbraw/zinc/63/09/05/1033630905.db2.gz OXAPCPIVXBENGU-SFHVURJKSA-N 1 0 330.432 3.921 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057264 1033634921 /nfs/dbraw/zinc/63/49/21/1033634921.db2.gz VYNJIYOEZZSXNR-UKRRQHHQSA-N 1 0 335.448 3.517 20 5 EHBDRO COc1ccc(C[NH2+]CC2(C(F)(F)F)CCCC2)cc1[N+](=O)[O-] ZINC000599013217 1033640812 /nfs/dbraw/zinc/64/08/12/1033640812.db2.gz FNCCBMSFTPTTAV-UHFFFAOYSA-N 1 0 332.322 3.816 20 5 EHBDRO O=[N+]([O-])c1cccnc1NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000063737628 1033642557 /nfs/dbraw/zinc/64/25/57/1033642557.db2.gz NBXSBPXXXFJOBM-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595074707 1033644271 /nfs/dbraw/zinc/64/42/71/1033644271.db2.gz UJDPOKHRCKERSR-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCSCC(F)(F)F ZINC000595027279 1033648167 /nfs/dbraw/zinc/64/81/67/1033648167.db2.gz QTGWBLPGAQCDRA-VIFPVBQESA-N 1 0 338.351 3.550 20 5 EHBDRO COCc1ccccc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122023766 1033653744 /nfs/dbraw/zinc/65/37/44/1033653744.db2.gz XVLXBUCRCOXIKR-IBGZPJMESA-N 1 0 340.423 3.852 20 5 EHBDRO CCc1nc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cs1 ZINC000595045350 1033662794 /nfs/dbraw/zinc/66/27/94/1033662794.db2.gz YWJPSRJAAAXJSL-LLVKDONJSA-N 1 0 335.429 3.516 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078562431 1033712849 /nfs/dbraw/zinc/71/28/49/1033712849.db2.gz NGACTHWTNBYZHC-LBPRGKRZSA-N 1 0 345.365 3.782 20 5 EHBDRO Cc1ncccc1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599072283 1033715506 /nfs/dbraw/zinc/71/55/06/1033715506.db2.gz AJGSJUHLTVGAGS-QAPCUYQASA-N 1 0 325.412 3.799 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 ZINC000599075095 1033716662 /nfs/dbraw/zinc/71/66/62/1033716662.db2.gz SRYRARNGRWQEQA-FUHWJXTLSA-N 1 0 339.395 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCN1C1CCCC1)CCC2 ZINC000599074670 1033717867 /nfs/dbraw/zinc/71/78/67/1033717867.db2.gz UFNNVVQHAAJIFI-HKUYNNGSSA-N 1 0 329.444 3.579 20 5 EHBDRO Cc1noc(C[N@H+](CCc2ccc(Cl)cc2)CC2CC2)c1[N+](=O)[O-] ZINC000595320532 1033740490 /nfs/dbraw/zinc/74/04/90/1033740490.db2.gz GGQWIFWLNMYFOS-UHFFFAOYSA-N 1 0 349.818 3.999 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363642 1033781692 /nfs/dbraw/zinc/78/16/92/1033781692.db2.gz FWYGDDRWLMOICJ-VBQJREDUSA-N 1 0 335.423 3.571 20 5 EHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@@H]2Cc2ccccc2)c1[N+](=O)[O-] ZINC000595441555 1033803472 /nfs/dbraw/zinc/80/34/72/1033803472.db2.gz WTMIGHUIDWQKQX-CVEARBPZSA-N 1 0 329.400 3.782 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000595491955 1033829675 /nfs/dbraw/zinc/82/96/75/1033829675.db2.gz IXZSAFYYYLFWRY-HNNXBMFYSA-N 1 0 348.374 3.992 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC2(CO)CCC2)c2ccccc2)c1 ZINC000593719059 1033835719 /nfs/dbraw/zinc/83/57/19/1033835719.db2.gz UPQHFFXESWOYJL-IBGZPJMESA-N 1 0 340.423 3.827 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@]2(C)Cc2cccc(F)c2)c1[N+](=O)[O-] ZINC000595564068 1033845173 /nfs/dbraw/zinc/84/51/73/1033845173.db2.gz WETIFXKNCLFLEQ-QGZVFWFLSA-N 1 0 333.363 3.628 20 5 EHBDRO CN1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000608836171 1033907690 /nfs/dbraw/zinc/90/76/90/1033907690.db2.gz UMUMHKLJLQHRLT-LBPRGKRZSA-N 1 0 349.818 3.692 20 5 EHBDRO CN(C(=O)C[NH+]1CCC2(CCCCC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000608833425 1033908775 /nfs/dbraw/zinc/90/87/75/1033908775.db2.gz YGTVHMMBRORPIS-UHFFFAOYSA-N 1 0 345.443 3.604 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000603868005 1033994877 /nfs/dbraw/zinc/99/48/77/1033994877.db2.gz IHOVFOOKEXZFQA-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590206 1034027694 /nfs/dbraw/zinc/02/76/94/1034027694.db2.gz VWYRBWFEUOOVTH-BBRMVZONSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@@H]1CC[N@H+](CCN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610450 1034071559 /nfs/dbraw/zinc/07/15/59/1034071559.db2.gz MAWXHWOMPSNDJR-UZLBHIALSA-N 1 0 339.439 3.616 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[NH+](C3CCCCC3)CC2)ccc1Cl ZINC001168325039 1034111576 /nfs/dbraw/zinc/11/15/76/1034111576.db2.gz PYYHIVYILVNBFV-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC(C[NH+]3CCCC3)CC2)ccc1Cl ZINC000171139422 1034137327 /nfs/dbraw/zinc/13/73/27/1034137327.db2.gz VSYMLIJIEHGBJA-UHFFFAOYSA-N 1 0 337.851 3.556 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3cc(F)cc([N+](=O)[O-])c3)ccc21 ZINC000456259126 1034256005 /nfs/dbraw/zinc/25/60/05/1034256005.db2.gz DWDZCHPWZLCHKU-QGZVFWFLSA-N 1 0 343.358 3.535 20 5 EHBDRO CC1(C)C[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccncc1 ZINC000596590227 1034307403 /nfs/dbraw/zinc/30/74/03/1034307403.db2.gz DPJUAROYPPDUPF-SFHVURJKSA-N 1 0 341.411 3.842 20 5 EHBDRO CC[C@H]([NH2+]CCOCc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000179463320 1034327840 /nfs/dbraw/zinc/32/78/40/1034327840.db2.gz JDJJMEAUQRCZJL-IBGZPJMESA-N 1 0 344.411 3.861 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000310512218 1034534104 /nfs/dbraw/zinc/53/41/04/1034534104.db2.gz PPYOKZJZQYQYAV-HUUCEWRRSA-N 1 0 349.431 3.520 20 5 EHBDRO C[C@@]12COC[C@H]1C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210915 1034593756 /nfs/dbraw/zinc/59/37/56/1034593756.db2.gz ITTOXXHLTGWVBJ-FZKQIMNGSA-N 1 0 344.436 3.792 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](Cc1ccccc1)N(C)C ZINC000534529343 1034647592 /nfs/dbraw/zinc/64/75/92/1034647592.db2.gz FJLRGMSKRCAPEL-LPHOPBHVSA-N 1 0 341.455 3.727 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000534530851 1034650241 /nfs/dbraw/zinc/65/02/41/1034650241.db2.gz READCXYWCOGFOB-SFHVURJKSA-N 1 0 334.379 3.742 20 5 EHBDRO COC[C@@H]1CCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000450950330 1034971166 /nfs/dbraw/zinc/97/11/66/1034971166.db2.gz VBURXFLVNNXCLN-CQSZACIVSA-N 1 0 329.400 3.704 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCC[C@H]1OCc1ccccc1 ZINC000450975430 1034977266 /nfs/dbraw/zinc/97/72/66/1034977266.db2.gz XMDWBJDPGIUIPV-PKOBYXMFSA-N 1 0 326.396 3.822 20 5 EHBDRO CO[C@@](C)([C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000411970125 1035089626 /nfs/dbraw/zinc/08/96/26/1035089626.db2.gz MVYWHTLGQBCTEW-BONVTDFDSA-N 1 0 346.349 3.907 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@@H]1CCCc3sccc31)OCCO2 ZINC000613418306 1035820911 /nfs/dbraw/zinc/82/09/11/1035820911.db2.gz CUVGMQDFTXFGDH-CYBMUJFWSA-N 1 0 346.408 3.595 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccccc1[N+](=O)[O-] ZINC000492462742 1035822849 /nfs/dbraw/zinc/82/28/49/1035822849.db2.gz OKQXNWGPMHDCBA-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000463967293 1036015269 /nfs/dbraw/zinc/01/52/69/1036015269.db2.gz WJAGQGAEVONHBZ-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO C[N@H+](CCc1nccs1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000180179889 1036062885 /nfs/dbraw/zinc/06/28/85/1036062885.db2.gz MNSDOJCAQYOFIN-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO CC[C@H](C)[N@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000589180872 1036294310 /nfs/dbraw/zinc/29/43/10/1036294310.db2.gz LEQUIGCXBBAOKR-HNNXBMFYSA-N 1 0 335.451 3.848 20 5 EHBDRO Cn1cc(C[NH+]2CCC3(CCC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589188186 1036298178 /nfs/dbraw/zinc/29/81/78/1036298178.db2.gz GQSKGFYGJZSLET-UHFFFAOYSA-N 1 0 340.427 3.761 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(CC[NH+](C)C)Cc1ccc(F)cc1 ZINC000589195071 1036303896 /nfs/dbraw/zinc/30/38/96/1036303896.db2.gz GFPQELBZWKRJSZ-UHFFFAOYSA-N 1 0 345.418 3.606 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000589300213 1036328686 /nfs/dbraw/zinc/32/86/86/1036328686.db2.gz DZPLUVRBFZUSFE-JCGIZDLHSA-N 1 0 330.428 3.998 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC3(C2)CCCCC3)c1 ZINC000589503624 1036440777 /nfs/dbraw/zinc/44/07/77/1036440777.db2.gz XDFILJUTPHJTJP-UHFFFAOYSA-N 1 0 332.400 3.538 20 5 EHBDRO Cc1cc(N2CCNc3ccccc3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000589559468 1036525105 /nfs/dbraw/zinc/52/51/05/1036525105.db2.gz NTTBRANBOWRMKE-UHFFFAOYSA-N 1 0 334.379 3.884 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCO[C@H]2C2CC2)s1 ZINC000535541159 1036618857 /nfs/dbraw/zinc/61/88/57/1036618857.db2.gz CFRYFTVMGSDDKX-QAPCUYQASA-N 1 0 344.436 3.980 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000165640566 1036662355 /nfs/dbraw/zinc/66/23/55/1036662355.db2.gz JOEJQCJQVUTLTG-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCc1ccccc1OC(F)(F)F ZINC000237718067 1036876301 /nfs/dbraw/zinc/87/63/01/1036876301.db2.gz BNXWYNDEBLUQOO-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000414350212 1036880668 /nfs/dbraw/zinc/88/06/68/1036880668.db2.gz QGHJLRJELNHNGK-CJNGLKHVSA-N 1 0 329.375 3.663 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NCc1csc([N+](=O)[O-])c1 ZINC000539531019 1036888947 /nfs/dbraw/zinc/88/89/47/1036888947.db2.gz OYEIKQQHERQRTO-GJZGRUSLSA-N 1 0 325.478 3.647 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)s1 ZINC000076342880 1036938020 /nfs/dbraw/zinc/93/80/20/1036938020.db2.gz QVHSOQRTDJUGPV-UHFFFAOYSA-N 1 0 347.440 3.734 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](C(=O)NC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000361481579 1036984824 /nfs/dbraw/zinc/98/48/24/1036984824.db2.gz OMVNQVAIQKBOSP-NUJGCVRESA-N 1 0 347.459 3.719 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163396070 1037089047 /nfs/dbraw/zinc/08/90/47/1037089047.db2.gz OIDDBNWMHYVZHX-IUODEOHRSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@@H](COc1cccc(F)c1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521375 1037090284 /nfs/dbraw/zinc/09/02/84/1037090284.db2.gz GGNIOCIQLJYXOY-NSHDSACASA-N 1 0 338.766 3.944 20 5 EHBDRO CC[C@@H](CCO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738870 1037133849 /nfs/dbraw/zinc/13/38/49/1037133849.db2.gz MHZBLGFFSLEZNF-KXBFYZLASA-N 1 0 328.412 3.682 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2Cc3cccc(O)c3C2)cc1[N+](=O)[O-] ZINC000428556500 1037158451 /nfs/dbraw/zinc/15/84/51/1037158451.db2.gz DTGAAAATOXRHLY-OAHLLOKOSA-N 1 0 326.396 3.681 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000542242644 1037207344 /nfs/dbraw/zinc/20/73/44/1037207344.db2.gz KOWUNHORRHGYDV-OAHLLOKOSA-N 1 0 331.416 3.520 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@]3(C)CCO[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316626 1037280897 /nfs/dbraw/zinc/28/08/97/1037280897.db2.gz WUQDVDGPPMAKMV-SGTLLEGYSA-N 1 0 346.383 3.521 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)Oc1cccc(F)c1 ZINC000462733816 1037334186 /nfs/dbraw/zinc/33/41/86/1037334186.db2.gz KSHFJFHQKUYORD-CYBMUJFWSA-N 1 0 348.374 3.690 20 5 EHBDRO Cc1cc(C)[nH+]c(NCc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000122332131 1037358446 /nfs/dbraw/zinc/35/84/46/1037358446.db2.gz KHVKPNUDPAGACG-UHFFFAOYSA-N 1 0 337.383 3.619 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072491910 1037427879 /nfs/dbraw/zinc/42/78/79/1037427879.db2.gz QRUQBWLIZJBVBL-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1ccc(Sc2ccc(C[N@@H+](C)C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462825983 1037449203 /nfs/dbraw/zinc/44/92/03/1037449203.db2.gz BMBLDALHLYUYJE-AWEZNQCLSA-N 1 0 346.452 3.867 20 5 EHBDRO Cc1cccc([C@H](C)C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000472616570 1037477662 /nfs/dbraw/zinc/47/76/62/1037477662.db2.gz MLBSWYRPSOKZGF-KBAYOESNSA-N 1 0 342.443 3.977 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000462903565 1037532418 /nfs/dbraw/zinc/53/24/18/1037532418.db2.gz BOMBTTVCNXAXSR-GOSISDBHSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NCc1nccn1CC(F)(F)F ZINC000532497841 1037542801 /nfs/dbraw/zinc/54/28/01/1037542801.db2.gz SWZIZPPYSCZTIS-NSHDSACASA-N 1 0 342.321 3.513 20 5 EHBDRO C[C@@H](O)[C@@](C)(C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000188910155 1037557253 /nfs/dbraw/zinc/55/72/53/1037557253.db2.gz BCXDKHVPXRUYSK-RZQQEMMASA-N 1 0 342.439 3.875 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2ncccc12 ZINC000540146948 1037604467 /nfs/dbraw/zinc/60/44/67/1037604467.db2.gz FWYKNOAGVVGRMA-AWEZNQCLSA-N 1 0 338.411 3.625 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC3(C2)CCCCC3)cccc1[N+](=O)[O-] ZINC000532576365 1037682681 /nfs/dbraw/zinc/68/26/81/1037682681.db2.gz AKMLKSBHJDRCMZ-OAHLLOKOSA-N 1 0 345.443 3.886 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000179219042 1037718453 /nfs/dbraw/zinc/71/84/53/1037718453.db2.gz ZPACPJRVBCFVHC-ZBFHGGJFSA-N 1 0 333.435 3.587 20 5 EHBDRO COC(=O)CC(C)(C)C[C@H](C)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897459514 1037835823 /nfs/dbraw/zinc/83/58/23/1037835823.db2.gz ACURGCGITCJUFW-KGLIPLIRSA-N 1 0 336.432 3.656 20 5 EHBDRO C[C@H](C[NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897461720 1037849733 /nfs/dbraw/zinc/84/97/33/1037849733.db2.gz WETWORGXQVMWQX-SJORKVTESA-N 1 0 339.439 3.814 20 5 EHBDRO CC(C)([NH2+]Cc1cccc(-n2cccn2)c1)c1ccccc1[N+](=O)[O-] ZINC000492005682 1037857229 /nfs/dbraw/zinc/85/72/29/1037857229.db2.gz ZEVJQDLZMJFEEM-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO Cc1ccc(C2([NH2+]CC(=O)Nc3ccccc3[N+](=O)[O-])CCC2)cc1 ZINC000592189813 1037926517 /nfs/dbraw/zinc/92/65/17/1037926517.db2.gz WSRSSLDIFCBJGW-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)C3CC[NH2+]CC3)o2)cc1 ZINC000592424765 1037981269 /nfs/dbraw/zinc/98/12/69/1037981269.db2.gz YUPALYQSCIOFSK-UHFFFAOYSA-N 1 0 341.411 3.571 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592529433 1038029416 /nfs/dbraw/zinc/02/94/16/1038029416.db2.gz ZIRDBJVHHPMVQO-IZNAZMGOSA-N 1 0 330.428 3.889 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000058528205 1038076565 /nfs/dbraw/zinc/07/65/65/1038076565.db2.gz LDQQYQWXGQBREN-UHFFFAOYSA-N 1 0 332.425 3.957 20 5 EHBDRO COc1cc(C[NH+]2CC(C)C2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000549410309 1038355826 /nfs/dbraw/zinc/35/58/26/1038355826.db2.gz XGXDJUOARHXGIJ-UHFFFAOYSA-N 1 0 342.395 3.634 20 5 EHBDRO Cc1ccc(C[N@H+](CCCO)[C@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731434 1038497756 /nfs/dbraw/zinc/49/77/56/1038497756.db2.gz KKOWYLPPPZNHNW-IBGZPJMESA-N 1 0 340.423 3.775 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@@H](C4CC4)C3)cs2)c1 ZINC000538752999 1038517846 /nfs/dbraw/zinc/51/78/46/1038517846.db2.gz BXWZMEFSVFSRCO-CQSZACIVSA-N 1 0 329.425 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CSCCc3ccccc32)c1 ZINC000539055024 1038656271 /nfs/dbraw/zinc/65/62/71/1038656271.db2.gz RPDCHVPQQJSKKO-SFHVURJKSA-N 1 0 328.437 3.758 20 5 EHBDRO Cc1cc(C(=O)Nc2cccc3c2C[N@@H+](C2CC2)C3)ccc1[N+](=O)[O-] ZINC000378527565 1038701567 /nfs/dbraw/zinc/70/15/67/1038701567.db2.gz VUNUVVZMSGYUIU-UHFFFAOYSA-N 1 0 337.379 3.634 20 5 EHBDRO O=[N+]([O-])c1ccccc1NCCNc1cc[nH+]c2cc(F)ccc12 ZINC000500468812 1038778472 /nfs/dbraw/zinc/77/84/72/1038778472.db2.gz VMYIYJMLFCBDSP-UHFFFAOYSA-N 1 0 326.331 3.806 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1ccc(F)cc1 ZINC000041888290 1038789226 /nfs/dbraw/zinc/78/92/26/1038789226.db2.gz QAEQWFSUCHMVHW-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552047525 1038914144 /nfs/dbraw/zinc/91/41/44/1038914144.db2.gz PMYBUFNFZODFLU-RKVPGOIHSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc2c1CCOC2 ZINC000601303055 1038921431 /nfs/dbraw/zinc/92/14/31/1038921431.db2.gz BREFEFJKLMYCLC-AWEZNQCLSA-N 1 0 326.396 3.827 20 5 EHBDRO C[NH+]1CCC(CC(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC1 ZINC000488347304 1039106075 /nfs/dbraw/zinc/10/60/75/1039106075.db2.gz MFFOKYMDVSFCCC-UHFFFAOYSA-N 1 0 333.432 3.563 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc([N+](=O)[O-])cc1COC)c1ccco1 ZINC000175059917 1039150848 /nfs/dbraw/zinc/15/08/48/1039150848.db2.gz LAPLKDMOGFFIFM-QGZVFWFLSA-N 1 0 347.415 3.829 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000488587557 1039288302 /nfs/dbraw/zinc/28/83/02/1039288302.db2.gz PSHNWRIKIOULOJ-ZDUSSCGKSA-N 1 0 328.368 3.907 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCCC[C@]2(CC[NH2+]C2)C1 ZINC000906094828 1039288589 /nfs/dbraw/zinc/28/85/89/1039288589.db2.gz QRDVDNYUMNONLA-MRXNPFEDSA-N 1 0 325.359 3.502 20 5 EHBDRO COc1ccc(CN(C)Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000051454706 1039292923 /nfs/dbraw/zinc/29/29/23/1039292923.db2.gz BSPAYNYYLSWCKT-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@H](c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000366071903 1039343499 /nfs/dbraw/zinc/34/34/99/1039343499.db2.gz GIAJHDZAIJJKRB-BPUTZDHNSA-N 1 0 328.416 3.705 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(OCC3CC3)cc2)cc1 ZINC000480390066 1039498153 /nfs/dbraw/zinc/49/81/53/1039498153.db2.gz DKLGPPMZENUHSY-UHFFFAOYSA-N 1 0 326.396 3.716 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]CCSCc1ccccc1 ZINC000552802311 1039538555 /nfs/dbraw/zinc/53/85/55/1039538555.db2.gz JYWJBFRYEDXVKG-UHFFFAOYSA-N 1 0 332.425 3.626 20 5 EHBDRO CCOC(=O)CC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000485797559 1039569858 /nfs/dbraw/zinc/56/98/58/1039569858.db2.gz YMRYJNNHRSFLCG-AWEZNQCLSA-N 1 0 334.416 3.629 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000485846430 1039613571 /nfs/dbraw/zinc/61/35/71/1039613571.db2.gz IBKONDIZFNCVMO-LBPRGKRZSA-N 1 0 343.408 3.934 20 5 EHBDRO Cc1cc(F)ccc1C[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000554723986 1039648969 /nfs/dbraw/zinc/64/89/69/1039648969.db2.gz AJBNXUJBSBDVLG-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2cc(C)c(OC)c(C)c2)ccc1[N+](=O)[O-] ZINC000489177269 1039699101 /nfs/dbraw/zinc/69/91/01/1039699101.db2.gz QSGOHIBBRLDVFK-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000549734073 1039746725 /nfs/dbraw/zinc/74/67/25/1039746725.db2.gz VULKIYDSCGRFKW-DLBZAZTESA-N 1 0 348.443 3.629 20 5 EHBDRO COc1ccc([C@@H](C)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549809206 1039925745 /nfs/dbraw/zinc/92/57/45/1039925745.db2.gz AHYACSUGECUIJP-HNNXBMFYSA-N 1 0 328.412 3.881 20 5 EHBDRO C[C@H](CCO)CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453230096 1040269319 /nfs/dbraw/zinc/26/93/19/1040269319.db2.gz GTUAFMUDTLAUMS-KXBFYZLASA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000481086643 1040342458 /nfs/dbraw/zinc/34/24/58/1040342458.db2.gz DNUXTIPTLKYEBG-UKRRQHHQSA-N 1 0 333.432 3.646 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481190386 1040463795 /nfs/dbraw/zinc/46/37/95/1040463795.db2.gz OJGYEHKBFNFJFB-AWEZNQCLSA-N 1 0 339.823 3.745 20 5 EHBDRO CCOc1cc(N2CCC(C[NH+](CC)CC)CC2)ccc1[N+](=O)[O-] ZINC000486953443 1040598695 /nfs/dbraw/zinc/59/86/95/1040598695.db2.gz FHGRCVKLQWGXGH-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO CCC(O)(CC)C[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000600216160 1040853821 /nfs/dbraw/zinc/85/38/21/1040853821.db2.gz WAVURNOFLBJSQQ-UHFFFAOYSA-N 1 0 349.456 3.701 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022888 1040869212 /nfs/dbraw/zinc/86/92/12/1040869212.db2.gz QDAMCVZUECETNM-PXNSSMCTSA-N 1 0 337.423 3.511 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078765 1040885735 /nfs/dbraw/zinc/88/57/35/1040885735.db2.gz QATRPIVWONYKFH-HZPDHXFCSA-N 1 0 349.450 3.820 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)s1 ZINC001168966025 1132621782 /nfs/dbraw/zinc/62/17/82/1132621782.db2.gz FWBLGBCXOXSBIH-AEJSXWLSSA-N 1 0 333.251 3.607 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453390118 1041072938 /nfs/dbraw/zinc/07/29/38/1041072938.db2.gz XWNNIVVCDYNPNA-PZFZOXMESA-N 1 0 332.444 3.709 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2ncccc2[N+](=O)[O-])c2cccs2)CC1 ZINC000015128656 1041304778 /nfs/dbraw/zinc/30/47/78/1041304778.db2.gz WPDNRPZRZFVFAT-OAHLLOKOSA-N 1 0 346.456 3.936 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 ZINC000481733646 1041308269 /nfs/dbraw/zinc/30/82/69/1041308269.db2.gz UMLWMZAQOKWUCK-UONOGXRCSA-N 1 0 342.395 3.995 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185700 1041377909 /nfs/dbraw/zinc/37/79/09/1041377909.db2.gz HQSDAPJWDSECDG-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH+]2CCCCC2)c(C(F)(F)F)c1 ZINC000511743172 1041550888 /nfs/dbraw/zinc/55/08/88/1041550888.db2.gz SJHARMMEZDEDSX-UHFFFAOYSA-N 1 0 331.338 3.902 20 5 EHBDRO CC(C)[C@H](CO)[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000112659808 1042416562 /nfs/dbraw/zinc/41/65/62/1042416562.db2.gz KRYFRRSOJHCRTH-FQEVSTJZSA-N 1 0 342.439 3.656 20 5 EHBDRO CCC1([NH3+])CCN([C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000925757187 1042604128 /nfs/dbraw/zinc/60/41/28/1042604128.db2.gz FAPPVARLDJNABB-IBGZPJMESA-N 1 0 339.439 3.888 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@@H](CO)c1c(F)cccc1F)CCC2 ZINC000278877602 1042809412 /nfs/dbraw/zinc/80/94/12/1042809412.db2.gz XMRMGWIFYRBOLW-IRXDYDNUSA-N 1 0 348.349 3.574 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000165623165 1042863204 /nfs/dbraw/zinc/86/32/04/1042863204.db2.gz DSABYEHEDZEQJQ-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432324963 1042903009 /nfs/dbraw/zinc/90/30/09/1042903009.db2.gz IXBAKGBHXZQTAK-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432329283 1042924040 /nfs/dbraw/zinc/92/40/40/1042924040.db2.gz OGUYRCBZRIQVEH-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000106466041 1042985974 /nfs/dbraw/zinc/98/59/74/1042985974.db2.gz ITZVZBMVGCWEJG-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCCCC[C@@H]2CCO)o1 ZINC000585767852 1043029852 /nfs/dbraw/zinc/02/98/52/1043029852.db2.gz MVELHMATGVSUSW-OAHLLOKOSA-N 1 0 344.411 3.982 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029797 1043219608 /nfs/dbraw/zinc/21/96/08/1043219608.db2.gz IHPPRCYEJUXYNH-HOTGVXAUSA-N 1 0 330.384 3.542 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2cc([N+](=O)[O-])ccc21 ZINC000279118020 1043380190 /nfs/dbraw/zinc/38/01/90/1043380190.db2.gz PVMVCVNBTGCICP-HOTGVXAUSA-N 1 0 326.400 3.708 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411127 1044061773 /nfs/dbraw/zinc/06/17/73/1044061773.db2.gz DUGBDYNNZULVPX-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccccc1 ZINC000344746350 1044374999 /nfs/dbraw/zinc/37/49/99/1044374999.db2.gz MLFJRRVOBBDSCU-QAPCUYQASA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000279669986 1044388958 /nfs/dbraw/zinc/38/89/58/1044388958.db2.gz NEGIUXHGCZGLFH-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000344781611 1044413473 /nfs/dbraw/zinc/41/34/73/1044413473.db2.gz WTSCBFRUUCVKSG-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000572422528 1044874946 /nfs/dbraw/zinc/87/49/46/1044874946.db2.gz BANDVKYTMFTCCD-IAQYHMDHSA-N 1 0 326.352 3.662 20 5 EHBDRO CCCN(CC[NH+](CC)CC)C(=O)/C(C)=C\c1ccc([N+](=O)[O-])cc1 ZINC000763769516 1126777304 /nfs/dbraw/zinc/77/73/04/1126777304.db2.gz MAPXUZQGAGEFII-NXVVXOECSA-N 1 0 347.459 3.579 20 5 EHBDRO C[C@H](CCc1ccco1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000764609113 1127513897 /nfs/dbraw/zinc/51/38/97/1127513897.db2.gz SBDZVOYYPKKSQJ-OAHLLOKOSA-N 1 0 343.427 3.768 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H](Cn2ccnc2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251223 1127588994 /nfs/dbraw/zinc/58/89/94/1127588994.db2.gz MXILNQPPUJXVMP-PBHICJAKSA-N 1 0 330.432 3.865 20 5 EHBDRO Cc1ccnc(NCc2ccc(C[NH+]3CCCCC3)cc2)c1[N+](=O)[O-] ZINC000301310257 1127734163 /nfs/dbraw/zinc/73/41/63/1127734163.db2.gz ZDWBXLDRWPUITO-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO Cc1ccnc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)c1[N+](=O)[O-] ZINC000301302499 1127735955 /nfs/dbraw/zinc/73/59/55/1127735955.db2.gz RWQOYZXBWFEFJM-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@H]1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC001168553465 1127750832 /nfs/dbraw/zinc/75/08/32/1127750832.db2.gz RLBZXSKKQMDBOO-CWRNSKLLSA-N 1 0 334.416 3.533 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc3c2OC(C)(C)C3)cc1[N+](=O)[O-] ZINC000265662893 1127933044 /nfs/dbraw/zinc/93/30/44/1127933044.db2.gz SEMNEQDIFXWXLU-UHFFFAOYSA-N 1 0 342.395 3.607 20 5 EHBDRO O=C(Nc1cc(F)cc([N+](=O)[O-])c1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000338634035 1127941049 /nfs/dbraw/zinc/94/10/49/1127941049.db2.gz NFSIHAKJOTZILG-UHFFFAOYSA-N 1 0 343.358 3.582 20 5 EHBDRO CC(C)C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccs1 ZINC000347616711 1128144652 /nfs/dbraw/zinc/14/46/52/1128144652.db2.gz SDJJYWUGAVCPQO-CQSZACIVSA-N 1 0 347.440 3.632 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477796 1131242368 /nfs/dbraw/zinc/24/23/68/1131242368.db2.gz UMDLYFQDCXRZKI-WMLDXEAASA-N 1 0 336.395 3.780 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC001168601934 1128280121 /nfs/dbraw/zinc/28/01/21/1128280121.db2.gz WRFWITGONAWPHM-KBPBESRZSA-N 1 0 331.338 3.898 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272956529 1128371432 /nfs/dbraw/zinc/37/14/32/1128371432.db2.gz FKHMXULIYQXTGM-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1 ZINC000326686164 1128430391 /nfs/dbraw/zinc/43/03/91/1128430391.db2.gz IUXMHICALQSZCN-QRVBRYPASA-N 1 0 332.444 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC3CCCC3)C2)c2ncccc12 ZINC000301477507 1128467512 /nfs/dbraw/zinc/46/75/12/1128467512.db2.gz UDUIVPLUKLTBNS-OAHLLOKOSA-N 1 0 340.427 3.819 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cs1 ZINC000273377232 1128517090 /nfs/dbraw/zinc/51/70/90/1128517090.db2.gz GBNQZVRYAARVNC-HUUCEWRRSA-N 1 0 336.388 3.805 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@H]1CC[N@@H+](Cc2ccccc2)C[C@H]1C ZINC000301602885 1128520294 /nfs/dbraw/zinc/52/02/94/1128520294.db2.gz WQSNJLKTWAHSHV-QAPCUYQASA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765848197 1128560903 /nfs/dbraw/zinc/56/09/03/1128560903.db2.gz HKHIXBIBVTYKIC-UPRAQXHNSA-N 1 0 326.396 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000765849918 1128581640 /nfs/dbraw/zinc/58/16/40/1128581640.db2.gz UZBWDFUPODEAFB-MISYRCLQSA-N 1 0 340.423 3.629 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000301647355 1128838688 /nfs/dbraw/zinc/83/86/88/1128838688.db2.gz IHUVHKJOSYHKSK-RHSMWYFYSA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N1CCC(CC[N@H+]2CCCC[C@H]2C)CC1 ZINC000301650625 1128844732 /nfs/dbraw/zinc/84/47/32/1128844732.db2.gz GIMSDZFLZNMKGH-MRXNPFEDSA-N 1 0 346.475 3.779 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](C)N1CCc2ccccc21 ZINC001649000084 1120342802 /nfs/dbraw/zinc/34/28/02/1120342802.db2.gz WPQVQZHPSYLAFR-HNNXBMFYSA-N 1 0 339.439 3.752 20 5 EHBDRO CC1(C)[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000494439043 1120566611 /nfs/dbraw/zinc/56/66/11/1120566611.db2.gz YRBSBBGJNZNADX-CVEARBPZSA-N 1 0 332.425 3.572 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC[C@@H]2CCOC2)c2ccccc2)c1 ZINC000542486345 1120606750 /nfs/dbraw/zinc/60/67/50/1120606750.db2.gz FLIBMZTYMWZZPM-DNVCBOLYSA-N 1 0 326.396 3.700 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC[C@H](C)CO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496404 1120758135 /nfs/dbraw/zinc/75/81/35/1120758135.db2.gz PQTSZOTVRPDGHM-IFXJQAMLSA-N 1 0 346.427 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+](Cc2ccc([N+](=O)[O-])cc2)CC2CC2)cc1 ZINC000914873618 1121032294 /nfs/dbraw/zinc/03/22/94/1121032294.db2.gz KYLNCMRODIXMRS-UHFFFAOYSA-N 1 0 341.367 3.915 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495368607 1121135479 /nfs/dbraw/zinc/13/54/79/1121135479.db2.gz IUMHAUZVQICHPV-QGZVFWFLSA-N 1 0 348.830 3.638 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)N(C)C ZINC000609223408 1121562971 /nfs/dbraw/zinc/56/29/71/1121562971.db2.gz MVOQCFBOIDPBTD-CYBMUJFWSA-N 1 0 347.390 3.566 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130941885 1129007290 /nfs/dbraw/zinc/00/72/90/1129007290.db2.gz SCRZCZNSPCWDQL-KRWDZBQOSA-N 1 0 342.399 3.716 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000282119447 1121798130 /nfs/dbraw/zinc/79/81/30/1121798130.db2.gz ARLBJMHYTCUNRL-XJKSGUPXSA-N 1 0 330.384 3.854 20 5 EHBDRO CN(C(=O)c1cc2ccccc2c2cccnc12)C1CC[NH+](C)CC1 ZINC000194273691 1121830158 /nfs/dbraw/zinc/83/01/58/1121830158.db2.gz QGNJICAQHBXDPH-UHFFFAOYSA-N 1 0 333.435 3.554 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H]1C ZINC000916575986 1122201368 /nfs/dbraw/zinc/20/13/68/1122201368.db2.gz GDIVFOCCNNNBII-WZRBSPASSA-N 1 0 339.823 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N[C@@H]3CC[N@H+](Cc4ccccc4)C3)ccc2c1 ZINC000311855804 1129048008 /nfs/dbraw/zinc/04/80/08/1129048008.db2.gz PTGIZRKYQFUCPL-QGZVFWFLSA-N 1 0 348.406 3.829 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301206518 1122512292 /nfs/dbraw/zinc/51/22/92/1122512292.db2.gz ZJBDHVVTSWPWFS-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000154295069 1122535254 /nfs/dbraw/zinc/53/52/54/1122535254.db2.gz WPQLBHXIDRVLQT-XEZPLFJOSA-N 1 0 348.399 3.749 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCCSC)o2)c([N+](=O)[O-])c1 ZINC000130297283 1122927873 /nfs/dbraw/zinc/92/78/73/1122927873.db2.gz VNPWJCTWJWCQQF-UHFFFAOYSA-N 1 0 336.413 3.706 20 5 EHBDRO CC(C)(C)c1ncc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000556597750 1123052242 /nfs/dbraw/zinc/05/22/42/1123052242.db2.gz XYCLXCRSPMMZEW-UHFFFAOYSA-N 1 0 342.443 3.795 20 5 EHBDRO C[NH+](C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccc(F)c1 ZINC000301806511 1129098341 /nfs/dbraw/zinc/09/83/41/1129098341.db2.gz WCZNTIMUEUKOIG-OAHLLOKOSA-N 1 0 339.317 3.727 20 5 EHBDRO COCC[N@H+](CCCc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000065958732 1129115377 /nfs/dbraw/zinc/11/53/77/1129115377.db2.gz LMFMDJMLTJTHJS-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000301819843 1129120500 /nfs/dbraw/zinc/12/05/00/1129120500.db2.gz JETCAIPQNKJJFD-YPMHNXCESA-N 1 0 343.349 3.677 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOC1 ZINC000609600568 1123619332 /nfs/dbraw/zinc/61/93/32/1123619332.db2.gz JOOGARJZMASIBL-KRWDZBQOSA-N 1 0 332.425 3.840 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249653 1123750750 /nfs/dbraw/zinc/75/07/50/1123750750.db2.gz CTPDUXWRMYUOHR-LSDHHAIUSA-N 1 0 335.423 3.825 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)[C@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000090810267 1123790798 /nfs/dbraw/zinc/79/07/98/1123790798.db2.gz ZEKQJEUXODOYLG-SUMWQHHRSA-N 1 0 338.448 3.687 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCN1Cc2ccccc2C1 ZINC000615720474 1123863628 /nfs/dbraw/zinc/86/36/28/1123863628.db2.gz CKYVMWDYNYUAOC-LFIBNONCSA-N 1 0 337.423 3.604 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000237799317 1123865518 /nfs/dbraw/zinc/86/55/18/1123865518.db2.gz UKLIXMZLMHKCSA-LJQANCHMSA-N 1 0 339.439 3.657 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000616357538 1123988345 /nfs/dbraw/zinc/98/83/45/1123988345.db2.gz ZPYKIGFYIWANDY-GDBMZVCRSA-N 1 0 342.443 3.889 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539666 1129160374 /nfs/dbraw/zinc/16/03/74/1129160374.db2.gz DNJUPBFKECSJOH-SWLSCSKDSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1[nH+]ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)c1Cl ZINC000616955446 1124058917 /nfs/dbraw/zinc/05/89/17/1124058917.db2.gz WFDFXFRTVPVVSU-UHFFFAOYSA-N 1 0 343.717 3.587 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000618197812 1125017020 /nfs/dbraw/zinc/01/70/20/1125017020.db2.gz AZBYWEZGZRZQLK-MOVXZBDNSA-N 1 0 338.407 3.851 20 5 EHBDRO COCCOc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000163008210 1125022336 /nfs/dbraw/zinc/02/23/36/1125022336.db2.gz XAFUKKDTUZZGLJ-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)O[C@H](C)C2 ZINC000069752210 1125036873 /nfs/dbraw/zinc/03/68/73/1125036873.db2.gz XZLKKCYSQYRWDF-CHWSQXEVSA-N 1 0 342.395 3.778 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569528 1125363984 /nfs/dbraw/zinc/36/39/84/1125363984.db2.gz FMHJDRJJZXLORY-AXUOBQJMSA-N 1 0 332.444 3.746 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[NH2+]C1CCCCC1 ZINC000555012415 1129209299 /nfs/dbraw/zinc/20/92/99/1129209299.db2.gz YYTOSMQVLKFJSA-UHFFFAOYSA-N 1 0 348.447 3.591 20 5 EHBDRO Cc1csc(C2([NH2+]CCOc3cccc([N+](=O)[O-])c3)CCCC2)n1 ZINC000081595664 1129430957 /nfs/dbraw/zinc/43/09/57/1129430957.db2.gz JRCYJILMUBFNFG-UHFFFAOYSA-N 1 0 347.440 3.798 20 5 EHBDRO C[C@H]1CCC[C@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000466424987 1129441791 /nfs/dbraw/zinc/44/17/91/1129441791.db2.gz YOQMRELAWLRZEJ-ZFWWWQNUSA-N 1 0 328.416 3.521 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(CCOC)CCC2)cc1[N+](=O)[O-] ZINC000154249292 1129542518 /nfs/dbraw/zinc/54/25/18/1129542518.db2.gz RYZFUOLODPNUMA-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO CN1C[C@H](CC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1=O ZINC000922486531 1129548876 /nfs/dbraw/zinc/54/88/76/1129548876.db2.gz VZFFEYVKRIWQCT-MRXNPFEDSA-N 1 0 332.447 3.951 20 5 EHBDRO Cn1cc(C[N@H+](C)CC2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092667148 1129555601 /nfs/dbraw/zinc/55/56/01/1129555601.db2.gz AVZGFAXVGJCWPL-UHFFFAOYSA-N 1 0 328.416 3.617 20 5 EHBDRO C[C@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482611 1129590678 /nfs/dbraw/zinc/59/06/78/1129590678.db2.gz IJKAJLKDYVRGLE-UONOGXRCSA-N 1 0 330.384 3.590 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000330609975 1129641758 /nfs/dbraw/zinc/64/17/58/1129641758.db2.gz MUSTUFZWXDJIDU-KRWDZBQOSA-N 1 0 332.444 3.967 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@H](Cc2ccccc2)C2CC2)c(F)c1 ZINC000509020814 1129656779 /nfs/dbraw/zinc/65/67/79/1129656779.db2.gz GRDCDMRLUZQMQK-GOSISDBHSA-N 1 0 332.350 3.984 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)c(F)c1 ZINC000922776902 1129658002 /nfs/dbraw/zinc/65/80/02/1129658002.db2.gz VGRXLSDUTBYXFH-GDBMZVCRSA-N 1 0 336.313 3.872 20 5 EHBDRO CO[C@@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384176 1129674690 /nfs/dbraw/zinc/67/46/90/1129674690.db2.gz QWCRPNPRXCMMBZ-MLGOLLRUSA-N 1 0 347.440 3.718 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126293682 1129743505 /nfs/dbraw/zinc/74/35/05/1129743505.db2.gz FJGRURPMLSFXQJ-QGZVFWFLSA-N 1 0 345.374 3.803 20 5 EHBDRO Cc1cc(N2CCC([C@@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302533169 1129781367 /nfs/dbraw/zinc/78/13/67/1129781367.db2.gz FWTUXXVGJRNBGL-IBGZPJMESA-N 1 0 341.411 3.847 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000056196531 1129806145 /nfs/dbraw/zinc/80/61/45/1129806145.db2.gz SFRHNZAVTFYKIL-QWHCGFSZSA-N 1 0 345.374 3.720 20 5 EHBDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000132403330 1129898762 /nfs/dbraw/zinc/89/87/62/1129898762.db2.gz LJYQSGXYTKVIHI-ZDUSSCGKSA-N 1 0 330.384 3.805 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCCCC[NH+]1CCCCC1 ZINC000163108004 1129919374 /nfs/dbraw/zinc/91/93/74/1129919374.db2.gz DOMYQOWNCXLCRH-UHFFFAOYSA-N 1 0 348.447 3.681 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)n1 ZINC000355207079 1129947667 /nfs/dbraw/zinc/94/76/67/1129947667.db2.gz XGRSAKRFRATFCL-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO CC(C)Cn1ccnc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000164757416 1129991286 /nfs/dbraw/zinc/99/12/86/1129991286.db2.gz WKAZAIHGGVTHHX-KRWDZBQOSA-N 1 0 342.443 3.558 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000245900147 1130328782 /nfs/dbraw/zinc/32/87/82/1130328782.db2.gz RYFVWQPMPRDWLG-XMTFNYHQSA-N 1 0 330.428 3.983 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731205594 1130778503 /nfs/dbraw/zinc/77/85/03/1130778503.db2.gz ARVAFOIWTMAXBJ-LBPRGKRZSA-N 1 0 334.445 3.881 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208667 1130779465 /nfs/dbraw/zinc/77/94/65/1130779465.db2.gz CSRIBIGJRIOEQO-NEPJUHHUSA-N 1 0 334.445 3.737 20 5 EHBDRO Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2Cl)c(C[NH+](C)C)c1 ZINC000733807165 1131080720 /nfs/dbraw/zinc/08/07/20/1131080720.db2.gz SKHGGJLWOGWISO-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082828 1131149831 /nfs/dbraw/zinc/14/98/31/1131149831.db2.gz TZTHCZVPPGSGMK-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO COc1cccc(CC[NH+]2CCCC2)c1Nc1ccccc1[N+](=O)[O-] ZINC001206165179 1131765530 /nfs/dbraw/zinc/76/55/30/1131765530.db2.gz YRALDBWWWXAJPU-UHFFFAOYSA-N 1 0 341.411 3.985 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899510 1131882694 /nfs/dbraw/zinc/88/26/94/1131882694.db2.gz NTKWTEOWCDWEIH-SFHVURJKSA-N 1 0 339.439 3.698 20 5 EHBDRO Cc1csc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172899000 1131882908 /nfs/dbraw/zinc/88/29/08/1131882908.db2.gz KJIWLGTUXOCGCO-WFASDCNBSA-N 1 0 331.441 3.958 20 5 EHBDRO Cc1nc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899037 1131883100 /nfs/dbraw/zinc/88/31/00/1131883100.db2.gz LBNVLCVHHMRUCS-NHYWBVRUSA-N 1 0 331.441 3.958 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cccc3ncoc31)CC2 ZINC001172903708 1131886285 /nfs/dbraw/zinc/88/62/85/1131886285.db2.gz SPGKLQGEZQJBDX-MRXNPFEDSA-N 1 0 337.379 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@H]3CC[C@@H](C1)C3(F)F)CC2 ZINC001172906352 1131888340 /nfs/dbraw/zinc/88/83/40/1131888340.db2.gz XIRAOEVUTMKXSE-OWCLPIDISA-N 1 0 336.382 3.819 20 5 EHBDRO COc1cccc(C[N@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172908608 1131888372 /nfs/dbraw/zinc/88/83/72/1131888372.db2.gz DYLSZBTYYCEWMO-GOSISDBHSA-N 1 0 340.423 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](COCC3CC3)C1)CC2 ZINC001172919274 1131904278 /nfs/dbraw/zinc/90/42/78/1131904278.db2.gz FLKBJKLQVMIMJE-LPHOPBHVSA-N 1 0 344.455 3.591 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000743475668 1131928614 /nfs/dbraw/zinc/92/86/14/1131928614.db2.gz WKYLVXQHAZOLKY-OLZOCXBDSA-N 1 0 339.395 3.526 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C/C=C/c2ccccc2)c1F ZINC001173178186 1131992189 /nfs/dbraw/zinc/99/21/89/1131992189.db2.gz JVEAPKCGBVMMBU-MRZGDXHCSA-N 1 0 344.386 3.977 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2cccc(N)c2)c1F ZINC001173190809 1131994630 /nfs/dbraw/zinc/99/46/30/1131994630.db2.gz HGFJKIGKPQQILB-RYUDHWBXSA-N 1 0 347.390 3.607 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173217811 1132002033 /nfs/dbraw/zinc/00/20/33/1132002033.db2.gz GGUMRZSONZWNJG-KSSFIOAISA-N 1 0 326.396 3.948 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173218011 1132002135 /nfs/dbraw/zinc/00/21/35/1132002135.db2.gz IOEQSHUQIGAWJM-ACJLOTCBSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001173226390 1132006561 /nfs/dbraw/zinc/00/65/61/1132006561.db2.gz JIWICESRZUYSAP-KXBFYZLASA-N 1 0 326.396 3.679 20 5 EHBDRO COc1cnccc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173230357 1132008073 /nfs/dbraw/zinc/00/80/73/1132008073.db2.gz XOUWXJMIVNBHGU-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2c(F)cc(F)cc21 ZINC001173227579 1132008451 /nfs/dbraw/zinc/00/84/51/1132008451.db2.gz HBGFFUATNRPKCL-GTNSWQLSSA-N 1 0 348.349 3.917 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](CO)c1cccc(Cl)c1 ZINC001173231068 1132008847 /nfs/dbraw/zinc/00/88/47/1132008847.db2.gz XATLJGSCKBHFPF-BBRMVZONSA-N 1 0 348.830 3.545 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)c1cccs1 ZINC001173230805 1132009637 /nfs/dbraw/zinc/00/96/37/1132009637.db2.gz GQEFQAZTXISVET-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO COc1ccc(CC[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173232746 1132010317 /nfs/dbraw/zinc/01/03/17/1132010317.db2.gz HNKHKFZLCJWVHP-HNNXBMFYSA-N 1 0 328.412 3.709 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C(=O)c2ccccc2)C1 ZINC001173233808 1132010562 /nfs/dbraw/zinc/01/05/62/1132010562.db2.gz YYWJXLCQEINBSN-QAPCUYQASA-N 1 0 338.407 3.731 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccncc1 ZINC001173884604 1132179469 /nfs/dbraw/zinc/17/94/69/1132179469.db2.gz MVFGJEHOGMZBCH-UHFFFAOYSA-N 1 0 330.391 3.639 20 5 EHBDRO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@@H]1CC1(C)C ZINC001174908310 1132501706 /nfs/dbraw/zinc/50/17/06/1132501706.db2.gz ZHHJKAJXEKURPT-NSHDSACASA-N 1 0 327.222 3.835 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052532 1132550404 /nfs/dbraw/zinc/55/04/04/1132550404.db2.gz HAWVDZIQYFGLBP-HSWBROFVSA-N 1 0 349.406 3.741 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCOc2ccc(-c3ccccc3)cc2)C1 ZINC001168977452 1132617468 /nfs/dbraw/zinc/61/74/68/1132617468.db2.gz JXMBIHGTYVZNSF-QFBILLFUSA-N 1 0 340.423 3.767 20 5 EHBDRO COc1cccc([C@H]([NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)c2ccccc2)c1 ZINC001168985314 1132619541 /nfs/dbraw/zinc/61/95/41/1132619541.db2.gz DGLXKHFOSGJOFO-QKYXUNIQSA-N 1 0 340.423 3.820 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cc1 ZINC001168966126 1132621676 /nfs/dbraw/zinc/62/16/76/1132621676.db2.gz GLQOJGFYAOLPDH-GOEBONIOSA-N 1 0 349.431 3.569 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168996540 1132626592 /nfs/dbraw/zinc/62/65/92/1132626592.db2.gz VQQPYZZNIBOFRD-UGFHNGPFSA-N 1 0 341.249 3.935 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1C(F)(F)F ZINC001168998268 1132627924 /nfs/dbraw/zinc/62/79/24/1132627924.db2.gz KQKGINDPYZQTCD-OLZOCXBDSA-N 1 0 346.349 3.639 20 5 EHBDRO CCc1ccccc1-c1nc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)cs1 ZINC001169006395 1132629766 /nfs/dbraw/zinc/62/97/66/1132629766.db2.gz HPBKZQHOBZSZBO-ZFWWWQNUSA-N 1 0 345.468 3.908 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030294 1132635919 /nfs/dbraw/zinc/63/59/19/1132635919.db2.gz YCUIASDNTPVIHF-PKOBYXMFSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(c3nc4ccccc4s3)CC2)C1 ZINC001169025916 1132641093 /nfs/dbraw/zinc/64/10/93/1132641093.db2.gz JWRPEHDFXKETNW-ZFWWWQNUSA-N 1 0 345.468 3.921 20 5 EHBDRO CCOc1cc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)ccc1[N+](=O)[O-] ZINC001169151495 1132678467 /nfs/dbraw/zinc/67/84/67/1132678467.db2.gz KIWOCIHNAZLBCC-KBXCAEBGSA-N 1 0 335.448 3.949 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccc(F)cn1 ZINC001175851064 1132783734 /nfs/dbraw/zinc/78/37/34/1132783734.db2.gz YJMKIJPMHVOCHA-UHFFFAOYSA-N 1 0 348.381 3.778 20 5 EHBDRO CC(C)([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC001176177212 1132857907 /nfs/dbraw/zinc/85/79/07/1132857907.db2.gz UEVOILCDVJYDCF-UHFFFAOYSA-N 1 0 336.338 3.777 20 5 EHBDRO CCOc1cc(N2CC[NH+](CCC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC001169909041 1132895838 /nfs/dbraw/zinc/89/58/38/1132895838.db2.gz WJGQQDVMRBCXIK-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CCC(C)(C)C1 ZINC001169942268 1132903670 /nfs/dbraw/zinc/90/36/70/1132903670.db2.gz LDLTYHWENUFTNG-GFCCVEGCSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1ccc(C[NH2+][C@@]2(CO)CC[C@@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC001176933651 1133011579 /nfs/dbraw/zinc/01/15/79/1133011579.db2.gz YQAYKXXMRAPHNX-JLTOFOAXSA-N 1 0 340.423 3.778 20 5 EHBDRO CCCOc1ccc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC001177683737 1133091550 /nfs/dbraw/zinc/09/15/50/1133091550.db2.gz RRCAILWOZQBHPA-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@H]1OCCc2ccccc21 ZINC000768542754 1133153994 /nfs/dbraw/zinc/15/39/94/1133153994.db2.gz YNOOIDAUCCDFAG-SFHVURJKSA-N 1 0 346.814 3.994 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1nc2cc(F)ccc2o1 ZINC001178327131 1133160110 /nfs/dbraw/zinc/16/01/10/1133160110.db2.gz YYDWGCZWALZTES-UHFFFAOYSA-N 1 0 349.749 3.861 20 5 EHBDRO CCCOc1cc(C[NH2+]CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC001178386603 1133161674 /nfs/dbraw/zinc/16/16/74/1133161674.db2.gz HIFCCFWIHZWLQM-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO O=C1CC[N@H+](Cc2c3ccccc3c(Cl)c3ccccc32)CCN1 ZINC000769326388 1133262846 /nfs/dbraw/zinc/26/28/46/1133262846.db2.gz LELHUUQHMPHLJF-UHFFFAOYSA-N 1 0 338.838 3.968 20 5 EHBDRO O[C@@H]1C[C@@H]([NH2+]Cc2c3ccccc3c(Cl)c3ccccc32)C[C@@H]1O ZINC001179602876 1133263107 /nfs/dbraw/zinc/26/31/07/1133263107.db2.gz LBFWLELOBJJJRS-IXBARVDASA-N 1 0 341.838 3.620 20 5 EHBDRO OCCOC1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000769538073 1133311085 /nfs/dbraw/zinc/31/10/85/1133311085.db2.gz QZABIEHAHMNNMM-UHFFFAOYSA-N 1 0 335.447 3.966 20 5 EHBDRO CC[N@@H+]1CCCC[C@@H]1C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001181999436 1133560507 /nfs/dbraw/zinc/56/05/07/1133560507.db2.gz YIUBKVUZEZEKDQ-QGZVFWFLSA-N 1 0 334.423 3.596 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C1(O)CCCC1 ZINC001182371011 1133646175 /nfs/dbraw/zinc/64/61/75/1133646175.db2.gz XWVYFOBKSFTMQK-HNNXBMFYSA-N 1 0 334.460 3.837 20 5 EHBDRO COc1ccc([C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000774407588 1133673063 /nfs/dbraw/zinc/67/30/63/1133673063.db2.gz BCDULDSTTMJCAH-RBUKOAKNSA-N 1 0 344.411 3.624 20 5 EHBDRO C[N@H+](Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21)C(C1CC1)C1CC1 ZINC000774625841 1133801181 /nfs/dbraw/zinc/80/11/81/1133801181.db2.gz GQXSMNXMELXUQM-UHFFFAOYSA-N 1 0 334.807 3.676 20 5 EHBDRO COC(=O)CC[C@H]1CCC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC001183631249 1133839249 /nfs/dbraw/zinc/83/92/49/1133839249.db2.gz QIQOAOGRRADIJI-UVQBRAAOSA-N 1 0 346.427 3.663 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1cccs1)[NH+](C)C ZINC000786574764 1133877092 /nfs/dbraw/zinc/87/70/92/1133877092.db2.gz PNWJPIKLQCFWFZ-OAHLLOKOSA-N 1 0 333.413 3.574 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCNC(=O)OC(C)(C)C ZINC000786814355 1133910115 /nfs/dbraw/zinc/91/01/15/1133910115.db2.gz VOXBHHZRGWEQET-KAMYIIQDSA-N 1 0 349.431 3.503 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1 ZINC000786880488 1133923622 /nfs/dbraw/zinc/92/36/22/1133923622.db2.gz QSCMDQWVTXCZKY-RDTXWAMCSA-N 1 0 346.427 3.914 20 5 EHBDRO Cc1cc(N(C)CC2CC[NH+](C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC001185281982 1134062829 /nfs/dbraw/zinc/06/28/29/1134062829.db2.gz PTHALLGDKDLZGY-UHFFFAOYSA-N 1 0 345.365 3.700 20 5 EHBDRO O=[N+]([O-])c1ccccc1NCC1([NH+]2CCSCC2)CCCCC1 ZINC001185355127 1134070792 /nfs/dbraw/zinc/07/07/92/1134070792.db2.gz VRHHJGLVRVBVPB-UHFFFAOYSA-N 1 0 335.473 3.758 20 5 EHBDRO CCN(CCC[NH+](CC)CC)C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000788538224 1134138586 /nfs/dbraw/zinc/13/85/86/1134138586.db2.gz BSQMQTZNMBBRCP-FOCLMDBBSA-N 1 0 347.459 3.579 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788568886 1134146529 /nfs/dbraw/zinc/14/65/29/1134146529.db2.gz FDZMUIKYTPBUBN-KBPBESRZSA-N 1 0 343.427 3.858 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670162 1134159714 /nfs/dbraw/zinc/15/97/14/1134159714.db2.gz SQFUMQBDUUGQIR-APPDUMDISA-N 1 0 349.818 3.869 20 5 EHBDRO CSc1ccc(CC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788802917 1134171437 /nfs/dbraw/zinc/17/14/37/1134171437.db2.gz QSAFGLJHOHRUCN-GFCCVEGCSA-N 1 0 331.441 3.792 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH+]1CCC(C2CCOCC2)CC1 ZINC000752147567 1134174735 /nfs/dbraw/zinc/17/47/35/1134174735.db2.gz CJNSTPAMJHXSPY-UHFFFAOYSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815719 1134176696 /nfs/dbraw/zinc/17/66/96/1134176696.db2.gz DPAYQIPTXJRSAC-MGPLVRAMSA-N 1 0 345.374 3.663 20 5 EHBDRO CC(C)[NH+](CCSCc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)C ZINC000789966655 1134353189 /nfs/dbraw/zinc/35/31/89/1134353189.db2.gz JQXYYWDUJWTUAG-UHFFFAOYSA-N 1 0 341.433 3.855 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775370109 1134672692 /nfs/dbraw/zinc/67/26/92/1134672692.db2.gz LAABKVIHKKQADN-GOEBONIOSA-N 1 0 326.824 3.932 20 5 EHBDRO CCc1ccc(C[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170298057 1134737862 /nfs/dbraw/zinc/73/78/62/1134737862.db2.gz ZDOTZJOGQVPVPP-CQSZACIVSA-N 1 0 328.412 3.887 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccncc1 ZINC001170304266 1134739048 /nfs/dbraw/zinc/73/90/48/1134739048.db2.gz ARNYZKCLOLQFFE-GUYCJALGSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170305434 1134739439 /nfs/dbraw/zinc/73/94/39/1134739439.db2.gz KNVKLFREFNMOEZ-HNNXBMFYSA-N 1 0 344.411 3.593 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(C)cc(F)c2)c([N+](=O)[O-])c1 ZINC001170305793 1134739735 /nfs/dbraw/zinc/73/97/35/1134739735.db2.gz PSNDMRUZJWXGNS-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170321849 1134747102 /nfs/dbraw/zinc/74/71/02/1134747102.db2.gz CPKZKUAMMCAXIJ-CHWSQXEVSA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344946 1134758575 /nfs/dbraw/zinc/75/85/75/1134758575.db2.gz FSOCCLMTBDCXFX-YPMHNXCESA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346421 1134760007 /nfs/dbraw/zinc/76/00/07/1134760007.db2.gz NMMLDMXVCYYKEB-RDTXWAMCSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350552 1134760418 /nfs/dbraw/zinc/76/04/18/1134760418.db2.gz BCKOBKZPJAPXAH-KDOFPFPSSA-N 1 0 326.396 3.981 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H](CC2CC2)c2ccccc2)c1 ZINC000775422876 1134769323 /nfs/dbraw/zinc/76/93/23/1134769323.db2.gz LWNJUQXRFFWMJB-RBUKOAKNSA-N 1 0 326.396 3.759 20 5 EHBDRO CCC(CC)[C@@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001192652244 1135039729 /nfs/dbraw/zinc/03/97/29/1135039729.db2.gz CBIJHWWDCZKPEX-GOSISDBHSA-N 1 0 330.432 3.867 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804556386 1135125854 /nfs/dbraw/zinc/12/58/54/1135125854.db2.gz WCSYYSPQQGTRQY-HNNXBMFYSA-N 1 0 346.475 3.658 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001194029672 1135216948 /nfs/dbraw/zinc/21/69/48/1135216948.db2.gz JSCLMHSOXJXDDC-AWEZNQCLSA-N 1 0 336.432 3.883 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](c1ccc(Cl)cc1)C(C)C ZINC001194408094 1135266050 /nfs/dbraw/zinc/26/60/50/1135266050.db2.gz ATVGZYFFFWTWRT-MRXNPFEDSA-N 1 0 336.823 3.740 20 5 EHBDRO CC[C@@H](c1ccccc1OC)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834350 1135332344 /nfs/dbraw/zinc/33/23/44/1135332344.db2.gz FXIKGSHGOYLJKN-ROUUACIJSA-N 1 0 344.411 3.720 20 5 EHBDRO O=C(C[NH2+]C(C1CCCC1)C1CCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000775616516 1135333884 /nfs/dbraw/zinc/33/38/84/1135333884.db2.gz FYLSSNAWRZFFBH-UHFFFAOYSA-N 1 0 345.443 3.872 20 5 EHBDRO C[C@@H](C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820337 1135336359 /nfs/dbraw/zinc/33/63/59/1135336359.db2.gz KXSWGQJAYVUOAY-GJZGRUSLSA-N 1 0 346.402 3.720 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@H+]1CCC[C@H](C)C1 ZINC000807926261 1135591559 /nfs/dbraw/zinc/59/15/59/1135591559.db2.gz GDEDVPAIAODRHL-AWEZNQCLSA-N 1 0 333.432 3.721 20 5 EHBDRO C[C@H](C[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC001197600013 1135713367 /nfs/dbraw/zinc/71/33/67/1135713367.db2.gz BXQWTLHQFPLKGR-LLVKDONJSA-N 1 0 341.839 3.801 20 5 EHBDRO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000808793772 1135738760 /nfs/dbraw/zinc/73/87/60/1135738760.db2.gz UCTKYVNUVRHIKP-GUTXKFCHSA-N 1 0 346.349 3.681 20 5 EHBDRO C[C@H](Cc1ccccc1Cl)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809732341 1135874016 /nfs/dbraw/zinc/87/40/16/1135874016.db2.gz BZQCJFGINLBMGJ-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@@H+](CCCCO)C1CC1 ZINC000809949104 1135905472 /nfs/dbraw/zinc/90/54/72/1135905472.db2.gz ZBPVPEOWJXHMNZ-UHFFFAOYSA-N 1 0 333.215 3.639 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000809975717 1135907575 /nfs/dbraw/zinc/90/75/75/1135907575.db2.gz SIPIMPVNJOVDJP-OLZOCXBDSA-N 1 0 333.215 3.949 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC3(CCC3)[C@H]2[C@H]2CCCO2)ccc1Cl ZINC000810093565 1135920182 /nfs/dbraw/zinc/92/01/82/1135920182.db2.gz OCYLLNWFZZDZNT-HZPDHXFCSA-N 1 0 336.819 3.782 20 5 EHBDRO Cc1cc([C@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000776030897 1135936542 /nfs/dbraw/zinc/93/65/42/1135936542.db2.gz BXIQSNLLVFMYQQ-RTBURBONSA-N 1 0 344.386 3.817 20 5 EHBDRO Cc1cc([C@@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000776030893 1135936545 /nfs/dbraw/zinc/93/65/45/1135936545.db2.gz BXIQSNLLVFMYQQ-MOPGFXCFSA-N 1 0 344.386 3.817 20 5 EHBDRO CC(C)c1ccc(C(=O)O[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810836978 1136012068 /nfs/dbraw/zinc/01/20/68/1136012068.db2.gz JQJQZJOYOGOLAM-CABCVRRESA-N 1 0 332.400 3.502 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1ccccn1 ZINC000811471806 1136095007 /nfs/dbraw/zinc/09/50/07/1136095007.db2.gz KVBBORXGZDFAPN-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccnc(Cl)c2Cl)cc1 ZINC000811479149 1136096775 /nfs/dbraw/zinc/09/67/75/1136096775.db2.gz YZWSQPMEXSMKTP-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479553 1136097491 /nfs/dbraw/zinc/09/74/91/1136097491.db2.gz HVRXDBQZIDHSQR-YMTOWFKASA-N 1 0 335.231 3.788 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)cc1Cl ZINC000811512713 1136103795 /nfs/dbraw/zinc/10/37/95/1136103795.db2.gz QFSYZAZHWISVPM-YJBOKZPZSA-N 1 0 346.814 3.504 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3COC4(CCC4)C3)cs2)c1 ZINC000850367437 1136241770 /nfs/dbraw/zinc/24/17/70/1136241770.db2.gz IVOPHMOMJAMKGF-CYBMUJFWSA-N 1 0 345.424 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000850408732 1136252292 /nfs/dbraw/zinc/25/22/92/1136252292.db2.gz DKDUECWWROSBLJ-HYVNUMGLSA-N 1 0 332.762 3.815 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)C[C@@H](O)c1ccccc1 ZINC000850442019 1136259329 /nfs/dbraw/zinc/25/93/29/1136259329.db2.gz JRAKJLXVSXCYGZ-QWQRMKEZSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)[C@H](O)c1ccccc1 ZINC000812850653 1136261427 /nfs/dbraw/zinc/26/14/27/1136261427.db2.gz XTGQUSPTOIHAER-KUHUBIRLSA-N 1 0 344.411 3.547 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812853110 1136263013 /nfs/dbraw/zinc/26/30/13/1136263013.db2.gz AOSLJJQSAGCMBL-DNVCBOLYSA-N 1 0 328.412 3.581 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000850460801 1136263815 /nfs/dbraw/zinc/26/38/15/1136263815.db2.gz CIDUGCWZCRTNHJ-CYBMUJFWSA-N 1 0 344.411 3.682 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000850472519 1136265758 /nfs/dbraw/zinc/26/57/58/1136265758.db2.gz JCLSFXVHPCWKSN-NOZJJQNGSA-N 1 0 333.215 3.838 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@@H](O)c2ccccc21 ZINC000850528912 1136279485 /nfs/dbraw/zinc/27/94/85/1136279485.db2.gz OEBDOXVGDXKTLM-XVGQJIODSA-N 1 0 326.396 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583162 1136441637 /nfs/dbraw/zinc/44/16/37/1136441637.db2.gz YPNOSGWVYQUSKZ-QZTJIDSGSA-N 1 0 348.349 3.744 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586086 1136445333 /nfs/dbraw/zinc/44/53/33/1136445333.db2.gz JLVZGAKNDBVMJS-QUCCMNQESA-N 1 0 342.439 3.971 20 5 EHBDRO CC(C)Oc1cccc([C@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776605494 1136473648 /nfs/dbraw/zinc/47/36/48/1136473648.db2.gz LNEJEFRKJLTJAU-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCOCC1 ZINC000815104886 1136556968 /nfs/dbraw/zinc/55/69/68/1136556968.db2.gz XTHNNVBWGLYSCO-UHFFFAOYSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1c(COC(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000815445467 1136596378 /nfs/dbraw/zinc/59/63/78/1136596378.db2.gz ZJWBRMGIBOBACX-GOSISDBHSA-N 1 0 346.427 3.744 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000815510085 1136607285 /nfs/dbraw/zinc/60/72/85/1136607285.db2.gz IYPDWXWXTRYRFA-UHFFFAOYSA-N 1 0 348.321 3.502 20 5 EHBDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591289 1136616016 /nfs/dbraw/zinc/61/60/16/1136616016.db2.gz BZVHHWIDHYAFIU-YVEFUNNKSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571650 1136617822 /nfs/dbraw/zinc/61/78/22/1136617822.db2.gz JAKBUAOQHUGBNP-NSHDSACASA-N 1 0 342.374 3.691 20 5 EHBDRO C[C@H](CCOCc1ccccc1)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626505 1136620881 /nfs/dbraw/zinc/62/08/81/1136620881.db2.gz FUUJOOBRZXTTRG-HUUCEWRRSA-N 1 0 343.427 3.823 20 5 EHBDRO C[C@@H]1CCC[C@@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660472 1136746061 /nfs/dbraw/zinc/74/60/61/1136746061.db2.gz FURJEYKQAJZKCY-YMTOWFKASA-N 1 0 333.215 3.542 20 5 EHBDRO CCCNC(=O)c1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173327615 1136762862 /nfs/dbraw/zinc/76/28/62/1136762862.db2.gz ZANMZWBSWCKNBT-CQSZACIVSA-N 1 0 341.411 3.585 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961852 1136891114 /nfs/dbraw/zinc/89/11/14/1136891114.db2.gz VVOIPONRXYOYGE-DLBZAZTESA-N 1 0 344.411 3.833 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818961494 1136891656 /nfs/dbraw/zinc/89/16/56/1136891656.db2.gz QPELBPNAKDMCSX-SJORKVTESA-N 1 0 344.411 3.833 20 5 EHBDRO CC(C)(C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000818984445 1136897051 /nfs/dbraw/zinc/89/70/51/1136897051.db2.gz HSUJIPYWVCSXKU-QGZVFWFLSA-N 1 0 348.830 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCCCCc2ccccc2)cc1 ZINC000819011696 1136899933 /nfs/dbraw/zinc/89/99/33/1136899933.db2.gz WMCROLQICYYGPH-LJQANCHMSA-N 1 0 328.412 3.631 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819151031 1136914139 /nfs/dbraw/zinc/91/41/39/1136914139.db2.gz VQHJCJSTSDXEOP-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCCCCc2ccc(F)cc2)cc1 ZINC000819244287 1136924086 /nfs/dbraw/zinc/92/40/86/1136924086.db2.gz MIVFWODTUYYVMU-LJQANCHMSA-N 1 0 346.402 3.770 20 5 EHBDRO CCSc1cccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000819328015 1136931463 /nfs/dbraw/zinc/93/14/63/1136931463.db2.gz KVODQPFVAZDJFT-KRWDZBQOSA-N 1 0 332.425 3.530 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)c1 ZINC000819334427 1136932384 /nfs/dbraw/zinc/93/23/84/1136932384.db2.gz XYIVCMJQBOHUOV-DEYYWGMASA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCC[C@H]2c2ccccc2)c1 ZINC000819338989 1136932780 /nfs/dbraw/zinc/93/27/80/1136932780.db2.gz FMUKDXVDKJTRGJ-YZGWKJHDSA-N 1 0 340.423 3.802 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCCC1 ZINC001170929856 1136950367 /nfs/dbraw/zinc/95/03/67/1136950367.db2.gz NWIZSMIMPQJLQW-INIZCTEOSA-N 1 0 342.386 3.540 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1cccs1)[NH+](C)C ZINC000266017727 1136997997 /nfs/dbraw/zinc/99/79/97/1136997997.db2.gz PAFOWMDYAMEWEG-OAHLLOKOSA-N 1 0 335.429 3.518 20 5 EHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)CC1(O)CCCCCC1 ZINC000820632230 1136999070 /nfs/dbraw/zinc/99/90/70/1136999070.db2.gz GTYGGDLYPBEUPM-UHFFFAOYSA-N 1 0 326.824 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3C[C@@H](c4ccccc4)[C@@H]3C2)cc1F ZINC000859928274 1137037189 /nfs/dbraw/zinc/03/71/89/1137037189.db2.gz IBGYIIYBAXMVFL-YESZJQIVSA-N 1 0 326.371 3.969 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC001136619628 1137069557 /nfs/dbraw/zinc/06/95/57/1137069557.db2.gz GCUOWBFTGPFXRV-UHFFFAOYSA-N 1 0 349.475 3.762 20 5 EHBDRO CC(C)(c1nc(-c2ccc([N+](=O)[O-])s2)no1)[C@H]([NH3+])c1ccccc1 ZINC000823069279 1137085859 /nfs/dbraw/zinc/08/58/59/1137085859.db2.gz LGWWBXOMWLLGHV-CYBMUJFWSA-N 1 0 344.396 3.684 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000862483469 1137146781 /nfs/dbraw/zinc/14/67/81/1137146781.db2.gz UPRYHHFOWAQTDM-NSDNCLLMSA-N 1 0 338.407 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)cc1Cl ZINC000824952899 1137158976 /nfs/dbraw/zinc/15/89/76/1137158976.db2.gz FNDGMPKHZJDGOL-PBHICJAKSA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C1CCC(OC(F)F)CC1 ZINC000825144909 1137167257 /nfs/dbraw/zinc/16/72/57/1137167257.db2.gz SNVLIKJEQQDXBA-UHFFFAOYSA-N 1 0 334.750 3.888 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1(O)CCCC1 ZINC000825232028 1137170206 /nfs/dbraw/zinc/17/02/06/1137170206.db2.gz KUBYJQNQPJCIPW-UHFFFAOYSA-N 1 0 326.824 3.669 20 5 EHBDRO Cc1c(Cl)cccc1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000865702990 1137305370 /nfs/dbraw/zinc/30/53/70/1137305370.db2.gz IOOQCJIAXMRBBW-KRWDZBQOSA-N 1 0 334.803 3.554 20 5 EHBDRO CS[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000846010949 1137325244 /nfs/dbraw/zinc/32/52/44/1137325244.db2.gz UAFIWUZHYNFVGC-QZTJIDSGSA-N 1 0 349.500 3.827 20 5 EHBDRO COCc1ccccc1C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866221345 1137336008 /nfs/dbraw/zinc/33/60/08/1137336008.db2.gz PEWIJHJMPSNPQC-ZDUSSCGKSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCc2c1cccc2O ZINC000866260871 1137340356 /nfs/dbraw/zinc/34/03/56/1137340356.db2.gz OBXAZRBNPQTUBR-ZBEGNZNMSA-N 1 0 330.359 3.648 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000866310499 1137344551 /nfs/dbraw/zinc/34/45/51/1137344551.db2.gz FAMKZKDPBLVWFO-PVUWLOKVSA-N 1 0 338.423 3.848 20 5 EHBDRO COCC[C@@H]([NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccco1 ZINC000866338161 1137347017 /nfs/dbraw/zinc/34/70/17/1137347017.db2.gz YBJGDFPWWZXRJV-SWLSCSKDSA-N 1 0 336.363 3.625 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866367173 1137350022 /nfs/dbraw/zinc/35/00/22/1137350022.db2.gz GPGCVQDBJMRZNY-AWEZNQCLSA-N 1 0 331.391 3.591 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)C(C)(F)F ZINC000866543146 1137363366 /nfs/dbraw/zinc/36/33/66/1137363366.db2.gz RTUDXHIODSRCFO-LLVKDONJSA-N 1 0 343.374 3.583 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1c(F)cccc1F ZINC000773016433 1137459557 /nfs/dbraw/zinc/45/95/57/1137459557.db2.gz YKEBDFVJJNEROT-MEDUHNTESA-N 1 0 336.338 3.566 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(F)n1 ZINC000773083993 1137463987 /nfs/dbraw/zinc/46/39/87/1137463987.db2.gz AFYYZBHGYAPUHY-LBPRGKRZSA-N 1 0 335.404 3.789 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cccc1[N+](=O)[O-] ZINC000510980117 1137471443 /nfs/dbraw/zinc/47/14/43/1137471443.db2.gz QLRJLKFOGRYOIW-GOEBONIOSA-N 1 0 326.396 3.948 20 5 EHBDRO Cc1ccccc1C1([NH2+]CCOc2ccccc2[N+](=O)[O-])CCC1 ZINC001171700360 1137504964 /nfs/dbraw/zinc/50/49/64/1137504964.db2.gz QIRSNHSBXPVKMT-UHFFFAOYSA-N 1 0 326.396 3.951 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2SC)ccn1 ZINC000872021477 1137565196 /nfs/dbraw/zinc/56/51/96/1137565196.db2.gz PUVPFSZUUMNJMP-LLVKDONJSA-N 1 0 333.413 3.571 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872032623 1137566430 /nfs/dbraw/zinc/56/64/30/1137566430.db2.gz WVIIYHBZUDGNJG-LBPRGKRZSA-N 1 0 345.374 3.586 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[S@@](=O)C(C)(C)C ZINC000872033203 1137566634 /nfs/dbraw/zinc/56/66/34/1137566634.db2.gz BRRDNAYHDUOSCE-RKFFSXRUSA-N 1 0 344.502 3.515 20 5 EHBDRO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042348 1137567211 /nfs/dbraw/zinc/56/72/11/1137567211.db2.gz BUBHINSOYIXJBU-GYSYKLTISA-N 1 0 338.404 3.958 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2ccccn2)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070477 1137569638 /nfs/dbraw/zinc/56/96/38/1137569638.db2.gz DAZVXBVUVXGASW-CYBMUJFWSA-N 1 0 329.375 3.901 20 5 EHBDRO CC1(C)CO[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000873156406 1137591740 /nfs/dbraw/zinc/59/17/40/1137591740.db2.gz WMCYODAMAUXWLS-HNNXBMFYSA-N 1 0 347.440 3.623 20 5 EHBDRO CC(C)[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1 ZINC000876902260 1137664942 /nfs/dbraw/zinc/66/49/42/1137664942.db2.gz LJCUDDCNUUEROD-VMBOVVBDSA-N 1 0 332.379 3.621 20 5 EHBDRO CC1(C)CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878048472 1137700601 /nfs/dbraw/zinc/70/06/01/1137700601.db2.gz QDDXTKGVCCKDCW-UHFFFAOYSA-N 1 0 336.779 3.673 20 5 EHBDRO CC1(C)CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878147983 1137704442 /nfs/dbraw/zinc/70/44/42/1137704442.db2.gz COXRAWWJDGGHPH-UHFFFAOYSA-N 1 0 336.779 3.530 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000878369779 1137713175 /nfs/dbraw/zinc/71/31/75/1137713175.db2.gz APBPZPPITZYBFP-ZWKOTPCHSA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3[C@@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000879680690 1137755093 /nfs/dbraw/zinc/75/50/93/1137755093.db2.gz VZPJLUSFMLSQMH-RJPYNODJSA-N 1 0 342.399 3.758 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ccnc(F)c2[N+](=O)[O-])CC1 ZINC000881988350 1137818312 /nfs/dbraw/zinc/81/83/12/1137818312.db2.gz CHPSUEZFIWQMAR-CYBMUJFWSA-N 1 0 344.390 3.766 20 5 EHBDRO COc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1SC ZINC000105448231 1137881026 /nfs/dbraw/zinc/88/10/26/1137881026.db2.gz USGAGJAZHADGNL-UHFFFAOYSA-N 1 0 332.425 3.658 20 5 EHBDRO CC[C@@H]1C[C@@H](C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000332116787 1137932271 /nfs/dbraw/zinc/93/22/71/1137932271.db2.gz KIYKYZDVUBZFPB-DOTOQJQBSA-N 1 0 348.443 3.643 20 5 EHBDRO CC(C)(C)C[C@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000121323473 1137956921 /nfs/dbraw/zinc/95/69/21/1137956921.db2.gz KSDMBMXGQQVSES-CYBMUJFWSA-N 1 0 349.456 3.605 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC000884485958 1137961136 /nfs/dbraw/zinc/96/11/36/1137961136.db2.gz LELORHUYXRWRLO-LLVKDONJSA-N 1 0 331.338 3.534 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@@H](C)[C@@H]3C)O2)cccc1[N+](=O)[O-] ZINC000886772361 1138137495 /nfs/dbraw/zinc/13/74/95/1138137495.db2.gz XGUVRZFXZGMNAX-SIBFUHKCSA-N 1 0 348.443 3.526 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2cc(F)ccc2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000090044173 1138208616 /nfs/dbraw/zinc/20/86/16/1138208616.db2.gz RZVHDEAOSFOHTM-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCc1ccc(Cl)nc1)C1CC1 ZINC000122688511 1138261203 /nfs/dbraw/zinc/26/12/03/1138261203.db2.gz BHOLBHKFHXTDKN-INIZCTEOSA-N 1 0 345.830 3.797 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](C[C@@H]2CCOC2)C2CC2)o1 ZINC000129968261 1138429674 /nfs/dbraw/zinc/42/96/74/1138429674.db2.gz ZSBFLRMHAIXUDB-AWEZNQCLSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccnc(N3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000131434321 1138517947 /nfs/dbraw/zinc/51/79/47/1138517947.db2.gz URFWTKQVABHLPB-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607244 1139144377 /nfs/dbraw/zinc/14/43/77/1139144377.db2.gz YQPOBXYELWYWTR-HZPDHXFCSA-N 1 0 349.475 3.765 20 5 EHBDRO Cc1cc(C(=O)Nc2cc(C[NH+](C)C)ccc2C)cc([N+](=O)[O-])c1 ZINC000177349059 1139614917 /nfs/dbraw/zinc/61/49/17/1139614917.db2.gz DSXQTHUDZYDVFZ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000179769265 1139781168 /nfs/dbraw/zinc/78/11/68/1139781168.db2.gz GXUIOFDNLLGDTH-VMPITWQZSA-N 1 0 329.444 3.558 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)N[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181551210 1139914951 /nfs/dbraw/zinc/91/49/51/1139914951.db2.gz NHDBNDFEALAWAJ-RDTXWAMCSA-N 1 0 341.411 3.513 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000192133614 1140505396 /nfs/dbraw/zinc/50/53/96/1140505396.db2.gz RPRSQONPXYFASI-ROUUACIJSA-N 1 0 348.349 3.535 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1-n1ccnc1)CCC2 ZINC000192727166 1140547545 /nfs/dbraw/zinc/54/75/45/1140547545.db2.gz AYOCYGCCRLZCSX-IBGZPJMESA-N 1 0 348.406 3.948 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000194803568 1140622331 /nfs/dbraw/zinc/62/23/31/1140622331.db2.gz OPTQRMFAFVBKQR-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000269310401 1141091804 /nfs/dbraw/zinc/09/18/04/1141091804.db2.gz FVHFUUPMNVBXEU-WMHVBEDNSA-N 1 0 348.468 3.642 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625581 1141129128 /nfs/dbraw/zinc/12/91/28/1141129128.db2.gz CJVFZWRAJVFQOA-DOMZBBRYSA-N 1 0 349.456 3.649 20 5 EHBDRO COC[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271212198 1141326755 /nfs/dbraw/zinc/32/67/55/1141326755.db2.gz YRTTYOFBONBLNM-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCO1 ZINC000271255222 1141335390 /nfs/dbraw/zinc/33/53/90/1141335390.db2.gz LLBCNVOHMDPWBH-GXTWGEPZSA-N 1 0 332.425 3.980 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000271508833 1141383789 /nfs/dbraw/zinc/38/37/89/1141383789.db2.gz NLKOLUBNTNPXFC-JQHSSLGASA-N 1 0 344.455 3.997 20 5 EHBDRO C[C@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283143444 1141561765 /nfs/dbraw/zinc/56/17/65/1141561765.db2.gz ODEZXFGDSVIJJB-CQSZACIVSA-N 1 0 332.375 3.507 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])cn1 ZINC000052245057 214123845 /nfs/dbraw/zinc/12/38/45/214123845.db2.gz SGTUHCHDERHDBF-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cccc(Cn2cccn2)c1 ZINC000579732246 1014312274 /nfs/dbraw/zinc/31/22/74/1014312274.db2.gz SNMFAQBCFFAPGA-LJQANCHMSA-N 1 0 348.406 3.617 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1noc(-c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)n1 ZINC000339391232 1014326089 /nfs/dbraw/zinc/32/60/89/1014326089.db2.gz AAHYHUYZMSRWRW-CYBMUJFWSA-N 1 0 332.404 3.988 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000584305515 1032106818 /nfs/dbraw/zinc/10/68/18/1032106818.db2.gz VGZAPVCEQUTVRV-LBPRGKRZSA-N 1 0 347.802 3.928 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215073 1015005729 /nfs/dbraw/zinc/00/57/29/1015005729.db2.gz HNVKSADAKNJLIP-CYBMUJFWSA-N 1 0 349.456 3.994 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1 ZINC000471169679 1015234136 /nfs/dbraw/zinc/23/41/36/1015234136.db2.gz NJUFXDJOETZUDW-FQEVSTJZSA-N 1 0 339.439 3.738 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000339670822 1015492275 /nfs/dbraw/zinc/49/22/75/1015492275.db2.gz FUFRMWBBMHGYDF-TZMCWYRMSA-N 1 0 342.399 3.828 20 5 EHBDRO Cc1nc(NC[C@]2(C)CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000311219127 1016400017 /nfs/dbraw/zinc/40/00/17/1016400017.db2.gz TXBUVVVIACAFPX-IBGZPJMESA-N 1 0 340.427 3.622 20 5 EHBDRO CC[NH+](CC)CCCCNC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000189794982 1016728892 /nfs/dbraw/zinc/72/88/92/1016728892.db2.gz WBKBPDLXPOUWGF-UHFFFAOYSA-N 1 0 335.448 3.570 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000190002229 1016844992 /nfs/dbraw/zinc/84/49/92/1016844992.db2.gz DVCRRPGAIDUNFI-IUODEOHRSA-N 1 0 337.420 3.549 20 5 EHBDRO COC1([C@@H](C)[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC1 ZINC000414527723 1016953812 /nfs/dbraw/zinc/95/38/12/1016953812.db2.gz RLDWLLUCJCHCCT-CYBMUJFWSA-N 1 0 330.384 3.902 20 5 EHBDRO CCOCc1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449074308 1032159621 /nfs/dbraw/zinc/15/96/21/1032159621.db2.gz KJGOAONQEOEFBT-HNNXBMFYSA-N 1 0 328.412 3.852 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(c2ccccc2)CC1 ZINC000449091196 1032196838 /nfs/dbraw/zinc/19/68/38/1032196838.db2.gz IWIXJRIMXFDFHD-MRXNPFEDSA-N 1 0 339.439 3.784 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449092739 1032200327 /nfs/dbraw/zinc/20/03/27/1032200327.db2.gz UBKMEZABGSLWHQ-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449092740 1032202060 /nfs/dbraw/zinc/20/20/60/1032202060.db2.gz UBKMEZABGSLWHQ-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000074742655 1032219112 /nfs/dbraw/zinc/21/91/12/1032219112.db2.gz UCDXUVODZUSWTQ-GOEBONIOSA-N 1 0 326.400 3.546 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000449167685 1032260469 /nfs/dbraw/zinc/26/04/69/1032260469.db2.gz BEGDDTHLJIIORT-BLLLJJGKSA-N 1 0 330.432 3.617 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(F)(F)F)cs1 ZINC000449161612 1032275795 /nfs/dbraw/zinc/27/57/95/1032275795.db2.gz GBQCVBCWWUFKEI-SECBINFHSA-N 1 0 345.346 3.791 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000449191548 1032285526 /nfs/dbraw/zinc/28/55/26/1032285526.db2.gz PHYZCUYVESSIGM-RDJZCZTQSA-N 1 0 332.444 3.997 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1COc2ccccc21 ZINC000449202504 1032327345 /nfs/dbraw/zinc/32/73/45/1032327345.db2.gz FSIXXPHKJNQNDD-KEYYUXOJSA-N 1 0 326.396 3.680 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000459643071 1032362788 /nfs/dbraw/zinc/36/27/88/1032362788.db2.gz UDRCDUHSADLGPR-GFCCVEGCSA-N 1 0 335.354 3.769 20 5 EHBDRO CCC[NH2+][C@H](C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000449282243 1032400710 /nfs/dbraw/zinc/40/07/10/1032400710.db2.gz HAITYPBKFRDDSP-CYBMUJFWSA-N 1 0 343.383 3.714 20 5 EHBDRO Cn1cc(C[N@H+](C)C2CC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459723892 1032430774 /nfs/dbraw/zinc/43/07/74/1032430774.db2.gz DHBUYFABKQLIPT-UHFFFAOYSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1Cl ZINC000302035781 1032457553 /nfs/dbraw/zinc/45/75/53/1032457553.db2.gz UQLGDNNLCQVDQC-LBPRGKRZSA-N 1 0 334.807 3.576 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000449350349 1032467185 /nfs/dbraw/zinc/46/71/85/1032467185.db2.gz VAUCWBYOZWSEAL-AWEZNQCLSA-N 1 0 342.395 3.997 20 5 EHBDRO [NH3+][C@@H]1CCN(Cc2ccc(Oc3ccc(Cl)cc3[N+](=O)[O-])cc2)C1 ZINC000414648272 1017095113 /nfs/dbraw/zinc/09/51/13/1017095113.db2.gz AUMZFTGJZWYFQO-CQSZACIVSA-N 1 0 347.802 3.574 20 5 EHBDRO CC[C@@H](C)[C@@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449403237 1032525683 /nfs/dbraw/zinc/52/56/83/1032525683.db2.gz VLMVMGRRFQDXCF-MLGOLLRUSA-N 1 0 349.456 3.869 20 5 EHBDRO C[C@@H](CC(C)(C)O)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449449430 1032567070 /nfs/dbraw/zinc/56/70/70/1032567070.db2.gz LLKIDQAODJZKJI-LBPRGKRZSA-N 1 0 334.441 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@@H]2CCCC2(F)F)c1 ZINC000449497341 1032667539 /nfs/dbraw/zinc/66/75/39/1032667539.db2.gz QXQJSYBXQLRCKF-JTQLQIEISA-N 1 0 336.285 3.721 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)[C@@H]3CC[NH2+]C3)s2)cc1 ZINC000414664890 1017115028 /nfs/dbraw/zinc/11/50/28/1017115028.db2.gz UOYLJZAOOMBDTQ-MRXNPFEDSA-N 1 0 343.452 3.650 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cnn(C)c1 ZINC000610272987 1017160441 /nfs/dbraw/zinc/16/04/41/1017160441.db2.gz AAWMXZPJIMWJIG-GFCCVEGCSA-N 1 0 342.424 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNC[C@H]3CCC[NH2+]C3)o2)c(Cl)c1 ZINC000414828377 1017230504 /nfs/dbraw/zinc/23/05/04/1017230504.db2.gz MESHZMXOINGJFD-LBPRGKRZSA-N 1 0 349.818 3.597 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892729823 1017242054 /nfs/dbraw/zinc/24/20/54/1017242054.db2.gz CBQVLHWCORKEHC-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000414958942 1017344984 /nfs/dbraw/zinc/34/49/84/1017344984.db2.gz DZSOJMHRHVKCCZ-LPHOPBHVSA-N 1 0 339.439 3.986 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000341030986 1017908012 /nfs/dbraw/zinc/90/80/12/1017908012.db2.gz BXNKDRPBDAPPDM-GOSISDBHSA-N 1 0 341.411 3.973 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000892949546 1017918424 /nfs/dbraw/zinc/91/84/24/1017918424.db2.gz YIHLIPSEUTZOKI-CYBMUJFWSA-N 1 0 330.384 3.777 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)O ZINC000449545697 1032736135 /nfs/dbraw/zinc/73/61/35/1032736135.db2.gz UCLODQUDXLHCEM-BLLLJJGKSA-N 1 0 348.374 3.775 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2(c3ccc4c(c3)OCO4)CC2)cc1[N+](=O)[O-] ZINC000537449314 1032737228 /nfs/dbraw/zinc/73/72/28/1032737228.db2.gz YBINANMRAQUDPK-CYBMUJFWSA-N 1 0 340.379 3.972 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000415490351 1018093184 /nfs/dbraw/zinc/09/31/84/1018093184.db2.gz YCPCKGBUJKZJKR-CYBMUJFWSA-N 1 0 342.399 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000083211418 1018547713 /nfs/dbraw/zinc/54/77/13/1018547713.db2.gz KTFFUEFGBXOICH-OAHLLOKOSA-N 1 0 337.379 3.801 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000419347139 1018734534 /nfs/dbraw/zinc/73/45/34/1018734534.db2.gz WJXPDJHVFASSAI-ZDUSSCGKSA-N 1 0 339.395 3.762 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)COCc1ccccc1 ZINC000500955303 1018848244 /nfs/dbraw/zinc/84/82/44/1018848244.db2.gz CDVNJWQBAKWGEF-UHFFFAOYSA-N 1 0 344.411 3.688 20 5 EHBDRO COc1cccc(N[C@@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111385 1018972992 /nfs/dbraw/zinc/97/29/92/1018972992.db2.gz DFSMWKCWEXNGRC-GDBMZVCRSA-N 1 0 341.411 3.678 20 5 EHBDRO CC(C)c1ccc(CN2CCC[C@@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425501 1032811199 /nfs/dbraw/zinc/81/11/99/1032811199.db2.gz HBDGRRYFCBHDGL-AEFFLSMTSA-N 1 0 331.460 3.682 20 5 EHBDRO COc1ccccc1CC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000513502738 1019760406 /nfs/dbraw/zinc/76/04/06/1019760406.db2.gz DZLFICHXTSJNPB-JXMROGBWSA-N 1 0 326.396 3.791 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@]3(CC[NH2+]C3)C2)s1 ZINC000261959384 1019770336 /nfs/dbraw/zinc/77/03/36/1019770336.db2.gz HBFHICHXRIAYMB-GOSISDBHSA-N 1 0 343.452 3.509 20 5 EHBDRO CC[N@H+](C)Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000126321600 1019863737 /nfs/dbraw/zinc/86/37/37/1019863737.db2.gz RWNSDZRLZZESDH-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CS1 ZINC000581039234 1020371843 /nfs/dbraw/zinc/37/18/43/1020371843.db2.gz QMUNJOTYZUOLMT-DYVFJYSZSA-N 1 0 333.457 3.738 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cccc(C)c2[N+](=O)[O-])C1 ZINC000109966622 1020377637 /nfs/dbraw/zinc/37/76/37/1020377637.db2.gz LRABUATUZVFTBS-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCCO[C@H](c3ccccc3)C2)c(F)c1 ZINC000610476529 1020422150 /nfs/dbraw/zinc/42/21/50/1020422150.db2.gz DEBQRVWYLIXFEB-SFHVURJKSA-N 1 0 330.359 3.698 20 5 EHBDRO C[C@H]([NH2+]CCCCNC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000183177079 1020512720 /nfs/dbraw/zinc/51/27/20/1020512720.db2.gz WJFNETQQMYPJNE-ZDUSSCGKSA-N 1 0 337.420 3.550 20 5 EHBDRO CC[C@H](C)[C@H](O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237006530 1020615249 /nfs/dbraw/zinc/61/52/49/1020615249.db2.gz DWBHLENVKLYQRD-BLLLJJGKSA-N 1 0 334.441 3.820 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@H]1CC[C@H](O)CC1 ZINC000276133249 1020688364 /nfs/dbraw/zinc/68/83/64/1020688364.db2.gz ZNTHRWZRLGSRBI-KOMQPUFPSA-N 1 0 330.384 3.590 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1F ZINC000126609654 1021106654 /nfs/dbraw/zinc/10/66/54/1021106654.db2.gz GTEIRUPTYTUALY-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510436043 1021147713 /nfs/dbraw/zinc/14/77/13/1021147713.db2.gz YAQLVGKIUURGKP-GOEBONIOSA-N 1 0 336.395 3.953 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)c1 ZINC000477149316 1021205550 /nfs/dbraw/zinc/20/55/50/1021205550.db2.gz FEJUASMJPZNOGV-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO CC[C@@H]([NH2+]CCc1nnc(C(C)C)s1)c1cccc([N+](=O)[O-])c1 ZINC000426300742 1021209952 /nfs/dbraw/zinc/20/99/52/1021209952.db2.gz IXABJDRLIVCCIX-CQSZACIVSA-N 1 0 334.445 3.853 20 5 EHBDRO CCO[C@H](CC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCC1 ZINC000602564272 1032975299 /nfs/dbraw/zinc/97/52/99/1032975299.db2.gz KOPVCKTVRCFTEW-MRXNPFEDSA-N 1 0 347.415 3.811 20 5 EHBDRO COC(=O)c1csc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000602564892 1032975898 /nfs/dbraw/zinc/97/58/98/1032975898.db2.gz WGNNJCRMXVVBJB-NSHDSACASA-N 1 0 334.397 3.602 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507714655 1021467717 /nfs/dbraw/zinc/46/77/17/1021467717.db2.gz PEBGDKCOWBTJAN-KRWDZBQOSA-N 1 0 326.396 3.804 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2Cc3ccccc3N(C)C2)cc1[N+](=O)[O-] ZINC000437074602 1021526427 /nfs/dbraw/zinc/52/64/27/1021526427.db2.gz DEBPLANPCNMCMX-JKSUJKDBSA-N 1 0 339.439 3.863 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437108294 1021564032 /nfs/dbraw/zinc/56/40/32/1021564032.db2.gz NBLCBAVJGFWJHL-DNVCBOLYSA-N 1 0 339.439 3.944 20 5 EHBDRO CCc1nc2c(s1)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCC2 ZINC000090910280 1021692139 /nfs/dbraw/zinc/69/21/39/1021692139.db2.gz JMQPBJYCDUUTTF-AWEZNQCLSA-N 1 0 331.441 3.823 20 5 EHBDRO CC[NH+](CC)CCN(Cc1cccs1)c1ccc([N+](=O)[O-])c(C)n1 ZINC000471744674 1021948964 /nfs/dbraw/zinc/94/89/64/1021948964.db2.gz NJESTJPTONDIFX-UHFFFAOYSA-N 1 0 348.472 3.708 20 5 EHBDRO C[N@H+](Cc1ccc(Br)cc1)Cc1cccc([N+](=O)[O-])c1 ZINC000058887107 1033059536 /nfs/dbraw/zinc/05/95/36/1033059536.db2.gz CEGUZYPVKSPZCB-UHFFFAOYSA-N 1 0 335.201 3.989 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)cc1Br ZINC000602686285 1033066295 /nfs/dbraw/zinc/06/62/95/1033066295.db2.gz BDDPIOWNPPBWPO-POZPLHJXSA-N 1 0 331.235 3.697 20 5 EHBDRO CC(C)(C)C(C)(C)C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602669570 1033066759 /nfs/dbraw/zinc/06/67/59/1033066759.db2.gz JUGHYRPKLKYCKD-UHFFFAOYSA-N 1 0 334.464 3.621 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325519 1022668889 /nfs/dbraw/zinc/66/88/89/1022668889.db2.gz IVXIAYLPIPWLEZ-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO COc1cccc2c1CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000426073207 1022838883 /nfs/dbraw/zinc/83/88/83/1022838883.db2.gz AEEUILXDJRGTRN-CQSZACIVSA-N 1 0 346.814 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000729469205 1022843595 /nfs/dbraw/zinc/84/35/95/1022843595.db2.gz KKXWUDMVLQHCJI-AWEZNQCLSA-N 1 0 340.358 3.531 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000310150834 1022910769 /nfs/dbraw/zinc/91/07/69/1022910769.db2.gz FSYIJOOXLWQPLW-CRAIPNDOSA-N 1 0 325.412 3.520 20 5 EHBDRO CC[NH+](CC)CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(C)C ZINC000610615439 1023013657 /nfs/dbraw/zinc/01/36/57/1023013657.db2.gz YQNCYYHLHGITPF-UHFFFAOYSA-N 1 0 348.447 3.536 20 5 EHBDRO C(c1nc(-c2ccc3ccc4cccnc4c3n2)no1)=C1CC[NH2+]CC1 ZINC001211845551 1023029893 /nfs/dbraw/zinc/02/98/93/1023029893.db2.gz PSTWLRBDUXYOIL-UHFFFAOYSA-N 1 0 343.390 3.600 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(OC(C)C)cc1N(C(N)=[NH2+])c1ccc(F)cc1 ZINC001167999218 1023084792 /nfs/dbraw/zinc/08/47/92/1023084792.db2.gz JWBFAQGBYRIHPV-UHFFFAOYSA-N 1 0 346.362 3.861 20 5 EHBDRO COC(=O)c1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000507152660 1023160569 /nfs/dbraw/zinc/16/05/69/1023160569.db2.gz XQZZWNIGUUWGBI-UHFFFAOYSA-N 1 0 342.395 3.792 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC3([C@H]4CCCCO4)CCC3)nc2c1 ZINC000602744185 1033109748 /nfs/dbraw/zinc/10/97/48/1033109748.db2.gz YYFKXTMTVCPDDH-MRXNPFEDSA-N 1 0 345.399 3.565 20 5 EHBDRO CCC1(C)CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000507197369 1023175132 /nfs/dbraw/zinc/17/51/32/1023175132.db2.gz PXBIHRMQGGRVDL-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO COCc1ccccc1/C=C(\C)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000510871101 1023322735 /nfs/dbraw/zinc/32/27/35/1023322735.db2.gz DYFRYVFWZCYCKS-DTQAZKPQSA-N 1 0 340.423 3.977 20 5 EHBDRO O=C(C[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000610720142 1023352483 /nfs/dbraw/zinc/35/24/83/1023352483.db2.gz WWGQFDNZVLIQDW-LJQANCHMSA-N 1 0 338.407 3.875 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H](c3cccs3)C3CC3)nc2c1 ZINC000341842090 1023441540 /nfs/dbraw/zinc/44/15/40/1023441540.db2.gz JQNSZCYTQUUVNS-INIZCTEOSA-N 1 0 328.397 3.774 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000510982829 1023547169 /nfs/dbraw/zinc/54/71/69/1023547169.db2.gz GPZIZXZDTXNISG-RHSMWYFYSA-N 1 0 326.396 3.948 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000126836409 1024223357 /nfs/dbraw/zinc/22/33/57/1024223357.db2.gz UEBOOGROKYCWQC-HNNXBMFYSA-N 1 0 342.443 3.995 20 5 EHBDRO CC(C)N1CCC[C@@H](Oc2cc([N+](=O)[O-])ccc2Br)C1 ZINC001226586688 1024432490 /nfs/dbraw/zinc/43/24/90/1024432490.db2.gz YJMBFAQDZKCWMO-GFCCVEGCSA-N 1 0 343.221 3.609 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc2c(ccc(C)c2C)[nH]1 ZINC000472040110 1024444763 /nfs/dbraw/zinc/44/47/63/1024444763.db2.gz ZCHJZAUHESNBIH-UHFFFAOYSA-N 1 0 339.395 3.991 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000472057781 1024524666 /nfs/dbraw/zinc/52/46/66/1024524666.db2.gz LSCDUXZFOYUGDB-HNAYVOBHSA-N 1 0 327.428 3.684 20 5 EHBDRO Cc1cc(NC[C@H](C)[N@@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000520748266 1024609730 /nfs/dbraw/zinc/60/97/30/1024609730.db2.gz GSGFYDULYOGLPX-HNNXBMFYSA-N 1 0 325.412 3.762 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000514632728 1024621171 /nfs/dbraw/zinc/62/11/71/1024621171.db2.gz FQKOUBQBIXIDEG-CDMJZVDBSA-N 1 0 339.823 3.601 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000514632729 1024621350 /nfs/dbraw/zinc/62/13/50/1024621350.db2.gz FQKOUBQBIXIDEG-GHMZBOCLSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1c(CN(C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000474235678 1024625470 /nfs/dbraw/zinc/62/54/70/1024625470.db2.gz DIAFLKZVIUYGRT-LJQANCHMSA-N 1 0 339.439 3.610 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C1CC(F)(F)C1 ZINC000895610404 1024658387 /nfs/dbraw/zinc/65/83/87/1024658387.db2.gz AKCAYJPOUSTTQF-MRVPVSSYSA-N 1 0 349.175 3.881 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000548625535 1024843150 /nfs/dbraw/zinc/84/31/50/1024843150.db2.gz WOELTTOJIBIOOK-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO CC(C)n1cncc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000425369121 1024886517 /nfs/dbraw/zinc/88/65/17/1024886517.db2.gz LETUNNZTAPQTRX-MRXNPFEDSA-N 1 0 328.416 3.752 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)c(F)c1 ZINC000425371689 1024895079 /nfs/dbraw/zinc/89/50/79/1024895079.db2.gz LSAGYKLOQSDPDT-QGZVFWFLSA-N 1 0 334.391 3.515 20 5 EHBDRO C[NH+](C)CCN(Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000428099196 1024979300 /nfs/dbraw/zinc/97/93/00/1024979300.db2.gz LTBWDCHNZACMGG-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO COc1cc(NC[C@@H]2CCC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435585071 1025019057 /nfs/dbraw/zinc/01/90/57/1025019057.db2.gz RUDJUSZQOQCMOI-INIZCTEOSA-N 1 0 333.432 3.812 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C(C)C)C1CCCC1 ZINC000068449278 1025033054 /nfs/dbraw/zinc/03/30/54/1025033054.db2.gz CHCLKDGOJKNZCL-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CSC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000515140018 1025042691 /nfs/dbraw/zinc/04/26/91/1025042691.db2.gz BKQSGEBKBAJPFY-MRXNPFEDSA-N 1 0 348.424 3.847 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435994651 1025280870 /nfs/dbraw/zinc/28/08/70/1025280870.db2.gz OTUUPMSRXARGMS-HUUCEWRRSA-N 1 0 325.412 3.554 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)Cc2ccc(C)cc2C)cc1[N+](=O)[O-] ZINC000521336731 1025331976 /nfs/dbraw/zinc/33/19/76/1025331976.db2.gz XDVUIUOLBDFWAS-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)cn1 ZINC000521504250 1025441641 /nfs/dbraw/zinc/44/16/41/1025441641.db2.gz DOWMJJHFKHRXME-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057563 1025480549 /nfs/dbraw/zinc/48/05/49/1025480549.db2.gz UBQJIRRJWXGPFN-KDOFPFPSSA-N 1 0 328.412 3.584 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000436240799 1025489984 /nfs/dbraw/zinc/48/99/84/1025489984.db2.gz RFGPMOAFHOPEDG-OCCSQVGLSA-N 1 0 333.432 3.741 20 5 EHBDRO CC1(C)CCC[C@@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000898048308 1033286373 /nfs/dbraw/zinc/28/63/73/1033286373.db2.gz IPFOSOKLCVKNSJ-SFHVURJKSA-N 1 0 347.459 3.501 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334244 1025506598 /nfs/dbraw/zinc/50/65/98/1025506598.db2.gz UIYFFZSXAPYMGB-KGLIPLIRSA-N 1 0 331.441 3.985 20 5 EHBDRO CC(C)N(C(=O)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000451096529 1025537638 /nfs/dbraw/zinc/53/76/38/1025537638.db2.gz BHJZXOXMDPEJLK-HNNXBMFYSA-N 1 0 341.411 3.687 20 5 EHBDRO COc1cc(C[NH2+]CC[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000898018664 1033291150 /nfs/dbraw/zinc/29/11/50/1033291150.db2.gz CYYXGQJWUAGVQS-LLVKDONJSA-N 1 0 344.358 3.527 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213767 1025682960 /nfs/dbraw/zinc/68/29/60/1025682960.db2.gz WFIMYFNFGPIAOV-KSSFIOAISA-N 1 0 341.411 3.972 20 5 EHBDRO CCCOc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000521828982 1025697779 /nfs/dbraw/zinc/69/77/79/1025697779.db2.gz BETQFLBYLZRTII-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425544180 1025703777 /nfs/dbraw/zinc/70/37/77/1025703777.db2.gz BTSWTBKYIUCRHH-RDTXWAMCSA-N 1 0 330.428 3.937 20 5 EHBDRO CC(C)(CCC(=O)OCc1ccc(C[NH+]2CCCCC2)cc1)[N+](=O)[O-] ZINC000840581244 1025832700 /nfs/dbraw/zinc/83/27/00/1025832700.db2.gz WRFKJDUGUYBWBB-UHFFFAOYSA-N 1 0 348.443 3.551 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000452089778 1026485468 /nfs/dbraw/zinc/48/54/68/1026485468.db2.gz QBIJSKQZSVVYNP-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO CCN(CC)[C@H](C)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335964 1026489106 /nfs/dbraw/zinc/48/91/06/1026489106.db2.gz NNDGMKYYZYGJOB-NUJGCVRESA-N 1 0 333.476 3.626 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCCC[NH+]1CCCCCC1 ZINC000127812450 1026526671 /nfs/dbraw/zinc/52/66/71/1026526671.db2.gz VLAGNWJMVUYCTP-UHFFFAOYSA-N 1 0 348.447 3.599 20 5 EHBDRO CO[C@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000531240423 1026716420 /nfs/dbraw/zinc/71/64/20/1026716420.db2.gz RIFZLHGNHHFWFW-CABCVRRESA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@@H]1COCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000277826149 1027066676 /nfs/dbraw/zinc/06/66/76/1027066676.db2.gz LIPAXUMUQNHJBQ-WBMJQRKESA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cnc3n1CCCC3)CCCC2 ZINC000520203576 1027101660 /nfs/dbraw/zinc/10/16/60/1027101660.db2.gz QYICRIZCLXCAJS-SFHVURJKSA-N 1 0 340.427 3.685 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N3CCC[C@@H]([NH+]4CCCC4)CC3)c2c1 ZINC000413156660 1027139685 /nfs/dbraw/zinc/13/96/85/1027139685.db2.gz ORYBSKINPDYRCB-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178644091 1027231964 /nfs/dbraw/zinc/23/19/64/1027231964.db2.gz ILYQQRIXEMUOAR-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CCOC2(CCCC2)C1)C1CC1 ZINC000127074655 1027270530 /nfs/dbraw/zinc/27/05/30/1027270530.db2.gz JUFXAVBGJBBFGM-ROUUACIJSA-N 1 0 344.455 3.997 20 5 EHBDRO COCCC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC000475497429 1027422890 /nfs/dbraw/zinc/42/28/90/1027422890.db2.gz YKJDJTCEUCUJLZ-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CO)CC2CCC2)s1 ZINC000475516723 1027534852 /nfs/dbraw/zinc/53/48/52/1027534852.db2.gz NORUFTUEIWSBAA-AWEZNQCLSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1c(C[NH2+][C@H]2C[C@@H](C)N(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663382 1027579749 /nfs/dbraw/zinc/57/97/49/1027579749.db2.gz FKFXORYIULODQB-BEFAXECRSA-N 1 0 339.439 3.656 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178659976 1027620250 /nfs/dbraw/zinc/62/02/50/1027620250.db2.gz MSNKTSJDGQUXLL-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2ccccc2C(F)(F)F)cc1 ZINC000237809959 1027762151 /nfs/dbraw/zinc/76/21/51/1027762151.db2.gz YSKFMUICJKBNAJ-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]([C@H]3CCCc4ccccc43)C2)nc1 ZINC000440486076 1028086376 /nfs/dbraw/zinc/08/63/76/1028086376.db2.gz JBFKATVZRJARLJ-QAPCUYQASA-N 1 0 338.411 3.554 20 5 EHBDRO C[NH+]1CCC(NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000237169220 1028115770 /nfs/dbraw/zinc/11/57/70/1028115770.db2.gz XJBHMNZDVPDBRB-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)CN([C@@H]1CCCc3ccc(F)cc31)CC2 ZINC000612469192 1028121224 /nfs/dbraw/zinc/12/12/24/1028121224.db2.gz MPPLEWGPOXXZFP-GOSISDBHSA-N 1 0 327.359 3.565 20 5 EHBDRO Cc1cc(C)cc(CN(C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000444687340 1028161238 /nfs/dbraw/zinc/16/12/38/1028161238.db2.gz ANAZSCRBZKSTPG-UHFFFAOYSA-N 1 0 341.411 3.591 20 5 EHBDRO COc1cc(C)c(C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000502402145 1028175244 /nfs/dbraw/zinc/17/52/44/1028175244.db2.gz MFPAIPLZFKLBQE-CQSZACIVSA-N 1 0 344.411 3.641 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H](C(C)C)C1 ZINC000444774972 1028262685 /nfs/dbraw/zinc/26/26/85/1028262685.db2.gz YXPJXOJFDNRTFF-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])c(F)c3)CC2)cn1 ZINC000366911823 1028316033 /nfs/dbraw/zinc/31/60/33/1028316033.db2.gz CZSFMHSZRODKIY-UHFFFAOYSA-N 1 0 329.375 3.817 20 5 EHBDRO COCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000519917882 1028380908 /nfs/dbraw/zinc/38/09/08/1028380908.db2.gz OREATMPERFCALH-MRXNPFEDSA-N 1 0 344.411 3.683 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000421431661 1028412584 /nfs/dbraw/zinc/41/25/84/1028412584.db2.gz PYIZWWXOXSPIIN-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc2c1CCCN2 ZINC000423408974 1028425452 /nfs/dbraw/zinc/42/54/52/1028425452.db2.gz BFJZFLOODKYWMD-CQSZACIVSA-N 1 0 325.412 3.674 20 5 EHBDRO CCc1ccccc1[C@@H](N)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498601 1028464826 /nfs/dbraw/zinc/46/48/26/1028464826.db2.gz IHTHBDVDRFCBNK-KSSFIOAISA-N 1 0 327.428 3.816 20 5 EHBDRO Cn1cc(C[NH2+]CC2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000504518344 1028706894 /nfs/dbraw/zinc/70/68/94/1028706894.db2.gz GGUXFBOQLWHDOE-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2)cc1OC ZINC000026738759 1028844401 /nfs/dbraw/zinc/84/44/01/1028844401.db2.gz ITZXFAFRCNCYPH-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO COC(=O)c1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000514891887 1029011233 /nfs/dbraw/zinc/01/12/33/1029011233.db2.gz ZSFIZSONOWKRCP-UHFFFAOYSA-N 1 0 342.395 3.795 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC2([NH+](C)C)CCCC2)cc1[N+](=O)[O-] ZINC000504899087 1029027486 /nfs/dbraw/zinc/02/74/86/1029027486.db2.gz AKCLYCXKCNELGQ-CQSZACIVSA-N 1 0 335.448 3.519 20 5 EHBDRO C[C@@H]1CCSCCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819296 1029029800 /nfs/dbraw/zinc/02/98/00/1029029800.db2.gz KZUZSGRDVWVGFU-SNVBAGLBSA-N 1 0 332.372 3.524 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000504906029 1029049528 /nfs/dbraw/zinc/04/95/28/1029049528.db2.gz RQQSDTYTUNCIDO-MAUKXSAKSA-N 1 0 349.475 3.765 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@H](O)C1 ZINC000504905771 1029049722 /nfs/dbraw/zinc/04/97/22/1029049722.db2.gz NOWMLWQNYGYDFE-ZNMIVQPWSA-N 1 0 338.473 3.606 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927450 1029071332 /nfs/dbraw/zinc/07/13/32/1029071332.db2.gz PAQMFSIPRGYPME-CVEARBPZSA-N 1 0 349.475 3.766 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC1(CCO)CCCC1 ZINC000513822896 1029523601 /nfs/dbraw/zinc/52/36/01/1029523601.db2.gz KRUMLNXIGNYPRP-FUHWJXTLSA-N 1 0 346.471 3.838 20 5 EHBDRO CC1(C)CC[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000533265625 1029565185 /nfs/dbraw/zinc/56/51/85/1029565185.db2.gz SHUKYFIYTAJBLU-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000429707700 1029961073 /nfs/dbraw/zinc/96/10/73/1029961073.db2.gz BOUMMRSZCABGLO-GOSISDBHSA-N 1 0 328.412 3.753 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453311282 1030083479 /nfs/dbraw/zinc/08/34/79/1030083479.db2.gz SGUIRUZWQDIBKG-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453318880 1030098223 /nfs/dbraw/zinc/09/82/23/1030098223.db2.gz MEZBVTYBFFTMFO-QSFXBCCZSA-N 1 0 346.471 3.957 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000525868287 1030183338 /nfs/dbraw/zinc/18/33/38/1030183338.db2.gz UBRDIDGMTADPRU-DLBZAZTESA-N 1 0 326.396 3.900 20 5 EHBDRO CC[N@H+](CCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000537635225 1030200726 /nfs/dbraw/zinc/20/07/26/1030200726.db2.gz YWPPXJUFTJNNRP-UHFFFAOYSA-N 1 0 348.374 3.731 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccccc2Cl)n1 ZINC000447522968 1030244189 /nfs/dbraw/zinc/24/41/89/1030244189.db2.gz ROJVTWQVKILMPV-LSDHHAIUSA-N 1 0 334.807 3.718 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509099 1030257275 /nfs/dbraw/zinc/25/72/75/1030257275.db2.gz LUISUPNLAKOLBL-BEFAXECRSA-N 1 0 331.460 3.826 20 5 EHBDRO CCc1ccccc1C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447540980 1030276655 /nfs/dbraw/zinc/27/66/55/1030276655.db2.gz LCALGUCJVOYPCC-DLBZAZTESA-N 1 0 328.416 3.627 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447545106 1030280320 /nfs/dbraw/zinc/28/03/20/1030280320.db2.gz XCOUAKWQQFUJQN-IAGOWNOFSA-N 1 0 328.416 3.682 20 5 EHBDRO CSc1cc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000447586188 1030319995 /nfs/dbraw/zinc/31/99/95/1030319995.db2.gz MRXKJQBUSCSDOX-INIZCTEOSA-N 1 0 329.425 3.879 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@H]2C2CCCCC2)n1 ZINC000447586430 1030320448 /nfs/dbraw/zinc/32/04/48/1030320448.db2.gz NTUREXGMFUQJFW-LUKYLMHMSA-N 1 0 332.448 3.833 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000447594502 1030331656 /nfs/dbraw/zinc/33/16/56/1030331656.db2.gz ZHZQKXUOYBHFRW-RHSMWYFYSA-N 1 0 347.459 3.661 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](CCO)C1CCCCC1)CCC2 ZINC000447577648 1030339351 /nfs/dbraw/zinc/33/93/51/1030339351.db2.gz ASYRKHDWDMJGCT-MOPGFXCFSA-N 1 0 332.444 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCC[C@@H]1n1cccn1)CCC2 ZINC000192923808 1030481906 /nfs/dbraw/zinc/48/19/06/1030481906.db2.gz QTJXKUZZAZMUDR-QRVBRYPASA-N 1 0 340.427 3.942 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000482507801 1030487477 /nfs/dbraw/zinc/48/74/77/1030487477.db2.gz IGYCNRXPJDGQIN-CHWSQXEVSA-N 1 0 333.457 3.924 20 5 EHBDRO CN(C)C[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776187 1030704213 /nfs/dbraw/zinc/70/42/13/1030704213.db2.gz TXLRGRAJRBHTFZ-SUQGKYDKSA-N 1 0 343.402 3.640 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894736 1030775687 /nfs/dbraw/zinc/77/56/87/1030775687.db2.gz GOMVSSDVNMRYBR-OALUTQOASA-N 1 0 326.396 3.699 20 5 EHBDRO COc1ccc(OCC[N@@H+]2C[C@@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073322 1030939775 /nfs/dbraw/zinc/93/97/75/1030939775.db2.gz XVXJDYUZOQPIGB-AUUYWEPGSA-N 1 0 342.395 3.675 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2c[nH]nc2C)CC1 ZINC000551564841 1031458804 /nfs/dbraw/zinc/45/88/04/1031458804.db2.gz QDJQHUVPAHBISJ-UVTDQMKNSA-N 1 0 340.427 3.909 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@@H](C)[C@@H]1C ZINC000475744578 1031834651 /nfs/dbraw/zinc/83/46/51/1031834651.db2.gz RBVXSTGVJDEZRJ-YUELXQCFSA-N 1 0 333.432 3.598 20 5 EHBDRO COc1ccc(COCC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000537936259 1032021241 /nfs/dbraw/zinc/02/12/41/1032021241.db2.gz ITJIPGWBJOEXJI-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594489567 1033394034 /nfs/dbraw/zinc/39/40/34/1033394034.db2.gz DBLAHPLPVKHPGT-PXAZEXFGSA-N 1 0 342.395 3.950 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502849 1033403762 /nfs/dbraw/zinc/40/37/62/1033403762.db2.gz QVDDHXUBJLVJEW-HOTGVXAUSA-N 1 0 340.379 3.704 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594512886 1033417371 /nfs/dbraw/zinc/41/73/71/1033417371.db2.gz SKUPXPACVHQJSS-MJXNMMHHSA-N 1 0 348.443 3.992 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594513166 1033418171 /nfs/dbraw/zinc/41/81/71/1033418171.db2.gz BOXQHYJAPBUUAF-ZIAGYGMSSA-N 1 0 329.400 3.670 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1C1CCCC1 ZINC000063551555 1033447771 /nfs/dbraw/zinc/44/77/71/1033447771.db2.gz UQABKOFDHMNJKZ-SFHVURJKSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1c1ccc(F)cc1 ZINC000059374628 1033591923 /nfs/dbraw/zinc/59/19/23/1033591923.db2.gz AGPUQCSGGSKIPK-INIZCTEOSA-N 1 0 330.359 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CC[NH+](C2CCCC2)CC1 ZINC000595015067 1033609391 /nfs/dbraw/zinc/60/93/91/1033609391.db2.gz WWVUSVDHLMSCAN-CQSZACIVSA-N 1 0 347.459 3.661 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](CCCO)c1ccccc1 ZINC000595020764 1033613754 /nfs/dbraw/zinc/61/37/54/1033613754.db2.gz BLCDFTZALKJILP-KSSFIOAISA-N 1 0 344.411 3.768 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC000595021429 1033614388 /nfs/dbraw/zinc/61/43/88/1033614388.db2.gz DKVBLDSDPBUXAN-GUYCJALGSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023872 1033616247 /nfs/dbraw/zinc/61/62/47/1033616247.db2.gz ZDYMKGXOENHQBS-CVEARBPZSA-N 1 0 349.475 3.622 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccc1)[C@@H](O)C(C)C ZINC000594991078 1033621024 /nfs/dbraw/zinc/62/10/24/1033621024.db2.gz ZHFWSYVYYRAZTL-MOPGFXCFSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1ccccc1CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595006593 1033631033 /nfs/dbraw/zinc/63/10/33/1033631033.db2.gz LMNXQBFIXXXYHZ-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCCO[C@H]1C(C)C ZINC000595027543 1033648986 /nfs/dbraw/zinc/64/89/86/1033648986.db2.gz POLMXNIBWHSCIP-IYOUNJFTSA-N 1 0 336.432 3.705 20 5 EHBDRO COC(=O)CC1CCC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000599030573 1033659529 /nfs/dbraw/zinc/65/95/29/1033659529.db2.gz JKTFIUKFIVESQC-VQCLRJIVSA-N 1 0 334.416 3.676 20 5 EHBDRO CC[C@@H](OCC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000593664440 1033663910 /nfs/dbraw/zinc/66/39/10/1033663910.db2.gz NHOPSASMRHBLDO-GOSISDBHSA-N 1 0 344.411 3.861 20 5 EHBDRO COc1ccc([C@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599020520 1033667842 /nfs/dbraw/zinc/66/78/42/1033667842.db2.gz SFRICCOJKBQVMT-GJEJWFRCSA-N 1 0 339.395 3.753 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595101254 1033691853 /nfs/dbraw/zinc/69/18/53/1033691853.db2.gz CPRMHLBZSKSZKX-KXBFYZLASA-N 1 0 325.412 3.520 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595109147 1033694672 /nfs/dbraw/zinc/69/46/72/1033694672.db2.gz UQKOCTCUHKMDDT-OIISXLGYSA-N 1 0 332.444 3.711 20 5 EHBDRO CC(=O)c1cc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000599125690 1033745332 /nfs/dbraw/zinc/74/53/32/1033745332.db2.gz AKAOUAKENKXAMB-INIZCTEOSA-N 1 0 331.416 3.616 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595414491 1033789760 /nfs/dbraw/zinc/78/97/60/1033789760.db2.gz KQQHEKPPDHSGOR-CABCVRRESA-N 1 0 347.459 3.530 20 5 EHBDRO COCc1ccnc(N[C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000593698553 1033797484 /nfs/dbraw/zinc/79/74/84/1033797484.db2.gz SWDCGYPFAIFENM-WBVHZDCISA-N 1 0 341.411 3.960 20 5 EHBDRO CC[C@@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000603629432 1033814308 /nfs/dbraw/zinc/81/43/08/1033814308.db2.gz SHBUKYAEGNBAQC-LBPRGKRZSA-N 1 0 331.338 3.900 20 5 EHBDRO CN(Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](CO)c1ccc(Cl)cc1 ZINC000595511513 1033837232 /nfs/dbraw/zinc/83/72/32/1033837232.db2.gz SDQUIYOTGKEWTH-INIZCTEOSA-N 1 0 338.766 3.553 20 5 EHBDRO O=[N+]([O-])c1ncccc1NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000603844667 1033967647 /nfs/dbraw/zinc/96/76/47/1033967647.db2.gz LOWVLLHISYZLSD-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC)cc1 ZINC000603854628 1033979321 /nfs/dbraw/zinc/97/93/21/1033979321.db2.gz IGZMLGHLWJZUDO-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CCOc1cc(C[NH+]2CCC([C@@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000595782279 1033995139 /nfs/dbraw/zinc/99/51/39/1033995139.db2.gz IPZIYZPRLOUPNQ-SFHVURJKSA-N 1 0 348.443 3.775 20 5 EHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000595782268 1033997201 /nfs/dbraw/zinc/99/72/01/1033997201.db2.gz IMLDTFIWSBAXCW-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)cc1 ZINC000595788256 1033999721 /nfs/dbraw/zinc/99/97/21/1033999721.db2.gz HOEYLHIGZDOHEK-APWZRJJASA-N 1 0 348.443 3.645 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599676925 1034085235 /nfs/dbraw/zinc/08/52/35/1034085235.db2.gz FTUCXCFPFOQAFZ-MRXNPFEDSA-N 1 0 344.386 3.775 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c([N+](=O)[O-])s1 ZINC000596171014 1034117421 /nfs/dbraw/zinc/11/74/21/1034117421.db2.gz CNNKDQPBLRSCQO-CYBMUJFWSA-N 1 0 346.456 3.997 20 5 EHBDRO COc1cc(NCCCC[N@H+](C)C2CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596260233 1034154990 /nfs/dbraw/zinc/15/49/90/1034154990.db2.gz BXBNLKYCWRDWQM-UHFFFAOYSA-N 1 0 327.812 3.543 20 5 EHBDRO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@H]1CCC1CCCCC1 ZINC000534136283 1034181482 /nfs/dbraw/zinc/18/14/82/1034181482.db2.gz BOYLEADRFWXLIW-KRWDZBQOSA-N 1 0 347.459 3.581 20 5 EHBDRO CC(=O)c1cc(N[C@H]2CC[N@@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000596481055 1034255061 /nfs/dbraw/zinc/25/50/61/1034255061.db2.gz WPFBSDGTZOGFCI-HNNXBMFYSA-N 1 0 331.416 3.616 20 5 EHBDRO Nc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000596650142 1034346077 /nfs/dbraw/zinc/34/60/77/1034346077.db2.gz GVVJCRAYEUMTLO-RBUKOAKNSA-N 1 0 337.423 3.775 20 5 EHBDRO C[C@H](N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000596648775 1034346263 /nfs/dbraw/zinc/34/62/63/1034346263.db2.gz FONPWUITPSWKAI-MJXNMMHHSA-N 1 0 343.402 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@H]2c2ccc(O)cc2)cc1 ZINC000604484206 1034388822 /nfs/dbraw/zinc/38/88/22/1034388822.db2.gz FGHYIMXUQKUYBW-SFHVURJKSA-N 1 0 328.368 3.516 20 5 EHBDRO Cc1ccc([C@H](CNc2cccnc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000604508568 1034408077 /nfs/dbraw/zinc/40/80/77/1034408077.db2.gz TZBQVJGEQLVSPN-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO COCC1(C2CCC2)C[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000597193799 1034579065 /nfs/dbraw/zinc/57/90/65/1034579065.db2.gz XOXSXTQSSIMDKC-UHFFFAOYSA-N 1 0 332.444 3.967 20 5 EHBDRO C[C@@]12COC[C@H]1C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212095 1034596347 /nfs/dbraw/zinc/59/63/47/1034596347.db2.gz RPSMVSYVNXMZIZ-RDTXWAMCSA-N 1 0 344.436 3.792 20 5 EHBDRO C[C@@]12COC[C@@H]1C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212089 1034597022 /nfs/dbraw/zinc/59/70/22/1034597022.db2.gz RPSMVSYVNXMZIZ-KBXCAEBGSA-N 1 0 344.436 3.792 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC4(COC4)C3)s2)cc1 ZINC000597229312 1034610753 /nfs/dbraw/zinc/61/07/53/1034610753.db2.gz KWBMLZUDWRIFMH-UHFFFAOYSA-N 1 0 330.409 3.546 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000364577250 1034701160 /nfs/dbraw/zinc/70/11/60/1034701160.db2.gz JCHZBQAHTWWLRU-CJNGLKHVSA-N 1 0 328.416 3.580 20 5 EHBDRO C[C@@H]([NH2+]CC1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000188506995 1034713074 /nfs/dbraw/zinc/71/30/74/1034713074.db2.gz LNRRBGSVGJPFQT-GFCCVEGCSA-N 1 0 345.365 3.520 20 5 EHBDRO COc1ccc(NC(=O)CC[N@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000411361335 1034869514 /nfs/dbraw/zinc/86/95/14/1034869514.db2.gz HBMPPYKDKNJKHT-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c(F)c1 ZINC000491206688 1034869819 /nfs/dbraw/zinc/86/98/19/1034869819.db2.gz UIVWZSCTEZVLAC-MRXNPFEDSA-N 1 0 349.450 3.822 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC3CC[NH+](C4CCC4)CC3)ccnc21 ZINC000450876635 1034905267 /nfs/dbraw/zinc/90/52/67/1034905267.db2.gz JRUJYUPLQKCWGG-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO CC(C)([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000411761311 1035019968 /nfs/dbraw/zinc/01/99/68/1035019968.db2.gz VAVIVMZYEDUMQP-UHFFFAOYSA-N 1 0 345.374 3.587 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000612582093 1035071868 /nfs/dbraw/zinc/07/18/68/1035071868.db2.gz VQOJDSFSVNPRBT-QGZVFWFLSA-N 1 0 326.396 3.559 20 5 EHBDRO CO[C@](C)([C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CC1 ZINC000411970126 1035089401 /nfs/dbraw/zinc/08/94/01/1035089401.db2.gz MVYWHTLGQBCTEW-MEBBXXQBSA-N 1 0 346.349 3.907 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044379 1035274950 /nfs/dbraw/zinc/27/49/50/1035274950.db2.gz NEMGTVITVGNTQT-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000075865948 1035570254 /nfs/dbraw/zinc/57/02/54/1035570254.db2.gz GPVRWZGFGIYJPG-GOSISDBHSA-N 1 0 340.423 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CCC[NH2+]CC3)o2)c(Cl)c1 ZINC000591278472 1035616348 /nfs/dbraw/zinc/61/63/48/1035616348.db2.gz DWDGZDBTNOYNIF-LBPRGKRZSA-N 1 0 349.818 3.740 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554378 1035666724 /nfs/dbraw/zinc/66/67/24/1035666724.db2.gz CQQVUZMRQVZUCV-GOEBONIOSA-N 1 0 349.431 3.645 20 5 EHBDRO CCC[N@H+](C)[C@@H](CNc1ncc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000588061765 1035716821 /nfs/dbraw/zinc/71/68/21/1035716821.db2.gz RFOGMVXHUWMOKF-HNNXBMFYSA-N 1 0 349.822 3.533 20 5 EHBDRO COc1cc(C[NH2+]CCC2=CCCCCC2)c([N+](=O)[O-])cc1OC ZINC000463715214 1035761693 /nfs/dbraw/zinc/76/16/93/1035761693.db2.gz GWAHFJKDHDUTRU-UHFFFAOYSA-N 1 0 334.416 3.982 20 5 EHBDRO COc1cc2c(cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C)O[C@H](C)C2 ZINC000327858923 1035821972 /nfs/dbraw/zinc/82/19/72/1035821972.db2.gz OFDZPAZTQBXCAD-GFCCVEGCSA-N 1 0 342.395 3.525 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492660032 1036153065 /nfs/dbraw/zinc/15/30/65/1036153065.db2.gz XWNLNJKYVKFKBM-KRWDZBQOSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000582677782 1036171775 /nfs/dbraw/zinc/17/17/75/1036171775.db2.gz VHXOZDGXHQHBGM-QMIHWGKISA-N 1 0 339.439 3.863 20 5 EHBDRO CCCC[C@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000442723072 1036209880 /nfs/dbraw/zinc/20/98/80/1036209880.db2.gz YNAFKPHSINLDGQ-KRWDZBQOSA-N 1 0 343.383 3.843 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C2CCC(COC)CC2)cc1[N+](=O)[O-] ZINC000414315735 1036628750 /nfs/dbraw/zinc/62/87/50/1036628750.db2.gz SLJFWDXCCSPLLE-HLIUYOAVSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135585 1036783970 /nfs/dbraw/zinc/78/39/70/1036783970.db2.gz OASBPCYQDKYZBE-VXGBXAGGSA-N 1 0 343.349 3.961 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)c2ccccc2C1 ZINC000590369317 1036856316 /nfs/dbraw/zinc/85/63/16/1036856316.db2.gz CNIRHANQTDXFLQ-UHFFFAOYSA-N 1 0 331.803 3.700 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1occc1C ZINC000412026011 1036858777 /nfs/dbraw/zinc/85/87/77/1036858777.db2.gz KMKIYPUVSQCMSG-UHFFFAOYSA-N 1 0 345.399 3.655 20 5 EHBDRO CCC[C@@]1(C)CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000464844079 1036881764 /nfs/dbraw/zinc/88/17/64/1036881764.db2.gz CYUWGYHMOSSUEX-SFHVURJKSA-N 1 0 333.432 3.826 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000539588698 1036957142 /nfs/dbraw/zinc/95/71/42/1036957142.db2.gz GAGHUUSWPJGEMJ-SFHVURJKSA-N 1 0 344.411 3.742 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC(C)(C)C[C@@H]1C ZINC000412031155 1036990641 /nfs/dbraw/zinc/99/06/41/1036990641.db2.gz AMUPJCXCPXKGKX-RYUDHWBXSA-N 1 0 330.388 3.826 20 5 EHBDRO C[C@H]1CCC[N@@H+](C(C)(C)CNCc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000761521358 1037098712 /nfs/dbraw/zinc/09/87/12/1037098712.db2.gz GDASIXUJNDKPIR-ZDUSSCGKSA-N 1 0 339.867 3.848 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237783944 1037178817 /nfs/dbraw/zinc/17/88/17/1037178817.db2.gz QIEJTBNWZQAPGV-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308448 1037243193 /nfs/dbraw/zinc/24/31/93/1037243193.db2.gz YPFXHIWGHXBHSG-MOPGFXCFSA-N 1 0 328.412 3.945 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@@H]32)o1 ZINC000539891715 1037315000 /nfs/dbraw/zinc/31/50/00/1037315000.db2.gz ZJAGFPLPTUJVIX-PBHICJAKSA-N 1 0 342.395 3.856 20 5 EHBDRO CC(C)CC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000472612222 1037386991 /nfs/dbraw/zinc/38/69/91/1037386991.db2.gz QTZWBQQEVYRCHA-GJZGRUSLSA-N 1 0 333.432 3.728 20 5 EHBDRO COc1cc(NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786735 1037395597 /nfs/dbraw/zinc/39/55/97/1037395597.db2.gz BFAUKNSKCRGYRM-GASCZTMLSA-N 1 0 335.448 3.773 20 5 EHBDRO CCOc1cc(N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992811 1037429732 /nfs/dbraw/zinc/42/97/32/1037429732.db2.gz FZIHWPDOENKNNF-HLLBOEOZSA-N 1 0 347.459 3.835 20 5 EHBDRO CC1(C)CCC[C@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000549859688 1037459708 /nfs/dbraw/zinc/45/97/08/1037459708.db2.gz ZIZPAPHMBZUULJ-IBGZPJMESA-N 1 0 344.411 3.886 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462838720 1037463418 /nfs/dbraw/zinc/46/34/18/1037463418.db2.gz ZHTZOUYKINCVNN-ZDUSSCGKSA-N 1 0 343.374 3.873 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCOC1 ZINC000540067922 1037517677 /nfs/dbraw/zinc/51/76/77/1037517677.db2.gz FYFILFDSMWERIZ-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786893 1037535250 /nfs/dbraw/zinc/53/52/50/1037535250.db2.gz GTABYMUDLFIOSS-LBTNJELSSA-N 1 0 344.411 3.836 20 5 EHBDRO COc1cccc(COCC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000540139591 1037612602 /nfs/dbraw/zinc/61/26/02/1037612602.db2.gz CEAATRKWEDJQJO-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CN(C(=O)C[N@@H+]1CCCC2(CCCCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000532579803 1037665921 /nfs/dbraw/zinc/66/59/21/1037665921.db2.gz LACQIFOBPZWOSI-UHFFFAOYSA-N 1 0 345.443 3.604 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccccc2[N+](=O)[O-])cc1 ZINC000103135233 1037764561 /nfs/dbraw/zinc/76/45/61/1037764561.db2.gz WDXXWOOKEGLZFI-UHFFFAOYSA-N 1 0 329.400 3.537 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000573858778 1037784589 /nfs/dbraw/zinc/78/45/89/1037784589.db2.gz YTZHYSXTRZZFFW-ZFWWWQNUSA-N 1 0 342.395 3.820 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccccc1)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897466229 1037877580 /nfs/dbraw/zinc/87/75/80/1037877580.db2.gz PYTDCEWVGOFHAB-CABCVRRESA-N 1 0 341.411 3.705 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000341293526 1037903244 /nfs/dbraw/zinc/90/32/44/1037903244.db2.gz PSXSRAXARMWZIV-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@@H]3C3CCC3)n2)c1 ZINC000592198799 1037944471 /nfs/dbraw/zinc/94/44/71/1037944471.db2.gz VNIWTCRFQSIQMN-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCCc2occc21 ZINC000341439286 1038304838 /nfs/dbraw/zinc/30/48/38/1038304838.db2.gz HPNQJNXOZOUWKA-LRDDRELGSA-N 1 0 343.383 3.572 20 5 EHBDRO O=C(C[NH2+][C@H](c1ccccc1)C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000104701887 1038490643 /nfs/dbraw/zinc/49/06/43/1038490643.db2.gz NEAYWTWCQRIPSG-LJQANCHMSA-N 1 0 339.395 3.664 20 5 EHBDRO CC1CCC([NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236828441 1038531844 /nfs/dbraw/zinc/53/18/44/1038531844.db2.gz CEELBBSXGQXKCK-UHFFFAOYSA-N 1 0 328.416 3.664 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1C ZINC000538937423 1038604088 /nfs/dbraw/zinc/60/40/88/1038604088.db2.gz RXEDLIPLELGNDY-AAEUAGOBSA-N 1 0 343.374 3.505 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777581 1038604295 /nfs/dbraw/zinc/60/42/95/1038604295.db2.gz GAZOAXQHFAARTN-SNVBAGLBSA-N 1 0 329.322 3.571 20 5 EHBDRO C[C@@H](C[C@@H](O)c1cccs1)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268735 1038911670 /nfs/dbraw/zinc/91/16/70/1038911670.db2.gz YMZXDHSOBBCZGY-IINYFYTJSA-N 1 0 340.832 3.912 20 5 EHBDRO COc1cccc(NCC2CC[NH+](CCC(C)C)CC2)c1[N+](=O)[O-] ZINC000500694090 1039200666 /nfs/dbraw/zinc/20/06/66/1039200666.db2.gz GLHHGNWHBRQFKF-UHFFFAOYSA-N 1 0 335.448 3.773 20 5 EHBDRO CCOCC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000500770289 1039458710 /nfs/dbraw/zinc/45/87/10/1039458710.db2.gz IKANEHBREPGRCL-UHFFFAOYSA-N 1 0 338.791 3.977 20 5 EHBDRO CCCc1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000488992998 1039529022 /nfs/dbraw/zinc/52/90/22/1039529022.db2.gz AJZLEIFRGWROEY-UHFFFAOYSA-N 1 0 328.416 3.581 20 5 EHBDRO COc1cc2c(c(C[NH2+]Cc3cccc([N+](=O)[O-])c3C)c1)O[C@@H](C)C2 ZINC000480502678 1039627866 /nfs/dbraw/zinc/62/78/66/1039627866.db2.gz WVHLBLKFLXHQHY-LBPRGKRZSA-N 1 0 342.395 3.525 20 5 EHBDRO Cc1cc(C[C@H](C)[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000417312936 1039668590 /nfs/dbraw/zinc/66/85/90/1039668590.db2.gz UCXDSOJUPVPIEI-KPZWWZAWSA-N 1 0 328.416 3.615 20 5 EHBDRO Cc1cc(C)n(CCC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417326286 1039685643 /nfs/dbraw/zinc/68/56/43/1039685643.db2.gz RPKZONIRBBNKFI-LJQANCHMSA-N 1 0 342.443 3.856 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COCc2ccccc21 ZINC000417355450 1039714460 /nfs/dbraw/zinc/71/44/60/1039714460.db2.gz DJCIIKRFWDSVQR-RDTXWAMCSA-N 1 0 326.396 3.777 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)nc1 ZINC000417358501 1039720019 /nfs/dbraw/zinc/72/00/19/1039720019.db2.gz HZCNPQQKKYMBCF-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCCCCC1 ZINC000480660233 1039821607 /nfs/dbraw/zinc/82/16/07/1039821607.db2.gz FJIVVIBNADVIOX-SJORKVTESA-N 1 0 333.476 3.770 20 5 EHBDRO CC(C)N(C)C[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990959 1040023269 /nfs/dbraw/zinc/02/32/69/1040023269.db2.gz HEUIXBDWCXXSOL-JZXOWHBKSA-N 1 0 333.476 3.624 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)CC(=O)OC(C)(C)C ZINC000468638376 1040039261 /nfs/dbraw/zinc/03/92/61/1040039261.db2.gz NYFYAEFLMHDIMT-XXYUJHKVSA-N 1 0 334.416 3.708 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769531 1040425381 /nfs/dbraw/zinc/42/53/81/1040425381.db2.gz FFQDXJPJAMMJGN-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000481195100 1040472913 /nfs/dbraw/zinc/47/29/13/1040472913.db2.gz WVWSBKUHLCHVPG-NTZNESFSSA-N 1 0 339.823 3.601 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000512677954 1040496407 /nfs/dbraw/zinc/49/64/07/1040496407.db2.gz NJHWUTKDBDNDDS-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848824 1040571346 /nfs/dbraw/zinc/57/13/46/1040571346.db2.gz JRULVDWBAONMII-SJCJKPOMSA-N 1 0 342.399 3.887 20 5 EHBDRO CCC[C@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000433062291 1040582252 /nfs/dbraw/zinc/58/22/52/1040582252.db2.gz SSNUUWJMBOKILT-KRWDZBQOSA-N 1 0 332.444 3.968 20 5 EHBDRO CO[C@@H](CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433075772 1040637342 /nfs/dbraw/zinc/63/73/42/1040637342.db2.gz LGUYIHQBZIQUMA-KGLIPLIRSA-N 1 0 346.349 3.874 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C1CCC(C(C)C)CC1 ZINC000433144002 1040909399 /nfs/dbraw/zinc/90/93/99/1040909399.db2.gz AQMZKIKHCGLKTF-UHFFFAOYSA-N 1 0 347.459 3.988 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@H](C)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541547139 1040920103 /nfs/dbraw/zinc/92/01/03/1040920103.db2.gz AKOHSWOOTBSXPU-UGSOOPFHSA-N 1 0 332.400 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)c(F)c1 ZINC000491130994 1040938067 /nfs/dbraw/zinc/93/80/67/1040938067.db2.gz GWMHHPUDNMODIH-UHFFFAOYSA-N 1 0 330.359 3.819 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1)c1ccccc1[N+](=O)[O-] ZINC000586791501 1041025022 /nfs/dbraw/zinc/02/50/22/1041025022.db2.gz PKAVCJAOUKCECH-WDEREUQCSA-N 1 0 327.340 3.853 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](CO)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000433283861 1041232344 /nfs/dbraw/zinc/23/23/44/1041232344.db2.gz PQDKSPIUFLRMMF-MSOLQXFVSA-N 1 0 344.386 3.780 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(C)o1 ZINC000433285387 1041235537 /nfs/dbraw/zinc/23/55/37/1041235537.db2.gz SFNMPVIJUMPZJV-QGZVFWFLSA-N 1 0 329.400 3.754 20 5 EHBDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433295449 1041248250 /nfs/dbraw/zinc/24/82/50/1041248250.db2.gz DMNSNURCXGDWBW-IAGOWNOFSA-N 1 0 334.460 3.950 20 5 EHBDRO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000110788966 1041602435 /nfs/dbraw/zinc/60/24/35/1041602435.db2.gz QSNIVGUMNVOWCV-UHFFFAOYSA-N 1 0 339.823 3.840 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccs2)C[C@@H]2CCCO2)cc1 ZINC000108086118 1042009667 /nfs/dbraw/zinc/00/96/67/1042009667.db2.gz GUHLIAGHEAMTPI-KRWDZBQOSA-N 1 0 346.452 3.880 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCCCCC1 ZINC000109093461 1042130971 /nfs/dbraw/zinc/13/09/71/1042130971.db2.gz LDILUHMMHGQPQK-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000181816105 1042399794 /nfs/dbraw/zinc/39/97/94/1042399794.db2.gz LBOPCOLJZKIQAC-MKVSYHDVSA-N 1 0 347.459 3.637 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCC(=O)Nc2ccccc2)cccc1[N+](=O)[O-] ZINC000164986556 1042585087 /nfs/dbraw/zinc/58/50/87/1042585087.db2.gz FPLFIEVOEKAFII-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000128530510 1042630522 /nfs/dbraw/zinc/63/05/22/1042630522.db2.gz JBSWACGEGXERNN-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCCC[C@@H]([NH+]4CCCC4)C3)ccnc21 ZINC000432326769 1042903943 /nfs/dbraw/zinc/90/39/43/1042903943.db2.gz QEYBDUZNOBZEHT-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO CC1(C)[C@H](C(F)(F)F)CC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000330945802 1042911543 /nfs/dbraw/zinc/91/15/43/1042911543.db2.gz ABSGBCMDOZGHTE-CYBMUJFWSA-N 1 0 332.322 3.636 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(NC(C)=O)nc1)c1cccc([N+](=O)[O-])c1 ZINC000279006140 1043172183 /nfs/dbraw/zinc/17/21/83/1043172183.db2.gz GICORJDXSPNMFQ-QGZVFWFLSA-N 1 0 342.399 3.579 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000344095084 1043244360 /nfs/dbraw/zinc/24/43/60/1043244360.db2.gz SBPVRQXRJUDKKN-INIZCTEOSA-N 1 0 344.411 3.895 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132142 1043401115 /nfs/dbraw/zinc/40/11/15/1043401115.db2.gz RCKHGSWUZVNISL-HZPDHXFCSA-N 1 0 332.425 3.702 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000107675337 1043756949 /nfs/dbraw/zinc/75/69/49/1043756949.db2.gz CPUAFUQSUNRXDU-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO CN(c1ccc(F)cc1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1 ZINC000090156360 1044512675 /nfs/dbraw/zinc/51/26/75/1044512675.db2.gz GFWPQSFEYHANMT-UHFFFAOYSA-N 1 0 343.402 3.835 20 5 EHBDRO CCOCC[N@H+](CC)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000512300224 1044563250 /nfs/dbraw/zinc/56/32/50/1044563250.db2.gz QRUPEZHOHHJFAD-UHFFFAOYSA-N 1 0 348.399 3.722 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000178568451 1044637940 /nfs/dbraw/zinc/63/79/40/1044637940.db2.gz BLYZQVSFFUZECA-LJQANCHMSA-N 1 0 342.370 3.557 20 5 EHBDRO C[N@H+](CCc1ccncc1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000183756959 1125773530 /nfs/dbraw/zinc/77/35/30/1125773530.db2.gz NHKQSHCEPVTZHY-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000072597907 1126793276 /nfs/dbraw/zinc/79/32/76/1126793276.db2.gz RVLZOBDLRYCXMO-IFXJQAMLSA-N 1 0 326.396 3.902 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CCSC(F)(F)F)c1 ZINC000195422131 1126959440 /nfs/dbraw/zinc/95/94/40/1126959440.db2.gz RRJRWADAJQVFOS-UHFFFAOYSA-N 1 0 346.277 3.539 20 5 EHBDRO O=C(NCc1cccc([N+](=O)[O-])c1)c1ccc(Nc2cc[nH+]cc2)cc1 ZINC000073100472 1127008266 /nfs/dbraw/zinc/00/82/66/1127008266.db2.gz LYUJMGUACHNKLB-UHFFFAOYSA-N 1 0 348.362 3.663 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)o1 ZINC000131339825 1127626438 /nfs/dbraw/zinc/62/64/38/1127626438.db2.gz RXAUPRJXIMDHKP-QGZVFWFLSA-N 1 0 346.383 3.550 20 5 EHBDRO [NH3+]CC[C@@H]1CN(c2ccc3cnccc3c2[N+](=O)[O-])c2ccccc21 ZINC001168548887 1127708675 /nfs/dbraw/zinc/70/86/75/1127708675.db2.gz JLJVSCJBFCWOEZ-CQSZACIVSA-N 1 0 334.379 3.727 20 5 EHBDRO COc1cc(N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301328075 1127737348 /nfs/dbraw/zinc/73/73/48/1127737348.db2.gz JFBHYQSTXSSBJD-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO Cc1cc(NCC(C)(C)[N@@H+]2CCc3ccccc3C2)ncc1[N+](=O)[O-] ZINC000301420069 1127742588 /nfs/dbraw/zinc/74/25/88/1127742588.db2.gz DSOOFJRYQOPSKX-UHFFFAOYSA-N 1 0 340.427 3.547 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000301467877 1128440583 /nfs/dbraw/zinc/44/05/83/1128440583.db2.gz YNQPOBNNAXVEAV-QGZVFWFLSA-N 1 0 325.412 3.553 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000153592559 1128486162 /nfs/dbraw/zinc/48/61/62/1128486162.db2.gz NYXOQKVRNBKTMV-UONOGXRCSA-N 1 0 344.411 3.981 20 5 EHBDRO Cc1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000301562894 1128497574 /nfs/dbraw/zinc/49/75/74/1128497574.db2.gz IWOZSXXQNCVHOU-DOTOQJQBSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848110 1128560089 /nfs/dbraw/zinc/56/00/89/1128560089.db2.gz FOXNBIITMGOLLW-MLGOLLRUSA-N 1 0 326.352 3.725 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(C(=O)NC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000327011370 1128583975 /nfs/dbraw/zinc/58/39/75/1128583975.db2.gz MOGNSGDGCMHPNB-GOSISDBHSA-N 1 0 341.411 3.585 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000554067259 1128609822 /nfs/dbraw/zinc/60/98/22/1128609822.db2.gz PMRPVUISFWLFFT-KGLIPLIRSA-N 1 0 348.830 3.983 20 5 EHBDRO O=C(CC[N@@H+]1CCCC2(CCCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000554077188 1128612518 /nfs/dbraw/zinc/61/25/18/1128612518.db2.gz IUACYOAEZVRJPA-UHFFFAOYSA-N 1 0 345.443 3.970 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000123146519 1128654391 /nfs/dbraw/zinc/65/43/91/1128654391.db2.gz YTZAUBMTSKRPOU-SFHVURJKSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000462862129 1128751347 /nfs/dbraw/zinc/75/13/47/1128751347.db2.gz LMAQECXBLITDOQ-DGCLKSJQSA-N 1 0 345.365 3.780 20 5 EHBDRO Cc1nc(NCC2CC[NH+](Cc3cccs3)CC2)ccc1[N+](=O)[O-] ZINC000301667551 1128864414 /nfs/dbraw/zinc/86/44/14/1128864414.db2.gz XHNNAQORESWVNK-UHFFFAOYSA-N 1 0 346.456 3.684 20 5 EHBDRO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C[C@H]1CCc2ccccc21 ZINC000595876755 1120362211 /nfs/dbraw/zinc/36/22/11/1120362211.db2.gz GFSDTZPNVRFPRO-CQSZACIVSA-N 1 0 336.395 3.633 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CCCO[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000492874962 1120374342 /nfs/dbraw/zinc/37/43/42/1120374342.db2.gz QXDVDFTUBUNUDV-NVXWUHKLSA-N 1 0 336.432 3.677 20 5 EHBDRO CCc1ccc([C@@H](NCC[NH+](CC)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479389 1120469435 /nfs/dbraw/zinc/46/94/35/1120469435.db2.gz RERGKRRXEYUNRT-IBGZPJMESA-N 1 0 345.443 3.771 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272200549 1120560554 /nfs/dbraw/zinc/56/05/54/1120560554.db2.gz OLHZXCQAFXQZPP-APWZRJJASA-N 1 0 339.439 3.595 20 5 EHBDRO CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000494439046 1120566545 /nfs/dbraw/zinc/56/65/45/1120566545.db2.gz YRBSBBGJNZNADX-JKSUJKDBSA-N 1 0 332.425 3.572 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000495024771 1120932774 /nfs/dbraw/zinc/93/27/74/1120932774.db2.gz FQHRYYHYNCUWHZ-DKSSEZFCSA-N 1 0 326.396 3.841 20 5 EHBDRO CCSc1cc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])ccn1 ZINC000495178686 1120980843 /nfs/dbraw/zinc/98/08/43/1120980843.db2.gz SXVDIDBIFIUOLF-ALCCZGGFSA-N 1 0 329.425 3.905 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@@H]1CCCN(C(=O)OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000495562549 1121274419 /nfs/dbraw/zinc/27/44/19/1121274419.db2.gz ZJKADZAATMBGLS-UNEWFSDZSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301067846 1121302227 /nfs/dbraw/zinc/30/22/27/1121302227.db2.gz RIFJBPIMMTXEGV-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000301069710 1121312085 /nfs/dbraw/zinc/31/20/85/1121312085.db2.gz UDQLTKUGFGZKAS-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000542977374 1128982516 /nfs/dbraw/zinc/98/25/16/1128982516.db2.gz FSJCNUHSBLNQES-DHSIGJKJSA-N 1 0 345.443 3.742 20 5 EHBDRO CC(C)COC(=O)N1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000495746418 1121397865 /nfs/dbraw/zinc/39/78/65/1121397865.db2.gz DADYNNGOJNKKGQ-CQSZACIVSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCCC2)c2ccccc2)c(F)c1 ZINC000301081367 1121479613 /nfs/dbraw/zinc/47/96/13/1121479613.db2.gz KOLIMSBQRCMSIH-GOSISDBHSA-N 1 0 329.375 3.983 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C(C)(C)c1cccs1 ZINC000542574157 1121512388 /nfs/dbraw/zinc/51/23/88/1121512388.db2.gz VBSGCQBGESSSEL-UHFFFAOYSA-N 1 0 347.440 3.818 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCCOCC(F)(F)F)C2CC2)c1 ZINC000153269337 1121556053 /nfs/dbraw/zinc/55/60/53/1121556053.db2.gz PHLPMWDECVJDEO-UHFFFAOYSA-N 1 0 332.322 3.528 20 5 EHBDRO Cc1cnn(CCCCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000153295208 1121641083 /nfs/dbraw/zinc/64/10/83/1121641083.db2.gz VDLHDTRVLIDCPK-UHFFFAOYSA-N 1 0 342.443 3.935 20 5 EHBDRO C[NH+]1CCC(C)(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000322584018 1121658916 /nfs/dbraw/zinc/65/89/16/1121658916.db2.gz DOSWKWYVWBLEOW-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO CCCC1(CN[C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272472858 1121660062 /nfs/dbraw/zinc/66/00/62/1121660062.db2.gz APPNRRKTLDUIOW-INIZCTEOSA-N 1 0 328.416 3.588 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)c(Cl)c1 ZINC000322895818 1121681358 /nfs/dbraw/zinc/68/13/58/1121681358.db2.gz BSPBGKWGCYTILD-OIISXLGYSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC3(O)CCCCC3)cs2)c1 ZINC000113331869 1129002356 /nfs/dbraw/zinc/00/23/56/1129002356.db2.gz VMSOICGSROFTCE-UHFFFAOYSA-N 1 0 347.440 3.503 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C ZINC000194035951 1121760606 /nfs/dbraw/zinc/76/06/06/1121760606.db2.gz SBMNUXNMSWTDAZ-GYSYKLTISA-N 1 0 339.823 3.601 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000194059399 1121764647 /nfs/dbraw/zinc/76/46/47/1121764647.db2.gz VYBNMYCDHLEGAO-GJZGRUSLSA-N 1 0 347.459 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N[C@H]3CC[N@H+](Cc4ccccc4)C3)ccc2c1 ZINC000311855801 1129047803 /nfs/dbraw/zinc/04/78/03/1129047803.db2.gz PTGIZRKYQFUCPL-KRWDZBQOSA-N 1 0 348.406 3.829 20 5 EHBDRO CN(CCOc1cccc(Cl)c1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000916972952 1122426316 /nfs/dbraw/zinc/42/63/16/1122426316.db2.gz FGVCBHAYLAFNPS-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087091 1122490924 /nfs/dbraw/zinc/49/09/24/1122490924.db2.gz QDNOISIUONMIMZ-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000301206519 1122528393 /nfs/dbraw/zinc/52/83/93/1122528393.db2.gz ZJBDHVVTSWPWFS-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2ccc([N+](=O)[O-])nc2)c2ccccc2)CC1 ZINC000497646310 1122619962 /nfs/dbraw/zinc/61/99/62/1122619962.db2.gz UTAFRMJHSOZVOY-GOSISDBHSA-N 1 0 340.427 3.875 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2C)C1 ZINC000609489224 1123590523 /nfs/dbraw/zinc/59/05/23/1123590523.db2.gz CDIYRPCRMZNMEM-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609571507 1123611042 /nfs/dbraw/zinc/61/10/42/1123611042.db2.gz LDZCTCPXXYGANF-UGSOOPFHSA-N 1 0 332.400 3.742 20 5 EHBDRO CCOC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000233779539 1123713544 /nfs/dbraw/zinc/71/35/44/1123713544.db2.gz GYCJAYOXFPEVBU-LBPRGKRZSA-N 1 0 345.237 3.508 20 5 EHBDRO COc1cccc([C@H](CNc2ccc(Cl)cc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301245063 1123740311 /nfs/dbraw/zinc/74/03/11/1123740311.db2.gz ZRKLYZZASFFNQU-KRWDZBQOSA-N 1 0 349.818 3.972 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301827772 1129142341 /nfs/dbraw/zinc/14/23/41/1129142341.db2.gz FUTNLCPLXOIZSC-RDJZCZTQSA-N 1 0 333.338 3.730 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(F)c(F)c2)c(Cl)c1 ZINC000615727108 1123864834 /nfs/dbraw/zinc/86/48/34/1123864834.db2.gz PWVSLSUEMLCXKV-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO COCCOc1cccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000163007885 1125020816 /nfs/dbraw/zinc/02/08/16/1125020816.db2.gz DTCWBNVWFBVBQQ-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000181840967 1125058068 /nfs/dbraw/zinc/05/80/68/1125058068.db2.gz IKSPYHAZTKOJRO-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](Nc1cnn(-c3cc[nH+]cc3)c1)CCC2 ZINC000618574529 1125121134 /nfs/dbraw/zinc/12/11/34/1125121134.db2.gz AREWSXJIDARTBG-SFHVURJKSA-N 1 0 335.367 3.665 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000301841605 1129185230 /nfs/dbraw/zinc/18/52/30/1129185230.db2.gz BUDGSUCNCMSPQZ-UHFFFAOYSA-N 1 0 340.427 3.943 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@@H]1C1CC1 ZINC000543242503 1129366560 /nfs/dbraw/zinc/36/65/60/1129366560.db2.gz QWYHRVXJECBNQF-RTBURBONSA-N 1 0 342.395 3.902 20 5 EHBDRO CSc1ccc([C@@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338832540 1129378473 /nfs/dbraw/zinc/37/84/73/1129378473.db2.gz MZTLJMAYPDFKDG-MRXNPFEDSA-N 1 0 346.456 3.735 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000766215007 1131371028 /nfs/dbraw/zinc/37/10/28/1131371028.db2.gz AFXYPJWSJOTAIX-CYBMUJFWSA-N 1 0 345.374 3.549 20 5 EHBDRO CSc1ccc([C@@H](CNc2nc(C)ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338834597 1129397936 /nfs/dbraw/zinc/39/79/36/1129397936.db2.gz CKFZCHOMLOOADW-MRXNPFEDSA-N 1 0 346.456 3.735 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2cc(C)cc(C)c2)c([N+](=O)[O-])c1 ZINC001168722145 1129449684 /nfs/dbraw/zinc/44/96/84/1129449684.db2.gz CLODHVSCRHTEQJ-HNNXBMFYSA-N 1 0 344.411 3.950 20 5 EHBDRO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000543447883 1129494478 /nfs/dbraw/zinc/49/44/78/1129494478.db2.gz FBRUKQFIZXNOIQ-SFHVURJKSA-N 1 0 328.412 3.676 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+](C3CC3)C2)c(C(F)(F)F)c1 ZINC000390049142 1129602103 /nfs/dbraw/zinc/60/21/03/1129602103.db2.gz FOUFXAYQYJZNRJ-JTQLQIEISA-N 1 0 329.322 3.510 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154970961 1129602370 /nfs/dbraw/zinc/60/23/70/1129602370.db2.gz IINMUZQPCFBYAV-ACJLOTCBSA-N 1 0 331.391 3.687 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922680883 1129621891 /nfs/dbraw/zinc/62/18/91/1129621891.db2.gz ZICBUZAPNBDVJD-BBZUXEQDSA-N 1 0 344.333 3.698 20 5 EHBDRO CCC[C@H]([NH2+]CCCN1CCCCCC1=O)c1cccc([N+](=O)[O-])c1 ZINC000155522751 1129645510 /nfs/dbraw/zinc/64/55/10/1129645510.db2.gz ZASDVCQPQKSOFX-SFHVURJKSA-N 1 0 347.459 3.818 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304730 1129660154 /nfs/dbraw/zinc/66/01/54/1129660154.db2.gz UJLAKCPTEFGDAT-LSDHHAIUSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1nccc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000391697465 1129679729 /nfs/dbraw/zinc/67/97/29/1129679729.db2.gz RJWMNPHTYZUBRU-INIZCTEOSA-N 1 0 328.416 3.793 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H](C)CO ZINC000157180408 1129751855 /nfs/dbraw/zinc/75/18/55/1129751855.db2.gz VDKPWUURKNCPEE-UPJWGTAASA-N 1 0 334.441 3.991 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032643 1129764517 /nfs/dbraw/zinc/76/45/17/1129764517.db2.gz SPQUPQLHOYTZMS-HIFRSBDPSA-N 1 0 331.441 3.979 20 5 EHBDRO Cc1cc(NC[C@@H](O)c2ccccc2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302135183 1129769509 /nfs/dbraw/zinc/76/95/09/1129769509.db2.gz DAFAAMSGLJSWBV-LJQANCHMSA-N 1 0 337.379 3.905 20 5 EHBDRO COc1ccccc1[C@@H](CNc1cccc(C)c1[N+](=O)[O-])[NH+](C)C ZINC000302480138 1129779280 /nfs/dbraw/zinc/77/92/80/1129779280.db2.gz GJQUNOHJAJSVBT-MRXNPFEDSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(-c3nc(-c4ccn5c[nH+]cc5c4)no3)cc2c1 ZINC000351076526 1129798276 /nfs/dbraw/zinc/79/82/76/1129798276.db2.gz IRIYXBNCCVRZTE-UHFFFAOYSA-N 1 0 347.290 3.706 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(-c3cccc(C[NH+]4CCCC4)c3)n2)o1 ZINC000351154394 1129801788 /nfs/dbraw/zinc/80/17/88/1129801788.db2.gz ZLDFWGHUKXTMPT-UHFFFAOYSA-N 1 0 340.339 3.501 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173451094 1130232351 /nfs/dbraw/zinc/23/23/51/1130232351.db2.gz XRVCDZBDJJACDB-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO CC[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246107120 1130344674 /nfs/dbraw/zinc/34/46/74/1130344674.db2.gz DJEJMQDPYMIZCT-NVXWUHKLSA-N 1 0 326.400 3.627 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107247 1130345590 /nfs/dbraw/zinc/34/55/90/1130345590.db2.gz DOGKNZKQZLWAKG-XJKCOSOUSA-N 1 0 342.399 3.798 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000246198435 1130356001 /nfs/dbraw/zinc/35/60/01/1130356001.db2.gz AQECGINYVMOCIP-SJKOYZFVSA-N 1 0 334.803 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC000730454182 1130711323 /nfs/dbraw/zinc/71/13/23/1130711323.db2.gz IONRHSXAXOMGDC-ZDUSSCGKSA-N 1 0 340.358 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCCC3(CCCCC3)C2)c1 ZINC000732190678 1130892131 /nfs/dbraw/zinc/89/21/31/1130892131.db2.gz KEFBZBVKWQKYMR-UHFFFAOYSA-N 1 0 328.416 3.948 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000738221954 1131464129 /nfs/dbraw/zinc/46/41/29/1131464129.db2.gz QFUGDAQOGSULIR-OAHLLOKOSA-N 1 0 334.445 3.510 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237611 1131465510 /nfs/dbraw/zinc/46/55/10/1131465510.db2.gz ANAAIQWZGNLNFJ-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO Cc1ccnc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172897610 1131880393 /nfs/dbraw/zinc/88/03/93/1131880393.db2.gz BCSMAHBHAXMJBV-YOEHRIQHSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOc1ccc(F)cc1)CC2 ZINC001172898993 1131882531 /nfs/dbraw/zinc/88/25/31/1131882531.db2.gz KGSXFKSWDSOYCD-KRWDZBQOSA-N 1 0 344.386 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(Cl)cn1)CC2 ZINC001172901231 1131883749 /nfs/dbraw/zinc/88/37/49/1131883749.db2.gz LNDLAOUGLLEYRJ-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172902369 1131884862 /nfs/dbraw/zinc/88/48/62/1131884862.db2.gz XTGBLMHVJCFABP-RHSMWYFYSA-N 1 0 325.412 3.896 20 5 EHBDRO [NH3+]Cc1nn([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc12 ZINC001172902125 1131885718 /nfs/dbraw/zinc/88/57/18/1131885718.db2.gz VQIHHMQTEXPCLE-OAHLLOKOSA-N 1 0 336.395 3.523 20 5 EHBDRO CCC1(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172907254 1131887578 /nfs/dbraw/zinc/88/75/78/1131887578.db2.gz RMEQWUJKHJWIGS-QGZVFWFLSA-N 1 0 332.444 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1cccc(F)c1)CC2 ZINC001172896072 1131901321 /nfs/dbraw/zinc/90/13/21/1131901321.db2.gz LHXJTRCDSHPWDR-GOSISDBHSA-N 1 0 328.387 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cc(Cl)ccn1)CC2 ZINC001172895223 1131901738 /nfs/dbraw/zinc/90/17/38/1131901738.db2.gz BBVJSRSJERSZPT-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](COCC3CC3)C1)CC2 ZINC001172919276 1131904153 /nfs/dbraw/zinc/90/41/53/1131904153.db2.gz FLKBJKLQVMIMJE-VQIMIIECSA-N 1 0 344.455 3.591 20 5 EHBDRO CC(=O)c1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912319 1131917469 /nfs/dbraw/zinc/91/74/69/1131917469.db2.gz NCLZXZRIBIKOES-LJQANCHMSA-N 1 0 338.407 3.835 20 5 EHBDRO O=C(CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172911571 1131918244 /nfs/dbraw/zinc/91/82/44/1131918244.db2.gz JWEWNUMZKKPOHI-GOSISDBHSA-N 1 0 338.407 3.705 20 5 EHBDRO CCCCC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007612 1131935649 /nfs/dbraw/zinc/93/56/49/1131935649.db2.gz URNIBNALTQHVBD-UHFFFAOYSA-N 1 0 327.375 3.622 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2(F)CCCCC2)c1F ZINC001173176848 1131992763 /nfs/dbraw/zinc/99/27/63/1131992763.db2.gz MQKZDNQVSDJDTB-LBPRGKRZSA-N 1 0 342.386 3.936 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173218012 1132002262 /nfs/dbraw/zinc/00/22/62/1132002262.db2.gz IOEQSHUQIGAWJM-FZKQIMNGSA-N 1 0 342.395 3.648 20 5 EHBDRO COc1cc(F)c(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173216379 1132002346 /nfs/dbraw/zinc/00/23/46/1132002346.db2.gz IYUBHZIPYCHNAE-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC001173217868 1132002502 /nfs/dbraw/zinc/00/25/02/1132002502.db2.gz MUDVZNQWNKYPJT-SCLBCKFNSA-N 1 0 348.830 3.893 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173219531 1132003141 /nfs/dbraw/zinc/00/31/41/1132003141.db2.gz CVYGZYRDUFNAMA-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ncccc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223627 1132005399 /nfs/dbraw/zinc/00/53/99/1132005399.db2.gz JGGABDJOCLZPRY-UGSOOPFHSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224435 1132005690 /nfs/dbraw/zinc/00/56/90/1132005690.db2.gz FTZBDHPIQANQQO-CQSZACIVSA-N 1 0 326.396 3.593 20 5 EHBDRO COc1ccc(C2([NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173222603 1132005925 /nfs/dbraw/zinc/00/59/25/1132005925.db2.gz XIVSNZXBRUZSER-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC001173226265 1132006737 /nfs/dbraw/zinc/00/67/37/1132006737.db2.gz WRXLIIRFLWUSLI-BZNIZROVSA-N 1 0 332.787 3.903 20 5 EHBDRO Cc1cccnc1C1(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231450 1132009241 /nfs/dbraw/zinc/00/92/41/1132009241.db2.gz ZJOPEFLJMANMHY-OAHLLOKOSA-N 1 0 325.412 3.551 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1ccc(Cl)cc1 ZINC001173231571 1132009668 /nfs/dbraw/zinc/00/96/68/1132009668.db2.gz AUXOYWDLJZYAKW-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1C[C@@H]([NH3+])C2 ZINC001173235492 1132010034 /nfs/dbraw/zinc/01/00/34/1132010034.db2.gz UDUVRFHFIPPALM-HIFRSBDPSA-N 1 0 335.407 3.779 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC001173209516 1132012626 /nfs/dbraw/zinc/01/26/26/1132012626.db2.gz CODLRWXCVJHJKV-PXAZEXFGSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173212993 1132014241 /nfs/dbraw/zinc/01/42/41/1132014241.db2.gz FBNWQUPRDVACSR-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(OCC[N@H+]2Cc3ccccc3[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000744385196 1132085458 /nfs/dbraw/zinc/08/54/58/1132085458.db2.gz MXXGFTSPRNBWMS-CQSZACIVSA-N 1 0 342.395 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@H+](CCc2ccccc2)C2CC2)c1 ZINC000746023456 1132350762 /nfs/dbraw/zinc/35/07/62/1132350762.db2.gz VEOCYGMJQWNJRL-UHFFFAOYSA-N 1 0 336.395 3.609 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001168973473 1132624988 /nfs/dbraw/zinc/62/49/88/1132624988.db2.gz OTXCLGZFUDKAQY-JOYOIKCWSA-N 1 0 336.741 3.894 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168996537 1132626163 /nfs/dbraw/zinc/62/61/63/1132626163.db2.gz VQQPYZZNIBOFRD-CQDKDKBSSA-N 1 0 341.249 3.935 20 5 EHBDRO CCc1ccccc1-c1nc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cs1 ZINC001169006393 1132630193 /nfs/dbraw/zinc/63/01/93/1132630193.db2.gz HPBKZQHOBZSZBO-HIFRSBDPSA-N 1 0 345.468 3.908 20 5 EHBDRO CCCCCCOC(=O)CCCCC[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168987914 1132634602 /nfs/dbraw/zinc/63/46/02/1132634602.db2.gz LHDLSBGFXBEAND-DLBZAZTESA-N 1 0 342.480 3.705 20 5 EHBDRO CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169045714 1132642043 /nfs/dbraw/zinc/64/20/43/1132642043.db2.gz JTISPAKFDIDFTR-UKRRQHHQSA-N 1 0 330.350 3.973 20 5 EHBDRO COc1cc(C)c([N+](=O)[O-])cc1N[C@H]1CC(C)(C)C[C@](C)(C[NH3+])C1 ZINC001169147727 1132676641 /nfs/dbraw/zinc/67/66/41/1132676641.db2.gz UTIPMHMPHASZCU-SCLBCKFNSA-N 1 0 335.448 3.867 20 5 EHBDRO CC(C)C1(C)CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169508187 1132773268 /nfs/dbraw/zinc/77/32/68/1132773268.db2.gz WVMMSMVZOPXYQY-AWEZNQCLSA-N 1 0 333.432 3.680 20 5 EHBDRO CC[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC001169604454 1132793011 /nfs/dbraw/zinc/79/30/11/1132793011.db2.gz MJSRNRVGEMEJCU-AWEZNQCLSA-N 1 0 334.441 3.988 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ncc2cccc([N+](=O)[O-])c2n1 ZINC001169699083 1132826501 /nfs/dbraw/zinc/82/65/01/1132826501.db2.gz UTBCVKDFLDRIIU-HNNXBMFYSA-N 1 0 349.394 3.778 20 5 EHBDRO [NH3+]CCc1cn(-c2cc3ccccc3c([N+](=O)[O-])c2)c2cccnc12 ZINC001169710138 1132830680 /nfs/dbraw/zinc/83/06/80/1132830680.db2.gz ZDTYDXXLERNHTC-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086170 1132830710 /nfs/dbraw/zinc/83/07/10/1132830710.db2.gz DKGPWNTXQIPIIS-XLIONFOSSA-N 1 0 338.407 3.767 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccsc1 ZINC000804348461 1132972040 /nfs/dbraw/zinc/97/20/40/1132972040.db2.gz BRNPWYILBZFYEG-MRXNPFEDSA-N 1 0 334.445 3.734 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000767943607 1133074587 /nfs/dbraw/zinc/07/45/87/1133074587.db2.gz ZPZLAXRSWLCVHC-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)ccc1Cl ZINC000773700953 1133090752 /nfs/dbraw/zinc/09/07/52/1133090752.db2.gz LGFDFAWLESGVEF-UKRRQHHQSA-N 1 0 338.835 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000773699591 1133091171 /nfs/dbraw/zinc/09/11/71/1133091171.db2.gz IAJNUQAHLUBJJK-KGLIPLIRSA-N 1 0 338.835 3.887 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCNc2ccccc2)cc1[N+](=O)[O-] ZINC000768106420 1133095954 /nfs/dbraw/zinc/09/59/54/1133095954.db2.gz IWTWXBHHJRKPJJ-CQSZACIVSA-N 1 0 329.400 3.756 20 5 EHBDRO CCO[C@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001178326686 1133160105 /nfs/dbraw/zinc/16/01/05/1133160105.db2.gz OVZHWJVVZWEDRV-GJZGRUSLSA-N 1 0 326.824 3.728 20 5 EHBDRO C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386536 1133161283 /nfs/dbraw/zinc/16/12/83/1133161283.db2.gz BUNLLEYCIZJKPH-VQIMIIECSA-N 1 0 339.439 3.562 20 5 EHBDRO CC1(C)OCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001178754564 1133195592 /nfs/dbraw/zinc/19/55/92/1133195592.db2.gz QUIVCZRXCCDNJC-INIZCTEOSA-N 1 0 332.425 3.980 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC001179579054 1133260877 /nfs/dbraw/zinc/26/08/77/1133260877.db2.gz IDVDBVLOZKGBLX-SUMWQHHRSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccnn1-c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC001179685032 1133269725 /nfs/dbraw/zinc/26/97/25/1133269725.db2.gz AOTXRMUVVSZAKQ-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO CCCC[N@H+](CCOC)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001180266759 1133353242 /nfs/dbraw/zinc/35/32/42/1133353242.db2.gz CTQAGYIBGNJFMR-UHFFFAOYSA-N 1 0 334.338 3.862 20 5 EHBDRO Cc1c(CN(CC[NH+](C)C)Cc2ccsc2)cccc1[N+](=O)[O-] ZINC001182262730 1133611816 /nfs/dbraw/zinc/61/18/16/1133611816.db2.gz YUWOPEKOWYYFIK-UHFFFAOYSA-N 1 0 333.457 3.529 20 5 EHBDRO C[NH+](C)C[C@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000772020510 1133634523 /nfs/dbraw/zinc/63/45/23/1133634523.db2.gz CKJZEPRYUIFHJA-SNVBAGLBSA-N 1 0 332.231 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC[C@@H]3C[C@H]3C3CC3)CC2)cc1 ZINC001183824118 1133866764 /nfs/dbraw/zinc/86/67/64/1133866764.db2.gz YSEZTEASCNYPLF-BEFAXECRSA-N 1 0 329.444 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCc1ccc(F)c(F)c1 ZINC000786819043 1133911226 /nfs/dbraw/zinc/91/12/26/1133911226.db2.gz NNKAORHVGSPHEH-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO Cc1cc(N2CCC[N@H+](Cc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC001184681112 1133981227 /nfs/dbraw/zinc/98/12/27/1133981227.db2.gz JYWJEDDFYOGVHI-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774909431 1134117110 /nfs/dbraw/zinc/11/71/10/1134117110.db2.gz PZNCGOMEIYOVGD-SFHVURJKSA-N 1 0 341.367 3.667 20 5 EHBDRO C[C@H]([NH2+]CCCc1c[nH]c2ccccc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788594465 1134148747 /nfs/dbraw/zinc/14/87/47/1134148747.db2.gz MULLPGJXRVEBKJ-ZDUSSCGKSA-N 1 0 338.411 3.942 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694565 1134163676 /nfs/dbraw/zinc/16/36/76/1134163676.db2.gz WATSOADGMNQKOA-ZIAGYGMSSA-N 1 0 325.412 3.633 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1COCc2cccc(Cl)c21 ZINC000788795989 1134170290 /nfs/dbraw/zinc/17/02/90/1134170290.db2.gz CRXUHWJXIAOVQB-OAHLLOKOSA-N 1 0 332.787 3.652 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788777869 1134173837 /nfs/dbraw/zinc/17/38/37/1134173837.db2.gz QHPMSYYJDMCITF-HIFRSBDPSA-N 1 0 333.432 3.710 20 5 EHBDRO C[C@H]([NH2+]CCC1Cc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788782454 1134174885 /nfs/dbraw/zinc/17/48/85/1134174885.db2.gz JNEDYRTZRRPBJI-ZDUSSCGKSA-N 1 0 325.412 3.633 20 5 EHBDRO CC[C@@H]1C[N@H+](CC)CCN1c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001186440828 1134213121 /nfs/dbraw/zinc/21/31/21/1134213121.db2.gz GKBXHFFZYMOGNK-GFCCVEGCSA-N 1 0 331.338 3.534 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)CCCC1 ZINC000789389974 1134261284 /nfs/dbraw/zinc/26/12/84/1134261284.db2.gz WRVAJZWOFUYMOI-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000789361221 1134262806 /nfs/dbraw/zinc/26/28/06/1134262806.db2.gz GBILQVVQVILIGF-RBUKOAKNSA-N 1 0 328.412 3.932 20 5 EHBDRO Cn1nccc1[C@@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000790494800 1134425944 /nfs/dbraw/zinc/42/59/44/1134425944.db2.gz HJECLEMEGDFZPL-OCCSQVGLSA-N 1 0 348.834 3.798 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604449 1134581727 /nfs/dbraw/zinc/58/17/27/1134581727.db2.gz JPRXSFICEPHISE-XLIONFOSSA-N 1 0 340.423 3.735 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000775387116 1134697816 /nfs/dbraw/zinc/69/78/16/1134697816.db2.gz WYBUIKIVMRGEHD-VMDGZTHMSA-N 1 0 326.396 3.541 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC001170296649 1134737277 /nfs/dbraw/zinc/73/72/77/1134737277.db2.gz HGUAWNMMNUQCKF-INIZCTEOSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2cccc(O)c2)c([N+](=O)[O-])c1 ZINC001170296252 1134737430 /nfs/dbraw/zinc/73/74/30/1134737430.db2.gz FWDPGYIUNVKZJN-QWHCGFSZSA-N 1 0 330.384 3.591 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCOc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170295670 1134737548 /nfs/dbraw/zinc/73/75/48/1134737548.db2.gz DJWGDHRSANTRRX-OAHLLOKOSA-N 1 0 344.411 3.511 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170298172 1134737974 /nfs/dbraw/zinc/73/79/74/1134737974.db2.gz HMWGTEPJRYHWCX-OAHLLOKOSA-N 1 0 328.412 3.675 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(F)cc2F)c([N+](=O)[O-])c1 ZINC001170299285 1134738414 /nfs/dbraw/zinc/73/84/14/1134738414.db2.gz UVLGQGZFZLNONE-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170313837 1134745795 /nfs/dbraw/zinc/74/57/95/1134745795.db2.gz RZCRPNDLGYMNMS-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170313508 1134745972 /nfs/dbraw/zinc/74/59/72/1134745972.db2.gz NOPPKRMZLZERTA-ZDUSSCGKSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@@H](C)n2ccc3cccc(C[NH3+])c32)c([N+](=O)[O-])c1 ZINC001170319646 1134746585 /nfs/dbraw/zinc/74/65/85/1134746585.db2.gz XVPCDLQWHHHWAG-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170329833 1134749510 /nfs/dbraw/zinc/74/95/10/1134749510.db2.gz VLHBXYQHMYVCNF-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C2CCC2)C2CCOCC2)c([N+](=O)[O-])c1 ZINC001170355519 1134754011 /nfs/dbraw/zinc/75/40/11/1134754011.db2.gz IBVVXTUZBBSREM-CQSZACIVSA-N 1 0 348.443 3.568 20 5 EHBDRO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204365 1134815211 /nfs/dbraw/zinc/81/52/11/1134815211.db2.gz SQTXHELUKBAAOM-HOCLYGCPSA-N 1 0 326.824 3.884 20 5 EHBDRO CCC[C@@]1(C)CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259244 1134826933 /nfs/dbraw/zinc/82/69/33/1134826933.db2.gz UKFCWSXVAIDMSB-SFHVURJKSA-N 1 0 333.432 3.744 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001192200419 1134978762 /nfs/dbraw/zinc/97/87/62/1134978762.db2.gz RKNIRCUMWPCLJL-HNNXBMFYSA-N 1 0 333.432 3.682 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804386455 1135052783 /nfs/dbraw/zinc/05/27/83/1135052783.db2.gz CHORWQKFYOVTMZ-CQSZACIVSA-N 1 0 348.359 3.591 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C1(CC)CC ZINC001193663286 1135169114 /nfs/dbraw/zinc/16/91/14/1135169114.db2.gz RMMREZWMSDCPOK-DLBZAZTESA-N 1 0 336.432 3.547 20 5 EHBDRO CC1(C)C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC001193818817 1135188406 /nfs/dbraw/zinc/18/84/06/1135188406.db2.gz JNPWWOJEOTXKPR-UWVAXJGDSA-N 1 0 344.455 3.807 20 5 EHBDRO CSc1ccccc1C[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001193977157 1135209468 /nfs/dbraw/zinc/20/94/68/1135209468.db2.gz OTHXZDJJTSFJIV-UHFFFAOYSA-N 1 0 332.425 3.828 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCCCCCCC1 ZINC001194400713 1135264173 /nfs/dbraw/zinc/26/41/73/1135264173.db2.gz MJKVSFOKCMORBM-UHFFFAOYSA-N 1 0 333.432 3.888 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@@H](C)C1 ZINC000775684039 1135505148 /nfs/dbraw/zinc/50/51/48/1135505148.db2.gz WFYALWGCWJDYEP-NTZNESFSSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCOC(C2CC2)(C2CC2)C1 ZINC001196450618 1135568142 /nfs/dbraw/zinc/56/81/42/1135568142.db2.gz FNKARSSWVUBFMT-AWEZNQCLSA-N 1 0 330.428 3.855 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613675 1135589253 /nfs/dbraw/zinc/58/92/53/1135589253.db2.gz KVZAUSKWLRDCPT-LRPXVYOUSA-N 1 0 331.416 3.600 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@H+]1CCCC[C@H]1C ZINC000807926239 1135591460 /nfs/dbraw/zinc/59/14/60/1135591460.db2.gz FYNXIYYKJSFAIB-CQSZACIVSA-N 1 0 333.432 3.864 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC1CC[NH+](C2CCCC2)CC1 ZINC000807990075 1135599936 /nfs/dbraw/zinc/59/99/36/1135599936.db2.gz UPCMRDWWSGEGLE-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@H](C4CC4)C3)c2)c1 ZINC000808230092 1135633271 /nfs/dbraw/zinc/63/32/71/1135633271.db2.gz GWRPIHXARIERKT-INIZCTEOSA-N 1 0 326.400 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CC[C@H](O)c2ccccc2)C2CC2)cc1 ZINC000808741825 1135734465 /nfs/dbraw/zinc/73/44/65/1135734465.db2.gz QGAHWVXDGVMNBI-IBGZPJMESA-N 1 0 326.396 3.683 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921397 1135751075 /nfs/dbraw/zinc/75/10/75/1135751075.db2.gz SGZUWGYNFUVWLU-CQSZACIVSA-N 1 0 331.441 3.814 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809689163 1135872040 /nfs/dbraw/zinc/87/20/40/1135872040.db2.gz WBORULAPNJYXGD-UHFFFAOYSA-N 1 0 349.774 3.831 20 5 EHBDRO Cc1ccc([C@@H](O)[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701711 1135874271 /nfs/dbraw/zinc/87/42/71/1135874271.db2.gz JCOUALUGGMOFFB-SJCJKPOMSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000810093373 1135920706 /nfs/dbraw/zinc/92/07/06/1135920706.db2.gz NHOHCOODRRVCHO-HZPDHXFCSA-N 1 0 336.819 3.782 20 5 EHBDRO C[C@H](C1CC1)[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271953 1136124366 /nfs/dbraw/zinc/12/43/66/1136124366.db2.gz PIGGULWUPYBOBQ-FOIQADDNSA-N 1 0 340.423 3.929 20 5 EHBDRO CC(C)[C@@H]1c2ccccc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276667 1136130923 /nfs/dbraw/zinc/13/09/23/1136130923.db2.gz IRXVKSUNGNNAQF-VQTJNVASSA-N 1 0 340.423 3.884 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000850424806 1136256573 /nfs/dbraw/zinc/25/65/73/1136256573.db2.gz HMQWRFRQCMUZLW-DYVFJYSZSA-N 1 0 346.431 3.565 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc([C@@H](C)O)cc1 ZINC000850426981 1136256821 /nfs/dbraw/zinc/25/68/21/1136256821.db2.gz JHUHGMUYAYWTPT-QWHCGFSZSA-N 1 0 330.384 3.508 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847512 1136259898 /nfs/dbraw/zinc/25/98/98/1136259898.db2.gz DSJZYOMGWITDER-SCLBCKFNSA-N 1 0 332.375 3.678 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000850476935 1136267099 /nfs/dbraw/zinc/26/70/99/1136267099.db2.gz OZFINOVOVYHIGZ-COLVAYQJSA-N 1 0 330.787 3.959 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000776591061 1136450973 /nfs/dbraw/zinc/45/09/73/1136450973.db2.gz GIIUWOLGLOPWRV-ZNOIYHFQSA-N 1 0 344.386 3.850 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589716 1136453018 /nfs/dbraw/zinc/45/30/18/1136453018.db2.gz VUPNDISZUILLIL-XOKHGSTOSA-N 1 0 330.384 3.694 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589714 1136453093 /nfs/dbraw/zinc/45/30/93/1136453093.db2.gz VUPNDISZUILLIL-KBRIMQKVSA-N 1 0 330.384 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3cccc(F)c3)CC2)cc1 ZINC000776593614 1136454133 /nfs/dbraw/zinc/45/41/33/1136454133.db2.gz YRWYPEIJGNOSGK-LJQANCHMSA-N 1 0 344.386 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+](Cc2ccccc2F)CC2CC2)cc1 ZINC000852564659 1136467070 /nfs/dbraw/zinc/46/70/70/1136467070.db2.gz QKYAILTVSXPKSQ-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])c(F)c3)CCC2)c1 ZINC000852693964 1136478730 /nfs/dbraw/zinc/47/87/30/1136478730.db2.gz MRPXRQKPJXOUTB-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]([C@H]2CCC[NH2+]C2)C1 ZINC000853016246 1136498812 /nfs/dbraw/zinc/49/88/12/1136498812.db2.gz UURTZDKTQLZAQS-UONOGXRCSA-N 1 0 339.386 3.748 20 5 EHBDRO C[C@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC[N@@H+](C2CCC2)C1 ZINC000853644266 1136552391 /nfs/dbraw/zinc/55/23/91/1136552391.db2.gz IEOTXLLPMLHBEH-GFCCVEGCSA-N 1 0 339.386 3.843 20 5 EHBDRO C[C@@H]([NH2+]C1(Cc2ccccc2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815606880 1136622461 /nfs/dbraw/zinc/62/24/61/1136622461.db2.gz JOJNSYYUSPZSBL-CQSZACIVSA-N 1 0 325.412 3.993 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)c1cccc(CC[NH+](C)C)c1 ZINC001135313054 1136660293 /nfs/dbraw/zinc/66/02/93/1136660293.db2.gz WZIPYBZTLOLNTO-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO C[C@H](C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000780764112 1136958788 /nfs/dbraw/zinc/95/87/88/1136958788.db2.gz IXJTXUKPYYMXTB-CZUORRHYSA-N 1 0 330.432 3.690 20 5 EHBDRO CC[N@H+](CCNC(=O)OC(C)(C)C)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000859529386 1137018402 /nfs/dbraw/zinc/01/84/02/1137018402.db2.gz RIAIKFQGGKTHGC-CYBMUJFWSA-N 1 0 337.420 3.502 20 5 EHBDRO Cc1ccccc1C1([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000844351477 1137214454 /nfs/dbraw/zinc/21/44/54/1137214454.db2.gz PDUMYXXZBHTIBO-SFHVURJKSA-N 1 0 326.396 3.606 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706722 1137239759 /nfs/dbraw/zinc/23/97/59/1137239759.db2.gz WABVWJFZHJLYHW-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccnc1F ZINC000794826174 1137264726 /nfs/dbraw/zinc/26/47/26/1137264726.db2.gz AOKVVWRMXBWMDX-CYBMUJFWSA-N 1 0 335.404 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H]([NH+]3CCCCC3)C2)c(C(F)F)c1 ZINC000865525845 1137291754 /nfs/dbraw/zinc/29/17/54/1137291754.db2.gz HLWDJSMBVBCDJJ-CYBMUJFWSA-N 1 0 325.359 3.597 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567283 1137295620 /nfs/dbraw/zinc/29/56/20/1137295620.db2.gz HKFVZVIZGOGWSX-GFCCVEGCSA-N 1 0 327.375 3.701 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000865781511 1137311508 /nfs/dbraw/zinc/31/15/08/1137311508.db2.gz BMGAZKVCIYDWKQ-QWHCGFSZSA-N 1 0 344.333 3.838 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000866146738 1137331768 /nfs/dbraw/zinc/33/17/68/1137331768.db2.gz AAKLAGMLKJCHTL-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](CCCO)c1ccccc1 ZINC000866271745 1137341600 /nfs/dbraw/zinc/34/16/00/1137341600.db2.gz PHLAXYZRGZFYPI-RDTXWAMCSA-N 1 0 346.402 3.768 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](C)C[C@H](O)c1ccccc1 ZINC000866288084 1137342771 /nfs/dbraw/zinc/34/27/71/1137342771.db2.gz UCKIRUNZBFNGSQ-LPMFXHHGSA-N 1 0 346.402 3.767 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1 ZINC000866348114 1137348104 /nfs/dbraw/zinc/34/81/04/1137348104.db2.gz ZPZRNBNTWHUNBJ-SDDRHHMPSA-N 1 0 349.410 3.647 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000866400638 1137351894 /nfs/dbraw/zinc/35/18/94/1137351894.db2.gz FWCRADPDZVGZCI-IRWQIABSSA-N 1 0 344.386 3.785 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000866421155 1137353251 /nfs/dbraw/zinc/35/32/51/1137353251.db2.gz MQEKZGPAYWBGGE-AWEZNQCLSA-N 1 0 342.395 3.665 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540195 1137363167 /nfs/dbraw/zinc/36/31/67/1137363167.db2.gz KTLWTKFSBJFCAI-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO CC[C@H](C[C@@H](C)O)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635268 1137371560 /nfs/dbraw/zinc/37/15/60/1137371560.db2.gz OJXSGBHXYIOVLJ-LSBZLQRGSA-N 1 0 328.412 3.823 20 5 EHBDRO CC[C@H](C[C@H](C)O)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635269 1137371764 /nfs/dbraw/zinc/37/17/64/1137371764.db2.gz OJXSGBHXYIOVLJ-POZUXBRTSA-N 1 0 328.412 3.823 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1ccnc2c1cccc2[N+](=O)[O-] ZINC001171304341 1137406754 /nfs/dbraw/zinc/40/67/54/1137406754.db2.gz QRFAITHHVWBRDW-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872017253 1137564698 /nfs/dbraw/zinc/56/46/98/1137564698.db2.gz XROCXGTWDHKWFH-CZUORRHYSA-N 1 0 347.390 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1ccco1)N(C)C ZINC000872018792 1137564828 /nfs/dbraw/zinc/56/48/28/1137564828.db2.gz PPHUCPMLPOTHPX-DOMZBBRYSA-N 1 0 349.456 3.863 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCn1ccnc1C ZINC000872037403 1137566740 /nfs/dbraw/zinc/56/67/40/1137566740.db2.gz BIYTXWKRIFTKGV-ZDUSSCGKSA-N 1 0 348.472 3.953 20 5 EHBDRO C[C@H]([NH2+][C@H](CO)[C@@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872045532 1137567509 /nfs/dbraw/zinc/56/75/09/1137567509.db2.gz NXLXXVWJPRQEOX-HEHGZKQESA-N 1 0 332.375 3.549 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052592 1137568204 /nfs/dbraw/zinc/56/82/04/1137568204.db2.gz PJFCIJCSPRBKJE-FZKQIMNGSA-N 1 0 344.386 3.898 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872060527 1137568917 /nfs/dbraw/zinc/56/89/17/1137568917.db2.gz QNSLLYCXFQRXLY-STQMWFEESA-N 1 0 336.363 3.625 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064421 1137569140 /nfs/dbraw/zinc/56/91/40/1137569140.db2.gz GNWYGNZHBOYHNH-QWHCGFSZSA-N 1 0 334.395 3.558 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ncccc1C ZINC000872076212 1137570071 /nfs/dbraw/zinc/57/00/71/1137570071.db2.gz JOFLIFWDHVLCNT-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000872076606 1137570095 /nfs/dbraw/zinc/57/00/95/1137570095.db2.gz OCKAUYOBVUEJJG-FUDCBSFHSA-N 1 0 335.473 3.593 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086093 1137570403 /nfs/dbraw/zinc/57/04/03/1137570403.db2.gz ROGMRUUJTJJONV-DUVNUKRYSA-N 1 0 346.406 3.529 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000872244553 1137576309 /nfs/dbraw/zinc/57/63/09/1137576309.db2.gz NMCIECPKMHLUQI-SFHVURJKSA-N 1 0 344.411 3.595 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](OC4CCC4)CC3)nc2c1 ZINC000872281814 1137577765 /nfs/dbraw/zinc/57/77/65/1137577765.db2.gz WDVQLDAXZZJEJA-HNNXBMFYSA-N 1 0 345.399 3.660 20 5 EHBDRO Cc1c(C[NH2+]CCCc2nc3ccccc3n2C)cccc1[N+](=O)[O-] ZINC000873055820 1137589094 /nfs/dbraw/zinc/58/90/94/1137589094.db2.gz NVEXOTIFBRHQMM-UHFFFAOYSA-N 1 0 338.411 3.512 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000873108557 1137590362 /nfs/dbraw/zinc/59/03/62/1137590362.db2.gz NERXDWDSVKFKNS-UHFFFAOYSA-N 1 0 328.412 3.729 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2cc(F)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000873116213 1137590571 /nfs/dbraw/zinc/59/05/71/1137590571.db2.gz YINXKXNGZLCSGF-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO O=C([O-])C[NH+]1CCC([NH2+]Cc2c3ccccc3cc3ccccc32)CC1 ZINC000874048289 1137609833 /nfs/dbraw/zinc/60/98/33/1137609833.db2.gz OXJLTZSYEGVCGW-UHFFFAOYSA-N 1 0 348.446 3.632 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000874048327 1137609846 /nfs/dbraw/zinc/60/98/46/1137609846.db2.gz PNEKLSQOVXHYKC-HNNXBMFYSA-N 1 0 347.459 3.596 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc2ccccc21 ZINC000876905992 1137665095 /nfs/dbraw/zinc/66/50/95/1137665095.db2.gz OAJBXBYBVLMQCU-IUDNXUCKSA-N 1 0 336.395 3.999 20 5 EHBDRO CCOC(=O)N1CCC(C)(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000877131095 1137671092 /nfs/dbraw/zinc/67/10/92/1137671092.db2.gz URHZURPWGJZYQM-AWEZNQCLSA-N 1 0 349.431 3.504 20 5 EHBDRO Cc1ccnc(C2CC[NH+](Cc3c(C)ccc([N+](=O)[O-])c3C)CC2)n1 ZINC000877331458 1137674561 /nfs/dbraw/zinc/67/45/61/1137674561.db2.gz PFBNSKIOBRUONJ-UHFFFAOYSA-N 1 0 340.427 3.690 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827756 1137692436 /nfs/dbraw/zinc/69/24/36/1137692436.db2.gz OQNCLXKJNSNZEU-GIYNXVAASA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966241 1137697466 /nfs/dbraw/zinc/69/74/66/1137697466.db2.gz DXQYDBVYFMXNAO-STQMWFEESA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@H]3CCC4(CCC4)O3)CC2)cc1 ZINC000878148260 1137704446 /nfs/dbraw/zinc/70/44/46/1137704446.db2.gz FXGRXUUQUGJNBL-GOSISDBHSA-N 1 0 346.427 3.540 20 5 EHBDRO C[C@@H]1CCC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507749 1137718449 /nfs/dbraw/zinc/71/84/49/1137718449.db2.gz JPBFLDWDBDHSSH-BXKDBHETSA-N 1 0 336.779 3.576 20 5 EHBDRO CC[C@@H](C)[N@H+](CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878885155 1137730946 /nfs/dbraw/zinc/73/09/46/1137730946.db2.gz XYEURDQGVFLDIU-SNVBAGLBSA-N 1 0 338.795 3.919 20 5 EHBDRO COc1ccc(C2CC2)cc1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883265787 1137851480 /nfs/dbraw/zinc/85/14/80/1137851480.db2.gz LABCRDZVAZAEMR-GFCCVEGCSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H]([NH3+])c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000429560642 1137883962 /nfs/dbraw/zinc/88/39/62/1137883962.db2.gz RJYJTKZEQYTWJM-GFCCVEGCSA-N 1 0 327.384 3.531 20 5 EHBDRO Cc1nc(C)c([C@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000106876528 1137884830 /nfs/dbraw/zinc/88/48/30/1137884830.db2.gz FYLJRFXMKUTUMQ-LBPRGKRZSA-N 1 0 335.429 3.740 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000800175983 1137901077 /nfs/dbraw/zinc/90/10/77/1137901077.db2.gz UXZWBGIMDCPKPL-UHFFFAOYSA-N 1 0 348.321 3.502 20 5 EHBDRO CC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)COC1 ZINC000112711938 1137909462 /nfs/dbraw/zinc/90/94/62/1137909462.db2.gz MVBVSKOGQCVSTG-UHFFFAOYSA-N 1 0 336.775 3.634 20 5 EHBDRO C[NH+](C)C[C@H](NCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000282915560 1137952017 /nfs/dbraw/zinc/95/20/17/1137952017.db2.gz VKQITJVTLWLCER-KRWDZBQOSA-N 1 0 333.819 3.641 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000120911033 1137953498 /nfs/dbraw/zinc/95/34/98/1137953498.db2.gz HLIHLVNFQSVONP-AWEZNQCLSA-N 1 0 345.418 3.955 20 5 EHBDRO COCC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282917915 1137955698 /nfs/dbraw/zinc/95/56/98/1137955698.db2.gz XSXUDWDXCVXYPH-IUODEOHRSA-N 1 0 326.824 3.586 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777134 1137960790 /nfs/dbraw/zinc/96/07/90/1137960790.db2.gz BVODMWWGHIFQFK-MJGOQNOKSA-N 1 0 344.386 3.822 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000884718775 1137971206 /nfs/dbraw/zinc/97/12/06/1137971206.db2.gz PMCILSUZTPFXQS-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[N@H+](CCOCC1CC1)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000088600182 1138194859 /nfs/dbraw/zinc/19/48/59/1138194859.db2.gz GQENHKNIGFENPF-UHFFFAOYSA-N 1 0 337.419 3.805 20 5 EHBDRO C[C@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644280 1138239126 /nfs/dbraw/zinc/23/91/26/1138239126.db2.gz QVJALBYKUFALHM-LSDHHAIUSA-N 1 0 343.427 3.769 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000131347781 1138511567 /nfs/dbraw/zinc/51/15/67/1138511567.db2.gz VLKHPJUEGYATHL-HNNXBMFYSA-N 1 0 346.383 3.550 20 5 EHBDRO COC1CC[NH+](C2(CNc3ccc(C)cc3[N+](=O)[O-])CCCC2)CC1 ZINC000338287378 1138817557 /nfs/dbraw/zinc/81/75/57/1138817557.db2.gz OWNKQACWISRNBG-UHFFFAOYSA-N 1 0 347.459 3.739 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000174855301 1139446356 /nfs/dbraw/zinc/44/63/56/1139446356.db2.gz KKAYPOIVBPHCQI-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1c(CNc2ccc(OCC[NH+](C)C)c(F)c2)cccc1[N+](=O)[O-] ZINC001202769251 1139458353 /nfs/dbraw/zinc/45/83/53/1139458353.db2.gz STPSBIVBMWKLBA-UHFFFAOYSA-N 1 0 347.390 3.595 20 5 EHBDRO C[C@H](c1ccccn1)[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000177353515 1139615707 /nfs/dbraw/zinc/61/57/07/1139615707.db2.gz PZWKQYWUMLCTOO-CQSZACIVSA-N 1 0 327.384 3.594 20 5 EHBDRO C[C@@H](O)C[C@H]1CCC[N@@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102207 1139735096 /nfs/dbraw/zinc/73/50/96/1139735096.db2.gz VGSZZPLDRXVUBH-RHSMWYFYSA-N 1 0 337.419 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCOCC3)s2)cc1 ZINC000181029040 1139880407 /nfs/dbraw/zinc/88/04/07/1139880407.db2.gz IXPZHUWCLFVPMZ-CQSZACIVSA-N 1 0 332.425 3.982 20 5 EHBDRO CCCCNC(=O)C1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000182590408 1139981734 /nfs/dbraw/zinc/98/17/34/1139981734.db2.gz APLUHPKJACTXSL-HNNXBMFYSA-N 1 0 347.459 3.593 20 5 EHBDRO COc1cc(C[NH2+][C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000184317231 1140095889 /nfs/dbraw/zinc/09/58/89/1140095889.db2.gz YCQCJFIEYAIQKY-GOSISDBHSA-N 1 0 330.359 3.983 20 5 EHBDRO CSCCCCC[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000185166240 1140138668 /nfs/dbraw/zinc/13/86/68/1140138668.db2.gz DCJCTNIHASKJKG-UHFFFAOYSA-N 1 0 348.472 3.618 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000186617368 1140213268 /nfs/dbraw/zinc/21/32/68/1140213268.db2.gz OCXWBTMQYISGIV-CQSZACIVSA-N 1 0 328.412 3.981 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)cccc1[N+](=O)[O-] ZINC000186618036 1140213497 /nfs/dbraw/zinc/21/34/97/1140213497.db2.gz ZZZDBRBFGLDSDL-CQSZACIVSA-N 1 0 328.412 3.981 20 5 EHBDRO C[C@@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192460141 1140534606 /nfs/dbraw/zinc/53/46/06/1140534606.db2.gz BFEMBQSIUVIRLB-UKRRQHHQSA-N 1 0 346.456 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000192971831 1140557126 /nfs/dbraw/zinc/55/71/26/1140557126.db2.gz GMEYZHYOCAGJKJ-INIZCTEOSA-N 1 0 327.340 3.670 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000193347522 1140572567 /nfs/dbraw/zinc/57/25/67/1140572567.db2.gz VYPYWLUPMUCEGL-IBGZPJMESA-N 1 0 342.395 3.853 20 5 EHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000266141163 1140645728 /nfs/dbraw/zinc/64/57/28/1140645728.db2.gz HHIXPLFBBRKPCE-JKSUJKDBSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(N2CCCCC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000267383650 1140784918 /nfs/dbraw/zinc/78/49/18/1140784918.db2.gz BCNQFDFVGGFRGA-HNNXBMFYSA-N 1 0 340.427 3.831 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000269038364 1141052221 /nfs/dbraw/zinc/05/22/21/1141052221.db2.gz SVCCKDVZLWGODC-BBRMVZONSA-N 1 0 341.411 3.684 20 5 EHBDRO Cc1ccc(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000269928376 1141158681 /nfs/dbraw/zinc/15/86/81/1141158681.db2.gz MMGFFCICUKZIMP-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000270020760 1141168685 /nfs/dbraw/zinc/16/86/85/1141168685.db2.gz OKTHIYRHTOCWCI-QILLFSRXSA-N 1 0 344.411 3.531 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@@H](O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000271427358 1141363397 /nfs/dbraw/zinc/36/33/97/1141363397.db2.gz BICFHHVWECBMQF-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCSCC1 ZINC000271455682 1141371454 /nfs/dbraw/zinc/37/14/54/1141371454.db2.gz JDCAGZAKOHBWOD-LBPRGKRZSA-N 1 0 326.487 3.951 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCOC2(CCSCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000271565772 1141398327 /nfs/dbraw/zinc/39/83/27/1141398327.db2.gz XQTXKYVTAMGYOC-ZFWWWQNUSA-N 1 0 336.457 3.690 20 5 EHBDRO CC(C)(CCCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000271585001 1141403117 /nfs/dbraw/zinc/40/31/17/1141403117.db2.gz VXSWDYIFUGRAOY-UHFFFAOYSA-N 1 0 332.400 3.743 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575523 1141522122 /nfs/dbraw/zinc/52/21/22/1141522122.db2.gz VOGCUFNGAHPJMZ-ZYHUDNBSSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCC[C@H](C)C1 ZINC000052160047 214120503 /nfs/dbraw/zinc/12/05/03/214120503.db2.gz KYXJZOWUMBHMGD-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO CC1(C)CN(Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000078516558 217066672 /nfs/dbraw/zinc/06/66/72/217066672.db2.gz AGMWKGHXXGGZPD-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO COc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000536672114 1032107030 /nfs/dbraw/zinc/10/70/30/1032107030.db2.gz ABRRICAXJBPNFX-PBHICJAKSA-N 1 0 326.396 3.981 20 5 EHBDRO CC(=O)c1ccc(N[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044419 1015178899 /nfs/dbraw/zinc/17/88/99/1015178899.db2.gz JUNXAXLRHUVHRM-XJKSGUPXSA-N 1 0 345.443 3.862 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339727274 1015608953 /nfs/dbraw/zinc/60/89/53/1015608953.db2.gz JVLDCZPXCUNRPF-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO O=C(CC[N@H+](CC1CCCCC1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC001167094441 1015731037 /nfs/dbraw/zinc/73/10/37/1015731037.db2.gz PXBCSGHJXRMJQI-UHFFFAOYSA-N 1 0 345.443 3.968 20 5 EHBDRO CCOc1cc(NC[C@H](c2ccc(F)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471252407 1016131137 /nfs/dbraw/zinc/13/11/37/1016131137.db2.gz YGVQEQWFLDLHFB-QGZVFWFLSA-N 1 0 347.390 3.847 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H](C)C[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700918 1016790168 /nfs/dbraw/zinc/79/01/68/1016790168.db2.gz RYZCYCWYQFVSDN-HOTGVXAUSA-N 1 0 349.475 3.909 20 5 EHBDRO CCOCOc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000782952646 1016833600 /nfs/dbraw/zinc/83/36/00/1016833600.db2.gz NEQFRLVSDYOGKV-AWEZNQCLSA-N 1 0 330.384 3.818 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)cn1 ZINC000349207506 1016925515 /nfs/dbraw/zinc/92/55/15/1016925515.db2.gz HUXNSPYEGDJWIM-ZDUSSCGKSA-N 1 0 335.404 3.789 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(C[NH+](C)C)cc1F ZINC000414493586 1016940628 /nfs/dbraw/zinc/94/06/28/1016940628.db2.gz CGDQVMGVMPYARG-CYBMUJFWSA-N 1 0 331.391 3.839 20 5 EHBDRO CC(C)[C@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414537034 1016963402 /nfs/dbraw/zinc/96/34/02/1016963402.db2.gz KNQIXLGXFHHONB-MRXNPFEDSA-N 1 0 338.835 3.885 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000175730249 1016977468 /nfs/dbraw/zinc/97/74/68/1016977468.db2.gz QUNXXGHUPDOSPT-GOSISDBHSA-N 1 0 341.411 3.925 20 5 EHBDRO CC(C)C[C@H]([NH3+])c1noc(-c2cc(C(F)(F)F)ccc2[N+](=O)[O-])n1 ZINC000414613076 1017027991 /nfs/dbraw/zinc/02/79/91/1017027991.db2.gz DOHDXWBKPVATLA-JTQLQIEISA-N 1 0 344.293 3.710 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2[NH2+]CC[C@@H]3CCCC[C@@H]23)n1 ZINC000904604343 1032153681 /nfs/dbraw/zinc/15/36/81/1032153681.db2.gz QEYCSSCYRNESIC-APHBMKBZSA-N 1 0 342.399 3.794 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1CCCC13CCOCC3)CCC2 ZINC000376986704 1017236355 /nfs/dbraw/zinc/23/63/55/1017236355.db2.gz TXKGEWDEJGRENK-ROUUACIJSA-N 1 0 330.428 3.911 20 5 EHBDRO COc1cccc(C[C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449145404 1032248468 /nfs/dbraw/zinc/24/84/68/1032248468.db2.gz XTEMKDGDWVHPNY-LSDHHAIUSA-N 1 0 328.412 3.755 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000449191286 1032286339 /nfs/dbraw/zinc/28/63/39/1032286339.db2.gz XAQASNRNJSQBCB-QAPCUYQASA-N 1 0 327.428 3.950 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1CCC2(CCOCC2)CC1 ZINC000449191951 1032287846 /nfs/dbraw/zinc/28/78/46/1032287846.db2.gz XPPONXVQDMSRQT-OAHLLOKOSA-N 1 0 332.444 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000538423816 1032350278 /nfs/dbraw/zinc/35/02/78/1032350278.db2.gz RBTYAUZQDUPLJL-HYXAFXHYSA-N 1 0 338.363 3.616 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000449269767 1032391074 /nfs/dbraw/zinc/39/10/74/1032391074.db2.gz OIODZXCGHNSEFK-WBMJQRKESA-N 1 0 330.359 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](c4cccc(F)c4)C3)nc2c1 ZINC000083170874 1032405640 /nfs/dbraw/zinc/40/56/40/1032405640.db2.gz AVFYGWYVPCSIGW-CYBMUJFWSA-N 1 0 341.342 3.865 20 5 EHBDRO C[C@H](Cc1ccoc1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000449287129 1032406844 /nfs/dbraw/zinc/40/68/44/1032406844.db2.gz JORHFYCYCNLDJC-SNVBAGLBSA-N 1 0 328.290 3.927 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000459691615 1032418412 /nfs/dbraw/zinc/41/84/12/1032418412.db2.gz GKOPOHHWGWPRAH-PBHICJAKSA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](CC(C)C)CC(C)(C)C ZINC001168163308 1032431279 /nfs/dbraw/zinc/43/12/79/1032431279.db2.gz KIORIIKUCUUSRM-UHFFFAOYSA-N 1 0 335.448 3.846 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000537203503 1032567069 /nfs/dbraw/zinc/56/70/69/1032567069.db2.gz COIVCIPXCDGSJC-MTIYJEKLSA-N 1 0 341.411 3.628 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@@H](CO)c1ccc(Cl)cc1 ZINC000449452048 1032570180 /nfs/dbraw/zinc/57/01/80/1032570180.db2.gz JRIZISPRDFTQIU-KRWDZBQOSA-N 1 0 334.803 3.722 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3(CF)CCOCC3)o2)c1 ZINC000449487587 1032642403 /nfs/dbraw/zinc/64/24/03/1032642403.db2.gz ZJAPVLSZJNWWCK-UHFFFAOYSA-N 1 0 348.374 3.711 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656698 1017107027 /nfs/dbraw/zinc/10/70/27/1017107027.db2.gz IZXJBBZCULKIES-ZIAGYGMSSA-N 1 0 345.468 3.883 20 5 EHBDRO CC(C)[C@@H](O)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000537383791 1032680968 /nfs/dbraw/zinc/68/09/68/1032680968.db2.gz NXQAHEKGGSTRBM-GOSISDBHSA-N 1 0 344.411 3.742 20 5 EHBDRO Cc1c(NC(=O)N[C@@H](CCC[NH3+])c2ccccc2)cccc1[N+](=O)[O-] ZINC000414703627 1017144767 /nfs/dbraw/zinc/14/47/67/1017144767.db2.gz MJNRSTHMWARMRQ-INIZCTEOSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]CC2=Cc3ccccc3OC2)cc1 ZINC000610271494 1017161202 /nfs/dbraw/zinc/16/12/02/1017161202.db2.gz PHXWGQRBTNJFMB-UHFFFAOYSA-N 1 0 338.407 3.983 20 5 EHBDRO CC[C@@H]1C[C@H](C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503961 1032686125 /nfs/dbraw/zinc/68/61/25/1032686125.db2.gz VGLPYUHZRPUFTF-HHXXYDBFSA-N 1 0 332.444 3.979 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H]1C ZINC000449507236 1032691551 /nfs/dbraw/zinc/69/15/51/1032691551.db2.gz STLDSXKLSMUSKY-SUMWQHHRSA-N 1 0 330.384 3.712 20 5 EHBDRO C[NH2+]Cc1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000414968542 1017359065 /nfs/dbraw/zinc/35/90/65/1017359065.db2.gz CYGYMHNEPGWZSA-UHFFFAOYSA-N 1 0 337.326 3.528 20 5 EHBDRO CC(C)c1ccc(CN2CCCC[C@H]2[C@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057907 1017470010 /nfs/dbraw/zinc/47/00/10/1017470010.db2.gz VFAHMMGSIDBCSU-WMZOPIPTSA-N 1 0 331.460 3.682 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CCCC[NH2+]C2)s1 ZINC000415071378 1017503191 /nfs/dbraw/zinc/50/31/91/1017503191.db2.gz SVHQJVOOHUUQGI-CYBMUJFWSA-N 1 0 331.441 3.555 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000377255646 1017545630 /nfs/dbraw/zinc/54/56/30/1017545630.db2.gz YKOKVIHNXNUBBM-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1nccn1C[C@H](C)C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000236652490 1017633634 /nfs/dbraw/zinc/63/36/34/1017633634.db2.gz PSZRXAYMKUVHHB-CQSZACIVSA-N 1 0 330.432 3.649 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000177471553 1017679314 /nfs/dbraw/zinc/67/93/14/1017679314.db2.gz QYEKMNVOBFFATJ-ZNMIVQPWSA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@@H]([NH2+]C1(c2ccc3c(c2)OCO3)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000537449878 1032739624 /nfs/dbraw/zinc/73/96/24/1032739624.db2.gz LNBIJIHTBCKHRY-GFCCVEGCSA-N 1 0 326.352 3.663 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc(N(C)C)c1 ZINC000468626804 1018504011 /nfs/dbraw/zinc/50/40/11/1018504011.db2.gz JGKCTNGDEYPBCL-XNTDXEJSSA-N 1 0 325.412 3.854 20 5 EHBDRO O=S1(=O)CC[C@H](C[NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000044862832 1018561820 /nfs/dbraw/zinc/56/18/20/1018561820.db2.gz DMDONXHSPCDIEF-OAHLLOKOSA-N 1 0 339.460 3.517 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000560847580 1018616223 /nfs/dbraw/zinc/61/62/23/1018616223.db2.gz NYDKDSIZEAASEK-HZMBPMFUSA-N 1 0 341.839 3.990 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC000579495026 1018841062 /nfs/dbraw/zinc/84/10/62/1018841062.db2.gz KKWHGSPJLZSUFI-CYBMUJFWSA-N 1 0 337.301 3.786 20 5 EHBDRO COc1ccc(C[NH2+]C2(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000449566851 1032819687 /nfs/dbraw/zinc/81/96/87/1032819687.db2.gz QHFXXMLHJDHESH-UHFFFAOYSA-N 1 0 330.359 3.607 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2(c3ccc(F)cc3)CCCC2)c1 ZINC000178868946 1019320439 /nfs/dbraw/zinc/32/04/39/1019320439.db2.gz IHGFQGBMKAATHT-SFHVURJKSA-N 1 0 344.386 3.826 20 5 EHBDRO CC(C)[C@@H]1[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CC=CC2 ZINC000592446792 1032833823 /nfs/dbraw/zinc/83/38/23/1032833823.db2.gz ZKGBVFXRNPFDMG-SFHVURJKSA-N 1 0 343.427 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2C2CC2)c2ccncc21 ZINC000433812022 1019638203 /nfs/dbraw/zinc/63/82/03/1019638203.db2.gz TXVFYFJMSZQQTE-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(OC[C@H]2CCCO2)CC1 ZINC000182836748 1019767328 /nfs/dbraw/zinc/76/73/28/1019767328.db2.gz KXJFCBPAKCLCPR-CRAIPNDOSA-N 1 0 348.443 3.624 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CCOCC2)ccc1Oc1ccc(F)cc1 ZINC000513647786 1019905271 /nfs/dbraw/zinc/90/52/71/1019905271.db2.gz KOWGLYYUHDEJDD-UHFFFAOYSA-N 1 0 346.358 3.795 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000120682690 1019945437 /nfs/dbraw/zinc/94/54/37/1019945437.db2.gz UHRNRKOKDMHKKV-XIKOKIGWSA-N 1 0 330.432 3.617 20 5 EHBDRO OC[C@@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)[C@H]1CCOC1 ZINC000280361986 1020322922 /nfs/dbraw/zinc/32/29/22/1020322922.db2.gz UBORJXVNZCJESA-RBUKOAKNSA-N 1 0 335.447 3.728 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCN2c3ccccc3C[C@@H]2C1 ZINC000580984596 1020334087 /nfs/dbraw/zinc/33/40/87/1020334087.db2.gz OFXFYGGHCMQXGU-FVXMCEBTSA-N 1 0 349.434 3.745 20 5 EHBDRO COC(=O)C[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H]1C ZINC000280660047 1020552375 /nfs/dbraw/zinc/55/23/75/1020552375.db2.gz BMAJPMZNGJLGHY-HOSILWTGSA-N 1 0 334.416 3.532 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000326000045 1020667859 /nfs/dbraw/zinc/66/78/59/1020667859.db2.gz FPJKKVDKPRFDTG-UHOSZYNNSA-N 1 0 332.444 3.809 20 5 EHBDRO CO[C@@H]([C@@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627036 1032923473 /nfs/dbraw/zinc/92/34/73/1032923473.db2.gz FOKDNRWCYAKQKN-XIKOKIGWSA-N 1 0 330.384 3.758 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CC[N@@H+](C4CCCC4)C3)c2c1 ZINC000413129973 1020729466 /nfs/dbraw/zinc/72/94/66/1020729466.db2.gz QCVDMNXULMWJCX-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000276379445 1021134575 /nfs/dbraw/zinc/13/45/75/1021134575.db2.gz GCFWRUNKCIWCDH-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516014 1021174862 /nfs/dbraw/zinc/17/48/62/1021174862.db2.gz VJHPYSSOWHHLOI-DZGCQCFKSA-N 1 0 331.441 3.979 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000602524597 1032959535 /nfs/dbraw/zinc/95/95/35/1032959535.db2.gz MYLZYHOSVQRQMS-SFHVURJKSA-N 1 0 340.427 3.700 20 5 EHBDRO C[C@H](CCC(C)(C)C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602559716 1032973222 /nfs/dbraw/zinc/97/32/22/1032973222.db2.gz ZXPWHCLCRZTGPI-CQSZACIVSA-N 1 0 334.464 3.763 20 5 EHBDRO CCS[C@H]1CCC[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567661 1032977599 /nfs/dbraw/zinc/97/75/99/1032977599.db2.gz KUHCFNCHZQNZDN-AAEUAGOBSA-N 1 0 335.429 3.890 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](CO)Cc1cccc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000467410713 1021456245 /nfs/dbraw/zinc/45/62/45/1021456245.db2.gz JUKADGWYVKSDLC-AZUAARDMSA-N 1 0 342.439 3.938 20 5 EHBDRO C[NH+](C)C1CCC(Oc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001226041659 1021495586 /nfs/dbraw/zinc/49/55/86/1021495586.db2.gz WFQNNUIFLTUDNT-UHFFFAOYSA-N 1 0 343.221 3.609 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CNCC[NH+]2CCCCCC2)o1 ZINC000518767834 1021520530 /nfs/dbraw/zinc/52/05/30/1021520530.db2.gz UAUGWNHKNLPOBT-UHFFFAOYSA-N 1 0 343.427 3.820 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000581698864 1021554279 /nfs/dbraw/zinc/55/42/79/1021554279.db2.gz ZPRHNDUMJXOJJV-SFHVURJKSA-N 1 0 344.411 3.742 20 5 EHBDRO COc1cc(C[N@@H+]2CC(C)(C)[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000516670757 1021638866 /nfs/dbraw/zinc/63/88/66/1021638866.db2.gz RHBUNVPQVBMEIP-UONOGXRCSA-N 1 0 334.416 3.623 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1 ZINC000519777738 1021682726 /nfs/dbraw/zinc/68/27/26/1021682726.db2.gz IFVGYFLFLBJPJD-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000506705388 1021782835 /nfs/dbraw/zinc/78/28/35/1021782835.db2.gz GHVBPMFZJAIISQ-CYBMUJFWSA-N 1 0 330.384 3.805 20 5 EHBDRO COCCC(C)(C)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602614557 1033008051 /nfs/dbraw/zinc/00/80/51/1033008051.db2.gz SSOOREYVSFETEP-UHFFFAOYSA-N 1 0 334.338 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC000602614904 1033010207 /nfs/dbraw/zinc/01/02/07/1033010207.db2.gz AVTPYTYVZCYRDS-IEBWSBKVSA-N 1 0 326.396 3.647 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CCC[N@@H+]2CCC[C@@H]2C1 ZINC000141537095 1033032732 /nfs/dbraw/zinc/03/27/32/1033032732.db2.gz PMYXDJUCNFOHLA-QGZVFWFLSA-N 1 0 345.446 3.698 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@]2(C1)CCCOC2 ZINC000602651341 1033041100 /nfs/dbraw/zinc/04/11/00/1033041100.db2.gz HEHDOBKMWJQISD-OAHLLOKOSA-N 1 0 344.333 3.616 20 5 EHBDRO CCSC1(C[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001203216739 1022255271 /nfs/dbraw/zinc/25/52/71/1022255271.db2.gz YECDCUGWONRUKV-UHFFFAOYSA-N 1 0 345.262 3.733 20 5 EHBDRO C[C@@H](CCC(F)(F)F)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000517618936 1022505384 /nfs/dbraw/zinc/50/53/84/1022505384.db2.gz CYRWJCSVTRWDPK-JTQLQIEISA-N 1 0 329.322 3.939 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2ccccc2)cc1[N+](=O)[O-] ZINC000152585474 1033059727 /nfs/dbraw/zinc/05/97/27/1033059727.db2.gz FWZJVONGYHPSHT-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC(C)[C@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000438489439 1022710201 /nfs/dbraw/zinc/71/02/01/1022710201.db2.gz JIQFGKRFHAJVPN-HNNXBMFYSA-N 1 0 329.400 3.770 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)CC1(O)CCCCCC1 ZINC000426201016 1023083755 /nfs/dbraw/zinc/08/37/55/1023083755.db2.gz LDDRLKWHVHDPIZ-UHFFFAOYSA-N 1 0 326.824 3.765 20 5 EHBDRO Cc1ccn2c(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cnc2c1 ZINC000507172256 1023174253 /nfs/dbraw/zinc/17/42/53/1023174253.db2.gz ABUGJJBMQIULMH-UHFFFAOYSA-N 1 0 338.411 3.962 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729730 1033118234 /nfs/dbraw/zinc/11/82/34/1033118234.db2.gz CAHQMEWWSUYBLG-HKUYNNGSSA-N 1 0 326.396 3.601 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](O)C[C@H]1c1ccccc1 ZINC000602729763 1033118342 /nfs/dbraw/zinc/11/83/42/1033118342.db2.gz CLMOGNKHTAMATJ-MOPGFXCFSA-N 1 0 326.396 3.601 20 5 EHBDRO C[C@](O)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000588467869 1023561682 /nfs/dbraw/zinc/56/16/82/1023561682.db2.gz VLGACNPOZVBGRN-POZKEBTKSA-N 1 0 346.814 3.759 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000610809797 1023695114 /nfs/dbraw/zinc/69/51/14/1023695114.db2.gz GDXAVGHLCZEZNZ-ZFWWWQNUSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(CN(Cc2ccccc2)CC2(CO)CC2)c(F)c1 ZINC000341959539 1023721062 /nfs/dbraw/zinc/72/10/62/1023721062.db2.gz AGWHNEBCWWNAJM-UHFFFAOYSA-N 1 0 344.386 3.509 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000610831081 1023781581 /nfs/dbraw/zinc/78/15/81/1023781581.db2.gz WYWCGVFOHRYAFX-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1ccc(Cl)cc1 ZINC000602767469 1033165517 /nfs/dbraw/zinc/16/55/17/1033165517.db2.gz QYESDBMQVRBSTR-HNNXBMFYSA-N 1 0 334.807 3.590 20 5 EHBDRO CC(C)c1ccc([C@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)C)cc1 ZINC000602797889 1033171808 /nfs/dbraw/zinc/17/18/08/1033171808.db2.gz CWLWQIZAILLDHG-QGZVFWFLSA-N 1 0 330.432 3.939 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247226 1024327239 /nfs/dbraw/zinc/32/72/39/1024327239.db2.gz PYUYPHVJQZWDDH-HNNXBMFYSA-N 1 0 330.432 3.827 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3)CC2)cc1 ZINC000280999104 1024510270 /nfs/dbraw/zinc/51/02/70/1024510270.db2.gz XMYQSSGKLKRKNU-UHFFFAOYSA-N 1 0 326.396 3.776 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000434953033 1024523722 /nfs/dbraw/zinc/52/37/22/1024523722.db2.gz YHGOYIGCBSGTRN-CYBMUJFWSA-N 1 0 338.795 3.731 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@H](c1ccccc1)N(C)C ZINC000472057780 1024524463 /nfs/dbraw/zinc/52/44/63/1024524463.db2.gz LSCDUXZFOYUGDB-DNVCBOLYSA-N 1 0 327.428 3.684 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434980407 1024535360 /nfs/dbraw/zinc/53/53/60/1024535360.db2.gz DPMBWIHZICMKBJ-LJQANCHMSA-N 1 0 348.406 3.942 20 5 EHBDRO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000342246462 1024544102 /nfs/dbraw/zinc/54/41/02/1024544102.db2.gz RNLIXXPZDCGKNL-QGZVFWFLSA-N 1 0 346.431 3.567 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)c1 ZINC000519197266 1024574467 /nfs/dbraw/zinc/57/44/67/1024574467.db2.gz AHFFVKJBPQCCOM-KRWDZBQOSA-N 1 0 328.416 3.772 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000427877714 1024841798 /nfs/dbraw/zinc/84/17/98/1024841798.db2.gz UFKSKLRBFPPHQM-KRWDZBQOSA-N 1 0 344.386 3.853 20 5 EHBDRO CC[C@H](c1ccccc1)[N@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000346664914 1025001176 /nfs/dbraw/zinc/00/11/76/1025001176.db2.gz IALFIVWFFQNPMC-QGZVFWFLSA-N 1 0 341.411 3.667 20 5 EHBDRO CC[C@H]([NH2+][C@@H](CCOC)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000346810074 1025133023 /nfs/dbraw/zinc/13/30/23/1025133023.db2.gz QOTOFKVAIZUWIM-YJBOKZPZSA-N 1 0 332.400 3.876 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCc2ccc(O)cc2)o1 ZINC000520960295 1025133424 /nfs/dbraw/zinc/13/34/24/1025133424.db2.gz ZKFKOKMLOGPRIY-UHFFFAOYSA-N 1 0 338.363 3.893 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948060 1025136057 /nfs/dbraw/zinc/13/60/57/1025136057.db2.gz QHTVJEGMJLQFPD-HOTGVXAUSA-N 1 0 333.476 3.928 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000024154233 1025328234 /nfs/dbraw/zinc/32/82/34/1025328234.db2.gz WIASUZMDGWNEHB-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@H](CNc1ccc(F)cc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000521402550 1025370882 /nfs/dbraw/zinc/37/08/82/1025370882.db2.gz POBDRATUUDVHJT-CYBMUJFWSA-N 1 0 329.375 3.593 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000521460597 1025397097 /nfs/dbraw/zinc/39/70/97/1025397097.db2.gz GJJMWARHYMZHKT-LJQANCHMSA-N 1 0 348.406 3.617 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000451162575 1025620849 /nfs/dbraw/zinc/62/08/49/1025620849.db2.gz NQKFLNHGVQTGSR-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425557014 1025725491 /nfs/dbraw/zinc/72/54/91/1025725491.db2.gz VNOWHFQQZBIYKM-RDTXWAMCSA-N 1 0 330.428 3.937 20 5 EHBDRO C[C@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000321384546 1025765850 /nfs/dbraw/zinc/76/58/50/1025765850.db2.gz NUAWVVOJGCGQRV-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H](c1ccccc1)[NH+](C)C ZINC000439130070 1025784918 /nfs/dbraw/zinc/78/49/18/1025784918.db2.gz RTBBPLUDRQJGBJ-ABAIWWIYSA-N 1 0 334.807 3.747 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(CCOCc3ccccc3)CC2)c(F)c1 ZINC000478200242 1026021624 /nfs/dbraw/zinc/02/16/24/1026021624.db2.gz SYHXZGKJVZQAAT-UHFFFAOYSA-N 1 0 344.386 3.963 20 5 EHBDRO CC(C)(C)c1ccc([C@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478429964 1026116859 /nfs/dbraw/zinc/11/68/59/1026116859.db2.gz QJGDQKWPQAIORI-QGZVFWFLSA-N 1 0 342.443 3.926 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000896950255 1026147844 /nfs/dbraw/zinc/14/78/44/1026147844.db2.gz AGEIBPUPMBFOIG-CABZTGNLSA-N 1 0 334.363 3.987 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000475158392 1026263186 /nfs/dbraw/zinc/26/31/86/1026263186.db2.gz MCLGCDHZXWWRAG-CVEARBPZSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1ccc(C[NH2+]CC2CCN(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000475283757 1026441090 /nfs/dbraw/zinc/44/10/90/1026441090.db2.gz YGBCEJAWECIRGH-UHFFFAOYSA-N 1 0 339.439 3.909 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000475289816 1026446549 /nfs/dbraw/zinc/44/65/49/1026446549.db2.gz DRFHGDJKNPVPDK-SFHVURJKSA-N 1 0 330.384 3.856 20 5 EHBDRO CCN(CC)[C@H](C)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335962 1026489385 /nfs/dbraw/zinc/48/93/85/1026489385.db2.gz NNDGMKYYZYGJOB-JFIYKMOQSA-N 1 0 333.476 3.626 20 5 EHBDRO Cc1cc(NC(=O)c2cccc(Cl)c2[N+](=O)[O-])ccc1C[NH+](C)C ZINC001142008121 1026491833 /nfs/dbraw/zinc/49/18/33/1026491833.db2.gz PQFOYXHBDFUHCN-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000452124256 1026492793 /nfs/dbraw/zinc/49/27/93/1026492793.db2.gz WFOCLNLHSFQEQU-CQSZACIVSA-N 1 0 345.365 3.528 20 5 EHBDRO COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000475346512 1026504641 /nfs/dbraw/zinc/50/46/41/1026504641.db2.gz HGMOUWRBTUSVLM-SFHVURJKSA-N 1 0 328.412 3.722 20 5 EHBDRO COc1cccc(N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000475394559 1026557916 /nfs/dbraw/zinc/55/79/16/1026557916.db2.gz WLWZULMALJSBFH-CVEARBPZSA-N 1 0 347.459 3.694 20 5 EHBDRO COc1cccc(N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000475394561 1026558514 /nfs/dbraw/zinc/55/85/14/1026558514.db2.gz WLWZULMALJSBFH-HOTGVXAUSA-N 1 0 347.459 3.694 20 5 EHBDRO COc1cccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158630474 1026751281 /nfs/dbraw/zinc/75/12/81/1026751281.db2.gz DKBZIFXMKVLZFH-GOSISDBHSA-N 1 0 326.396 3.714 20 5 EHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCN(c2ccccc2)C1 ZINC000531378679 1026848993 /nfs/dbraw/zinc/84/89/93/1026848993.db2.gz WWKMICAQNCWYCF-GOSISDBHSA-N 1 0 325.412 3.696 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135220220 1027042711 /nfs/dbraw/zinc/04/27/11/1027042711.db2.gz XOJBCGYXCVBRGI-IBGZPJMESA-N 1 0 344.386 3.740 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](Cc1ccccc1)CN(C)C ZINC000531684224 1027211560 /nfs/dbraw/zinc/21/15/60/1027211560.db2.gz FBWYMNPZZCHQKR-FUHWJXTLSA-N 1 0 341.455 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cc1Cl ZINC000783592738 1027528766 /nfs/dbraw/zinc/52/87/66/1027528766.db2.gz MUDQPIUZJZPLRQ-MRXNPFEDSA-N 1 0 345.830 3.612 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000501809715 1027540436 /nfs/dbraw/zinc/54/04/36/1027540436.db2.gz LORZGUITBMJYNN-QGZVFWFLSA-N 1 0 326.396 3.681 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CNC1CC([NH+]2CCCCC2)C1 ZINC000475576816 1027682327 /nfs/dbraw/zinc/68/23/27/1027682327.db2.gz XZEBNIUHORZWEV-GDNBJRDFSA-N 1 0 329.444 3.605 20 5 EHBDRO CC(C)[NH+](CCN(C)c1ccc2ncccc2c1[N+](=O)[O-])C(C)C ZINC000503275202 1027698052 /nfs/dbraw/zinc/69/80/52/1027698052.db2.gz MDRKYMXZSAPCSJ-UHFFFAOYSA-N 1 0 330.432 3.698 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN2CCCC[C@H]12 ZINC000513784978 1027706409 /nfs/dbraw/zinc/70/64/09/1027706409.db2.gz COOFMJXOOVPDLL-TXJVSEOTSA-N 1 0 343.471 3.522 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCOc2ccccc2C(F)(F)F)cs1 ZINC000237810317 1027764752 /nfs/dbraw/zinc/76/47/52/1027764752.db2.gz VLXIEZZRDNSGEF-UHFFFAOYSA-N 1 0 346.330 3.844 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@H]1C ZINC000444676937 1028145403 /nfs/dbraw/zinc/14/54/03/1028145403.db2.gz OUDUGSSSDXMYDO-DYVFJYSZSA-N 1 0 334.416 3.862 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cnn(C2CCCC2)c1 ZINC000502427457 1028213364 /nfs/dbraw/zinc/21/33/64/1028213364.db2.gz ILVZRYBJGFWPBD-AWEZNQCLSA-N 1 0 328.416 3.800 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCCCCC[NH+]1CCCC1 ZINC000455456396 1028217523 /nfs/dbraw/zinc/21/75/23/1028217523.db2.gz AYIRMDZLUNEQAC-UHFFFAOYSA-N 1 0 348.447 3.545 20 5 EHBDRO CCC[C@H]([NH2+]C1CCC2(CC1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161775152 1028289767 /nfs/dbraw/zinc/28/97/67/1028289767.db2.gz GKFOKLGPBFUVNS-KRWDZBQOSA-N 1 0 334.416 3.711 20 5 EHBDRO CC(C)(CC1CCCCCC1)[NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000444798162 1028292611 /nfs/dbraw/zinc/29/26/11/1028292611.db2.gz FYFFVPJLBRIHOL-UHFFFAOYSA-N 1 0 347.459 3.922 20 5 EHBDRO C[C@H]1C[C@H](CO)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358469 1028308786 /nfs/dbraw/zinc/30/87/86/1028308786.db2.gz BZTHAJCRWQMSRS-KBPBESRZSA-N 1 0 346.452 3.774 20 5 EHBDRO C[C@@H]1C[C@@H](CO)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000421358475 1028309522 /nfs/dbraw/zinc/30/95/22/1028309522.db2.gz BZTHAJCRWQMSRS-ZIAGYGMSSA-N 1 0 346.452 3.774 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](CCO)CC2)o1 ZINC000421391203 1028367347 /nfs/dbraw/zinc/36/73/47/1028367347.db2.gz AANQSGQXYLPFKY-OAHLLOKOSA-N 1 0 344.411 3.839 20 5 EHBDRO C[C@H](NC[C@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333857 1028369745 /nfs/dbraw/zinc/36/97/45/1028369745.db2.gz WEXDMJSEEMJPAI-FZMZJTMJSA-N 1 0 331.441 3.711 20 5 EHBDRO C[C@@H](NC[C@@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333856 1028371048 /nfs/dbraw/zinc/37/10/48/1028371048.db2.gz WEXDMJSEEMJPAI-BXUZGUMPSA-N 1 0 331.441 3.711 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000423487877 1028478023 /nfs/dbraw/zinc/47/80/23/1028478023.db2.gz YAIRJCYASZRPIT-SFHVURJKSA-N 1 0 325.412 3.998 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1CN2CCC[C@@H]2CO1 ZINC000729684800 1028553350 /nfs/dbraw/zinc/55/33/50/1028553350.db2.gz WWXALVNUZANNJU-UXHICEINSA-N 1 0 346.474 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC000523701852 1028555829 /nfs/dbraw/zinc/55/58/29/1028555829.db2.gz NCVLGUZIKZMKKG-LJQANCHMSA-N 1 0 328.387 3.984 20 5 EHBDRO Cc1cccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)c1 ZINC000237636862 1028659110 /nfs/dbraw/zinc/65/91/10/1028659110.db2.gz MGTHGHRXYPRBSC-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CC(C)(C)C ZINC000504894964 1029040186 /nfs/dbraw/zinc/04/01/86/1029040186.db2.gz PMBYNFDDXYRCPV-KGLIPLIRSA-N 1 0 340.489 3.852 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@H](C)N(C2CC2)C1 ZINC000504893861 1029040723 /nfs/dbraw/zinc/04/07/23/1029040723.db2.gz IQTMABBXSOMICH-ZNMIVQPWSA-N 1 0 349.500 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000179171917 1029065057 /nfs/dbraw/zinc/06/50/57/1029065057.db2.gz AYOKBNABWFIYSE-ACJLOTCBSA-N 1 0 349.862 3.697 20 5 EHBDRO CC[C@H]1CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000532976401 1029133938 /nfs/dbraw/zinc/13/39/38/1029133938.db2.gz IAZIZMINETVYKS-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(=O)Nc1ccc(Cl)cc1 ZINC000533088504 1029314702 /nfs/dbraw/zinc/31/47/02/1029314702.db2.gz ZTSZJXCSWSAZLL-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513819866 1029521475 /nfs/dbraw/zinc/52/14/75/1029521475.db2.gz FQBZTOVTQMRKOZ-QSOKESPWSA-N 1 0 332.444 3.853 20 5 EHBDRO CCC1CCC([N@H+](C)CC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533310033 1029592165 /nfs/dbraw/zinc/59/21/65/1029592165.db2.gz GJYFQBLBUSDKRC-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2nc3ccc(F)cc3s2)cc1 ZINC000583299354 1029595209 /nfs/dbraw/zinc/59/52/09/1029595209.db2.gz IDFVRIUWLOLSCP-UHFFFAOYSA-N 1 0 347.371 3.512 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000248266762 1029607126 /nfs/dbraw/zinc/60/71/26/1029607126.db2.gz SVXNFINRJBGNDA-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@H]1[C@H](c2ccccc2)C[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446847999 1029816998 /nfs/dbraw/zinc/81/69/98/1029816998.db2.gz CVZLEWACHFLIHZ-MJEQTWJJSA-N 1 0 336.395 3.753 20 5 EHBDRO Cc1cccnc1OC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000429704282 1029958937 /nfs/dbraw/zinc/95/89/37/1029958937.db2.gz VFXFPPPMRKEEGH-OAHLLOKOSA-N 1 0 341.411 3.903 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000555965741 1029994209 /nfs/dbraw/zinc/99/42/09/1029994209.db2.gz VISXFELVKXLLGY-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192898165 1030010973 /nfs/dbraw/zinc/01/09/73/1030010973.db2.gz KSSDLKKTMKGZMD-GOSISDBHSA-N 1 0 328.416 3.547 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000453288438 1030030678 /nfs/dbraw/zinc/03/06/78/1030030678.db2.gz KPDPUHBEYSKSHC-KRWDZBQOSA-N 1 0 325.412 3.935 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2ccco2)N2CCCC2)cccc1[N+](=O)[O-] ZINC000152277415 1030044048 /nfs/dbraw/zinc/04/40/48/1030044048.db2.gz CLTOJRGWZOFTBU-YJBOKZPZSA-N 1 0 343.427 3.984 20 5 EHBDRO C[C@@H](CCO)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000525708325 1030045238 /nfs/dbraw/zinc/04/52/38/1030045238.db2.gz HKWFVNIJUZZQJE-ZDUSSCGKSA-N 1 0 348.374 3.634 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnccc1C ZINC000453330195 1030065269 /nfs/dbraw/zinc/06/52/69/1030065269.db2.gz SAMHSPMQUQPGSG-HNNXBMFYSA-N 1 0 331.441 3.959 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453348333 1030137612 /nfs/dbraw/zinc/13/76/12/1030137612.db2.gz GBMVEUFJEINXHS-JCKWVBRZSA-N 1 0 327.384 3.561 20 5 EHBDRO C[NH+](C)C[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574589 1030169291 /nfs/dbraw/zinc/16/92/91/1030169291.db2.gz DPBUGARPYHYUIA-MSOLQXFVSA-N 1 0 343.402 3.614 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccccc1[N+](=O)[O-] ZINC000453392558 1030240033 /nfs/dbraw/zinc/24/00/33/1030240033.db2.gz ZUNQWMMEGQGPSZ-PMUMKWKESA-N 1 0 327.384 3.561 20 5 EHBDRO CC(C)(C)OC(=O)CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447526807 1030249102 /nfs/dbraw/zinc/24/91/02/1030249102.db2.gz DGIMMAUSTLZWKO-MRXNPFEDSA-N 1 0 334.416 3.684 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2ccccc2Cl)n1 ZINC000447544083 1030278152 /nfs/dbraw/zinc/27/81/52/1030278152.db2.gz NDRHFTCQQHBJPD-JKSUJKDBSA-N 1 0 348.834 3.761 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2ccccc2Cl)n1 ZINC000447544081 1030278762 /nfs/dbraw/zinc/27/87/62/1030278762.db2.gz NDRHFTCQQHBJPD-HOTGVXAUSA-N 1 0 348.834 3.761 20 5 EHBDRO CCc1ccc([C@@H](CO)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447575022 1030293669 /nfs/dbraw/zinc/29/36/69/1030293669.db2.gz PTEHBWRBHBSBPE-WOJBJXKFSA-N 1 0 340.423 3.858 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCS3)o2)c([N+](=O)[O-])c1 ZINC000532046151 1030316369 /nfs/dbraw/zinc/31/63/69/1030316369.db2.gz IYCJWSPQRABUFX-AWEZNQCLSA-N 1 0 348.424 3.849 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@@H]2C2CCCCC2)n1 ZINC000447586432 1030320483 /nfs/dbraw/zinc/32/04/83/1030320483.db2.gz NTUREXGMFUQJFW-YYIAUSFCSA-N 1 0 332.448 3.833 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCc1cccc(F)c1)C1CC1 ZINC000532200159 1030473342 /nfs/dbraw/zinc/47/33/42/1030473342.db2.gz CASVIJSKXRVZEU-GOSISDBHSA-N 1 0 328.387 3.887 20 5 EHBDRO COC[C@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000171051256 1030560344 /nfs/dbraw/zinc/56/03/44/1030560344.db2.gz LLNVSBNIZVDYSM-LLVKDONJSA-N 1 0 338.791 3.880 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691254 1030587705 /nfs/dbraw/zinc/58/77/05/1030587705.db2.gz GHNMILYFGPUNRQ-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO C[N+](C)(C)CCCOC1CC(c2ccc(Br)cc2)C1 ZINC001224620791 1030721336 /nfs/dbraw/zinc/72/13/36/1030721336.db2.gz BTHXIENKIDLNLC-UHFFFAOYSA-N 1 0 327.286 3.808 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623393 1030793541 /nfs/dbraw/zinc/79/35/41/1030793541.db2.gz AFUFJFGCNGIEKP-ABAIWWIYSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@]1(C)CCCO1 ZINC000340496921 1031294592 /nfs/dbraw/zinc/29/45/92/1031294592.db2.gz HFHRTTWFLCBQSQ-YGRLFVJLSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC[C@@H]2CCC(F)(F)C2)n1 ZINC000903340526 1031343706 /nfs/dbraw/zinc/34/37/06/1031343706.db2.gz JAMQYPDONNEASZ-MELADBBJSA-N 1 0 342.390 3.690 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026224421 1031389202 /nfs/dbraw/zinc/38/92/02/1031389202.db2.gz RYOWZQYWNKUWNM-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Br)c(F)c2)c1 ZINC000111158861 1031432170 /nfs/dbraw/zinc/43/21/70/1031432170.db2.gz ZCZLUCRHWOYIRD-UHFFFAOYSA-N 1 0 339.164 3.786 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2C[C@H](C)C[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000475741017 1031736495 /nfs/dbraw/zinc/73/64/95/1031736495.db2.gz WHJUIDMUBJQCLR-NFAWXSAZSA-N 1 0 333.432 3.598 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000543852931 1031797931 /nfs/dbraw/zinc/79/79/31/1031797931.db2.gz PRYCWEAWKJGSRW-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO Cc1cccc(NC(=O)C[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000584147721 1031813350 /nfs/dbraw/zinc/81/33/50/1031813350.db2.gz ZCPSCFFHVJPXBP-CQSZACIVSA-N 1 0 341.411 3.719 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)C1CC1 ZINC000926950863 1031848745 /nfs/dbraw/zinc/84/87/45/1031848745.db2.gz VPPZDCZLRBIDNC-BFHYXJOUSA-N 1 0 328.334 3.704 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000052907659 1032000547 /nfs/dbraw/zinc/00/05/47/1032000547.db2.gz APTCORVEGMEDKO-HNNXBMFYSA-N 1 0 341.411 3.559 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603054321 1033328917 /nfs/dbraw/zinc/32/89/17/1033328917.db2.gz IJXHOYSNPPILOL-GFCCVEGCSA-N 1 0 332.404 3.759 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000173485937 1033367129 /nfs/dbraw/zinc/36/71/29/1033367129.db2.gz TZRWEYUWGDVNRN-UKRRQHHQSA-N 1 0 334.445 3.508 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000898181544 1033383765 /nfs/dbraw/zinc/38/37/65/1033383765.db2.gz JQGMGRJTTMZJCV-UGSOOPFHSA-N 1 0 340.427 3.930 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](Cn1cccn1)c1ccccc1 ZINC000594494832 1033395871 /nfs/dbraw/zinc/39/58/71/1033395871.db2.gz INDCIBFLRFCGIP-RBUKOAKNSA-N 1 0 348.406 3.810 20 5 EHBDRO COc1cccc(C[C@@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594503617 1033403827 /nfs/dbraw/zinc/40/38/27/1033403827.db2.gz ZZMHXTOUZJNEDE-ACJLOTCBSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000594516720 1033422166 /nfs/dbraw/zinc/42/21/66/1033422166.db2.gz CWGJDTPVHJNWLK-SUMWQHHRSA-N 1 0 346.814 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCCN3CCCC[C@H]13)CCC2 ZINC000594518569 1033424662 /nfs/dbraw/zinc/42/46/62/1033424662.db2.gz IDLAHZAROJBWGZ-CEXWTWQISA-N 1 0 329.444 3.579 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594520870 1033427046 /nfs/dbraw/zinc/42/70/46/1033427046.db2.gz QQQJTYBNWIRYOJ-LXZKKBNFSA-N 1 0 336.432 3.992 20 5 EHBDRO CCOc1cccc(N(C)CCC[N@H+](C)Cc2ccco2)c1[N+](=O)[O-] ZINC000343806232 1033450914 /nfs/dbraw/zinc/45/09/14/1033450914.db2.gz KIZCGKUKOJAAQF-UHFFFAOYSA-N 1 0 347.415 3.545 20 5 EHBDRO COc1ccc(C2CC[NH+](Cc3ccc([N+](=O)[O-])cc3C)CC2)nc1 ZINC000593645677 1033574089 /nfs/dbraw/zinc/57/40/89/1033574089.db2.gz XUWSVDHJLGBWJB-UHFFFAOYSA-N 1 0 341.411 3.686 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cccc(F)c2OC(F)F)c1 ZINC000594940052 1033588134 /nfs/dbraw/zinc/58/81/34/1033588134.db2.gz YDRYYTHEFHKPTN-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[C@@H]1CCCC[C@@H]1O ZINC000595022312 1033613439 /nfs/dbraw/zinc/61/34/39/1033613439.db2.gz LAISMINQSWSRHQ-ZQIUZPCESA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595022752 1033613601 /nfs/dbraw/zinc/61/36/01/1033613601.db2.gz VHVQLVXHSXLFLA-SJCJKPOMSA-N 1 0 342.395 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1[C@@H]2Cc3ccccc3[C@H]12 ZINC000595023135 1033614364 /nfs/dbraw/zinc/61/43/64/1033614364.db2.gz SBXAPQBMJBFXPA-BJVKYNJZSA-N 1 0 338.407 3.840 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000594992903 1033624582 /nfs/dbraw/zinc/62/45/82/1033624582.db2.gz ZZDRSVPLMRXHRN-MOPGFXCFSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](c1cccs1)N(C)C ZINC000595002905 1033627221 /nfs/dbraw/zinc/62/72/21/1033627221.db2.gz BEKHWQSRNHYPAX-SWLSCSKDSA-N 1 0 349.456 3.618 20 5 EHBDRO COCc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595003424 1033628738 /nfs/dbraw/zinc/62/87/38/1033628738.db2.gz FXVJUYPBHPBJMA-ZDUSSCGKSA-N 1 0 330.384 3.601 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057269 1033635157 /nfs/dbraw/zinc/63/51/57/1033635157.db2.gz VYNJIYOEZZSXNR-ZFWWWQNUSA-N 1 0 335.448 3.517 20 5 EHBDRO Cn1cc(C[NH2+]CC[C@@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598999912 1033635760 /nfs/dbraw/zinc/63/57/60/1033635760.db2.gz JSAOXZMUQAUYOJ-OAHLLOKOSA-N 1 0 340.427 3.831 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cnc(C(F)(F)F)nc2)cccc1[N+](=O)[O-] ZINC000595061191 1033639812 /nfs/dbraw/zinc/63/98/12/1033639812.db2.gz QXONUFQJKOFWTJ-JTQLQIEISA-N 1 0 340.305 3.563 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCO[C@@H]2CC2(F)F)c2ccccc2)c1 ZINC000595067691 1033644843 /nfs/dbraw/zinc/64/48/43/1033644843.db2.gz GHOLBDHDTJUNRH-SJORKVTESA-N 1 0 348.349 3.698 20 5 EHBDRO C[C@@H](COc1c(F)cccc1F)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000595072437 1033646739 /nfs/dbraw/zinc/64/67/39/1033646739.db2.gz HUDDFAGYAHIWBF-RYUDHWBXSA-N 1 0 336.338 3.991 20 5 EHBDRO COC(=O)CC(C)(C)C[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000595025848 1033648855 /nfs/dbraw/zinc/64/88/55/1033648855.db2.gz IZUIWUKGYWHGPD-UONOGXRCSA-N 1 0 336.432 3.922 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599022519 1033652731 /nfs/dbraw/zinc/65/27/31/1033652731.db2.gz MPOQJVFCHFEZAJ-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599025129 1033654638 /nfs/dbraw/zinc/65/46/38/1033654638.db2.gz KHKSBOBTAYGLGF-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C)c1ncc(C)s1 ZINC000595034324 1033655794 /nfs/dbraw/zinc/65/57/94/1033655794.db2.gz VGFYUMZYGMYGBS-CMPLNLGQSA-N 1 0 335.429 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2c(Cl)oc3ccccc32)cc1 ZINC000761314160 1033661536 /nfs/dbraw/zinc/66/15/36/1033661536.db2.gz VARNGDGKKUWHEM-OAHLLOKOSA-N 1 0 346.770 3.818 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC(OC)C1 ZINC000595051982 1033666866 /nfs/dbraw/zinc/66/68/66/1033666866.db2.gz ZOPOMSAAKANVJP-SLTAFYQDSA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccn1 ZINC000595051504 1033667889 /nfs/dbraw/zinc/66/78/89/1033667889.db2.gz VMLWRDRBQBAQMM-KSSFIOAISA-N 1 0 325.412 3.704 20 5 EHBDRO CC[NH+]1CCC(CCNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599050361 1033677782 /nfs/dbraw/zinc/67/77/82/1033677782.db2.gz LWJLWAOCNADSNR-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000595079785 1033695683 /nfs/dbraw/zinc/69/56/83/1033695683.db2.gz YRKMOVKEHUQJGG-BXWFABGCSA-N 1 0 338.407 3.744 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599058118 1033698877 /nfs/dbraw/zinc/69/88/77/1033698877.db2.gz REFXUFPBAQFOMR-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)OC)c1 ZINC000599062863 1033702986 /nfs/dbraw/zinc/70/29/86/1033702986.db2.gz VXJYFXQKNTUBLP-LIRRHRJNSA-N 1 0 344.411 3.950 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1CCC(O)CC1 ZINC000595095723 1033703752 /nfs/dbraw/zinc/70/37/52/1033703752.db2.gz WWNZIIBOQIRNSV-SLTAFYQDSA-N 1 0 338.473 3.606 20 5 EHBDRO Cc1noc(C[N@@H+](CCc2ccc(F)cc2)CC(C)C)c1[N+](=O)[O-] ZINC000595297573 1033719902 /nfs/dbraw/zinc/71/99/02/1033719902.db2.gz WQLOKAOQTBZLEX-UHFFFAOYSA-N 1 0 335.379 3.731 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599094657 1033730880 /nfs/dbraw/zinc/73/08/80/1033730880.db2.gz XKEPDUOLVVCCGR-KZULUSFZSA-N 1 0 327.384 3.800 20 5 EHBDRO C[C@@H](COCC1CC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000593681368 1033749168 /nfs/dbraw/zinc/74/91/68/1033749168.db2.gz FVZYDYPVGNUAPU-LBPRGKRZSA-N 1 0 347.440 3.623 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1 ZINC000892415132 1033755385 /nfs/dbraw/zinc/75/53/85/1033755385.db2.gz BCKPKEHYFSJWJY-OAHLLOKOSA-N 1 0 330.384 3.940 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000593721513 1033847144 /nfs/dbraw/zinc/84/71/44/1033847144.db2.gz VSOSCFYQYKGURR-MLHJIOFPSA-N 1 0 340.427 3.729 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](CCCc3ccccc3)CC2)s1 ZINC000608779505 1033885492 /nfs/dbraw/zinc/88/54/92/1033885492.db2.gz XAAIRYGYDCBDBR-UHFFFAOYSA-N 1 0 345.468 3.801 20 5 EHBDRO CN1CCC[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000608836169 1033909170 /nfs/dbraw/zinc/90/91/70/1033909170.db2.gz UMUMHKLJLQHRLT-GFCCVEGCSA-N 1 0 349.818 3.692 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCCC12CCCCC2 ZINC000595603638 1033917808 /nfs/dbraw/zinc/91/78/08/1033917808.db2.gz ITQUHCPPMXDPAZ-MRXNPFEDSA-N 1 0 345.443 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3CCC(C4CCC4)CC3)o2)cc1 ZINC000595659148 1033940344 /nfs/dbraw/zinc/94/03/44/1033940344.db2.gz LEWJLYFTSOUVTQ-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841252 1033964665 /nfs/dbraw/zinc/96/46/65/1033964665.db2.gz ZRQVWDSMAGYQGP-GFCCVEGCSA-N 1 0 336.338 3.945 20 5 EHBDRO CCOc1ccccc1C[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603856623 1033980692 /nfs/dbraw/zinc/98/06/92/1033980692.db2.gz MUXDKOKLPJRKGM-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO COc1ccccc1[C@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040696 1033991226 /nfs/dbraw/zinc/99/12/26/1033991226.db2.gz KHHBTPGEDQCPMW-GOSISDBHSA-N 1 0 342.395 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc2c(ccnc2N2CCC([NH+]3CCCCC3)CC2)c1 ZINC000450261041 1034001908 /nfs/dbraw/zinc/00/19/08/1034001908.db2.gz LZBUIKIYVXUTMF-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1cc(N2CCC([C@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000612099214 1034047226 /nfs/dbraw/zinc/04/72/26/1034047226.db2.gz UJFFAOSUQJDSPQ-HNNXBMFYSA-N 1 0 341.411 3.704 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(O)CCC(C)CC2)cc1[N+](=O)[O-] ZINC000596095938 1034059896 /nfs/dbraw/zinc/05/98/96/1034059896.db2.gz RSILJEKPQGOTSO-FVRSWCFKSA-N 1 0 336.432 3.585 20 5 EHBDRO CCC[NH+]1CCC(CNc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450295074 1034071695 /nfs/dbraw/zinc/07/16/95/1034071695.db2.gz UTRIOYKKUOGZBA-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CCC(O)(CC)C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599673656 1034081086 /nfs/dbraw/zinc/08/10/86/1034081086.db2.gz SOJZJAPTJYMONA-UHFFFAOYSA-N 1 0 334.338 3.597 20 5 EHBDRO C[C@H]([NH2+]CCCN1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000325102144 1034153168 /nfs/dbraw/zinc/15/31/68/1034153168.db2.gz TVWBGKBJUPWSII-HNNXBMFYSA-N 1 0 325.412 3.698 20 5 EHBDRO CCc1cc(N2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc[nH+]1 ZINC000450362672 1034171938 /nfs/dbraw/zinc/17/19/38/1034171938.db2.gz RQXKBSWJYDPKPT-UHFFFAOYSA-N 1 0 327.384 3.600 20 5 EHBDRO Cc1cc(N2CCC(c3ccon3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000596528939 1034275821 /nfs/dbraw/zinc/27/58/21/1034275821.db2.gz OBABDXVJFMDOMY-UHFFFAOYSA-N 1 0 338.367 3.823 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000075837934 1034576038 /nfs/dbraw/zinc/57/60/38/1034576038.db2.gz OBWKOBGVEFIYNQ-XPKDYRNWSA-N 1 0 342.399 3.798 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CNc3ccccc3C2)cc1[N+](=O)[O-] ZINC000593319495 1034657806 /nfs/dbraw/zinc/65/78/06/1034657806.db2.gz LTJVFEFTKAISQI-CJNGLKHVSA-N 1 0 341.411 3.681 20 5 EHBDRO C[C@@H]1c2ccsc2CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411147586 1034791470 /nfs/dbraw/zinc/79/14/70/1034791470.db2.gz PLAMBMCJPROTFC-GFCCVEGCSA-N 1 0 345.424 3.604 20 5 EHBDRO C[C@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000612404325 1034894825 /nfs/dbraw/zinc/89/48/25/1034894825.db2.gz DOKKAPMHWBHEAB-CQSZACIVSA-N 1 0 342.443 3.863 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000411470478 1034898033 /nfs/dbraw/zinc/89/80/33/1034898033.db2.gz CERULVIPXHNFAQ-HUUCEWRRSA-N 1 0 341.411 3.605 20 5 EHBDRO Cc1c(F)cccc1NC(=O)CC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000411484152 1034899582 /nfs/dbraw/zinc/89/95/82/1034899582.db2.gz OOSZLAHEYFEIAL-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N(C)C2CC[NH+](CCC(F)(F)F)CC2)c1 ZINC000450952831 1034980175 /nfs/dbraw/zinc/98/01/75/1034980175.db2.gz VNFZFVVFQQDLKB-UHFFFAOYSA-N 1 0 345.365 3.756 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCc2ccccc21 ZINC000135954211 1035352150 /nfs/dbraw/zinc/35/21/50/1035352150.db2.gz UWZVURUFEWPVES-SCLBCKFNSA-N 1 0 339.395 3.589 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973788 1035578065 /nfs/dbraw/zinc/57/80/65/1035578065.db2.gz ICKBADDEYGPDSH-KPZWWZAWSA-N 1 0 348.374 3.608 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000122126219 1035592297 /nfs/dbraw/zinc/59/22/97/1035592297.db2.gz LOVOMKOMLCNGHY-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1cc2c(cc1F)CN([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000540837660 1035721724 /nfs/dbraw/zinc/72/17/24/1035721724.db2.gz NFDQJIJCQLEGQB-GFCCVEGCSA-N 1 0 330.359 3.862 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000414153272 1035801003 /nfs/dbraw/zinc/80/10/03/1035801003.db2.gz ZBLQSUIHUACVBM-NZSAHSFTSA-N 1 0 326.396 3.841 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1C[NH2+][C@H]1CCCc3sccc31)OCCO2 ZINC000613418307 1035819098 /nfs/dbraw/zinc/81/90/98/1035819098.db2.gz CUVGMQDFTXFGDH-ZDUSSCGKSA-N 1 0 346.408 3.595 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]2c2cccnc2)cc1 ZINC000588203882 1035821806 /nfs/dbraw/zinc/82/18/06/1035821806.db2.gz MQKPJKMNLNSHDR-GOSISDBHSA-N 1 0 327.384 3.596 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174126292 1035860228 /nfs/dbraw/zinc/86/02/28/1035860228.db2.gz HTXIGTXILASGFG-QGZVFWFLSA-N 1 0 347.462 3.944 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414170114 1035869742 /nfs/dbraw/zinc/86/97/42/1035869742.db2.gz BQRLWLJNMSYBOQ-STQMWFEESA-N 1 0 334.445 3.550 20 5 EHBDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000460347897 1035930482 /nfs/dbraw/zinc/93/04/82/1035930482.db2.gz DPGHDAVUPQMRLR-YOEHRIQHSA-N 1 0 333.432 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cc(F)c(F)c(F)c3)c2c1 ZINC000572037986 1035952510 /nfs/dbraw/zinc/95/25/10/1035952510.db2.gz QAHJXWXDIFMCON-UHFFFAOYSA-N 1 0 349.312 3.826 20 5 EHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccc2c(c1)OCCO2 ZINC000535068413 1035986722 /nfs/dbraw/zinc/98/67/22/1035986722.db2.gz MSYYFJOYLZZKQJ-XQRVVYSFSA-N 1 0 340.379 3.511 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000463951745 1035994245 /nfs/dbraw/zinc/99/42/45/1035994245.db2.gz BVQRSDNXQODSDR-LSDHHAIUSA-N 1 0 348.447 3.596 20 5 EHBDRO COC(=O)CCC1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000540907923 1036039610 /nfs/dbraw/zinc/03/96/10/1036039610.db2.gz IPJXYMNAQUDHDX-AWEZNQCLSA-N 1 0 334.416 3.629 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000582636348 1036100733 /nfs/dbraw/zinc/10/07/33/1036100733.db2.gz JHFDRTMZHKQOSI-YJBOKZPZSA-N 1 0 340.423 3.818 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)NCCC1=CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000056196794 1036139988 /nfs/dbraw/zinc/13/99/88/1036139988.db2.gz MWZQCSAKVFBDGL-CABCVRRESA-N 1 0 345.443 3.641 20 5 EHBDRO CCC(CC)[N@H+](CC)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000588977253 1036207038 /nfs/dbraw/zinc/20/70/38/1036207038.db2.gz FKYKSFNBPQIAMK-UHFFFAOYSA-N 1 0 327.812 3.697 20 5 EHBDRO CCOc1cc(C[N@H+](C[C@H](C)O)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000492787754 1036294428 /nfs/dbraw/zinc/29/44/28/1036294428.db2.gz GMOSIMRNLDNMLK-AWEZNQCLSA-N 1 0 336.432 3.509 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000589327540 1036348157 /nfs/dbraw/zinc/34/81/57/1036348157.db2.gz QZGOVYIUSRIUJO-AWEZNQCLSA-N 1 0 332.787 3.650 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000165264700 1036351280 /nfs/dbraw/zinc/35/12/80/1036351280.db2.gz YMWYAQLXUIJUPY-MRXNPFEDSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+][C@@H](CO)c1ccccc1 ZINC000130206490 1036354454 /nfs/dbraw/zinc/35/44/54/1036354454.db2.gz QVVRQNNWCZEGAY-QRQLOZEOSA-N 1 0 340.423 3.629 20 5 EHBDRO CCc1ccc(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000026223567 1036395085 /nfs/dbraw/zinc/39/50/85/1036395085.db2.gz ZMZOEBVGZYVCTQ-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC[C@H]2c2cccs2)c1 ZINC000589495339 1036436350 /nfs/dbraw/zinc/43/63/50/1036436350.db2.gz QBKWEDKSHSCMRY-HNNXBMFYSA-N 1 0 346.408 3.780 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC(O)(CC)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541549007 1036440914 /nfs/dbraw/zinc/44/09/14/1036440914.db2.gz KTSUDCVOBBQCPH-SFHVURJKSA-N 1 0 346.427 3.980 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000572804024 1036502430 /nfs/dbraw/zinc/50/24/30/1036502430.db2.gz MXCOGPZLTQRZQP-HOTGVXAUSA-N 1 0 336.819 3.782 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000310751885 1036901705 /nfs/dbraw/zinc/90/17/05/1036901705.db2.gz INFZEXCXLRFDRJ-VQIMIIECSA-N 1 0 339.439 3.656 20 5 EHBDRO Cc1nn(C[N@H+]2C[C@H](c3ccccc3C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537290 1037023106 /nfs/dbraw/zinc/02/31/06/1037023106.db2.gz IDKLLCCPWLDPFB-CZUORRHYSA-N 1 0 328.416 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCCC[C@@H]([NH+]3CCCC3)C2)cc1Cl ZINC000761506014 1037088953 /nfs/dbraw/zinc/08/89/53/1037088953.db2.gz LXKDISUAXSXZSO-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(F)cc2F)cc1Cl ZINC000761521077 1037098417 /nfs/dbraw/zinc/09/84/17/1037098417.db2.gz TXIBZBOMHQAQDX-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCOC1 ZINC000539710728 1037102731 /nfs/dbraw/zinc/10/27/31/1037102731.db2.gz YOJBYGHFQWNCDF-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)cc1 ZINC000237783858 1037177810 /nfs/dbraw/zinc/17/78/10/1037177810.db2.gz BHQLQNRPSGLSHO-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO Cc1c(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207311 1037218171 /nfs/dbraw/zinc/21/81/71/1037218171.db2.gz QEDOPMFMFPZUGM-GOSISDBHSA-N 1 0 345.487 3.991 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC(C)(C)O ZINC000539824498 1037227564 /nfs/dbraw/zinc/22/75/64/1037227564.db2.gz AFQADAHRPZHUSQ-UHFFFAOYSA-N 1 0 334.441 3.916 20 5 EHBDRO CCC[C@@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000539824620 1037227679 /nfs/dbraw/zinc/22/76/79/1037227679.db2.gz JBFXZQMYXOGVGJ-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO CO[C@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308451 1037242960 /nfs/dbraw/zinc/24/29/60/1037242960.db2.gz YPFXHIWGHXBHSG-RTBURBONSA-N 1 0 328.412 3.945 20 5 EHBDRO CC[C@@H](O)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850728 1037280296 /nfs/dbraw/zinc/28/02/96/1037280296.db2.gz OVBWTWHPUMFJCJ-KEEQEYLASA-N 1 0 340.423 3.881 20 5 EHBDRO C[N@H+](CCOCC1CC1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000539863382 1037292239 /nfs/dbraw/zinc/29/22/39/1037292239.db2.gz ZHBYNFRIAWPSBD-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO CC[C@H]([NH2+]Cc1cnc(OC)c(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000271843984 1037473593 /nfs/dbraw/zinc/47/35/93/1037473593.db2.gz ZYEZUJXMGLRINT-HNNXBMFYSA-N 1 0 335.791 3.893 20 5 EHBDRO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786891 1037532442 /nfs/dbraw/zinc/53/24/42/1037532442.db2.gz GTABYMUDLFIOSS-GLJUWKHASA-N 1 0 344.411 3.836 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCCC[C@@H]1C ZINC000045951464 1037582481 /nfs/dbraw/zinc/58/24/81/1037582481.db2.gz HVHXCBFHPXNIBE-HNNXBMFYSA-N 1 0 348.447 3.679 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](Cc2ccccc2)CN(C)C)cc1[N+](=O)[O-] ZINC000480877124 1037619359 /nfs/dbraw/zinc/61/93/59/1037619359.db2.gz KMWMXUFDXYZVLE-LPHOPBHVSA-N 1 0 341.455 3.727 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cncc(C)c1 ZINC000540153427 1037627282 /nfs/dbraw/zinc/62/72/82/1037627282.db2.gz KMOAKSZSLVRZCG-OAHLLOKOSA-N 1 0 331.441 3.959 20 5 EHBDRO C[NH2+]Cc1cccc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000415916268 1037627968 /nfs/dbraw/zinc/62/79/68/1037627968.db2.gz BJLLVTHVSTYTAL-CYBMUJFWSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1ncccc1S[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000591827501 1037639565 /nfs/dbraw/zinc/63/95/65/1037639565.db2.gz QHVBNVTWFAGDFM-HNNXBMFYSA-N 1 0 329.425 3.747 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000540186314 1037654179 /nfs/dbraw/zinc/65/41/79/1037654179.db2.gz RRSNFBFXDRIJCZ-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@@H]34)o2)cc1 ZINC000249845514 1037690611 /nfs/dbraw/zinc/69/06/11/1037690611.db2.gz OIRLCRDVXGEPKW-LZLYRXPVSA-N 1 0 328.368 3.512 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000573858777 1037786189 /nfs/dbraw/zinc/78/61/89/1037786189.db2.gz YTZHYSXTRZZFFW-UKRRQHHQSA-N 1 0 342.395 3.820 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000463198571 1037864619 /nfs/dbraw/zinc/86/46/19/1037864619.db2.gz NKMMWJVLBOQQFG-LZLYRXPVSA-N 1 0 348.443 3.509 20 5 EHBDRO CCOCOc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000897463922 1037870077 /nfs/dbraw/zinc/87/00/77/1037870077.db2.gz CPOZHBXMGFXHSZ-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000540417780 1037920080 /nfs/dbraw/zinc/92/00/80/1037920080.db2.gz UIVCSKYXFIOVDL-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCS[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000592379939 1037952162 /nfs/dbraw/zinc/95/21/62/1037952162.db2.gz BFIWMJJAQVIIJE-IAQYHMDHSA-N 1 0 348.424 3.847 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000181580691 1038095838 /nfs/dbraw/zinc/09/58/38/1038095838.db2.gz YOAXSNJHSBTGFS-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111346 1038112816 /nfs/dbraw/zinc/11/28/16/1038112816.db2.gz OUIJSUANTCOZSD-DOMZBBRYSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C[C@@H](c1ccccc1)[NH+](C)C ZINC000416120634 1038171367 /nfs/dbraw/zinc/17/13/67/1038171367.db2.gz DRQNBRVOVHSLNF-SFHVURJKSA-N 1 0 341.411 3.843 20 5 EHBDRO O=[N+]([O-])c1cnccc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000066797066 1038205340 /nfs/dbraw/zinc/20/53/40/1038205340.db2.gz XYWFDNYQKIDRNB-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO C[C@@H](NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000905851776 1039156824 /nfs/dbraw/zinc/15/68/24/1039156824.db2.gz DAAIPFKOFWGYLA-KFWWJZLASA-N 1 0 341.411 3.511 20 5 EHBDRO CC(C)[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000480432795 1039555685 /nfs/dbraw/zinc/55/56/85/1039555685.db2.gz NLLZEPNMTRXAJT-KRWDZBQOSA-N 1 0 328.416 3.675 20 5 EHBDRO Cn1cc(Cl)c(CN[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417346931 1039698037 /nfs/dbraw/zinc/69/80/37/1039698037.db2.gz GGYNQVRPVKUYHF-OAHLLOKOSA-N 1 0 334.807 3.539 20 5 EHBDRO Cc1cccc(CC[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000569216876 1039699006 /nfs/dbraw/zinc/69/90/06/1039699006.db2.gz CBEWNHOFBSBZRW-KRWDZBQOSA-N 1 0 325.412 3.720 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000549734243 1039746639 /nfs/dbraw/zinc/74/66/39/1039746639.db2.gz VULKIYDSCGRFKW-SJORKVTESA-N 1 0 348.443 3.629 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2oc(=O)oc2c1 ZINC000893945965 1039868418 /nfs/dbraw/zinc/86/84/18/1039868418.db2.gz QYXBFXYDMRTZLA-UHFFFAOYSA-N 1 0 342.351 3.705 20 5 EHBDRO C[C@H](O)C[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000072714013 1039941757 /nfs/dbraw/zinc/94/17/57/1039941757.db2.gz URZIYPDAEDGOFD-NSHDSACASA-N 1 0 336.775 3.511 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@@H]1C[NH+]1CCCC1 ZINC000489880200 1040220536 /nfs/dbraw/zinc/22/05/36/1040220536.db2.gz DRRRRUCTXWBRBX-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO CC(C)CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CC1 ZINC000128285111 1040287563 /nfs/dbraw/zinc/28/75/63/1040287563.db2.gz QSKNMUKVOMYTHA-UHFFFAOYSA-N 1 0 337.395 3.573 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000120280920 1040299103 /nfs/dbraw/zinc/29/91/03/1040299103.db2.gz AHDWUTUEJYNZIR-IAGOWNOFSA-N 1 0 331.416 3.922 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)c1 ZINC000490038759 1040305965 /nfs/dbraw/zinc/30/59/65/1040305965.db2.gz AEFIMTHKCRHYSB-QGZVFWFLSA-N 1 0 341.411 3.550 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000481094854 1040349363 /nfs/dbraw/zinc/34/93/63/1040349363.db2.gz XIHJLGZDBIJIHL-KGLIPLIRSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C[C@@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481094404 1040349468 /nfs/dbraw/zinc/34/94/68/1040349468.db2.gz WSIOAFZNFFOXQO-MELADBBJSA-N 1 0 333.432 3.726 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)s1 ZINC000190350513 1040502485 /nfs/dbraw/zinc/50/24/85/1040502485.db2.gz ZKLSYVXIEAAJSM-UNEWFSDZSA-N 1 0 344.436 3.980 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CC[NH+](C2CCCCC2)CC1 ZINC000487090505 1040686398 /nfs/dbraw/zinc/68/63/98/1040686398.db2.gz XRJXXWSDFPIKDJ-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487179775 1040770500 /nfs/dbraw/zinc/77/05/00/1040770500.db2.gz QKNFAJOJKCKGGH-OAHLLOKOSA-N 1 0 335.448 3.693 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000054981070 1041091712 /nfs/dbraw/zinc/09/17/12/1041091712.db2.gz KEYUIKSVPRIXEO-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@H](C)C1 ZINC000481604703 1041146284 /nfs/dbraw/zinc/14/62/84/1041146284.db2.gz ZYHVPOVZUUZLIJ-NWDGAFQWSA-N 1 0 339.823 3.697 20 5 EHBDRO CC(=O)c1cc(N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344416 1041214552 /nfs/dbraw/zinc/21/45/52/1041214552.db2.gz GSORBMUCFBLZHM-ZQIUZPCESA-N 1 0 345.443 3.639 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CC1(C)C ZINC000419313683 1041249160 /nfs/dbraw/zinc/24/91/60/1041249160.db2.gz GNHFZXJFHWBANZ-UONOGXRCSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCCOC3CCCC3)CC2)cc1 ZINC000125340729 1041937622 /nfs/dbraw/zinc/93/76/22/1041937622.db2.gz JGAKWCICAUMCGQ-UHFFFAOYSA-N 1 0 347.459 3.503 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(OC3CCCCC3)CC2)cc1 ZINC000125432765 1042085009 /nfs/dbraw/zinc/08/50/09/1042085009.db2.gz ADBMHSVKKWKDBC-UHFFFAOYSA-N 1 0 348.443 3.787 20 5 EHBDRO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000108931330 1042111610 /nfs/dbraw/zinc/11/16/10/1042111610.db2.gz SUDWGEYMFBSNFY-QLFBSQMISA-N 1 0 342.443 3.921 20 5 EHBDRO COc1cc(C[NH2+]C[C@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000111398370 1042262214 /nfs/dbraw/zinc/26/22/14/1042262214.db2.gz LLEXHFORBWKLRT-ZBFHGGJFSA-N 1 0 342.395 3.505 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CCC(F)(F)F ZINC000104676693 1042280444 /nfs/dbraw/zinc/28/04/44/1042280444.db2.gz NNMMFWPLLFFKHY-UHFFFAOYSA-N 1 0 343.305 3.677 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000093593192 1042376706 /nfs/dbraw/zinc/37/67/06/1042376706.db2.gz PTUAHWYBLSWISY-INIZCTEOSA-N 1 0 326.396 3.901 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1F ZINC000291235462 1042789843 /nfs/dbraw/zinc/78/98/43/1042789843.db2.gz UMBLVXLIQURAOC-LESCRADOSA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979135 1042829628 /nfs/dbraw/zinc/82/96/28/1042829628.db2.gz RTSDFQUPLIEAJK-CYBMUJFWSA-N 1 0 330.384 3.854 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cccc(CO)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279006171 1043172656 /nfs/dbraw/zinc/17/26/56/1043172656.db2.gz GJCOPDRRXXCZSI-GOSISDBHSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898517 1043598433 /nfs/dbraw/zinc/59/84/33/1043598433.db2.gz YMKUBPLKMLTKQD-KBXCAEBGSA-N 1 0 328.416 3.926 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H]3Cc3ccccc3)nc2c1 ZINC000344698890 1044302215 /nfs/dbraw/zinc/30/22/15/1044302215.db2.gz IWGBGDOFWMHQHL-OAHLLOKOSA-N 1 0 336.395 3.678 20 5 EHBDRO CC[C@@H]([NH2+]CCCc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000183475151 1125577383 /nfs/dbraw/zinc/57/73/83/1125577383.db2.gz KEJJMTKGWGQTPH-GOSISDBHSA-N 1 0 330.432 3.619 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000183720547 1125742133 /nfs/dbraw/zinc/74/21/33/1125742133.db2.gz FJBVPPFXFNFFMM-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO Cn1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(C2CCCCC2)n1 ZINC000183732384 1125746816 /nfs/dbraw/zinc/74/68/16/1125746816.db2.gz JSNSBBARPLYTJG-UHFFFAOYSA-N 1 0 342.443 3.708 20 5 EHBDRO Cc1ccc(C[C@H](CO)[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1C ZINC001308427191 1126165829 /nfs/dbraw/zinc/16/58/29/1126165829.db2.gz UFNNKNOMKDUZCL-GOSISDBHSA-N 1 0 342.439 3.522 20 5 EHBDRO C[C@@H](Cc1cccs1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000764774707 1127532600 /nfs/dbraw/zinc/53/26/00/1127532600.db2.gz QPQCMUGRFCLJJV-AWEZNQCLSA-N 1 0 345.468 3.846 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039956 1127568704 /nfs/dbraw/zinc/56/87/04/1127568704.db2.gz USRGYCZPIAHOLJ-HIFRSBDPSA-N 1 0 348.472 3.816 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301286493 1127733481 /nfs/dbraw/zinc/73/34/81/1127733481.db2.gz ROJDZOQVEJPZPH-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC001168601904 1128280432 /nfs/dbraw/zinc/28/04/32/1128280432.db2.gz UYPZKTJQDQNMHX-STQMWFEESA-N 1 0 331.338 3.898 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1 ZINC000301479812 1128468217 /nfs/dbraw/zinc/46/82/17/1128468217.db2.gz NQIWRUHVONMVPK-MRXNPFEDSA-N 1 0 341.411 3.680 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301590276 1128505897 /nfs/dbraw/zinc/50/58/97/1128505897.db2.gz CSRFPFDYMLKVSO-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@]2(O)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000765879117 1128636294 /nfs/dbraw/zinc/63/62/94/1128636294.db2.gz UAJXXOHBBPDZSO-MGPUTAFESA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000554358210 1128637160 /nfs/dbraw/zinc/63/71/60/1128637160.db2.gz BFPGJRZUJXIBSH-HIFRSBDPSA-N 1 0 348.830 3.983 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2COC)c1 ZINC000091457241 1128668003 /nfs/dbraw/zinc/66/80/03/1128668003.db2.gz CAHKXBLBLXVXGD-UHFFFAOYSA-N 1 0 343.427 3.805 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123253494 1128735513 /nfs/dbraw/zinc/73/55/13/1128735513.db2.gz VBUYBISOJBIEKD-LSDHHAIUSA-N 1 0 328.412 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2Cc2ccccc2)c2ncccc12 ZINC000715715949 1128810609 /nfs/dbraw/zinc/81/06/09/1128810609.db2.gz VESHJPTWEKZESQ-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO COc1cc(NC2CC[NH+](C3CCCC3)CC2)c([N+](=O)[O-])cc1F ZINC000301651899 1128849712 /nfs/dbraw/zinc/84/97/12/1128849712.db2.gz STJDBVWXLWAVCF-UHFFFAOYSA-N 1 0 337.395 3.561 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CCCO[C@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000492874964 1120374032 /nfs/dbraw/zinc/37/40/32/1120374032.db2.gz QXDVDFTUBUNUDV-WBVHZDCISA-N 1 0 336.432 3.677 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114426 1120691055 /nfs/dbraw/zinc/69/10/55/1120691055.db2.gz MDSPIIGBWVPNLZ-KBXCAEBGSA-N 1 0 344.411 3.686 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000494634817 1120708413 /nfs/dbraw/zinc/70/84/13/1120708413.db2.gz DWNOQROPNMWIIZ-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO CCc1cc(N2CCc3c[nH+]ccc32)nc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000487785149 1120737866 /nfs/dbraw/zinc/73/78/66/1120737866.db2.gz NRPLOUIVYIALBV-UHFFFAOYSA-N 1 0 347.378 3.703 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193234596 1120995626 /nfs/dbraw/zinc/99/56/26/1120995626.db2.gz GPSGCVFDLDCBBI-CHWSQXEVSA-N 1 0 327.384 3.965 20 5 EHBDRO COc1cccc([C@@H](CNc2ccccc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC000301055712 1121196388 /nfs/dbraw/zinc/19/63/88/1121196388.db2.gz GXQPEDIZPBUENL-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@H]21 ZINC000301716086 1128980447 /nfs/dbraw/zinc/98/04/47/1128980447.db2.gz NDFLOTNZLVAZKD-BXUZGUMPSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CCN(C2CCCC2)C1)C1CC1 ZINC000153682206 1121581188 /nfs/dbraw/zinc/58/11/88/1121581188.db2.gz OPGAJSYCQGAFOS-IEBWSBKVSA-N 1 0 343.471 3.522 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000153343023 1121747932 /nfs/dbraw/zinc/74/79/32/1121747932.db2.gz SJWHLWYGGHXBPY-CJNGLKHVSA-N 1 0 342.395 3.648 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(c3ccc(F)cc3[N+](=O)[O-])C2)CC1 ZINC000301121516 1122041875 /nfs/dbraw/zinc/04/18/75/1122041875.db2.gz QWWVJYMTRQROHG-HNNXBMFYSA-N 1 0 335.423 3.682 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@H]2CCc3ccccc32)ccc1Cl ZINC000153913635 1122107009 /nfs/dbraw/zinc/10/70/09/1122107009.db2.gz XBJZYSKZGRRNQX-KRWDZBQOSA-N 1 0 346.814 3.730 20 5 EHBDRO CC(=O)c1ccc(NC[C@@]2([NH+](C)C)CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000497648383 1122616611 /nfs/dbraw/zinc/61/66/11/1122616611.db2.gz SGKXHURWVMWBHO-FZKQIMNGSA-N 1 0 333.432 3.720 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2ccc([N+](=O)[O-])nc2)c2ccccc2)CC1 ZINC000497646311 1122620258 /nfs/dbraw/zinc/62/02/58/1122620258.db2.gz UTAFRMJHSOZVOY-SFHVURJKSA-N 1 0 340.427 3.875 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H](O)C(F)(F)F ZINC000498356655 1122884981 /nfs/dbraw/zinc/88/49/81/1122884981.db2.gz ZVZRRRLASKOMQL-TZMCWYRMSA-N 1 0 334.338 3.510 20 5 EHBDRO C[C@H]1c2ccccc2CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315893 1123374516 /nfs/dbraw/zinc/37/45/16/1123374516.db2.gz IQSGGOIHQPGAQQ-HNNXBMFYSA-N 1 0 326.396 3.983 20 5 EHBDRO O=[N+]([O-])c1cc(CN(CCO)[C@H]2CCCc3ccccc32)cs1 ZINC000114193014 1129123846 /nfs/dbraw/zinc/12/38/46/1129123846.db2.gz NJSRJWHSLFRISS-INIZCTEOSA-N 1 0 332.425 3.528 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000092218731 1129132153 /nfs/dbraw/zinc/13/21/53/1129132153.db2.gz LKZCXIBCKYFRAV-YOCVDRLZSA-N 1 0 329.444 3.558 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631909 1123635121 /nfs/dbraw/zinc/63/51/21/1123635121.db2.gz MUMZMQFNIXYZOR-AWEZNQCLSA-N 1 0 334.416 3.719 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)C(C)(C)O ZINC000609707888 1123648434 /nfs/dbraw/zinc/64/84/34/1123648434.db2.gz KXMDPFBOSPJSEO-CQSZACIVSA-N 1 0 343.427 3.612 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000130782845 1123737240 /nfs/dbraw/zinc/73/72/40/1123737240.db2.gz AIIBYIGRSPLDBX-DNVCBOLYSA-N 1 0 328.412 3.548 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)N(C)C1CC1 ZINC000237579583 1123779479 /nfs/dbraw/zinc/77/94/79/1123779479.db2.gz WMMMCRBCWGNLEA-CYBMUJFWSA-N 1 0 345.468 3.896 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2ccnn2C)C(C)C)cccc1[N+](=O)[O-] ZINC000615967238 1123919475 /nfs/dbraw/zinc/91/94/75/1123919475.db2.gz WYZHBOALTWTEIR-ZBFHGGJFSA-N 1 0 330.432 3.727 20 5 EHBDRO CC(C)[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1F ZINC000180259793 1123975999 /nfs/dbraw/zinc/97/59/99/1123975999.db2.gz LHXTYGLUOGMRDI-HNNXBMFYSA-N 1 0 340.786 3.571 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507371 1124019544 /nfs/dbraw/zinc/01/95/44/1124019544.db2.gz QFCLJLXJDVBIHZ-JXFKEZNVSA-N 1 0 339.439 3.616 20 5 EHBDRO C[NH+]1CCC(CCNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000301836725 1129169300 /nfs/dbraw/zinc/16/93/00/1129169300.db2.gz VKGALGNOGXASJD-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CC1CCCC1 ZINC000069227757 1124538487 /nfs/dbraw/zinc/53/84/87/1124538487.db2.gz LYOBQJFISICCKL-NSHDSACASA-N 1 0 339.823 3.697 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCO[C@H]21 ZINC000618569916 1125114911 /nfs/dbraw/zinc/11/49/11/1125114911.db2.gz GZYIPTVNKOBTOD-DZOHQFGASA-N 1 0 330.428 3.765 20 5 EHBDRO CO[C@@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000619430961 1125348446 /nfs/dbraw/zinc/34/84/46/1125348446.db2.gz TXVZCWCRIAKLMP-GXTWGEPZSA-N 1 0 332.322 3.661 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000619531308 1125358535 /nfs/dbraw/zinc/35/85/35/1125358535.db2.gz CYRNENWZWXSUIP-LJQANCHMSA-N 1 0 342.395 3.567 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000619531307 1125358597 /nfs/dbraw/zinc/35/85/97/1125358597.db2.gz CYRNENWZWXSUIP-IBGZPJMESA-N 1 0 342.395 3.567 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493205 1131353749 /nfs/dbraw/zinc/35/37/49/1131353749.db2.gz YGTATWMVBNCDRH-JKIFEVAISA-N 1 0 335.423 3.571 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000255954899 1129237885 /nfs/dbraw/zinc/23/78/85/1129237885.db2.gz AKNAZURMVWPHPE-UMVBOHGHSA-N 1 0 333.432 3.646 20 5 EHBDRO COCCOc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080346885 1129348027 /nfs/dbraw/zinc/34/80/27/1129348027.db2.gz YQCZRMSFKNAALL-UHFFFAOYSA-N 1 0 344.411 3.645 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@H]3CCOC3)C2)c(Cl)c1 ZINC000466363639 1129403619 /nfs/dbraw/zinc/40/36/19/1129403619.db2.gz FPOACOBPVHBUCW-VHDGCEQUSA-N 1 0 338.835 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]([C@@H]3CCOC3)C2)c(Cl)c1 ZINC000466363637 1129403883 /nfs/dbraw/zinc/40/38/83/1129403883.db2.gz FPOACOBPVHBUCW-BPLDGKMQSA-N 1 0 338.835 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](CO)CC2CCCC2)c(Cl)c1 ZINC000466409870 1129428852 /nfs/dbraw/zinc/42/88/52/1129428852.db2.gz OZWZKCXUNSKJDW-ZDUSSCGKSA-N 1 0 326.824 3.527 20 5 EHBDRO C[NH+](C)CCc1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000466432557 1129443492 /nfs/dbraw/zinc/44/34/92/1129443492.db2.gz YPSVZQBHHXAOPE-UHFFFAOYSA-N 1 0 333.819 3.964 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CCO[C@@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543422850 1129477746 /nfs/dbraw/zinc/47/77/46/1129477746.db2.gz IPKYFUJMTDGJOF-ZUEVXXBESA-N 1 0 344.411 3.997 20 5 EHBDRO CC(C)[C@H](O)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000123826279 1129556497 /nfs/dbraw/zinc/55/64/97/1129556497.db2.gz CVFONNKHCCEONE-IUODEOHRSA-N 1 0 334.441 3.991 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000092785566 1129561052 /nfs/dbraw/zinc/56/10/52/1129561052.db2.gz PDGVPFBDGGNBAQ-PDFOZTTASA-N 1 0 329.444 3.558 20 5 EHBDRO CCC[C@@H]([NH2+]CCc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000124217480 1129588885 /nfs/dbraw/zinc/58/88/85/1129588885.db2.gz FUUPJCRQGAPLHU-GOSISDBHSA-N 1 0 330.432 3.619 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CN(Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000389826715 1129591305 /nfs/dbraw/zinc/59/13/05/1129591305.db2.gz RTMDDHFJTJUPFC-KXBFYZLASA-N 1 0 339.439 3.513 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3C=C[C@H]4C[C@@H]3CO4)o2)cc1 ZINC000922721854 1129643721 /nfs/dbraw/zinc/64/37/21/1129643721.db2.gz HCHBVAAMKIZOGI-UXLLHSPISA-N 1 0 340.379 3.536 20 5 EHBDRO Cc1cc(NC[C@@H]2CSCCS2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302078302 1129766578 /nfs/dbraw/zinc/76/65/78/1129766578.db2.gz KGDBNUGCNYYVOW-GFCCVEGCSA-N 1 0 335.454 3.712 20 5 EHBDRO Cc1cc(NC[C@@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302187278 1129772280 /nfs/dbraw/zinc/77/22/80/1129772280.db2.gz PXJZYROOMKEJDC-GOSISDBHSA-N 1 0 341.342 3.736 20 5 EHBDRO Cc1cc(N2CCC([C@H]3CCCO3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302533170 1129781072 /nfs/dbraw/zinc/78/10/72/1129781072.db2.gz FWTUXXVGJRNBGL-LJQANCHMSA-N 1 0 341.411 3.847 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1NC1CC[NH+](CC3CCCC3)CC1)CCN2 ZINC000302869579 1129796000 /nfs/dbraw/zinc/79/60/00/1129796000.db2.gz AYFBWBCVHNUSQU-UHFFFAOYSA-N 1 0 344.459 3.629 20 5 EHBDRO C[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)C[NH+]1CCCCC1 ZINC000302945223 1129800475 /nfs/dbraw/zinc/80/04/75/1129800475.db2.gz IWZSYGGXRYWLBN-AWEZNQCLSA-N 1 0 328.416 3.677 20 5 EHBDRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196400 1129805674 /nfs/dbraw/zinc/80/56/74/1129805674.db2.gz RDKZWRFTCILAKT-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO CN(CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(F)cc1Cl ZINC000303283604 1129835343 /nfs/dbraw/zinc/83/53/43/1129835343.db2.gz JFNAPDWNLYPOLI-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO C[N@H+](CCCNc1ncc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000303398778 1129842725 /nfs/dbraw/zinc/84/27/25/1129842725.db2.gz MJXKTBQCLDXRNA-UHFFFAOYSA-N 1 0 334.807 3.577 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC([C@H](O)c3ccc(F)cc3)CC2)c1 ZINC000303992771 1129875772 /nfs/dbraw/zinc/87/57/72/1129875772.db2.gz NLCROZHPLVCRCG-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CC[C@H](O)CC2)c2ccccc2)c1 ZINC000305787572 1129926942 /nfs/dbraw/zinc/92/69/42/1129926942.db2.gz AGISXRQMLBWLBP-BHIYHBOVSA-N 1 0 326.396 3.577 20 5 EHBDRO Cn1cc2c(n1)CCC[C@@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000282480949 1129927855 /nfs/dbraw/zinc/92/78/55/1129927855.db2.gz QEQNPZGYILVDSL-FUHWJXTLSA-N 1 0 340.427 3.718 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1cccc(F)c1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000133557097 1129952541 /nfs/dbraw/zinc/95/25/41/1129952541.db2.gz PKKCKBBZCSEPPF-ACJLOTCBSA-N 1 0 331.391 3.687 20 5 EHBDRO C[NH+]1CCC(CCNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000171211418 1130033236 /nfs/dbraw/zinc/03/32/36/1130033236.db2.gz LPHAEFODOFHSRV-UHFFFAOYSA-N 1 0 347.462 3.850 20 5 EHBDRO CCC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000171680801 1130078340 /nfs/dbraw/zinc/07/83/40/1130078340.db2.gz KIQHMDLFBMVTEP-UHFFFAOYSA-N 1 0 330.331 3.579 20 5 EHBDRO C[C@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000173318004 1130205771 /nfs/dbraw/zinc/20/57/71/1130205771.db2.gz GIIXNVXILQFKOL-INIZCTEOSA-N 1 0 340.423 3.994 20 5 EHBDRO CC[C@@](C)([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1nc(C)cs1 ZINC000173936707 1130325025 /nfs/dbraw/zinc/32/50/25/1130325025.db2.gz HFWHAWLXRGIYSA-MRXNPFEDSA-N 1 0 335.429 3.654 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCC[C@H](O)C2)s1 ZINC000174430200 1130358277 /nfs/dbraw/zinc/35/82/77/1130358277.db2.gz URHCMONPJMGGMU-KGLIPLIRSA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)c1 ZINC000174878133 1130389816 /nfs/dbraw/zinc/38/98/16/1130389816.db2.gz KVFZCBRWCCSRSM-FQEVSTJZSA-N 1 0 348.406 3.591 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000246559403 1130391915 /nfs/dbraw/zinc/39/19/15/1130391915.db2.gz XCCWITFNBDFPRB-PVAVHDDUSA-N 1 0 336.457 3.690 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000246801311 1130413355 /nfs/dbraw/zinc/41/33/55/1130413355.db2.gz ABTVUTXBCLRPPT-BTELXILVSA-N 1 0 332.425 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@H+](CC2CC2)C2CCCCC2)c1 ZINC000727825198 1130601150 /nfs/dbraw/zinc/60/11/50/1130601150.db2.gz MKNHGNBTBLJMBC-UHFFFAOYSA-N 1 0 328.416 3.947 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731206477 1130779706 /nfs/dbraw/zinc/77/97/06/1130779706.db2.gz IUNNUQPZVIRHQM-UHFFFAOYSA-N 1 0 348.472 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2cc(Cl)cc(Cl)c2)cc1 ZINC000731677876 1130831869 /nfs/dbraw/zinc/83/18/69/1130831869.db2.gz ARUZMUDEFVKSSN-OAHLLOKOSA-N 1 0 341.194 3.725 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000732568407 1130935477 /nfs/dbraw/zinc/93/54/77/1130935477.db2.gz RDZJXZWQVFYRMM-UHFFFAOYSA-N 1 0 345.365 3.924 20 5 EHBDRO COc1cccc(F)c1C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897919 1131880270 /nfs/dbraw/zinc/88/02/70/1131880270.db2.gz DLSPKRXURWSYKE-HNNXBMFYSA-N 1 0 344.386 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cn(C3CCC3)cn1)CC2 ZINC001172902568 1131883626 /nfs/dbraw/zinc/88/36/26/1131883626.db2.gz AAQUCLUYQNSNQW-INIZCTEOSA-N 1 0 340.427 3.554 20 5 EHBDRO Cc1ccccc1OCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900474 1131884097 /nfs/dbraw/zinc/88/40/97/1131884097.db2.gz UDFCEATYZQWEBD-SFHVURJKSA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCCOc1ccccc1)CC2 ZINC001172901610 1131885199 /nfs/dbraw/zinc/88/51/99/1131885199.db2.gz OWYJSMSRSNBHSW-GOSISDBHSA-N 1 0 340.423 3.901 20 5 EHBDRO CC(=O)[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901827 1131885400 /nfs/dbraw/zinc/88/54/00/1131885400.db2.gz PRNYAYTUACMKCI-QUCCMNQESA-N 1 0 338.407 3.762 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1F ZINC001172902554 1131885560 /nfs/dbraw/zinc/88/55/60/1131885560.db2.gz ZTUXPBQFAHNPAB-INIZCTEOSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@@H](CCCC(C)(C)O)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901573 1131885640 /nfs/dbraw/zinc/88/56/40/1131885640.db2.gz NUCLJUYMKDKFNH-YOEHRIQHSA-N 1 0 334.460 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@H]3[C@H](CCC3(F)F)C1)CC2 ZINC001172903964 1131885897 /nfs/dbraw/zinc/88/58/97/1131885897.db2.gz KIIAWMAOPPVHMG-INMHGKMJSA-N 1 0 336.382 3.819 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381063 1131915154 /nfs/dbraw/zinc/91/51/54/1131915154.db2.gz TUJABFOPVRSLDP-ZBFHGGJFSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H](c1ccccn1)C1CC1)CC2 ZINC001172910745 1131917475 /nfs/dbraw/zinc/91/74/75/1131917475.db2.gz CKKWPMPTBFYHKN-YLJYHZDGSA-N 1 0 337.423 3.978 20 5 EHBDRO CC(C)[N@H+](C1CCOCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911605 1131917982 /nfs/dbraw/zinc/91/79/82/1131917982.db2.gz CWEGGNKRCDUKDB-KRWDZBQOSA-N 1 0 332.444 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H](c1ccncc1)C1CC1)CC2 ZINC001172912071 1131918108 /nfs/dbraw/zinc/91/81/08/1131918108.db2.gz LNYKRBOBIRZLGD-ICSRJNTNSA-N 1 0 337.423 3.978 20 5 EHBDRO Cc1cnc2c(c1)C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172913259 1131918730 /nfs/dbraw/zinc/91/87/30/1131918730.db2.gz QHTJSGKIEDICEF-SFHVURJKSA-N 1 0 337.423 3.604 20 5 EHBDRO CC1(C[NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1 ZINC001173011617 1131936186 /nfs/dbraw/zinc/93/61/86/1131936186.db2.gz HGSXKDACUFLZBK-UHFFFAOYSA-N 1 0 339.386 3.622 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2(F)CCCCC2)c1F ZINC001173176847 1131992689 /nfs/dbraw/zinc/99/26/89/1131992689.db2.gz MQKZDNQVSDJDTB-GFCCVEGCSA-N 1 0 342.386 3.936 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2ccc(O)cc2)c1F ZINC001173180594 1131992891 /nfs/dbraw/zinc/99/28/91/1131992891.db2.gz WZSWYDHLNNPQLE-NEPJUHHUSA-N 1 0 348.374 3.730 20 5 EHBDRO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H](O)c1ccc(C)cc1 ZINC000743867024 1131993070 /nfs/dbraw/zinc/99/30/70/1131993070.db2.gz QVSYJEHJZOBRHH-IBGZPJMESA-N 1 0 328.412 3.767 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC(C(F)F)CC2)c1F ZINC001173197609 1131996544 /nfs/dbraw/zinc/99/65/44/1131996544.db2.gz VHZQMJQCGCKSNE-SNVBAGLBSA-N 1 0 346.349 3.651 20 5 EHBDRO COc1c(F)cc(F)cc1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216548 1132002003 /nfs/dbraw/zinc/00/20/03/1132002003.db2.gz LWMQYOAHBIACSY-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1cccc(OC)c1[C@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216590 1132002013 /nfs/dbraw/zinc/00/20/13/1132002013.db2.gz DHFXXHQZBMWDEE-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOCc1ccccc1 ZINC001173218937 1132003563 /nfs/dbraw/zinc/00/35/63/1132003563.db2.gz UCGNAQXWCZXWGO-MRXNPFEDSA-N 1 0 328.412 3.722 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173219553 1132003599 /nfs/dbraw/zinc/00/35/99/1132003599.db2.gz NWHXJLCVVJMUAG-DJJJIMSYSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccnc(F)c1)C1CC1 ZINC001173220685 1132004296 /nfs/dbraw/zinc/00/42/96/1132004296.db2.gz DTWYFUYIJWVLQZ-SGTLLEGYSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1ccccc1C1([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173221166 1132004796 /nfs/dbraw/zinc/00/47/96/1132004796.db2.gz LBPDGEXOBHCHSQ-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1ccc(C2(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC001173225215 1132006265 /nfs/dbraw/zinc/00/62/65/1132006265.db2.gz RCAMPMAQASHLQJ-OAHLLOKOSA-N 1 0 325.412 3.551 20 5 EHBDRO COc1ccc(CC2([NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173226220 1132006270 /nfs/dbraw/zinc/00/62/70/1132006270.db2.gz WDMCVOJBEBTWBV-OAHLLOKOSA-N 1 0 340.423 3.899 20 5 EHBDRO Cc1ccccc1O[C@@H]1CC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226695 1132006791 /nfs/dbraw/zinc/00/67/91/1132006791.db2.gz KWGPDJQXFPUFSZ-VQIMIIECSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1CC[NH2+]C2 ZINC001173226376 1132006846 /nfs/dbraw/zinc/00/68/46/1132006846.db2.gz JCRSOGYRUYLLLX-CQSZACIVSA-N 1 0 335.407 3.999 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001168982870 1132619448 /nfs/dbraw/zinc/61/94/48/1132619448.db2.gz TVFCPKHZRNWDEP-OLMNPRSZSA-N 1 0 345.443 3.649 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cc(-c3cccc(Cl)c3)no2)C1 ZINC001168983825 1132619511 /nfs/dbraw/zinc/61/95/11/1132619511.db2.gz LKUZYDACGKWBNH-BXUZGUMPSA-N 1 0 335.791 3.530 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCSCc2ccccc2Cl)C1 ZINC001168970211 1132622777 /nfs/dbraw/zinc/62/27/77/1132622777.db2.gz GVFUDVICWSAVJO-JSGCOSHPSA-N 1 0 328.865 3.608 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168973375 1132625064 /nfs/dbraw/zinc/62/50/64/1132625064.db2.gz ONVGLUOKKVESIN-GYSYKLTISA-N 1 0 327.222 3.545 20 5 EHBDRO CC[N@H+](Cc1cccc(Br)c1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169035068 1132636626 /nfs/dbraw/zinc/63/66/26/1132636626.db2.gz ADLOSRCAFXEMDG-DZGCQCFKSA-N 1 0 341.249 3.716 20 5 EHBDRO C[C@H](c1cccc(Br)c1)[N@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057844 1132646217 /nfs/dbraw/zinc/64/62/17/1132646217.db2.gz XZYGCMJLHFNDNO-XUJVJEKNSA-N 1 0 341.249 3.887 20 5 EHBDRO CC1CC[NH+](CC[C@H]2CCCN2Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC001175353273 1132646959 /nfs/dbraw/zinc/64/69/59/1132646959.db2.gz VKAYTFUYDMKBNV-GOSISDBHSA-N 1 0 349.450 3.820 20 5 EHBDRO [NH3+]Cc1ccc2c(n1)N(c1cc(Cl)ccc1/C=C/[N+](=O)[O-])CCC2 ZINC001169590711 1132790136 /nfs/dbraw/zinc/79/01/36/1132790136.db2.gz LHGUGGYUGIZVND-VQHVLOKHSA-N 1 0 344.802 3.525 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001176086168 1132830815 /nfs/dbraw/zinc/83/08/15/1132830815.db2.gz DKGPWNTXQIPIIS-FXAWDEMLSA-N 1 0 338.407 3.767 20 5 EHBDRO COc1ccc(Nc2ccccc2C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC001176362568 1132921683 /nfs/dbraw/zinc/92/16/83/1132921683.db2.gz FFTCWCMOVNKULB-UHFFFAOYSA-N 1 0 327.384 3.943 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765167 1133049803 /nfs/dbraw/zinc/04/98/03/1133049803.db2.gz KHOHLPBIUORPEB-GDBMZVCRSA-N 1 0 343.431 3.711 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765169 1133050431 /nfs/dbraw/zinc/05/04/31/1133050431.db2.gz KHOHLPBIUORPEB-GOEBONIOSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C)(O)CC1 ZINC000768104602 1133095916 /nfs/dbraw/zinc/09/59/16/1133095916.db2.gz BAEXDYIYKMDEIK-CBCUQQMYSA-N 1 0 338.473 3.749 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000768542852 1133153628 /nfs/dbraw/zinc/15/36/28/1133153628.db2.gz ZXJDBPLCTGWFMO-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555294 1133155456 /nfs/dbraw/zinc/15/54/56/1133155456.db2.gz PTUBEMVHGYPQCN-GXTWGEPZSA-N 1 0 325.840 3.553 20 5 EHBDRO CON(C)C(=O)C[NH2+]Cc1c2ccccc2c(Cl)c2ccccc21 ZINC001179555176 1133261428 /nfs/dbraw/zinc/26/14/28/1133261428.db2.gz SGZXMDYPBHWQPD-UHFFFAOYSA-N 1 0 342.826 3.756 20 5 EHBDRO O[C@@H]1C[C@H](O)C[N@@H+](Cc2c3ccccc3c(Cl)c3ccccc32)C1 ZINC000769563239 1133315475 /nfs/dbraw/zinc/31/54/75/1133315475.db2.gz HGROTBHDQKHLRU-OKILXGFUSA-N 1 0 341.838 3.574 20 5 EHBDRO C[N@H+](CCCc1ccc(F)c(F)c1)CCc1cccc([N+](=O)[O-])c1 ZINC001181155232 1133460905 /nfs/dbraw/zinc/46/09/05/1133460905.db2.gz ZLDRCUJCGLJZIQ-UHFFFAOYSA-N 1 0 334.366 3.980 20 5 EHBDRO [NH3+]CCN(Cc1cccc(CC2CCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC001181464261 1133490541 /nfs/dbraw/zinc/49/05/41/1133490541.db2.gz LCUSLGPSULSOHU-UHFFFAOYSA-N 1 0 339.439 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1COC3(CCCCC3)O1)CCC2 ZINC000774273527 1133652793 /nfs/dbraw/zinc/65/27/93/1133652793.db2.gz SKHKHJRXQLICHB-SJLPKXTDSA-N 1 0 346.427 3.638 20 5 EHBDRO C[C@H](C[NH+](C)C)NC(=O)CCc1c2ccccc2cc2ccccc21 ZINC001182412332 1133655792 /nfs/dbraw/zinc/65/57/92/1133655792.db2.gz DAYYPNJEXFEZLL-MRXNPFEDSA-N 1 0 334.463 3.992 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000774411877 1133673437 /nfs/dbraw/zinc/67/34/37/1133673437.db2.gz SMRTXRYOIYWLMX-MOPGFXCFSA-N 1 0 328.412 3.924 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC001183642019 1133835207 /nfs/dbraw/zinc/83/52/07/1133835207.db2.gz GPWIVYTYVWSTGB-PIUDJOPYSA-N 1 0 344.455 3.853 20 5 EHBDRO COC(=O)CC[C@@H]1CCC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC001183631247 1133839351 /nfs/dbraw/zinc/83/93/51/1133839351.db2.gz QIQOAOGRRADIJI-SFKKXYGYSA-N 1 0 346.427 3.663 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1COc2ccccc2C1 ZINC000786810180 1133909631 /nfs/dbraw/zinc/90/96/31/1133909631.db2.gz ROONUCCWTJBLDG-FVLHSZHDSA-N 1 0 338.407 3.839 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](CCO)c1cccs1 ZINC000786816011 1133910659 /nfs/dbraw/zinc/91/06/59/1133910659.db2.gz VEQWRPPVOMSCPU-ISBHARSQSA-N 1 0 332.425 3.773 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCCC[C@@H]([C@@H]2CCOC2)C1 ZINC001184252506 1133916170 /nfs/dbraw/zinc/91/61/70/1133916170.db2.gz QEIBLZXQABJSQE-IAGOWNOFSA-N 1 0 332.444 3.850 20 5 EHBDRO CC1CC[NH+](CCCNc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC001184644580 1133971262 /nfs/dbraw/zinc/97/12/62/1133971262.db2.gz QVIMLDZXZDKHHB-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000746674152 1133991874 /nfs/dbraw/zinc/99/18/74/1133991874.db2.gz OCBLHCKLRMWYOX-CQSZACIVSA-N 1 0 337.851 3.556 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)cc1 ZINC000774843534 1134052107 /nfs/dbraw/zinc/05/21/07/1134052107.db2.gz JVHLVERDDRGUSQ-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000774886698 1134102262 /nfs/dbraw/zinc/10/22/62/1134102262.db2.gz WQZYZXGKELZWTA-QGZVFWFLSA-N 1 0 331.372 3.825 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479726 1134130465 /nfs/dbraw/zinc/13/04/65/1134130465.db2.gz AAOQNCBNVAVBAF-DOTOQJQBSA-N 1 0 349.450 3.820 20 5 EHBDRO CCOc1cc(N(CC[NH+](C)C)CC2CCCCC2)ccc1[N+](=O)[O-] ZINC001185897574 1134147043 /nfs/dbraw/zinc/14/70/43/1134147043.db2.gz FTHRYKDFXVMSKM-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO Cc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788607092 1134150271 /nfs/dbraw/zinc/15/02/71/1134150271.db2.gz COVPFFRJHHBNGQ-UONOGXRCSA-N 1 0 329.400 3.604 20 5 EHBDRO CCO[C@H](CC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788606740 1134150480 /nfs/dbraw/zinc/15/04/80/1134150480.db2.gz ADYLULQYJHAFOB-FZKQIMNGSA-N 1 0 335.448 3.813 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788643294 1134155001 /nfs/dbraw/zinc/15/50/01/1134155001.db2.gz PQLAXFGJQQRFAC-BZNIZROVSA-N 1 0 345.374 3.881 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788643292 1134155176 /nfs/dbraw/zinc/15/51/76/1134155176.db2.gz PQLAXFGJQQRFAC-BDJLRTHQSA-N 1 0 345.374 3.881 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688724 1134157521 /nfs/dbraw/zinc/15/75/21/1134157521.db2.gz GTQQPQPTWQVQQF-SOZUMNATSA-N 1 0 347.390 3.743 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2[N@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001186368657 1134202782 /nfs/dbraw/zinc/20/27/82/1134202782.db2.gz VEIKZOBUQKEOOT-KRWDZBQOSA-N 1 0 333.432 3.720 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584986 1134298775 /nfs/dbraw/zinc/29/87/75/1134298775.db2.gz UKPYNFTYIXXTTK-INIZCTEOSA-N 1 0 348.830 3.938 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC001187371547 1134327899 /nfs/dbraw/zinc/32/78/99/1134327899.db2.gz MCPOQYPHEHKAKY-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[N@@H+]1C[C@@H]2CC[C@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001187913801 1134396334 /nfs/dbraw/zinc/39/63/34/1134396334.db2.gz QCYXKPKVKRNJLG-QXEWZRGKSA-N 1 0 330.215 3.654 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790693334 1134453780 /nfs/dbraw/zinc/45/37/80/1134453780.db2.gz AXXHKPVEIHZADP-OAHLLOKOSA-N 1 0 328.368 3.525 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170297974 1134738319 /nfs/dbraw/zinc/73/83/19/1134738319.db2.gz XFJJXXNHNXEOPA-HNNXBMFYSA-N 1 0 340.423 3.899 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2cccc(C)n2)c([N+](=O)[O-])c1 ZINC001170305632 1134739416 /nfs/dbraw/zinc/73/94/16/1134739416.db2.gz OIOACKUJVQXWOL-KGLIPLIRSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2ccncc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170313839 1134745752 /nfs/dbraw/zinc/74/57/52/1134745752.db2.gz RZCRPNDLGYMNMS-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@@H](F)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170329027 1134749407 /nfs/dbraw/zinc/74/94/07/1134749407.db2.gz NGJAINQNLUDCDD-IAQYHMDHSA-N 1 0 346.349 3.604 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCc3cnccc32)c([N+](=O)[O-])c1 ZINC001170328083 1134749550 /nfs/dbraw/zinc/74/95/50/1134749550.db2.gz UUCHCGKMXLGXSJ-SCLBCKFNSA-N 1 0 341.411 3.597 20 5 EHBDRO CCOC(=O)CCCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170410229 1134771764 /nfs/dbraw/zinc/77/17/64/1134771764.db2.gz FKILUQJUEVINDS-QGZVFWFLSA-N 1 0 348.443 3.898 20 5 EHBDRO CC[C@H]1CN(C)c2ccccc2C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001191531665 1134880671 /nfs/dbraw/zinc/88/06/71/1134880671.db2.gz VHJLYVCDAZBWJI-KRWDZBQOSA-N 1 0 325.412 3.825 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789195 1134923016 /nfs/dbraw/zinc/92/30/16/1134923016.db2.gz GKABKYFLPKOGBC-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCC3)cc1[N+](=O)[O-] ZINC001192814508 1135058090 /nfs/dbraw/zinc/05/80/90/1135058090.db2.gz NYLISFWTDXSMOQ-CYBMUJFWSA-N 1 0 326.396 3.943 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804607881 1135137167 /nfs/dbraw/zinc/13/71/67/1135137167.db2.gz CAQNYZYOTMHVRS-UHFFFAOYSA-N 1 0 334.464 3.515 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC001193954717 1135205950 /nfs/dbraw/zinc/20/59/50/1135205950.db2.gz LDUBLLPGWHSNBP-LMMKCTJWSA-N 1 0 332.444 3.809 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH+]1CCN(CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC001194356382 1135258634 /nfs/dbraw/zinc/25/86/34/1135258634.db2.gz AEDKFADYYWEFCL-UHFFFAOYSA-N 1 0 347.503 3.970 20 5 EHBDRO CCCC[C@H](C)[N@H+](C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194874975 1135333750 /nfs/dbraw/zinc/33/37/50/1135333750.db2.gz WBSBRWUURADYBK-NSHDSACASA-N 1 0 327.812 3.697 20 5 EHBDRO Cc1cccc2c1CC(C)(C)[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC001170502255 1135416609 /nfs/dbraw/zinc/41/66/09/1135416609.db2.gz YWSJCSDMZMZRKM-LJQANCHMSA-N 1 0 340.423 3.774 20 5 EHBDRO Cc1ccc(C2([NH2+]CCOc3ccc([N+](=O)[O-])cc3)CCC2)cc1 ZINC001195776062 1135467786 /nfs/dbraw/zinc/46/77/86/1135467786.db2.gz AUCRVLMZGBEWRH-UHFFFAOYSA-N 1 0 326.396 3.951 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](Cc1ccccc1)C(C)C ZINC001197770796 1135735262 /nfs/dbraw/zinc/73/52/62/1135735262.db2.gz VGWXNANPRGMSST-GOSISDBHSA-N 1 0 328.412 3.960 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CNC3CC[NH+](C4CC4)CC3)o2)c1 ZINC001199078893 1135879941 /nfs/dbraw/zinc/87/99/41/1135879941.db2.gz VRHYFPSMMBGMBT-UHFFFAOYSA-N 1 0 341.411 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOCC(F)(F)F)o2)cc1 ZINC001199094055 1135880741 /nfs/dbraw/zinc/88/07/41/1135880741.db2.gz UPABSJDBVPPGDA-UHFFFAOYSA-N 1 0 344.289 3.523 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC[C@@H]2COCC[C@H]21 ZINC000809954151 1135905829 /nfs/dbraw/zinc/90/58/29/1135905829.db2.gz QHUDKABSEGTORW-QMTHXVAHSA-N 1 0 345.226 3.903 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482897 1136091525 /nfs/dbraw/zinc/09/15/25/1136091525.db2.gz WQNMISQFJUQGPI-QWHCGFSZSA-N 1 0 346.258 3.864 20 5 EHBDRO CCC[C@@H](CCO)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811481853 1136091632 /nfs/dbraw/zinc/09/16/32/1136091632.db2.gz OMPYTPXBSUOJET-JTQLQIEISA-N 1 0 335.231 3.790 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCCCn1ccnc1 ZINC000811474935 1136096102 /nfs/dbraw/zinc/09/61/02/1136096102.db2.gz FVWCSYCPIOSQOQ-UHFFFAOYSA-N 1 0 343.214 3.668 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(O)CCCCC1 ZINC000811477425 1136096531 /nfs/dbraw/zinc/09/65/31/1136096531.db2.gz RBOZKEIOUNIUDJ-UHFFFAOYSA-N 1 0 333.215 3.686 20 5 EHBDRO C[N@H+](CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CCCC1 ZINC000811479083 1136096984 /nfs/dbraw/zinc/09/69/84/1136096984.db2.gz WMHUAHCVZWUWRF-UHFFFAOYSA-N 1 0 346.258 3.866 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811478960 1136097105 /nfs/dbraw/zinc/09/71/05/1136097105.db2.gz TXOPDHVBMPQEQU-SNVBAGLBSA-N 1 0 334.247 3.722 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3cccc(C)c23)cc1[N+](=O)[O-] ZINC000106469399 1136110110 /nfs/dbraw/zinc/11/01/10/1136110110.db2.gz QQHJFTQITADRMH-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO C[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1c1ccccc1 ZINC000776278074 1136131186 /nfs/dbraw/zinc/13/11/86/1136131186.db2.gz RPDXKWXPEPXDDR-CDHQVMDDSA-N 1 0 340.423 3.754 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812853796 1136262381 /nfs/dbraw/zinc/26/23/81/1136262381.db2.gz KGVWDAXGXDUWDJ-IFXJQAMLSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](O)c1cc(C)cc(C)c1 ZINC000850467730 1136265022 /nfs/dbraw/zinc/26/50/22/1136265022.db2.gz SDVRDHLYEJMZIW-KBXCAEBGSA-N 1 0 344.411 3.604 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000850472522 1136265974 /nfs/dbraw/zinc/26/59/74/1136265974.db2.gz JCLSFXVHPCWKSN-ZANVPECISA-N 1 0 333.215 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583167 1136441683 /nfs/dbraw/zinc/44/16/83/1136441683.db2.gz YPNOSGWVYQUSKZ-ZWKOTPCHSA-N 1 0 348.349 3.744 20 5 EHBDRO C[C@@H](Cc1ccc(Cl)cc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585346 1136442239 /nfs/dbraw/zinc/44/22/39/1136442239.db2.gz WASMTHCBEOFIGG-UGSOOPFHSA-N 1 0 348.830 3.845 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC000776582419 1136442380 /nfs/dbraw/zinc/44/23/80/1136442380.db2.gz QAGBUAICFGHAOT-FXAWDEMLSA-N 1 0 340.423 3.583 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585079 1136442450 /nfs/dbraw/zinc/44/24/50/1136442450.db2.gz SOJQKJJBLLGUMZ-BJZITVGISA-N 1 0 326.396 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591251 1136450982 /nfs/dbraw/zinc/45/09/82/1136450982.db2.gz IETFKUXXOIPIBY-RBUKOAKNSA-N 1 0 344.386 3.995 20 5 EHBDRO Cc1cccc(C2=CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000776596973 1136457958 /nfs/dbraw/zinc/45/79/58/1136457958.db2.gz BJICVOZIMAOMEV-FQEVSTJZSA-N 1 0 338.407 3.726 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Cl ZINC000776604314 1136465962 /nfs/dbraw/zinc/46/59/62/1136465962.db2.gz BJXARYKNWFNZHX-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606608 1136470327 /nfs/dbraw/zinc/47/03/27/1136470327.db2.gz YJSCDWIOZNNSBX-KSSFIOAISA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)Oc1cccc([C@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776605496 1136473619 /nfs/dbraw/zinc/47/36/19/1136473619.db2.gz LNEJEFRKJLTJAU-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)Oc1cccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776605493 1136473863 /nfs/dbraw/zinc/47/38/63/1136473863.db2.gz LNEJEFRKJLTJAU-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000217094855 1136487748 /nfs/dbraw/zinc/48/77/48/1136487748.db2.gz KESMQSQQKAEEOT-JQWIXIFHSA-N 1 0 344.358 3.873 20 5 EHBDRO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000853618902 1136549444 /nfs/dbraw/zinc/54/94/44/1136549444.db2.gz OQWZVURJABSUPL-YPMHNXCESA-N 1 0 325.359 3.595 20 5 EHBDRO Cc1cc(Cl)c(C(=O)OCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000815405592 1136592718 /nfs/dbraw/zinc/59/27/18/1136592718.db2.gz BIGSCACWHQZFOW-UHFFFAOYSA-N 1 0 340.807 3.589 20 5 EHBDRO Cc1cccc(C)c1OCC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567518 1136611786 /nfs/dbraw/zinc/61/17/86/1136611786.db2.gz BRXYIAPFJWDAEY-AWEZNQCLSA-N 1 0 329.400 3.523 20 5 EHBDRO Cc1cc(C)cc(OCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815568823 1136612261 /nfs/dbraw/zinc/61/22/61/1136612261.db2.gz VYRLCOHWUKDWSN-CQSZACIVSA-N 1 0 329.400 3.523 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740095 1136619976 /nfs/dbraw/zinc/61/99/76/1136619976.db2.gz IEXHTURWYJIJHP-KJUJZPGYSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@@H]([NH2+][C@H](CCO)c1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626531 1136620801 /nfs/dbraw/zinc/62/08/01/1136620801.db2.gz GMECIVRALUKRJI-BDJLRTHQSA-N 1 0 349.818 3.605 20 5 EHBDRO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCCC[C@H]32)cc1[N+](=O)[O-] ZINC000776774784 1136661235 /nfs/dbraw/zinc/66/12/35/1136661235.db2.gz OKJBUSBDADPSKT-RCCFBDPRSA-N 1 0 340.427 3.715 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000776815346 1136698856 /nfs/dbraw/zinc/69/88/56/1136698856.db2.gz IXQRXLGKHCJNRX-MEDUHNTESA-N 1 0 343.408 3.589 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000218479945 1136819235 /nfs/dbraw/zinc/81/92/35/1136819235.db2.gz AKNAZURMVWPHPE-KCQAQPDRSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000218478971 1136819285 /nfs/dbraw/zinc/81/92/85/1136819285.db2.gz YQKXGEKHLKTQKS-RVSPLBMKSA-N 1 0 333.432 3.646 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000858171186 1136946243 /nfs/dbraw/zinc/94/62/43/1136946243.db2.gz WINREUWDWOSCKY-LBPRGKRZSA-N 1 0 345.399 3.567 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000858321120 1136958581 /nfs/dbraw/zinc/95/85/81/1136958581.db2.gz SMBOFIUJJUDCJD-CQSZACIVSA-N 1 0 348.786 3.740 20 5 EHBDRO C[C@H](C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)(C)C ZINC000780764111 1136958771 /nfs/dbraw/zinc/95/87/71/1136958771.db2.gz IXJTXUKPYYMXTB-CJNGLKHVSA-N 1 0 330.432 3.690 20 5 EHBDRO C[C@H]([NH2+]CC1(C(F)(F)F)CCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858568556 1136979157 /nfs/dbraw/zinc/97/91/57/1136979157.db2.gz OIACACQLURGUHB-JTQLQIEISA-N 1 0 331.338 3.950 20 5 EHBDRO Cc1ccc(-c2noc([C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)n2)cc1[N+](=O)[O-] ZINC000822722291 1137071681 /nfs/dbraw/zinc/07/16/81/1137071681.db2.gz DFNTVGKTJDIVMK-UBHSHLNASA-N 1 0 328.372 3.546 20 5 EHBDRO Cc1cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@H]4[NH2+]3)n2)cc([N+](=O)[O-])c1 ZINC000823270841 1137092523 /nfs/dbraw/zinc/09/25/23/1137092523.db2.gz VYWKXZGZCLSWPH-GLQYFDAESA-N 1 0 328.372 3.546 20 5 EHBDRO Cc1c(F)nccc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386280 1137141949 /nfs/dbraw/zinc/14/19/49/1137141949.db2.gz NWOGDGWHAHFELY-MRXNPFEDSA-N 1 0 329.375 3.817 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC[C@@H]1CCOC1 ZINC000825144149 1137167275 /nfs/dbraw/zinc/16/72/75/1137167275.db2.gz LUYZFUDFWAPOOG-SNVBAGLBSA-N 1 0 333.215 3.808 20 5 EHBDRO [NH3+][C@@H]1CCc2c3ccccc3n(-c3cc4cc[nH]c4c([N+](=O)[O-])c3)c2C1 ZINC001171094852 1137187089 /nfs/dbraw/zinc/18/70/89/1137187089.db2.gz QRKFHPWLGVYSIO-CYBMUJFWSA-N 1 0 346.390 3.836 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC000865501619 1137289438 /nfs/dbraw/zinc/28/94/38/1137289438.db2.gz CTWYIVJHFRLOJB-UHFFFAOYSA-N 1 0 332.231 3.868 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000865778867 1137310959 /nfs/dbraw/zinc/31/09/59/1137310959.db2.gz ZKIBUCBPHUIEPO-JMPLCFMRSA-N 1 0 330.428 3.795 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000865787711 1137311986 /nfs/dbraw/zinc/31/19/86/1137311986.db2.gz RLQXSWOEUWGMFO-OAHLLOKOSA-N 1 0 344.411 3.607 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc3c(c2)OCCCCO3)cc1[N+](=O)[O-] ZINC000865787453 1137312083 /nfs/dbraw/zinc/31/20/83/1137312083.db2.gz MWKAQXGVICPXDL-UHFFFAOYSA-N 1 0 342.395 3.744 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(C)(F)F ZINC000865789972 1137312145 /nfs/dbraw/zinc/31/21/45/1137312145.db2.gz CKUSPQQKJGDLFM-UHFFFAOYSA-N 1 0 338.301 3.967 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000866147127 1137331787 /nfs/dbraw/zinc/33/17/87/1137331787.db2.gz LXRBZSPLFKOQSM-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@]1(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C[C@]1(F)Cl ZINC000846185580 1137340534 /nfs/dbraw/zinc/34/05/34/1137340534.db2.gz SNIBEEDOHFGMAR-RJZRQDKASA-N 1 0 344.818 3.569 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@](C)(O)c1ccccc1 ZINC000846191299 1137340911 /nfs/dbraw/zinc/34/09/11/1137340911.db2.gz XOIADQDQWYXZBL-GKCIPKSASA-N 1 0 340.423 3.858 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC12CCOCC2 ZINC000866528891 1137361529 /nfs/dbraw/zinc/36/15/29/1137361529.db2.gz JZWWLRHKCSKTEZ-DOTOQJQBSA-N 1 0 332.444 3.712 20 5 EHBDRO COCCOc1ccc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866538541 1137362927 /nfs/dbraw/zinc/36/29/27/1137362927.db2.gz BYSCENTUAWEWIH-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000866539928 1137363148 /nfs/dbraw/zinc/36/31/48/1137363148.db2.gz HVLMJEMTQACRIA-OAHLLOKOSA-N 1 0 327.340 3.589 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000715138462 1137476192 /nfs/dbraw/zinc/47/61/92/1137476192.db2.gz UVAGRAGAKPIUBG-NFAWXSAZSA-N 1 0 349.431 3.549 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(c2cccc(F)c2)CCC1 ZINC001171435394 1137482042 /nfs/dbraw/zinc/48/20/42/1137482042.db2.gz KEKWTYZVVDRTDF-UHFFFAOYSA-N 1 0 330.359 3.782 20 5 EHBDRO CCC(=O)c1ccc(N2CCC[C@H]2C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000795141457 1137507164 /nfs/dbraw/zinc/50/71/64/1137507164.db2.gz WQBREVWGYOURNY-INIZCTEOSA-N 1 0 345.443 3.642 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020789 1137565061 /nfs/dbraw/zinc/56/50/61/1137565061.db2.gz KKPINGGUGNTMOU-GJZGRUSLSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027404 1137566001 /nfs/dbraw/zinc/56/60/01/1137566001.db2.gz JKXOKLAVIGJGFL-LBPRGKRZSA-N 1 0 342.374 3.894 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](C)Cn1ccnc1C ZINC000872030724 1137566368 /nfs/dbraw/zinc/56/63/68/1137566368.db2.gz BCSVSEVUDWRDDI-OLZOCXBDSA-N 1 0 348.472 3.809 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1cc(C)n[nH]1 ZINC000872049628 1137567752 /nfs/dbraw/zinc/56/77/52/1137567752.db2.gz UHWNETMYKFWAGM-ZYHUDNBSSA-N 1 0 334.445 3.630 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872088463 1137570570 /nfs/dbraw/zinc/57/05/70/1137570570.db2.gz OWXBWGBOBUASNS-IGCXYCKISA-N 1 0 332.375 3.549 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000872128315 1137572942 /nfs/dbraw/zinc/57/29/42/1137572942.db2.gz KNPALFQYKYCGHW-BYNSBNAKSA-N 1 0 334.416 3.613 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](C[C@@H](C)O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000873080051 1137589593 /nfs/dbraw/zinc/58/95/93/1137589593.db2.gz ZYNNZZSBBDWYOS-KDOFPFPSSA-N 1 0 328.412 3.548 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1c(F)cccc1Cl ZINC000877082108 1137669906 /nfs/dbraw/zinc/66/99/06/1137669906.db2.gz WBDAMRMALIOFJS-WHXUTIOJSA-N 1 0 338.770 3.638 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]CCCCCc3ccc(F)cc3)C2)c1 ZINC000877436544 1137676276 /nfs/dbraw/zinc/67/62/76/1137676276.db2.gz IKZWBLVCKKVVDV-UHFFFAOYSA-N 1 0 346.406 3.637 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2CC=CC[C@H]2C(F)(F)F)cc1 ZINC000877729161 1137686895 /nfs/dbraw/zinc/68/68/95/1137686895.db2.gz NTWDHGWIMJGBLB-DZGCQCFKSA-N 1 0 328.334 3.872 20 5 EHBDRO CC(C)[C@@H](C)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928034 1137695959 /nfs/dbraw/zinc/69/59/59/1137695959.db2.gz KVYOFSRPLBIKSI-SNVBAGLBSA-N 1 0 338.795 3.775 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419432 1137715108 /nfs/dbraw/zinc/71/51/08/1137715108.db2.gz FDTGRPKWLDKNLW-DZGCQCFKSA-N 1 0 344.415 3.949 20 5 EHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878688752 1137725056 /nfs/dbraw/zinc/72/50/56/1137725056.db2.gz PZEQHQUHUZVELU-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCCC[C@H]2C2CCC2)o1 ZINC000878771857 1137727775 /nfs/dbraw/zinc/72/77/75/1137727775.db2.gz XXADHGIQHSROFB-HNNXBMFYSA-N 1 0 342.399 3.799 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC1CC[NH+](C(C)C)CC1 ZINC000879228488 1137741547 /nfs/dbraw/zinc/74/15/47/1137741547.db2.gz JIKHCSRXRNLNDV-UHFFFAOYSA-N 1 0 348.447 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(CC[NH+](C)C)cc2)c1C ZINC000888780161 1137753109 /nfs/dbraw/zinc/75/31/09/1137753109.db2.gz JYZFDZQUBFVHQH-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO Cc1cncc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000879747626 1137757598 /nfs/dbraw/zinc/75/75/98/1137757598.db2.gz OIJNAAZFNUTKSR-INIZCTEOSA-N 1 0 327.384 3.514 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000882963539 1137839943 /nfs/dbraw/zinc/83/99/43/1137839943.db2.gz BQVZAJVYTOIFOB-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)c2c(F)cccc2F)C2CC2)cc1 ZINC000130709162 1137841284 /nfs/dbraw/zinc/84/12/84/1137841284.db2.gz FLZKMFJTCYMOJQ-QGZVFWFLSA-N 1 0 348.349 3.571 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)F ZINC000883251862 1137850642 /nfs/dbraw/zinc/85/06/42/1137850642.db2.gz GUUSUKIFRORVPY-UHFFFAOYSA-N 1 0 338.301 3.967 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)[C@@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000883352162 1137857031 /nfs/dbraw/zinc/85/70/31/1137857031.db2.gz USLMFKYTBLYQMH-NUEKZKHPSA-N 1 0 336.432 3.849 20 5 EHBDRO C[C@H]([NH3+])c1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000429560644 1137883994 /nfs/dbraw/zinc/88/39/94/1137883994.db2.gz RJYJTKZEQYTWJM-LBPRGKRZSA-N 1 0 327.384 3.531 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348319325 1137949112 /nfs/dbraw/zinc/94/91/12/1137949112.db2.gz LDLNCMQRTFFKIS-NSHDSACASA-N 1 0 333.413 3.508 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccnc3ccc([N+](=O)[O-])cc32)CC1 ZINC000884716747 1137970860 /nfs/dbraw/zinc/97/08/60/1137970860.db2.gz HYLTUTNJFFSHEN-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])[C@@H](C)C2CC2)cc1 ZINC000885964925 1138029052 /nfs/dbraw/zinc/02/90/52/1138029052.db2.gz GVCHCHBAVVKSOQ-AWEZNQCLSA-N 1 0 341.411 3.799 20 5 EHBDRO CC(=O)Nc1cccc(C[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000060574711 1138067051 /nfs/dbraw/zinc/06/70/51/1138067051.db2.gz PIGVLCKTGJKVEY-UHFFFAOYSA-N 1 0 341.411 3.964 20 5 EHBDRO C[C@@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000886707416 1138120420 /nfs/dbraw/zinc/12/04/20/1138120420.db2.gz HQABYGNAESPKLV-CRAIPNDOSA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090728412 1138213160 /nfs/dbraw/zinc/21/31/60/1138213160.db2.gz QPMOKRNXXALDTQ-SJKOYZFVSA-N 1 0 343.427 3.914 20 5 EHBDRO C[C@H]([N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1(C)CC1 ZINC000091900253 1138222692 /nfs/dbraw/zinc/22/26/92/1138222692.db2.gz IFXDVSHYRFGGML-ZDUSSCGKSA-N 1 0 328.416 3.616 20 5 EHBDRO CCC[NH+]1CCC(N(C)C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000127794619 1138371371 /nfs/dbraw/zinc/37/13/71/1138371371.db2.gz UVPSWWIYYQRCOY-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc3c(c2)CC(C)(C)O3)cc1[N+](=O)[O-] ZINC000264392425 1138499075 /nfs/dbraw/zinc/49/90/75/1138499075.db2.gz SLWSVYBMKNZMTI-UHFFFAOYSA-N 1 0 342.395 3.607 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(OCC3CC3)nc2)cccc1[N+](=O)[O-] ZINC000131339709 1138511331 /nfs/dbraw/zinc/51/13/31/1138511331.db2.gz HUXAUJUSPMYTEP-AWEZNQCLSA-N 1 0 341.411 3.938 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)cs1 ZINC000337310979 1138528179 /nfs/dbraw/zinc/52/81/79/1138528179.db2.gz WEGJBTSYMLGKMR-UHFFFAOYSA-N 1 0 333.388 3.999 20 5 EHBDRO COC1CC[NH+](C2(CNc3ccc([N+](=O)[O-])c(C)c3)CCCC2)CC1 ZINC000338288408 1138817312 /nfs/dbraw/zinc/81/73/12/1138817312.db2.gz SCXVTFCNZLSTBT-UHFFFAOYSA-N 1 0 347.459 3.739 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153750202 1139150978 /nfs/dbraw/zinc/15/09/78/1139150978.db2.gz GQFIYOVMVJDOFD-KBXCAEBGSA-N 1 0 344.411 3.686 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314751 1139585189 /nfs/dbraw/zinc/58/51/89/1139585189.db2.gz WEIPAKFDUHJCKM-HGDQPMEPSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000178643627 1139709404 /nfs/dbraw/zinc/70/94/04/1139709404.db2.gz MTXMXMSZELCOFC-NSHDSACASA-N 1 0 348.786 3.870 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500579 1139760518 /nfs/dbraw/zinc/76/05/18/1139760518.db2.gz FGHSMVRJFPVCSV-DOMZBBRYSA-N 1 0 341.415 3.531 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@H]12 ZINC000182489622 1139975894 /nfs/dbraw/zinc/97/58/94/1139975894.db2.gz NZSRKSJTHQZOJM-WQVCFCJDSA-N 1 0 342.399 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192972140 1140557607 /nfs/dbraw/zinc/55/76/07/1140557607.db2.gz SLTVPAZFZXURIX-KRWDZBQOSA-N 1 0 327.340 3.670 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193049977 1140561722 /nfs/dbraw/zinc/56/17/22/1140561722.db2.gz SBXFUNHJZHNDEA-SFHVURJKSA-N 1 0 342.443 3.620 20 5 EHBDRO C[C@H]1C[C@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000193466556 1140577271 /nfs/dbraw/zinc/57/72/71/1140577271.db2.gz QSFUNHPZOXRQHC-WMLDXEAASA-N 1 0 340.427 3.642 20 5 EHBDRO CSC1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000193655381 1140581952 /nfs/dbraw/zinc/58/19/52/1140581952.db2.gz HHUAJUPQYPUGPO-UHFFFAOYSA-N 1 0 335.454 3.704 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268804940 1140995864 /nfs/dbraw/zinc/99/58/64/1140995864.db2.gz FHVBVXMTLCKFQC-HNNXBMFYSA-N 1 0 345.365 3.662 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CSCCc3ccccc32)cc1[N+](=O)[O-] ZINC000268842531 1141005521 /nfs/dbraw/zinc/00/55/21/1141005521.db2.gz RBYTWIRABWQYQC-MRXNPFEDSA-N 1 0 344.436 3.724 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000268994917 1141041563 /nfs/dbraw/zinc/04/15/63/1141041563.db2.gz NGKHNYMUTFZBRD-DOTOQJQBSA-N 1 0 328.412 3.720 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](CO)CC1 ZINC000271134108 1141311982 /nfs/dbraw/zinc/31/19/82/1141311982.db2.gz MOSUAUXACZJKKA-KKUMJFAQSA-N 1 0 338.473 3.606 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271512413 1141385049 /nfs/dbraw/zinc/38/50/49/1141385049.db2.gz STPOZRGGFBOENV-QZTJIDSGSA-N 1 0 332.375 3.898 20 5 EHBDRO Cc1nnc([C@H](C)[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238781 1141488243 /nfs/dbraw/zinc/48/82/43/1141488243.db2.gz QNIHOKAUECYERX-CORIIIEPSA-N 1 0 346.456 3.817 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc3ccc4ccc(Cl)nc4c3n2)C1 ZINC001165039506 721891828 /nfs/dbraw/zinc/89/18/28/721891828.db2.gz MTJZVCOXCGAWHS-HNNXBMFYSA-N 1 0 340.858 3.967 20 5 EHBDRO CC[NH+](CC)C1CCN(c2cc(C)c3cc([N+](=O)[O-])ccc3n2)CC1 ZINC001165052681 722001271 /nfs/dbraw/zinc/00/12/71/722001271.db2.gz CEWSZVIVGOOSHB-UHFFFAOYSA-N 1 0 342.443 3.762 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000537971319 1032071169 /nfs/dbraw/zinc/07/11/69/1032071169.db2.gz ISTIYZWBSNLZOD-CQSZACIVSA-N 1 0 343.427 3.910 20 5 EHBDRO CCCCC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C(C)C ZINC000753914429 1014683614 /nfs/dbraw/zinc/68/36/14/1014683614.db2.gz GAYVVTQWDCCGQW-UHFFFAOYSA-N 1 0 339.411 3.963 20 5 EHBDRO COc1ccc(-c2ccncc2)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000187136176 1014874724 /nfs/dbraw/zinc/87/47/24/1014874724.db2.gz PLZAPNKPNDNYSU-UHFFFAOYSA-N 1 0 349.390 3.955 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCCC[C@@H]2C(C)C)cccc1[N+](=O)[O-] ZINC000577914329 1014922378 /nfs/dbraw/zinc/92/23/78/1014922378.db2.gz PUTWVYRSAFMHAJ-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C(C1CC1)C1CC1 ZINC000162148795 1032121864 /nfs/dbraw/zinc/12/18/64/1032121864.db2.gz UEHAMPNIZGGWLD-UHFFFAOYSA-N 1 0 325.206 3.636 20 5 EHBDRO CCc1nn(C)c(CC)c1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000154467930 1016035799 /nfs/dbraw/zinc/03/57/99/1016035799.db2.gz XKLRPHIYHDJHDC-UHFFFAOYSA-N 1 0 344.459 3.864 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H]1CCO ZINC000275145594 1016094988 /nfs/dbraw/zinc/09/49/88/1016094988.db2.gz UGNYDZRTFKUALJ-RBSFLKMASA-N 1 0 338.473 3.606 20 5 EHBDRO Cc1cc(NC[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000311211009 1016398019 /nfs/dbraw/zinc/39/80/19/1016398019.db2.gz PCTBCYAEXHAYHY-LJQANCHMSA-N 1 0 340.427 3.622 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000066696076 1016413988 /nfs/dbraw/zinc/41/39/88/1016413988.db2.gz ZDNHTVMKKVLPJN-MRXNPFEDSA-N 1 0 332.425 3.838 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000177965120 1016497327 /nfs/dbraw/zinc/49/73/27/1016497327.db2.gz IXCQRQJIOAEEMN-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCc3c2cccc3Cl)c1[N+](=O)[O-] ZINC000892679957 1016571654 /nfs/dbraw/zinc/57/16/54/1016571654.db2.gz KJZMXMMZEGVENQ-CQSZACIVSA-N 1 0 348.786 3.740 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CS1 ZINC000414497058 1016941647 /nfs/dbraw/zinc/94/16/47/1016941647.db2.gz JOGMNYVXJDLFPB-ZYHUDNBSSA-N 1 0 335.454 3.702 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](O)C(C)C ZINC000414536822 1016964054 /nfs/dbraw/zinc/96/40/54/1016964054.db2.gz YHLZVAIECMNOHV-CVEARBPZSA-N 1 0 349.456 3.603 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449071761 1032159586 /nfs/dbraw/zinc/15/95/86/1032159586.db2.gz OMYSDCWDVJKJLL-ZIAGYGMSSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000449077018 1032166667 /nfs/dbraw/zinc/16/66/67/1032166667.db2.gz QOYHBSOOYFERSA-SJORKVTESA-N 1 0 339.439 3.642 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000449108046 1032188122 /nfs/dbraw/zinc/18/81/22/1032188122.db2.gz SAVWBDGMGFOZQC-YJBOKZPZSA-N 1 0 345.443 3.792 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1cnn(C)c1)C(C)(C)C ZINC000449176343 1032268412 /nfs/dbraw/zinc/26/84/12/1032268412.db2.gz MPTJEJBNQDSOJR-CXAGYDPISA-N 1 0 330.432 3.636 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000536829273 1032308527 /nfs/dbraw/zinc/30/85/27/1032308527.db2.gz XFFYDYISCIDNHO-RMRDIRSESA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC1=CCCCC1 ZINC000237494177 1032317315 /nfs/dbraw/zinc/31/73/15/1032317315.db2.gz QPVZULDCVSZYIV-CQSZACIVSA-N 1 0 331.416 3.792 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cc(COC(C)(C)C)on1 ZINC000449255156 1032362831 /nfs/dbraw/zinc/36/28/31/1032362831.db2.gz BDWNSQDVTRHRKJ-CYBMUJFWSA-N 1 0 347.415 3.619 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2c(O)cccc21 ZINC000449278348 1032397463 /nfs/dbraw/zinc/39/74/63/1032397463.db2.gz IVJDHZWCXYZDNY-DYVFJYSZSA-N 1 0 326.396 3.899 20 5 EHBDRO CC1(C)CCC[C@@](O)(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783733523 1032431899 /nfs/dbraw/zinc/43/18/99/1032431899.db2.gz IEPAVSYCPPWOOC-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CN(C)C)c1ccc(F)cc1 ZINC000449329703 1032441172 /nfs/dbraw/zinc/44/11/72/1032441172.db2.gz IYTCLTOXUYBEGL-KBXCAEBGSA-N 1 0 345.418 3.557 20 5 EHBDRO COC[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000449479359 1032603334 /nfs/dbraw/zinc/60/33/34/1032603334.db2.gz MDMBCUMWTIRXKC-HNNXBMFYSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCCC[NH2+]C3)o2)c(Cl)c1 ZINC000415065926 1017485912 /nfs/dbraw/zinc/48/59/12/1017485912.db2.gz HWXAOFPBGDPCSY-GFCCVEGCSA-N 1 0 349.818 3.740 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C/c1cccc([N+](=O)[O-])c1 ZINC000177316391 1017605252 /nfs/dbraw/zinc/60/52/52/1017605252.db2.gz KOOPBSYVKSBUEZ-MDZDMXLPSA-N 1 0 339.395 3.617 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000415583180 1018252092 /nfs/dbraw/zinc/25/20/92/1018252092.db2.gz QLYXGRVQDZYEND-ZDUSSCGKSA-N 1 0 342.399 3.553 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)Cc1cccc(O)c1 ZINC000468632063 1018549631 /nfs/dbraw/zinc/54/96/31/1018549631.db2.gz VIHLBDSWYUFKJG-HNRFISLBSA-N 1 0 326.396 3.925 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000122703278 1018570471 /nfs/dbraw/zinc/57/04/71/1018570471.db2.gz AVXHJTUINJHSDS-CQSZACIVSA-N 1 0 325.840 3.554 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000580212445 1018795156 /nfs/dbraw/zinc/79/51/56/1018795156.db2.gz MBGKNGNTHHDYCQ-MRXNPFEDSA-N 1 0 341.411 3.944 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433433 1019090795 /nfs/dbraw/zinc/09/07/95/1019090795.db2.gz JJJRSIYDRNRWIZ-WMZOPIPTSA-N 1 0 339.439 3.862 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2F)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178864620 1019321777 /nfs/dbraw/zinc/32/17/77/1019321777.db2.gz MFPZGDCMUNTSSG-VMDGZTHMSA-N 1 0 344.386 3.850 20 5 EHBDRO CC1CC[NH+](CCNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000614462429 1019333463 /nfs/dbraw/zinc/33/34/63/1019333463.db2.gz QBQKSDOITSGDDJ-UHFFFAOYSA-N 1 0 347.462 3.850 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182951625 1019868029 /nfs/dbraw/zinc/86/80/29/1019868029.db2.gz AVWQANPUKKMQHY-VXGBXAGGSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC2(C1)CCOCC2 ZINC000602483585 1032913655 /nfs/dbraw/zinc/91/36/55/1032913655.db2.gz MYLJBGJYVGDJGA-UHFFFAOYSA-N 1 0 344.333 3.616 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](C)O ZINC000513703172 1020635202 /nfs/dbraw/zinc/63/52/02/1020635202.db2.gz RIARMZNYAZXZTC-ZDUSSCGKSA-N 1 0 334.441 3.915 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602499180 1032925284 /nfs/dbraw/zinc/92/52/84/1032925284.db2.gz OBPAJXMRNWUEOV-OAHLLOKOSA-N 1 0 340.427 3.618 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1(CCO)CCCCC1)C1CC1 ZINC000165604480 1020778919 /nfs/dbraw/zinc/77/89/19/1020778919.db2.gz RWOPHBVWXBZNKU-SFHVURJKSA-N 1 0 346.471 3.838 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc(OC)c([N+](=O)[O-])c3)C2)c1 ZINC000449616675 1032940577 /nfs/dbraw/zinc/94/05/77/1032940577.db2.gz FBWGNLAZMXMUFU-WKILWMFISA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1cccc(O[C@H](C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602548666 1032956787 /nfs/dbraw/zinc/95/67/87/1032956787.db2.gz UVTACBWGVNDXEB-CYBMUJFWSA-N 1 0 341.367 3.602 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])s1)[NH+]1CCCC1 ZINC000610514190 1021157694 /nfs/dbraw/zinc/15/76/94/1021157694.db2.gz KIQVVOAWNLKDPP-AWEZNQCLSA-N 1 0 347.440 3.914 20 5 EHBDRO Cc1cccc(OC[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602526476 1032958372 /nfs/dbraw/zinc/95/83/72/1032958372.db2.gz JVTYTYODMSAWFM-ZDUSSCGKSA-N 1 0 341.367 3.602 20 5 EHBDRO CCN1CCCC[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000518450808 1021190767 /nfs/dbraw/zinc/19/07/67/1021190767.db2.gz WMUILWHLUICTOJ-QGZVFWFLSA-N 1 0 343.427 3.819 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000157879319 1021370419 /nfs/dbraw/zinc/37/04/19/1021370419.db2.gz JGNDSRGICDQKLU-ZDUSSCGKSA-N 1 0 346.431 3.584 20 5 EHBDRO COc1c(C)cc(C[N@H+](C)CCc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507618634 1021404390 /nfs/dbraw/zinc/40/43/90/1021404390.db2.gz WIIAVULMCVHFBO-UHFFFAOYSA-N 1 0 328.412 3.895 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1c(F)cccc1[N+](=O)[O-] ZINC000506564519 1021405725 /nfs/dbraw/zinc/40/57/25/1021405725.db2.gz UXGNKLLOVYMERQ-HNNXBMFYSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2C)[NH+](C)C)c1 ZINC000097262013 1021641277 /nfs/dbraw/zinc/64/12/77/1021641277.db2.gz MDTJFJBZLOWBLK-GOSISDBHSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@H]4CCC[C@@H]43)o2)c1 ZINC000426485341 1021688690 /nfs/dbraw/zinc/68/86/90/1021688690.db2.gz JDJHGYABTPFXGD-CJNGLKHVSA-N 1 0 327.384 3.667 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)OCCCO2 ZINC000090909859 1021698062 /nfs/dbraw/zinc/69/80/62/1021698062.db2.gz PKIQFYHAMPJHFJ-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]3OCC[C@H]32)c2cc([N+](=O)[O-])ccc21 ZINC000519861140 1021736080 /nfs/dbraw/zinc/73/60/80/1021736080.db2.gz IOHLRIHRTFBUPX-NBMRYCAZSA-N 1 0 330.428 3.864 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NCCC[N@@H+]1CCc2ccccc2C1 ZINC000506037651 1021752647 /nfs/dbraw/zinc/75/26/47/1021752647.db2.gz UQPYCOGUEHPFLJ-UHFFFAOYSA-N 1 0 329.375 3.594 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610538844 1021807982 /nfs/dbraw/zinc/80/79/82/1021807982.db2.gz VGXZBDQGBPPRER-IUODEOHRSA-N 1 0 347.365 3.803 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCO[C@@H](c3ccccc3)C2)cc1 ZINC000602614906 1033009993 /nfs/dbraw/zinc/00/99/93/1033009993.db2.gz AVTPYTYVZCYRDS-PKOBYXMFSA-N 1 0 326.396 3.647 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(Cl)cc1 ZINC000517044463 1021977156 /nfs/dbraw/zinc/97/71/56/1021977156.db2.gz CBNAYZFDAQSXLQ-QZTJIDSGSA-N 1 0 345.830 3.783 20 5 EHBDRO CC[C@@](C)(COc1ncccc1Cl)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000441306993 1022141603 /nfs/dbraw/zinc/14/16/03/1022141603.db2.gz KUEPYYCATSKLJE-KRWDZBQOSA-N 1 0 349.818 3.981 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)n1 ZINC000178236919 1022249556 /nfs/dbraw/zinc/24/95/56/1022249556.db2.gz VPEOTBVGWDMZPF-BBRMVZONSA-N 1 0 346.456 3.855 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562065 1022344103 /nfs/dbraw/zinc/34/41/03/1022344103.db2.gz SEEODPMZTORROK-AATOQMJSSA-N 1 0 340.379 3.730 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000237160491 1022424560 /nfs/dbraw/zinc/42/45/60/1022424560.db2.gz AEIJURWKNADNGA-KRWDZBQOSA-N 1 0 333.819 3.641 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC[C@H]1C ZINC000517722934 1022598102 /nfs/dbraw/zinc/59/81/02/1022598102.db2.gz HWCUTLJXQGKXTL-QLFBSQMISA-N 1 0 338.473 3.728 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOc2ccccc2)cc1[N+](=O)[O-] ZINC000152585571 1033074586 /nfs/dbraw/zinc/07/45/86/1033074586.db2.gz FWZJVONGYHPSHT-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)CC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000548389665 1022774883 /nfs/dbraw/zinc/77/48/83/1022774883.db2.gz PRGQDBVPHZLDTL-OAHLLOKOSA-N 1 0 347.459 3.735 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](CCCO)[C@H]2CCc3ccccc32)cc1 ZINC000510652596 1022839497 /nfs/dbraw/zinc/83/94/97/1022839497.db2.gz SWJKBALHRQCPCF-FQEVSTJZSA-N 1 0 340.423 3.509 20 5 EHBDRO Cc1nn(C[N@@H+]2CCCC[C@H]2Cc2ccc(F)cc2)c(C)c1[N+](=O)[O-] ZINC000729471718 1023115626 /nfs/dbraw/zinc/11/56/26/1023115626.db2.gz GCOSQKRKWUVCIQ-KRWDZBQOSA-N 1 0 346.406 3.602 20 5 EHBDRO CC(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000536389829 1023183587 /nfs/dbraw/zinc/18/35/87/1023183587.db2.gz HWJGUCPWWKYEBJ-UHFFFAOYSA-N 1 0 340.427 3.577 20 5 EHBDRO CCN(CCOc1ccccc1[N+](=O)[O-])Cc1c(F)cccc1F ZINC000507263902 1023218056 /nfs/dbraw/zinc/21/80/56/1023218056.db2.gz PWRXMXHVISHMPT-UHFFFAOYSA-N 1 0 336.338 3.774 20 5 EHBDRO C[NH+](C)CC1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC000891884041 1023242695 /nfs/dbraw/zinc/24/26/95/1023242695.db2.gz SKNBNDOJUAZFIL-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCCO1 ZINC000506476600 1023249774 /nfs/dbraw/zinc/24/97/74/1023249774.db2.gz IOBIMOFEFKUBAZ-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](Cc3cccs3)CC2)cc1 ZINC000060874271 1033127782 /nfs/dbraw/zinc/12/77/82/1033127782.db2.gz YAYNTPWTTMXVAM-UHFFFAOYSA-N 1 0 331.441 3.980 20 5 EHBDRO Cc1c(NC(=O)N(C)CCCC[NH+]2CCCCC2)cccc1[N+](=O)[O-] ZINC000602763746 1033133191 /nfs/dbraw/zinc/13/31/91/1033133191.db2.gz SILLWVKOLYZHIU-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)CC2CCCC2)cc1[N+](=O)[O-] ZINC000510944349 1023525985 /nfs/dbraw/zinc/52/59/85/1023525985.db2.gz JLORAVFSXGDMRL-CZUORRHYSA-N 1 0 336.432 3.585 20 5 EHBDRO C[C@](O)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000588467872 1023562022 /nfs/dbraw/zinc/56/20/22/1023562022.db2.gz DRMSEMSATKPWHM-YEODSOHDSA-N 1 0 346.814 3.759 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H]4COCC[C@H]43)o2)c1 ZINC000535801268 1023647431 /nfs/dbraw/zinc/64/74/31/1023647431.db2.gz GFPMOJHYYBTBHI-CRAIPNDOSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C2CCN(C(=O)C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000610799323 1023681877 /nfs/dbraw/zinc/68/18/77/1023681877.db2.gz RVNNSQKPCSLAJK-CQSZACIVSA-N 1 0 347.459 3.591 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000610810304 1023696484 /nfs/dbraw/zinc/69/64/84/1023696484.db2.gz AZQZEDHWJRFJDC-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1[C@H]1CCCO1 ZINC000342051338 1023804275 /nfs/dbraw/zinc/80/42/75/1023804275.db2.gz SIZFQDAPMZQEKY-FUHWJXTLSA-N 1 0 334.416 3.525 20 5 EHBDRO NC(=O)c1ccc(C[N@@H+]2CCC[C@@H]2CC2CCCCC2)c([N+](=O)[O-])c1 ZINC000060892867 1033176445 /nfs/dbraw/zinc/17/64/45/1033176445.db2.gz JCKAOHHSQNBFOO-QGZVFWFLSA-N 1 0 345.443 3.629 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000895227698 1024011857 /nfs/dbraw/zinc/01/18/57/1024011857.db2.gz QDLSIPHFEBAKQU-AWEZNQCLSA-N 1 0 348.786 3.870 20 5 EHBDRO Cn1cc(C[NH2+]C(C)(C)c2ccc(C(C)(C)C)cc2)c([N+](=O)[O-])n1 ZINC000602806909 1033179944 /nfs/dbraw/zinc/17/99/44/1033179944.db2.gz QYDSMENTULLBFU-UHFFFAOYSA-N 1 0 330.432 3.651 20 5 EHBDRO CC(C)[C@@H]([NH3+])CCN(C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000236783749 1024127012 /nfs/dbraw/zinc/12/70/12/1024127012.db2.gz QTKOAOZIBHRKQL-IBGZPJMESA-N 1 0 335.451 3.833 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCCN1C1CC1 ZINC000434789211 1024427649 /nfs/dbraw/zinc/42/76/49/1024427649.db2.gz MKTLNDCRAKGUNQ-HVEPWOEZSA-N 1 0 329.444 3.605 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H](CO)CC1CCCC1 ZINC000511010830 1024433181 /nfs/dbraw/zinc/43/31/81/1024433181.db2.gz KJIDANJTZLISEW-UHOSZYNNSA-N 1 0 346.471 3.837 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000380677271 1024435870 /nfs/dbraw/zinc/43/58/70/1024435870.db2.gz OUUNGGKQDFMRRA-TWOQFEAHSA-N 1 0 339.439 3.908 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000425246238 1024504461 /nfs/dbraw/zinc/50/44/61/1024504461.db2.gz XZQZSDSYDMJXFN-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000895658151 1024695679 /nfs/dbraw/zinc/69/56/79/1024695679.db2.gz IDCJCQICACGPKC-QCSXQHJISA-N 1 0 326.396 3.710 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000539079138 1024741164 /nfs/dbraw/zinc/74/11/64/1024741164.db2.gz ITCVGSZCXMNHMW-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000342292383 1024751982 /nfs/dbraw/zinc/75/19/82/1024751982.db2.gz ZGLLIFJQKUWJFM-KEDPEKRHSA-N 1 0 346.814 3.627 20 5 EHBDRO C[C@H]1C[C@H]([NH3+])CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000514946164 1024905193 /nfs/dbraw/zinc/90/51/93/1024905193.db2.gz BYSGAORBLGWFDM-NWDGAFQWSA-N 1 0 349.818 3.820 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346608290 1024946917 /nfs/dbraw/zinc/94/69/17/1024946917.db2.gz PEWDRAOJZHFCDF-MAUKXSAKSA-N 1 0 332.400 3.590 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000539225111 1024969705 /nfs/dbraw/zinc/96/97/05/1024969705.db2.gz KNFHYHOSAKVFDE-RHSMWYFYSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H](c1cc(F)ccc1F)N(C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520846004 1025080973 /nfs/dbraw/zinc/08/09/73/1025080973.db2.gz NMSCTZIXBZZLBQ-LBPRGKRZSA-N 1 0 336.338 3.945 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCc3ccco3)o2)c([N+](=O)[O-])c1 ZINC000520955848 1025137093 /nfs/dbraw/zinc/13/70/93/1025137093.db2.gz ZGJNPPKYNNDXGR-UHFFFAOYSA-N 1 0 342.351 3.789 20 5 EHBDRO Cc1ccccc1C[N@H+](CCOc1ccccc1[N+](=O)[O-])C1CC1 ZINC000521198903 1025271663 /nfs/dbraw/zinc/27/16/63/1025271663.db2.gz UBERJWOULNUUOT-UHFFFAOYSA-N 1 0 326.396 3.947 20 5 EHBDRO COc1cc(NC2CCC(C)([NH+]3CCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000896256273 1025287493 /nfs/dbraw/zinc/28/74/93/1025287493.db2.gz VJXCFOFUOROPAE-UHFFFAOYSA-N 1 0 337.395 3.561 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000934334243 1025507066 /nfs/dbraw/zinc/50/70/66/1025507066.db2.gz UIYFFZSXAPYMGB-KBPBESRZSA-N 1 0 331.441 3.985 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121057002 1025620795 /nfs/dbraw/zinc/62/07/95/1025620795.db2.gz BCTYOOSJPPJNRL-GDBMZVCRSA-N 1 0 341.411 3.971 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525705 1025677517 /nfs/dbraw/zinc/67/75/17/1025677517.db2.gz PNHNFEHRJNCMCX-INIZCTEOSA-N 1 0 343.427 3.771 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)OC(C)C ZINC000185718407 1025688901 /nfs/dbraw/zinc/68/89/01/1025688901.db2.gz AMQASYDVRPXTNJ-IBGZPJMESA-N 1 0 344.411 3.859 20 5 EHBDRO CN1C[C@@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000436413282 1025692625 /nfs/dbraw/zinc/69/26/25/1025692625.db2.gz NPGYEZUDWMFCEY-YXMGTMDOSA-N 1 0 337.423 3.506 20 5 EHBDRO CC(=O)c1ccc(N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000439128819 1025789039 /nfs/dbraw/zinc/78/90/39/1025789039.db2.gz PKKNKPZHMUKKLE-ORAYPTAESA-N 1 0 341.411 3.901 20 5 EHBDRO CCC[C@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000522136707 1026017034 /nfs/dbraw/zinc/01/70/34/1026017034.db2.gz OSUKRNVGFBQCRQ-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO CO[C@@]1(C)C[C@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000451490104 1026033651 /nfs/dbraw/zinc/03/36/51/1026033651.db2.gz OLPHBNZNNAQIGH-YJBOKZPZSA-N 1 0 345.399 3.543 20 5 EHBDRO C[NH+]1CCC(N(Cc2ccccc2)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000342528731 1026109422 /nfs/dbraw/zinc/10/94/22/1026109422.db2.gz VTNHEMDPLVGUJL-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141481 1026233750 /nfs/dbraw/zinc/23/37/50/1026233750.db2.gz WCQGTNDXSBZOFG-BEBFYNPSSA-N 1 0 340.423 3.798 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1C[C@H](C)C[C@H](C)C1 ZINC000023991490 1026773146 /nfs/dbraw/zinc/77/31/46/1026773146.db2.gz WJPWEVOCOHKVPV-TUAOUCFPSA-N 1 0 339.823 3.553 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000563418286 1026790664 /nfs/dbraw/zinc/79/06/64/1026790664.db2.gz NVLNIOWGVDTDBA-SCLBCKFNSA-N 1 0 349.394 3.514 20 5 EHBDRO CC(C)c1ccc(CN[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520200572 1027078296 /nfs/dbraw/zinc/07/82/96/1027078296.db2.gz CPVROQRQISIXSF-HZPDHXFCSA-N 1 0 333.476 3.928 20 5 EHBDRO COc1ccc(C[NH2+]C2(Cc3ccccc3)CCC2)cc1[N+](=O)[O-] ZINC000531609247 1027084758 /nfs/dbraw/zinc/08/47/58/1027084758.db2.gz BMQYHRDIGPIPCC-UHFFFAOYSA-N 1 0 326.396 3.858 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000473537107 1027112551 /nfs/dbraw/zinc/11/25/51/1027112551.db2.gz ZMDRRIXSYUYVKJ-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC[C@@H]([NH2+]CCc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000186475364 1027367024 /nfs/dbraw/zinc/36/70/24/1027367024.db2.gz ADOXUVRLUYMDND-QGZVFWFLSA-N 1 0 338.411 3.765 20 5 EHBDRO C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]2CCCC[C@H]12 ZINC000548761146 1027408141 /nfs/dbraw/zinc/40/81/41/1027408141.db2.gz GJBLRZRYKSEPTP-INMHGKMJSA-N 1 0 345.443 3.824 20 5 EHBDRO C[C@H]1C[NH+](Cc2cccc(Nc3ccccc3[N+](=O)[O-])c2)C[C@H](C)O1 ZINC000523113351 1027764954 /nfs/dbraw/zinc/76/49/54/1027764954.db2.gz MGZUXELTCHZHPQ-GJZGRUSLSA-N 1 0 341.411 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@H](C4CCCC4)C3)o2)cc1 ZINC000420963898 1027933482 /nfs/dbraw/zinc/93/34/82/1027933482.db2.gz OPERNAAHVNPTSL-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H](CC(F)F)c1ccccc1 ZINC000420998106 1027976851 /nfs/dbraw/zinc/97/68/51/1027976851.db2.gz SXQDNABGEMLTDY-AWEZNQCLSA-N 1 0 336.338 3.960 20 5 EHBDRO CC[C@@](O)(CCC(F)(F)F)C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000897519344 1028033433 /nfs/dbraw/zinc/03/34/33/1028033433.db2.gz RDXGZUFBQCDYQV-DZGCQCFKSA-N 1 0 346.349 3.655 20 5 EHBDRO CC[C@](O)(CCC(F)(F)F)C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000897519347 1028034083 /nfs/dbraw/zinc/03/40/83/1028034083.db2.gz RDXGZUFBQCDYQV-ZFWWWQNUSA-N 1 0 346.349 3.655 20 5 EHBDRO C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495058 1028089081 /nfs/dbraw/zinc/08/90/81/1028089081.db2.gz NZIJVPZOMSCUAQ-OLZOCXBDSA-N 1 0 346.818 3.891 20 5 EHBDRO C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495060 1028089189 /nfs/dbraw/zinc/08/91/89/1028089189.db2.gz NZIJVPZOMSCUAQ-STQMWFEESA-N 1 0 346.818 3.891 20 5 EHBDRO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@@H]1CCCC[C@H]1C ZINC000444667681 1028139566 /nfs/dbraw/zinc/13/95/66/1028139566.db2.gz YYNKLRLIPJNARU-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCC[C@H]1C ZINC000444679068 1028147764 /nfs/dbraw/zinc/14/77/64/1028147764.db2.gz SYBJJNCKUPWGIM-DYVFJYSZSA-N 1 0 333.432 3.742 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCOCC2 ZINC000248992745 1028160473 /nfs/dbraw/zinc/16/04/73/1028160473.db2.gz LJWJOSPUCDWIJR-ZTFGCOKTSA-N 1 0 348.443 3.528 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000137212366 1028196883 /nfs/dbraw/zinc/19/68/83/1028196883.db2.gz OQWNRBCHTACTGF-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO COC(=O)c1cc([C@@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375317 1028197024 /nfs/dbraw/zinc/19/70/24/1028197024.db2.gz GVHMPKIVRJBYOK-GHMZBOCLSA-N 1 0 332.356 3.695 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCCC1(O)CCC1 ZINC000421374933 1028333962 /nfs/dbraw/zinc/33/39/62/1028333962.db2.gz FTLVGGRZHRHOSS-WBVHZDCISA-N 1 0 332.444 3.591 20 5 EHBDRO CCCC[C@H](C[NH3+])N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423304401 1028357315 /nfs/dbraw/zinc/35/73/15/1028357315.db2.gz YRAHKPJFUVAIAG-IEBWSBKVSA-N 1 0 327.428 3.791 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000421388721 1028362092 /nfs/dbraw/zinc/36/20/92/1028362092.db2.gz QIYPNNHPEJKNDD-HOCLYGCPSA-N 1 0 330.384 3.902 20 5 EHBDRO COC[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000582956679 1028367330 /nfs/dbraw/zinc/36/73/30/1028367330.db2.gz LXGGUHJSJDLOOT-IBGZPJMESA-N 1 0 328.412 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2N2CCCCC2)cc1 ZINC000729682284 1028412164 /nfs/dbraw/zinc/41/21/64/1028412164.db2.gz LTPFKNCFILZBGQ-UHFFFAOYSA-N 1 0 339.439 3.917 20 5 EHBDRO CCc1ccccc1[C@@H](N)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505222 1028470388 /nfs/dbraw/zinc/47/03/88/1028470388.db2.gz OCHUTDGQJMZGDA-KSSFIOAISA-N 1 0 327.428 3.816 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC000582999305 1028490017 /nfs/dbraw/zinc/49/00/17/1028490017.db2.gz HCXFNNVXKMZBLU-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC2(CCOCC2)[C@H]1C(C)C ZINC000414526632 1028500259 /nfs/dbraw/zinc/50/02/59/1028500259.db2.gz LLHGRXDTXZQQQL-GOSISDBHSA-N 1 0 348.443 3.631 20 5 EHBDRO COc1ccc(C[N@H+](CCc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000523670126 1028512789 /nfs/dbraw/zinc/51/27/89/1028512789.db2.gz MISYREMNUSLWIF-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@@H]([NH2+]CCCN1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000324127482 1028522512 /nfs/dbraw/zinc/52/25/12/1028522512.db2.gz HSMSIXDDYBUJGC-OAHLLOKOSA-N 1 0 325.412 3.698 20 5 EHBDRO Cc1ccc(Cl)cc1NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000137255294 1028526227 /nfs/dbraw/zinc/52/62/27/1028526227.db2.gz CWVVNIUVSOMYPT-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000421752133 1028752679 /nfs/dbraw/zinc/75/26/79/1028752679.db2.gz QCHPECXNPZBCAC-MRXNPFEDSA-N 1 0 347.459 3.596 20 5 EHBDRO CCC[NH+](CCC)CCCc1nc(-c2ccc([N+](=O)[O-])s2)no1 ZINC000445483775 1028843157 /nfs/dbraw/zinc/84/31/57/1028843157.db2.gz WSOGANRVTOAOCL-UHFFFAOYSA-N 1 0 338.433 3.761 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000504899138 1029027973 /nfs/dbraw/zinc/02/79/73/1029027973.db2.gz BFDDQOUVEYHAOL-HNNXBMFYSA-N 1 0 335.448 3.520 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@H](O)C1 ZINC000504905768 1029049698 /nfs/dbraw/zinc/04/96/98/1029049698.db2.gz NOWMLWQNYGYDFE-KFWWJZLASA-N 1 0 338.473 3.606 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000504911323 1029052244 /nfs/dbraw/zinc/05/22/44/1029052244.db2.gz DTPOKLWSMGJLFH-OAHLLOKOSA-N 1 0 349.475 3.909 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCn1cnc2ccccc21 ZINC000161555737 1029236562 /nfs/dbraw/zinc/23/65/62/1029236562.db2.gz YRTIHWGKCDZUSJ-OAHLLOKOSA-N 1 0 338.411 3.994 20 5 EHBDRO CSCC[C@@H](C)[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000126523506 1029741037 /nfs/dbraw/zinc/74/10/37/1029741037.db2.gz VWYXLPHKLIKWFS-CYBMUJFWSA-N 1 0 349.456 3.866 20 5 EHBDRO C[C@@H]1[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1c1ccccc1 ZINC000446848002 1029816537 /nfs/dbraw/zinc/81/65/37/1029816537.db2.gz CVZLEWACHFLIHZ-YLQAJVPDSA-N 1 0 336.395 3.753 20 5 EHBDRO C[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1 ZINC000446854916 1029833239 /nfs/dbraw/zinc/83/32/39/1029833239.db2.gz DLTGUWHXOVFNBT-NSHDSACASA-N 1 0 328.347 3.504 20 5 EHBDRO CC[NH+](CC)[C@H](c1nc(-c2ccc([N+](=O)[O-])o2)no1)c1ccccc1 ZINC000453252528 1029980855 /nfs/dbraw/zinc/98/08/55/1029980855.db2.gz HACCFDXEJLBHMR-HNNXBMFYSA-N 1 0 342.355 3.669 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000520307478 1030056183 /nfs/dbraw/zinc/05/61/83/1030056183.db2.gz CKGILRYZLBFEFY-QGZVFWFLSA-N 1 0 345.399 3.836 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453318882 1030096677 /nfs/dbraw/zinc/09/66/77/1030096677.db2.gz MEZBVTYBFFTMFO-ZTNFWEORSA-N 1 0 346.471 3.957 20 5 EHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159432466 1030188945 /nfs/dbraw/zinc/18/89/45/1030188945.db2.gz SQJGNNQAJJMTIN-ZDUSSCGKSA-N 1 0 327.222 3.978 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447513081 1030260339 /nfs/dbraw/zinc/26/03/39/1030260339.db2.gz SOFRRUCLHNFPER-HYVNUMGLSA-N 1 0 328.416 3.668 20 5 EHBDRO CC(C)([NH2+]CCCc1ccc2c(c1)CCO2)c1ccc([N+](=O)[O-])cc1 ZINC000482252895 1030291118 /nfs/dbraw/zinc/29/11/18/1030291118.db2.gz CURZTNASMSRTJW-UHFFFAOYSA-N 1 0 340.423 3.987 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000447563164 1030308216 /nfs/dbraw/zinc/30/82/16/1030308216.db2.gz OPFFXSYXSUOKDT-KBRIMQKVSA-N 1 0 346.406 3.807 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@H]3CCC[C@H]3C2)n1 ZINC000447563379 1030309256 /nfs/dbraw/zinc/30/92/56/1030309256.db2.gz PQZLMLWLMPNODL-BPKGMFCQSA-N 1 0 332.448 3.833 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447576691 1030339179 /nfs/dbraw/zinc/33/91/79/1030339179.db2.gz ZMHFOQPPQCJCLC-KSSFIOAISA-N 1 0 332.444 3.751 20 5 EHBDRO CC(C)[N@H+](CCc1nccs1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000159830346 1030385049 /nfs/dbraw/zinc/38/50/49/1030385049.db2.gz ASHYSRMAOAWSRC-UHFFFAOYSA-N 1 0 346.412 3.646 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2c(c1)OCO2 ZINC000527039094 1030587180 /nfs/dbraw/zinc/58/71/80/1030587180.db2.gz UJVHGEIZDHQGBT-NTEUORMPSA-N 1 0 340.379 3.559 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607401 1030749784 /nfs/dbraw/zinc/74/97/84/1030749784.db2.gz OSCIMSKGPUCKGO-IUODEOHRSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H](CO)C1CCCCC1)C1CC1 ZINC000550896271 1030778502 /nfs/dbraw/zinc/77/85/02/1030778502.db2.gz ZUYXWATZUTWYJH-MOPGFXCFSA-N 1 0 346.471 3.694 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000026207668 1031001196 /nfs/dbraw/zinc/00/11/96/1031001196.db2.gz MPETWIJSCVZCBP-HNNXBMFYSA-N 1 0 341.411 3.671 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000483340553 1031128174 /nfs/dbraw/zinc/12/81/74/1031128174.db2.gz KVHQGZVPPYLDNM-HNAYVOBHSA-N 1 0 348.443 3.624 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](CO)C1CCCCC1)CCC2 ZINC000551271967 1031182981 /nfs/dbraw/zinc/18/29/81/1031182981.db2.gz HIFPNVMUXLIUGC-LPHOPBHVSA-N 1 0 332.444 3.751 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@@H]3CC3(F)F)cs2)c1 ZINC000598647458 1033364491 /nfs/dbraw/zinc/36/44/91/1033364491.db2.gz MMFZUENCXBDAJG-LLVKDONJSA-N 1 0 339.367 3.853 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccccc1 ZINC000063482859 1033391304 /nfs/dbraw/zinc/39/13/04/1033391304.db2.gz GKMMZXRECCOHMF-OAHLLOKOSA-N 1 0 341.411 3.925 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494524 1033396711 /nfs/dbraw/zinc/39/67/11/1033396711.db2.gz CAMYCALXMKLKBS-QMTHXVAHSA-N 1 0 338.367 3.515 20 5 EHBDRO Cc1ccc(C[NH2+]C2CCN(Cc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000061003351 1033418403 /nfs/dbraw/zinc/41/84/03/1033418403.db2.gz YBSWUNJPIMSHBX-UHFFFAOYSA-N 1 0 339.439 3.657 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN[C@@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000611935355 1033438396 /nfs/dbraw/zinc/43/83/96/1033438396.db2.gz UMHINXNIGJJJFX-IBGZPJMESA-N 1 0 339.439 3.912 20 5 EHBDRO CCOc1ccc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(C)c1 ZINC000594921027 1033547595 /nfs/dbraw/zinc/54/75/95/1033547595.db2.gz PDOCJSMRKUZODN-UHFFFAOYSA-N 1 0 330.384 3.600 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC23CCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000593645366 1033573949 /nfs/dbraw/zinc/57/39/49/1033573949.db2.gz KWFQUJFAXQMRAW-UHFFFAOYSA-N 1 0 326.400 3.514 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cccc(OC3CC3)c2F)c1 ZINC000594934708 1033586480 /nfs/dbraw/zinc/58/64/80/1033586480.db2.gz FMUKPYFGQZRAMQ-UHFFFAOYSA-N 1 0 330.359 3.607 20 5 EHBDRO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)s1 ZINC000598954337 1033609315 /nfs/dbraw/zinc/60/93/15/1033609315.db2.gz BTSGVFNOFFAEOE-UHFFFAOYSA-N 1 0 348.424 3.901 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CC[NH+](C2CCCC2)CC1 ZINC000595015066 1033610198 /nfs/dbraw/zinc/61/01/98/1033610198.db2.gz WWVUSVDHLMSCAN-AWEZNQCLSA-N 1 0 347.459 3.661 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccnc1N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000595064119 1033641626 /nfs/dbraw/zinc/64/16/26/1033641626.db2.gz CXDBXYPIAPMAPS-GOSISDBHSA-N 1 0 340.427 3.831 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595071401 1033646215 /nfs/dbraw/zinc/64/62/15/1033646215.db2.gz YNMBCONHSCLJDT-RDTXWAMCSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCO[C@H](C(C)C)C1 ZINC000595040270 1033659790 /nfs/dbraw/zinc/65/97/90/1033659790.db2.gz FUZXKXGKHPWZDU-ZQIUZPCESA-N 1 0 336.432 3.705 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN1CCC[N@H+](CC2CCCCC2)CC1 ZINC000059424679 1033660304 /nfs/dbraw/zinc/66/03/04/1033660304.db2.gz SNVVRMVUWRDVGP-UHFFFAOYSA-N 1 0 331.460 3.683 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CC(CF)(CF)C2)cc(C(F)(F)F)c1 ZINC000595045612 1033663377 /nfs/dbraw/zinc/66/33/77/1033663377.db2.gz OHZDEYCSQBLJMG-UHFFFAOYSA-N 1 0 338.276 3.791 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCSCC2)cc(C(F)(F)F)c1 ZINC000595045597 1033663519 /nfs/dbraw/zinc/66/35/19/1033663519.db2.gz ODOHETIXWUQYHJ-GFCCVEGCSA-N 1 0 334.363 3.989 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccn1 ZINC000595051501 1033667998 /nfs/dbraw/zinc/66/79/98/1033667998.db2.gz VMLWRDRBQBAQMM-KBXCAEBGSA-N 1 0 325.412 3.704 20 5 EHBDRO COCc1ccccc1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122023951 1033671286 /nfs/dbraw/zinc/67/12/86/1033671286.db2.gz XVLXBUCRCOXIKR-LJQANCHMSA-N 1 0 340.423 3.852 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)[C@H](C)c1ccccc1 ZINC000595098167 1033689364 /nfs/dbraw/zinc/68/93/64/1033689364.db2.gz BKLMBQNFPMTJGF-QINHECLXSA-N 1 0 342.439 3.670 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC1(C)C ZINC000595107655 1033693254 /nfs/dbraw/zinc/69/32/54/1033693254.db2.gz PDLOEAFOJRKQID-ZIAGYGMSSA-N 1 0 338.473 3.870 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081590 1033697244 /nfs/dbraw/zinc/69/72/44/1033697244.db2.gz SMNLMMRBTQRECB-HUUCEWRRSA-N 1 0 347.459 3.661 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000595084705 1033698702 /nfs/dbraw/zinc/69/87/02/1033698702.db2.gz HZJVCVFHWGDSHY-ZYSHUDEJSA-N 1 0 342.443 3.780 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@H]1CCCOC1 ZINC000599059612 1033698849 /nfs/dbraw/zinc/69/88/49/1033698849.db2.gz ZOGNPTJMJLEFMK-SOLBZPMBSA-N 1 0 332.444 3.712 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(C(F)(F)F)cnn1C ZINC000599061020 1033699957 /nfs/dbraw/zinc/69/99/57/1033699957.db2.gz NBKJOTLCXLPHKJ-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)OC)c1 ZINC000599062861 1033702574 /nfs/dbraw/zinc/70/25/74/1033702574.db2.gz VXJYFXQKNTUBLP-IFXJQAMLSA-N 1 0 344.411 3.950 20 5 EHBDRO Cc1ncccc1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599072284 1033714141 /nfs/dbraw/zinc/71/41/41/1033714141.db2.gz AJGSJUHLTVGAGS-YJBOKZPZSA-N 1 0 325.412 3.799 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599098553 1033732411 /nfs/dbraw/zinc/73/24/11/1033732411.db2.gz LTVIQWIUMRDFHY-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1noc(C[NH2+][C@H]2CCCC[C@H]2Oc2cccc(C)c2)c1[N+](=O)[O-] ZINC000595447684 1033815712 /nfs/dbraw/zinc/81/57/12/1033815712.db2.gz IFYVLKMQTXKTNY-JKSUJKDBSA-N 1 0 345.399 3.679 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000593017931 1033816947 /nfs/dbraw/zinc/81/69/47/1033816947.db2.gz DKYLVXSUCXUZRI-QGZVFWFLSA-N 1 0 342.395 3.931 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](c3ccccn3)C2)ccc1[N+](=O)[O-] ZINC000595502827 1033833196 /nfs/dbraw/zinc/83/31/96/1033833196.db2.gz NZWRDGCFJWINQV-MRXNPFEDSA-N 1 0 341.411 3.768 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C2CC2)C2CCOCC2)cc1[N+](=O)[O-] ZINC000593716719 1033839115 /nfs/dbraw/zinc/83/91/15/1033839115.db2.gz RUVJDUOJTPKOOL-BFUOFWGJSA-N 1 0 348.443 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2COc3ccccc3C2)cc1 ZINC000550700328 1033877546 /nfs/dbraw/zinc/87/75/46/1033877546.db2.gz FJIOKHXBLRCCEW-QGZVFWFLSA-N 1 0 326.396 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H]([C@@H]4CCCCO4)C3)nc2c1 ZINC000595788871 1033998413 /nfs/dbraw/zinc/99/84/13/1033998413.db2.gz KLCBQPZGWDYROW-CJNGLKHVSA-N 1 0 345.399 3.517 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]([C@@H]2CCCCO2)C1 ZINC000595791008 1034002703 /nfs/dbraw/zinc/00/27/03/1034002703.db2.gz SJIJELZLWRGSCJ-QAPCUYQASA-N 1 0 348.443 3.775 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450286720 1034023118 /nfs/dbraw/zinc/02/31/18/1034023118.db2.gz IUFLTFUQNVZLCX-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO CC1(C)C[NH2+]C[C@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001212181521 1034038146 /nfs/dbraw/zinc/03/81/46/1034038146.db2.gz KZUMMEOOCBQILQ-AWEZNQCLSA-N 1 0 345.406 3.546 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692813 1034098291 /nfs/dbraw/zinc/09/82/91/1034098291.db2.gz XXSUTATXMWCVRX-HSWBROFVSA-N 1 0 332.400 3.640 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NC1CC([NH+]2CCCCC2)C1 ZINC000596215995 1034122646 /nfs/dbraw/zinc/12/26/46/1034122646.db2.gz BUFPFKVZCBJYOV-UHFFFAOYSA-N 1 0 325.359 3.961 20 5 EHBDRO Cc1cc(N2CCC([NH2+]Cc3ccccc3)CC2)c([N+](=O)[O-])s1 ZINC000596251797 1034134795 /nfs/dbraw/zinc/13/47/95/1034134795.db2.gz YJTFGPRDEUJIKD-UHFFFAOYSA-N 1 0 331.441 3.723 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000596296320 1034147972 /nfs/dbraw/zinc/14/79/72/1034147972.db2.gz HAVCDQYUSYMCRZ-OCCSQVGLSA-N 1 0 325.359 3.961 20 5 EHBDRO CCCC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](C)c1ccccc1 ZINC000534133315 1034176877 /nfs/dbraw/zinc/17/68/77/1034176877.db2.gz FEFCJTOFZYSFLD-MRXNPFEDSA-N 1 0 343.427 3.620 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000450364060 1034178823 /nfs/dbraw/zinc/17/88/23/1034178823.db2.gz XIYQVCLNETXNLZ-HNNXBMFYSA-N 1 0 346.456 3.639 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000892431874 1034189507 /nfs/dbraw/zinc/18/95/07/1034189507.db2.gz YSOYDKAUMCPCOW-JTQLQIEISA-N 1 0 336.775 3.813 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)ccc1[N+](=O)[O-] ZINC000456268843 1034268242 /nfs/dbraw/zinc/26/82/42/1034268242.db2.gz SREIEFNPHHUTHX-SFHVURJKSA-N 1 0 339.395 3.704 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2cccnc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000604270582 1034311074 /nfs/dbraw/zinc/31/10/74/1034311074.db2.gz OFOJNTBTYDMHDZ-GOSISDBHSA-N 1 0 340.427 3.875 20 5 EHBDRO C[C@H](c1ccc(-c2cc([N+](=O)[O-])ccc2CCO)cc1)[NH+]1CCCC1 ZINC000596647485 1034346550 /nfs/dbraw/zinc/34/65/50/1034346550.db2.gz MWIPUMNGKRVIAV-OAHLLOKOSA-N 1 0 340.423 3.953 20 5 EHBDRO CC(C)(CNc1ccsc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000604432712 1034377434 /nfs/dbraw/zinc/37/74/34/1034377434.db2.gz VNXLWRNBYSQFIP-UHFFFAOYSA-N 1 0 331.441 3.905 20 5 EHBDRO CCC[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(OC)cc1 ZINC000604492976 1034399325 /nfs/dbraw/zinc/39/93/25/1034399325.db2.gz RTRFNOIHDVGFIM-UHFFFAOYSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000604532602 1034416667 /nfs/dbraw/zinc/41/66/67/1034416667.db2.gz AVTABHBGZFQFOJ-INIZCTEOSA-N 1 0 326.396 3.812 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCn2nccc21 ZINC000601321345 1034451903 /nfs/dbraw/zinc/45/19/03/1034451903.db2.gz PUXHRNJXDYUSMJ-ZIAGYGMSSA-N 1 0 346.456 3.787 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CNc2ccccc2C1 ZINC000593314732 1034627672 /nfs/dbraw/zinc/62/76/72/1034627672.db2.gz DFYSZVQOQMDPCQ-YOEHRIQHSA-N 1 0 325.412 3.542 20 5 EHBDRO CCC[N@H+](Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000179931148 1035048156 /nfs/dbraw/zinc/04/81/56/1035048156.db2.gz NDQFJWAKGRLSEW-UHFFFAOYSA-N 1 0 344.358 3.622 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)c(F)c1 ZINC000431664993 1035131530 /nfs/dbraw/zinc/13/15/30/1035131530.db2.gz CCEXNOOCCULMDU-CRAIPNDOSA-N 1 0 330.359 3.601 20 5 EHBDRO CC(C)[N@H+](C)CCCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581256255 1035482088 /nfs/dbraw/zinc/48/20/88/1035482088.db2.gz YDWCWHVAHRQZPV-AWEZNQCLSA-N 1 0 333.354 3.518 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NC[C@@H]1CCCC[N@H+]1CC(C)C ZINC000443386889 1035603707 /nfs/dbraw/zinc/60/37/07/1035603707.db2.gz NOXJWHYFXGQWCJ-INIZCTEOSA-N 1 0 348.447 3.535 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1Cc2ccccc2O1)C1CC1 ZINC000540766983 1035661412 /nfs/dbraw/zinc/66/14/12/1035661412.db2.gz LVYCGEZHKXEZOP-QZTJIDSGSA-N 1 0 338.407 3.509 20 5 EHBDRO CCC[N@H+](C)[C@H](CNc1ncc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000588061766 1035717641 /nfs/dbraw/zinc/71/76/41/1035717641.db2.gz RFOGMVXHUWMOKF-OAHLLOKOSA-N 1 0 349.822 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3cncc(Cl)c3)CC2)cc1 ZINC000582539653 1035861018 /nfs/dbraw/zinc/86/10/18/1035861018.db2.gz RDFRPUCSKOWRCL-UHFFFAOYSA-N 1 0 347.802 3.687 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1(C2CCC2)CCC1 ZINC000414172464 1035882906 /nfs/dbraw/zinc/88/29/06/1035882906.db2.gz FGHMAKNWXIXONR-CYBMUJFWSA-N 1 0 331.416 3.624 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CCNc1cnccn1 ZINC000760702157 1036002594 /nfs/dbraw/zinc/00/25/94/1036002594.db2.gz SSXNORDPIBCTEZ-UHFFFAOYSA-N 1 0 328.419 3.985 20 5 EHBDRO Cc1cc(N[C@@H]2CCO[C@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541191198 1036060667 /nfs/dbraw/zinc/06/06/67/1036060667.db2.gz SGXFLCQYBDUSOX-ACJLOTCBSA-N 1 0 343.427 3.879 20 5 EHBDRO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CCCC2)CC1 ZINC000582633115 1036069602 /nfs/dbraw/zinc/06/96/02/1036069602.db2.gz LNXKPRWRNIGHPK-AWEZNQCLSA-N 1 0 331.416 3.578 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](C4CC4)C3)co2)cc1 ZINC000588977548 1036206273 /nfs/dbraw/zinc/20/62/73/1036206273.db2.gz ASFASFAXHVCCHY-OAHLLOKOSA-N 1 0 327.384 3.872 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000589114181 1036259399 /nfs/dbraw/zinc/25/93/99/1036259399.db2.gz QIBYAHKKXMZDIL-UHFFFAOYSA-N 1 0 331.338 3.580 20 5 EHBDRO CCC(CC)[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CC1 ZINC000165364522 1036434660 /nfs/dbraw/zinc/43/46/60/1036434660.db2.gz IUZNKOKUTRXYAG-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@H](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541555017 1036447999 /nfs/dbraw/zinc/44/79/99/1036447999.db2.gz GULNGSZPEZWURU-INIZCTEOSA-N 1 0 342.443 3.863 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000541571975 1036463723 /nfs/dbraw/zinc/46/37/23/1036463723.db2.gz YBDWZESRWQKGEH-ZBFHGGJFSA-N 1 0 332.400 3.795 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133523 1036563736 /nfs/dbraw/zinc/56/37/36/1036563736.db2.gz DXBGFJMOFRBVPT-GFCCVEGCSA-N 1 0 342.342 3.579 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742946 1036600724 /nfs/dbraw/zinc/60/07/24/1036600724.db2.gz KHVSPHNMVGDLFF-MIGQKNRLSA-N 1 0 338.473 3.808 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464778441 1036773835 /nfs/dbraw/zinc/77/38/35/1036773835.db2.gz QBOFURIBEFVLSQ-SFHVURJKSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](CO)C2CCCCC2)c(Cl)c1 ZINC000590194597 1036796127 /nfs/dbraw/zinc/79/61/27/1036796127.db2.gz SABJPQDGTNTUGW-CQSZACIVSA-N 1 0 326.824 3.527 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000414349215 1036848335 /nfs/dbraw/zinc/84/83/35/1036848335.db2.gz PARTVEGLXSIZMP-YOEHRIQHSA-N 1 0 343.402 3.533 20 5 EHBDRO COc1cccc([C@@H]2C[C@H]2C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000414347656 1036858468 /nfs/dbraw/zinc/85/84/68/1036858468.db2.gz WTWOMIHVINSWSM-LJHODMEESA-N 1 0 340.423 3.928 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C[NH+]2CCCC2)c2ccccc2)n1 ZINC000541933351 1036859389 /nfs/dbraw/zinc/85/93/89/1036859389.db2.gz OKNJPWVWSBQFGN-KRWDZBQOSA-N 1 0 340.427 3.856 20 5 EHBDRO CCC[C@]1(C)CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC000464844078 1036885082 /nfs/dbraw/zinc/88/50/82/1036885082.db2.gz CYUWGYHMOSSUEX-GOSISDBHSA-N 1 0 333.432 3.826 20 5 EHBDRO CCC(CC)[N@H+](CCOC)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089892798 1036892015 /nfs/dbraw/zinc/89/20/15/1036892015.db2.gz PLQNBDFZDROBJQ-UHFFFAOYSA-N 1 0 347.415 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)cc1 ZINC000237744362 1036901711 /nfs/dbraw/zinc/90/17/11/1036901711.db2.gz XEZZUQXFKAYLFJ-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601499 1036963948 /nfs/dbraw/zinc/96/39/48/1036963948.db2.gz CMFLOQUQYJZZCG-BBRMVZONSA-N 1 0 328.416 3.515 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C[C@H](C)O ZINC000180601074 1036984286 /nfs/dbraw/zinc/98/42/86/1036984286.db2.gz YRPNWGWIWNQGAB-VCBZYWHSSA-N 1 0 328.412 3.681 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000590653747 1036993607 /nfs/dbraw/zinc/99/36/07/1036993607.db2.gz LZOVMRFTVMRSRP-TZMCWYRMSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1ccc2[nH]c(CNc3cc(C)[nH+]c4ccc([N+](=O)[O-])cc34)nc2c1 ZINC000542117706 1037094376 /nfs/dbraw/zinc/09/43/76/1037094376.db2.gz GBEKSIJOQIPIDV-UHFFFAOYSA-N 1 0 347.378 3.670 20 5 EHBDRO C[C@@H]1CCc2nc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)sc2C1 ZINC000152535151 1037207339 /nfs/dbraw/zinc/20/73/39/1037207339.db2.gz QXMXAFHCSJGUTP-GFCCVEGCSA-N 1 0 331.441 3.508 20 5 EHBDRO COc1cnccc1[C@@H](C)[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000188769414 1037211938 /nfs/dbraw/zinc/21/19/38/1037211938.db2.gz NOSWATYGOOUMNB-UONOGXRCSA-N 1 0 329.400 3.670 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800021 1037303769 /nfs/dbraw/zinc/30/37/69/1037303769.db2.gz PESJYSWBMYYIKQ-DIFFPNOSSA-N 1 0 336.338 3.566 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)Oc1ccc(F)cc1 ZINC000462738065 1037344287 /nfs/dbraw/zinc/34/42/87/1037344287.db2.gz KQZGJVDZFOZQHK-CYBMUJFWSA-N 1 0 348.374 3.690 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCC1 ZINC000271815987 1037359939 /nfs/dbraw/zinc/35/99/39/1037359939.db2.gz MBZNCOLXPGQQRL-GFCCVEGCSA-N 1 0 326.824 3.527 20 5 EHBDRO CC(C)CC[C@@H]1CCC[C@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000472612226 1037386972 /nfs/dbraw/zinc/38/69/72/1037386972.db2.gz QTZWBQQEVYRCHA-LSDHHAIUSA-N 1 0 333.432 3.728 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1OC ZINC000151583327 1037412423 /nfs/dbraw/zinc/41/24/23/1037412423.db2.gz BQGQLPRYISIBTK-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000532476385 1037466148 /nfs/dbraw/zinc/46/61/48/1037466148.db2.gz VKMATZBUGNGBBM-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO CSc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)cc2)c1 ZINC000029952244 1037479534 /nfs/dbraw/zinc/47/95/34/1037479534.db2.gz BMFISHWIVUURLB-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO CC1(C)[C@H](O)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000462868196 1037491387 /nfs/dbraw/zinc/49/13/87/1037491387.db2.gz AJQJXRJHPOVMNK-MRXNPFEDSA-N 1 0 332.425 3.669 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CCN(c3cc[nH+]cc3)CC2)c(Cl)c1 ZINC000540039107 1037509131 /nfs/dbraw/zinc/50/91/31/1037509131.db2.gz AQPSVAMZPNZHMN-UHFFFAOYSA-N 1 0 346.818 3.972 20 5 EHBDRO CCc1ccc([C@@H](NC[C@@H]2CCCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578055 1037514666 /nfs/dbraw/zinc/51/46/66/1037514666.db2.gz PUYIIQRLMNBUCR-KXBFYZLASA-N 1 0 343.427 3.571 20 5 EHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CCCCC1 ZINC000462923236 1037548076 /nfs/dbraw/zinc/54/80/76/1037548076.db2.gz FWYIEIIXNOLSAG-UHFFFAOYSA-N 1 0 343.374 3.873 20 5 EHBDRO CCCC[C@H]1CCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000491661753 1037610435 /nfs/dbraw/zinc/61/04/35/1037610435.db2.gz JJJZSJPFPCGXHU-WMLDXEAASA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000573576705 1037618376 /nfs/dbraw/zinc/61/83/76/1037618376.db2.gz MNTBXMBAMVWNGJ-HOTGVXAUSA-N 1 0 328.343 3.835 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000540150018 1037619318 /nfs/dbraw/zinc/61/93/18/1037619318.db2.gz CXFWFLGZZWEOOR-QKYXUNIQSA-N 1 0 339.439 3.999 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000540150019 1037620583 /nfs/dbraw/zinc/62/05/83/1037620583.db2.gz CXFWFLGZZWEOOR-QSFXBCCZSA-N 1 0 339.439 3.999 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)CCC[C@@H]1C ZINC000532571301 1037671049 /nfs/dbraw/zinc/67/10/49/1037671049.db2.gz LWZWJXVAISYVKV-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCC2 ZINC000760903753 1037696016 /nfs/dbraw/zinc/69/60/16/1037696016.db2.gz YBYBXNGCJKBIKF-VLIAUNLRSA-N 1 0 340.423 3.858 20 5 EHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587414 1037707585 /nfs/dbraw/zinc/70/75/85/1037707585.db2.gz ZHWWHSHKFOILSK-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC(C)C ZINC000046064921 1037740877 /nfs/dbraw/zinc/74/08/77/1037740877.db2.gz GYEFHVOFIHSGBR-UHFFFAOYSA-N 1 0 332.347 3.683 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]([C@H]1CC[C@H](O)CC1)[C@H]1C=CCCC1 ZINC000592131271 1037841748 /nfs/dbraw/zinc/84/17/48/1037841748.db2.gz VXUJZVDXNUWSHG-BZSNNMDCSA-N 1 0 330.428 3.809 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CCCCCF)[C@H]1CC[C@H](O)CC1 ZINC000592132829 1037849760 /nfs/dbraw/zinc/84/97/60/1037849760.db2.gz OCOYTWPBVNOCHB-QAQDUYKDSA-N 1 0 338.423 3.840 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+](C2CC2)C2CCCC2)cccc1[N+](=O)[O-] ZINC000103466263 1037899690 /nfs/dbraw/zinc/89/96/90/1037899690.db2.gz UDCYXKGXYMNRTH-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592529431 1038028246 /nfs/dbraw/zinc/02/82/46/1038028246.db2.gz ZIRDBJVHHPMVQO-AAGJOFLKSA-N 1 0 330.428 3.889 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000058563194 1038122584 /nfs/dbraw/zinc/12/25/84/1038122584.db2.gz HJGWOFMBIABQTA-UHFFFAOYSA-N 1 0 326.396 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[N@@H+]3CC[C@H](C4CC4)C3)cs2)c1 ZINC000538752998 1038517780 /nfs/dbraw/zinc/51/77/80/1038517780.db2.gz BXWZMEFSVFSRCO-AWEZNQCLSA-N 1 0 329.425 3.950 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000470180730 1038598754 /nfs/dbraw/zinc/59/87/54/1038598754.db2.gz RSRFRMUMSQTQIL-VHUCWBOISA-N 1 0 330.428 3.747 20 5 EHBDRO Cc1cc(N2CCC(C[NH+](C)C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461770799 1038601532 /nfs/dbraw/zinc/60/15/32/1038601532.db2.gz XKYFHUWUQSOHQP-UHFFFAOYSA-N 1 0 345.365 3.700 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+]CCC(C)(C)O)cc1[N+](=O)[O-] ZINC000479886551 1038865695 /nfs/dbraw/zinc/86/56/95/1038865695.db2.gz PSIUXQURJWSWMW-UHFFFAOYSA-N 1 0 343.427 3.613 20 5 EHBDRO COc1ccc(COc2ccc([C@H]3CCC[NH2+]3)cc2)cc1[N+](=O)[O-] ZINC000905619283 1039004739 /nfs/dbraw/zinc/00/47/39/1039004739.db2.gz UOXUAVVIFCFZOH-MRXNPFEDSA-N 1 0 328.368 3.607 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480064997 1039089680 /nfs/dbraw/zinc/08/96/80/1039089680.db2.gz UFKWSYXMUUHXSA-AWEZNQCLSA-N 1 0 333.432 3.577 20 5 EHBDRO C[C@@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)CO)c1ccccc1 ZINC000554283189 1039156924 /nfs/dbraw/zinc/15/69/24/1039156924.db2.gz LTWQNZYKMSEIJD-GJZGRUSLSA-N 1 0 346.402 3.720 20 5 EHBDRO COc1cc(C[N@H+](CCc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485567504 1039246666 /nfs/dbraw/zinc/24/66/66/1039246666.db2.gz HIHNHBLGNHNASM-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@@H](O)c1ccccc1 ZINC000728918106 1039391002 /nfs/dbraw/zinc/39/10/02/1039391002.db2.gz JEJBMXZAZXGMCD-MOPGFXCFSA-N 1 0 344.386 3.822 20 5 EHBDRO CCN(C)c1ccc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000480355450 1039466469 /nfs/dbraw/zinc/46/64/69/1039466469.db2.gz MBPNZANOWWAALH-UHFFFAOYSA-N 1 0 342.443 3.558 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccccc2OCC2CC2)cccc1[N+](=O)[O-] ZINC000480478093 1039583273 /nfs/dbraw/zinc/58/32/73/1039583273.db2.gz DPHSHOUMMGMGFC-UHFFFAOYSA-N 1 0 326.396 3.982 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)CCCC2 ZINC000417307856 1039659347 /nfs/dbraw/zinc/65/93/47/1039659347.db2.gz HNIKBWJAQFBYBC-PXNSSMCTSA-N 1 0 340.423 3.728 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOCC(F)(F)F)CCCC2 ZINC000417346718 1039708237 /nfs/dbraw/zinc/70/82/37/1039708237.db2.gz WCLWIOJYVWZAEI-CQSZACIVSA-N 1 0 332.322 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC[C@@H](CO)C1)CCCC2 ZINC000417353590 1039709781 /nfs/dbraw/zinc/70/97/81/1039709781.db2.gz XOBQTFDJFCOVDK-KHYOSLBOSA-N 1 0 332.444 3.751 20 5 EHBDRO O=C(CC[N@H+](Cc1cccs1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000027109482 1039896341 /nfs/dbraw/zinc/89/63/41/1039896341.db2.gz FRZJBZDBUYJZTA-UHFFFAOYSA-N 1 0 345.424 3.650 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192827560 1039944759 /nfs/dbraw/zinc/94/47/59/1039944759.db2.gz PSZPQTGZAHGQFE-YJYMSZOUSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](CCO)c2ccc(Cl)cc2)cc1 ZINC000347419680 1039964102 /nfs/dbraw/zinc/96/41/02/1039964102.db2.gz CMFXPJCELYWTMC-QGZVFWFLSA-N 1 0 334.803 3.504 20 5 EHBDRO CCCCC[N@H+](CCO)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845260 1040031866 /nfs/dbraw/zinc/03/18/66/1040031866.db2.gz JFGMOSOAULJPQR-UHFFFAOYSA-N 1 0 334.338 3.598 20 5 EHBDRO Cc1cc(N2CCC[C@H](OCC3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000489933759 1040245987 /nfs/dbraw/zinc/24/59/87/1040245987.db2.gz IFEICCQALKAQJZ-INIZCTEOSA-N 1 0 341.411 3.847 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1cccc(O)c1 ZINC000490065043 1040330909 /nfs/dbraw/zinc/33/09/09/1040330909.db2.gz DGKNWTAUYQUIJC-ZDUSSCGKSA-N 1 0 330.384 3.892 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000479570004 1040366039 /nfs/dbraw/zinc/36/60/39/1040366039.db2.gz WDQKNQZWBVGHTH-SFHVURJKSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2(O)CCCCC2)c2ccccc2)c1 ZINC000490179014 1040368586 /nfs/dbraw/zinc/36/85/86/1040368586.db2.gz UNICNKXETQBXPZ-IBGZPJMESA-N 1 0 340.423 3.969 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000481163577 1040414605 /nfs/dbraw/zinc/41/46/05/1040414605.db2.gz AFHIHBQLYDFIMG-PXNSSMCTSA-N 1 0 342.439 3.877 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCOC2)s1 ZINC000542301089 1040711730 /nfs/dbraw/zinc/71/17/30/1040711730.db2.gz RZYUJIXBSICJOZ-ZDUSSCGKSA-N 1 0 332.425 3.840 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2cnc3ccccc3n2)cc1 ZINC000600137978 1040712055 /nfs/dbraw/zinc/71/20/55/1040712055.db2.gz WJURRMIURKWXSQ-UHFFFAOYSA-N 1 0 336.395 3.651 20 5 EHBDRO CCC[NH+]1CCC(N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155870 1040938593 /nfs/dbraw/zinc/93/85/93/1040938593.db2.gz ZRXMXAKKYSYUOP-GOSISDBHSA-N 1 0 331.460 3.781 20 5 EHBDRO Cn1cc(C[NH2+]CCC(C)(C)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000555636923 1040939556 /nfs/dbraw/zinc/93/95/56/1040939556.db2.gz DMJKXHVAYYXIFY-UHFFFAOYSA-N 1 0 342.443 3.911 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCc3csc([N+](=O)[O-])c3)cccc21 ZINC000433205747 1041062886 /nfs/dbraw/zinc/06/28/86/1041062886.db2.gz GBHJBNUEXRLLMS-AWEZNQCLSA-N 1 0 333.413 3.654 20 5 EHBDRO CC1=CCN(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433225841 1041112411 /nfs/dbraw/zinc/11/24/11/1041112411.db2.gz DOKQVTXLFJRUGA-GOSISDBHSA-N 1 0 329.444 3.559 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](CO)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433233676 1041120939 /nfs/dbraw/zinc/12/09/39/1041120939.db2.gz POJXNUQHAYCYIX-BEFAXECRSA-N 1 0 340.423 3.510 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[N@@H+](C4CCCC4)CC3)ccc2c1 ZINC000077994927 1041160880 /nfs/dbraw/zinc/16/08/80/1041160880.db2.gz CPEQWBXGRCSOBH-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CC2(CCO)CCCC2)c2cc([N+](=O)[O-])ccc21 ZINC000433291303 1041228021 /nfs/dbraw/zinc/22/80/21/1041228021.db2.gz UIFTULBRKCEURE-KRWDZBQOSA-N 1 0 332.444 3.850 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c(C)o1 ZINC000433285386 1041237543 /nfs/dbraw/zinc/23/75/43/1041237543.db2.gz SFNMPVIJUMPZJV-KRWDZBQOSA-N 1 0 329.400 3.754 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CC1(C)C ZINC000419314211 1041251749 /nfs/dbraw/zinc/25/17/49/1041251749.db2.gz HOLVBZFZVWIMCZ-UONOGXRCSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CC1(C)C ZINC000419315166 1041276587 /nfs/dbraw/zinc/27/65/87/1041276587.db2.gz JIDMINXPSNGAFP-UONOGXRCSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(C)c1nnc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000893404242 1041757481 /nfs/dbraw/zinc/75/74/81/1041757481.db2.gz YZBGVMOXKWFNST-UHFFFAOYSA-N 1 0 340.836 3.555 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCNc2ccc(Br)cc2[N+](=O)[O-])C1 ZINC000108086459 1042009121 /nfs/dbraw/zinc/00/91/21/1042009121.db2.gz ILRYCXKYUWEKNW-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C(C)C)C1CCCC1 ZINC000108365179 1042047861 /nfs/dbraw/zinc/04/78/61/1042047861.db2.gz UBOQRUFTTMWKNC-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO CC[C@@H](C)C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000111253531 1042254306 /nfs/dbraw/zinc/25/43/06/1042254306.db2.gz HIZJUVAOCIPLJF-MNOVXSKESA-N 1 0 327.812 3.553 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181835835 1042549660 /nfs/dbraw/zinc/54/96/60/1042549660.db2.gz MZCUZFDHLMAMKD-CABCVRRESA-N 1 0 347.459 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ncc4n3CCCC4)CC2)cc1 ZINC000278879972 1042817457 /nfs/dbraw/zinc/81/74/57/1042817457.db2.gz MZOCIBUYPSOLAX-UHFFFAOYSA-N 1 0 340.427 3.507 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(-n3ccnc3)cc2)C2CC2)cc1 ZINC000343951397 1042930885 /nfs/dbraw/zinc/93/08/85/1042930885.db2.gz LFCBSWCZKQMCLK-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC000279411126 1044062922 /nfs/dbraw/zinc/06/29/22/1044062922.db2.gz DUGBDYNNZULVPX-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@H](C)c1ccccc1 ZINC000183356193 1125537942 /nfs/dbraw/zinc/53/79/42/1125537942.db2.gz KSXGAWXYRACGGD-GJZGRUSLSA-N 1 0 341.411 3.624 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000163223627 1125697006 /nfs/dbraw/zinc/69/70/06/1125697006.db2.gz YLHSAKVQJHLGOV-SMDDNHRTSA-N 1 0 339.823 3.745 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000183720589 1125742096 /nfs/dbraw/zinc/74/20/96/1125742096.db2.gz AHGZYCNEABRESZ-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000183739534 1125744540 /nfs/dbraw/zinc/74/45/40/1125744540.db2.gz LHWUMOYOXQTRAH-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283255 1127473607 /nfs/dbraw/zinc/47/36/07/1127473607.db2.gz PFKBJQOHBYXWMX-NEPJUHHUSA-N 1 0 341.839 3.943 20 5 EHBDRO CC[NH+](CC)CCCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000171980028 1127642281 /nfs/dbraw/zinc/64/22/81/1127642281.db2.gz PWMZVKZWEHRQDX-UHFFFAOYSA-N 1 0 349.456 3.661 20 5 EHBDRO Cc1ccnc(NC[C@@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415283 1127742535 /nfs/dbraw/zinc/74/25/35/1127742535.db2.gz LUXLRCNWWDHECX-XJKSGUPXSA-N 1 0 346.456 3.855 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C(C3CC3)C3CC3)cs2)c1 ZINC000172116080 1127748691 /nfs/dbraw/zinc/74/86/91/1127748691.db2.gz KIDCWBNOBHCOFK-UHFFFAOYSA-N 1 0 329.425 3.997 20 5 EHBDRO Cc1cc(NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)ncc1[N+](=O)[O-] ZINC000301421622 1127887844 /nfs/dbraw/zinc/88/78/44/1127887844.db2.gz FLFVVSJYGOMHEV-AWEZNQCLSA-N 1 0 328.416 3.840 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1cc(OC)ccc1[N+](=O)[O-])c1ccco1 ZINC000338654303 1127998343 /nfs/dbraw/zinc/99/83/43/1127998343.db2.gz IPDWVTCYCHVPRM-INIZCTEOSA-N 1 0 333.388 3.691 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478248 1131242559 /nfs/dbraw/zinc/24/25/59/1131242559.db2.gz XXRKYODHZIPQDE-RHSMWYFYSA-N 1 0 336.395 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCCC3)CC2)c2ncccc12 ZINC000301559730 1128496844 /nfs/dbraw/zinc/49/68/44/1128496844.db2.gz TYZOGLPWUWWORK-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301567437 1128498071 /nfs/dbraw/zinc/49/80/71/1128498071.db2.gz KBXQKMSBTKOTBV-WDEREUQCSA-N 1 0 342.237 3.642 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)cs1 ZINC000273377228 1128516663 /nfs/dbraw/zinc/51/66/63/1128516663.db2.gz GBNQZVRYAARVNC-GJZGRUSLSA-N 1 0 336.388 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000765848654 1128559493 /nfs/dbraw/zinc/55/94/93/1128559493.db2.gz KNQCOIXCJWZVJC-SJORKVTESA-N 1 0 332.787 3.559 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000554358211 1128640503 /nfs/dbraw/zinc/64/05/03/1128640503.db2.gz BFPGJRZUJXIBSH-UKRRQHHQSA-N 1 0 348.830 3.983 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123253733 1128735743 /nfs/dbraw/zinc/73/57/43/1128735743.db2.gz VBUYBISOJBIEKD-CABCVRRESA-N 1 0 328.412 3.928 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000338739709 1128803045 /nfs/dbraw/zinc/80/30/45/1128803045.db2.gz CVQMOFLISNROHZ-HNNXBMFYSA-N 1 0 343.349 3.536 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C[C@@H]1CC=CCC1 ZINC000162163345 1120197871 /nfs/dbraw/zinc/19/78/71/1120197871.db2.gz ZAXYAPNVORMSPV-LLVKDONJSA-N 1 0 325.206 3.803 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)c1 ZINC000172768899 1128919500 /nfs/dbraw/zinc/91/95/00/1128919500.db2.gz BUDNUENDICWMCJ-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494653209 1120719372 /nfs/dbraw/zinc/71/93/72/1120719372.db2.gz YMGVSARMSFTKBZ-GDBMZVCRSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000153331924 1120967140 /nfs/dbraw/zinc/96/71/40/1120967140.db2.gz NSXPQAVQNKGKRI-KDOFPFPSSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000153331805 1120967195 /nfs/dbraw/zinc/96/71/95/1120967195.db2.gz NSXPQAVQNKGKRI-KSSFIOAISA-N 1 0 343.427 3.557 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC001626016616 1120981491 /nfs/dbraw/zinc/98/14/91/1120981491.db2.gz WJUBDFNFGUMIKG-INIZCTEOSA-N 1 0 347.459 3.596 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000193503576 1121358270 /nfs/dbraw/zinc/35/82/70/1121358270.db2.gz KAHJRMGLJQUYKZ-SWLSCSKDSA-N 1 0 345.365 3.520 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCC[C@H](C)C1 ZINC000301075500 1121359064 /nfs/dbraw/zinc/35/90/64/1121359064.db2.gz FCUUQZBLNYAFTN-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(C)cc1 ZINC000194014238 1121752418 /nfs/dbraw/zinc/75/24/18/1121752418.db2.gz KIBOOLYXMFIDPW-KRWDZBQOSA-N 1 0 341.411 3.891 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000301104660 1121919919 /nfs/dbraw/zinc/91/99/19/1121919919.db2.gz VISRRSKIWGMOBN-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@H+](C)Cc1ccccc1 ZINC000301753106 1129034359 /nfs/dbraw/zinc/03/43/59/1129034359.db2.gz VYIOCCCOXUEYNZ-GFCCVEGCSA-N 1 0 334.807 3.576 20 5 EHBDRO COc1cccc(NC2CC[NH+](CC3CCCC3)CC2)c1[N+](=O)[O-] ZINC000302285408 1122205431 /nfs/dbraw/zinc/20/54/31/1122205431.db2.gz LPYGYDKAKIZQLI-UHFFFAOYSA-N 1 0 333.432 3.670 20 5 EHBDRO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)c(C)c1 ZINC000917151282 1122543771 /nfs/dbraw/zinc/54/37/71/1122543771.db2.gz KZPCFNPGWUQHDK-UHFFFAOYSA-N 1 0 328.412 3.860 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2c1cccc2O ZINC000130687508 1123182104 /nfs/dbraw/zinc/18/21/04/1123182104.db2.gz CFCCYPOJOJQQPR-GUYCJALGSA-N 1 0 326.396 3.899 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130744799 1123554332 /nfs/dbraw/zinc/55/43/32/1123554332.db2.gz LAXLRXJCQCVPFF-IBGZPJMESA-N 1 0 344.386 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(Oc3ccc(F)cc3)CC2)cc1 ZINC000609672539 1123639551 /nfs/dbraw/zinc/63/95/51/1123639551.db2.gz MFFUEFHAOANVFE-UHFFFAOYSA-N 1 0 344.386 3.820 20 5 EHBDRO Cc1csc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000618984008 1125257123 /nfs/dbraw/zinc/25/71/23/1125257123.db2.gz NZNXMCYMUCUUNT-OAHLLOKOSA-N 1 0 331.441 3.914 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@H]12 ZINC000182500294 1125316159 /nfs/dbraw/zinc/31/61/59/1125316159.db2.gz JXUAFBHIIUQWAD-WQVCFCJDSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccccc1Nc1cc[nH+]cc1 ZINC000619581841 1125367901 /nfs/dbraw/zinc/36/79/01/1125367901.db2.gz RWFJKLFBAOOKFJ-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(c2nccs2)CC1 ZINC000619611768 1125369925 /nfs/dbraw/zinc/36/99/25/1125369925.db2.gz AZVAHYRBHJVSEA-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000182947051 1125404301 /nfs/dbraw/zinc/40/43/01/1125404301.db2.gz SUHYITKDXIUBRL-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000619798686 1125407821 /nfs/dbraw/zinc/40/78/21/1125407821.db2.gz SROYOQCGLGXZSU-CLLJXQQHSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000078989326 1129220712 /nfs/dbraw/zinc/22/07/12/1129220712.db2.gz YFZSZBYULWLLHS-OLZOCXBDSA-N 1 0 328.368 3.778 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000067383269 1129268891 /nfs/dbraw/zinc/26/88/91/1129268891.db2.gz WBIQPSQVSLVLHN-QGZVFWFLSA-N 1 0 345.399 3.885 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@H]21 ZINC000301901921 1129315124 /nfs/dbraw/zinc/31/51/24/1129315124.db2.gz NUTKGGYHIPRQAZ-GDBMZVCRSA-N 1 0 347.459 3.693 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+](CCCO)[C@@H]2CCCc3ccccc32)cs1 ZINC000081549068 1129428185 /nfs/dbraw/zinc/42/81/85/1129428185.db2.gz ZDZIGQODDDUZTL-QGZVFWFLSA-N 1 0 346.452 3.918 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC(C)(C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543405421 1129468957 /nfs/dbraw/zinc/46/89/57/1129468957.db2.gz RRMRFGSHXPURSM-SFHVURJKSA-N 1 0 346.427 3.838 20 5 EHBDRO CC[C@H](CCO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000123874219 1129560273 /nfs/dbraw/zinc/56/02/73/1129560273.db2.gz KBDWTVNKJQANGH-OAHLLOKOSA-N 1 0 348.374 3.777 20 5 EHBDRO CO[C@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)C1 ZINC000282384181 1129674568 /nfs/dbraw/zinc/67/45/68/1129674568.db2.gz QWCRPNPRXCMMBZ-WBMJQRKESA-N 1 0 347.440 3.718 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCOc1ccccc1 ZINC000509047885 1129692266 /nfs/dbraw/zinc/69/22/66/1129692266.db2.gz COEKHJFQBKYCCC-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CCc1noc([C@H]2CC[C@@H]([NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC000922861574 1129696780 /nfs/dbraw/zinc/69/67/80/1129696780.db2.gz DRDUHGCYTBGNGK-UONOGXRCSA-N 1 0 344.415 3.583 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000392549798 1129717608 /nfs/dbraw/zinc/71/76/08/1129717608.db2.gz YSHSALQLXHUASI-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C[NH+](C)CC1(CNc2ccc([N+](=O)[O-])c3cccnc23)CCCC1 ZINC000302150415 1129770731 /nfs/dbraw/zinc/77/07/31/1129770731.db2.gz JZHYHUNNOGWJKH-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO COc1cccc([C@@H](CNc2cccc(C)c2[N+](=O)[O-])[NH+](C)C)c1 ZINC000302483918 1129779960 /nfs/dbraw/zinc/77/99/60/1129779960.db2.gz HKNDJPDRFLDMEA-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO CCc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000056197488 1129805664 /nfs/dbraw/zinc/80/56/64/1129805664.db2.gz ZJTMPGSPXXTJMJ-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(F)c1 ZINC000056196706 1129805760 /nfs/dbraw/zinc/80/57/60/1129805760.db2.gz KBEJRSLEWBUAJG-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO Cc1cc(NC2CCC([NH+]3CCC(C)CC3)CC2)ncc1[N+](=O)[O-] ZINC000132186869 1129880648 /nfs/dbraw/zinc/88/06/48/1129880648.db2.gz YUYZTQTUDDGDFY-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO CCOc1cc(N2CCC(CCC[NH+](C)C)CC2)ccc1[N+](=O)[O-] ZINC000162751893 1129903853 /nfs/dbraw/zinc/90/38/53/1129903853.db2.gz FVBWUAHQGJVJQK-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000227525041 1129911880 /nfs/dbraw/zinc/91/18/80/1129911880.db2.gz SUDWGEYMFBSNFY-KFWWJZLASA-N 1 0 342.443 3.921 20 5 EHBDRO Cc1ccc(C(C)(C)[NH2+]CCCOc2ccc([N+](=O)[O-])cc2)cn1 ZINC000353571203 1129921734 /nfs/dbraw/zinc/92/17/34/1129921734.db2.gz OTUOEOGGEGVOFJ-UHFFFAOYSA-N 1 0 329.400 3.592 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)CNC(=O)c1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000171927349 1130097902 /nfs/dbraw/zinc/09/79/02/1130097902.db2.gz XVTLFTXGNJLRDX-LBPRGKRZSA-N 1 0 347.440 3.516 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173334100 1130210665 /nfs/dbraw/zinc/21/06/65/1130210665.db2.gz OMRWSIXZNSGDNF-SCLBCKFNSA-N 1 0 331.391 3.687 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173418570 1130228450 /nfs/dbraw/zinc/22/84/50/1130228450.db2.gz HQDQPLPGHUAJFS-NVXWUHKLSA-N 1 0 325.412 3.914 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2(CCCC2)C1 ZINC000173825387 1130319679 /nfs/dbraw/zinc/31/96/79/1130319679.db2.gz OMOHTTBJPXFIHG-CYBMUJFWSA-N 1 0 342.399 3.972 20 5 EHBDRO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000246068376 1130339927 /nfs/dbraw/zinc/33/99/27/1130339927.db2.gz ZBHGKOVUIYECET-ZIAGYGMSSA-N 1 0 329.400 3.770 20 5 EHBDRO COc1cccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000174241095 1130343506 /nfs/dbraw/zinc/34/35/06/1130343506.db2.gz AWEUZDPSSXKMJM-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CN(CC[N@H+](C)C1CCCCC1)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208717 1130779426 /nfs/dbraw/zinc/77/94/26/1130779426.db2.gz GZOLKGKLTWKZJN-UHFFFAOYSA-N 1 0 348.472 3.905 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000766193680 1131159240 /nfs/dbraw/zinc/15/92/40/1131159240.db2.gz OKJPVGATYSTPIE-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000742430426 1131729568 /nfs/dbraw/zinc/72/95/68/1131729568.db2.gz QNNYZRNDWAFIOH-MRXNPFEDSA-N 1 0 325.412 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCc3ncccc31)CC2 ZINC001172900828 1131883375 /nfs/dbraw/zinc/88/33/75/1131883375.db2.gz GCNHWJXULXJJOM-OXQOHEQNSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCCCCCCCO)CC2 ZINC001172903388 1131886508 /nfs/dbraw/zinc/88/65/08/1131886508.db2.gz QRVOZFFEFXGFPY-GOSISDBHSA-N 1 0 334.460 3.765 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172914157 1131902352 /nfs/dbraw/zinc/90/23/52/1131902352.db2.gz DIKQPJCRTVKKOQ-GOSISDBHSA-N 1 0 338.407 3.867 20 5 EHBDRO CCC[C@@]1(C)CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000743407244 1131917582 /nfs/dbraw/zinc/91/75/82/1131917582.db2.gz RNVHQAANGZNINI-SFHVURJKSA-N 1 0 343.431 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H](c1ccncc1)C1CC1)CC2 ZINC001172912077 1131918102 /nfs/dbraw/zinc/91/81/02/1131918102.db2.gz LNYKRBOBIRZLGD-QUCCMNQESA-N 1 0 337.423 3.978 20 5 EHBDRO COc1cc(F)ccc1C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911216 1131918248 /nfs/dbraw/zinc/91/82/48/1131918248.db2.gz HPTKEGGDIBCRIN-QGZVFWFLSA-N 1 0 344.386 3.780 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)cc1[N+](=O)[O-] ZINC000743498754 1131930427 /nfs/dbraw/zinc/93/04/27/1131930427.db2.gz RZAYYNXOJXSMCJ-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CCC[C@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007218 1131934490 /nfs/dbraw/zinc/93/44/90/1131934490.db2.gz FLIURFAMVGPGSY-NSHDSACASA-N 1 0 327.375 3.620 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@H]3C=CCCC3)CC2)c(F)c1 ZINC001173013210 1131936180 /nfs/dbraw/zinc/93/61/80/1131936180.db2.gz QHQKDXCPPXMVEK-LBPRGKRZSA-N 1 0 337.370 3.540 20 5 EHBDRO CCc1ccc(N2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000743866277 1131992901 /nfs/dbraw/zinc/99/29/01/1131992901.db2.gz BFPHAHDJQCOECA-UHFFFAOYSA-N 1 0 339.439 3.522 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cncc(C(F)(F)F)c1 ZINC001173218612 1132003188 /nfs/dbraw/zinc/00/31/88/1132003188.db2.gz KYELPQIVWLGAMQ-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO COC(=O)CC1(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCCCC1 ZINC001173220259 1132003969 /nfs/dbraw/zinc/00/39/69/1132003969.db2.gz WUIHUEAJYVDYCK-HNNXBMFYSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@](CF)(C(F)(F)F)C1 ZINC001173221258 1132004364 /nfs/dbraw/zinc/00/43/64/1132004364.db2.gz GSEJDXUPRPRGAE-FZMZJTMJSA-N 1 0 334.313 3.750 20 5 EHBDRO CCOC(=O)[C@@]1(C)CCCC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223260 1132005712 /nfs/dbraw/zinc/00/57/12/1132005712.db2.gz ZEFPSUGKFYKGCA-KXBFYZLASA-N 1 0 348.443 3.581 20 5 EHBDRO COc1cncc([C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229225 1132007600 /nfs/dbraw/zinc/00/76/00/1132007600.db2.gz RTMSLRRHGJLSQP-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO Cc1ccccc1N1CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230375 1132007765 /nfs/dbraw/zinc/00/77/65/1132007765.db2.gz XTSDBGREKOJVSV-KRWDZBQOSA-N 1 0 339.439 3.656 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001173227878 1132007821 /nfs/dbraw/zinc/00/78/21/1132007821.db2.gz SFKVVKZDQFDNCA-KXBFYZLASA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(Cc2ccc(O)cc2)CC1 ZINC001173228338 1132007988 /nfs/dbraw/zinc/00/79/88/1132007988.db2.gz JGNOCFJWMLGYPM-AWEZNQCLSA-N 1 0 326.396 3.596 20 5 EHBDRO COc1cnccc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173230356 1132008090 /nfs/dbraw/zinc/00/80/90/1132008090.db2.gz XOUWXJMIVNBHGU-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO Cc1cncc([C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229275 1132008198 /nfs/dbraw/zinc/00/81/98/1132008198.db2.gz SEOMDEIXXWYZDX-KUHUBIRLSA-N 1 0 325.412 3.970 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233505 1132010096 /nfs/dbraw/zinc/01/00/96/1132010096.db2.gz JJTNOVRPHXUVGK-FZKQIMNGSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCN1CCCc2ccccc21 ZINC001173235750 1132010716 /nfs/dbraw/zinc/01/07/16/1132010716.db2.gz UUPOFWHPUCAWFO-INIZCTEOSA-N 1 0 339.439 3.568 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccccc2N2CCCCCC2)C1 ZINC001168965704 1132621745 /nfs/dbraw/zinc/62/17/45/1132621745.db2.gz CEXAIADAXNVSNU-WMZOPIPTSA-N 1 0 331.460 3.602 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccnc(F)c3)c(F)c2)C1 ZINC001168970885 1132621995 /nfs/dbraw/zinc/62/19/95/1132621995.db2.gz JDIOQORHVFCEHP-UKRRQHHQSA-N 1 0 347.365 3.562 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@H]2CCOc3cc(C(F)(F)F)ccc32)C1 ZINC001168999472 1132627172 /nfs/dbraw/zinc/62/71/72/1132627172.db2.gz UFTUXQRBLLOFSD-JKOKRWQUSA-N 1 0 344.333 3.564 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040028 1132638076 /nfs/dbraw/zinc/63/80/76/1132638076.db2.gz XCAHBRMZIXAPMC-WCQYABFASA-N 1 0 328.334 3.509 20 5 EHBDRO COc1cc(C)c([N+](=O)[O-])cc1N[C@H]1CC(C)(C)C[C@@](C)(C[NH3+])C1 ZINC001169147728 1132676956 /nfs/dbraw/zinc/67/69/56/1132676956.db2.gz UTIPMHMPHASZCU-UGSOOPFHSA-N 1 0 335.448 3.867 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCSC[C@H]2C(C)(C)C)ccc1[N+](=O)[O-] ZINC001175698486 1132729922 /nfs/dbraw/zinc/72/99/22/1132729922.db2.gz PTBUPLDDVYUNOT-INIZCTEOSA-N 1 0 338.473 3.957 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1cc(F)cc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC001176030018 1132824317 /nfs/dbraw/zinc/82/43/17/1132824317.db2.gz XUYISAYOKMTAPO-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO CC(C)[C@H](Cc1ccccc1)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC001176121189 1132853812 /nfs/dbraw/zinc/85/38/12/1132853812.db2.gz FBHZKDBKGVVFMK-IBGZPJMESA-N 1 0 328.412 3.831 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000804345771 1132928161 /nfs/dbraw/zinc/92/81/61/1132928161.db2.gz NIOZNFQGVWGSAO-QGZVFWFLSA-N 1 0 342.443 3.542 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766842 1133049623 /nfs/dbraw/zinc/04/96/23/1133049623.db2.gz XXEMFNDEPUFUHT-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767765451 1133050511 /nfs/dbraw/zinc/05/05/11/1133050511.db2.gz PJTWTYDOIGOYLT-AWEZNQCLSA-N 1 0 331.420 3.650 20 5 EHBDRO C[C@]1(Cc2ccccc2)CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936029 1133072309 /nfs/dbraw/zinc/07/23/09/1133072309.db2.gz OJGMATXFUBRMSZ-VQTJNVASSA-N 1 0 340.423 3.725 20 5 EHBDRO C[N@@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@H]1OCCc2ccccc21 ZINC000768542752 1133153530 /nfs/dbraw/zinc/15/35/30/1133153530.db2.gz YNOOIDAUCCDFAG-GOSISDBHSA-N 1 0 346.814 3.994 20 5 EHBDRO CCC[C@@H](C)[C@@H](CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179082352 1133227786 /nfs/dbraw/zinc/22/77/86/1133227786.db2.gz XLBQUFAJJXQODY-CXAGYDPISA-N 1 0 332.400 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC001182911272 1133749009 /nfs/dbraw/zinc/74/90/09/1133749009.db2.gz XXTNPPRWHWCXQC-RDJZCZTQSA-N 1 0 346.814 3.911 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001183464877 1133810594 /nfs/dbraw/zinc/81/05/94/1133810594.db2.gz ZYTXOZZTISBHGB-HNNXBMFYSA-N 1 0 348.443 3.765 20 5 EHBDRO COc1ccc(C2CC2)cc1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC001183582724 1133830862 /nfs/dbraw/zinc/83/08/62/1133830862.db2.gz OGTFYVDLFCSJHD-UHFFFAOYSA-N 1 0 326.396 3.813 20 5 EHBDRO O=S1(=O)CC(CC[NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000786823709 1133912489 /nfs/dbraw/zinc/91/24/89/1133912489.db2.gz DHETZBRZEDFCAC-UHFFFAOYSA-N 1 0 339.460 3.517 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2([NH+]3CCCCC3)CCCCC2)n1 ZINC001184536016 1133949997 /nfs/dbraw/zinc/94/99/97/1133949997.db2.gz ICOHCXKSFPYNHN-UHFFFAOYSA-N 1 0 332.448 3.899 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@@H]1C ZINC000746671976 1133990407 /nfs/dbraw/zinc/99/04/07/1133990407.db2.gz CYRYNVPJZPODHK-WFASDCNBSA-N 1 0 325.840 3.553 20 5 EHBDRO CC(C)C[C@H](CNc1c([N+](=O)[O-])cnn1C)[NH2+][C@@H](C)c1ccccc1 ZINC001185338508 1134074416 /nfs/dbraw/zinc/07/44/16/1134074416.db2.gz LCONPRYTIGJKIE-GOEBONIOSA-N 1 0 345.447 3.506 20 5 EHBDRO CC[N@@H+]1CCCC[C@H]1CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001185339682 1134074772 /nfs/dbraw/zinc/07/47/72/1134074772.db2.gz SQSSKCRABSEJSV-LBPRGKRZSA-N 1 0 331.338 3.900 20 5 EHBDRO C[NH+](C)CCN(Cc1cccc(Cl)c1)c1ccc([N+](=O)[O-])cc1 ZINC001185691419 1134120769 /nfs/dbraw/zinc/12/07/69/1134120769.db2.gz ATJBVVQJCOIAPM-UHFFFAOYSA-N 1 0 333.819 3.816 20 5 EHBDRO C[C@@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788522249 1134137215 /nfs/dbraw/zinc/13/72/15/1134137215.db2.gz ZNEZXCTWQCNZBD-CYBMUJFWSA-N 1 0 347.390 3.826 20 5 EHBDRO CSc1ccc(F)cc1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788609059 1134145641 /nfs/dbraw/zinc/14/56/41/1134145641.db2.gz HVWWXFHTUANORZ-JTQLQIEISA-N 1 0 335.404 3.889 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000788578530 1134147064 /nfs/dbraw/zinc/14/70/64/1134147064.db2.gz BAUJLTYBDKJIQD-RBUKOAKNSA-N 1 0 340.423 3.949 20 5 EHBDRO C[C@@H]([NH2+][C@H](Cc1ccccc1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788640408 1134154448 /nfs/dbraw/zinc/15/44/48/1134154448.db2.gz AGJLPDXEBWDKTC-FZKQIMNGSA-N 1 0 325.412 3.849 20 5 EHBDRO COc1cccc(C(C)(C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788668254 1134159308 /nfs/dbraw/zinc/15/93/08/1134159308.db2.gz AFDIJDCWUJGKEF-CYBMUJFWSA-N 1 0 343.427 3.814 20 5 EHBDRO C[C@H]1C[NH+](CCCCNc2cc(Cl)ccc2[N+](=O)[O-])C[C@H](C)O1 ZINC000791412129 1134547498 /nfs/dbraw/zinc/54/74/98/1134547498.db2.gz BRMQVSUTVWYIKW-STQMWFEESA-N 1 0 341.839 3.550 20 5 EHBDRO COc1cccc([C@H](C)[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170297795 1134737925 /nfs/dbraw/zinc/73/79/25/1134737925.db2.gz SGXVNXAAYPWVPN-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170298373 1134738212 /nfs/dbraw/zinc/73/82/12/1134738212.db2.gz KKJIDWRBHKDBMQ-HNNXBMFYSA-N 1 0 328.412 3.675 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC001170298568 1134738225 /nfs/dbraw/zinc/73/82/25/1134738225.db2.gz MMHCICLDYIRFDU-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2ccncc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170329054 1134748983 /nfs/dbraw/zinc/74/89/83/1134748983.db2.gz NQZXFMUVQIUUKS-AUUYWEPGSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170307459 1134752958 /nfs/dbraw/zinc/75/29/58/1134752958.db2.gz GDMDZPIDSDDJLY-BVGQSLNGSA-N 1 0 326.396 3.680 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341443 1134758969 /nfs/dbraw/zinc/75/89/69/1134758969.db2.gz IXJKRIIOJRTVGU-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@H](C)Cc2cccs2)c1 ZINC001191465278 1134876036 /nfs/dbraw/zinc/87/60/36/1134876036.db2.gz YSDLGKBALDWXLN-GFCCVEGCSA-N 1 0 348.424 3.506 20 5 EHBDRO CC1(C)CCC[C@@H]1[C@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424183 1135428102 /nfs/dbraw/zinc/42/81/02/1135428102.db2.gz HXMKKWKEOXIZGJ-CGTJXYLNSA-N 1 0 332.444 3.776 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000775684038 1135505542 /nfs/dbraw/zinc/50/55/42/1135505542.db2.gz WFYALWGCWJDYEP-NQBHXWOUSA-N 1 0 339.823 3.601 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000808445344 1135668604 /nfs/dbraw/zinc/66/86/04/1135668604.db2.gz OMRFWMDYXNYAEL-LIRRHRJNSA-N 1 0 328.412 3.930 20 5 EHBDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761672 1135729225 /nfs/dbraw/zinc/72/92/25/1135729225.db2.gz QHDLGQJFXNWVHT-MOPGFXCFSA-N 1 0 344.411 3.720 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809689230 1135872216 /nfs/dbraw/zinc/87/22/16/1135872216.db2.gz LGLGQEMGSLVEOT-KRWDZBQOSA-N 1 0 334.803 3.634 20 5 EHBDRO [NH3+]CCN(Cc1cccc(-c2cccnc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000809734620 1135873861 /nfs/dbraw/zinc/87/38/61/1135873861.db2.gz IRYPKOYRZJJAEO-UHFFFAOYSA-N 1 0 348.406 3.622 20 5 EHBDRO [NH3+]CCN(Cc1ccccc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000809734922 1135874418 /nfs/dbraw/zinc/87/44/18/1135874418.db2.gz SMGWWSNKVVQGLB-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCN1CCc2ccccc21 ZINC001199110854 1135882615 /nfs/dbraw/zinc/88/26/15/1135882615.db2.gz PITUBLUBRQWTGD-UHFFFAOYSA-N 1 0 339.439 3.754 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809950312 1135905615 /nfs/dbraw/zinc/90/56/15/1135905615.db2.gz FZGCOQVKIHUYEH-CYBMUJFWSA-N 1 0 346.258 3.818 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@]2(CCOC2)C1 ZINC000809954051 1135905888 /nfs/dbraw/zinc/90/58/88/1135905888.db2.gz PGCBDYCCMHRLDM-AWEZNQCLSA-N 1 0 331.199 3.514 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000810177546 1135934459 /nfs/dbraw/zinc/93/44/59/1135934459.db2.gz ANAIOSPJSGOKDS-AWEZNQCLSA-N 1 0 332.787 3.650 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCNc1cccc(F)c1 ZINC001201644641 1136051286 /nfs/dbraw/zinc/05/12/86/1136051286.db2.gz IQYJVIBXTHBGLE-UHFFFAOYSA-N 1 0 347.390 3.724 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cnn(CC2CCC2)c1 ZINC001201692780 1136057254 /nfs/dbraw/zinc/05/72/54/1136057254.db2.gz GTNAWOTUUZQQBD-UHFFFAOYSA-N 1 0 348.834 3.577 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2ccnc(Cl)c2Cl)c1 ZINC000811485438 1136092147 /nfs/dbraw/zinc/09/21/47/1136092147.db2.gz KTLLJGSZKSYTOJ-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO C[C@@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000811474381 1136095723 /nfs/dbraw/zinc/09/57/23/1136095723.db2.gz HNHAPRZAMLFQSE-NSHDSACASA-N 1 0 346.258 3.723 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)ccc1Cl ZINC000776252055 1136101476 /nfs/dbraw/zinc/10/14/76/1136101476.db2.gz MFJKBFRCGYLJOH-APHBMKBZSA-N 1 0 336.819 3.686 20 5 EHBDRO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2ccccc21 ZINC000776270564 1136123902 /nfs/dbraw/zinc/12/39/02/1136123902.db2.gz CTNWEHDRUXFYBE-RTBURBONSA-N 1 0 326.396 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCc2csc3ccccc23)cc1 ZINC000776275754 1136130217 /nfs/dbraw/zinc/13/02/17/1136130217.db2.gz HOGBQYVEFWRMDD-QGZVFWFLSA-N 1 0 342.420 3.675 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812853114 1136262622 /nfs/dbraw/zinc/26/26/22/1136262622.db2.gz AOSLJJQSAGCMBL-KXBFYZLASA-N 1 0 328.412 3.581 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCC1SCCS1 ZINC000850570644 1136289090 /nfs/dbraw/zinc/28/90/90/1136289090.db2.gz KMBJCEKGNLZJEW-LBPRGKRZSA-N 1 0 326.487 3.702 20 5 EHBDRO CO[C@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC001202482980 1136399788 /nfs/dbraw/zinc/39/97/88/1136399788.db2.gz BJVHANHDJVWANW-KRWDZBQOSA-N 1 0 328.412 3.559 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585081 1136442264 /nfs/dbraw/zinc/44/22/64/1136442264.db2.gz SOJQKJJBLLGUMZ-DKSSEZFCSA-N 1 0 326.396 3.506 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585279 1136442508 /nfs/dbraw/zinc/44/25/08/1136442508.db2.gz SXEMQMUQDHNZJK-NRXGSXMXSA-N 1 0 344.386 3.645 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000852446604 1136456494 /nfs/dbraw/zinc/45/64/94/1136456494.db2.gz KPUVLNYUFWGKRN-ZWKOTPCHSA-N 1 0 332.375 3.754 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCC[C@H]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000852566982 1136467226 /nfs/dbraw/zinc/46/72/26/1136467226.db2.gz JVTUAHXLUGDTJN-YJBOKZPZSA-N 1 0 325.412 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2(c3ccc(F)cc3F)CCC2)cc1 ZINC000776606698 1136470173 /nfs/dbraw/zinc/47/01/73/1136470173.db2.gz ZTJZILVGOGNCSL-QGZVFWFLSA-N 1 0 348.349 3.575 20 5 EHBDRO CCc1ccc([C@H]2CC[N@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640970 1136487789 /nfs/dbraw/zinc/48/77/89/1136487789.db2.gz ZHQBTRJMNPRNFW-ICSRJNTNSA-N 1 0 340.423 3.680 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814641794 1136488495 /nfs/dbraw/zinc/48/84/95/1136488495.db2.gz LEGZXNDZYLDQDG-MJGOQNOKSA-N 1 0 326.396 3.508 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000815150439 1136563444 /nfs/dbraw/zinc/56/34/44/1136563444.db2.gz CLBQEFMMUSAIPN-CQSZACIVSA-N 1 0 326.824 3.527 20 5 EHBDRO CS(=O)(=O)CCCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000818224755 1136867821 /nfs/dbraw/zinc/86/78/21/1136867821.db2.gz QECAHQNNTARFLQ-UHFFFAOYSA-N 1 0 341.476 3.907 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1cccc([N+](=O)[O-])c1 ZINC000173368053 1136898221 /nfs/dbraw/zinc/89/82/21/1136898221.db2.gz AZKJZZMZXIAPQX-ZDUSSCGKSA-N 1 0 327.384 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](Oc3ccc(C4CC4)cn3)C2)c1 ZINC000858015369 1136931568 /nfs/dbraw/zinc/93/15/68/1136931568.db2.gz UOQQFCFJZKUTIU-GOSISDBHSA-N 1 0 339.395 3.521 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@H]2Cc3cc(Cl)ccc3[C@@H]12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858456777 1136969560 /nfs/dbraw/zinc/96/95/60/1136969560.db2.gz CQKJNMJIVBHZAI-QGSMBUMASA-N 1 0 343.814 3.819 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)nc1 ZINC000858488371 1136972447 /nfs/dbraw/zinc/97/24/47/1136972447.db2.gz RQOKCXAKFPSZBO-ZDUSSCGKSA-N 1 0 328.416 3.509 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc4c(n3)[nH]cc4[N+](=O)[O-])c2c1 ZINC001171163829 1137274885 /nfs/dbraw/zinc/27/48/85/1137274885.db2.gz FPZLRNCLKZPWNH-GFCCVEGCSA-N 1 0 349.394 3.613 20 5 EHBDRO C[C@H](C[C@H](O)c1ccco1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120865653 1137324948 /nfs/dbraw/zinc/32/49/48/1137324948.db2.gz AFNHJXFHAQADGX-SKDZVZGDSA-N 1 0 344.411 3.611 20 5 EHBDRO CCN1C[C@H](C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1=O ZINC000846092890 1137332031 /nfs/dbraw/zinc/33/20/31/1137332031.db2.gz JWOGSXYFJJVGEI-INIZCTEOSA-N 1 0 332.447 3.951 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCSCCC(F)(F)F ZINC000866542635 1137363451 /nfs/dbraw/zinc/36/34/51/1137363451.db2.gz KNDKBIMZZWVFTD-LBPRGKRZSA-N 1 0 334.363 3.857 20 5 EHBDRO Cc1ccnc([C@H]2CC[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])C2)c1 ZINC000846972519 1137377939 /nfs/dbraw/zinc/37/79/39/1137377939.db2.gz GSCPAUGTXOFRKV-ZDUSSCGKSA-N 1 0 331.803 3.941 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1ccc2ncccc2c1[N+](=O)[O-] ZINC001171305729 1137407403 /nfs/dbraw/zinc/40/74/03/1137407403.db2.gz XGROSLCKFQCVIZ-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO Clc1nc2ccc3ccccc3c2nc1NC[C@@H]1CCCC[NH2+]1 ZINC001171328958 1137421606 /nfs/dbraw/zinc/42/16/06/1137421606.db2.gz DSBWOVUBUIEOQK-ZDUSSCGKSA-N 1 0 326.831 3.990 20 5 EHBDRO CC(C)c1ccc(CNc2c[nH+]ccc2-n2cccn2)cc1[N+](=O)[O-] ZINC000348132054 1137444335 /nfs/dbraw/zinc/44/43/35/1137444335.db2.gz UTOKSXGPVRSDRF-UHFFFAOYSA-N 1 0 337.383 3.911 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1cc(C)c([N+](=O)[O-])cn1)c1ccsc1 ZINC000348179971 1137451325 /nfs/dbraw/zinc/45/13/25/1137451325.db2.gz NLCBYOXHZIAYEA-OAHLLOKOSA-N 1 0 334.445 3.855 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@@H](O)c1cccc(F)c1 ZINC000773045271 1137461445 /nfs/dbraw/zinc/46/14/45/1137461445.db2.gz YORLBCMPSRFDGN-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@](C)(O)c1ccc(F)cc1 ZINC000773120151 1137466830 /nfs/dbraw/zinc/46/68/30/1137466830.db2.gz RBNLHBDNJBBYQM-FZKQIMNGSA-N 1 0 332.375 3.601 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cccc1[N+](=O)[O-] ZINC000510980125 1137471321 /nfs/dbraw/zinc/47/13/21/1137471321.db2.gz QLRJLKFOGRYOIW-ZBFHGGJFSA-N 1 0 326.396 3.948 20 5 EHBDRO CCC1(CC)CCC[N@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001171954506 1137518652 /nfs/dbraw/zinc/51/86/52/1137518652.db2.gz JUIVXYWBKUXNGS-UHFFFAOYSA-N 1 0 334.416 3.784 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1ccccc1 ZINC000872015992 1137564650 /nfs/dbraw/zinc/56/46/50/1137564650.db2.gz AXVJNURBWLPKFO-MLGOLLRUSA-N 1 0 332.425 3.701 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000872022241 1137565271 /nfs/dbraw/zinc/56/52/71/1137565271.db2.gz IHPGXFXMNTWRCD-VBNZEHGJSA-N 1 0 335.473 3.594 20 5 EHBDRO C[C@H]([NH2+][C@@H](Cn1ccnc1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023191 1137565326 /nfs/dbraw/zinc/56/53/26/1137565326.db2.gz CZOGVNCIGOVAAH-WFASDCNBSA-N 1 0 334.395 3.696 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)c1cn(C)nc1C ZINC000872030720 1137566327 /nfs/dbraw/zinc/56/63/27/1137566327.db2.gz BBSPXCQHEHIJOQ-MNOVXSKESA-N 1 0 334.445 3.770 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](O)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033253 1137566609 /nfs/dbraw/zinc/56/66/09/1137566609.db2.gz CAQLAQNRBJFWHW-DINDLPBHSA-N 1 0 336.338 3.646 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041578 1137567010 /nfs/dbraw/zinc/56/70/10/1137567010.db2.gz UPUAGODCBQQEDP-FRRDWIJNSA-N 1 0 326.462 3.764 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1ccncc1 ZINC000872041701 1137567215 /nfs/dbraw/zinc/56/72/15/1137567215.db2.gz KEZSFFSMZBWTDY-STQMWFEESA-N 1 0 331.441 3.994 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000872045788 1137567574 /nfs/dbraw/zinc/56/75/74/1137567574.db2.gz BIPUMCZYQOSUJH-ZDUSSCGKSA-N 1 0 337.489 3.840 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067617 1137569386 /nfs/dbraw/zinc/56/93/86/1137569386.db2.gz ZSUOUTRZRMOIPS-OCCSQVGLSA-N 1 0 346.406 3.719 20 5 EHBDRO C[C@@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070712 1137569578 /nfs/dbraw/zinc/56/95/78/1137569578.db2.gz HHMBKSZYOUBVRQ-WBMJQRKESA-N 1 0 349.381 3.827 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000872073170 1137569691 /nfs/dbraw/zinc/56/96/91/1137569691.db2.gz NXKSKFXTDNQELK-KSSFIOAISA-N 1 0 345.443 3.802 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(CO)C[C@@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072664 1137569751 /nfs/dbraw/zinc/56/97/51/1137569751.db2.gz IGAYLCFMPULGMC-ZBQZNYHESA-N 1 0 344.386 3.551 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872074743 1137569903 /nfs/dbraw/zinc/56/99/03/1137569903.db2.gz HAVVDNAFEARCRB-UWVGGRQHSA-N 1 0 338.301 3.742 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(C2OCCO2)cc1 ZINC000873049155 1137588869 /nfs/dbraw/zinc/58/88/69/1137588869.db2.gz BGOMFIRRFPNHCU-UHFFFAOYSA-N 1 0 342.395 3.547 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](C[C@H](C)O)c1ccccc1 ZINC000873079575 1137589625 /nfs/dbraw/zinc/58/96/25/1137589625.db2.gz VZDUDXXYZPPKPF-YJBOKZPZSA-N 1 0 342.439 3.856 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc2c(c1)CCCC2 ZINC000876898076 1137664849 /nfs/dbraw/zinc/66/48/49/1137664849.db2.gz ZBVYCGURHPQWII-NLNFPOJYSA-N 1 0 340.427 3.724 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC1SCCS1 ZINC000877638910 1137683955 /nfs/dbraw/zinc/68/39/55/1137683955.db2.gz RVOMIEVWZUFREA-UHFFFAOYSA-N 1 0 338.376 3.509 20 5 EHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111751 1137702997 /nfs/dbraw/zinc/70/29/97/1137702997.db2.gz CYPDGDZSYOCBNN-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543500 1137719583 /nfs/dbraw/zinc/71/95/83/1137719583.db2.gz DMJQNIVOWYQCIK-CYBMUJFWSA-N 1 0 344.415 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@H](C3CCOCC3)C2)cc1F ZINC000880577797 1137781683 /nfs/dbraw/zinc/78/16/83/1137781683.db2.gz LCFZIHMQCDMEPN-INIZCTEOSA-N 1 0 336.407 3.763 20 5 EHBDRO Cc1cc(N2CCC(C)([NH+]3CCC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000882964162 1137839881 /nfs/dbraw/zinc/83/98/81/1137839881.db2.gz UWEOODXNTUTARV-UHFFFAOYSA-N 1 0 340.427 3.516 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2c3ccccc3NC2(C)C)cc1[N+](=O)[O-] ZINC000883462860 1137861245 /nfs/dbraw/zinc/86/12/45/1137861245.db2.gz BQQVXAOWKYFXHI-QGZVFWFLSA-N 1 0 327.384 3.638 20 5 EHBDRO Cc1c(C[N@H+]2CCC[C@@H]2[C@@H]2C[C@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000331948603 1137926645 /nfs/dbraw/zinc/92/66/45/1137926645.db2.gz PAGXPESNAQDAPZ-HQJJXPTPSA-N 1 0 332.444 3.665 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000120324360 1137948557 /nfs/dbraw/zinc/94/85/57/1137948557.db2.gz FDNGOAAVGDLNBH-KDOFPFPSSA-N 1 0 344.411 3.686 20 5 EHBDRO Cc1c(NC(=O)NCCCC[N@H+]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000045960119 1138041147 /nfs/dbraw/zinc/04/11/47/1138041147.db2.gz ZMNHFHTVCHRTPU-CQSZACIVSA-N 1 0 348.447 3.679 20 5 EHBDRO C[C@@H](c1cccc(Cl)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962484 1138044596 /nfs/dbraw/zinc/04/45/96/1138044596.db2.gz AQECGINYVMOCIP-SJCJKPOMSA-N 1 0 334.803 3.975 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@@H]2C)O1 ZINC000886772072 1138137537 /nfs/dbraw/zinc/13/75/37/1138137537.db2.gz RVIWMFGTYXILMM-NDVSXACPSA-N 1 0 348.443 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)c1 ZINC000886818103 1138148726 /nfs/dbraw/zinc/14/87/26/1138148726.db2.gz ALHNLERLMDNSSR-IAQYHMDHSA-N 1 0 344.333 3.615 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@H]1OC(F)F)CCC2 ZINC000337551465 1138602932 /nfs/dbraw/zinc/60/29/32/1138602932.db2.gz ORVNUGWTISKETG-QLFBSQMISA-N 1 0 326.343 3.722 20 5 EHBDRO COc1ccccc1N1CC[C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000151857189 1139060852 /nfs/dbraw/zinc/06/08/52/1139060852.db2.gz CLBMFHUTJQAXRK-GDBMZVCRSA-N 1 0 341.411 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(CO)CCC3)o2)c(Cl)c1 ZINC000178640017 1139709437 /nfs/dbraw/zinc/70/94/37/1139709437.db2.gz BJJRSPUVNBWCIL-UHFFFAOYSA-N 1 0 336.775 3.513 20 5 EHBDRO CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3csc([N+](=O)[O-])c3)c2C1 ZINC000179768502 1139781371 /nfs/dbraw/zinc/78/13/71/1139781371.db2.gz VMLRUZOHRDPQQB-UHFFFAOYSA-N 1 0 345.424 3.880 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180044399 1139804327 /nfs/dbraw/zinc/80/43/27/1139804327.db2.gz NEMGTVITVGNTQT-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCO[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181456614 1139907547 /nfs/dbraw/zinc/90/75/47/1139907547.db2.gz XCCWITFNBDFPRB-BHYGNILZSA-N 1 0 336.457 3.690 20 5 EHBDRO Cc1cnn(CCCCC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181818929 1139933567 /nfs/dbraw/zinc/93/35/67/1139933567.db2.gz IKDOJHGUNXMGAP-MRXNPFEDSA-N 1 0 330.432 3.929 20 5 EHBDRO Cc1ccc(C)c(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181812937 1139933931 /nfs/dbraw/zinc/93/39/31/1139933931.db2.gz BDCGERRFXHHPGQ-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO COC(=O)c1cccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181839719 1139936109 /nfs/dbraw/zinc/93/61/09/1139936109.db2.gz VMYSLTYSMIPTCK-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C[S@](C)=O)c1ccccc1 ZINC000183176805 1140018451 /nfs/dbraw/zinc/01/84/51/1140018451.db2.gz ZLAKVNTXIXQVGM-IKGLDXFJSA-N 1 0 346.452 3.674 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000184299057 1140093893 /nfs/dbraw/zinc/09/38/93/1140093893.db2.gz HZYLYGLNEWWEGO-MRXNPFEDSA-N 1 0 348.374 3.992 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CC[C@H](O)C2)s1 ZINC000188843198 1140310110 /nfs/dbraw/zinc/31/01/10/1140310110.db2.gz BFANAEYBYIIMHF-OLZOCXBDSA-N 1 0 332.425 3.574 20 5 EHBDRO CC[C@H]([NH2+]CCOCC(F)(F)C(F)F)c1cccc([N+](=O)[O-])c1 ZINC000189860085 1140368119 /nfs/dbraw/zinc/36/81/19/1140368119.db2.gz HWJLBKVDGTXOHW-LBPRGKRZSA-N 1 0 338.301 3.553 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000192375934 1140527321 /nfs/dbraw/zinc/52/73/21/1140527321.db2.gz BVUXOFYMHCNYLV-HKUYNNGSSA-N 1 0 326.396 3.771 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192628808 1140540600 /nfs/dbraw/zinc/54/06/00/1140540600.db2.gz DVXOGHSAEZTIPQ-IBGZPJMESA-N 1 0 339.395 3.720 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193043660 1140562349 /nfs/dbraw/zinc/56/23/49/1140562349.db2.gz SQWFJQZZYMJHRC-DIFFPNOSSA-N 1 0 329.400 3.970 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776819 1140989410 /nfs/dbraw/zinc/98/94/10/1140989410.db2.gz WBSPZSVYHIVADF-PIGZYNQJSA-N 1 0 336.338 3.566 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000269126619 1141069419 /nfs/dbraw/zinc/06/94/19/1141069419.db2.gz YSQKEXXWYNHPGQ-FHWLQOOXSA-N 1 0 326.396 3.684 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCC[C@H]1O ZINC000270170600 1141187501 /nfs/dbraw/zinc/18/75/01/1141187501.db2.gz UGPBAVRPUOMXHN-CRAIPNDOSA-N 1 0 337.419 3.539 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000270649530 1141250780 /nfs/dbraw/zinc/25/07/80/1141250780.db2.gz LRAQIMPFZIQLSA-DZGCQCFKSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@@H](O)C(C)(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000270743747 1141265107 /nfs/dbraw/zinc/26/51/07/1141265107.db2.gz VULVIYFFEMHKAH-SNVBAGLBSA-N 1 0 338.791 3.757 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1nccs1 ZINC000271163905 1141315753 /nfs/dbraw/zinc/31/57/53/1141315753.db2.gz SOIHMDAZAKXBMN-LBPRGKRZSA-N 1 0 337.470 3.754 20 5 EHBDRO CC(C)(CCCO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000271464141 1141373814 /nfs/dbraw/zinc/37/38/14/1141373814.db2.gz GKRGXXWELZZFBC-UHFFFAOYSA-N 1 0 349.456 3.607 20 5 EHBDRO COc1ccc([C@H](OC)[C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000271485002 1141378325 /nfs/dbraw/zinc/37/83/25/1141378325.db2.gz IQMJEVTXGXXHPD-BDJLRTHQSA-N 1 0 336.413 3.531 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)Cc1cc(C)n[nH]1 ZINC000271482973 1141378738 /nfs/dbraw/zinc/37/87/38/1141378738.db2.gz JFHSMLHENLXTFT-TZMCWYRMSA-N 1 0 348.472 3.718 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1cccs1 ZINC000348679637 1141565819 /nfs/dbraw/zinc/56/58/19/1141565819.db2.gz ZTXOVQIBKXWDNO-UHFFFAOYSA-N 1 0 342.424 3.721 20 5 EHBDRO [NH3+]CCN(Cc1cccc(-c2ccncc2)c1)c1ccccc1[N+](=O)[O-] ZINC000348921796 1141609989 /nfs/dbraw/zinc/60/99/89/1141609989.db2.gz OPZMGMFUVMHPPZ-UHFFFAOYSA-N 1 0 348.406 3.622 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C\c2ccc3cccc([N+](=O)[O-])c3n2)s1 ZINC000349108164 1141640674 /nfs/dbraw/zinc/64/06/74/1141640674.db2.gz KWVGYBDXGDERBU-HJWRWDBZSA-N 1 0 340.408 3.832 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)c1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1 ZINC001165041019 721934649 /nfs/dbraw/zinc/93/46/49/721934649.db2.gz BDMKLAQJAHKMDP-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC000339425787 1014404031 /nfs/dbraw/zinc/40/40/31/1014404031.db2.gz OEAHUFHEMNHDNU-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO COC(=O)[C@H]1CC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)[C@H]1C(C)C ZINC000430148978 1014426149 /nfs/dbraw/zinc/42/61/49/1014426149.db2.gz MEZXAAMPYOXFNE-MPYBMCPGSA-N 1 0 346.427 3.518 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)Cc2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153894196 1014487624 /nfs/dbraw/zinc/48/76/24/1014487624.db2.gz DOONYQSNLXFHDE-VXGBXAGGSA-N 1 0 347.415 3.880 20 5 EHBDRO COc1ccc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000536672117 1032105400 /nfs/dbraw/zinc/10/54/00/1032105400.db2.gz ABRRICAXJBPNFX-YOEHRIQHSA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1cc(N2CCN(c3cccc([N+](=O)[O-])c3)CC2)c2ccccc2[nH+]1 ZINC000510095325 1015039811 /nfs/dbraw/zinc/03/98/11/1015039811.db2.gz KHXNUVWSFJOBAI-UHFFFAOYSA-N 1 0 348.406 3.778 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000430219831 1015087551 /nfs/dbraw/zinc/08/75/51/1015087551.db2.gz NWZFVASZVGGNBO-VLXJIEOASA-N 1 0 342.395 3.646 20 5 EHBDRO CC(C)(O)c1ccc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000274803105 1015248282 /nfs/dbraw/zinc/24/82/82/1015248282.db2.gz OVDDGPZJNLINGW-UHFFFAOYSA-N 1 0 334.803 3.765 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CCOC2(CCCC2)C1)C1CC1 ZINC000127074160 1015284986 /nfs/dbraw/zinc/28/49/86/1015284986.db2.gz JUFXAVBGJBBFGM-MSOLQXFVSA-N 1 0 344.455 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2c[nH]nc2-c2cccnc2)C2CC2)cc1 ZINC000154269219 1015330208 /nfs/dbraw/zinc/33/02/08/1015330208.db2.gz XHYDPDUJLRCPKV-UHFFFAOYSA-N 1 0 349.394 3.545 20 5 EHBDRO CC[C@](C)(CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000134469321 1015547017 /nfs/dbraw/zinc/54/70/17/1015547017.db2.gz QSDPZRSCRJESGJ-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000579868706 1015576923 /nfs/dbraw/zinc/57/69/23/1015576923.db2.gz HAESZOZHJYCHOQ-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO CC1=C[C@@H](C)C[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000430282945 1015780799 /nfs/dbraw/zinc/78/07/99/1015780799.db2.gz GVQPOCQIIJDSIS-YPMHNXCESA-N 1 0 328.372 3.604 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146912 1016615940 /nfs/dbraw/zinc/61/59/40/1016615940.db2.gz YFBZPXXNOAJOIW-CABCVRRESA-N 1 0 347.459 3.530 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000189713451 1016691848 /nfs/dbraw/zinc/69/18/48/1016691848.db2.gz XEHYUMGYXVVWSO-OAHLLOKOSA-N 1 0 347.440 3.766 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000348631021 1016738670 /nfs/dbraw/zinc/73/86/70/1016738670.db2.gz CANCWTLKEMFIKY-UHFFFAOYSA-N 1 0 344.411 3.595 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H](C)c2cc(F)cc(F)c2)cc1[N+](=O)[O-] ZINC000449103134 1032181873 /nfs/dbraw/zinc/18/18/73/1032181873.db2.gz OTHNFGVLXHSNIT-LLVKDONJSA-N 1 0 336.338 3.775 20 5 EHBDRO CC(C)(C)Oc1cc(N2CC[C@H]([NH+]3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000484982309 1032198493 /nfs/dbraw/zinc/19/84/93/1032198493.db2.gz BJLAPNMBXUPJPO-INIZCTEOSA-N 1 0 347.459 3.837 20 5 EHBDRO O=C(CC[NH2+][C@@H]1CC[C@H]2CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000548825372 1032251206 /nfs/dbraw/zinc/25/12/06/1032251206.db2.gz FRZUKDQNFGMSKJ-OWCLPIDISA-N 1 0 345.443 3.872 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000449201842 1032326796 /nfs/dbraw/zinc/32/67/96/1032326796.db2.gz HOGPUSUSTRTBSV-MOXGXCLJSA-N 1 0 339.439 3.561 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)CC(C)(C)C ZINC000536835370 1032329864 /nfs/dbraw/zinc/32/98/64/1032329864.db2.gz YBBHYYTTZGQAOP-KGLIPLIRSA-N 1 0 340.489 3.852 20 5 EHBDRO COc1ccc2c(c1)OC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000536842922 1032338802 /nfs/dbraw/zinc/33/88/02/1032338802.db2.gz BDCZPCICLMFIKW-ZFWWWQNUSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccnn1C1CCCC1 ZINC000449227900 1032346439 /nfs/dbraw/zinc/34/64/39/1032346439.db2.gz RKBLJWDQUJUGJK-UHFFFAOYSA-N 1 0 348.834 3.892 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000536856851 1032354454 /nfs/dbraw/zinc/35/44/54/1032354454.db2.gz GYJLXIZCJXMAMO-CABCVRRESA-N 1 0 344.411 3.764 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOC1CCCCC1)C1CC1 ZINC000536859861 1032358508 /nfs/dbraw/zinc/35/85/08/1032358508.db2.gz VEFHTIBILSURLJ-GOSISDBHSA-N 1 0 332.444 3.855 20 5 EHBDRO COC1CCC([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000459678883 1032407103 /nfs/dbraw/zinc/40/71/03/1032407103.db2.gz NJRAAYOVYKNAMQ-UHFFFAOYSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000449333726 1032445126 /nfs/dbraw/zinc/44/51/26/1032445126.db2.gz VQPWHYFTEWTGGC-ZFWWWQNUSA-N 1 0 348.830 3.545 20 5 EHBDRO C[C@H](Cc1cccc(F)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000459757906 1032449756 /nfs/dbraw/zinc/44/97/56/1032449756.db2.gz HZKWMNBDUIDZKI-GFCCVEGCSA-N 1 0 342.374 3.673 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3CCC[C@@H]4C[C@@H]43)cs2)c1 ZINC000459773068 1032460932 /nfs/dbraw/zinc/46/09/32/1032460932.db2.gz SIQFSHVJTSWNGI-RLCCDNCMSA-N 1 0 329.425 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3=CCOCC3)o2)c(Cl)c1 ZINC000449401321 1032524647 /nfs/dbraw/zinc/52/46/47/1032524647.db2.gz GPUZPZSPBDYXEA-UHFFFAOYSA-N 1 0 348.786 3.945 20 5 EHBDRO C[C@H](CC(C)(C)O)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449454185 1032571761 /nfs/dbraw/zinc/57/17/61/1032571761.db2.gz YPAHKULBONQDBQ-GFCCVEGCSA-N 1 0 334.441 3.962 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CCO1 ZINC000449490901 1032653643 /nfs/dbraw/zinc/65/36/43/1032653643.db2.gz DLSCYYDWQPGERD-MDZRGWNJSA-N 1 0 334.460 3.957 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCc1noc2ccccc21)C1CC1 ZINC000593967770 1032661260 /nfs/dbraw/zinc/66/12/60/1032661260.db2.gz YLTDQAYUQTZLMM-UHFFFAOYSA-N 1 0 337.379 3.943 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2cc(F)ccc2o1 ZINC000511108762 1017112733 /nfs/dbraw/zinc/11/27/33/1017112733.db2.gz QJVLEUVRZIGHRN-UHFFFAOYSA-N 1 0 329.331 3.550 20 5 EHBDRO O=[N+]([O-])c1c(NC2CC[NH+](C3CCCC3)CC2)ccc2ncccc21 ZINC000176820192 1017474619 /nfs/dbraw/zinc/47/46/19/1017474619.db2.gz VXZHYYXHWFVXPM-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[N@H+](CCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000177010418 1017545249 /nfs/dbraw/zinc/54/52/49/1017545249.db2.gz KURWMIFNYAJHOB-UHFFFAOYSA-N 1 0 325.368 3.801 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C/c1ccccc1[N+](=O)[O-] ZINC000177316498 1017604668 /nfs/dbraw/zinc/60/46/68/1017604668.db2.gz CHNPZMQWRCFHDQ-ZHACJKMWSA-N 1 0 339.395 3.617 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](C)c1ccccc1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177471567 1017678150 /nfs/dbraw/zinc/67/81/50/1017678150.db2.gz QYEKMNVOBFFATJ-ILXRZTDVSA-N 1 0 341.411 3.704 20 5 EHBDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(C)C ZINC000412074496 1017691482 /nfs/dbraw/zinc/69/14/82/1017691482.db2.gz MQRUVNZGYFOQEF-LSDHHAIUSA-N 1 0 346.431 3.543 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCc1ccc([C@H](C)[NH3+])cc1 ZINC000415295489 1017834519 /nfs/dbraw/zinc/83/45/19/1017834519.db2.gz LOISKGIEEAEZJK-ZDUSSCGKSA-N 1 0 342.399 3.553 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2coc3ccccc23)n1 ZINC000340450663 1017873855 /nfs/dbraw/zinc/87/38/55/1017873855.db2.gz NUGGMMZBDIFHMI-HOTGVXAUSA-N 1 0 340.383 3.811 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593466426 1032732338 /nfs/dbraw/zinc/73/23/38/1032732338.db2.gz VNMYITVRZBYAKN-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC(C)[C@H](CNC(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC000602287840 1032769429 /nfs/dbraw/zinc/76/94/29/1032769429.db2.gz IHKHWMSSBDKNRW-KRWDZBQOSA-N 1 0 348.447 3.617 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH+]2CCC(C3CCCC3)CC2)c2c(c1)COCO2 ZINC000610370911 1018545374 /nfs/dbraw/zinc/54/53/74/1018545374.db2.gz YSZMPBIYUKJKIQ-UHFFFAOYSA-N 1 0 346.427 3.864 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2ccccc2OC(F)F)cc1[N+](=O)[O-] ZINC000471542122 1018670412 /nfs/dbraw/zinc/67/04/12/1018670412.db2.gz MYOKTOSSJQVCCR-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO CC[C@H]([NH2+][C@@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402538 1032797083 /nfs/dbraw/zinc/79/70/83/1032797083.db2.gz IRKFUDHFAMXJIB-ROUUACIJSA-N 1 0 332.375 3.898 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@@H](C)[C@@H]1C ZINC000419373610 1018950120 /nfs/dbraw/zinc/95/01/20/1018950120.db2.gz OLWWMVHRXZQMFB-FVCCEPFGSA-N 1 0 330.388 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](CCO)c1ccccc1F)CCC2 ZINC000592403639 1032799700 /nfs/dbraw/zinc/79/97/00/1032799700.db2.gz ROCHLRDRTBCCEY-MOPGFXCFSA-N 1 0 344.386 3.825 20 5 EHBDRO CSCC[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000093559008 1019047659 /nfs/dbraw/zinc/04/76/59/1019047659.db2.gz OBAUSMZEIHRUAX-JTQLQIEISA-N 1 0 334.388 3.770 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000322407058 1019087437 /nfs/dbraw/zinc/08/74/37/1019087437.db2.gz XMEBHTCUMLYYBG-NWDGAFQWSA-N 1 0 329.322 3.652 20 5 EHBDRO CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000178857569 1019131964 /nfs/dbraw/zinc/13/19/64/1019131964.db2.gz JMCVYZJBCVBKOH-LIRRHRJNSA-N 1 0 344.411 3.720 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2(CO)CCCC2)s1 ZINC000083475457 1019196081 /nfs/dbraw/zinc/19/60/81/1019196081.db2.gz JTVZJGSUHZIDBN-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120656407 1019298520 /nfs/dbraw/zinc/29/85/20/1019298520.db2.gz XTXOYRZPGWPVOB-AWEZNQCLSA-N 1 0 338.411 3.912 20 5 EHBDRO CC(C)(C)C1=CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000500980899 1019384573 /nfs/dbraw/zinc/38/45/73/1019384573.db2.gz BEAMRNGZPHDSII-UHFFFAOYSA-N 1 0 331.416 3.602 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000580469641 1019420687 /nfs/dbraw/zinc/42/06/87/1019420687.db2.gz BGKDOBMFDBQNMP-HOCLYGCPSA-N 1 0 334.416 3.587 20 5 EHBDRO C[C@@H]1CCCC[C@H]1C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513661941 1019929412 /nfs/dbraw/zinc/92/94/12/1019929412.db2.gz RJZGKLUOLZGCPN-UWWQBHOKSA-N 1 0 342.443 3.834 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(CO)CCCC1 ZINC000471619280 1020075434 /nfs/dbraw/zinc/07/54/34/1020075434.db2.gz OMKFOZDPBRCZFG-CQSZACIVSA-N 1 0 338.473 3.608 20 5 EHBDRO CC(C)C[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000119358011 1020267918 /nfs/dbraw/zinc/26/79/18/1020267918.db2.gz ZCDZDAZSBLDCGY-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO CCC[C@H]([NH2+]CC[C@H](OC)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000345497585 1020319820 /nfs/dbraw/zinc/31/98/20/1020319820.db2.gz ZVLLIPJWAGXFTG-KBPBESRZSA-N 1 0 334.338 3.993 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000183163393 1020430935 /nfs/dbraw/zinc/43/09/35/1020430935.db2.gz NLHYTGGYPRFDKH-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)n1 ZINC000360870464 1020846118 /nfs/dbraw/zinc/84/61/18/1020846118.db2.gz ILZWXTJIFMIPQM-WBVHZDCISA-N 1 0 340.427 3.763 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090771177 1020914928 /nfs/dbraw/zinc/91/49/28/1020914928.db2.gz PYWXQVHFQFZKOP-RDTXWAMCSA-N 1 0 326.396 3.759 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602511486 1032944891 /nfs/dbraw/zinc/94/48/91/1032944891.db2.gz SYENWQFOTKZEIP-PBHICJAKSA-N 1 0 332.448 3.517 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000581507903 1021028652 /nfs/dbraw/zinc/02/86/52/1021028652.db2.gz LZYGESNQFORBPT-OAHLLOKOSA-N 1 0 333.432 3.682 20 5 EHBDRO CC(C)(C)c1csc(CC[NH2+]CCc2ccc([N+](=O)[O-])cc2)n1 ZINC000602540776 1032953512 /nfs/dbraw/zinc/95/35/12/1032953512.db2.gz SCFGIMYSRGVKBF-UHFFFAOYSA-N 1 0 333.457 3.724 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436045 1021147531 /nfs/dbraw/zinc/14/75/31/1021147531.db2.gz YAQLVGKIUURGKP-ZBFHGGJFSA-N 1 0 336.395 3.953 20 5 EHBDRO C[N@H+](Cc1ccc(Br)cc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000101434745 1021228563 /nfs/dbraw/zinc/22/85/63/1021228563.db2.gz SPGHISRMUPGKIF-UHFFFAOYSA-N 1 0 335.201 3.989 20 5 EHBDRO CC(C)(CO)CCC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602560869 1032973625 /nfs/dbraw/zinc/97/36/25/1032973625.db2.gz WFRGQGQFOIWPFE-UHFFFAOYSA-N 1 0 334.338 3.502 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCc1cccc(F)c1 ZINC000518818604 1021593350 /nfs/dbraw/zinc/59/33/50/1021593350.db2.gz JGQKCHYCVBVMGG-UHFFFAOYSA-N 1 0 332.375 3.855 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000519706566 1021638470 /nfs/dbraw/zinc/63/84/70/1021638470.db2.gz LYUYLCLZSGVUKG-KRWDZBQOSA-N 1 0 340.427 3.613 20 5 EHBDRO COCC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000506011781 1021696065 /nfs/dbraw/zinc/69/60/65/1021696065.db2.gz GZDWMPDYQICSDX-QPJJXVBHSA-N 1 0 332.425 3.818 20 5 EHBDRO C[N@@H+]1CCC2(CN(C(=O)c3cccc4cc5ccccc5cc43)C2)C1 ZINC001270531543 1021711578 /nfs/dbraw/zinc/71/15/78/1021711578.db2.gz LZDYCPJIPVKRRJ-UHFFFAOYSA-N 1 0 330.431 3.771 20 5 EHBDRO COc1ccc(OCC[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000506054774 1021873217 /nfs/dbraw/zinc/87/32/17/1021873217.db2.gz BMVNAQKSVJJBAJ-FNORWQNLSA-N 1 0 342.395 3.627 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000129482175 1022075651 /nfs/dbraw/zinc/07/56/51/1022075651.db2.gz CBFLGOYXQLMUOY-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000441409822 1022220965 /nfs/dbraw/zinc/22/09/65/1022220965.db2.gz CIGUHBWALBNKGP-MRXNPFEDSA-N 1 0 334.803 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+](CCC(F)(F)F)CC2CC2)cc1 ZINC000084137965 1022278002 /nfs/dbraw/zinc/27/80/02/1022278002.db2.gz PJJGCWBKKWRIGY-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO COc1cc(C[NH2+]CC(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000237136477 1022279727 /nfs/dbraw/zinc/27/97/27/1022279727.db2.gz YGENBCFMCYMVOH-UHFFFAOYSA-N 1 0 344.411 3.928 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187564744 1022338198 /nfs/dbraw/zinc/33/81/98/1022338198.db2.gz NNPPACQJHLSKBS-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCCC1CCOCC1 ZINC000602671591 1033050001 /nfs/dbraw/zinc/05/00/01/1033050001.db2.gz MBFCUSHNGYRQJO-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO C[C@]1(CCCO)CCC[N@@H+]1Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602668131 1033064547 /nfs/dbraw/zinc/06/45/47/1033064547.db2.gz UCMCBYREOSOMFR-OAHLLOKOSA-N 1 0 346.349 3.741 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000438346718 1022584204 /nfs/dbraw/zinc/58/42/04/1022584204.db2.gz LUYVSZYBKOPLMU-QGZVFWFLSA-N 1 0 346.452 3.916 20 5 EHBDRO CC[C@](C)(O)C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517710749 1022602253 /nfs/dbraw/zinc/60/22/53/1022602253.db2.gz CPELJDHLOUXRRV-IBGZPJMESA-N 1 0 343.427 3.613 20 5 EHBDRO CC(C)(C[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1=CCCC1 ZINC000602686729 1033067682 /nfs/dbraw/zinc/06/76/82/1033067682.db2.gz HENFXWWVUJNBFI-UHFFFAOYSA-N 1 0 344.459 3.685 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000430821236 1022723832 /nfs/dbraw/zinc/72/38/32/1022723832.db2.gz HVVNMSOFCHQJPE-NVXWUHKLSA-N 1 0 347.459 3.534 20 5 EHBDRO CCC1(CC)CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000438507518 1022743912 /nfs/dbraw/zinc/74/39/12/1022743912.db2.gz WAALIOXACYKKLG-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]C2(C3CCC3)CC2)cc1Br ZINC000602699156 1033079049 /nfs/dbraw/zinc/07/90/49/1033079049.db2.gz MPNVVBHUQYGPJK-UHFFFAOYSA-N 1 0 331.235 3.841 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3(CO)CCCCC3)o2)c1 ZINC000610583439 1022809775 /nfs/dbraw/zinc/80/97/75/1022809775.db2.gz IMTUTQWPPFQNEK-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO CC1(C)C[C@@H](O)CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602683109 1033083537 /nfs/dbraw/zinc/08/35/37/1033083537.db2.gz IHLDWNGDWSHWMD-ZDUSSCGKSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1 ZINC000510652598 1022839229 /nfs/dbraw/zinc/83/92/29/1022839229.db2.gz SWJKBALHRQCPCF-HXUWFJFHSA-N 1 0 340.423 3.509 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000536345655 1022955529 /nfs/dbraw/zinc/95/55/29/1022955529.db2.gz NJUZGNASMGCPAF-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2cccs2)C2CC2)c2c(c1)COCO2 ZINC000509568864 1023057201 /nfs/dbraw/zinc/05/72/01/1023057201.db2.gz BOIFCFZJOHMBLS-INIZCTEOSA-N 1 0 346.408 3.764 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000414958939 1023063367 /nfs/dbraw/zinc/06/33/67/1023063367.db2.gz DZSOJMHRHVKCCZ-APWZRJJASA-N 1 0 339.439 3.986 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(-n3ccnc3)cc2)C2CC2)c1 ZINC000507169200 1023171815 /nfs/dbraw/zinc/17/18/15/1023171815.db2.gz UMMTZIJTDGDQDA-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256562 1023173243 /nfs/dbraw/zinc/17/32/43/1023173243.db2.gz FOHWHCSUULQSFA-HZPDHXFCSA-N 1 0 327.428 3.766 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000266841728 1023176299 /nfs/dbraw/zinc/17/62/99/1023176299.db2.gz GYMRIYQVJGGXBN-OAHLLOKOSA-N 1 0 325.412 3.914 20 5 EHBDRO CC(C)(C)OCCC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000610682222 1023198187 /nfs/dbraw/zinc/19/81/87/1023198187.db2.gz AOZHXHWVACOYSA-UHFFFAOYSA-N 1 0 336.432 3.643 20 5 EHBDRO Cc1cc(NC[C@H](C2CC2)[N@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000480500568 1033149652 /nfs/dbraw/zinc/14/96/52/1033149652.db2.gz LEZCPHOJSCMCQO-GOSISDBHSA-N 1 0 340.427 3.621 20 5 EHBDRO CC1CC[NH+](CCCNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000024059502 1023707016 /nfs/dbraw/zinc/70/70/16/1023707016.db2.gz SJBGNEIERUTLPV-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+][C@@H]1CCCC2(CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000897773694 1033160133 /nfs/dbraw/zinc/16/01/33/1033160133.db2.gz LKMJKFXDHKUQCB-WBVHZDCISA-N 1 0 340.427 3.730 20 5 EHBDRO Cc1cccn2cc(CN(Cc3cccc([N+](=O)[O-])c3)C3CC3)nc12 ZINC000610864869 1023809232 /nfs/dbraw/zinc/80/92/32/1023809232.db2.gz NWUAQXAMKOGPCI-UHFFFAOYSA-N 1 0 336.395 3.716 20 5 EHBDRO C[C@H]1CC2(CC([NH2+]Cc3ccc(-c4ccc([N+](=O)[O-])cc4)o3)C2)CO1 ZINC000897779786 1033172592 /nfs/dbraw/zinc/17/25/92/1033172592.db2.gz AVIWMOWCJGGUIB-XIWWETDGSA-N 1 0 342.395 3.902 20 5 EHBDRO Cc1ccc([C@@H](CNc2c(F)cccc2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000342098532 1023952930 /nfs/dbraw/zinc/95/29/30/1023952930.db2.gz SFGGFGBGRWVOKF-OAHLLOKOSA-N 1 0 333.363 3.884 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@H]1CC(C)(C)C ZINC000060889725 1033175195 /nfs/dbraw/zinc/17/51/95/1033175195.db2.gz ZPGZNLJVKWKDFJ-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccccc1CC[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000522551454 1024074868 /nfs/dbraw/zinc/07/48/68/1024074868.db2.gz JBBXPUZUVAAOQV-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000465052459 1024334745 /nfs/dbraw/zinc/33/47/45/1024334745.db2.gz ITNDUCREBREZMK-GFCCVEGCSA-N 1 0 343.374 3.586 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000320438313 1024437466 /nfs/dbraw/zinc/43/74/66/1024437466.db2.gz CKOPMACPUULORS-NSHDSACASA-N 1 0 331.338 3.756 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](Oc2ccncc2)C1 ZINC000435055010 1024584667 /nfs/dbraw/zinc/58/46/67/1024584667.db2.gz GKGPVGSPMFWEJU-ILCZHQDMSA-N 1 0 339.395 3.546 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000237327945 1024724827 /nfs/dbraw/zinc/72/48/27/1024724827.db2.gz VVZZEJIKQGNTTH-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO COc1cc(C[NH2+]CC[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1O ZINC000507942996 1024789108 /nfs/dbraw/zinc/78/91/08/1024789108.db2.gz WLTKSPGRPPBJBI-ZDUSSCGKSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000119690084 1024793599 /nfs/dbraw/zinc/79/35/99/1024793599.db2.gz YEJZBGKEMUIEEC-ZDUSSCGKSA-N 1 0 349.390 3.698 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)cc2OC)cc1[N+](=O)[O-] ZINC000537970354 1024797370 /nfs/dbraw/zinc/79/73/70/1024797370.db2.gz RJJNSEHBFYBJFF-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1C[C@H]([NH+]2CCCC2)C[C@@H]1C ZINC000514890649 1024855284 /nfs/dbraw/zinc/85/52/84/1024855284.db2.gz LMFSDXZJNWWRAV-IPJVVFLOSA-N 1 0 329.444 3.557 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000514972466 1024935050 /nfs/dbraw/zinc/93/50/50/1024935050.db2.gz PALGOMDJGIQVFT-LLVKDONJSA-N 1 0 339.823 3.745 20 5 EHBDRO COc1cc(NCCCC[N@@H+]2CCC[C@@H](C)C2)c(F)cc1[N+](=O)[O-] ZINC000508272943 1025013367 /nfs/dbraw/zinc/01/33/67/1025013367.db2.gz WIKRUJYLQJSVEQ-CYBMUJFWSA-N 1 0 339.411 3.667 20 5 EHBDRO Cc1occc1CN(C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425407823 1025117767 /nfs/dbraw/zinc/11/77/67/1025117767.db2.gz QNKIMTJKGTZYOB-UHFFFAOYSA-N 1 0 339.189 3.891 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(Nc2ccccn2)CC1 ZINC000896197724 1025229076 /nfs/dbraw/zinc/22/90/76/1025229076.db2.gz FIMSYUXVVQXXIV-FNORWQNLSA-N 1 0 338.411 3.580 20 5 EHBDRO C[C@H]([NH2+]CCCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173384198 1033270976 /nfs/dbraw/zinc/27/09/76/1033270976.db2.gz SZVXGPWMYKCEOB-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000346932251 1025324888 /nfs/dbraw/zinc/32/48/88/1025324888.db2.gz LXUMSCKUHOCNTK-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCCO2)o1 ZINC000551826593 1025474788 /nfs/dbraw/zinc/47/47/88/1025474788.db2.gz NTAARYCJMYRPON-MJGOQNOKSA-N 1 0 342.395 3.998 20 5 EHBDRO O=c1cc(C[NH2+][C@@H]2CCC[C@@H]2CCO)c2c(ccc3ccccc32)o1 ZINC000285968984 1025516130 /nfs/dbraw/zinc/51/61/30/1025516130.db2.gz DREDZCFJEKYTKT-CRAIPNDOSA-N 1 0 337.419 3.587 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000451104044 1025567713 /nfs/dbraw/zinc/56/77/13/1025567713.db2.gz JHQYSCFAIOTZKU-STQMWFEESA-N 1 0 345.374 3.720 20 5 EHBDRO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000436307284 1025572326 /nfs/dbraw/zinc/57/23/26/1025572326.db2.gz KIUPCLDMCZQHHO-MNOVXSKESA-N 1 0 346.353 3.541 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000185673786 1025583677 /nfs/dbraw/zinc/58/36/77/1025583677.db2.gz HTMFUXLZDZNUQL-KXBFYZLASA-N 1 0 327.428 3.684 20 5 EHBDRO C[C@@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H](c1ccccc1)[NH+](C)C ZINC000439130071 1025787691 /nfs/dbraw/zinc/78/76/91/1025787691.db2.gz RTBBPLUDRQJGBJ-IAQYHMDHSA-N 1 0 334.807 3.747 20 5 EHBDRO CCOC[C@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474921287 1025858241 /nfs/dbraw/zinc/85/82/41/1025858241.db2.gz BRZGPVLFIBFAKE-UKRRQHHQSA-N 1 0 326.824 3.586 20 5 EHBDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1(C)C ZINC000783676026 1025859800 /nfs/dbraw/zinc/85/98/00/1025859800.db2.gz LIZPSQLJIJHDBJ-HUUCEWRRSA-N 1 0 326.824 3.930 20 5 EHBDRO C[C@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000530494592 1025942308 /nfs/dbraw/zinc/94/23/08/1025942308.db2.gz PFQAFVRUIUNXEE-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063418 1025949407 /nfs/dbraw/zinc/94/94/07/1025949407.db2.gz SXSUOJOGLYPKTA-QWRGUYRKSA-N 1 0 336.775 3.775 20 5 EHBDRO O=C(NCC12CCC[NH+]1CCC2)c1cc2ccccc2c2cccnc12 ZINC000684847416 1026081598 /nfs/dbraw/zinc/08/15/98/1026081598.db2.gz JEGROXSQRCNFPZ-UHFFFAOYSA-N 1 0 345.446 3.746 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCOCC(F)(F)F)C2)cc1 ZINC000451547195 1026099919 /nfs/dbraw/zinc/09/99/19/1026099919.db2.gz KNDWHDBWXIXJFZ-CQSZACIVSA-N 1 0 346.349 3.743 20 5 EHBDRO Cc1nc(CC[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000451550864 1026101239 /nfs/dbraw/zinc/10/12/39/1026101239.db2.gz SRHMPICDMHUWEX-HNNXBMFYSA-N 1 0 331.441 3.782 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CCO)CC2)s1 ZINC000186173834 1026316820 /nfs/dbraw/zinc/31/68/20/1026316820.db2.gz OSEGHTTVKXKJOY-UHFFFAOYSA-N 1 0 332.425 3.576 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000452078674 1026478809 /nfs/dbraw/zinc/47/88/09/1026478809.db2.gz FJIRNKGWPNEHHD-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@@H](Cc1ccsc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001167582124 1026525503 /nfs/dbraw/zinc/52/55/03/1026525503.db2.gz KYTAXLXQPXEXBG-AWEZNQCLSA-N 1 0 334.441 3.988 20 5 EHBDRO CC(C)[N@H+](C)Cc1ccccc1CNc1ccc([N+](=O)[O-])c(N)c1F ZINC000348739656 1026714858 /nfs/dbraw/zinc/71/48/58/1026714858.db2.gz DEKAECGVWLMZOD-UHFFFAOYSA-N 1 0 346.406 3.768 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[N@H+]3CCCC[C@@H]3C)C2)n1 ZINC000611616499 1027154840 /nfs/dbraw/zinc/15/48/40/1027154840.db2.gz ULTPPOBCNVRUNB-DLBZAZTESA-N 1 0 346.475 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCCC3)CC2)c2cccnc21 ZINC000413173827 1027214250 /nfs/dbraw/zinc/21/42/50/1027214250.db2.gz PNAINFYEZCQTPN-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413211244 1027284055 /nfs/dbraw/zinc/28/40/55/1027284055.db2.gz WRSMYEKDROFGQW-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@@H](C1CCCCC1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501854087 1027600697 /nfs/dbraw/zinc/60/06/97/1027600697.db2.gz WYYOLKVIMCONRR-AWEZNQCLSA-N 1 0 333.432 3.824 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178656756 1027612707 /nfs/dbraw/zinc/61/27/07/1027612707.db2.gz HRKWAPPXAAMQAH-DOTOQJQBSA-N 1 0 325.412 3.914 20 5 EHBDRO COc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178659573 1027620012 /nfs/dbraw/zinc/62/00/12/1027620012.db2.gz AXRQXVDJDMDHOC-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000078338101 1027686794 /nfs/dbraw/zinc/68/67/94/1027686794.db2.gz PBMBNLHBQZRWOB-BLLLJJGKSA-N 1 0 332.429 3.546 20 5 EHBDRO CC(C)C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391411 1027795546 /nfs/dbraw/zinc/79/55/46/1027795546.db2.gz XQEKOAKWZBNORR-MRXNPFEDSA-N 1 0 334.416 3.862 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H]([NH+]2[C@H](C)CC[C@H]2C)C1 ZINC000533511376 1027994148 /nfs/dbraw/zinc/99/41/48/1027994148.db2.gz FADKVYRIQZXYOJ-NNFUDEMPSA-N 1 0 331.460 3.993 20 5 EHBDRO CC[C@@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496897 1028090247 /nfs/dbraw/zinc/09/02/47/1028090247.db2.gz TUFRHUSGOXDCPR-RDJZCZTQSA-N 1 0 344.390 3.766 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc4c(c3)CCCC4)CC2)n1 ZINC000430069281 1028104652 /nfs/dbraw/zinc/10/46/52/1028104652.db2.gz YMDKISZODROOQY-UHFFFAOYSA-N 1 0 340.427 3.507 20 5 EHBDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685664 1028131112 /nfs/dbraw/zinc/13/11/12/1028131112.db2.gz PAIQAFHEMYBTQK-UKRRQHHQSA-N 1 0 334.445 3.625 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000444680973 1028150143 /nfs/dbraw/zinc/15/01/43/1028150143.db2.gz XWJDRIGGGIGOOL-WMLDXEAASA-N 1 0 333.432 3.742 20 5 EHBDRO COCC1(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000502373275 1028172524 /nfs/dbraw/zinc/17/25/24/1028172524.db2.gz LZTVJYQZZRGWST-NVXWUHKLSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000444764104 1028247257 /nfs/dbraw/zinc/24/72/57/1028247257.db2.gz AYHXGEMYDBVGJE-AWEZNQCLSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000421373207 1028333168 /nfs/dbraw/zinc/33/31/68/1028333168.db2.gz DPRQUGHKONQHEP-HOCLYGCPSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)OCCCO3)cc1[N+](=O)[O-] ZINC000161867822 1028334439 /nfs/dbraw/zinc/33/44/39/1028334439.db2.gz KQUDNKSGYFTPIK-AWEZNQCLSA-N 1 0 342.395 3.915 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](O)CC34CCC4)o2)c1 ZINC000421380633 1028343615 /nfs/dbraw/zinc/34/36/15/1028343615.db2.gz YQTDKUPWCPRRMS-MRXNPFEDSA-N 1 0 342.395 3.734 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391334 1028367921 /nfs/dbraw/zinc/36/79/21/1028367921.db2.gz UAFNQWCTPWXDCW-CJNGLKHVSA-N 1 0 347.440 3.766 20 5 EHBDRO COCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000519917717 1028378989 /nfs/dbraw/zinc/37/89/89/1028378989.db2.gz FRSJTXCCESYBLK-INIZCTEOSA-N 1 0 344.411 3.683 20 5 EHBDRO CCc1ccc([C@H](N[C@@H]2CC[NH2+][C@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423391996 1028404434 /nfs/dbraw/zinc/40/44/34/1028404434.db2.gz XGKVZPGMNQXDAP-ZXYWRSMDSA-N 1 0 343.427 3.570 20 5 EHBDRO CC(C)c1nc(CC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cs1 ZINC000582974698 1028416439 /nfs/dbraw/zinc/41/64/39/1028416439.db2.gz GUZSGZABJCCWKY-OAHLLOKOSA-N 1 0 331.441 3.994 20 5 EHBDRO C[C@@H](O)C[C@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000077425359 1028485349 /nfs/dbraw/zinc/48/53/49/1028485349.db2.gz YHTSXPYRZOMMJC-QWHCGFSZSA-N 1 0 334.441 3.820 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCSC[C@@H]1c1ccccc1 ZINC000523791359 1028627432 /nfs/dbraw/zinc/62/74/32/1028627432.db2.gz XZNZEHVJVSGBEC-QGZVFWFLSA-N 1 0 344.436 3.764 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000523855636 1028665615 /nfs/dbraw/zinc/66/56/15/1028665615.db2.gz RIEFTSYSBYPSIW-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3cccc([N+](=O)[O-])c3C)C2)cc1 ZINC000504495216 1028676312 /nfs/dbraw/zinc/67/63/12/1028676312.db2.gz YUQFKJDEMIGUBM-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]C2CC2)cc1 ZINC000061555031 1028692464 /nfs/dbraw/zinc/69/24/64/1028692464.db2.gz ZVMVDNCEEHSIAM-UHFFFAOYSA-N 1 0 334.379 3.700 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569540 1028703298 /nfs/dbraw/zinc/70/32/98/1028703298.db2.gz GGUGPPOWGDJJQL-XIVBQZFQSA-N 1 0 332.444 3.746 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCN(C3CCCC3)C1)CCC2 ZINC000583064226 1028714417 /nfs/dbraw/zinc/71/44/17/1028714417.db2.gz ISPNGHAGZNTJAO-BEFAXECRSA-N 1 0 329.444 3.579 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1C[C@H]([NH+]2CCCC2)C[C@H]1C ZINC000514890650 1028777527 /nfs/dbraw/zinc/77/75/27/1028777527.db2.gz LMFSDXZJNWWRAV-LNCHUYFUSA-N 1 0 329.444 3.557 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000524189015 1028953272 /nfs/dbraw/zinc/95/32/72/1028953272.db2.gz RGPZFSARAFOZLS-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@](C)(O)CCC(C)C)cc1[N+](=O)[O-] ZINC000504900219 1029026134 /nfs/dbraw/zinc/02/61/34/1029026134.db2.gz UDQIPQIYWRMXJB-KBXCAEBGSA-N 1 0 338.448 3.831 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000504899567 1029043108 /nfs/dbraw/zinc/04/31/08/1029043108.db2.gz IUIDJWKEFYQLIH-XJKSGUPXSA-N 1 0 342.395 3.648 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000514892760 1029049170 /nfs/dbraw/zinc/04/91/70/1029049170.db2.gz BAPUVPWRCTZNCY-KGLIPLIRSA-N 1 0 348.447 3.542 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912014 1029056092 /nfs/dbraw/zinc/05/60/92/1029056092.db2.gz OVGQBILFCUNYPI-PMPSAXMXSA-N 1 0 349.475 3.907 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000504911962 1029056202 /nfs/dbraw/zinc/05/62/02/1029056202.db2.gz OGMJKCNTKWAKSB-OAHLLOKOSA-N 1 0 343.427 3.781 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCCO[C@H]3C2(C)C)cc1[N+](=O)[O-] ZINC000504927513 1029073613 /nfs/dbraw/zinc/07/36/13/1029073613.db2.gz PYEHTHXKGRACLH-MZTNWIODSA-N 1 0 348.443 3.848 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](C)C(C)C ZINC000532935226 1029102429 /nfs/dbraw/zinc/10/24/29/1029102429.db2.gz WYSUJZKEKIQDEX-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO COc1ccc(CN(Cc2cccc(F)c2)C2CC2)cc1[N+](=O)[O-] ZINC000052161770 1029128202 /nfs/dbraw/zinc/12/82/02/1029128202.db2.gz PSMBXMXGHNJKGM-UHFFFAOYSA-N 1 0 330.359 3.907 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC4(CCCC4)C3)n2)c1 ZINC000615000541 1029237577 /nfs/dbraw/zinc/23/75/77/1029237577.db2.gz UGNGUSUYCYDXSS-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO CO[C@@H]1CC[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000249023608 1029285696 /nfs/dbraw/zinc/28/56/96/1029285696.db2.gz KOSXVWGRUAYTFQ-QXAKKESOSA-N 1 0 326.396 3.841 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513821042 1029522639 /nfs/dbraw/zinc/52/26/39/1029522639.db2.gz AXEMMGWPMLGEHO-JHDROBOHSA-N 1 0 334.460 3.693 20 5 EHBDRO CC(C)(C)[C@@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000446750990 1029780415 /nfs/dbraw/zinc/78/04/15/1029780415.db2.gz IWZUIOPVJXUAGQ-MRXNPFEDSA-N 1 0 334.441 3.820 20 5 EHBDRO CC[C@@H](Cc1ccc(C)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835424 1029815527 /nfs/dbraw/zinc/81/55/27/1029815527.db2.gz KZKQTPVBHKIRDF-HNNXBMFYSA-N 1 0 338.411 3.890 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC000453288106 1030030533 /nfs/dbraw/zinc/03/05/33/1030030533.db2.gz JVLMHPCXGWAEIC-NVXWUHKLSA-N 1 0 328.412 3.812 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](C(=O)N(C)CC)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000453295451 1030042911 /nfs/dbraw/zinc/04/29/11/1030042911.db2.gz YCNGUPWVIVCSHQ-SJORKVTESA-N 1 0 335.448 3.529 20 5 EHBDRO Cc1cc(-c2noc([C@H](C)[NH+]3[C@H](C)CC[C@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299254 1030049860 /nfs/dbraw/zinc/04/98/60/1030049860.db2.gz WZUKBQZBRLIXAJ-UPJWGTAASA-N 1 0 330.388 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCOC3(CCC3)C1)CCC2 ZINC000453308528 1030080650 /nfs/dbraw/zinc/08/06/50/1030080650.db2.gz CQYAHZQDBMGJPG-KSSFIOAISA-N 1 0 330.428 3.911 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])nc1 ZINC000453413608 1030225309 /nfs/dbraw/zinc/22/53/09/1030225309.db2.gz HZWQMSZAHPOVFG-QFBILLFUSA-N 1 0 339.439 3.842 20 5 EHBDRO Cc1nc2ccccc2n1CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000159591303 1030277582 /nfs/dbraw/zinc/27/75/82/1030277582.db2.gz RJKJTAGHIPQMOM-CQSZACIVSA-N 1 0 338.411 3.994 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000447546697 1030280907 /nfs/dbraw/zinc/28/09/07/1030280907.db2.gz YBEXPMUXMSEHIK-RCCFBDPRSA-N 1 0 330.428 3.910 20 5 EHBDRO COc1ccc(C[N@H+](CCc2nccs2)C(C)C)cc1[N+](=O)[O-] ZINC000159753089 1030349657 /nfs/dbraw/zinc/34/96/57/1030349657.db2.gz SZGVAZZRKMJTHP-UHFFFAOYSA-N 1 0 335.429 3.513 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000526050469 1030372423 /nfs/dbraw/zinc/37/24/23/1030372423.db2.gz RARVCDLGMOQAJY-ZDUSSCGKSA-N 1 0 346.431 3.584 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[C@@H]3O)s2)cc1 ZINC000453630742 1030433862 /nfs/dbraw/zinc/43/38/62/1030433862.db2.gz MQFFQJXJOVEUMQ-CJNGLKHVSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1)CC1(O)CCCC1 ZINC000532144619 1030436523 /nfs/dbraw/zinc/43/65/23/1030436523.db2.gz LHTRUERRJOEJBD-UHFFFAOYSA-N 1 0 340.423 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCOc1ccccc1)C1CC1 ZINC000532201995 1030475338 /nfs/dbraw/zinc/47/53/38/1030475338.db2.gz APVHJAJGDXRTSG-LJQANCHMSA-N 1 0 340.423 3.975 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2ccccc21 ZINC000520428110 1030500125 /nfs/dbraw/zinc/50/01/25/1030500125.db2.gz KXXGAQUGLQZWQR-ZDUSSCGKSA-N 1 0 325.368 3.847 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1F ZINC000482524034 1030504012 /nfs/dbraw/zinc/50/40/12/1030504012.db2.gz GHEIGLOJJYPWHU-CYBMUJFWSA-N 1 0 332.375 3.944 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267979 1030515697 /nfs/dbraw/zinc/51/56/97/1030515697.db2.gz PLWBTDCXRCYIBG-DYVFJYSZSA-N 1 0 334.416 3.862 20 5 EHBDRO COC(=O)CCC1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000527304331 1030768326 /nfs/dbraw/zinc/76/83/26/1030768326.db2.gz ZIUNKXYLFYMBNT-QINSGFPZSA-N 1 0 346.427 3.663 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccc3c(c2)OCCO3)C2CC2)cs1 ZINC000237997300 1030806840 /nfs/dbraw/zinc/80/68/40/1030806840.db2.gz VBLDAHPXLGLPMR-KRWDZBQOSA-N 1 0 346.408 3.668 20 5 EHBDRO C[C@H]1[C@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@@H+]1C ZINC000343436002 1030867363 /nfs/dbraw/zinc/86/73/63/1030867363.db2.gz LJGSGCBFLROKBB-IFXJQAMLSA-N 1 0 333.435 3.601 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1 ZINC000483101751 1030957328 /nfs/dbraw/zinc/95/73/28/1030957328.db2.gz DFXZDIHAVQUJFQ-OAHLLOKOSA-N 1 0 330.359 3.602 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360660 1030986391 /nfs/dbraw/zinc/98/63/91/1030986391.db2.gz CORVCHKFCXLNDS-PBHICJAKSA-N 1 0 344.411 3.980 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000593069977 1031313393 /nfs/dbraw/zinc/31/33/93/1031313393.db2.gz MIUIELICYXDGTQ-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2cn[nH]c2)CC1 ZINC000347370082 1031429259 /nfs/dbraw/zinc/42/92/59/1031429259.db2.gz URKWECPQTRDBBX-ZROIWOOFSA-N 1 0 326.400 3.601 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2c[nH]nc2C)CC1 ZINC000551564839 1031457804 /nfs/dbraw/zinc/45/78/04/1031457804.db2.gz QDJQHUVPAHBISJ-GXDHUFHOSA-N 1 0 340.427 3.909 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@H](C)[C@@H]1C ZINC000475744576 1031834067 /nfs/dbraw/zinc/83/40/67/1031834067.db2.gz RBVXSTGVJDEZRJ-SNPRPXQTSA-N 1 0 333.432 3.598 20 5 EHBDRO CCOc1cncc(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000598679061 1033377628 /nfs/dbraw/zinc/37/76/28/1033377628.db2.gz OZWYXUSHCMBNPR-UHFFFAOYSA-N 1 0 327.384 3.553 20 5 EHBDRO C[C@]1([NH2+]CCOc2cccc([N+](=O)[O-])c2)CCCc2ccccc21 ZINC001168423592 1033385055 /nfs/dbraw/zinc/38/50/55/1033385055.db2.gz MYRZIPZFYZPJNA-IBGZPJMESA-N 1 0 326.396 3.815 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494525 1033397398 /nfs/dbraw/zinc/39/73/98/1033397398.db2.gz CAMYCALXMKLKBS-YGRLFVJLSA-N 1 0 338.367 3.515 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594520869 1033426701 /nfs/dbraw/zinc/42/67/01/1033426701.db2.gz QQQJTYBNWIRYOJ-JLJPHGGASA-N 1 0 336.432 3.992 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000594519919 1033427369 /nfs/dbraw/zinc/42/73/69/1033427369.db2.gz MPXAJHWHCMHZRD-WBVHZDCISA-N 1 0 332.444 3.997 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000594716279 1033501126 /nfs/dbraw/zinc/50/11/26/1033501126.db2.gz NYDMNLVVRNHBDY-MRXNPFEDSA-N 1 0 343.358 3.510 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](CCO)C1CCCCC1 ZINC000595021038 1033613945 /nfs/dbraw/zinc/61/39/45/1033613945.db2.gz OKEXZXPSPOSRQL-CXAGYDPISA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](c1ccsc1)N(C)C ZINC000595002981 1033628452 /nfs/dbraw/zinc/62/84/52/1033628452.db2.gz AMTRFQWLQNIGDN-LRDDRELGSA-N 1 0 349.456 3.618 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](c1ccsc1)N(C)C ZINC000595002983 1033628477 /nfs/dbraw/zinc/62/84/77/1033628477.db2.gz AMTRFQWLQNIGDN-WBMJQRKESA-N 1 0 349.456 3.618 20 5 EHBDRO Cn1cc(C[NH2+]CC[C@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598999910 1033636112 /nfs/dbraw/zinc/63/61/12/1033636112.db2.gz JSAOXZMUQAUYOJ-HNNXBMFYSA-N 1 0 340.427 3.831 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CO[C@H](C4CC4)C3)s2)cc1 ZINC000599008179 1033643314 /nfs/dbraw/zinc/64/33/14/1033643314.db2.gz VMZUXMUAUUOHMO-YOEHRIQHSA-N 1 0 344.436 3.980 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCO[C@H]2CC2(F)F)c2ccccc2)c1 ZINC000595067690 1033644567 /nfs/dbraw/zinc/64/45/67/1033644567.db2.gz GHOLBDHDTJUNRH-IRXDYDNUSA-N 1 0 348.349 3.698 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000598994625 1033647327 /nfs/dbraw/zinc/64/73/27/1033647327.db2.gz CZFMHHMKXVQWHX-QPBFKRLHSA-N 1 0 342.395 3.976 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595070515 1033647457 /nfs/dbraw/zinc/64/74/57/1033647457.db2.gz VKQLYUDVQKKESE-UGSOOPFHSA-N 1 0 330.384 3.642 20 5 EHBDRO C[N@@H+]1CCCC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000598994321 1033647870 /nfs/dbraw/zinc/64/78/70/1033647870.db2.gz JUNTYYGIAQVNRF-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NCC[C@H](C)[NH+]1CCCCC1 ZINC000595032290 1033653227 /nfs/dbraw/zinc/65/32/27/1033653227.db2.gz MCIYFACWUPUEPL-LSDHHAIUSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC1(c2ccccn2)CCC1 ZINC000595042529 1033660931 /nfs/dbraw/zinc/66/09/31/1033660931.db2.gz HKUVAUSLRGDSGS-AWEZNQCLSA-N 1 0 341.411 3.771 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000595040279 1033661002 /nfs/dbraw/zinc/66/10/02/1033661002.db2.gz GFVISMQTUSFHDW-KBPBESRZSA-N 1 0 334.416 3.603 20 5 EHBDRO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000599047094 1033678214 /nfs/dbraw/zinc/67/82/14/1033678214.db2.gz OYEUSXBDXHZNEA-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO COCc1csc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000595077839 1033696807 /nfs/dbraw/zinc/69/68/07/1033696807.db2.gz QKXDBOMZCFMKNU-QGZVFWFLSA-N 1 0 346.452 3.914 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc2CO1)c1cccc([N+](=O)[O-])c1 ZINC000599059656 1033699377 /nfs/dbraw/zinc/69/93/77/1033699377.db2.gz IUZAWLKVBIAGLS-RBUKOAKNSA-N 1 0 326.396 3.777 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)OC)c1 ZINC000599062862 1033703141 /nfs/dbraw/zinc/70/31/41/1033703141.db2.gz VXJYFXQKNTUBLP-KUHUBIRLSA-N 1 0 344.411 3.950 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](n1cccn1)C(F)(F)F ZINC000599053933 1033704784 /nfs/dbraw/zinc/70/47/84/1033704784.db2.gz BAMDBHGJVIUABI-SMDDNHRTSA-N 1 0 342.321 3.554 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329287 1033730693 /nfs/dbraw/zinc/73/06/93/1033730693.db2.gz PNKBPDJKGXXKPE-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)C[NH+]1CCCC1 ZINC000108298880 1033795006 /nfs/dbraw/zinc/79/50/06/1033795006.db2.gz AKZCXIWSABNKEX-INIZCTEOSA-N 1 0 347.462 3.850 20 5 EHBDRO C[C@H](CCO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000593693797 1033800631 /nfs/dbraw/zinc/80/06/31/1033800631.db2.gz DVOSIWNXEKQAHA-LLVKDONJSA-N 1 0 338.791 3.711 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](CC[C@H]3CCc4ccccc43)CC2)n1 ZINC000595484247 1033809427 /nfs/dbraw/zinc/80/94/27/1033809427.db2.gz YVTOMYGDHVIYTD-MRXNPFEDSA-N 1 0 340.427 3.548 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](c3ccccn3)C2)ccc1[N+](=O)[O-] ZINC000595502817 1033834492 /nfs/dbraw/zinc/83/44/92/1033834492.db2.gz NZWRDGCFJWINQV-INIZCTEOSA-N 1 0 341.411 3.768 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(C(=O)OC)cc1 ZINC000550704400 1033894273 /nfs/dbraw/zinc/89/42/73/1033894273.db2.gz WZYBJIGSUOWHIC-GOSISDBHSA-N 1 0 342.395 3.665 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704418 1033894647 /nfs/dbraw/zinc/89/46/47/1033894647.db2.gz XKSPOEQZIJADTE-QUCCMNQESA-N 1 0 339.439 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC3(CCOCC3)[C@H]2c2ccco2)cc1 ZINC000595715487 1033959695 /nfs/dbraw/zinc/95/96/95/1033959695.db2.gz AKXRIPKPGVBMBX-GOSISDBHSA-N 1 0 342.395 3.584 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H]1CCCc2ccccc21 ZINC000603837175 1033961947 /nfs/dbraw/zinc/96/19/47/1033961947.db2.gz AJHYNQWJRCGOLA-QGZVFWFLSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1c(CN2C[C@@H](c3ccccc3)OC[C@H]2C)cccc1[N+](=O)[O-] ZINC000608976014 1033969131 /nfs/dbraw/zinc/96/91/31/1033969131.db2.gz KRQPAHPXSNRLEN-KUHUBIRLSA-N 1 0 326.396 3.865 20 5 EHBDRO Cc1c(CN2C[C@H](c3ccccc3)OC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000608976013 1033969494 /nfs/dbraw/zinc/96/94/94/1033969494.db2.gz KRQPAHPXSNRLEN-IFXJQAMLSA-N 1 0 326.396 3.865 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1CN1CC[C@]2(CC2(F)F)C1 ZINC000593119219 1033970812 /nfs/dbraw/zinc/97/08/12/1033970812.db2.gz VRWBSPDNSRLEHE-LBPRGKRZSA-N 1 0 347.159 3.588 20 5 EHBDRO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000603853712 1033977254 /nfs/dbraw/zinc/97/72/54/1033977254.db2.gz KHPXTNFVBKJDLO-UONOGXRCSA-N 1 0 328.416 3.818 20 5 EHBDRO COc1ccc(OC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)cc1 ZINC000603854809 1033978291 /nfs/dbraw/zinc/97/82/91/1033978291.db2.gz LNACMBYCJGMLBQ-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CCC1CC[NH+](Cc2cc(OC)c(OC(F)F)cc2[N+](=O)[O-])CC1 ZINC000603859876 1033984046 /nfs/dbraw/zinc/98/40/46/1033984046.db2.gz GORPWTOAWZBSMB-UHFFFAOYSA-N 1 0 344.358 3.827 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N1CCC([NH+]2CCCCC2)CC1 ZINC000450262273 1034003229 /nfs/dbraw/zinc/00/32/29/1034003229.db2.gz RVGZZSHLOBIUJX-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1cc(C[NH2+]C2(CC(C)C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000595835230 1034015056 /nfs/dbraw/zinc/01/50/56/1034015056.db2.gz SZHDYVMYTKFWLX-UHFFFAOYSA-N 1 0 344.358 3.873 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCc2nc(C3CC3)ncc2C1 ZINC000599620189 1034040029 /nfs/dbraw/zinc/04/00/29/1034040029.db2.gz QSQVNBAMNWMHMT-CYBMUJFWSA-N 1 0 338.411 3.690 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000596099812 1034062548 /nfs/dbraw/zinc/06/25/48/1034062548.db2.gz XQLOKWPXDWFOIR-NEPJUHHUSA-N 1 0 348.369 3.843 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cc(C)ccc1C ZINC000599642099 1034067029 /nfs/dbraw/zinc/06/70/29/1034067029.db2.gz ZYCAGQDQAVWOMV-KRWDZBQOSA-N 1 0 341.411 3.551 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000599692812 1034098763 /nfs/dbraw/zinc/09/87/63/1034098763.db2.gz XXSUTATXMWCVRX-BAABZTOOSA-N 1 0 332.400 3.640 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000599679785 1034108358 /nfs/dbraw/zinc/10/83/58/1034108358.db2.gz OVYJVFDHZXZOJV-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc2c(ccnc2N2CCCC[C@H]([NH+]3CCCC3)C2)c1 ZINC000450326070 1034140064 /nfs/dbraw/zinc/14/00/64/1034140064.db2.gz WXUWTEIYZNMJEX-KRWDZBQOSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@@H](NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413039 1034298761 /nfs/dbraw/zinc/29/87/61/1034298761.db2.gz SKMDWINSCADWGZ-KDOFPFPSSA-N 1 0 345.443 3.569 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000604266302 1034309960 /nfs/dbraw/zinc/30/99/60/1034309960.db2.gz YZXIUPIHXSNJRA-ZDUSSCGKSA-N 1 0 345.399 3.521 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649921 1034345937 /nfs/dbraw/zinc/34/59/37/1034345937.db2.gz DRMFZBROZBTYLG-SJKOYZFVSA-N 1 0 341.411 3.914 20 5 EHBDRO [NH3+]C1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000596648353 1034345992 /nfs/dbraw/zinc/34/59/92/1034345992.db2.gz QSXLDCLQXSBNQF-SFHVURJKSA-N 1 0 325.412 3.545 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCC[C@@H](C)C1 ZINC000604435949 1034377965 /nfs/dbraw/zinc/37/79/65/1034377965.db2.gz OHAMOWXAWCUCHW-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CSCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000604477455 1034385737 /nfs/dbraw/zinc/38/57/37/1034385737.db2.gz DNMGBDXTJQJQGG-UHFFFAOYSA-N 1 0 331.441 3.815 20 5 EHBDRO Cc1ccc(C[NH2+]CC(C)(C)c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000604532668 1034416617 /nfs/dbraw/zinc/41/66/17/1034416617.db2.gz OCXOZVVCRHPHML-UHFFFAOYSA-N 1 0 342.395 3.699 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000612194073 1034436867 /nfs/dbraw/zinc/43/68/67/1034436867.db2.gz XAONJTCEBBHYJJ-SUZKBHRPSA-N 1 0 338.407 3.764 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2cccc3[nH]ccc32)n1 ZINC000601321002 1034451887 /nfs/dbraw/zinc/45/18/87/1034451887.db2.gz MQXQDGNQYZGNKK-IRXDYDNUSA-N 1 0 339.399 3.546 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534475657 1034601047 /nfs/dbraw/zinc/60/10/47/1034601047.db2.gz PWFNYBVTRCXBMM-AWEZNQCLSA-N 1 0 338.407 3.959 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)CC2 ZINC000614976493 1034742855 /nfs/dbraw/zinc/74/28/55/1034742855.db2.gz CUDYJUOXYAXJNG-UHFFFAOYSA-N 1 0 347.459 3.837 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](c2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000892485664 1034783491 /nfs/dbraw/zinc/78/34/91/1034783491.db2.gz LLNSHMHXXPBYLJ-INIZCTEOSA-N 1 0 328.368 3.550 20 5 EHBDRO CCc1nnc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146951 1034802231 /nfs/dbraw/zinc/80/22/31/1034802231.db2.gz LAWHCQLDBXUCMU-TZMCWYRMSA-N 1 0 346.456 3.510 20 5 EHBDRO COc1cc(C[N@H+](C)C2CCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000179893610 1034984363 /nfs/dbraw/zinc/98/43/63/1034984363.db2.gz UPKPJHNXBMQCGY-UHFFFAOYSA-N 1 0 344.358 3.622 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000411896748 1035065362 /nfs/dbraw/zinc/06/53/62/1035065362.db2.gz SQIRJYZBFJEYJY-WBVHZDCISA-N 1 0 332.787 3.650 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2cc(C)sc2C)c1[N+](=O)[O-] ZINC000892510249 1035174921 /nfs/dbraw/zinc/17/49/21/1035174921.db2.gz VOZZQXCCTFOHHD-SNVBAGLBSA-N 1 0 336.413 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000431686625 1035237167 /nfs/dbraw/zinc/23/71/67/1035237167.db2.gz NXMMWGCFWAOERS-RUQDQRPJSA-N 1 0 338.407 3.975 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NCC2CCN(c3cc[nH+]cc3)CC2)c(F)c1 ZINC000180046665 1035280557 /nfs/dbraw/zinc/28/05/57/1035280557.db2.gz ISBSCYDNJFGTPV-UHFFFAOYSA-N 1 0 348.353 3.597 20 5 EHBDRO C[C@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000310659643 1035282237 /nfs/dbraw/zinc/28/22/37/1035282237.db2.gz XNQMZDANZAKRCX-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)CN(C)Cc1ccccc1 ZINC000580737133 1035450331 /nfs/dbraw/zinc/45/03/31/1035450331.db2.gz NPOVHEQGLKGKDC-MRXNPFEDSA-N 1 0 327.428 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000580984601 1035468774 /nfs/dbraw/zinc/46/87/74/1035468774.db2.gz OFXFYGGHCMQXGU-SQUITACLSA-N 1 0 349.434 3.745 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973792 1035577424 /nfs/dbraw/zinc/57/74/24/1035577424.db2.gz ICKBADDEYGPDSH-SGTLLEGYSA-N 1 0 348.374 3.608 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCCO1 ZINC000271984691 1035635094 /nfs/dbraw/zinc/63/50/94/1035635094.db2.gz KMMXGIUVCSRALF-WBMJQRKESA-N 1 0 347.440 3.766 20 5 EHBDRO O=[N+]([O-])c1sccc1N1CC[C@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000588072502 1035700545 /nfs/dbraw/zinc/70/05/45/1035700545.db2.gz RXUHBDIRTIXGRB-SFHVURJKSA-N 1 0 343.452 3.759 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389353 1035719831 /nfs/dbraw/zinc/71/98/31/1035719831.db2.gz IQQQROXKKQNDTB-LRDDRELGSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000540906905 1035785614 /nfs/dbraw/zinc/78/56/14/1035785614.db2.gz AJWCMXNXBDGEAW-HZPDHXFCSA-N 1 0 347.459 3.694 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000540917709 1035806956 /nfs/dbraw/zinc/80/69/56/1035806956.db2.gz HDPVIJCVEBPHTO-HNNXBMFYSA-N 1 0 326.824 3.586 20 5 EHBDRO Cc1ccccc1C1CC([N@H+](CCn2cc([N+](=O)[O-])cn2)C2CC2)C1 ZINC000350150613 1035964292 /nfs/dbraw/zinc/96/42/92/1035964292.db2.gz CLBGXEZRYQWLRB-UHFFFAOYSA-N 1 0 340.427 3.510 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1c(Cl)cncc1[N+](=O)[O-] ZINC000589106483 1036251815 /nfs/dbraw/zinc/25/18/15/1036251815.db2.gz UJHGQWVFAPBDKH-UHFFFAOYSA-N 1 0 348.834 3.519 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000056495176 1036329990 /nfs/dbraw/zinc/32/99/90/1036329990.db2.gz WSNYYWVDFMCRKF-UHFFFAOYSA-N 1 0 325.478 3.600 20 5 EHBDRO CCOc1cc(C[NH2+]C(C)(C)c2ccc(C)nc2)ccc1[N+](=O)[O-] ZINC000492843310 1036337608 /nfs/dbraw/zinc/33/76/08/1036337608.db2.gz BJAFUPANNFZVHN-UHFFFAOYSA-N 1 0 329.400 3.722 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000589284649 1036340085 /nfs/dbraw/zinc/34/00/85/1036340085.db2.gz NZQLJZIQCOKGDL-FUHWJXTLSA-N 1 0 345.830 3.783 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@@H](C)c2ccccc2)c1 ZINC000589497027 1036436439 /nfs/dbraw/zinc/43/64/39/1036436439.db2.gz GUNLPVIMUAKAFK-CQSZACIVSA-N 1 0 342.395 3.617 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@@H](C)O[C@@H]1C ZINC000414284048 1036436749 /nfs/dbraw/zinc/43/67/49/1036436749.db2.gz QAPSHSNUPNXBCV-APIJFGDWSA-N 1 0 338.473 3.869 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000541566579 1036442048 /nfs/dbraw/zinc/44/20/48/1036442048.db2.gz PTSCUFHSINONSD-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(C)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000045471142 1036448272 /nfs/dbraw/zinc/44/82/72/1036448272.db2.gz VFKTYRODIHMAEF-SFHVURJKSA-N 1 0 345.374 3.659 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000175730230 1036520617 /nfs/dbraw/zinc/52/06/17/1036520617.db2.gz QUNXXGHUPDOSPT-SFHVURJKSA-N 1 0 341.411 3.925 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414305425 1036558152 /nfs/dbraw/zinc/55/81/52/1036558152.db2.gz RTQOFKZHXBHJFL-ZNMIVQPWSA-N 1 0 328.359 3.574 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000541685000 1036570871 /nfs/dbraw/zinc/57/08/71/1036570871.db2.gz JMLOCNBYQGEDKJ-QUJCMNEKSA-N 1 0 342.395 3.646 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000057139434 1036721226 /nfs/dbraw/zinc/72/12/26/1036721226.db2.gz HLCBYKDKBCEQFA-UHFFFAOYSA-N 1 0 347.365 3.950 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2cncn2)cc1 ZINC000152782467 1036722890 /nfs/dbraw/zinc/72/28/90/1036722890.db2.gz GLRDWIAFUSYIBO-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000127604580 1036816120 /nfs/dbraw/zinc/81/61/20/1036816120.db2.gz XEFUNIYCLRPJEI-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO Cc1sc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1C ZINC000180446307 1036839684 /nfs/dbraw/zinc/83/96/84/1036839684.db2.gz BEQIKYJWGJWQTG-GFCCVEGCSA-N 1 0 347.440 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC34CCOCC4)o2)cc1 ZINC000376463052 1037025963 /nfs/dbraw/zinc/02/59/63/1037025963.db2.gz KLGXMGCQEUMWGI-UHFFFAOYSA-N 1 0 328.368 3.610 20 5 EHBDRO C[C@@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1CCCC[C@H]1C ZINC000761520403 1037097891 /nfs/dbraw/zinc/09/78/91/1037097891.db2.gz FAYVCUCMLRBQLX-OLZOCXBDSA-N 1 0 325.840 3.601 20 5 EHBDRO C[C@H](CN(C)Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761527037 1037101892 /nfs/dbraw/zinc/10/18/92/1037101892.db2.gz LZIVRSDIRLSUQI-CQSZACIVSA-N 1 0 347.846 3.858 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[NH2+]C3(CCC3)C2)o1 ZINC000591282897 1037319910 /nfs/dbraw/zinc/31/99/10/1037319910.db2.gz YGURXKOCVBFYOV-CQSZACIVSA-N 1 0 341.411 3.619 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)Oc1ccccc1C ZINC000462738130 1037344444 /nfs/dbraw/zinc/34/44/44/1037344444.db2.gz LBTZUGGBXRTZBA-OAHLLOKOSA-N 1 0 344.411 3.859 20 5 EHBDRO C[NH+](C)CC(C)(C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491370045 1037429412 /nfs/dbraw/zinc/42/94/12/1037429412.db2.gz XYILRTPSMCDAAX-LJQANCHMSA-N 1 0 341.455 3.862 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c1 ZINC000462922078 1037558337 /nfs/dbraw/zinc/55/83/37/1037558337.db2.gz HKKNOPGVNFOQLS-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000532547499 1037562515 /nfs/dbraw/zinc/56/25/15/1037562515.db2.gz VLFQJQOZSSRCIN-DOTOQJQBSA-N 1 0 328.412 3.812 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1N(C)C ZINC000540154102 1037624886 /nfs/dbraw/zinc/62/48/86/1037624886.db2.gz VTXFIFOIQLPXQK-CYBMUJFWSA-N 1 0 331.391 3.693 20 5 EHBDRO CC(C)C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000031582054 1037722813 /nfs/dbraw/zinc/72/28/13/1037722813.db2.gz ZOVMXWKWCSLGDP-UHFFFAOYSA-N 1 0 327.812 3.553 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H]2c2ccsc2)c2c(c1)COCO2 ZINC000046089270 1037727462 /nfs/dbraw/zinc/72/74/62/1037727462.db2.gz XMULSKDRZVWHKT-INIZCTEOSA-N 1 0 346.408 3.860 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220563 1037784864 /nfs/dbraw/zinc/78/48/64/1037784864.db2.gz NVGNGAFCBIGPCG-CXAGYDPISA-N 1 0 327.384 3.663 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000897466202 1037877542 /nfs/dbraw/zinc/87/75/42/1037877542.db2.gz PRAYJKVXJYJGAT-LRDDRELGSA-N 1 0 347.440 3.796 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC000540417778 1037920221 /nfs/dbraw/zinc/92/02/21/1037920221.db2.gz UIVCSKYXFIOVDL-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO CCCC[C@](C)(CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375422 1037924473 /nfs/dbraw/zinc/92/44/73/1037924473.db2.gz RQKMYVAHMNLFJA-QGZVFWFLSA-N 1 0 349.456 3.749 20 5 EHBDRO CCC[C@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549999401 1038011432 /nfs/dbraw/zinc/01/14/32/1038011432.db2.gz DQLZZBPNTWFTKM-OAHLLOKOSA-N 1 0 346.349 3.741 20 5 EHBDRO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000540521144 1038046146 /nfs/dbraw/zinc/04/61/46/1038046146.db2.gz JGZUUZGUGVVZAI-QGZVFWFLSA-N 1 0 345.399 3.545 20 5 EHBDRO [NH3+]C1(CC(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CCC1 ZINC000592274219 1038101114 /nfs/dbraw/zinc/10/11/14/1038101114.db2.gz RKBFVJCVUTXUHF-UHFFFAOYSA-N 1 0 341.367 3.597 20 5 EHBDRO CC(C)(C)C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(F)cc1 ZINC000341454117 1038385366 /nfs/dbraw/zinc/38/53/66/1038385366.db2.gz JITAXBIFDWHLIR-INIZCTEOSA-N 1 0 334.395 3.698 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000470172143 1038441009 /nfs/dbraw/zinc/44/10/09/1038441009.db2.gz SIWREDYBYQPSRG-WPNIOXTASA-N 1 0 343.471 3.806 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000470172232 1038449857 /nfs/dbraw/zinc/44/98/57/1038449857.db2.gz UCIFHHKMJDBRRU-SVEZXWBTSA-N 1 0 330.428 3.747 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000538743504 1038509236 /nfs/dbraw/zinc/50/92/36/1038509236.db2.gz JTMVTNWGNFBDQZ-INIZCTEOSA-N 1 0 347.459 3.514 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1C ZINC000538937424 1038604646 /nfs/dbraw/zinc/60/46/46/1038604646.db2.gz RXEDLIPLELGNDY-DGCLKSJQSA-N 1 0 343.374 3.505 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCSCC(F)(F)F ZINC000539049995 1038653757 /nfs/dbraw/zinc/65/37/57/1038653757.db2.gz UEIRZGAOEYRJOO-NSHDSACASA-N 1 0 336.379 3.801 20 5 EHBDRO CC[C@@H](C)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000539313687 1038768442 /nfs/dbraw/zinc/76/84/42/1038768442.db2.gz AZQQHAMNOAPTJU-MLGOLLRUSA-N 1 0 336.823 3.822 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCN3CCCC3)o2)c(Cl)c1 ZINC000500507704 1038886715 /nfs/dbraw/zinc/88/67/15/1038886715.db2.gz KOAOIVQTSOMPPJ-UHFFFAOYSA-N 1 0 349.818 3.694 20 5 EHBDRO CCOc1ccc(CN(C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000015293392 1039088028 /nfs/dbraw/zinc/08/80/28/1039088028.db2.gz PHHRWHGEVNFAFU-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480090349 1039140238 /nfs/dbraw/zinc/14/02/38/1039140238.db2.gz WGSCCDPFVCXOKK-WMZOPIPTSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000485738641 1039491665 /nfs/dbraw/zinc/49/16/65/1039491665.db2.gz OUYPIWTXIXEYJE-ZDUSSCGKSA-N 1 0 328.368 3.825 20 5 EHBDRO COc1cc(C[N@H+](C)CCCOc2ccc(F)cc2)ccc1[N+](=O)[O-] ZINC000485774313 1039530895 /nfs/dbraw/zinc/53/08/95/1039530895.db2.gz RDSDSZAHVNRSBZ-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000500823285 1039546829 /nfs/dbraw/zinc/54/68/29/1039546829.db2.gz URBJLFKNLBOXMF-UHFFFAOYSA-N 1 0 344.411 3.559 20 5 EHBDRO COc1ccccc1[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489106243 1039626320 /nfs/dbraw/zinc/62/63/20/1039626320.db2.gz PPYXQCDENILANO-INIZCTEOSA-N 1 0 342.395 3.949 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128418619 1039628526 /nfs/dbraw/zinc/62/85/26/1039628526.db2.gz PREWWBXGVWTJEJ-ZDUSSCGKSA-N 1 0 337.395 3.573 20 5 EHBDRO Cc1noc(C)c1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417312152 1039667372 /nfs/dbraw/zinc/66/73/72/1039667372.db2.gz NCFKTLUWPOFZBW-GOSISDBHSA-N 1 0 329.400 3.799 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)CN1CCCCCC1 ZINC000480660230 1039822523 /nfs/dbraw/zinc/82/25/23/1039822523.db2.gz FJIVVIBNADVIOX-IAGOWNOFSA-N 1 0 333.476 3.770 20 5 EHBDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893320985 1040253453 /nfs/dbraw/zinc/25/34/53/1040253453.db2.gz WQJQPUKDDMFUKM-GJZGRUSLSA-N 1 0 326.824 3.932 20 5 EHBDRO COCCOc1ccccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000481046266 1040294491 /nfs/dbraw/zinc/29/44/91/1040294491.db2.gz ILTOEBZLUDPJFA-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490038971 1040300832 /nfs/dbraw/zinc/30/08/32/1040300832.db2.gz BFDBVCYSMOIBGQ-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@](C)(c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000490042478 1040318058 /nfs/dbraw/zinc/31/80/58/1040318058.db2.gz VQNBYVJQIFRNLF-IBGZPJMESA-N 1 0 326.396 3.767 20 5 EHBDRO C[C@@H]1C[C@@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@@H+]1Cc1ccccc1 ZINC000511649212 1040398968 /nfs/dbraw/zinc/39/89/68/1040398968.db2.gz WCRKZIVYPNTJCS-NVXWUHKLSA-N 1 0 340.427 3.702 20 5 EHBDRO CCOc1cc(C[N@H+](C)C[C@@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000276938788 1040431257 /nfs/dbraw/zinc/43/12/57/1040431257.db2.gz RXPZCEVYVUWWIA-GFCCVEGCSA-N 1 0 335.429 3.686 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CCCCC2(C)C)cccc1[N+](=O)[O-] ZINC000481178652 1040437180 /nfs/dbraw/zinc/43/71/80/1040437180.db2.gz SQLLASVWHKLWQI-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCCCC1(C)C ZINC000481183384 1040444547 /nfs/dbraw/zinc/44/45/47/1040444547.db2.gz BEPXXYHJVKECDN-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H]1CCCCC1(C)C ZINC000481183382 1040444843 /nfs/dbraw/zinc/44/48/43/1040444843.db2.gz BEPXXYHJVKECDN-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481184758 1040447490 /nfs/dbraw/zinc/44/74/90/1040447490.db2.gz TVVOPVFLNODLGR-ZBFHGGJFSA-N 1 0 333.432 3.790 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1cccc([N+](=O)[O-])c1 ZINC000512673668 1040486471 /nfs/dbraw/zinc/48/64/71/1040486471.db2.gz PZNITONOQYNHGN-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@H](c4ccccc4)C3)nc2c1 ZINC000433053568 1040574990 /nfs/dbraw/zinc/57/49/90/1040574990.db2.gz QRMNRMOTPUBHDJ-HNNXBMFYSA-N 1 0 336.395 3.851 20 5 EHBDRO Cc1ncccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000487159941 1040733655 /nfs/dbraw/zinc/73/36/55/1040733655.db2.gz OCKROINFEAVGAH-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487200449 1040786814 /nfs/dbraw/zinc/78/68/14/1040786814.db2.gz PPYTYQPJSFPUNB-CQSZACIVSA-N 1 0 335.448 3.550 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1c2cc(C)ccc2C[C@@H]1C ZINC000491026974 1040873421 /nfs/dbraw/zinc/87/34/21/1040873421.db2.gz AAROUCYDRVDZLY-DJJJIMSYSA-N 1 0 326.396 3.935 20 5 EHBDRO CC1(C)C[C@@H](NC2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154341 1040917799 /nfs/dbraw/zinc/91/77/99/1040917799.db2.gz ZBZKAYMXQWGLPA-LJQANCHMSA-N 1 0 343.471 3.781 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC000491137925 1040922343 /nfs/dbraw/zinc/92/23/43/1040922343.db2.gz HASDKCMUYLTTFG-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)nc1 ZINC000078333908 1041026189 /nfs/dbraw/zinc/02/61/89/1041026189.db2.gz DSLMIVQKXIZSHO-KRWDZBQOSA-N 1 0 326.400 3.629 20 5 EHBDRO Cc1cc([C@](C)(O)C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000164181735 1041220136 /nfs/dbraw/zinc/22/01/36/1041220136.db2.gz VICPYIUKRXCTIM-BFUOFWGJSA-N 1 0 346.427 3.623 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854376 1041242772 /nfs/dbraw/zinc/24/27/72/1041242772.db2.gz QGJTZXQMKBQXIR-HNNXBMFYSA-N 1 0 341.411 3.577 20 5 EHBDRO Cc1cnccc1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433304640 1041245187 /nfs/dbraw/zinc/24/51/87/1041245187.db2.gz NYOFOJWWMQAITE-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2ncccc2[N+](=O)[O-])c2cccs2)CC1 ZINC000015128654 1041300156 /nfs/dbraw/zinc/30/01/56/1041300156.db2.gz WPDNRPZRZFVFAT-HNNXBMFYSA-N 1 0 346.456 3.936 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2)cc1[N+](=O)[O-] ZINC000544185701 1041371900 /nfs/dbraw/zinc/37/19/00/1041371900.db2.gz HQSDAPJWDSECDG-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCCO1 ZINC000511665840 1041449304 /nfs/dbraw/zinc/44/93/04/1041449304.db2.gz STGRGVROAOWALT-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1nc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])sc1C ZINC000893403566 1041734200 /nfs/dbraw/zinc/73/42/00/1041734200.db2.gz ULFBFWCKDJSZFQ-UHFFFAOYSA-N 1 0 325.821 3.654 20 5 EHBDRO Cc1cc(N2CCC[N@H+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000108101731 1042008026 /nfs/dbraw/zinc/00/80/26/1042008026.db2.gz HHJRMKHQWJPWCA-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO CCOc1ccc(NC(=O)C[N@H+](C(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000108364384 1042047465 /nfs/dbraw/zinc/04/74/65/1042047465.db2.gz KXROGPQKRZPNJJ-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000120337072 1042596337 /nfs/dbraw/zinc/59/63/37/1042596337.db2.gz ONGYAITWBKTXEJ-INIZCTEOSA-N 1 0 328.368 3.955 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCCC[C@H]([NH+]4CCCC4)C3)ccnc21 ZINC000432326768 1042904217 /nfs/dbraw/zinc/90/42/17/1042904217.db2.gz QEYBDUZNOBZEHT-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCNc3ccccc32)cc1[N+](=O)[O-] ZINC000278908601 1042904588 /nfs/dbraw/zinc/90/45/88/1042904588.db2.gz ZZJPYWVKWVBRTP-INIZCTEOSA-N 1 0 327.384 3.640 20 5 EHBDRO CSCCC[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000305936827 1042955492 /nfs/dbraw/zinc/95/54/92/1042955492.db2.gz KRYBQBAWCVVAEQ-UHFFFAOYSA-N 1 0 333.251 3.542 20 5 EHBDRO Cc1nccn1CCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278976860 1043115580 /nfs/dbraw/zinc/11/55/80/1043115580.db2.gz COWMMUBKPKWPAH-QGZVFWFLSA-N 1 0 328.416 3.502 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000344100623 1043250466 /nfs/dbraw/zinc/25/04/66/1043250466.db2.gz GQCNEQWFPWUJHX-YVEFUNNKSA-N 1 0 328.368 3.778 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])nc2)[NH+]2CCCC2)cc1 ZINC000344410512 1043977336 /nfs/dbraw/zinc/97/73/36/1043977336.db2.gz AYQFCYQRQPMGRD-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO CCC(O)(CC)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236858246 1044742395 /nfs/dbraw/zinc/74/23/95/1044742395.db2.gz NCBKFAXQMGIXIC-UHFFFAOYSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1OC(=O)c1ccc(C[NH+]2CCCCC2)o1 ZINC001125149871 1126936297 /nfs/dbraw/zinc/93/62/97/1126936297.db2.gz FNERIHAATWZVRN-UHFFFAOYSA-N 1 0 344.367 3.701 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](Cn2ccnc2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251231 1127588757 /nfs/dbraw/zinc/58/87/57/1127588757.db2.gz MXILNQPPUJXVMP-YOEHRIQHSA-N 1 0 330.432 3.865 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000765357702 1127601087 /nfs/dbraw/zinc/60/10/87/1127601087.db2.gz CEGHVNWIDSGYDN-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccnc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000301279636 1127618971 /nfs/dbraw/zinc/61/89/71/1127618971.db2.gz JRLGNHCNRJCGNA-MRXNPFEDSA-N 1 0 326.400 3.547 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@H]2CCC[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000301286212 1127729702 /nfs/dbraw/zinc/72/97/02/1127729702.db2.gz QSKDKDMLTRYMKE-CQSZACIVSA-N 1 0 346.818 3.720 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000301398762 1127740853 /nfs/dbraw/zinc/74/08/53/1127740853.db2.gz ARWFIRQVVHLYJM-PWSUYJOCSA-N 1 0 331.338 3.533 20 5 EHBDRO Cc1cc(Nc2cccc(C[NH+]3CCSCC3)c2)ncc1[N+](=O)[O-] ZINC000301417102 1127742417 /nfs/dbraw/zinc/74/24/17/1127742417.db2.gz CFFFAANDEMMPEP-UHFFFAOYSA-N 1 0 344.440 3.591 20 5 EHBDRO COc1cc(NC[C@@H](c2ccc(C)o2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301418001 1127742495 /nfs/dbraw/zinc/74/24/95/1127742495.db2.gz RJCSZIRDDYJVKQ-INIZCTEOSA-N 1 0 345.399 3.754 20 5 EHBDRO CN(C[C@@H]1CCC[N@H+](C)C1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000172235136 1127838326 /nfs/dbraw/zinc/83/83/26/1127838326.db2.gz IXOOHLQXTCJBRD-MRXNPFEDSA-N 1 0 347.462 3.802 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000282220541 1128097937 /nfs/dbraw/zinc/09/79/37/1128097937.db2.gz HYNJQAUBNSDKQW-XJKSGUPXSA-N 1 0 330.384 3.854 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1nc(-c2ccccc2)ccc1[N+](=O)[O-] ZINC001168592994 1128196899 /nfs/dbraw/zinc/19/68/99/1128196899.db2.gz DWZUSAUBEQLRAZ-IRXDYDNUSA-N 1 0 340.427 3.942 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000553331061 1128408094 /nfs/dbraw/zinc/40/80/94/1128408094.db2.gz RZPZBRPFCIUQGS-MGPQQGTHSA-N 1 0 333.432 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCc3c2cccc3Cl)cc1 ZINC000765848620 1128559549 /nfs/dbraw/zinc/55/95/49/1128559549.db2.gz JFKBJYMSWMPDCG-IRXDYDNUSA-N 1 0 332.787 3.559 20 5 EHBDRO CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765847352 1128557427 /nfs/dbraw/zinc/55/74/27/1128557427.db2.gz BCBZRXNGXLWMOS-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000273535786 1128584529 /nfs/dbraw/zinc/58/45/29/1128584529.db2.gz WFFRCXXCXMZRMG-AEFFLSMTSA-N 1 0 330.359 3.744 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1NC[C@H]1CC[N@@H+]1Cc1ccccc1 ZINC000715651301 1128655838 /nfs/dbraw/zinc/65/58/38/1128655838.db2.gz VYZCAAKJODHLGT-OAHLLOKOSA-N 1 0 331.803 3.935 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2cnn(C3CCC3)c2)cc1 ZINC000921780048 1128754857 /nfs/dbraw/zinc/75/48/57/1128754857.db2.gz OMQBKWGTKAOKSZ-UHFFFAOYSA-N 1 0 328.416 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@@H]3COCC[C@@H]3C2)cc1 ZINC000921781166 1128756701 /nfs/dbraw/zinc/75/67/01/1128756701.db2.gz XIGZRTQREOANFF-KZNAEPCWSA-N 1 0 332.444 3.712 20 5 EHBDRO COc1cc(NC[C@@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])cc1F ZINC000301624733 1128763806 /nfs/dbraw/zinc/76/38/06/1128763806.db2.gz PIHLVJJTWVBKCX-HNNXBMFYSA-N 1 0 349.362 3.585 20 5 EHBDRO Cc1nc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000301626268 1128765224 /nfs/dbraw/zinc/76/52/24/1128765224.db2.gz HKRXUJCIUSJDKB-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO CC(C)[C@@H](C)NC(=O)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153853598 1128774036 /nfs/dbraw/zinc/77/40/36/1128774036.db2.gz DJCQNAAYWWBYHM-HUUCEWRRSA-N 1 0 347.459 3.529 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000542545466 1121002184 /nfs/dbraw/zinc/00/21/84/1121002184.db2.gz QZIXZAOWLIHXJY-CABCVRRESA-N 1 0 344.411 3.764 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]2CCCO[C@H]21 ZINC000495440382 1121205183 /nfs/dbraw/zinc/20/51/83/1121205183.db2.gz RRSJVAIXWPKYTK-FVQBIDKESA-N 1 0 338.835 3.584 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCCc1ccc(Cl)cc1)CC2 ZINC000495456286 1121215601 /nfs/dbraw/zinc/21/56/01/1121215601.db2.gz ZCKCMLLURBHJMR-UHFFFAOYSA-N 1 0 331.803 3.634 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@H]1CCCN(C(=O)OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000495562548 1121274073 /nfs/dbraw/zinc/27/40/73/1121274073.db2.gz ZJKADZAATMBGLS-QRTARXTBSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@H]3SCCS[C@H]23)c1 ZINC000762613015 1121382906 /nfs/dbraw/zinc/38/29/06/1121382906.db2.gz GPJVEMOVJVUEEB-MGPQQGTHSA-N 1 0 344.889 3.717 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000193630475 1121514418 /nfs/dbraw/zinc/51/44/18/1121514418.db2.gz PVTMPUWHQKBVHA-GOSISDBHSA-N 1 0 341.411 3.973 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NCCC[N@@H+]1CCc2ccccc2C1 ZINC000301089558 1121541952 /nfs/dbraw/zinc/54/19/52/1121541952.db2.gz KYICTBJQMYURIV-UHFFFAOYSA-N 1 0 329.375 3.594 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@@H]2CC[N@@H+](C3CCCC3)C2)cc1[N+](=O)[O-] ZINC000153663106 1121561440 /nfs/dbraw/zinc/56/14/40/1121561440.db2.gz PXQLMBNSJXFWRQ-GDBMZVCRSA-N 1 0 347.459 3.661 20 5 EHBDRO Cc1c(C[NH2+]Cc2cccc3c2OC(C)(C)C3)cccc1[N+](=O)[O-] ZINC000326340214 1121650228 /nfs/dbraw/zinc/65/02/28/1121650228.db2.gz AOTHNGJBHZAAPL-UHFFFAOYSA-N 1 0 326.396 3.907 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000322473396 1121652233 /nfs/dbraw/zinc/65/22/33/1121652233.db2.gz PFBGZDFNODWRKA-MJEQTWJJSA-N 1 0 338.835 3.764 20 5 EHBDRO C[C@@H]([NH2+]CCc1nnc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000090658785 1121669335 /nfs/dbraw/zinc/66/93/35/1121669335.db2.gz PXGIXCZYQNEQAQ-CYBMUJFWSA-N 1 0 338.367 3.538 20 5 EHBDRO C[C@H](O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536205 1121683564 /nfs/dbraw/zinc/68/35/64/1121683564.db2.gz OCUXWHABLIVFPY-QWHCGFSZSA-N 1 0 332.425 3.526 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000153342919 1121747574 /nfs/dbraw/zinc/74/75/74/1121747574.db2.gz SJWHLWYGGHXBPY-XJKSGUPXSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1ncc([C@@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC000272600550 1121768718 /nfs/dbraw/zinc/76/87/18/1121768718.db2.gz IWGAOZHTNCZVQE-SNVBAGLBSA-N 1 0 334.807 3.548 20 5 EHBDRO CC(C)n1cc([C@@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cn1 ZINC000272609198 1121778787 /nfs/dbraw/zinc/77/87/87/1121778787.db2.gz KEBHNJOTOZPEOC-GFCCVEGCSA-N 1 0 336.823 3.919 20 5 EHBDRO COCC[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272619778 1121792089 /nfs/dbraw/zinc/79/20/89/1121792089.db2.gz XWJAHJIFWSVMNB-GOEBONIOSA-N 1 0 332.400 3.876 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301180698 1122311671 /nfs/dbraw/zinc/31/16/71/1122311671.db2.gz HTEBAJOGVIRPLL-QGZVFWFLSA-N 1 0 325.412 3.571 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCC[C@H]1O ZINC000497157475 1122354611 /nfs/dbraw/zinc/35/46/11/1122354611.db2.gz AFRLKOUSTVCDGC-CRAIPNDOSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+](Cc2ccc(F)cc2)CC2CC2)c1 ZINC000154310980 1122552454 /nfs/dbraw/zinc/55/24/54/1122552454.db2.gz BLSAAPSXYBFRKY-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000174870734 1122912127 /nfs/dbraw/zinc/91/21/27/1122912127.db2.gz SMEHTIKVQHHKRC-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+](Cc2cccc(O)c2)CC2CC2)c1 ZINC000498891882 1123103559 /nfs/dbraw/zinc/10/35/59/1123103559.db2.gz GIYQJGCMSPHVQH-UHFFFAOYSA-N 1 0 342.395 3.591 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000556919602 1123208370 /nfs/dbraw/zinc/20/83/70/1123208370.db2.gz GUZQHULDWVRMJR-JTQLQIEISA-N 1 0 332.322 3.987 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(C)(C)O ZINC000609707423 1123647502 /nfs/dbraw/zinc/64/75/02/1123647502.db2.gz OWXLSJUTXMMEQU-LBPRGKRZSA-N 1 0 348.374 3.775 20 5 EHBDRO O[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)COCC1CC1 ZINC000237956492 1123930632 /nfs/dbraw/zinc/93/06/32/1123930632.db2.gz QFTKZMJIUSTDGT-LJQANCHMSA-N 1 0 335.447 3.870 20 5 EHBDRO C[C@@H](O)C[C@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000543063783 1129175258 /nfs/dbraw/zinc/17/52/58/1129175258.db2.gz OZFWUVGHQFHNPH-LSDHHAIUSA-N 1 0 343.427 3.612 20 5 EHBDRO CCCCC[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)C(C)C ZINC000734829046 1131282756 /nfs/dbraw/zinc/28/27/56/1131282756.db2.gz GNNVVGNJEXHRQI-UHFFFAOYSA-N 1 0 331.420 3.711 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCO[C@@H]21 ZINC000618569915 1125114776 /nfs/dbraw/zinc/11/47/76/1125114776.db2.gz GZYIPTVNKOBTOD-DDBAPUKQSA-N 1 0 330.428 3.765 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)s1 ZINC000619696383 1125383578 /nfs/dbraw/zinc/38/35/78/1125383578.db2.gz CMKZGEYJDFWUQM-AWEZNQCLSA-N 1 0 332.429 3.690 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccccc2)nc1 ZINC000619785171 1125404055 /nfs/dbraw/zinc/40/40/55/1125404055.db2.gz DDJRQIPRPHIRHQ-UHFFFAOYSA-N 1 0 348.406 3.726 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891198 1129286266 /nfs/dbraw/zinc/28/62/66/1129286266.db2.gz UNHCMNHRBYCPRR-YOEHRIQHSA-N 1 0 346.818 3.809 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000079724010 1129289951 /nfs/dbraw/zinc/28/99/51/1129289951.db2.gz XDTOYDNLXYPBNS-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@@H]21 ZINC000301901924 1129311802 /nfs/dbraw/zinc/31/18/02/1129311802.db2.gz NUTKGGYHIPRQAZ-ZBFHGGJFSA-N 1 0 347.459 3.693 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccccc1 ZINC000067961104 1129326627 /nfs/dbraw/zinc/32/66/27/1129326627.db2.gz GARMWXDKGGPYHJ-HNNXBMFYSA-N 1 0 341.411 3.925 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@@H]3CCOC3)s2)cc1 ZINC000543227959 1129352391 /nfs/dbraw/zinc/35/23/91/1129352391.db2.gz RCMJBPDZJOCHTO-CYBMUJFWSA-N 1 0 332.425 3.840 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453581 1129360907 /nfs/dbraw/zinc/36/09/07/1129360907.db2.gz HQKURWMNINJHKO-CMPLNLGQSA-N 1 0 342.342 3.579 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000068836506 1129401807 /nfs/dbraw/zinc/40/18/07/1129401807.db2.gz PMGTTWMIHKBRTG-SFHVURJKSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069070382 1129420717 /nfs/dbraw/zinc/42/07/17/1129420717.db2.gz LRCPGGBATQZETI-ZDUSSCGKSA-N 1 0 331.372 3.518 20 5 EHBDRO CN(C)CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCC1 ZINC000466422579 1129437562 /nfs/dbraw/zinc/43/75/62/1129437562.db2.gz ULHBRQUJCZVIDQ-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@H](O)[C@H]4C3)s2)cc1 ZINC000543413224 1129473445 /nfs/dbraw/zinc/47/34/45/1129473445.db2.gz ZUKMGJDZOAPXOS-JQFCIGGWSA-N 1 0 344.436 3.526 20 5 EHBDRO Cc1nc(Nc2cccc(CC[N@@H+](C)C3CC3)c2)ccc1[N+](=O)[O-] ZINC000301985586 1129486038 /nfs/dbraw/zinc/48/60/38/1129486038.db2.gz JRDGUJYOPBXIDW-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO CN1C[C@@H](CC[NH2+]Cc2c3ccccc3cc3ccccc32)CC1=O ZINC000922486529 1129548895 /nfs/dbraw/zinc/54/88/95/1129548895.db2.gz VZFFEYVKRIWQCT-INIZCTEOSA-N 1 0 332.447 3.951 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802845 1129590660 /nfs/dbraw/zinc/59/06/60/1129590660.db2.gz YFWXURGDCNIZEK-BLLLJJGKSA-N 1 0 346.818 3.576 20 5 EHBDRO CC1(C)[C@@H]2C[N@@H+](Cc3csc(-c4cccc([N+](=O)[O-])c4)n3)C[C@@H]21 ZINC000093660985 1129598508 /nfs/dbraw/zinc/59/85/08/1129598508.db2.gz NSIMYTNHEAEOTA-GASCZTMLSA-N 1 0 329.425 3.806 20 5 EHBDRO COc1cc(CN2C[C@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000093867491 1129605672 /nfs/dbraw/zinc/60/56/72/1129605672.db2.gz LETJSUZTAXLHLD-DJJJIMSYSA-N 1 0 342.395 3.805 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)cccc1[N+](=O)[O-] ZINC000155070288 1129610190 /nfs/dbraw/zinc/61/01/90/1129610190.db2.gz CESJTZRVXGBWEH-CJNGLKHVSA-N 1 0 333.457 3.918 20 5 EHBDRO CCc1noc([C@H]2CC[C@H]([NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC000922861572 1129696861 /nfs/dbraw/zinc/69/68/61/1129696861.db2.gz DRDUHGCYTBGNGK-KBPBESRZSA-N 1 0 344.415 3.583 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2c3c(ccc2[N+](=O)[O-])NCC3)c1 ZINC000302385649 1129776832 /nfs/dbraw/zinc/77/68/32/1129776832.db2.gz ARXDAUVTOOVNMC-UHFFFAOYSA-N 1 0 340.427 3.627 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000543559403 1129973421 /nfs/dbraw/zinc/97/34/21/1129973421.db2.gz SDIRMULNCVVHAI-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000700734075 1130066892 /nfs/dbraw/zinc/06/68/92/1130066892.db2.gz ITOVCXDBKCVAQP-HEHGZKQESA-N 1 0 349.431 3.643 20 5 EHBDRO C[C@@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccn1 ZINC000172111686 1130106549 /nfs/dbraw/zinc/10/65/49/1130106549.db2.gz QKPLZLYKDUINRT-GFCCVEGCSA-N 1 0 340.408 3.964 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173349650 1130214450 /nfs/dbraw/zinc/21/44/50/1130214450.db2.gz OVBJWZXNLIPIMY-LSDHHAIUSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000246201014 1130356025 /nfs/dbraw/zinc/35/60/25/1130356025.db2.gz WALCDVDUTBFCFG-IVMMDQJWSA-N 1 0 342.399 3.798 20 5 EHBDRO CCCO[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000175217149 1130413654 /nfs/dbraw/zinc/41/36/54/1130413654.db2.gz KSCUSPMUNBALIF-QGZVFWFLSA-N 1 0 336.432 3.775 20 5 EHBDRO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000731893302 1130854402 /nfs/dbraw/zinc/85/44/02/1130854402.db2.gz OYQRGHFUBZRXCT-VCBZYWHSSA-N 1 0 326.396 3.945 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000733299939 1131018346 /nfs/dbraw/zinc/01/83/46/1131018346.db2.gz KXXUPBZFVWVBSY-LLVKDONJSA-N 1 0 331.338 3.580 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000766191911 1131083844 /nfs/dbraw/zinc/08/38/44/1131083844.db2.gz IFCFMOHQMBIBDI-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO C[C@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000741021844 1131570553 /nfs/dbraw/zinc/57/05/53/1131570553.db2.gz QGCGTCIVXUNFRA-IJLUTSLNSA-N 1 0 340.807 3.553 20 5 EHBDRO Cc1cccc(C2(O)CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)c1C ZINC000741800194 1131651926 /nfs/dbraw/zinc/65/19/26/1131651926.db2.gz IUDFPLPFXWCHKX-UHFFFAOYSA-N 1 0 340.423 3.695 20 5 EHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150029 1131693291 /nfs/dbraw/zinc/69/32/91/1131693291.db2.gz TYFOILBQSHBOSC-GDBMZVCRSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOc1ccccc1F)CC2 ZINC001172898772 1131882448 /nfs/dbraw/zinc/88/24/48/1131882448.db2.gz JEZKFVXBTGMICF-INIZCTEOSA-N 1 0 344.386 3.650 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)cn1 ZINC001172899175 1131883166 /nfs/dbraw/zinc/88/31/66/1131883166.db2.gz LNCAFJVIYCCKFD-WBMJQRKESA-N 1 0 329.375 3.727 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172901575 1131884531 /nfs/dbraw/zinc/88/45/31/1131884531.db2.gz NUHZTLSCWHORRW-IEBWSBKVSA-N 1 0 325.412 3.978 20 5 EHBDRO [NH3+]Cc1ccc2ncn([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c2c1 ZINC001172902036 1131885702 /nfs/dbraw/zinc/88/57/02/1131885702.db2.gz UDDFKRACXCSUMM-MRXNPFEDSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCOc3ccccc31)CC2 ZINC001172896410 1131901876 /nfs/dbraw/zinc/90/18/76/1131901876.db2.gz OZNYYLXNDVKZSI-VQIMIIECSA-N 1 0 338.407 3.956 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(O)cc1 ZINC001172911308 1131917458 /nfs/dbraw/zinc/91/74/58/1131917458.db2.gz IIBRMRGPIRJTFN-KDOFPFPSSA-N 1 0 340.423 3.941 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@@H]3CCC[C@@H]3C2)c1F ZINC001173178277 1131992790 /nfs/dbraw/zinc/99/27/90/1131992790.db2.gz ACFXDYLKKMQTEN-MELADBBJSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)c1F ZINC001173188983 1131994590 /nfs/dbraw/zinc/99/45/90/1131994590.db2.gz MTDADAKOGDWGAR-OSFYFWSMSA-N 1 0 336.407 3.842 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)Cc2cccnc2C)c1F ZINC001173191214 1131995130 /nfs/dbraw/zinc/99/51/30/1131995130.db2.gz BBSXRBZUACGLJF-GFCCVEGCSA-N 1 0 347.390 3.509 20 5 EHBDRO Cc1cccn2c([C@H](C)[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)cnc12 ZINC001173222346 1132004068 /nfs/dbraw/zinc/00/40/68/1132004068.db2.gz WQMGXTZCVMKHFG-GJZGRUSLSA-N 1 0 338.411 3.833 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC001173220208 1132004400 /nfs/dbraw/zinc/00/44/00/1132004400.db2.gz VWKUCHHAZYCAJV-LSDHHAIUSA-N 1 0 328.412 3.842 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001173228540 1132007699 /nfs/dbraw/zinc/00/76/99/1132007699.db2.gz XMSPKYVQYRCTLA-DNVCBOLYSA-N 1 0 325.412 3.628 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1cccnc1F)C1CC1 ZINC001173229596 1132007793 /nfs/dbraw/zinc/00/77/93/1132007793.db2.gz NXTGBRNRVBHVRH-YVEFUNNKSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1cccnc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228800 1132008008 /nfs/dbraw/zinc/00/80/08/1132008008.db2.gz KLGGMNMMAQCISX-FZKQIMNGSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1cccnc1F)C1CC1 ZINC001173229595 1132008123 /nfs/dbraw/zinc/00/81/23/1132008123.db2.gz NXTGBRNRVBHVRH-SJKOYZFVSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ncc(Cl)cc2C1 ZINC001173229920 1132008370 /nfs/dbraw/zinc/00/83/70/1132008370.db2.gz BURQXRVNYVUIEF-GFCCVEGCSA-N 1 0 331.803 3.633 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CSc2ccccc2C1 ZINC001173231111 1132009410 /nfs/dbraw/zinc/00/94/10/1132009410.db2.gz XLRBRFMYXJGITJ-XJKSGUPXSA-N 1 0 328.437 3.832 20 5 EHBDRO COc1ccccc1CC[N@H+](C)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232825 1132010329 /nfs/dbraw/zinc/01/03/29/1132010329.db2.gz IEGDTODFCYJTRE-OAHLLOKOSA-N 1 0 328.412 3.709 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccccc1-n1cccn1 ZINC001173236111 1132011201 /nfs/dbraw/zinc/01/12/01/1132011201.db2.gz WWVQOONWVAOBEX-HNNXBMFYSA-N 1 0 336.395 3.501 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(-c2ccccc2)no1 ZINC001173212997 1132014141 /nfs/dbraw/zinc/01/41/41/1132014141.db2.gz FEPCYIYXYDPVPQ-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168978351 1132618193 /nfs/dbraw/zinc/61/81/93/1132618193.db2.gz RGFSIMHQTFYVMG-SUNKGSAMSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2cncc(C(F)(F)F)c2)C2CC2)C1 ZINC001168999792 1132627895 /nfs/dbraw/zinc/62/78/95/1132627895.db2.gz VTGPUVKMMMXEMB-WKPIXPDZSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(n3ccc4ccccc43)CC2)C1 ZINC001169036543 1132637015 /nfs/dbraw/zinc/63/70/15/1132637015.db2.gz GKVOCDFBUNXKPS-YJBOKZPZSA-N 1 0 327.428 3.724 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2ccc(F)cc2C)c([N+](=O)[O-])c1 ZINC001175991604 1132809587 /nfs/dbraw/zinc/80/95/87/1132809587.db2.gz GTFFWAFMLXJUBI-ZDUSSCGKSA-N 1 0 348.374 3.781 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cscn1 ZINC001175945785 1132810110 /nfs/dbraw/zinc/81/01/10/1132810110.db2.gz WDFRQVHTMBUETC-UHFFFAOYSA-N 1 0 336.420 3.701 20 5 EHBDRO Cc1csc(C[C@H]2CCC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)n1 ZINC001176218350 1132877952 /nfs/dbraw/zinc/87/79/52/1132877952.db2.gz PLICJFFFZYCHNO-CYBMUJFWSA-N 1 0 349.431 3.954 20 5 EHBDRO CCC1([NH+]2CCC2)CCN([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC001176234839 1132882534 /nfs/dbraw/zinc/88/25/34/1132882534.db2.gz JCYZTAAERRFJOP-INIZCTEOSA-N 1 0 331.460 3.915 20 5 EHBDRO CCOc1cc(N2CC[NH+]([C@H](C)CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC001169907310 1132895869 /nfs/dbraw/zinc/89/58/69/1132895869.db2.gz DNFSLFJSFCWBNF-OAHLLOKOSA-N 1 0 335.448 3.550 20 5 EHBDRO C[N@H+](CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CCC(C)(C)C1 ZINC001169942269 1132903752 /nfs/dbraw/zinc/90/37/52/1132903752.db2.gz LDLTYHWENUFTNG-LBPRGKRZSA-N 1 0 339.823 3.697 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccsc1 ZINC000804348460 1132971836 /nfs/dbraw/zinc/97/18/36/1132971836.db2.gz BRNPWYILBZFYEG-INIZCTEOSA-N 1 0 334.445 3.734 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@@H](O)C3CCCCC3)o2)c1 ZINC001177625205 1133088726 /nfs/dbraw/zinc/08/87/26/1133088726.db2.gz YLKQEOTWCQJJND-GOSISDBHSA-N 1 0 344.411 3.886 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)CC2 ZINC001178176201 1133138689 /nfs/dbraw/zinc/13/86/89/1133138689.db2.gz HUZYHNHZWCEBBB-HNNXBMFYSA-N 1 0 346.814 3.904 20 5 EHBDRO COc1ccccc1OC[C@H](C)C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001178228394 1133149237 /nfs/dbraw/zinc/14/92/37/1133149237.db2.gz FJIWCXZXJFHSEX-CQSZACIVSA-N 1 0 344.411 3.717 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@@H]2C[NH+]2CCCCC2)ccc1Cl ZINC000768542772 1133153674 /nfs/dbraw/zinc/15/36/74/1133153674.db2.gz ZJRMTMYWNGWYLO-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC001180306061 1133354766 /nfs/dbraw/zinc/35/47/66/1133354766.db2.gz RYKVQZHNPVUSDG-CABCVRRESA-N 1 0 341.411 3.971 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC001180533059 1133383758 /nfs/dbraw/zinc/38/37/58/1133383758.db2.gz XMDZQFUKVNUCJO-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)c(F)c1 ZINC000817544543 1133533721 /nfs/dbraw/zinc/53/37/21/1133533721.db2.gz ADPKTYIQOHXSMM-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO Cc1ccc([C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000774408864 1133673433 /nfs/dbraw/zinc/67/34/33/1133673433.db2.gz JRCZJJBTCHYNBN-RBUKOAKNSA-N 1 0 326.396 3.678 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC001183642013 1133834513 /nfs/dbraw/zinc/83/45/13/1133834513.db2.gz GPWIVYTYVWSTGB-ATCHWDNASA-N 1 0 344.455 3.853 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnn(CC2CCC2)c1 ZINC001184035982 1133890382 /nfs/dbraw/zinc/89/03/82/1133890382.db2.gz UAEUWBZMLQWCCD-OAHLLOKOSA-N 1 0 342.443 3.702 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)C[C@H](O)c1ccco1 ZINC000786820528 1133911367 /nfs/dbraw/zinc/91/13/67/1133911367.db2.gz KKQNIUVLRWYAJG-RVUPLZSRSA-N 1 0 330.384 3.693 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)C[C@@H](O)c1ccco1 ZINC000786820524 1133911486 /nfs/dbraw/zinc/91/14/86/1133911486.db2.gz KKQNIUVLRWYAJG-BYPLOIIRSA-N 1 0 330.384 3.693 20 5 EHBDRO CC(C)Oc1nc(NCCC[NH2+]C2CCCCC2)ccc1[N+](=O)[O-] ZINC001184793011 1133991469 /nfs/dbraw/zinc/99/14/69/1133991469.db2.gz OVQVWRKORLBYOY-UHFFFAOYSA-N 1 0 336.436 3.501 20 5 EHBDRO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998592 1134018236 /nfs/dbraw/zinc/01/82/36/1134018236.db2.gz FIDYFXUKQMUMRD-QLFBSQMISA-N 1 0 342.443 3.921 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)[C@H](CO)C2CC2)cc1F ZINC000788486381 1134131021 /nfs/dbraw/zinc/13/10/21/1134131021.db2.gz UUOAODKQRXVKBR-LJQANCHMSA-N 1 0 344.386 3.507 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000788541924 1134139520 /nfs/dbraw/zinc/13/95/20/1134139520.db2.gz ZGKDXYIATDDOKQ-RIZQAGQYSA-N 1 0 340.423 3.956 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000788580006 1134147195 /nfs/dbraw/zinc/14/71/95/1134147195.db2.gz JXUHDLQPDZAWPL-MSOLQXFVSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788646795 1134150934 /nfs/dbraw/zinc/15/09/34/1134150934.db2.gz CYWWHFOSDGTXAZ-SECBINFHSA-N 1 0 325.821 3.785 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000788665096 1134159047 /nfs/dbraw/zinc/15/90/47/1134159047.db2.gz MJYXBUJODXXPNT-RYUDHWBXSA-N 1 0 349.818 3.949 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)Oc1ccccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665095 1134159325 /nfs/dbraw/zinc/15/93/25/1134159325.db2.gz MJYXBUJODXXPNT-NWDGAFQWSA-N 1 0 349.818 3.949 20 5 EHBDRO CC(C)Oc1nc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187064506 1134291808 /nfs/dbraw/zinc/29/18/08/1134291808.db2.gz WTYZBRMIEBYKDW-HNNXBMFYSA-N 1 0 348.447 3.596 20 5 EHBDRO CC(C)[NH+]1CCC(CCNc2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001187189868 1134307870 /nfs/dbraw/zinc/30/78/70/1134307870.db2.gz KFETYWYJCVGOFG-UHFFFAOYSA-N 1 0 327.375 3.795 20 5 EHBDRO CCCCC[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000775316065 1134627995 /nfs/dbraw/zinc/62/79/95/1134627995.db2.gz MQTNVYGMPHIUMV-GOSISDBHSA-N 1 0 343.427 3.668 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C(C)(C)c1ccc(F)cc1 ZINC000103483461 1134707488 /nfs/dbraw/zinc/70/74/88/1134707488.db2.gz YAXZXQDWXWECBF-UHFFFAOYSA-N 1 0 345.374 3.506 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC001170296650 1134737544 /nfs/dbraw/zinc/73/75/44/1134737544.db2.gz HGUAWNMMNUQCKF-MRXNPFEDSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3cc(C)ncc32)c([N+](=O)[O-])c1 ZINC001170324113 1134747240 /nfs/dbraw/zinc/74/72/40/1134747240.db2.gz OGMMOBPZQXAKMV-ACJLOTCBSA-N 1 0 341.411 3.515 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170326930 1134748467 /nfs/dbraw/zinc/74/84/67/1134748467.db2.gz CNKVCOIRHNTKGI-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3c2cccc3O)c([N+](=O)[O-])c1 ZINC001170327869 1134749273 /nfs/dbraw/zinc/74/92/73/1134749273.db2.gz IPLPAMYHZXNYEC-PXAZEXFGSA-N 1 0 342.395 3.517 20 5 EHBDRO Cc1ccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1[N+](=O)[O-] ZINC001190826219 1134756034 /nfs/dbraw/zinc/75/60/34/1134756034.db2.gz GGCYZQSSEQGAPI-LJQANCHMSA-N 1 0 345.487 3.991 20 5 EHBDRO COc1ccc2c(c1)CCC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC001190840313 1134757631 /nfs/dbraw/zinc/75/76/31/1134757631.db2.gz ZBQAPZWYIGQPEQ-UHFFFAOYSA-N 1 0 326.396 3.860 20 5 EHBDRO COc1cc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)cc([N+](=O)[O-])c1C ZINC001170452062 1135091744 /nfs/dbraw/zinc/09/17/44/1135091744.db2.gz VMFWPJMDCJNDMA-UHFFFAOYSA-N 1 0 335.448 3.975 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCC[C@@H](C)C2)c1 ZINC000747207767 1135164663 /nfs/dbraw/zinc/16/46/63/1135164663.db2.gz NTSRSLJIJMDENS-CYBMUJFWSA-N 1 0 339.411 3.667 20 5 EHBDRO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)CCOc1ccccc1C ZINC001195324420 1135406187 /nfs/dbraw/zinc/40/61/87/1135406187.db2.gz PHAQLDXQSHHGNH-UHFFFAOYSA-N 1 0 344.411 3.683 20 5 EHBDRO Cc1c(C[N@H+]2CC[C@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495920 1135433865 /nfs/dbraw/zinc/43/38/65/1135433865.db2.gz AZTAXIBMQFYEQG-BBRMVZONSA-N 1 0 348.443 3.703 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1CC1CCCC1 ZINC001195639451 1135445875 /nfs/dbraw/zinc/44/58/75/1135445875.db2.gz URHSTALJFIOSQE-INIZCTEOSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC2(CCSCC2)CC1 ZINC001196685517 1135600731 /nfs/dbraw/zinc/60/07/31/1135600731.db2.gz XAGHRHQHJDBJPL-UHFFFAOYSA-N 1 0 336.457 3.583 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](CC[C@H](O)c2ccccc2)C2CC2)c1 ZINC000808735551 1135732494 /nfs/dbraw/zinc/73/24/94/1135732494.db2.gz RFHYMECUFNMGCC-IBGZPJMESA-N 1 0 326.396 3.683 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000809747577 1135884756 /nfs/dbraw/zinc/88/47/56/1135884756.db2.gz CUXPBGZCSCZFMK-LJQANCHMSA-N 1 0 328.412 3.932 20 5 EHBDRO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCCC[C@H]1O ZINC000809973119 1135907560 /nfs/dbraw/zinc/90/75/60/1135907560.db2.gz ITOOKFSZXQFMKL-QMTHXVAHSA-N 1 0 347.242 3.885 20 5 EHBDRO CCC[N@H+](CC)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811484351 1136091920 /nfs/dbraw/zinc/09/19/20/1136091920.db2.gz ZULVEAMBTJNBEL-UHFFFAOYSA-N 1 0 334.247 3.723 20 5 EHBDRO CCN(CCC[NH+](C)C)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811507214 1136101023 /nfs/dbraw/zinc/10/10/23/1136101023.db2.gz UYEDPRPKOUXZOS-UHFFFAOYSA-N 1 0 334.247 3.675 20 5 EHBDRO CC(C)c1ccc(CC[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776270246 1136124298 /nfs/dbraw/zinc/12/42/98/1136124298.db2.gz BENBAWSCJKLFET-IBGZPJMESA-N 1 0 328.412 3.584 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1c(Cl)cncc1[N+](=O)[O-] ZINC001170681068 1136221620 /nfs/dbraw/zinc/22/16/20/1136221620.db2.gz DZCUWVVGQBXDIM-JTQLQIEISA-N 1 0 343.774 3.516 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2C[C@@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850371582 1136244142 /nfs/dbraw/zinc/24/41/42/1136244142.db2.gz KWOOMYAXINGONG-PKOBYXMFSA-N 1 0 326.396 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3SCCS3)o2)cc1 ZINC000850401492 1136249829 /nfs/dbraw/zinc/24/98/29/1136249829.db2.gz FGYFACBQYCJFQV-UHFFFAOYSA-N 1 0 336.438 3.751 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411563 1136252602 /nfs/dbraw/zinc/25/26/02/1136252602.db2.gz FPXNOEVYJQMOJB-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](O)c1cc(C)cc(C)c1 ZINC000850467733 1136265194 /nfs/dbraw/zinc/26/51/94/1136265194.db2.gz SDVRDHLYEJMZIW-RDTXWAMCSA-N 1 0 344.411 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)CC2)cc1 ZINC000776582451 1136442600 /nfs/dbraw/zinc/44/26/00/1136442600.db2.gz UQSAUXLICLMWSP-FXAWDEMLSA-N 1 0 340.423 3.898 20 5 EHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@@H]1CCc2ccccc21 ZINC000852724736 1136480570 /nfs/dbraw/zinc/48/05/70/1136480570.db2.gz KZFRYYPUVZLYCS-AWEZNQCLSA-N 1 0 341.367 3.665 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)o1 ZINC000338956984 1136558869 /nfs/dbraw/zinc/55/88/69/1136558869.db2.gz CJBDZGAHCFXBLN-UHFFFAOYSA-N 1 0 340.383 3.561 20 5 EHBDRO CC(C)Oc1ccc(CC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556602 1136610245 /nfs/dbraw/zinc/61/02/45/1136610245.db2.gz ZDVADKZQHNLYAO-AWEZNQCLSA-N 1 0 343.427 3.858 20 5 EHBDRO Cc1cccc(OC[C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815563455 1136611318 /nfs/dbraw/zinc/61/13/18/1136611318.db2.gz CKFNSZVDMWPBMJ-KGLIPLIRSA-N 1 0 329.400 3.604 20 5 EHBDRO Cc1ccc2c(CC[NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)c[nH]c2c1 ZINC000815572362 1136618088 /nfs/dbraw/zinc/61/80/88/1136618088.db2.gz BDZGEQJISXHKEX-ZDUSSCGKSA-N 1 0 338.411 3.860 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815616841 1136619338 /nfs/dbraw/zinc/61/93/38/1136619338.db2.gz ZHWFIPXLGAZKIW-JTQLQIEISA-N 1 0 347.802 3.616 20 5 EHBDRO COc1ccc(C2([NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)cc1 ZINC000815605275 1136622369 /nfs/dbraw/zinc/62/23/69/1136622369.db2.gz PTMDUPZEGQPLJX-LBPRGKRZSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](CO)C2CCCCC2)cc1Cl ZINC000816650202 1136745004 /nfs/dbraw/zinc/74/50/04/1136745004.db2.gz XWYFUFJWQDBZIH-CQSZACIVSA-N 1 0 326.824 3.527 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(c3ccc(Cl)cc3)CC2)c1 ZINC000819009814 1136899833 /nfs/dbraw/zinc/89/98/33/1136899833.db2.gz SGEQTOKIOXIZNI-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(c3cccc(Cl)c3)CC2)cc1 ZINC000819091330 1136907853 /nfs/dbraw/zinc/90/78/53/1136907853.db2.gz FDYAHTGSDJSKIR-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000819284103 1136927790 /nfs/dbraw/zinc/92/77/90/1136927790.db2.gz XXCKNJGJBKKWDY-ZVZYQTTQSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000819274215 1136930645 /nfs/dbraw/zinc/93/06/45/1136930645.db2.gz FSGBDJAFJODHSH-UCLAIMLFSA-N 1 0 344.386 3.693 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(N(C)C(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000858496018 1136973300 /nfs/dbraw/zinc/97/33/00/1136973300.db2.gz HQFWRMUHJLIELU-IBGZPJMESA-N 1 0 341.411 3.818 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(N(C)C(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000858496019 1136973518 /nfs/dbraw/zinc/97/35/18/1136973518.db2.gz HQFWRMUHJLIELU-LJQANCHMSA-N 1 0 341.411 3.818 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000339011800 1136974998 /nfs/dbraw/zinc/97/49/98/1136974998.db2.gz SUXZTLFNJPQQGG-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO Cc1cc(-c2noc([C@@H]3C[C@H]4CCCC[C@@H]4[NH2+]3)n2)cc([N+](=O)[O-])c1 ZINC000823270844 1137092757 /nfs/dbraw/zinc/09/27/57/1137092757.db2.gz VYWKXZGZCLSWPH-UGFHNGPFSA-N 1 0 328.372 3.546 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823606944 1137106524 /nfs/dbraw/zinc/10/65/24/1137106524.db2.gz XTVZZIRTUBBQCD-BEFAXECRSA-N 1 0 328.412 3.804 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])nc1 ZINC000339029421 1137111123 /nfs/dbraw/zinc/11/11/23/1137111123.db2.gz LDKPVVDMGKQMNK-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO CO[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000824592031 1137144265 /nfs/dbraw/zinc/14/42/65/1137144265.db2.gz XSFNLWBDSJEOHG-HNNXBMFYSA-N 1 0 334.803 3.596 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)c1 ZINC000863590932 1137193096 /nfs/dbraw/zinc/19/30/96/1137193096.db2.gz PRWJGQAMUGBLIU-QZTJIDSGSA-N 1 0 346.814 3.949 20 5 EHBDRO C[C@@H](CSc1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359979 1137215269 /nfs/dbraw/zinc/21/52/69/1137215269.db2.gz LXGJXYNJJPNODU-KBXCAEBGSA-N 1 0 346.452 3.741 20 5 EHBDRO C[C@H](CSc1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000844359981 1137215353 /nfs/dbraw/zinc/21/53/53/1137215353.db2.gz LXGJXYNJJPNODU-KDOFPFPSSA-N 1 0 346.452 3.741 20 5 EHBDRO COCc1csc(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000866390874 1137351182 /nfs/dbraw/zinc/35/11/82/1137351182.db2.gz VAZHKZODHMOUGO-NSHDSACASA-N 1 0 338.404 3.663 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CCC1)[C@@H]1CCOC1 ZINC000866509834 1137360049 /nfs/dbraw/zinc/36/00/49/1137360049.db2.gz DLAFGQQTKSLIMT-LSBZLQRGSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540426 1137363177 /nfs/dbraw/zinc/36/31/77/1137363177.db2.gz OTEFHJOTEXUQMY-INIZCTEOSA-N 1 0 342.395 3.915 20 5 EHBDRO COc1ncc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1Cl ZINC000866540424 1137363182 /nfs/dbraw/zinc/36/31/82/1137363182.db2.gz ONBCNKHDUXONGR-NSHDSACASA-N 1 0 335.791 3.811 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1 ZINC000773044541 1137461536 /nfs/dbraw/zinc/46/15/36/1137461536.db2.gz WKBAXMNDAJPAOD-BIENJYKASA-N 1 0 346.402 3.767 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc(-c3ccccn3)c2)cc1[N+](=O)[O-] ZINC001649161598 1137487706 /nfs/dbraw/zinc/48/77/06/1137487706.db2.gz WUTWBVYVRYYZFG-UHFFFAOYSA-N 1 0 349.390 3.955 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H]2CCCC23CCCCC3)c1 ZINC001171930487 1137521425 /nfs/dbraw/zinc/52/14/25/1137521425.db2.gz GLBOWQAHZGUEPK-QGZVFWFLSA-N 1 0 346.427 3.974 20 5 EHBDRO CC(C)c1ccc(-c2nc(C3C[C@H]4CC[C@@H](C3)[NH2+]4)no2)cc1[N+](=O)[O-] ZINC000871798910 1137558656 /nfs/dbraw/zinc/55/86/56/1137558656.db2.gz YJZWFCZCXSBZID-AGUYFDCRSA-N 1 0 342.399 3.766 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017571 1137564748 /nfs/dbraw/zinc/56/47/48/1137564748.db2.gz CJEZCOYSCCEICF-BXUZGUMPSA-N 1 0 337.420 3.749 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@H](C)c3c(F)cccc3[N+](=O)[O-])nc12 ZINC000872041416 1137567040 /nfs/dbraw/zinc/56/70/40/1137567040.db2.gz SRSCECLISDDAIQ-CYBMUJFWSA-N 1 0 342.374 3.583 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccccc1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042540 1137567184 /nfs/dbraw/zinc/56/71/84/1137567184.db2.gz BZSVAPIEGCCEGA-PBFPGSCMSA-N 1 0 332.375 3.897 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872043232 1137567371 /nfs/dbraw/zinc/56/73/71/1137567371.db2.gz HPAYUNWATDAJJP-SQWLQELKSA-N 1 0 346.402 3.939 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC)C(F)(F)F ZINC000872056875 1137568557 /nfs/dbraw/zinc/56/85/57/1137568557.db2.gz UXNOOXFUNQRORQ-UFBFGSQYSA-N 1 0 338.351 3.545 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000872061078 1137568887 /nfs/dbraw/zinc/56/88/87/1137568887.db2.gz VXLYXSVFGJIQEW-OAHLLOKOSA-N 1 0 338.835 3.872 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1ccccn1 ZINC000872084430 1137570492 /nfs/dbraw/zinc/57/04/92/1137570492.db2.gz SBQGPTFLILGRTC-QWHCGFSZSA-N 1 0 331.441 3.994 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2ccccc2)[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000873028438 1137588347 /nfs/dbraw/zinc/58/83/47/1137588347.db2.gz MGCBEJVKDQHJFV-RTBURBONSA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](C[C@@H](C)O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000873080053 1137589549 /nfs/dbraw/zinc/58/95/49/1137589549.db2.gz ZYNNZZSBBDWYOS-RDTXWAMCSA-N 1 0 328.412 3.548 20 5 EHBDRO C[N@@H+]1CCC[C@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842444 1137624409 /nfs/dbraw/zinc/62/44/09/1137624409.db2.gz HMSGIULCUUKMML-UXHICEINSA-N 1 0 345.446 3.697 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC1CC[NH+](C(C)C)CC1 ZINC000876031248 1137642425 /nfs/dbraw/zinc/64/24/25/1137642425.db2.gz JDNBPTOBUMBHPY-UHFFFAOYSA-N 1 0 348.447 3.535 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H](CC3CC3)c3ccccc3)C2)c1 ZINC000877044329 1137668524 /nfs/dbraw/zinc/66/85/24/1137668524.db2.gz YRXJYXKWXBYOSQ-HTWSVDAQSA-N 1 0 326.400 3.626 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877130841 1137670943 /nfs/dbraw/zinc/67/09/43/1137670943.db2.gz OQNCLXKJNSNZEU-IFMYKAFSSA-N 1 0 328.349 3.968 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([C@@H]2C[C@H]2[NH3+])cc1 ZINC000877137337 1137671379 /nfs/dbraw/zinc/67/13/79/1137671379.db2.gz UADAEJNEPHWQJU-JKSUJKDBSA-N 1 0 339.395 3.587 20 5 EHBDRO CC(C)[C@H](C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)Cc1ccccc1 ZINC000877467038 1137677083 /nfs/dbraw/zinc/67/70/83/1137677083.db2.gz WARVPQAOTNZNPL-AOCRQIFASA-N 1 0 342.443 3.599 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]CCc3cc4ccccc4s3)C2)c1 ZINC000877551454 1137681042 /nfs/dbraw/zinc/68/10/42/1137681042.db2.gz AFNFXWWCJGXNOC-UHFFFAOYSA-N 1 0 342.424 3.542 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000877690119 1137685946 /nfs/dbraw/zinc/68/59/46/1137685946.db2.gz NMFDYRPINMGLLV-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO O=c1[nH]c2c(cc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)CCCC2 ZINC000877780053 1137689239 /nfs/dbraw/zinc/68/92/39/1137689239.db2.gz JKUCOCGSNNSABD-UHFFFAOYSA-N 1 0 347.802 3.517 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878124653 1137703415 /nfs/dbraw/zinc/70/34/15/1137703415.db2.gz JUPLQOMQXSOAII-CYBMUJFWSA-N 1 0 330.388 3.799 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878950669 1137733397 /nfs/dbraw/zinc/73/33/97/1137733397.db2.gz XIEBKVKEQRMEPN-GFCCVEGCSA-N 1 0 336.779 3.576 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@]12C[C@H]1CCCC2 ZINC000879267075 1137742892 /nfs/dbraw/zinc/74/28/92/1137742892.db2.gz UWWPAYVVIIFJRQ-JCGVRSQUSA-N 1 0 342.399 3.703 20 5 EHBDRO Cc1c(C[N@H+]2CCC[C@@H]2[C@@H]2C[C@@H](C)CC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000331948606 1137926643 /nfs/dbraw/zinc/92/66/43/1137926643.db2.gz PAGXPESNAQDAPZ-IVJVFBROSA-N 1 0 332.444 3.665 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332338777 1137940543 /nfs/dbraw/zinc/94/05/43/1137940543.db2.gz LFQLNANNOBJTQF-SJORKVTESA-N 1 0 334.416 3.766 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332338774 1137940598 /nfs/dbraw/zinc/94/05/98/1137940598.db2.gz LFQLNANNOBJTQF-DLBZAZTESA-N 1 0 334.416 3.766 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000884716855 1137970945 /nfs/dbraw/zinc/97/09/45/1137970945.db2.gz LCOADXWYGOIYOG-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962515 1138044617 /nfs/dbraw/zinc/04/46/17/1138044617.db2.gz AQECGINYVMOCIP-PXAZEXFGSA-N 1 0 334.803 3.975 20 5 EHBDRO C[C@@]1(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886776478 1138138865 /nfs/dbraw/zinc/13/88/65/1138138865.db2.gz HRXCAVJSRVSVPK-FUHWJXTLSA-N 1 0 330.428 3.911 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000089512649 1138200635 /nfs/dbraw/zinc/20/06/35/1138200635.db2.gz RTQCWPMBPQRZLC-QAPCUYQASA-N 1 0 326.396 3.852 20 5 EHBDRO CSC[C@H]1CCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089910192 1138207470 /nfs/dbraw/zinc/20/74/70/1138207470.db2.gz GZFNVPIVINWNGS-OAHLLOKOSA-N 1 0 333.413 3.577 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]CCc2cccc([N+](=O)[O-])c2)CC1 ZINC000092568371 1138229745 /nfs/dbraw/zinc/22/97/45/1138229745.db2.gz TXUSYWDFCIWGSM-UHFFFAOYSA-N 1 0 348.443 3.627 20 5 EHBDRO Cn1cc(C[N@H+](C)C(C2CC2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092703956 1138230696 /nfs/dbraw/zinc/23/06/96/1138230696.db2.gz TZFZOSQOOYPWQP-UHFFFAOYSA-N 1 0 340.427 3.616 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000127298296 1138352864 /nfs/dbraw/zinc/35/28/64/1138352864.db2.gz WJOPNVDKCULQMF-NVXWUHKLSA-N 1 0 332.444 3.997 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H]1CCc2ccccc21 ZINC000336965387 1138436450 /nfs/dbraw/zinc/43/64/50/1138436450.db2.gz JADPNDIUFXVTTR-QGZVFWFLSA-N 1 0 339.395 3.543 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@]2(CC=CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337211487 1138496410 /nfs/dbraw/zinc/49/64/10/1138496410.db2.gz DORXUPKSUBJCQI-LJQANCHMSA-N 1 0 343.427 3.746 20 5 EHBDRO CSC[C@@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000135450829 1138752059 /nfs/dbraw/zinc/75/20/59/1138752059.db2.gz ZBABXGVGHUVFGC-HNNXBMFYSA-N 1 0 347.440 3.620 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(F)c2)cc1[N+](=O)[O-] ZINC000152718325 1139105623 /nfs/dbraw/zinc/10/56/23/1139105623.db2.gz MUXQFHKTRYPHPY-GFCCVEGCSA-N 1 0 348.374 3.992 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@H]1CCCOC1 ZINC000174146224 1139402230 /nfs/dbraw/zinc/40/22/30/1139402230.db2.gz STWSBAGUZAOVGJ-OAHLLOKOSA-N 1 0 337.419 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2C[C@@H](O)c2cccs2)cc1 ZINC000175850965 1139523299 /nfs/dbraw/zinc/52/32/99/1139523299.db2.gz MMMWFNBRIUKGCB-DLBZAZTESA-N 1 0 346.452 3.787 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313945 1139583536 /nfs/dbraw/zinc/58/35/36/1139583536.db2.gz SBUIGHYUTUAKNH-SUUVNEMCSA-N 1 0 348.443 3.876 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000178686207 1139711789 /nfs/dbraw/zinc/71/17/89/1139711789.db2.gz ABTVUTXBCLRPPT-VQNPYFGKSA-N 1 0 332.425 3.744 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627622 1139769709 /nfs/dbraw/zinc/76/97/09/1139769709.db2.gz QCOJKNZTCZWMNS-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO CC(C)OC(=O)C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000181830026 1139935175 /nfs/dbraw/zinc/93/51/75/1139935175.db2.gz ABIDEVPFCSYUBV-GOSISDBHSA-N 1 0 342.395 3.767 20 5 EHBDRO Cc1noc(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000182686896 1139986260 /nfs/dbraw/zinc/98/62/60/1139986260.db2.gz JRZKHXGYYBERDY-LBPRGKRZSA-N 1 0 330.388 3.535 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCOCC2 ZINC000186417183 1140202866 /nfs/dbraw/zinc/20/28/66/1140202866.db2.gz LJWJOSPUCDWIJR-JCGIZDLHSA-N 1 0 348.443 3.528 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc(CSC)c2)cc1[N+](=O)[O-] ZINC000189489463 1140347344 /nfs/dbraw/zinc/34/73/44/1140347344.db2.gz RGEFYAKLVYUGSN-UHFFFAOYSA-N 1 0 332.425 3.756 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000192633092 1140541761 /nfs/dbraw/zinc/54/17/61/1140541761.db2.gz KJMAVHWFWCEMQZ-QGZVFWFLSA-N 1 0 330.359 3.910 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000268872555 1141014887 /nfs/dbraw/zinc/01/48/87/1141014887.db2.gz GMEOEYBRQKQORE-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCc1c[nH]nc1C ZINC000271027955 1141296408 /nfs/dbraw/zinc/29/64/08/1141296408.db2.gz BJKSBBXBSKQNKE-HNNXBMFYSA-N 1 0 348.472 3.719 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@@H]1c1ccncc1 ZINC000271045876 1141299443 /nfs/dbraw/zinc/29/94/43/1141299443.db2.gz VDHFSCYRFVGLQG-QGZVFWFLSA-N 1 0 327.384 3.726 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1ccccc1[N+](=O)[O-] ZINC000271445027 1141368627 /nfs/dbraw/zinc/36/86/27/1141368627.db2.gz FLWYICUGCOJWNH-BTELXILVSA-N 1 0 332.425 3.744 20 5 EHBDRO CC(C)(CCCO)C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000271584800 1141402066 /nfs/dbraw/zinc/40/20/66/1141402066.db2.gz RZTCLQGMEAXHGO-WBVHZDCISA-N 1 0 334.460 3.694 20 5 EHBDRO Cc1nnc([C@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238783 1141488386 /nfs/dbraw/zinc/48/83/86/1141488386.db2.gz QNIHOKAUECYERX-LNSITVRQSA-N 1 0 346.456 3.817 20 5 EHBDRO Cc1ccc(CN(C/C=C/c2ccccc2[N+](=O)[O-])CC[NH+](C)C)o1 ZINC000349034751 1141625493 /nfs/dbraw/zinc/62/54/93/1141625493.db2.gz FUZXMRYUZKTHLE-SOFGYWHQSA-N 1 0 343.427 3.573 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C\c2ccc3cc([N+](=O)[O-])ccc3n2)s1 ZINC000349113082 1141641435 /nfs/dbraw/zinc/64/14/35/1141641435.db2.gz PSVVKLLHLJIKOI-YVMONPNESA-N 1 0 340.408 3.832 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2ccc(Br)s2)c1 ZINC000037985182 213183591 /nfs/dbraw/zinc/18/35/91/213183591.db2.gz NYLWRVXKBWOCNL-UHFFFAOYSA-N 1 0 327.203 3.709 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCSc3c(F)cccc32)cc1 ZINC000537967838 1032065952 /nfs/dbraw/zinc/06/59/52/1032065952.db2.gz CPFBLPKNXFSFPR-INIZCTEOSA-N 1 0 348.399 3.939 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)OCCc2ccccc21 ZINC000577546089 1014313954 /nfs/dbraw/zinc/31/39/54/1014313954.db2.gz UOUYRMZHOFJYFI-IBGZPJMESA-N 1 0 326.396 3.563 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCOC1 ZINC000120157722 1014510726 /nfs/dbraw/zinc/51/07/26/1014510726.db2.gz PTGIPQHFRVUXBE-GOSISDBHSA-N 1 0 346.358 3.795 20 5 EHBDRO CC[NH+](CC)CCOc1ccc(CNc2ccc([N+](=O)[O-])s2)cc1 ZINC000064029543 1014767398 /nfs/dbraw/zinc/76/73/98/1014767398.db2.gz MPTCTCKSUOZZSK-UHFFFAOYSA-N 1 0 349.456 3.989 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000154003278 1014785577 /nfs/dbraw/zinc/78/55/77/1014785577.db2.gz IPFUPSPVWIYIQV-JTQLQIEISA-N 1 0 335.429 3.918 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430208123 1014954086 /nfs/dbraw/zinc/95/40/86/1014954086.db2.gz AEZZHMYTRIMAPS-SFHVURJKSA-N 1 0 342.395 3.949 20 5 EHBDRO C[NH2+]Cc1cn(-c2ncc([N+](=O)[O-])cc2Cl)c2ccc(C)cc12 ZINC001167121754 1016169807 /nfs/dbraw/zinc/16/98/07/1016169807.db2.gz SIOVYVYZJXGQNM-UHFFFAOYSA-N 1 0 330.775 3.615 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432115 1016240664 /nfs/dbraw/zinc/24/06/64/1016240664.db2.gz RDKJEEDLWGEHKI-QWHCGFSZSA-N 1 0 336.823 3.569 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226898 1016662969 /nfs/dbraw/zinc/66/29/69/1016662969.db2.gz DJIBNAFALYIQGT-YPMHNXCESA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)O1 ZINC000414517053 1016948234 /nfs/dbraw/zinc/94/82/34/1016948234.db2.gz QCTAZMJFNZNBMN-DYEKYZERSA-N 1 0 347.440 3.621 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](O)C(C)C ZINC000414536825 1016963498 /nfs/dbraw/zinc/96/34/98/1016963498.db2.gz YHLZVAIECMNOHV-JKSUJKDBSA-N 1 0 349.456 3.603 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@H](CO)C2)s1 ZINC000414565011 1016973514 /nfs/dbraw/zinc/97/35/14/1016973514.db2.gz DPRUIMIXJSCWLJ-UONOGXRCSA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)cc1 ZINC000780520793 1017033609 /nfs/dbraw/zinc/03/36/09/1017033609.db2.gz SYKBOOCNNMSMON-ILZDJORESA-N 1 0 340.423 3.629 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000449094280 1032200268 /nfs/dbraw/zinc/20/02/68/1032200268.db2.gz YTIIOEPWTHGLDB-LIRRHRJNSA-N 1 0 345.418 3.557 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@@H]1OC ZINC000538194819 1032211841 /nfs/dbraw/zinc/21/18/41/1032211841.db2.gz MJEREIDZCSSXQV-LZWOXQAQSA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOc2ccccc21 ZINC000449150217 1032251291 /nfs/dbraw/zinc/25/12/91/1032251291.db2.gz ZCOGRDQEYSNKTM-GDBMZVCRSA-N 1 0 326.396 3.682 20 5 EHBDRO Cc1c([C@@H](C)N[C@H](C[NH+](C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368980 1032252346 /nfs/dbraw/zinc/25/23/46/1032252346.db2.gz PVQVZKDNOAOGGV-RDTXWAMCSA-N 1 0 345.418 3.996 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449178100 1032273359 /nfs/dbraw/zinc/27/33/59/1032273359.db2.gz TZRJLHMDEJCFRG-FZKQIMNGSA-N 1 0 332.375 3.642 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCOCC1 ZINC000538323345 1032297324 /nfs/dbraw/zinc/29/73/24/1032297324.db2.gz LAUTULRWFDOUNT-QGZVFWFLSA-N 1 0 336.432 3.677 20 5 EHBDRO COCC1(C)C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000459624289 1032339170 /nfs/dbraw/zinc/33/91/70/1032339170.db2.gz SXCGIIMHNDYTPM-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO COc1cc(C[N@H+](C)C2CC(C)(C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000459723744 1032431474 /nfs/dbraw/zinc/43/14/74/1032431474.db2.gz CSOLKMVDINTWPX-UHFFFAOYSA-N 1 0 344.358 3.825 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(CC[NH+](C)C)Cc1ccsc1 ZINC000459744914 1032458848 /nfs/dbraw/zinc/45/88/48/1032458848.db2.gz MNOWWNCGEDXCPQ-UHFFFAOYSA-N 1 0 333.457 3.529 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCC1 ZINC000459813957 1032484974 /nfs/dbraw/zinc/48/49/74/1032484974.db2.gz WYFYLFBUHHASED-AWEZNQCLSA-N 1 0 339.823 3.745 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)NCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537173942 1032547885 /nfs/dbraw/zinc/54/78/85/1032547885.db2.gz POFZTQJOPBDIPY-HUUCEWRRSA-N 1 0 347.459 3.639 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000537203502 1032566975 /nfs/dbraw/zinc/56/69/75/1032566975.db2.gz COIVCIPXCDGSJC-GNJLHFKMSA-N 1 0 341.411 3.628 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000597664907 1032598720 /nfs/dbraw/zinc/59/87/20/1032598720.db2.gz AIBVAXOYSOLDKD-HNNXBMFYSA-N 1 0 345.443 3.805 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449488620 1032647781 /nfs/dbraw/zinc/64/77/81/1032647781.db2.gz JFKKNABNVAFHEA-VQIMIIECSA-N 1 0 339.439 3.842 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120910164 1017182453 /nfs/dbraw/zinc/18/24/53/1017182453.db2.gz FWSWSIGYKUJQLU-AWEZNQCLSA-N 1 0 345.418 3.955 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000728686682 1017382150 /nfs/dbraw/zinc/38/21/50/1017382150.db2.gz VTKUWNZWQYSCGS-MRXNPFEDSA-N 1 0 349.450 3.822 20 5 EHBDRO CC1(C)[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415050478 1017459293 /nfs/dbraw/zinc/45/92/93/1017459293.db2.gz YVTDKXMIPKDUCL-INIZCTEOSA-N 1 0 349.818 3.738 20 5 EHBDRO CCc1nc(CC[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000892806132 1017476970 /nfs/dbraw/zinc/47/69/70/1017476970.db2.gz ZPPWNFWZBRYBNF-UHFFFAOYSA-N 1 0 325.821 3.599 20 5 EHBDRO CCc1ccccc1[C@H](N)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070022 1017503410 /nfs/dbraw/zinc/50/34/10/1017503410.db2.gz UEUAZGFSCJSEAB-HNAYVOBHSA-N 1 0 341.455 3.768 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177471589 1017678360 /nfs/dbraw/zinc/67/83/60/1017678360.db2.gz QYEKMNVOBFFATJ-KKUMJFAQSA-N 1 0 341.411 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000593462825 1032721517 /nfs/dbraw/zinc/72/15/17/1032721517.db2.gz GVKVOSGGQIRCQU-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H](c1cccc(O)c1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171265 1017807720 /nfs/dbraw/zinc/80/77/20/1017807720.db2.gz SXHCYJDMZDYKIA-LLVKDONJSA-N 1 0 327.340 3.635 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000290297483 1017892216 /nfs/dbraw/zinc/89/22/16/1017892216.db2.gz NICKZGQAEJBJRQ-KSMMKXTCSA-N 1 0 344.411 3.766 20 5 EHBDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064373 1017972896 /nfs/dbraw/zinc/97/28/96/1017972896.db2.gz NANVFCRWJOEMKS-DOMZBBRYSA-N 1 0 335.429 3.890 20 5 EHBDRO CC[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866653 1018543439 /nfs/dbraw/zinc/54/34/39/1018543439.db2.gz DJEJMQDPYMIZCT-RDJZCZTQSA-N 1 0 326.400 3.627 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402534 1032797260 /nfs/dbraw/zinc/79/72/60/1032797260.db2.gz IRKFUDHFAMXJIB-MSOLQXFVSA-N 1 0 332.375 3.898 20 5 EHBDRO Cc1c(CN2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610433479 1019124943 /nfs/dbraw/zinc/12/49/43/1019124943.db2.gz NBGRSVXYGOLOOY-LJQANCHMSA-N 1 0 339.439 3.610 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](OC3CCC3)C2)ccc1[N+](=O)[O-] ZINC000594027220 1032809760 /nfs/dbraw/zinc/80/97/60/1032809760.db2.gz SNRFKHCRDDUIOK-MRXNPFEDSA-N 1 0 334.416 3.527 20 5 EHBDRO CCn1ccnc1[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449562769 1032810142 /nfs/dbraw/zinc/81/01/42/1032810142.db2.gz NXKZAYSKBLCKSC-ZOBUZTSGSA-N 1 0 342.443 3.873 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000340686668 1019324694 /nfs/dbraw/zinc/32/46/94/1019324694.db2.gz IWHPMXGTRITDAI-LLVKDONJSA-N 1 0 330.331 3.579 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCCNc3ccccc32)cc1 ZINC000579646685 1019401924 /nfs/dbraw/zinc/40/19/24/1019401924.db2.gz ZKPRZVKONAMTRV-SFHVURJKSA-N 1 0 327.384 3.510 20 5 EHBDRO C[C@@H]1CCCC[C@H]1C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513661936 1019929014 /nfs/dbraw/zinc/92/90/14/1019929014.db2.gz RJZGKLUOLZGCPN-HFTRVMKXSA-N 1 0 342.443 3.834 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280316299 1020283593 /nfs/dbraw/zinc/28/35/93/1020283593.db2.gz PZEQFBGTNMNZFL-MRXNPFEDSA-N 1 0 344.358 3.587 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000610476500 1020414889 /nfs/dbraw/zinc/41/48/89/1020414889.db2.gz WIKVCDAYICLDAS-OIISXLGYSA-N 1 0 336.407 3.759 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000237008810 1020592976 /nfs/dbraw/zinc/59/29/76/1020592976.db2.gz ADDYDFXLJNZHMY-SCLBCKFNSA-N 1 0 332.400 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]2COCC[C@H]21 ZINC000602485464 1032914117 /nfs/dbraw/zinc/91/41/17/1032914117.db2.gz QRDDEVWPNMBQBA-TZMCWYRMSA-N 1 0 344.333 3.615 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCCC3CCCC3)CC2)cn1 ZINC000602511018 1032946415 /nfs/dbraw/zinc/94/64/15/1032946415.db2.gz RWJYNHLHVZQCOZ-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCCOCC1CC1 ZINC000602514053 1032951249 /nfs/dbraw/zinc/95/12/49/1032951249.db2.gz QVYBWZMUKXIEKA-UHFFFAOYSA-N 1 0 332.322 3.520 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426299879 1021214622 /nfs/dbraw/zinc/21/46/22/1021214622.db2.gz ZMKVTYDRORUUKR-ZFWWWQNUSA-N 1 0 329.375 3.663 20 5 EHBDRO CCCC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCC1 ZINC000602565810 1032978591 /nfs/dbraw/zinc/97/85/91/1032978591.db2.gz AKGFNJAPHFBCKH-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000439458284 1021445609 /nfs/dbraw/zinc/44/56/09/1021445609.db2.gz BUTKUYVCDTXYPC-OAHLLOKOSA-N 1 0 349.475 3.959 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCCCC1 ZINC000602551569 1032986483 /nfs/dbraw/zinc/98/64/83/1032986483.db2.gz PKEPPMDXVSWADC-CQSZACIVSA-N 1 0 332.448 3.517 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437103033 1021576351 /nfs/dbraw/zinc/57/63/51/1021576351.db2.gz IGIASPIITUVAHT-LSDHHAIUSA-N 1 0 325.412 3.554 20 5 EHBDRO COc1cccc(C[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000090909950 1021695954 /nfs/dbraw/zinc/69/59/54/1021695954.db2.gz NPOJTPSDHSLWQG-FQEVSTJZSA-N 1 0 340.423 3.757 20 5 EHBDRO CC(C)[C@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602581381 1032999734 /nfs/dbraw/zinc/99/97/34/1032999734.db2.gz JEHVEEHNNPNJEW-UKRRQHHQSA-N 1 0 346.349 3.907 20 5 EHBDRO CN(Cc1ccc(F)cc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506765652 1021971664 /nfs/dbraw/zinc/97/16/64/1021971664.db2.gz CCKDHKVEKLGULG-UHFFFAOYSA-N 1 0 340.301 3.967 20 5 EHBDRO C[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602626182 1033020521 /nfs/dbraw/zinc/02/05/21/1033020521.db2.gz JLMKWIAGIAHWJH-GJZGRUSLSA-N 1 0 332.448 3.517 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000441240834 1022077146 /nfs/dbraw/zinc/07/71/46/1022077146.db2.gz CLZSYKUHLIPYGY-QGZVFWFLSA-N 1 0 342.395 3.819 20 5 EHBDRO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000441409821 1022218959 /nfs/dbraw/zinc/21/89/59/1022218959.db2.gz CIGUHBWALBNKGP-INIZCTEOSA-N 1 0 334.803 3.804 20 5 EHBDRO CC[C@](C)(COc1ncccc1Cl)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000610932613 1022276702 /nfs/dbraw/zinc/27/67/02/1022276702.db2.gz BCCBQAWQRVAPMY-QGZVFWFLSA-N 1 0 349.818 3.981 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602637293 1033046459 /nfs/dbraw/zinc/04/64/59/1033046459.db2.gz LSZSOYQFBNDYCU-AWEZNQCLSA-N 1 0 345.365 3.530 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](Oc2ccc(Cl)cc2)C1 ZINC000550391277 1022410038 /nfs/dbraw/zinc/41/00/38/1022410038.db2.gz CIJAALFGGKVAKW-INIZCTEOSA-N 1 0 332.787 3.902 20 5 EHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H]1CCOC(C)(C)C1 ZINC000602671156 1033050602 /nfs/dbraw/zinc/05/06/02/1033050602.db2.gz RDORHKOVWYPUJG-CYBMUJFWSA-N 1 0 333.388 3.516 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C3CCC(C(F)F)CC3)nc2c1 ZINC000602687617 1033070193 /nfs/dbraw/zinc/07/01/93/1033070193.db2.gz OOGSBHJNYRMERX-UHFFFAOYSA-N 1 0 325.315 3.650 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ccc(F)nc2)CC1 ZINC000276771434 1022762281 /nfs/dbraw/zinc/76/22/81/1022762281.db2.gz HYLLVLGSHVHVHD-CYBMUJFWSA-N 1 0 345.374 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@H+](C[C@@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582758 1022823242 /nfs/dbraw/zinc/82/32/42/1022823242.db2.gz VSTDMEQYGZDITG-HNNXBMFYSA-N 1 0 345.399 3.660 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](CCO)[C@H]2CCCc3ccccc32)cc1 ZINC000510653278 1022831615 /nfs/dbraw/zinc/83/16/15/1022831615.db2.gz YTVOHVJBMLPYAX-FQEVSTJZSA-N 1 0 340.423 3.509 20 5 EHBDRO CCO[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000602685393 1033086427 /nfs/dbraw/zinc/08/64/27/1033086427.db2.gz NWZHCOYIIBFXBL-XHDPSFHLSA-N 1 0 346.349 3.861 20 5 EHBDRO C[C@]1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO[C@H]1C1CC1 ZINC000519579657 1022945747 /nfs/dbraw/zinc/94/57/47/1022945747.db2.gz COQCWHJCHZFCTI-CEXWTWQISA-N 1 0 330.428 3.767 20 5 EHBDRO CN(Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000509578247 1023075831 /nfs/dbraw/zinc/07/58/31/1023075831.db2.gz GUNLDIXIRXBCAC-HXUWFJFHSA-N 1 0 339.439 3.691 20 5 EHBDRO CCC1(C)CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000507210889 1023189327 /nfs/dbraw/zinc/18/93/27/1023189327.db2.gz UGVSHVSKQCPQTD-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507233859 1023207810 /nfs/dbraw/zinc/20/78/10/1023207810.db2.gz PPZXYOSDYYOSFS-AUUYWEPGSA-N 1 0 326.396 3.902 20 5 EHBDRO CCCC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000507254255 1023210203 /nfs/dbraw/zinc/21/02/03/1023210203.db2.gz UNOBLEGAYDLJGG-UHFFFAOYSA-N 1 0 328.416 3.760 20 5 EHBDRO COCC1(C2CC2)C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000602732460 1033122689 /nfs/dbraw/zinc/12/26/89/1033122689.db2.gz PKOWENTVAOHBED-UHFFFAOYSA-N 1 0 342.395 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CCSC3)C2)c(Cl)c1 ZINC000449733930 1033127071 /nfs/dbraw/zinc/12/70/71/1033127071.db2.gz QMRKNTXXVRCHPC-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO CC1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCC2(CC1)OCCO2 ZINC000897720559 1033135068 /nfs/dbraw/zinc/13/50/68/1033135068.db2.gz VNWHPWBXKSPEDQ-XQRVVYSFSA-N 1 0 346.427 3.521 20 5 EHBDRO CC[C@@H](C)[C@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341879441 1023513491 /nfs/dbraw/zinc/51/34/91/1023513491.db2.gz UVISNGHERZHEDH-ABAIWWIYSA-N 1 0 336.823 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3CCC(F)(F)C3)cs2)c1 ZINC000610787772 1023516185 /nfs/dbraw/zinc/51/61/85/1023516185.db2.gz NPLMJKKTOUMULZ-NSHDSACASA-N 1 0 339.367 3.996 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN1Cc2ccccc2C1 ZINC000610805613 1023689905 /nfs/dbraw/zinc/68/99/05/1023689905.db2.gz YXCRGDAKACQKMH-OAHLLOKOSA-N 1 0 325.412 3.570 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2C[C@@H](O)C2)ccc1Oc1ccccc1Cl ZINC000449748593 1033160791 /nfs/dbraw/zinc/16/07/91/1033160791.db2.gz MNJBPMKMGDJLNX-BETUJISGSA-N 1 0 348.786 3.653 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccncc1 ZINC000610830988 1023781004 /nfs/dbraw/zinc/78/10/04/1023781004.db2.gz YZCPGTWOHQOATF-KDOFPFPSSA-N 1 0 325.412 3.704 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214689 1023883150 /nfs/dbraw/zinc/88/31/50/1023883150.db2.gz RDNQYOPNYMKOKK-GFCCVEGCSA-N 1 0 334.807 3.670 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288606 1024011138 /nfs/dbraw/zinc/01/11/38/1024011138.db2.gz YEGPFBVVNKFQJR-OLZOCXBDSA-N 1 0 336.823 3.569 20 5 EHBDRO Cn1cc(C[NH2+][C@@H](CC(C)(C)C)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602802206 1033175740 /nfs/dbraw/zinc/17/57/40/1033175740.db2.gz PTIAOUQZOOWOMB-HNNXBMFYSA-N 1 0 334.395 3.735 20 5 EHBDRO C[C@@H]1CC[NH2+][C@H](c2nc(-c3ccc4ccc5cccnc5c4n3)no2)C1 ZINC001211881042 1024405603 /nfs/dbraw/zinc/40/56/03/1024405603.db2.gz UPVQEJUUBDDGEL-WBMJQRKESA-N 1 0 345.406 3.894 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@@H](CNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220662 1024654481 /nfs/dbraw/zinc/65/44/81/1024654481.db2.gz UNIIWLDRCUUIBZ-KRWDZBQOSA-N 1 0 345.468 3.657 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(C)([NH+]2CCC2)CC1 ZINC000895672074 1024718120 /nfs/dbraw/zinc/71/81/20/1024718120.db2.gz VSZULTRGEBUHEI-DTQAZKPQSA-N 1 0 329.444 3.558 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000342293442 1024740521 /nfs/dbraw/zinc/74/05/21/1024740521.db2.gz GLMLJIDRUSTZEU-MAVJXHJTSA-N 1 0 346.814 3.975 20 5 EHBDRO [NH3+]C[C@]12CCC[C@H]1CN(C(=O)c1cc3ccccc3c3cccnc13)C2 ZINC000653194779 1024811336 /nfs/dbraw/zinc/81/13/36/1024811336.db2.gz XFOINSHBINNQMR-AOMKIAJQSA-N 1 0 345.446 3.589 20 5 EHBDRO CC(C)[C@H]([NH3+])CCN(C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000435383201 1024864881 /nfs/dbraw/zinc/86/48/81/1024864881.db2.gz HDACXEXNBDFTGR-MRXNPFEDSA-N 1 0 348.472 3.524 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc(-n3ccnc3)c(F)c2)cc1[N+](=O)[O-] ZINC000054224238 1024964090 /nfs/dbraw/zinc/96/40/90/1024964090.db2.gz MSFFPZHQRGOPBL-UHFFFAOYSA-N 1 0 346.343 3.542 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123759 1025034492 /nfs/dbraw/zinc/03/44/92/1025034492.db2.gz OLIVCRXKDJLMBK-IBGZPJMESA-N 1 0 342.395 3.819 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C2CCN(c3nccs3)CC2)cccc1[N+](=O)[O-] ZINC000281565706 1025219611 /nfs/dbraw/zinc/21/96/11/1025219611.db2.gz KBQBGBHVBGLVOR-CYBMUJFWSA-N 1 0 346.456 3.679 20 5 EHBDRO Cc1cc(N2CCC3(CC[NH2+]C3)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000521218692 1025278690 /nfs/dbraw/zinc/27/86/90/1025278690.db2.gz SSEHWGACXMIYNY-UHFFFAOYSA-N 1 0 343.349 3.502 20 5 EHBDRO Cc1cc(NC(=O)N(C)CCCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000602925623 1033272131 /nfs/dbraw/zinc/27/21/31/1033272131.db2.gz JPAQOQSLGVCTRH-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO CSCCC[N@H+](C)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000425441975 1025293610 /nfs/dbraw/zinc/29/36/10/1025293610.db2.gz ICFNDLWXQLBFAT-UHFFFAOYSA-N 1 0 333.251 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H]2CCC(F)(F)C2)c1 ZINC000281647650 1025328569 /nfs/dbraw/zinc/32/85/69/1025328569.db2.gz MSOHDRSDLFDKKW-VIFPVBQESA-N 1 0 336.285 3.721 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451098548 1025557634 /nfs/dbraw/zinc/55/76/34/1025557634.db2.gz IIBVOHNXKMBGOF-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000451100755 1025562302 /nfs/dbraw/zinc/56/23/02/1025562302.db2.gz XJWVQIDFWHKQRA-GJZGRUSLSA-N 1 0 341.411 3.687 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451156293 1025609634 /nfs/dbraw/zinc/60/96/34/1025609634.db2.gz SKEIVWHKOSXCEU-HNNXBMFYSA-N 1 0 332.444 3.981 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCSCC1 ZINC000474921305 1025857939 /nfs/dbraw/zinc/85/79/39/1025857939.db2.gz BUYUOXQCFANIFD-LLVKDONJSA-N 1 0 328.865 3.912 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH+]2CCC(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000444213304 1025918155 /nfs/dbraw/zinc/91/81/55/1025918155.db2.gz ORAPRQTVASXLBQ-AWEZNQCLSA-N 1 0 333.432 3.598 20 5 EHBDRO COCCSCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550451 1026103021 /nfs/dbraw/zinc/10/30/21/1026103021.db2.gz RTLUEPSCFZWVPI-INIZCTEOSA-N 1 0 338.473 3.544 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)CC(=O)Nc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000478491406 1026126165 /nfs/dbraw/zinc/12/61/65/1026126165.db2.gz ONPSPNYDIXLSGO-GFCCVEGCSA-N 1 0 345.374 3.549 20 5 EHBDRO CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000530627263 1026151614 /nfs/dbraw/zinc/15/16/14/1026151614.db2.gz NATVLFBXZOMGNG-GOSISDBHSA-N 1 0 328.412 3.674 20 5 EHBDRO Cn1ccc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)c1 ZINC000530640464 1026173284 /nfs/dbraw/zinc/17/32/84/1026173284.db2.gz UIZSALNPSUJVEF-UHFFFAOYSA-N 1 0 327.409 3.952 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H](C)C1 ZINC000127629585 1026195571 /nfs/dbraw/zinc/19/55/71/1026195571.db2.gz GHVULNVRYMBPBZ-QWHCGFSZSA-N 1 0 330.388 3.513 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897036080 1026255282 /nfs/dbraw/zinc/25/52/82/1026255282.db2.gz HZWDHQZRHBEFSW-NTCAYCPXSA-N 1 0 330.428 3.625 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCC[C@H](C)C1 ZINC000452066901 1026460344 /nfs/dbraw/zinc/46/03/44/1026460344.db2.gz LTMLYUNZGAWWTE-KCQAQPDRSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1 ZINC000452066944 1026461157 /nfs/dbraw/zinc/46/11/57/1026461157.db2.gz LYTJTMFRMMBTGV-SNPRPXQTSA-N 1 0 333.432 3.646 20 5 EHBDRO CCC[C@@H](NC1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143136 1026499364 /nfs/dbraw/zinc/49/93/64/1026499364.db2.gz NVXCAUHQZPHVGQ-LJQANCHMSA-N 1 0 349.475 3.527 20 5 EHBDRO CC[N@H+](CCc1nccs1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000159192069 1026529040 /nfs/dbraw/zinc/52/90/40/1026529040.db2.gz OYOUQEQAXGMGGS-UHFFFAOYSA-N 1 0 325.821 3.769 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H](C)C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000479375509 1026619349 /nfs/dbraw/zinc/61/93/49/1026619349.db2.gz ZGJSRBRVFXUTQQ-AWEZNQCLSA-N 1 0 333.432 3.721 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCCc2ccccc2F)n1 ZINC000479511048 1026655670 /nfs/dbraw/zinc/65/56/70/1026655670.db2.gz FYUWNVSZXPTCFJ-SJORKVTESA-N 1 0 346.406 3.637 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630729 1026822297 /nfs/dbraw/zinc/82/22/97/1026822297.db2.gz DNYIMVCWWHBMAJ-TZMCWYRMSA-N 1 0 346.818 3.891 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630726 1026822769 /nfs/dbraw/zinc/82/27/69/1026822769.db2.gz DNYIMVCWWHBMAJ-GXTWGEPZSA-N 1 0 346.818 3.891 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)[C@H]2CCCC[C@H]21 ZINC000543907458 1027303317 /nfs/dbraw/zinc/30/33/17/1027303317.db2.gz PVBSDAWFUDAVAI-YXJHDRRASA-N 1 0 345.443 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]4(C3)CCCOC4)o2)cc1 ZINC000342836624 1027559352 /nfs/dbraw/zinc/55/93/52/1027559352.db2.gz KMUXOTBUQOGMCK-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178659951 1027620228 /nfs/dbraw/zinc/62/02/28/1027620228.db2.gz MSNKTSJDGQUXLL-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO COc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)ccc1OC(C)C ZINC000237113576 1027667474 /nfs/dbraw/zinc/66/74/74/1027667474.db2.gz CBVTWHWFUGQUHT-UHFFFAOYSA-N 1 0 344.411 3.989 20 5 EHBDRO CCC[N@H+](C)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000533397917 1027766286 /nfs/dbraw/zinc/76/62/86/1027766286.db2.gz DJZKMVFLGKPNPW-SFHVURJKSA-N 1 0 341.411 3.925 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(C(C)(C)O)cc1 ZINC000924954187 1027771220 /nfs/dbraw/zinc/77/12/20/1027771220.db2.gz FWERFKAMTKPYKQ-CQSZACIVSA-N 1 0 328.412 3.716 20 5 EHBDRO CC(C)(CNc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2ccccc2C1 ZINC000502105963 1027791629 /nfs/dbraw/zinc/79/16/29/1027791629.db2.gz PERLKIBJELDZQM-UHFFFAOYSA-N 1 0 325.412 3.844 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc([N+](=O)[O-])c2cnccc21 ZINC001167624433 1027903121 /nfs/dbraw/zinc/90/31/21/1027903121.db2.gz HTGDAEOTWXHCHL-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174539 1027911797 /nfs/dbraw/zinc/91/17/97/1027911797.db2.gz FTRCTTWJOZAUOI-SCLBCKFNSA-N 1 0 330.359 3.948 20 5 EHBDRO Cc1c(CN2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512141 1027994378 /nfs/dbraw/zinc/99/43/78/1027994378.db2.gz MNPPQENNCPBYRU-DAYGRLMNSA-N 1 0 331.460 3.740 20 5 EHBDRO Cc1cnc(NCc2ccc(C[NH+]3CCCC3)cc2)c([N+](=O)[O-])c1 ZINC000078626945 1028028024 /nfs/dbraw/zinc/02/80/24/1028028024.db2.gz XKMQJWBMWGCLEP-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688461 1028161391 /nfs/dbraw/zinc/16/13/91/1028161391.db2.gz YVMPQLJLIXBEQM-LBPRGKRZSA-N 1 0 330.310 3.538 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691014 1028163824 /nfs/dbraw/zinc/16/38/24/1028163824.db2.gz WRENWHMBJIWOAU-HZPDHXFCSA-N 1 0 346.431 3.545 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(OC(F)F)c(F)c2)cc1 ZINC000168248866 1028179108 /nfs/dbraw/zinc/17/91/08/1028179108.db2.gz BMIJDXYBVLNXCN-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCCC1(O)CCC1 ZINC000421374931 1028334203 /nfs/dbraw/zinc/33/42/03/1028334203.db2.gz FTLVGGRZHRHOSS-NVXWUHKLSA-N 1 0 332.444 3.591 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NCC1CC[NH+](C2CC2)CC1 ZINC000444869012 1028357225 /nfs/dbraw/zinc/35/72/25/1028357225.db2.gz HPDSMMCCZYYORZ-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO Cc1c(NC(=O)CC[C@@H]([NH3+])CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000424076201 1028776024 /nfs/dbraw/zinc/77/60/24/1028776024.db2.gz LLGCRYOTVACLHB-OAHLLOKOSA-N 1 0 333.432 3.920 20 5 EHBDRO CCOc1ccc([C@@H](C)NCCC[NH+]2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504900472 1029027007 /nfs/dbraw/zinc/02/70/07/1029027007.db2.gz YNRNLMWPUODOBA-MRXNPFEDSA-N 1 0 349.475 3.766 20 5 EHBDRO CO[C@H](C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000583156219 1029037696 /nfs/dbraw/zinc/03/76/96/1029037696.db2.gz MQFAJBAZTNGMKR-LJQANCHMSA-N 1 0 326.396 3.947 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912415 1029054808 /nfs/dbraw/zinc/05/48/08/1029054808.db2.gz VYOCRIWNPWZXNL-CJNGLKHVSA-N 1 0 326.462 3.606 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCS1 ZINC000504912504 1029055826 /nfs/dbraw/zinc/05/58/26/1029055826.db2.gz WYPPPKRQWILUMS-CHWSQXEVSA-N 1 0 326.487 3.951 20 5 EHBDRO CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000524294192 1029055896 /nfs/dbraw/zinc/05/58/96/1029055896.db2.gz WUXQMIZEMZGFHH-FZKQIMNGSA-N 1 0 332.400 3.742 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(C[NH3+])CCC1 ZINC000414794776 1029107213 /nfs/dbraw/zinc/10/72/13/1029107213.db2.gz VYJQAMTVQWRTJZ-UHFFFAOYSA-N 1 0 331.441 3.637 20 5 EHBDRO CO[C@@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513819867 1029521807 /nfs/dbraw/zinc/52/18/07/1029521807.db2.gz FQBZTOVTQMRKOZ-VYCZESIESA-N 1 0 332.444 3.853 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533288749 1029581669 /nfs/dbraw/zinc/58/16/69/1029581669.db2.gz YOVUDFKPJKPRIR-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(=S)n(CN3CCc4ccsc4C3)c2c1 ZINC000760285613 1029668850 /nfs/dbraw/zinc/66/88/50/1029668850.db2.gz LDOFDUZZOPFSJG-UHFFFAOYSA-N 1 0 347.421 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2C[C@H]3CCCC[C@@H]3C2)c1 ZINC000537626336 1029905961 /nfs/dbraw/zinc/90/59/61/1029905961.db2.gz OPSCNWFAEBIZTO-VXGBXAGGSA-N 1 0 326.343 3.818 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258796 1029960517 /nfs/dbraw/zinc/96/05/17/1029960517.db2.gz WDZPYGKJWYWTFV-OCCSQVGLSA-N 1 0 332.404 3.741 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CC2(CF)CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000453306211 1030074031 /nfs/dbraw/zinc/07/40/31/1030074031.db2.gz IXPCBIFRVUGTCJ-MRXNPFEDSA-N 1 0 336.407 3.673 20 5 EHBDRO Cc1noc([C@@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529480 1030121063 /nfs/dbraw/zinc/12/10/63/1030121063.db2.gz RLFWDKNBSQVDCM-TZMCWYRMSA-N 1 0 330.388 3.535 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000453340687 1030124868 /nfs/dbraw/zinc/12/48/68/1030124868.db2.gz HXMRYHUBEQEOPA-ZSZQSSIHSA-N 1 0 341.411 3.869 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000441250935 1030132904 /nfs/dbraw/zinc/13/29/04/1030132904.db2.gz RMEYKDXNTODCFZ-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccncc2)C1 ZINC000583603050 1030258144 /nfs/dbraw/zinc/25/81/44/1030258144.db2.gz HYBPHRIOTILXHN-MRXNPFEDSA-N 1 0 341.411 3.767 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327135 1030265870 /nfs/dbraw/zinc/26/58/70/1030265870.db2.gz XWTWASJTLPYNLB-KSSFIOAISA-N 1 0 342.443 3.823 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447575019 1030293947 /nfs/dbraw/zinc/29/39/47/1030293947.db2.gz PTEHBWRBHBSBPE-PMACEKPBSA-N 1 0 340.423 3.858 20 5 EHBDRO COC(=O)c1coc([C@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000447583187 1030315137 /nfs/dbraw/zinc/31/51/37/1030315137.db2.gz AVMCUJBDAIQXKK-ZDUSSCGKSA-N 1 0 346.383 3.648 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CC2CCCCC2)CC1 ZINC000441284659 1030348718 /nfs/dbraw/zinc/34/87/18/1030348718.db2.gz WYCLEHRSPWHANT-INIZCTEOSA-N 1 0 331.460 3.854 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@]2(C1)OCc1ccccc12 ZINC000482383576 1030364404 /nfs/dbraw/zinc/36/44/04/1030364404.db2.gz YRDPTKGZIUOMDB-FQEVSTJZSA-N 1 0 338.407 3.925 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[C@@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631584 1030434023 /nfs/dbraw/zinc/43/40/23/1030434023.db2.gz OAMWBRBKAKUCFQ-OCCSQVGLSA-N 1 0 346.383 3.521 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000537640858 1030629054 /nfs/dbraw/zinc/62/90/54/1030629054.db2.gz CRLUCTRRBHUVEC-UHFFFAOYSA-N 1 0 347.459 3.514 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000237528972 1030888662 /nfs/dbraw/zinc/88/86/62/1030888662.db2.gz SVYFWRXBDAIPIF-QWHCGFSZSA-N 1 0 327.384 3.965 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+][C@H]2CCOC2)cc1 ZINC000178995338 1031054567 /nfs/dbraw/zinc/05/45/67/1031054567.db2.gz YXGJRPSTRFYQSP-AWEZNQCLSA-N 1 0 348.786 3.919 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000483631317 1031254725 /nfs/dbraw/zinc/25/47/25/1031254725.db2.gz BFBFSIUMDKPDEM-OAHLLOKOSA-N 1 0 344.411 3.632 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C12CCC2 ZINC000483742201 1031311301 /nfs/dbraw/zinc/31/13/01/1031311301.db2.gz JFGRTQCXHALQGF-YTQUADARSA-N 1 0 344.455 3.853 20 5 EHBDRO COc1ccc(CC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1F ZINC000584004256 1031384527 /nfs/dbraw/zinc/38/45/27/1031384527.db2.gz FLSWVGNFWKLOSV-INIZCTEOSA-N 1 0 330.359 3.562 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)NC(C)(C)CC[NH+]2CCCCCC2)c1 ZINC000484423242 1031564767 /nfs/dbraw/zinc/56/47/67/1031564767.db2.gz NAUUYRLVDRFYDN-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOCc1ccccc1)C1CC1 ZINC000484491520 1031614116 /nfs/dbraw/zinc/61/41/16/1031614116.db2.gz ZPMCRJBVJOWLFE-IBGZPJMESA-N 1 0 340.423 3.722 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN(C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000484480025 1031631319 /nfs/dbraw/zinc/63/13/19/1031631319.db2.gz KBFSPYPAQDFRIZ-OAHLLOKOSA-N 1 0 345.418 3.825 20 5 EHBDRO CC(C)Oc1cccc(CNCc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000278610419 1031632546 /nfs/dbraw/zinc/63/25/46/1031632546.db2.gz GKIAQMCENQRBRE-UHFFFAOYSA-N 1 0 340.383 3.548 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@H]1c1ccsc1)Nc1ccccc1[N+](=O)[O-] ZINC000052803844 1031702117 /nfs/dbraw/zinc/70/21/17/1031702117.db2.gz RQYSBNHQSMCTJP-OAHLLOKOSA-N 1 0 345.424 3.822 20 5 EHBDRO COc1ccc(C[NH2+]CC2(Cc3ccc(F)cc3)CC2)cc1[N+](=O)[O-] ZINC000537775112 1031926129 /nfs/dbraw/zinc/92/61/29/1031926129.db2.gz YZWAQOWGTSYMPS-UHFFFAOYSA-N 1 0 344.386 3.855 20 5 EHBDRO COc1ccsc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278688746 1032002733 /nfs/dbraw/zinc/00/27/33/1032002733.db2.gz IPJLWCDEZLQKMK-UHFFFAOYSA-N 1 0 346.330 3.974 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCCCC1 ZINC000063493763 1033403949 /nfs/dbraw/zinc/40/39/49/1033403949.db2.gz NEUJWXHSZSUJDY-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO COCC[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000061002526 1033416783 /nfs/dbraw/zinc/41/67/83/1033416783.db2.gz SOPQAXBCZQJJTH-UHFFFAOYSA-N 1 0 336.775 3.777 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594513165 1033417929 /nfs/dbraw/zinc/41/79/29/1033417929.db2.gz BOXQHYJAPBUUAF-UONOGXRCSA-N 1 0 329.400 3.670 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C1CC1)C1CCC(C)CC1 ZINC000063522466 1033434671 /nfs/dbraw/zinc/43/46/71/1033434671.db2.gz NLOZAYZYEKXBTG-UHFFFAOYSA-N 1 0 345.443 3.885 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925206 1033546850 /nfs/dbraw/zinc/54/68/50/1033546850.db2.gz MQHKISIOULAGEG-GJZGRUSLSA-N 1 0 344.411 3.859 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cccc(F)c1OC(F)F ZINC000594929968 1033551159 /nfs/dbraw/zinc/55/11/59/1033551159.db2.gz QUPSNCGVPIGETQ-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc(C(F)(F)F)nn1C)c1cccc([N+](=O)[O-])c1 ZINC000594937156 1033586234 /nfs/dbraw/zinc/58/62/34/1033586234.db2.gz IKRLPWXVHDXNMT-CYBMUJFWSA-N 1 0 342.321 3.588 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011470 1033606089 /nfs/dbraw/zinc/60/60/89/1033606089.db2.gz HOQPSTJSHXREKQ-ZBFHGGJFSA-N 1 0 344.411 3.512 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)F)nc1 ZINC000595019154 1033611789 /nfs/dbraw/zinc/61/17/89/1033611789.db2.gz IYVYAEUYMLSNJE-LLVKDONJSA-N 1 0 337.326 3.657 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccccc2)CC1 ZINC000603442060 1033612386 /nfs/dbraw/zinc/61/23/86/1033612386.db2.gz SPPDSSRSECZQQT-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO CCOCCC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)CCC1 ZINC000595022194 1033614686 /nfs/dbraw/zinc/61/46/86/1033614686.db2.gz KPSOZYZBSWAJCC-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000594995197 1033623631 /nfs/dbraw/zinc/62/36/31/1033623631.db2.gz LGOLLSGDEYYKNP-CQSZACIVSA-N 1 0 330.384 3.760 20 5 EHBDRO COCc1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595004162 1033628998 /nfs/dbraw/zinc/62/89/98/1033628998.db2.gz OFNKRUAEDYUPEE-ZDUSSCGKSA-N 1 0 330.384 3.601 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000595003262 1033629147 /nfs/dbraw/zinc/62/91/47/1033629147.db2.gz FKWJXWFHEUCCAW-KSSFIOAISA-N 1 0 343.427 3.557 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCCOC2)o1 ZINC000598985528 1033633442 /nfs/dbraw/zinc/63/34/42/1033633442.db2.gz RGPIKECRIDNJBL-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+]CC2COC2)cc1 ZINC000599011832 1033645002 /nfs/dbraw/zinc/64/50/02/1033645002.db2.gz MWRLHDDFNXYOOQ-UHFFFAOYSA-N 1 0 348.786 3.777 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)COc1c(F)cccc1F)c1ccc([N+](=O)[O-])cc1 ZINC000595072436 1033646342 /nfs/dbraw/zinc/64/63/42/1033646342.db2.gz HUDDFAGYAHIWBF-NWDGAFQWSA-N 1 0 336.338 3.991 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595073565 1033648402 /nfs/dbraw/zinc/64/84/02/1033648402.db2.gz NKJXZUQIOQCOQS-LPHOPBHVSA-N 1 0 339.439 3.842 20 5 EHBDRO COC(=O)CC(C)(C)C[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000595025847 1033648752 /nfs/dbraw/zinc/64/87/52/1033648752.db2.gz IZUIWUKGYWHGPD-KGLIPLIRSA-N 1 0 336.432 3.922 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000595029140 1033651107 /nfs/dbraw/zinc/65/11/07/1033651107.db2.gz HSTKJNZWZGSJOZ-HZZDSMARSA-N 1 0 346.427 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCc1ncccc1C ZINC000595041695 1033660749 /nfs/dbraw/zinc/66/07/49/1033660749.db2.gz OIGRYBKUIALTEG-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO O=[N+]([O-])c1c2ccncc2ccc1N1CC[NH+](C2CCCCC2)CC1 ZINC000599056205 1033695875 /nfs/dbraw/zinc/69/58/75/1033695875.db2.gz LSWRGEHMOIJRCC-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000599062369 1033701583 /nfs/dbraw/zinc/70/15/83/1033701583.db2.gz WMWRWZIYZQGOBA-BEFAXECRSA-N 1 0 340.423 3.647 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN1C1CCCC1 ZINC000599073562 1033714989 /nfs/dbraw/zinc/71/49/89/1033714989.db2.gz KDKIHOYVMLLXSO-YJBOKZPZSA-N 1 0 331.460 3.522 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000599077308 1033720016 /nfs/dbraw/zinc/72/00/16/1033720016.db2.gz BRISSAWCAWHISA-OLZOCXBDSA-N 1 0 344.406 3.936 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599092084 1033730667 /nfs/dbraw/zinc/73/06/67/1033730667.db2.gz FDRSMOMPYOGJJB-XIKOKIGWSA-N 1 0 327.384 3.800 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000595340932 1033731893 /nfs/dbraw/zinc/73/18/93/1033731893.db2.gz ZFYGJECLAFRVSL-SFHVURJKSA-N 1 0 344.386 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(F)cc(Br)c2)cc1 ZINC000108163863 1033772421 /nfs/dbraw/zinc/77/24/21/1033772421.db2.gz BSTLQFUFINHEHR-UHFFFAOYSA-N 1 0 339.164 3.786 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363640 1033782063 /nfs/dbraw/zinc/78/20/63/1033782063.db2.gz FWYGDDRWLMOICJ-CPUCHLNUSA-N 1 0 335.423 3.571 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](c2cccs2)C2CC2)c1 ZINC000593017841 1033818111 /nfs/dbraw/zinc/81/81/11/1033818111.db2.gz BWWXZVMRQOKLPR-INIZCTEOSA-N 1 0 346.408 3.684 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cc(C)cc(C)c2)c1 ZINC000593020573 1033823922 /nfs/dbraw/zinc/82/39/22/1033823922.db2.gz PCNKPFQNNHVKIQ-CQSZACIVSA-N 1 0 342.395 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H](c4ccccn4)C3)nc2c1 ZINC000595501917 1033831408 /nfs/dbraw/zinc/83/14/08/1033831408.db2.gz QEAFCGXRPLVEBB-ZDUSSCGKSA-N 1 0 338.367 3.511 20 5 EHBDRO C[C@@H]([NH2+][C@H](CO)CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593718983 1033833551 /nfs/dbraw/zinc/83/35/51/1033833551.db2.gz SGMMQYCLNAVCLZ-NEPJUHHUSA-N 1 0 338.404 3.694 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000593724141 1033862799 /nfs/dbraw/zinc/86/27/99/1033862799.db2.gz XDWNEPZUUGPPOV-HFTRVMKXSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000593724142 1033863357 /nfs/dbraw/zinc/86/33/57/1033863357.db2.gz XDWNEPZUUGPPOV-KYJSFNMBSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccccc1F)C1CC1 ZINC000603838144 1033950778 /nfs/dbraw/zinc/95/07/78/1033950778.db2.gz ZFZCMONEJZAMIM-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1cc(NCCC[N@@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000603848701 1033971871 /nfs/dbraw/zinc/97/18/71/1033971871.db2.gz FRUWMPFQRUMQAE-UHFFFAOYSA-N 1 0 325.412 3.764 20 5 EHBDRO CCOc1ccccc1C[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603856703 1033981495 /nfs/dbraw/zinc/98/14/95/1033981495.db2.gz TURKZFHUEGGBBM-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000603859556 1033986048 /nfs/dbraw/zinc/98/60/48/1033986048.db2.gz JEOOPXBUOBXJLQ-HNNXBMFYSA-N 1 0 342.443 3.631 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)cc1 ZINC000595788257 1033998867 /nfs/dbraw/zinc/99/88/67/1033998867.db2.gz HOEYLHIGZDOHEK-LPHOPBHVSA-N 1 0 348.443 3.645 20 5 EHBDRO CC[C@H](c1ccccc1)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C(C)C ZINC000595849668 1034007833 /nfs/dbraw/zinc/00/78/33/1034007833.db2.gz CLLCSKGGWFQMLY-GOSISDBHSA-N 1 0 343.427 3.618 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000595866558 1034032983 /nfs/dbraw/zinc/03/29/83/1034032983.db2.gz JCYUZQVLERDWTO-UONOGXRCSA-N 1 0 349.431 3.585 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450303099 1034059164 /nfs/dbraw/zinc/05/91/64/1034059164.db2.gz IPVAYJKIPMGOAS-UHFFFAOYSA-N 1 0 346.456 3.685 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097530 1034061663 /nfs/dbraw/zinc/06/16/63/1034061663.db2.gz YSLCWDCUIXHZLA-RDJZCZTQSA-N 1 0 331.460 3.676 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000596308345 1034165698 /nfs/dbraw/zinc/16/56/98/1034165698.db2.gz RDUWAESAKUDEEU-LLVKDONJSA-N 1 0 343.374 3.729 20 5 EHBDRO CC[C@H]([NH2+]CCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310054806 1034209208 /nfs/dbraw/zinc/20/92/08/1034209208.db2.gz YOVLQJVXBNVUMT-HNNXBMFYSA-N 1 0 337.420 3.502 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)c([N+](=O)[O-])c1 ZINC000596571727 1034293682 /nfs/dbraw/zinc/29/36/82/1034293682.db2.gz ZEUVPSOXNXQMDG-HNNXBMFYSA-N 1 0 345.443 3.721 20 5 EHBDRO CCN1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000604538788 1034418603 /nfs/dbraw/zinc/41/86/03/1034418603.db2.gz JTJSYWHPVAWLLO-AWEZNQCLSA-N 1 0 345.468 3.897 20 5 EHBDRO CC[N@H+](CCCNC(=O)c1cc(C)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000593249765 1034479244 /nfs/dbraw/zinc/47/92/44/1034479244.db2.gz KZPIDYBXVGEMFV-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594513160 1034597361 /nfs/dbraw/zinc/59/73/61/1034597361.db2.gz BOXQHYJAPBUUAF-KBPBESRZSA-N 1 0 329.400 3.670 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000597247773 1034640825 /nfs/dbraw/zinc/64/08/25/1034640825.db2.gz CBFNWRAAJGSJRZ-MMHDITDQSA-N 1 0 328.412 3.501 20 5 EHBDRO CC[C@@H](C)C[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948227 1034731924 /nfs/dbraw/zinc/73/19/24/1034731924.db2.gz UADYPSSSQNFBNO-MNOVXSKESA-N 1 0 327.812 3.553 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000431686623 1035237649 /nfs/dbraw/zinc/23/76/49/1035237649.db2.gz NXMMWGCFWAOERS-FXOUOLKJSA-N 1 0 338.407 3.975 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCc2ccccc21 ZINC000135954251 1035353869 /nfs/dbraw/zinc/35/38/69/1035353869.db2.gz UWZVURUFEWPVES-FZKQIMNGSA-N 1 0 339.395 3.589 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535652 1035655328 /nfs/dbraw/zinc/65/53/28/1035655328.db2.gz IDXIPSDFYFZKEP-KGLIPLIRSA-N 1 0 349.431 3.563 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554014 1035667422 /nfs/dbraw/zinc/66/74/22/1035667422.db2.gz CQQVUZMRQVZUCV-ZBFHGGJFSA-N 1 0 349.431 3.645 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000325721843 1035679956 /nfs/dbraw/zinc/67/99/56/1035679956.db2.gz UKPCRPGUKZFXOO-LJQANCHMSA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000588232599 1035831239 /nfs/dbraw/zinc/83/12/39/1035831239.db2.gz QGZIJLHCIKBWSB-DZGCQCFKSA-N 1 0 348.830 3.983 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347905 1035927222 /nfs/dbraw/zinc/92/72/22/1035927222.db2.gz DSRCGZRVXRABCS-CABCVRRESA-N 1 0 333.432 3.872 20 5 EHBDRO CC[C@@H](C)[N@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047257 1035957009 /nfs/dbraw/zinc/95/70/09/1035957009.db2.gz YTZPWSOFVASMBX-RISCZKNCSA-N 1 0 333.354 3.518 20 5 EHBDRO Cc1cc(NCc2ccc3c(n2)CCCC3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000443956306 1035973962 /nfs/dbraw/zinc/97/39/62/1035973962.db2.gz AVKYEIWTGSXXPF-UHFFFAOYSA-N 1 0 348.406 3.759 20 5 EHBDRO C[C@@]1(CCCO)CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000589199780 1036306170 /nfs/dbraw/zinc/30/61/70/1036306170.db2.gz IGWXIPJHTDIPTB-IBGZPJMESA-N 1 0 344.411 3.982 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000492818136 1036336830 /nfs/dbraw/zinc/33/68/30/1036336830.db2.gz MPZORQWWSWKODL-ZBFHGGJFSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@]1(C)OCCc2sccc21 ZINC000589325762 1036344192 /nfs/dbraw/zinc/34/41/92/1036344192.db2.gz UPOQMELLAHXQTC-QGZVFWFLSA-N 1 0 332.425 3.542 20 5 EHBDRO CCCC[C@H](C)[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000589310157 1036353779 /nfs/dbraw/zinc/35/37/79/1036353779.db2.gz ZDZOOFJMMWZDCK-NSHDSACASA-N 1 0 327.812 3.697 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c2ccccc2n1 ZINC000572735047 1036476369 /nfs/dbraw/zinc/47/63/69/1036476369.db2.gz OOFJLSJGYOKPDU-QGZVFWFLSA-N 1 0 349.390 3.929 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC2(CCC2)[C@H]1[C@@H]1CCCO1 ZINC000572804026 1036502287 /nfs/dbraw/zinc/50/22/87/1036502287.db2.gz MXCOGPZLTQRZQP-JKSUJKDBSA-N 1 0 336.819 3.782 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCO[C@@H]2C2CC2)s1 ZINC000535541157 1036618194 /nfs/dbraw/zinc/61/81/94/1036618194.db2.gz CFRYFTVMGSDDKX-MAUKXSAKSA-N 1 0 344.436 3.980 20 5 EHBDRO CCC(O)(CC)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180330235 1036684896 /nfs/dbraw/zinc/68/48/96/1036684896.db2.gz OORUCXKQSPUUSG-SFHVURJKSA-N 1 0 328.412 3.825 20 5 EHBDRO C[C@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCOC1 ZINC000493173102 1036841794 /nfs/dbraw/zinc/84/17/94/1036841794.db2.gz CJYOKLHNHHAPCM-RTBURBONSA-N 1 0 326.396 3.700 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@H]2CCCC(F)(F)C2)c1 ZINC000539526594 1036866708 /nfs/dbraw/zinc/86/67/08/1036866708.db2.gz ZNKLLXJIYOBBOL-JTQLQIEISA-N 1 0 336.285 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3[nH]nc4ccccc43)C2)cc1 ZINC000590659589 1036995645 /nfs/dbraw/zinc/99/56/45/1036995645.db2.gz QWZVOJQKOKWIPB-HNNXBMFYSA-N 1 0 336.395 3.851 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H]2C[NH+]2CCCCC2)cc1Cl ZINC000761505980 1037087972 /nfs/dbraw/zinc/08/79/72/1037087972.db2.gz KIDLHIPLIDQFEW-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2(c3cccc(Cl)c3)CC2)c1 ZINC000271758882 1037125228 /nfs/dbraw/zinc/12/52/28/1037125228.db2.gz HMAHWNZCXUIJPG-INIZCTEOSA-N 1 0 332.787 3.561 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cccc([N+](=O)[O-])c1Cl ZINC001299194881 1037205202 /nfs/dbraw/zinc/20/52/02/1037205202.db2.gz FKXMULJRDNIORT-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000573107565 1037287838 /nfs/dbraw/zinc/28/78/38/1037287838.db2.gz YCUYTFUWXRCYGR-BBRMVZONSA-N 1 0 348.468 3.617 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@@H]1Cc1ccccc1 ZINC000462751802 1037362531 /nfs/dbraw/zinc/36/25/31/1037362531.db2.gz CFKAMZYKGYEIPL-MAUKXSAKSA-N 1 0 326.396 3.714 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)Cc1cccs1 ZINC000532473151 1037422361 /nfs/dbraw/zinc/42/23/61/1037422361.db2.gz GKNVDPNPUBLUHX-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO C[NH+](C)CC(C)(C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491370044 1037428681 /nfs/dbraw/zinc/42/86/81/1037428681.db2.gz XYILRTPSMCDAAX-IBGZPJMESA-N 1 0 341.455 3.862 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CC(c2ccccc2F)C1 ZINC000462824493 1037446561 /nfs/dbraw/zinc/44/65/61/1037446561.db2.gz CFAAFKQEHCCAMP-UHFFFAOYSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@]2(CCSC2)C1 ZINC000540164171 1037651452 /nfs/dbraw/zinc/65/14/52/1037651452.db2.gz KFTIKCRJWJZAAZ-GRDNDAEWSA-N 1 0 336.457 3.609 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1ccsc1)N(C)C ZINC000468639624 1037656123 /nfs/dbraw/zinc/65/61/23/1037656123.db2.gz GCXWLKFLNPQWDO-WAFIBAPDSA-N 1 0 345.468 3.952 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000058274914 1037710647 /nfs/dbraw/zinc/71/06/47/1037710647.db2.gz RHIMLUBFULEGKN-MRXNPFEDSA-N 1 0 347.462 3.850 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221653 1037780829 /nfs/dbraw/zinc/78/08/29/1037780829.db2.gz QVBHBQJKBYYJCC-SUMWQHHRSA-N 1 0 327.384 3.663 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000463198566 1037863393 /nfs/dbraw/zinc/86/33/93/1037863393.db2.gz NKMMWJVLBOQQFG-JFIYKMOQSA-N 1 0 348.443 3.509 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475098 1037889991 /nfs/dbraw/zinc/88/99/91/1037889991.db2.gz PVAGFZCISSCSPP-KDOFPFPSSA-N 1 0 332.400 3.590 20 5 EHBDRO C[C@H]1SCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592380680 1037951566 /nfs/dbraw/zinc/95/15/66/1037951566.db2.gz PAUVZNUEVRNFBN-YGRLFVJLSA-N 1 0 335.454 3.702 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000090408292 1038057188 /nfs/dbraw/zinc/05/71/88/1038057188.db2.gz MOYCORZASYGXEI-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCc3n[nH]cc32)cc(C(F)(F)F)c1 ZINC000367614761 1038403476 /nfs/dbraw/zinc/40/34/76/1038403476.db2.gz IHIDYGQLSLXFGY-ZDUSSCGKSA-N 1 0 340.305 3.504 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@@H](C)CC(C)(C)C1 ZINC000541326122 1038475202 /nfs/dbraw/zinc/47/52/02/1038475202.db2.gz UNFIPJRQLZXUNK-ZDUSSCGKSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000541392884 1038602565 /nfs/dbraw/zinc/60/25/65/1038602565.db2.gz MECIXZPWURARCD-CQSZACIVSA-N 1 0 333.432 3.600 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000539217022 1038734785 /nfs/dbraw/zinc/73/47/85/1038734785.db2.gz ZYAYUZFKJZDMQQ-LJQANCHMSA-N 1 0 326.396 3.887 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000037131154 1038907006 /nfs/dbraw/zinc/90/70/06/1038907006.db2.gz FLWTVSNYUSRTNS-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000552293346 1039163751 /nfs/dbraw/zinc/16/37/51/1039163751.db2.gz YZTYMNPUWAZWHW-PRDNPTHXSA-N 1 0 340.423 3.534 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN2CCc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000480225308 1039322178 /nfs/dbraw/zinc/32/21/78/1039322178.db2.gz GALRLEXIVTZSIP-MRXNPFEDSA-N 1 0 339.439 3.612 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000554945286 1039969517 /nfs/dbraw/zinc/96/95/17/1039969517.db2.gz GQADKLUSSFVRDP-RDJZCZTQSA-N 1 0 337.423 3.793 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCO[C@@H](C(F)(F)F)C2)cc1 ZINC000584856297 1040115122 /nfs/dbraw/zinc/11/51/22/1040115122.db2.gz OMKYXWTUZQPQKI-DZGCQCFKSA-N 1 0 346.349 3.617 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000573507031 1040137277 /nfs/dbraw/zinc/13/72/77/1040137277.db2.gz YXKOTMADSWXICX-IRXDYDNUSA-N 1 0 346.814 3.949 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000027284904 1040158755 /nfs/dbraw/zinc/15/87/55/1040158755.db2.gz BJAQROLQRRHMJQ-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2ccc(F)cc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480907367 1040169384 /nfs/dbraw/zinc/16/93/84/1040169384.db2.gz ZJXIWTBXRVXBED-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO Cc1cccc(-c2n[nH]cc2C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000105448161 1040317721 /nfs/dbraw/zinc/31/77/21/1040317721.db2.gz LHVFOAVGJCBPGL-UHFFFAOYSA-N 1 0 336.395 3.626 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000481094855 1040348370 /nfs/dbraw/zinc/34/83/70/1040348370.db2.gz XIHJLGZDBIJIHL-UONOGXRCSA-N 1 0 333.432 3.646 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787132 1040443602 /nfs/dbraw/zinc/44/36/02/1040443602.db2.gz HEDIZDDHMCMDDG-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(CO)CC3(CCC3)C1)CCC2 ZINC000433055695 1040559924 /nfs/dbraw/zinc/55/99/24/1040559924.db2.gz FNXIAJNAKHPQIH-KRWDZBQOSA-N 1 0 330.428 3.505 20 5 EHBDRO CC[C@@H]([NH2+]CCn1c(C)nc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000120287970 1040714095 /nfs/dbraw/zinc/71/40/95/1040714095.db2.gz RXUIKORIXRKJHJ-QGZVFWFLSA-N 1 0 338.411 3.994 20 5 EHBDRO CCC(CC)(CCO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555511843 1040720244 /nfs/dbraw/zinc/72/02/44/1040720244.db2.gz OCRBABSRSKGUMV-UHFFFAOYSA-N 1 0 334.338 3.644 20 5 EHBDRO CC1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCOCC1 ZINC000500231395 1040765405 /nfs/dbraw/zinc/76/54/05/1040765405.db2.gz NTOYWAGHCVRUAY-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371473 1040790738 /nfs/dbraw/zinc/79/07/38/1040790738.db2.gz MXYURLXIVJSOIU-JQWIXIFHSA-N 1 0 344.358 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC4(C3)CCCO4)s2)cc1 ZINC000600190627 1040799280 /nfs/dbraw/zinc/79/92/80/1040799280.db2.gz QOGMIIGJNPQCDR-UHFFFAOYSA-N 1 0 330.409 3.688 20 5 EHBDRO CN(C)c1ncccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433154904 1040923640 /nfs/dbraw/zinc/92/36/40/1040923640.db2.gz VLAZCHGIEBBZCZ-QGZVFWFLSA-N 1 0 340.427 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC=C(c3ccco3)C2)cc1 ZINC000586773630 1040991136 /nfs/dbraw/zinc/99/11/36/1040991136.db2.gz QBERYICQPGTXAS-UHFFFAOYSA-N 1 0 328.368 3.746 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000481713411 1041292325 /nfs/dbraw/zinc/29/23/25/1041292325.db2.gz CSBBCKXJXPSEQX-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070107 1041813212 /nfs/dbraw/zinc/81/32/12/1041813212.db2.gz UVIVOMFVYMNLDJ-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC000893492590 1042267028 /nfs/dbraw/zinc/26/70/28/1042267028.db2.gz QVCAYJPHGGEPQN-LBPRGKRZSA-N 1 0 348.834 3.717 20 5 EHBDRO CC1(C)Cc2cccc(C[NH2+]CCc3ccccc3[N+](=O)[O-])c2O1 ZINC000236764916 1042399495 /nfs/dbraw/zinc/39/94/95/1042399495.db2.gz QGVSRFPDCLGNGK-UHFFFAOYSA-N 1 0 326.396 3.641 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000181828645 1042478828 /nfs/dbraw/zinc/47/88/28/1042478828.db2.gz FLFVTINMGNVCTR-MRXNPFEDSA-N 1 0 330.384 3.723 20 5 EHBDRO O=C(CN(Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1c[nH]c2ccccc12 ZINC000343925838 1042847981 /nfs/dbraw/zinc/84/79/81/1042847981.db2.gz CKMNCFAPPNJGIU-UHFFFAOYSA-N 1 0 349.390 3.923 20 5 EHBDRO COc1c(O)ccc(C[NH2+]Cc2ccc(C(F)F)cc2)c1[N+](=O)[O-] ZINC000893622925 1042954597 /nfs/dbraw/zinc/95/45/97/1042954597.db2.gz VQKZMUGZFWIEGJ-UHFFFAOYSA-N 1 0 338.310 3.536 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000106468587 1042985810 /nfs/dbraw/zinc/98/58/10/1042985810.db2.gz MVUKUZRXYLEYFV-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000585765589 1043029417 /nfs/dbraw/zinc/02/94/17/1043029417.db2.gz XKIDBMLUNRPZKI-CQSZACIVSA-N 1 0 338.411 3.625 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000344097763 1043239397 /nfs/dbraw/zinc/23/93/97/1043239397.db2.gz VWZZYAQWGJPKQV-INIZCTEOSA-N 1 0 342.395 3.649 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCO[C@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279094772 1043337905 /nfs/dbraw/zinc/33/79/05/1043337905.db2.gz NUQWYJCGCKHNAG-KKXDTOCCSA-N 1 0 330.428 3.864 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132137 1043400482 /nfs/dbraw/zinc/40/04/82/1043400482.db2.gz RCKHGSWUZVNISL-CVEARBPZSA-N 1 0 332.425 3.702 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000279211177 1043576074 /nfs/dbraw/zinc/57/60/74/1043576074.db2.gz YGIUYBGAWFPMRI-FHWLQOOXSA-N 1 0 338.407 3.565 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000344781612 1044413870 /nfs/dbraw/zinc/41/38/70/1044413870.db2.gz WTSCBFRUUCVKSG-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1sc(C)nc1C ZINC000344832277 1044499403 /nfs/dbraw/zinc/49/94/03/1044499403.db2.gz SIXFCYIWSWRUDL-FMIVXFBMSA-N 1 0 331.441 3.904 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)N2CCCC2)o1 ZINC000183644998 1125635506 /nfs/dbraw/zinc/63/55/06/1125635506.db2.gz NXDXFMJYOLWREY-GOSISDBHSA-N 1 0 343.427 3.731 20 5 EHBDRO Cc1cnc([C@H]([NH2+]CCCOc2ccc([N+](=O)[O-])cc2)C2CC2)s1 ZINC000185302908 1126856705 /nfs/dbraw/zinc/85/67/05/1126856705.db2.gz QEYOSIKAKMOLOP-MRXNPFEDSA-N 1 0 347.440 3.870 20 5 EHBDRO C[C@@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000764570637 1127507657 /nfs/dbraw/zinc/50/76/57/1127507657.db2.gz JBRVRZXNSDVWCX-INIZCTEOSA-N 1 0 339.439 3.957 20 5 EHBDRO COC(=O)CCC1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000552059446 1127550363 /nfs/dbraw/zinc/55/03/63/1127550363.db2.gz BGQZBVLLKBABRE-UHFFFAOYSA-N 1 0 348.443 3.883 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765352313 1127602996 /nfs/dbraw/zinc/60/29/96/1127602996.db2.gz XASVRHPYSWHUJF-QWHZDKJVSA-N 1 0 331.460 3.978 20 5 EHBDRO Cc1ccnc(Nc2cccc(C[NH+]3CCSCC3)c2)c1[N+](=O)[O-] ZINC000301290821 1127735179 /nfs/dbraw/zinc/73/51/79/1127735179.db2.gz NQQWUOXFSBZQJV-UHFFFAOYSA-N 1 0 344.440 3.591 20 5 EHBDRO COc1cc(NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301410308 1127742606 /nfs/dbraw/zinc/74/26/06/1127742606.db2.gz XQFPFCBJHWJXEK-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000734478249 1131242389 /nfs/dbraw/zinc/24/23/89/1131242389.db2.gz XXRKYODHZIPQDE-WMLDXEAASA-N 1 0 336.395 3.780 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000273063157 1128438597 /nfs/dbraw/zinc/43/85/97/1128438597.db2.gz MVAURWNQFASBPI-WFASDCNBSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506895 1128484227 /nfs/dbraw/zinc/48/42/27/1128484227.db2.gz CYWKYZJRUCPULH-BEFAXECRSA-N 1 0 325.412 3.917 20 5 EHBDRO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301583524 1128500263 /nfs/dbraw/zinc/50/02/63/1128500263.db2.gz QNSBBYKFJHQLFD-OLZOCXBDSA-N 1 0 343.349 3.677 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000542702724 1128549515 /nfs/dbraw/zinc/54/95/15/1128549515.db2.gz RJVJZXPPFLWGSD-FQEVSTJZSA-N 1 0 340.423 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@]1(O)CCCc2ccccc21 ZINC000765875762 1128629200 /nfs/dbraw/zinc/62/92/00/1128629200.db2.gz FXMWDMAZLDXBQW-YWZLYKJASA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1nc(NCC(C)(C)[NH2+][C@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301618287 1128670579 /nfs/dbraw/zinc/67/05/79/1128670579.db2.gz CTVGMIACEGGSBE-CYBMUJFWSA-N 1 0 328.416 3.840 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[C@H]([NH+]2CCCC2)[C@H]1C ZINC000554874911 1128741853 /nfs/dbraw/zinc/74/18/53/1128741853.db2.gz OIXQBOQELHDBFT-XUNQVJEASA-N 1 0 329.444 3.557 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@@H]1C[C@@H](C)O[C@@H](C)C1 ZINC000554936999 1128905438 /nfs/dbraw/zinc/90/54/38/1128905438.db2.gz DSVRQZKMUKTOGZ-QDMKHBRRSA-N 1 0 336.432 3.677 20 5 EHBDRO C[C@H]1CCN(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000525800608 1120295175 /nfs/dbraw/zinc/29/51/75/1120295175.db2.gz KWJYKQFJMVFPOR-AWEZNQCLSA-N 1 0 345.468 3.755 20 5 EHBDRO Cc1csc(C2([NH2+]CCCOc3ccc([N+](=O)[O-])cc3)CCC2)n1 ZINC000494808039 1120848439 /nfs/dbraw/zinc/84/84/39/1120848439.db2.gz BWTKAYSDQKWHBB-UHFFFAOYSA-N 1 0 347.440 3.798 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193311550 1121087759 /nfs/dbraw/zinc/08/77/59/1121087759.db2.gz GJPRKAULNOBVLR-QGZVFWFLSA-N 1 0 330.359 3.910 20 5 EHBDRO CC(C)[NH+](CCSCCOc1ccccc1[N+](=O)[O-])C(C)C ZINC000762199011 1121165433 /nfs/dbraw/zinc/16/54/33/1121165433.db2.gz KSKQPJAQLKGDRS-UHFFFAOYSA-N 1 0 326.462 3.826 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2F)CC1 ZINC000915211820 1121248763 /nfs/dbraw/zinc/24/87/63/1121248763.db2.gz HDKUWOIXRTULBS-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])c(C)c1)[NH+](C)C ZINC000301060974 1121279059 /nfs/dbraw/zinc/27/90/59/1121279059.db2.gz BVHLKKKBKOHLER-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000301065913 1121298418 /nfs/dbraw/zinc/29/84/18/1121298418.db2.gz DFDUEBAQERVPTQ-OAHLLOKOSA-N 1 0 333.363 3.966 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000193503561 1121358296 /nfs/dbraw/zinc/35/82/96/1121358296.db2.gz KAHJRMGLJQUYKZ-WFASDCNBSA-N 1 0 345.365 3.520 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc(C)cc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301098272 1121604111 /nfs/dbraw/zinc/60/41/11/1121604111.db2.gz SATQTHWJGUYSHP-GOSISDBHSA-N 1 0 329.400 3.627 20 5 EHBDRO COCC[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272619780 1121797002 /nfs/dbraw/zinc/79/70/02/1121797002.db2.gz XWJAHJIFWSVMNB-ZBFHGGJFSA-N 1 0 332.400 3.876 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301106794 1121921873 /nfs/dbraw/zinc/92/18/73/1121921873.db2.gz QOTAYMILIYXEMD-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000326522056 1121974231 /nfs/dbraw/zinc/97/42/31/1121974231.db2.gz URWVZZLSVIUJBB-KRWDZBQOSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000311667873 1129033623 /nfs/dbraw/zinc/03/36/23/1129033623.db2.gz XXRDLFGDAXRQLS-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000917481007 1122614047 /nfs/dbraw/zinc/61/40/47/1122614047.db2.gz WLPYGSVJCCMEEX-HNNXBMFYSA-N 1 0 345.399 3.505 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000154523579 1122684314 /nfs/dbraw/zinc/68/43/14/1122684314.db2.gz YUPFFDOWCOLJII-RTBURBONSA-N 1 0 344.386 3.898 20 5 EHBDRO CC(C)C[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301784060 1129075027 /nfs/dbraw/zinc/07/50/27/1129075027.db2.gz OEOZOOLUUZUVOF-HNNXBMFYSA-N 1 0 342.443 3.923 20 5 EHBDRO Cc1cccc(CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000130788493 1123790696 /nfs/dbraw/zinc/79/06/96/1123790696.db2.gz CSZPCGGPXHDBFZ-UHFFFAOYSA-N 1 0 339.439 3.704 20 5 EHBDRO Cc1nc2n(n1)C[C@@H]([NH2+]Cc1c3ccccc3cc3ccccc31)CC2 ZINC000237795879 1123862695 /nfs/dbraw/zinc/86/26/95/1123862695.db2.gz CJBGNWKWPOIHIT-SFHVURJKSA-N 1 0 342.446 3.998 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000078539659 1129160207 /nfs/dbraw/zinc/16/02/07/1129160207.db2.gz DNJUPBFKECSJOH-WFASDCNBSA-N 1 0 330.388 3.655 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000301837155 1129168642 /nfs/dbraw/zinc/16/86/42/1129168642.db2.gz MKASNDFHOUXTGE-UKRRQHHQSA-N 1 0 332.791 3.501 20 5 EHBDRO CCc1cccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181806871 1125046490 /nfs/dbraw/zinc/04/64/90/1125046490.db2.gz FFERCPFERVZTDZ-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1C ZINC000181819666 1125048024 /nfs/dbraw/zinc/04/80/24/1125048024.db2.gz MYKKHCNIBBRRPM-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1ccccc1[C@H](CO)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000618984927 1125257099 /nfs/dbraw/zinc/25/70/99/1125257099.db2.gz MMBJKJBZAKRLHT-MOPGFXCFSA-N 1 0 340.423 3.949 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C[C@H](c2ccccc2)O1 ZINC000070696044 1125362546 /nfs/dbraw/zinc/36/25/46/1125362546.db2.gz MPJBPNWFVWZQRR-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1ccnc(NCC2CC[NH+](Cc3cccs3)CC2)c1[N+](=O)[O-] ZINC000301264912 1125435105 /nfs/dbraw/zinc/43/51/05/1125435105.db2.gz GICBMVUHUJRTRK-UHFFFAOYSA-N 1 0 346.456 3.684 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)c1ccc([N+](=O)[O-])c(OC(C)(C)C)c1 ZINC000301889905 1129262511 /nfs/dbraw/zinc/26/25/11/1129262511.db2.gz QSIRBAXFZWLEMF-UHFFFAOYSA-N 1 0 335.448 3.550 20 5 EHBDRO CCOc1cc(NCC2C[NH+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000716223316 1131364250 /nfs/dbraw/zinc/36/42/50/1131364250.db2.gz RJUPSUVZBGFNLB-UHFFFAOYSA-N 1 0 341.411 3.537 20 5 EHBDRO C[C@@H]1CCC[C@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000466424985 1129442086 /nfs/dbraw/zinc/44/20/86/1129442086.db2.gz YOQMRELAWLRZEJ-HIFRSBDPSA-N 1 0 328.416 3.521 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@]2(C)CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402326 1129461719 /nfs/dbraw/zinc/46/17/19/1129461719.db2.gz HLDLIRTTZUEUNM-OALUTQOASA-N 1 0 344.411 3.856 20 5 EHBDRO CCOc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971348 1129465476 /nfs/dbraw/zinc/46/54/76/1129465476.db2.gz GFQJSYWUWVDUKL-LPHOPBHVSA-N 1 0 341.411 3.851 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1sccc1[N+](=O)[O-] ZINC000301996913 1129505932 /nfs/dbraw/zinc/50/59/32/1129505932.db2.gz HWJWMIYDVZQDFV-HNNXBMFYSA-N 1 0 331.441 3.615 20 5 EHBDRO CC(C)(C)Oc1cc(N2CCC[C@@H]([NH+]3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000301996666 1129507780 /nfs/dbraw/zinc/50/77/80/1129507780.db2.gz UBEZHPBITMYPDD-MRXNPFEDSA-N 1 0 347.459 3.837 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N2CCCC2)o1 ZINC000154053559 1129530056 /nfs/dbraw/zinc/53/00/56/1129530056.db2.gz XTDNMJIUVQPJRB-CRAIPNDOSA-N 1 0 343.427 3.984 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000092218730 1129536620 /nfs/dbraw/zinc/53/66/20/1129536620.db2.gz LKZCXIBCKYFRAV-AHKGRUIUSA-N 1 0 329.444 3.558 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000092586112 1129552747 /nfs/dbraw/zinc/55/27/47/1129552747.db2.gz FUCPPIXUMHSNHS-CQSZACIVSA-N 1 0 328.416 3.617 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)Cc1cnccn1 ZINC000092590918 1129552912 /nfs/dbraw/zinc/55/29/12/1129552912.db2.gz CGBRJSZYFDLXAN-UHFFFAOYSA-N 1 0 340.408 3.745 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000154462576 1129560803 /nfs/dbraw/zinc/56/08/03/1129560803.db2.gz VCXAIWZCGCRJFX-KRWDZBQOSA-N 1 0 330.384 3.590 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCOCC1 ZINC000123964775 1129569246 /nfs/dbraw/zinc/56/92/46/1129569246.db2.gz OPGXCMDROVQMAQ-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000922562336 1129571041 /nfs/dbraw/zinc/57/10/41/1129571041.db2.gz XQDZYRFUANNFLI-UHFFFAOYSA-N 1 0 334.803 3.647 20 5 EHBDRO Cn1cc(C[NH+]2C[C@@H]3CCCC[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093441807 1129588314 /nfs/dbraw/zinc/58/83/14/1129588314.db2.gz LPKRGWQEWVZCLE-HOTGVXAUSA-N 1 0 340.427 3.617 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390545296 1129622480 /nfs/dbraw/zinc/62/24/80/1129622480.db2.gz UCPWKIGVAKWULJ-OXQOHEQNSA-N 1 0 339.439 3.910 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000331182520 1129655945 /nfs/dbraw/zinc/65/59/45/1129655945.db2.gz SBLZXIAUWRMBIO-UAGQMJEPSA-N 1 0 347.459 3.637 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000125434282 1129691543 /nfs/dbraw/zinc/69/15/43/1129691543.db2.gz FOXKSGOKCFWXCY-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1cc(NC2CC[NH+](C(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302035295 1129764813 /nfs/dbraw/zinc/76/48/13/1129764813.db2.gz UKSPUTOXLZHUAY-UHFFFAOYSA-N 1 0 328.416 3.736 20 5 EHBDRO Cc1cc(N[C@@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302140662 1129770238 /nfs/dbraw/zinc/77/02/38/1129770238.db2.gz FGXSZLZJZSLTOV-RBUKOAKNSA-N 1 0 335.363 3.522 20 5 EHBDRO Cc1cc(NC[C@](C)(O)c2ccsc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302165685 1129771063 /nfs/dbraw/zinc/77/10/63/1129771063.db2.gz KTIXXCOINYODNA-KRWDZBQOSA-N 1 0 343.408 3.833 20 5 EHBDRO Cc1noc(C)c1CN(C)c1cc(C)[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000302169874 1129771252 /nfs/dbraw/zinc/77/12/52/1129771252.db2.gz LTYUHVPMQOOREF-UHFFFAOYSA-N 1 0 326.356 3.693 20 5 EHBDRO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000302929131 1129799104 /nfs/dbraw/zinc/79/91/04/1129799104.db2.gz CEVBNYYVYRGOJT-CQSZACIVSA-N 1 0 328.416 3.677 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000303584879 1129857418 /nfs/dbraw/zinc/85/74/18/1129857418.db2.gz FVMHXMNALOUFJY-OAHLLOKOSA-N 1 0 333.432 3.682 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000172169430 1130111096 /nfs/dbraw/zinc/11/10/96/1130111096.db2.gz RVSBCEHZEOLQQI-GHMZBOCLSA-N 1 0 339.823 3.744 20 5 EHBDRO CC(C)([NH2+]CCOCCOc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000429239438 1130173477 /nfs/dbraw/zinc/17/34/77/1130173477.db2.gz UMHCWFBPCPXWBW-UHFFFAOYSA-N 1 0 344.411 3.515 20 5 EHBDRO C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878119 1130178204 /nfs/dbraw/zinc/17/82/04/1130178204.db2.gz JYAIVDKNIFZNSQ-OLZOCXBDSA-N 1 0 337.420 3.501 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419142 1130228565 /nfs/dbraw/zinc/22/85/65/1130228565.db2.gz SLTHKKUGMNNEBO-PXAZEXFGSA-N 1 0 349.381 3.827 20 5 EHBDRO Cc1csc(C(C)(C)[NH2+]CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000173430748 1130230914 /nfs/dbraw/zinc/23/09/14/1130230914.db2.gz UWENYHKSUNNSRB-UHFFFAOYSA-N 1 0 335.429 3.654 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000245551281 1130235895 /nfs/dbraw/zinc/23/58/95/1130235895.db2.gz OZUKGUZJUILZFB-AACLIANESA-N 1 0 344.455 3.853 20 5 EHBDRO C[N@@H+]1CCC[C@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987161 1130335961 /nfs/dbraw/zinc/33/59/61/1130335961.db2.gz QFCLJLXJDVBIHZ-OXQOHEQNSA-N 1 0 339.439 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(OCC(F)F)cc2)cc1 ZINC000174351458 1130352023 /nfs/dbraw/zinc/35/20/23/1130352023.db2.gz XMZVQOUNDJLVDU-UHFFFAOYSA-N 1 0 336.338 3.571 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)O[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000728167593 1130642249 /nfs/dbraw/zinc/64/22/49/1130642249.db2.gz PQFNBZCHYMCJCP-CYBMUJFWSA-N 1 0 346.383 3.948 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CC1(N2CCOCC2)CC1 ZINC000766225392 1131447025 /nfs/dbraw/zinc/44/70/25/1131447025.db2.gz OZMZIDAEPLUDFE-UHFFFAOYSA-N 1 0 346.474 3.947 20 5 EHBDRO Cn1c(CNCc2cc(Cl)ccc2[N+](=O)[O-])nc2cc(F)ccc21 ZINC000740005839 1131515806 /nfs/dbraw/zinc/51/58/06/1131515806.db2.gz HONRLRJACMEFHV-UHFFFAOYSA-N 1 0 348.765 3.564 20 5 EHBDRO COCc1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172904074 1131886175 /nfs/dbraw/zinc/88/61/75/1131886175.db2.gz KWNORTNTMRWBES-LJQANCHMSA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1ncccc1C[N@@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913892 1131903095 /nfs/dbraw/zinc/90/30/95/1131903095.db2.gz VMPGMBLUKUNKHB-GOSISDBHSA-N 1 0 325.412 3.678 20 5 EHBDRO CCOC(=O)CCCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913683 1131903287 /nfs/dbraw/zinc/90/32/87/1131903287.db2.gz YPYFHBKRRJDPQA-KRWDZBQOSA-N 1 0 348.443 3.555 20 5 EHBDRO CO[C@@H]1CCC[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910546 1131916380 /nfs/dbraw/zinc/91/63/80/1131916380.db2.gz LVERWRJPTAWPSX-IZBJGVDFSA-N 1 0 344.455 3.589 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2cccs2)c1F ZINC001173175529 1131990721 /nfs/dbraw/zinc/99/07/21/1131990721.db2.gz PBYAKWKAAPUTSB-LLVKDONJSA-N 1 0 338.404 3.567 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(C)cc1 ZINC000743868657 1131993350 /nfs/dbraw/zinc/99/33/50/1131993350.db2.gz YNNVVLPWPDABKW-LJQANCHMSA-N 1 0 328.412 3.501 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1F ZINC001173183478 1131993658 /nfs/dbraw/zinc/99/36/58/1131993658.db2.gz YTRTVRFUIPNBQQ-MELADBBJSA-N 1 0 336.407 3.796 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccc(C)cc1 ZINC000743868656 1131994035 /nfs/dbraw/zinc/99/40/35/1131994035.db2.gz YNNVVLPWPDABKW-IBGZPJMESA-N 1 0 328.412 3.501 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC3CCC(CC3)C2)c1F ZINC001173191719 1131994704 /nfs/dbraw/zinc/99/47/04/1131994704.db2.gz GPTMLSWOHLQYMH-IYXRBSQSSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)Cc2ccc(C)nc2)c1F ZINC001173191205 1131994779 /nfs/dbraw/zinc/99/47/79/1131994779.db2.gz BACCWDNJIGCXIZ-ZDUSSCGKSA-N 1 0 347.390 3.509 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC001173218441 1132003030 /nfs/dbraw/zinc/00/30/30/1132003030.db2.gz AUXOYWDLJZYAKW-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cccc(C2([NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173219353 1132003639 /nfs/dbraw/zinc/00/36/39/1132003639.db2.gz BJRYKQNGYUGGCE-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1cccc2c1c(C[NH3+])cn2[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173221839 1132004145 /nfs/dbraw/zinc/00/41/45/1132004145.db2.gz QHBAZKUEICKQIN-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1ccccn1 ZINC001173224961 1132005912 /nfs/dbraw/zinc/00/59/12/1132005912.db2.gz PUWKBYJKCNAOQX-OAHLLOKOSA-N 1 0 327.428 3.779 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](OCc2ccccc2)C1 ZINC001173225459 1132006316 /nfs/dbraw/zinc/00/63/16/1132006316.db2.gz CGAYBEKHFCWWEH-UZLBHIALSA-N 1 0 340.423 3.817 20 5 EHBDRO CCCCCC[NH+]1CCN([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173226401 1132007242 /nfs/dbraw/zinc/00/72/42/1132007242.db2.gz JRVJHLHPMMUFQN-KRWDZBQOSA-N 1 0 333.476 3.724 20 5 EHBDRO Cc1ccc([C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173231104 1132009445 /nfs/dbraw/zinc/00/94/45/1132009445.db2.gz XKKTXKVBQRCSSF-KUHUBIRLSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ncccc1F)C1CC1 ZINC001173230564 1132009686 /nfs/dbraw/zinc/00/96/86/1132009686.db2.gz RXMFQNAMAZRWFE-YVEFUNNKSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCO)c1cccc(Cl)c1 ZINC001173233255 1132009946 /nfs/dbraw/zinc/00/99/46/1132009946.db2.gz HTQAOEORQKRUSR-FZKQIMNGSA-N 1 0 348.830 3.893 20 5 EHBDRO Cc1ccccc1OC[C@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232726 1132010970 /nfs/dbraw/zinc/01/09/70/1132010970.db2.gz FUUTUUXRWMWPIU-CVEARBPZSA-N 1 0 328.412 3.891 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@H](C)OC[C@@H]1c1ccccc1 ZINC001173236001 1132012096 /nfs/dbraw/zinc/01/20/96/1132012096.db2.gz DJHVRJQVJVSTOQ-TWOQFEAHSA-N 1 0 340.423 3.988 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000744395444 1132085109 /nfs/dbraw/zinc/08/51/09/1132085109.db2.gz YCHKEZOXQKMOLK-UHFFFAOYSA-N 1 0 348.374 3.646 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1c(C)n[nH]c1C ZINC001174216320 1132288552 /nfs/dbraw/zinc/28/85/52/1132288552.db2.gz ZDLWVTGPUWEGQU-UHFFFAOYSA-N 1 0 347.422 3.584 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000749298167 1132518240 /nfs/dbraw/zinc/51/82/40/1132518240.db2.gz ZJPHKMKLQFFGBG-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168978659 1132618534 /nfs/dbraw/zinc/61/85/34/1132618534.db2.gz UBCHZXFDNJQYBD-RYUDHWBXSA-N 1 0 341.249 3.719 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001168982872 1132619656 /nfs/dbraw/zinc/61/96/56/1132619656.db2.gz TVFCPKHZRNWDEP-ZTFGCOKTSA-N 1 0 345.443 3.649 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001168973464 1132624813 /nfs/dbraw/zinc/62/48/13/1132624813.db2.gz OTXCLGZFUDKAQY-BXKDBHETSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccc(C(F)(F)F)cn2)C2CC2)C1 ZINC001168998092 1132627229 /nfs/dbraw/zinc/62/72/29/1132627229.db2.gz ICAZZWRNJNZZTQ-RIEGTJTDSA-N 1 0 343.349 3.587 20 5 EHBDRO [NH2+]=C(N[C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C(F)(F)F)ccc1Cl ZINC001168997906 1132627660 /nfs/dbraw/zinc/62/76/60/1132627660.db2.gz GJIPVCRLXAKHFC-SCZZXKLOSA-N 1 0 349.740 3.719 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035325 1132637388 /nfs/dbraw/zinc/63/73/88/1132637388.db2.gz KGZRHNQMIXRWNC-XHDPSFHLSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040264 1132638170 /nfs/dbraw/zinc/63/81/70/1132638170.db2.gz ZFYBVASWXCFSPX-ABAIWWIYSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040265 1132638184 /nfs/dbraw/zinc/63/81/84/1132638184.db2.gz ZFYBVASWXCFSPX-IAQYHMDHSA-N 1 0 328.334 3.509 20 5 EHBDRO Cc1cnc(C[NH3+])n1-c1cnc2c3ccccc3c3ccccc3c2n1 ZINC001169020205 1132639282 /nfs/dbraw/zinc/63/92/82/1132639282.db2.gz HYXLPTGGAFUDAQ-UHFFFAOYSA-N 1 0 339.402 3.889 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](N2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052017 1132643183 /nfs/dbraw/zinc/64/31/83/1132643183.db2.gz FOHUXDDFXMMXCI-JSGCOSHPSA-N 1 0 329.425 3.571 20 5 EHBDRO C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057911 1132646101 /nfs/dbraw/zinc/64/61/01/1132646101.db2.gz YXKXZQDVZAAALQ-DZGCQCFKSA-N 1 0 330.350 3.625 20 5 EHBDRO C[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC001169136519 1132667881 /nfs/dbraw/zinc/66/78/81/1132667881.db2.gz NTPILQLVYLPLHM-AWEZNQCLSA-N 1 0 333.432 3.506 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC001175688946 1132738787 /nfs/dbraw/zinc/73/87/87/1132738787.db2.gz QVIWUJIEBPVSTR-QGZVFWFLSA-N 1 0 348.443 3.632 20 5 EHBDRO [NH3+]Cc1ccc2c(n1)N(c1cc3cccnc3c3ncccc13)CCC2 ZINC001169590913 1132790502 /nfs/dbraw/zinc/79/05/02/1132790502.db2.gz PVDWFHGSZGPTOI-UHFFFAOYSA-N 1 0 341.418 3.721 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CC[C@H](c2ccccc2)O1 ZINC001169667944 1132814723 /nfs/dbraw/zinc/81/47/23/1132814723.db2.gz YFFZMRHXIDAXRE-VQTJNVASSA-N 1 0 340.423 3.989 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1nc(Cl)ccc1[N+](=O)[O-] ZINC001169695562 1132822518 /nfs/dbraw/zinc/82/25/18/1132822518.db2.gz GWRSFKIHFDGSSY-GFCCVEGCSA-N 1 0 332.791 3.883 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC001169723330 1132835380 /nfs/dbraw/zinc/83/53/80/1132835380.db2.gz BZGPQKDBIBMYKM-OAHLLOKOSA-N 1 0 347.459 3.990 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CCNc2cc3ccc(Cl)nc3cc2[N+](=O)[O-])C1 ZINC001156385400 1132877471 /nfs/dbraw/zinc/87/74/71/1132877471.db2.gz FWDGPAHGPSUWCB-LBPRGKRZSA-N 1 0 348.834 3.940 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCc1cccnc1N1CCCC1 ZINC001169861082 1132883906 /nfs/dbraw/zinc/88/39/06/1132883906.db2.gz SONYTDWRBLNXKV-UHFFFAOYSA-N 1 0 339.507 3.890 20 5 EHBDRO Cc1csc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC001177225483 1133042521 /nfs/dbraw/zinc/04/25/21/1133042521.db2.gz CENSLJMFTQZSDH-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H](O)C23CCC3)s1 ZINC001179154602 1133231977 /nfs/dbraw/zinc/23/19/77/1133231977.db2.gz YLJZFRCPLDHBQA-SJORKVTESA-N 1 0 344.436 3.716 20 5 EHBDRO Cc1cc(C)c(C[NH2+][C@@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1C ZINC001179353372 1133243683 /nfs/dbraw/zinc/24/36/83/1133243683.db2.gz QDGQPELOCKKVJN-IBGZPJMESA-N 1 0 328.412 3.517 20 5 EHBDRO CCC[C@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001179359289 1133247159 /nfs/dbraw/zinc/24/71/59/1133247159.db2.gz RQTRBSHEGKECPF-CQSZACIVSA-N 1 0 334.441 3.964 20 5 EHBDRO COc1c(O)ccc(CN2CCC[C@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513297 1133380009 /nfs/dbraw/zinc/38/00/09/1133380009.db2.gz BOCMBFSSJLVOBS-HNNXBMFYSA-N 1 0 346.358 3.785 20 5 EHBDRO C[NH+](C)C[C@@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000772020508 1133634568 /nfs/dbraw/zinc/63/45/68/1133634568.db2.gz CKJZEPRYUIFHJA-JTQLQIEISA-N 1 0 332.231 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](O)c1ccccc1Cl)CCC2 ZINC000774256041 1133645130 /nfs/dbraw/zinc/64/51/30/1133645130.db2.gz WGBBGZRFWGNKOD-QZTJIDSGSA-N 1 0 346.814 3.949 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000774265957 1133649945 /nfs/dbraw/zinc/64/99/45/1133649945.db2.gz LLIIRCUYMJPVTC-GOSISDBHSA-N 1 0 341.367 3.713 20 5 EHBDRO CSCCCCCC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774355233 1133669465 /nfs/dbraw/zinc/66/94/65/1133669465.db2.gz PVRFQPUTIJDYQL-LSDHHAIUSA-N 1 0 340.493 3.788 20 5 EHBDRO Cc1ccnc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC001183596792 1133832206 /nfs/dbraw/zinc/83/22/06/1133832206.db2.gz CQRNYCIEBJSXAU-MAUKXSAKSA-N 1 0 325.412 3.799 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1COC2(CCCCC2)O1 ZINC000786821908 1133912051 /nfs/dbraw/zinc/91/20/51/1133912051.db2.gz WIFPPDWACRINMY-SPQRHKFCSA-N 1 0 346.427 3.664 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000786880486 1133923510 /nfs/dbraw/zinc/92/35/10/1133923510.db2.gz QSCMDQWVTXCZKY-KSSFIOAISA-N 1 0 346.427 3.914 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000746668804 1133988527 /nfs/dbraw/zinc/98/85/27/1133988527.db2.gz BGUKFVMXVSDDOC-SFHVURJKSA-N 1 0 346.402 3.814 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000788581214 1134147401 /nfs/dbraw/zinc/14/74/01/1134147401.db2.gz TWUBPNGSWZNPOG-QUCCMNQESA-N 1 0 340.423 3.815 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694563 1134163958 /nfs/dbraw/zinc/16/39/58/1134163958.db2.gz WATSOADGMNQKOA-UONOGXRCSA-N 1 0 325.412 3.633 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788796787 1134170545 /nfs/dbraw/zinc/17/05/45/1134170545.db2.gz VALAHSBJEWIJKP-ZBEGNZNMSA-N 1 0 349.818 3.869 20 5 EHBDRO CC1(C)CCC[N@@H+]1CCNc1c2cccc(Cl)c2ncc1[N+](=O)[O-] ZINC001186681324 1134249177 /nfs/dbraw/zinc/24/91/77/1134249177.db2.gz QRFZAACYMVJJTM-UHFFFAOYSA-N 1 0 348.834 3.505 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cccc1[N+](=O)[O-] ZINC000790695283 1134453818 /nfs/dbraw/zinc/45/38/18/1134453818.db2.gz MHZMVTVIMVMKNL-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO Cc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775205527 1134515281 /nfs/dbraw/zinc/51/52/81/1134515281.db2.gz ZDTXTXOHOXTGQM-CQSZACIVSA-N 1 0 343.383 3.874 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC001170305643 1134739766 /nfs/dbraw/zinc/73/97/66/1134739766.db2.gz OLEOIZLNZQICMF-KPZWWZAWSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c([N+](=O)[O-])c1 ZINC001170312163 1134744613 /nfs/dbraw/zinc/74/46/13/1134744613.db2.gz DFCQQIBTFWISKU-KPZWWZAWSA-N 1 0 342.395 3.517 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cncc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170326348 1134748072 /nfs/dbraw/zinc/74/80/72/1134748072.db2.gz HOPOVBCTKSGHSC-VXGBXAGGSA-N 1 0 349.818 3.934 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170342614 1134758832 /nfs/dbraw/zinc/75/88/32/1134758832.db2.gz MMCSBLPDLJUDMO-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340092 1134758989 /nfs/dbraw/zinc/75/89/89/1134758989.db2.gz DKJSTUQVEMFDHN-DGCLKSJQSA-N 1 0 346.349 3.809 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H](CC2CC2)c2ccccc2)c1 ZINC000775422868 1134769026 /nfs/dbraw/zinc/76/90/26/1134769026.db2.gz LWNJUQXRFFWMJB-MOPGFXCFSA-N 1 0 326.396 3.759 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792913114 1134823798 /nfs/dbraw/zinc/82/37/98/1134823798.db2.gz LXXBCWHCFXSCGY-UONOGXRCSA-N 1 0 345.226 3.619 20 5 EHBDRO C[C@@H](CCNC(=O)OC(C)(C)C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000793598713 1134966793 /nfs/dbraw/zinc/96/67/93/1134966793.db2.gz BFWBNGSOPYSBCP-LEJCZOIISA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCC(C4CC4)CC3)c2)cc1 ZINC000793632233 1134975471 /nfs/dbraw/zinc/97/54/71/1134975471.db2.gz RPRYQZRKQQWGRH-UHFFFAOYSA-N 1 0 326.400 3.538 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NC1CCN(CC(F)(F)F)CC1 ZINC001170446112 1135043582 /nfs/dbraw/zinc/04/35/82/1135043582.db2.gz RTEXWCOFBWILQA-UHFFFAOYSA-N 1 0 344.445 3.722 20 5 EHBDRO CC[C@@H](c1ccccc1OC)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000805834352 1135332878 /nfs/dbraw/zinc/33/28/78/1135332878.db2.gz FXIKGSHGOYLJKN-ZWKOTPCHSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1c(C[N@H+]2C[C@H](C(=O)OC(C)(C)C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC001195250334 1135399398 /nfs/dbraw/zinc/39/93/98/1135399398.db2.gz MBUCTEKVNBDKTA-XJKSGUPXSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@@]1(Cc2ccccc2Cl)CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC001196020268 1135506672 /nfs/dbraw/zinc/50/66/72/1135506672.db2.gz AQCKLEYBYZAAPB-KRWDZBQOSA-N 1 0 348.834 3.542 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613677 1135589726 /nfs/dbraw/zinc/58/97/26/1135589726.db2.gz KVZAUSKWLRDCPT-VUBDOFJKSA-N 1 0 331.416 3.600 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(Br)c1)c1ccc([N+](=O)[O-])cc1 ZINC001197661338 1135717425 /nfs/dbraw/zinc/71/74/25/1135717425.db2.gz UOQAGYJFGQUXBA-JTQLQIEISA-N 1 0 336.189 3.603 20 5 EHBDRO CCC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC(C)(C)O ZINC000809942317 1135902702 /nfs/dbraw/zinc/90/27/02/1135902702.db2.gz HOVAWQDDYJGSMD-UHFFFAOYSA-N 1 0 335.231 3.885 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000810165504 1135929709 /nfs/dbraw/zinc/92/97/09/1135929709.db2.gz URSKPJDDCSLDJD-FUHWJXTLSA-N 1 0 346.814 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCO[C@@H](C4CC4)C3)o2)cc1 ZINC001201910628 1136074249 /nfs/dbraw/zinc/07/42/49/1136074249.db2.gz HTPNTPMMZMDIRY-HNAYVOBHSA-N 1 0 342.395 3.902 20 5 EHBDRO C[C@@H]1CC([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@@H](C)O1 ZINC000811485783 1136092595 /nfs/dbraw/zinc/09/25/95/1136092595.db2.gz AUFPXDPRQORTPH-RKDXNWHRSA-N 1 0 333.215 3.947 20 5 EHBDRO COC(=O)C(C)(C)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811505525 1136101353 /nfs/dbraw/zinc/10/13/53/1136101353.db2.gz DJAOPFNYOJCQHZ-UHFFFAOYSA-N 1 0 349.214 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3ccccc3F)CC2)cc1 ZINC000776278059 1136130881 /nfs/dbraw/zinc/13/08/81/1136130881.db2.gz RCBKGGAINOKBGT-LJQANCHMSA-N 1 0 344.386 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2CCc2ccccc2)cc1 ZINC000776279062 1136133788 /nfs/dbraw/zinc/13/37/88/1136133788.db2.gz WYKOBLSYIXTKMK-UYAOXDASSA-N 1 0 340.423 3.725 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280111 1136135524 /nfs/dbraw/zinc/13/55/24/1136135524.db2.gz ZVIKIQHRUIEEBB-OALUTQOASA-N 1 0 326.396 3.774 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847513 1136259297 /nfs/dbraw/zinc/25/92/97/1136259297.db2.gz DSJZYOMGWITDER-UGSOOPFHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812849007 1136260149 /nfs/dbraw/zinc/26/01/49/1136260149.db2.gz NSPWHADXAJSQLL-KUHUBIRLSA-N 1 0 344.411 3.547 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COC2(CCC2)C1 ZINC000850525558 1136277785 /nfs/dbraw/zinc/27/77/85/1136277785.db2.gz OMWHNYKOJJDJSC-ZIAGYGMSSA-N 1 0 336.457 3.767 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1C[C@H](O)c2ccccc21)C1CC1 ZINC000850529602 1136278991 /nfs/dbraw/zinc/27/89/91/1136278991.db2.gz SKJJBFZAERGAPY-BJLQDIEVSA-N 1 0 338.407 3.684 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCCC[C@@H]2c2ccccc2)c1 ZINC000776487380 1136304089 /nfs/dbraw/zinc/30/40/89/1136304089.db2.gz ZBYQSOBGOVGDIQ-VAMGGRTRSA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)c(F)c1 ZINC000747840762 1136306894 /nfs/dbraw/zinc/30/68/94/1136306894.db2.gz SRKSQGUKILHNLQ-RTBURBONSA-N 1 0 344.386 3.822 20 5 EHBDRO C[C@]1(c2ccccc2)CCC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584560 1136442490 /nfs/dbraw/zinc/44/24/90/1136442490.db2.gz MYFGNYYSFWLFEQ-PMACEKPBSA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592484 1136453995 /nfs/dbraw/zinc/45/39/95/1136453995.db2.gz OXCPKEBBPPXBKE-BPAFIMBUSA-N 1 0 340.423 3.581 20 5 EHBDRO C[C@@H](OC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448824 1136597128 /nfs/dbraw/zinc/59/71/28/1136597128.db2.gz VGJNTCBBHHMVRF-KDOFPFPSSA-N 1 0 346.427 3.996 20 5 EHBDRO COc1ccc(C[C@@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815598758 1136616874 /nfs/dbraw/zinc/61/68/74/1136616874.db2.gz BMYHVWQQVAVYMH-ZIAGYGMSSA-N 1 0 343.427 3.715 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575553 1136618107 /nfs/dbraw/zinc/61/81/07/1136618107.db2.gz UXRYTOVBRRQBDJ-CHWSQXEVSA-N 1 0 329.400 3.555 20 5 EHBDRO Cc1cccc2[nH]cc(CC[NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)c21 ZINC000815574933 1136618400 /nfs/dbraw/zinc/61/84/00/1136618400.db2.gz GUVLRGBJOVQXBU-ZDUSSCGKSA-N 1 0 338.411 3.860 20 5 EHBDRO CCC[C@H](Cc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819013549 1136902908 /nfs/dbraw/zinc/90/29/08/1136902908.db2.gz WEMVDLBGFPPGNJ-MJGOQNOKSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819079439 1136911658 /nfs/dbraw/zinc/91/16/58/1136911658.db2.gz ADLLOTSGZCVUBX-WMZOPIPTSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819138080 1136912470 /nfs/dbraw/zinc/91/24/70/1136912470.db2.gz LWIQJDGCGBENPN-HQOQDVMHSA-N 1 0 344.386 3.681 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@H](Cc3ccccc3)C2)c1 ZINC000819251893 1136924555 /nfs/dbraw/zinc/92/45/55/1136924555.db2.gz VWJRAYKADMIHRJ-YVWKXTFCSA-N 1 0 340.423 3.629 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2ccc(Cl)c(F)c2)cccc1[N+](=O)[O-] ZINC000819262129 1136929521 /nfs/dbraw/zinc/92/95/21/1136929521.db2.gz RNTWRDMXAYOSDN-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000819280254 1136930728 /nfs/dbraw/zinc/93/07/28/1136930728.db2.gz ZOKISBNTIPDZIO-HHXXYDBFSA-N 1 0 344.386 3.693 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830161 1137033484 /nfs/dbraw/zinc/03/34/84/1137033484.db2.gz NECOVKJHNUFIMG-YDEXJTGXSA-N 1 0 333.215 3.803 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3C[C@@H]4C[C@@H](c5ccccc5)[C@@H]4C3)nc2c1 ZINC000859929972 1137037274 /nfs/dbraw/zinc/03/72/74/1137037274.db2.gz NWJDBEMKDSSVJM-BHYGNILZSA-N 1 0 349.390 3.972 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1F ZINC000860102785 1137044369 /nfs/dbraw/zinc/04/43/69/1137044369.db2.gz HFUWPDBWGJLLCB-CYBMUJFWSA-N 1 0 348.349 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3CC4CCC3CC4)CC2)cc1 ZINC000777159364 1137090634 /nfs/dbraw/zinc/09/06/34/1137090634.db2.gz XOBZKRKIAHMUIU-ZOJXTTQQSA-N 1 0 329.444 3.732 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@](C)(O)c1ccccc1 ZINC000823607018 1137106399 /nfs/dbraw/zinc/10/63/99/1137106399.db2.gz XTVZZIRTUBBQCD-KXBFYZLASA-N 1 0 328.412 3.804 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C2CC2)cn1 ZINC000862552231 1137149848 /nfs/dbraw/zinc/14/98/48/1137149848.db2.gz ZPIXIXGWOYXSEO-KRWDZBQOSA-N 1 0 347.802 3.893 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000824798234 1137152808 /nfs/dbraw/zinc/15/28/08/1137152808.db2.gz ACBNPYFEJVQBBT-LRDDRELGSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1 ZINC000863587732 1137192991 /nfs/dbraw/zinc/19/29/91/1137192991.db2.gz SDSDUVPWCZRZAC-DLBZAZTESA-N 1 0 332.787 3.559 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000863587735 1137193042 /nfs/dbraw/zinc/19/30/42/1137193042.db2.gz SDSDUVPWCZRZAC-SJORKVTESA-N 1 0 332.787 3.559 20 5 EHBDRO Cc1ccccc1C1([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000844351008 1137214310 /nfs/dbraw/zinc/21/43/10/1137214310.db2.gz KCLAJVIYUXQGDH-SFHVURJKSA-N 1 0 326.396 3.606 20 5 EHBDRO CSc1ccccc1CN(C)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000794661114 1137222264 /nfs/dbraw/zinc/22/22/64/1137222264.db2.gz MVLYISCXEMIHOU-UHFFFAOYSA-N 1 0 342.424 3.756 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccnc1F ZINC000794826176 1137264701 /nfs/dbraw/zinc/26/47/01/1137264701.db2.gz AOKVVWRMXBWMDX-ZDUSSCGKSA-N 1 0 335.404 3.789 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000865454577 1137285327 /nfs/dbraw/zinc/28/53/27/1137285327.db2.gz CTOCWEWPCYXJIV-SFHVURJKSA-N 1 0 344.411 3.595 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@]1(C)C[C@]1(F)Cl ZINC000846039070 1137329072 /nfs/dbraw/zinc/32/90/72/1137329072.db2.gz STQWQHDCVDXXNE-HUUCEWRRSA-N 1 0 330.787 3.788 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])[nH]1 ZINC000866348109 1137348007 /nfs/dbraw/zinc/34/80/07/1137348007.db2.gz ZPZRNBNTWHUNBJ-QJPTWQEYSA-N 1 0 349.410 3.647 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1ccnc(F)c1 ZINC000866472739 1137357591 /nfs/dbraw/zinc/35/75/91/1137357591.db2.gz DTWFQHLXRFPGKR-GDBMZVCRSA-N 1 0 329.375 3.630 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000866528894 1137361524 /nfs/dbraw/zinc/36/15/24/1137361524.db2.gz JZWWLRHKCSKTEZ-WBVHZDCISA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1CCC12CCOCC2)C1CC1 ZINC000866529748 1137361591 /nfs/dbraw/zinc/36/15/91/1137361591.db2.gz SABPYSWBBKYHBH-MSOLQXFVSA-N 1 0 344.455 3.712 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N1c2ccccc2[C@@H]([NH3+])C1(C)C ZINC000867989025 1137392696 /nfs/dbraw/zinc/39/26/96/1137392696.db2.gz ZWTCCYLYYJTSBX-QGZVFWFLSA-N 1 0 339.395 3.650 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000772982452 1137409836 /nfs/dbraw/zinc/40/98/36/1137409836.db2.gz VZTXGVAXMXHRNJ-KRWDZBQOSA-N 1 0 345.355 3.623 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCc2ccccc2OC1 ZINC000511038758 1137471409 /nfs/dbraw/zinc/47/14/09/1137471409.db2.gz VDXMIRCFIUIVRT-ZBFHGGJFSA-N 1 0 326.396 3.948 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC001171713673 1137505794 /nfs/dbraw/zinc/50/57/94/1137505794.db2.gz KNEDPLMDQOCIDF-PXAZEXFGSA-N 1 0 345.374 3.802 20 5 EHBDRO CCC[NH+]1CCC(N[C@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872018101 1137564811 /nfs/dbraw/zinc/56/48/11/1137564811.db2.gz IKDVWUOQOBXKAW-CYBMUJFWSA-N 1 0 337.489 3.842 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(N(C)C)nc1 ZINC000872020306 1137565049 /nfs/dbraw/zinc/56/50/49/1137565049.db2.gz FRLVYVBQCOFBON-GFCCVEGCSA-N 1 0 346.456 3.629 20 5 EHBDRO C[C@@H](NCc1cccc(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020634 1137565088 /nfs/dbraw/zinc/56/50/88/1137565088.db2.gz JNBMRRLXXUCOMU-CYBMUJFWSA-N 1 0 331.391 3.646 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCn1ccnc1 ZINC000872023517 1137565489 /nfs/dbraw/zinc/56/54/89/1137565489.db2.gz IFULKMVADLFPJQ-ZDUSSCGKSA-N 1 0 334.445 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC1(CCO)CCCC1 ZINC000872038903 1137566943 /nfs/dbraw/zinc/56/69/43/1137566943.db2.gz AYUGAXUZHKVAAG-ZDUSSCGKSA-N 1 0 338.473 3.910 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872048735 1137567774 /nfs/dbraw/zinc/56/77/74/1137567774.db2.gz LAWKYIBGSUKNQU-PSVSLLHZSA-N 1 0 336.338 3.646 20 5 EHBDRO C[C@H]([NH2+]C1CCC(OC(F)F)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077245 1137570036 /nfs/dbraw/zinc/57/00/36/1137570036.db2.gz DGQLQKKVGAVGIE-WHXUTIOJSA-N 1 0 332.322 3.935 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000124749217 1137608363 /nfs/dbraw/zinc/60/83/63/1137608363.db2.gz RROCBMYABDHJTK-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124849412 1137611056 /nfs/dbraw/zinc/61/10/56/1137611056.db2.gz VGWVFTCNMXKBMF-QZTJIDSGSA-N 1 0 332.375 3.898 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)(C)c1ccccc1 ZINC000877061225 1137669032 /nfs/dbraw/zinc/66/90/32/1137669032.db2.gz AOIGOTRWSKOREX-HTWSVDAQSA-N 1 0 342.443 3.841 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000877557368 1137681202 /nfs/dbraw/zinc/68/12/02/1137681202.db2.gz LCOLIIUWMBLGGM-IFMYKAFSSA-N 1 0 328.349 3.968 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000877557369 1137681298 /nfs/dbraw/zinc/68/12/98/1137681298.db2.gz LCOLIIUWMBLGGM-MZFXBISCSA-N 1 0 328.349 3.968 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877797490 1137690279 /nfs/dbraw/zinc/69/02/79/1137690279.db2.gz VOONVPACVOOTNC-AWEZNQCLSA-N 1 0 344.411 3.838 20 5 EHBDRO Cc1csc([C@@H]2CC[N@H+](C/C=C/c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813817 1137690936 /nfs/dbraw/zinc/69/09/36/1137690936.db2.gz PKNJCVQOEWWUBX-CSPWOOARSA-N 1 0 329.425 3.862 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966240 1137697439 /nfs/dbraw/zinc/69/74/39/1137697439.db2.gz DXQYDBVYFMXNAO-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[C@@H](C)C[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878092965 1137702089 /nfs/dbraw/zinc/70/20/89/1137702089.db2.gz CQTNLAYEUMHKDG-SNVBAGLBSA-N 1 0 338.795 3.776 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@H](C3CC3)C2)o1 ZINC000878323656 1137710912 /nfs/dbraw/zinc/71/09/12/1137710912.db2.gz BASXXAOKQGVUTE-LLVKDONJSA-N 1 0 348.790 3.530 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878670271 1137724445 /nfs/dbraw/zinc/72/44/45/1137724445.db2.gz TUVCKZIDAUKTHE-AWEZNQCLSA-N 1 0 332.404 3.949 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1ccc(C(F)(F)F)nc1 ZINC000880098065 1137768138 /nfs/dbraw/zinc/76/81/38/1137768138.db2.gz FVAVUVWCXAMFNZ-SECBINFHSA-N 1 0 343.280 3.999 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1 ZINC000882680249 1137831433 /nfs/dbraw/zinc/83/14/33/1137831433.db2.gz RIRBSWRUHBBNRS-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO CC(C)(C)Oc1cc(N2CCC(C)([NH+]3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000882963636 1137839853 /nfs/dbraw/zinc/83/98/53/1137839853.db2.gz FGFGOWRAUWJKFU-UHFFFAOYSA-N 1 0 347.459 3.837 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1c([N+](=O)[O-])cccc1C(F)(F)F ZINC000800200442 1137902245 /nfs/dbraw/zinc/90/22/45/1137902245.db2.gz MZKWLJNVUBNGSO-UHFFFAOYSA-N 1 0 348.321 3.502 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000120272154 1137948017 /nfs/dbraw/zinc/94/80/17/1137948017.db2.gz ZMBRXYGVOYHCBP-RDTXWAMCSA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[NH+]1CCC(CCc2ccc(O)cc2)CC1 ZINC000885956191 1138028315 /nfs/dbraw/zinc/02/83/15/1138028315.db2.gz LHLXHYLONQBEGU-UHFFFAOYSA-N 1 0 341.411 3.540 20 5 EHBDRO C[C@]1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886344755 1138069451 /nfs/dbraw/zinc/06/94/51/1138069451.db2.gz KXQANSUCGAFSQQ-UKTKYZJWSA-N 1 0 330.428 3.937 20 5 EHBDRO CSCC[C@H](C)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089912546 1138207446 /nfs/dbraw/zinc/20/74/46/1138207446.db2.gz SVSFCAIPVPMOBO-LBPRGKRZSA-N 1 0 335.429 3.823 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090728409 1138213010 /nfs/dbraw/zinc/21/30/10/1138213010.db2.gz QPMOKRNXXALDTQ-SJCJKPOMSA-N 1 0 343.427 3.914 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090728411 1138213110 /nfs/dbraw/zinc/21/31/10/1138213110.db2.gz QPMOKRNXXALDTQ-YVEFUNNKSA-N 1 0 343.427 3.914 20 5 EHBDRO C[C@H]([NH2+]C1(C2CC2)CCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000887147359 1138222586 /nfs/dbraw/zinc/22/25/86/1138222586.db2.gz JIBLCAMKWADOMT-NSHDSACASA-N 1 0 328.372 3.628 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cn1 ZINC000126836942 1138340090 /nfs/dbraw/zinc/34/00/90/1138340090.db2.gz HMDLASQRQKZDHS-HNNXBMFYSA-N 1 0 342.443 3.995 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)c1 ZINC000337307600 1138526918 /nfs/dbraw/zinc/52/69/18/1138526918.db2.gz SOQXEVJOJUCDEH-UHFFFAOYSA-N 1 0 327.359 3.938 20 5 EHBDRO CCCn1nccc1C1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000337355851 1138542548 /nfs/dbraw/zinc/54/25/48/1138542548.db2.gz DXDDKOCHGRWVCG-UHFFFAOYSA-N 1 0 346.406 3.720 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2COC)cc1[N+](=O)[O-] ZINC000152715106 1139105433 /nfs/dbraw/zinc/10/54/33/1139105433.db2.gz XIOKMLNQACDYAB-CQSZACIVSA-N 1 0 344.411 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@H]2C[C@H](O)c2cccs2)cc1 ZINC000175850985 1139523108 /nfs/dbraw/zinc/52/31/08/1139523108.db2.gz MMMWFNBRIUKGCB-IRXDYDNUSA-N 1 0 346.452 3.787 20 5 EHBDRO CC(C)Oc1cccc([C@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000179672441 1139773620 /nfs/dbraw/zinc/77/36/20/1139773620.db2.gz QBCDPPMJCBVRNE-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCO[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181456635 1139907757 /nfs/dbraw/zinc/90/77/57/1139907757.db2.gz XCCWITFNBDFPRB-USXIJHARSA-N 1 0 336.457 3.690 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946539 1140003565 /nfs/dbraw/zinc/00/35/65/1140003565.db2.gz QBFLQGLEWRYDBW-RYUDHWBXSA-N 1 0 330.388 3.559 20 5 EHBDRO CC1(C)CCC[C@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000191865014 1140490329 /nfs/dbraw/zinc/49/03/29/1140490329.db2.gz HZKVEPCLBOZDOW-MRXNPFEDSA-N 1 0 329.400 3.961 20 5 EHBDRO C[C@H]1C[C@H](N(C)c2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192460149 1140534642 /nfs/dbraw/zinc/53/46/42/1140534642.db2.gz BFEMBQSIUVIRLB-DZGCQCFKSA-N 1 0 346.456 3.541 20 5 EHBDRO COC[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000192994589 1140558566 /nfs/dbraw/zinc/55/85/66/1140558566.db2.gz UMBOREFCTZYDQF-RBUKOAKNSA-N 1 0 326.396 3.950 20 5 EHBDRO COc1cccc(N2CC[C@@H]([NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000267453766 1140793114 /nfs/dbraw/zinc/79/31/14/1140793114.db2.gz SFJVIVCRBJBIJM-GDBMZVCRSA-N 1 0 341.411 3.533 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](CCO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000268994924 1141041368 /nfs/dbraw/zinc/04/13/68/1141041368.db2.gz NGKHNYMUTFZBRD-WBVHZDCISA-N 1 0 328.412 3.720 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CC[C@H](CO)CC1 ZINC000271134111 1141311952 /nfs/dbraw/zinc/31/19/52/1141311952.db2.gz MOSUAUXACZJKKA-RBSFLKMASA-N 1 0 338.473 3.606 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](CCO)CC(C)C)cc1[N+](=O)[O-] ZINC000271199144 1141322919 /nfs/dbraw/zinc/32/29/19/1141322919.db2.gz ZAOGXJHFACVVPJ-HUUCEWRRSA-N 1 0 338.448 3.689 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000271212725 1141327293 /nfs/dbraw/zinc/32/72/93/1141327293.db2.gz DMOIAQGYHMZFDE-ZDUSSCGKSA-N 1 0 329.400 3.520 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@H](O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000271427357 1141364154 /nfs/dbraw/zinc/36/41/54/1141364154.db2.gz BICFHHVWECBMQF-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(CCOC)CC1 ZINC000271452585 1141371189 /nfs/dbraw/zinc/37/11/89/1141371189.db2.gz DXHYSYWQNIWRPP-CQSZACIVSA-N 1 0 338.473 3.872 20 5 EHBDRO COc1ccc([C@@H](OC)[C@@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000271485006 1141378004 /nfs/dbraw/zinc/37/80/04/1141378004.db2.gz IQMJEVTXGXXHPD-BZNIZROVSA-N 1 0 336.413 3.531 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271525767 1141388038 /nfs/dbraw/zinc/38/80/38/1141388038.db2.gz QELNQHPSGUEEQR-IAOVAPTHSA-N 1 0 340.427 3.696 20 5 EHBDRO C[C@H](NC(=O)Nc1cccc(C[NH+](C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271617045 1141407244 /nfs/dbraw/zinc/40/72/44/1141407244.db2.gz DHUVAVMTZIJLRI-ZDUSSCGKSA-N 1 0 342.399 3.539 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000283052302 1141544818 /nfs/dbraw/zinc/54/48/18/1141544818.db2.gz JAWJFCBLWYAXGX-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccnc(OC)c2)cc1[N+](=O)[O-] ZINC000348677040 1141565513 /nfs/dbraw/zinc/56/55/13/1141565513.db2.gz DXPHLDMAWUZCQV-STQMWFEESA-N 1 0 345.399 3.809 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000537986725 1032064692 /nfs/dbraw/zinc/06/46/92/1032064692.db2.gz IWFCUTYTSMQZEY-XJKSGUPXSA-N 1 0 336.432 3.585 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCn2cccn2)s1 ZINC000120107204 1014346862 /nfs/dbraw/zinc/34/68/62/1014346862.db2.gz SFWGNIMHTCKMGE-UHFFFAOYSA-N 1 0 342.424 3.700 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOC[C@@H](C2CCC2)C1 ZINC000430160267 1014484818 /nfs/dbraw/zinc/48/48/18/1014484818.db2.gz FWIYKJFUIJRHTA-BXBOZWQASA-N 1 0 330.428 3.747 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000246876465 1014813699 /nfs/dbraw/zinc/81/36/99/1014813699.db2.gz SWPGCFRYHJZMBF-WMZOPIPTSA-N 1 0 331.460 3.634 20 5 EHBDRO CCCC[N@H+](C)CC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000430219338 1015070879 /nfs/dbraw/zinc/07/08/79/1015070879.db2.gz NRGXELAXOFAWDX-UHFFFAOYSA-N 1 0 349.475 3.547 20 5 EHBDRO CC(=O)Nc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000154464034 1015465507 /nfs/dbraw/zinc/46/55/07/1015465507.db2.gz MQLJDLJRVQBZRU-UHFFFAOYSA-N 1 0 341.411 3.964 20 5 EHBDRO C[NH2+]Cc1cn(-c2ncnc3cc([N+](=O)[O-])ccc32)c2ccc(C)cc12 ZINC001167123250 1016185000 /nfs/dbraw/zinc/18/50/00/1016185000.db2.gz JBXXFHARJAFEAP-UHFFFAOYSA-N 1 0 347.378 3.510 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944317 1016193254 /nfs/dbraw/zinc/19/32/54/1016193254.db2.gz UGWKHLIUPLNLSS-OGWOLHLISA-N 1 0 329.444 3.605 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([S@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000247116402 1016532695 /nfs/dbraw/zinc/53/26/95/1016532695.db2.gz PKXXTRZGILAMGH-UNNNGVNHSA-N 1 0 338.473 3.715 20 5 EHBDRO CC(C)(O)C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000189944815 1016793936 /nfs/dbraw/zinc/79/39/36/1016793936.db2.gz UGHHWJFNABFZKP-UHFFFAOYSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CC2(c3ccccc3)CC2)n1 ZINC000472641066 1016920734 /nfs/dbraw/zinc/92/07/34/1016920734.db2.gz ZPLJKMCXSMCHDY-IRXDYDNUSA-N 1 0 340.427 3.596 20 5 EHBDRO C[C@@H]1CC(C)(C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414524724 1016954860 /nfs/dbraw/zinc/95/48/60/1016954860.db2.gz KYXLJTZCSCXDEZ-CYBMUJFWSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)O1 ZINC000414515917 1016949429 /nfs/dbraw/zinc/94/94/29/1016949429.db2.gz OCSJDXOHGSVJNY-VNHYZAJKSA-N 1 0 330.384 3.758 20 5 EHBDRO CC(C)C[C@H]([NH3+])c1noc(-c2cc([N+](=O)[O-])cc(C(F)(F)F)c2)n1 ZINC000414619521 1017067362 /nfs/dbraw/zinc/06/73/62/1017067362.db2.gz ODRWVLQSPVSBLY-NSHDSACASA-N 1 0 344.293 3.710 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1cccc2cccnc21 ZINC000449075843 1032165021 /nfs/dbraw/zinc/16/50/21/1032165021.db2.gz SEMBOUDMQWNKRX-OAHLLOKOSA-N 1 0 335.407 3.906 20 5 EHBDRO COCc1cc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])ccc1F ZINC000449121061 1032215714 /nfs/dbraw/zinc/21/57/14/1032215714.db2.gz FWRZITQATFUUPF-CYBMUJFWSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2ccc(F)cc12 ZINC000449136426 1032230267 /nfs/dbraw/zinc/23/02/67/1032230267.db2.gz BEQDRBDGFWZSAY-ZDUSSCGKSA-N 1 0 341.386 3.979 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000449211479 1032314828 /nfs/dbraw/zinc/31/48/28/1032314828.db2.gz XSTITVVIAHIQDZ-MOXGXCLJSA-N 1 0 340.423 3.893 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(C(=O)CC(C)C)CC1 ZINC000536825326 1032326312 /nfs/dbraw/zinc/32/63/12/1032326312.db2.gz GFVFFVUAKMSAEJ-HNNXBMFYSA-N 1 0 347.459 3.591 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000459692656 1032418639 /nfs/dbraw/zinc/41/86/39/1032418639.db2.gz MNPJCOIYRJDASK-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)n1 ZINC000459742357 1032456620 /nfs/dbraw/zinc/45/66/20/1032456620.db2.gz KYROTHBVKAUXML-GOSISDBHSA-N 1 0 340.427 3.799 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)n1 ZINC000459742790 1032457423 /nfs/dbraw/zinc/45/74/23/1032457423.db2.gz KYROTHBVKAUXML-SFHVURJKSA-N 1 0 340.427 3.799 20 5 EHBDRO CO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC000459777497 1032464144 /nfs/dbraw/zinc/46/41/44/1032464144.db2.gz WBAGSUGENWSUKP-UONOGXRCSA-N 1 0 344.333 3.661 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459809543 1032473515 /nfs/dbraw/zinc/47/35/15/1032473515.db2.gz STBLSYGCUSGJAU-CZUORRHYSA-N 1 0 333.432 3.789 20 5 EHBDRO CC[C@H](CO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000449379240 1032506083 /nfs/dbraw/zinc/50/60/83/1032506083.db2.gz ZVLUDVVBAXEDIX-LLVKDONJSA-N 1 0 338.791 3.711 20 5 EHBDRO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090770664 1032595082 /nfs/dbraw/zinc/59/50/82/1032595082.db2.gz WZBVLHODUZRSMB-KSSFIOAISA-N 1 0 326.396 3.759 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccncc2C)cc1[N+](=O)[O-] ZINC000090846940 1032601705 /nfs/dbraw/zinc/60/17/05/1032601705.db2.gz JUNRJSCMBBFFFW-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@H](c1ccccc1)[NH+](C)C ZINC000597668731 1032601969 /nfs/dbraw/zinc/60/19/69/1032601969.db2.gz YTSYLWLSFUXIOO-QGZVFWFLSA-N 1 0 341.411 3.843 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCO[C@@H](C(C)C)C1 ZINC000449490271 1032655154 /nfs/dbraw/zinc/65/51/54/1032655154.db2.gz BRRIONTXLVPIGP-KBXCAEBGSA-N 1 0 336.432 3.534 20 5 EHBDRO CCn1nc(C)c(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000449497179 1032669447 /nfs/dbraw/zinc/66/94/47/1032669447.db2.gz IGWXTWJOEDVMGK-QGZVFWFLSA-N 1 0 342.443 3.808 20 5 EHBDRO C[NH2+]C[C@@H]1CCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414658913 1017107987 /nfs/dbraw/zinc/10/79/87/1017107987.db2.gz KKJHHDZZPOMKCL-ZDUSSCGKSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656694 1017108121 /nfs/dbraw/zinc/10/81/21/1017108121.db2.gz IZXJBBZCULKIES-KGLIPLIRSA-N 1 0 345.468 3.883 20 5 EHBDRO C[C@H](C[NH3+])N(C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414668090 1017117196 /nfs/dbraw/zinc/11/71/96/1017117196.db2.gz YPFYHMQAGKQTEB-GFCCVEGCSA-N 1 0 349.818 3.820 20 5 EHBDRO CC(C)[C@@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000610271362 1017158879 /nfs/dbraw/zinc/15/88/79/1017158879.db2.gz KEMSLDWQNQAZTI-MRXNPFEDSA-N 1 0 334.441 3.820 20 5 EHBDRO CC(C)([NH3+])CNCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000414807599 1017207786 /nfs/dbraw/zinc/20/77/86/1017207786.db2.gz ROOIOWAUSPKNIN-UHFFFAOYSA-N 1 0 349.818 3.867 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460345167 1017467581 /nfs/dbraw/zinc/46/75/81/1017467581.db2.gz FJPIQWFDCRVACV-KKUMJFAQSA-N 1 0 333.432 3.726 20 5 EHBDRO CC[C@@H](C[C@H](C)CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345670 1018360645 /nfs/dbraw/zinc/36/06/45/1018360645.db2.gz YGLVEXOWMUJLCN-JSGCOSHPSA-N 1 0 349.456 3.605 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000610368097 1018530433 /nfs/dbraw/zinc/53/04/33/1018530433.db2.gz KIYLKOXCSNLJRN-UHFFFAOYSA-N 1 0 344.411 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(CN3CCSC4(CCCCC4)C3)nc2c1 ZINC000083243524 1018564850 /nfs/dbraw/zinc/56/48/50/1018564850.db2.gz RXCORIMPIWHXCF-UHFFFAOYSA-N 1 0 347.440 3.988 20 5 EHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(C)(C)O ZINC000579498974 1018843790 /nfs/dbraw/zinc/84/37/90/1018843790.db2.gz SSODIFUBDHDROG-UHFFFAOYSA-N 1 0 334.338 3.597 20 5 EHBDRO C[C@H]([NH2+]CCc1cn[nH]c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000576389890 1018919389 /nfs/dbraw/zinc/91/93/89/1018919389.db2.gz HMXMNJQNHJIKEU-LBPRGKRZSA-N 1 0 342.424 3.940 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@H](C)[C@H]1C ZINC000419373612 1018951710 /nfs/dbraw/zinc/95/17/10/1018951710.db2.gz OLWWMVHRXZQMFB-YVECIDJPSA-N 1 0 330.388 3.682 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccc(Cl)cc1)Cc1ccccc1[N+](=O)[O-] ZINC000052589536 1018993129 /nfs/dbraw/zinc/99/31/29/1018993129.db2.gz PEXJPOMDACSUQB-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccc(F)cc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000610420563 1019025286 /nfs/dbraw/zinc/02/52/86/1019025286.db2.gz RZCJLPGKCDXRCC-WFASDCNBSA-N 1 0 347.365 3.803 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116428 1019028179 /nfs/dbraw/zinc/02/81/79/1019028179.db2.gz FIAIFFAEYZQBBF-MRXNPFEDSA-N 1 0 345.468 3.849 20 5 EHBDRO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1ccc([N+](=O)[O-])cc1F ZINC000379668327 1019073225 /nfs/dbraw/zinc/07/32/25/1019073225.db2.gz DHXFBWKFXRHECY-UHFFFAOYSA-N 1 0 345.418 3.734 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000120616009 1019102532 /nfs/dbraw/zinc/10/25/32/1019102532.db2.gz KADLSLKVOUJDME-AAEUAGOBSA-N 1 0 330.432 3.535 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2NC1CC[NH+](C2CCCC2)CC1 ZINC000580345454 1019120690 /nfs/dbraw/zinc/12/06/90/1019120690.db2.gz JHKWGCYYRXHJTR-SFHVURJKSA-N 1 0 329.444 3.579 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1CO ZINC000536624363 1019204254 /nfs/dbraw/zinc/20/42/54/1019204254.db2.gz LHMGFNLYPPAUPT-MRXNPFEDSA-N 1 0 346.452 3.748 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2F)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000178864599 1019321607 /nfs/dbraw/zinc/32/16/07/1019321607.db2.gz MFPZGDCMUNTSSG-ZNOIYHFQSA-N 1 0 344.386 3.850 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556408 1032822863 /nfs/dbraw/zinc/82/28/63/1032822863.db2.gz NVGITNDEMYXRMG-HOCLYGCPSA-N 1 0 343.402 3.914 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556411 1032823085 /nfs/dbraw/zinc/82/30/85/1032823085.db2.gz NVGITNDEMYXRMG-ZBFHGGJFSA-N 1 0 343.402 3.914 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000513486568 1019745841 /nfs/dbraw/zinc/74/58/41/1019745841.db2.gz ZQRWAQYCXTXZIM-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@H](c2ccco2)N2CCCC2)c1 ZINC000060773976 1032866523 /nfs/dbraw/zinc/86/65/23/1032866523.db2.gz KPZRSKPZOMWIEY-MRXNPFEDSA-N 1 0 349.818 3.768 20 5 EHBDRO CC(C)c1nc([C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cs1 ZINC000121248378 1020035940 /nfs/dbraw/zinc/03/59/40/1020035940.db2.gz AFKGOHYZDAVLSV-GFCCVEGCSA-N 1 0 335.429 3.904 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)ccc1[N+](=O)[O-] ZINC000594044176 1032870319 /nfs/dbraw/zinc/87/03/19/1032870319.db2.gz QADKJMAEQKQOOS-NSHDSACASA-N 1 0 328.359 3.907 20 5 EHBDRO CCc1ncc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000449608818 1032874835 /nfs/dbraw/zinc/87/48/35/1032874835.db2.gz KJYUADHZLBLXGR-CJNGLKHVSA-N 1 0 329.400 3.646 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000177855572 1020213412 /nfs/dbraw/zinc/21/34/12/1020213412.db2.gz DDLCOMAYZDYNNC-NSHDSACASA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@H]([NH2+]CCCCNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000183175874 1020510827 /nfs/dbraw/zinc/51/08/27/1020510827.db2.gz RFADXYIHAQCADJ-ZDUSSCGKSA-N 1 0 337.420 3.550 20 5 EHBDRO Cc1ccc(NCc2nc3cc([N+](=O)[O-])ccc3o2)c(C[NH+](C)C)c1 ZINC000602493468 1032918747 /nfs/dbraw/zinc/91/87/47/1032918747.db2.gz AWPRVILSCAGXIQ-UHFFFAOYSA-N 1 0 340.383 3.718 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H](N2CCCC2=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000581380756 1020766406 /nfs/dbraw/zinc/76/64/06/1020766406.db2.gz DWRYRLGNDKMKOU-JZXOWHBKSA-N 1 0 345.443 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC3(c4ccc(F)cc4)CC3)nc2c1 ZINC000602516564 1032928369 /nfs/dbraw/zinc/92/83/69/1032928369.db2.gz NNFBMZWYSYTPTB-UHFFFAOYSA-N 1 0 341.342 3.697 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000602518787 1032930906 /nfs/dbraw/zinc/93/09/06/1032930906.db2.gz SFCQUAMPIYNQLK-OAHLLOKOSA-N 1 0 340.427 3.618 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1cccc(C)c1C ZINC001167463750 1020923522 /nfs/dbraw/zinc/92/35/22/1020923522.db2.gz AUGRXSRGPTXHQZ-QGZVFWFLSA-N 1 0 328.416 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@H]2CCc3ccccc32)cc1F ZINC000276270540 1020984179 /nfs/dbraw/zinc/98/41/79/1020984179.db2.gz CSXDPFDLTXTHKC-SFHVURJKSA-N 1 0 344.386 3.606 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000602568635 1032977130 /nfs/dbraw/zinc/97/71/30/1032977130.db2.gz LBHVEMXLOMOYKP-ZDUSSCGKSA-N 1 0 344.333 3.805 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000426403204 1021506068 /nfs/dbraw/zinc/50/60/68/1021506068.db2.gz FNOFYLPSKBNPGD-ZIAGYGMSSA-N 1 0 344.411 3.981 20 5 EHBDRO Cc1c(C[N@@H+]2CCCN3c4ccccc4C[C@@H]3C2)cccc1[N+](=O)[O-] ZINC000516514786 1021506323 /nfs/dbraw/zinc/50/63/23/1021506323.db2.gz CLAIPALGZWCTBC-GOSISDBHSA-N 1 0 337.423 3.540 20 5 EHBDRO CC[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602550978 1032986671 /nfs/dbraw/zinc/98/66/71/1032986671.db2.gz GMZAWBPYODDWMK-GOEBONIOSA-N 1 0 332.448 3.517 20 5 EHBDRO CC[NH+](CC)[C@H](C)CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000519760134 1021676000 /nfs/dbraw/zinc/67/60/00/1021676000.db2.gz PPQBIYYUCBTLQS-RISCZKNCSA-N 1 0 333.354 3.518 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnc2)cc1 ZINC000090909962 1021691860 /nfs/dbraw/zinc/69/18/60/1021691860.db2.gz RYXYIEJAGYJFHC-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2cccs2)[NH+]2CCCC2)n1 ZINC000178150573 1021793440 /nfs/dbraw/zinc/79/34/40/1021793440.db2.gz KRGYHAIJHXCZBF-AWEZNQCLSA-N 1 0 332.429 3.609 20 5 EHBDRO C[NH+]1CC2(CN(C(=O)c3ccc4ccc5cccc6ccc3c4c56)C2)C1 ZINC001270252372 1022060722 /nfs/dbraw/zinc/06/07/22/1022060722.db2.gz ANQHTVGEHUFOSE-UHFFFAOYSA-N 1 0 340.426 3.972 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCC[C@@H]1CCOC1 ZINC000449680396 1033031073 /nfs/dbraw/zinc/03/10/73/1033031073.db2.gz GLEFPZNWSAPRML-RYRKJORJSA-N 1 0 332.444 3.712 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000440412987 1022173657 /nfs/dbraw/zinc/17/36/57/1022173657.db2.gz WHUDDNRHIAQXHT-QGZVFWFLSA-N 1 0 327.384 3.616 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](CO)Cc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000467419044 1022257004 /nfs/dbraw/zinc/25/70/04/1022257004.db2.gz MMVZFCDTYPYKQE-UYAOXDASSA-N 1 0 342.439 3.938 20 5 EHBDRO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000187544474 1022331894 /nfs/dbraw/zinc/33/18/94/1022331894.db2.gz FSNWBENIBXBWQK-GOSISDBHSA-N 1 0 342.395 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@@H]3CCCCC3(F)F)nc2c1 ZINC000602672682 1033051166 /nfs/dbraw/zinc/05/11/66/1033051166.db2.gz DYFQPAJGEUGJTD-JTQLQIEISA-N 1 0 325.315 3.651 20 5 EHBDRO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)CC1(C[NH3+])CCCCC1 ZINC000184165951 1022447725 /nfs/dbraw/zinc/44/77/25/1022447725.db2.gz BFFUACSFMIOEPI-UHFFFAOYSA-N 1 0 347.459 3.631 20 5 EHBDRO Cc1c(CN2C[C@@H](c3ccsc3)O[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000120772973 1022559718 /nfs/dbraw/zinc/55/97/18/1022559718.db2.gz DXQPYPRKCVLYDQ-SJCJKPOMSA-N 1 0 332.425 3.927 20 5 EHBDRO CCC[C@H]([NH2+]CC1(C(=O)N(C)C)CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000165112765 1022568285 /nfs/dbraw/zinc/56/82/85/1022568285.db2.gz YGUZRBTUQZUJAE-KRWDZBQOSA-N 1 0 347.459 3.674 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H]2CCCC[C@H]2OC(F)F)c(F)c1 ZINC000510592604 1022707761 /nfs/dbraw/zinc/70/77/61/1022707761.db2.gz QMRWAPWAXATZNV-CHWSQXEVSA-N 1 0 336.285 3.513 20 5 EHBDRO Cc1ncsc1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602676890 1033079692 /nfs/dbraw/zinc/07/96/92/1033079692.db2.gz TYBVJNDGDHZOEW-UHFFFAOYSA-N 1 0 345.346 3.711 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602677784 1033081371 /nfs/dbraw/zinc/08/13/71/1033081371.db2.gz UKUKOUWYPVZKRM-CQSZACIVSA-N 1 0 332.322 3.518 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCCC1 ZINC000602683431 1033082165 /nfs/dbraw/zinc/08/21/65/1033082165.db2.gz VRXMRNOUGFQZRR-KRWDZBQOSA-N 1 0 332.448 3.517 20 5 EHBDRO CC(C)=CCC[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602682976 1033082488 /nfs/dbraw/zinc/08/24/88/1033082488.db2.gz ZJNADYUQYKNFRS-HNNXBMFYSA-N 1 0 332.448 3.683 20 5 EHBDRO C[N@@H+]1C[C@H]2C[C@@H](C1)N(C(=O)c1c3ccccc3cc3ccccc31)C2 ZINC001270378030 1022914455 /nfs/dbraw/zinc/91/44/55/1022914455.db2.gz XMMLZOWGKQEERN-QAPCUYQASA-N 1 0 330.431 3.769 20 5 EHBDRO CCC(CC)[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CC1 ZINC000165364218 1033101887 /nfs/dbraw/zinc/10/18/87/1033101887.db2.gz AIHSPOIZCSRWQM-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1c(Cl)cccc1[N+](=O)[O-] ZINC000438556739 1023125284 /nfs/dbraw/zinc/12/52/84/1023125284.db2.gz IFTBIHCDCYDLRH-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO Cc1c(C[N@H+](C)C[C@H]2OCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000507256801 1023213907 /nfs/dbraw/zinc/21/39/07/1023213907.db2.gz LSXQUUSYZKGNSZ-LJQANCHMSA-N 1 0 326.396 3.649 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccccc2OC)ccc1[N+](=O)[O-] ZINC000276854830 1023224784 /nfs/dbraw/zinc/22/47/84/1023224784.db2.gz FKPGVNHYLOUBFC-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CCC1([NH+](C)C)CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000602740562 1033129042 /nfs/dbraw/zinc/12/90/42/1033129042.db2.gz WUUXVFUZUGEMHL-DTQAZKPQSA-N 1 0 331.460 3.804 20 5 EHBDRO CCC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000548488330 1023496006 /nfs/dbraw/zinc/49/60/06/1023496006.db2.gz NRVKQVNJVSQZQB-PBHICJAKSA-N 1 0 333.432 3.790 20 5 EHBDRO CCC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000548488238 1023501171 /nfs/dbraw/zinc/50/11/71/1023501171.db2.gz QDMBNENUXHYSIK-LSDHHAIUSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H]4COCC[C@@H]43)o2)c1 ZINC000535801271 1023647693 /nfs/dbraw/zinc/64/76/93/1023647693.db2.gz GFPMOJHYYBTBHI-YJBOKZPZSA-N 1 0 342.395 3.856 20 5 EHBDRO CCCc1ccc([C@@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)C)cc1 ZINC000602786935 1033161471 /nfs/dbraw/zinc/16/14/71/1033161471.db2.gz XOKCSCPBFGHTOP-KRWDZBQOSA-N 1 0 330.432 3.768 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1ccc(Cl)cc1 ZINC000602767474 1033164967 /nfs/dbraw/zinc/16/49/67/1033164967.db2.gz QYESDBMQVRBSTR-OAHLLOKOSA-N 1 0 334.807 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+](Cc2ccc(F)cc2)C2CC2)cc1 ZINC000065208977 1023916606 /nfs/dbraw/zinc/91/66/06/1023916606.db2.gz SCANEEKGWOEYRL-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO COc1ccc(OCC[N@H+](CC(C)C)C2CCCC2)c([N+](=O)[O-])c1 ZINC000441528414 1024036574 /nfs/dbraw/zinc/03/65/74/1024036574.db2.gz YZPPRJZFHKZFNB-UHFFFAOYSA-N 1 0 336.432 3.883 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000178486301 1024324388 /nfs/dbraw/zinc/32/43/88/1024324388.db2.gz LCWOLDXQYVEULQ-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@H](Cc2ccccc2)C1 ZINC000538475226 1024402074 /nfs/dbraw/zinc/40/20/74/1024402074.db2.gz ASXOFMTUONGBNC-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000280899670 1024410658 /nfs/dbraw/zinc/41/06/58/1024410658.db2.gz DSUPKIIDKRLVOC-QAPCUYQASA-N 1 0 341.411 3.650 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(NC[C@@H]2CC[N@@H+](C3CC3)C2)c(Cl)c1 ZINC000228842362 1033209883 /nfs/dbraw/zinc/20/98/83/1033209883.db2.gz JKLOAGYBQVEZJV-VIFPVBQESA-N 1 0 330.215 3.798 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1cccnc1)C1CCC1 ZINC000280925990 1024442363 /nfs/dbraw/zinc/44/23/63/1024442363.db2.gz RLMAJQCLRBNKRA-SFHVURJKSA-N 1 0 327.384 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(OCC3CCCC3)CC2)c1 ZINC000434899654 1024490658 /nfs/dbraw/zinc/49/06/58/1024490658.db2.gz ABKXUVARVRKYNC-UHFFFAOYSA-N 1 0 348.443 3.645 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957239 1024525603 /nfs/dbraw/zinc/52/56/03/1024525603.db2.gz ZMKBBUVSXQAOEL-SWLSCSKDSA-N 1 0 346.818 3.891 20 5 EHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000472057353 1024527665 /nfs/dbraw/zinc/52/76/65/1024527665.db2.gz HNMRHJUUVMMZJR-BWHGNSOBSA-N 1 0 339.439 3.889 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000472057354 1024528332 /nfs/dbraw/zinc/52/83/32/1024528332.db2.gz HNMRHJUUVMMZJR-LFUCQOKTSA-N 1 0 339.439 3.889 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000514632730 1024623239 /nfs/dbraw/zinc/62/32/39/1024623239.db2.gz FQKOUBQBIXIDEG-QWRGUYRKSA-N 1 0 339.823 3.601 20 5 EHBDRO Cn1cc(C[N@H+](C)Cc2cccs2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000505605008 1024626798 /nfs/dbraw/zinc/62/67/98/1024626798.db2.gz FSNCBKIGUJEPGY-UHFFFAOYSA-N 1 0 342.424 3.689 20 5 EHBDRO C[C@@H](O)C(C)(C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000536496820 1024690468 /nfs/dbraw/zinc/69/04/68/1024690468.db2.gz HQJTVZAWROXJAH-CQSZACIVSA-N 1 0 343.427 3.612 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2ccccc2Cl)[NH+]2CCCC2)nc1 ZINC000025370927 1024732374 /nfs/dbraw/zinc/73/23/74/1024732374.db2.gz MQMZHNLIRQNNGR-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCOc1ccc(C)cc1 ZINC000507947675 1024790713 /nfs/dbraw/zinc/79/07/13/1024790713.db2.gz FKULRHYLSIEJML-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H]1CC(C)(C)C ZINC000435441719 1024927299 /nfs/dbraw/zinc/92/72/99/1024927299.db2.gz HJIQQKIJLYRHQZ-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CSC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000515140017 1025042298 /nfs/dbraw/zinc/04/22/98/1025042298.db2.gz BKQSGEBKBAJPFY-INIZCTEOSA-N 1 0 348.424 3.847 20 5 EHBDRO CC(C)OC(=O)C[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000248618743 1025046209 /nfs/dbraw/zinc/04/62/09/1025046209.db2.gz JWGNADFEJGZPTM-CABCVRRESA-N 1 0 334.416 3.710 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCO[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000157714788 1025093122 /nfs/dbraw/zinc/09/31/22/1025093122.db2.gz FLPBSXYHGHUNQB-QITLCBANSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1ccc(C[NH2+]CCc2ccc(SC)cc2)cc1[N+](=O)[O-] ZINC000435738586 1025116850 /nfs/dbraw/zinc/11/68/50/1025116850.db2.gz SVIPOABDFXMJTF-UHFFFAOYSA-N 1 0 332.425 3.658 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000435784438 1025148791 /nfs/dbraw/zinc/14/87/91/1025148791.db2.gz DOLPNICUQAMARA-HDJSIYSDSA-N 1 0 330.359 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000521479192 1025404283 /nfs/dbraw/zinc/40/42/83/1025404283.db2.gz BVPWMOUXGJTRJZ-SFHVURJKSA-N 1 0 330.359 3.950 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113924 1025521789 /nfs/dbraw/zinc/52/17/89/1025521789.db2.gz SPCNAGMJLLIOHY-SUMWQHHRSA-N 1 0 329.400 3.557 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113923 1025522152 /nfs/dbraw/zinc/52/21/52/1025522152.db2.gz SPCNAGMJLLIOHY-GUYCJALGSA-N 1 0 329.400 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC[C@H]3CCC(F)(F)C3)nc2c1 ZINC000898013715 1033288899 /nfs/dbraw/zinc/28/88/99/1033288899.db2.gz GQLFJHIMHGRHNK-SNVBAGLBSA-N 1 0 325.315 3.651 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000451108519 1025542656 /nfs/dbraw/zinc/54/26/56/1025542656.db2.gz WJXOFOPEACTXNB-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000451324672 1025827668 /nfs/dbraw/zinc/82/76/68/1025827668.db2.gz LPPMQIOITFIETQ-QGZVFWFLSA-N 1 0 334.803 3.722 20 5 EHBDRO CCC[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000522137750 1026016119 /nfs/dbraw/zinc/01/61/19/1026016119.db2.gz YRNKQUZCTDNUSZ-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2(Cc3ccc(F)cc3)CC2)c(F)c1 ZINC000478327743 1026067017 /nfs/dbraw/zinc/06/70/17/1026067017.db2.gz ZTTAUBYKPQYPFZ-UHFFFAOYSA-N 1 0 332.350 3.986 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@H+](Cc2ccc(F)cc2)C2CCCCC2)n1 ZINC000478418078 1026097184 /nfs/dbraw/zinc/09/71/84/1026097184.db2.gz OXOWBFFACKGVBN-UHFFFAOYSA-N 1 0 346.406 3.765 20 5 EHBDRO CN(C)C1(c2nc(-c3c4ccccc4nc4ccccc43)no2)CC1 ZINC000896944440 1026137932 /nfs/dbraw/zinc/13/79/32/1026137932.db2.gz PICCPXFCZTXGAD-UHFFFAOYSA-N 1 0 330.391 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H]([NH+]3CCCCC3)C2)cc1C(F)(F)F ZINC000530616634 1026141742 /nfs/dbraw/zinc/14/17/42/1026141742.db2.gz XUWLMFTVMQKXNH-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO COc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000511127475 1026283285 /nfs/dbraw/zinc/28/32/85/1026283285.db2.gz VQQCGKRKXGSPMP-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO C[C@@H](c1cccs1)N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025931405 1026463231 /nfs/dbraw/zinc/46/32/31/1026463231.db2.gz AJXTYZGJDXMQKU-NSHDSACASA-N 1 0 344.396 3.899 20 5 EHBDRO Cc1cccc(C[C@H](CO)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000466909861 1026571156 /nfs/dbraw/zinc/57/11/56/1026571156.db2.gz BCSZUTXKVBGQAR-GOSISDBHSA-N 1 0 342.439 3.720 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc(C(=O)CC)cc2[N+](=O)[O-])CC1 ZINC000479371708 1026601568 /nfs/dbraw/zinc/60/15/68/1026601568.db2.gz CYASEQVRUOGAHC-UHFFFAOYSA-N 1 0 333.432 3.864 20 5 EHBDRO CSCC[C@H](C)N(C)Cc1cccc([N+](=O)[O-])c1Br ZINC000235056615 1026668631 /nfs/dbraw/zinc/66/86/31/1026668631.db2.gz BJESGQUSCOEABU-JTQLQIEISA-N 1 0 347.278 3.931 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000128095861 1026958939 /nfs/dbraw/zinc/95/89/39/1026958939.db2.gz GXWLTNXBWWIGIV-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000187786726 1027081335 /nfs/dbraw/zinc/08/13/35/1027081335.db2.gz NCOUYHQDXCOPFQ-GUYCJALGSA-N 1 0 334.441 3.643 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1OC ZINC000531701244 1027224340 /nfs/dbraw/zinc/22/43/40/1027224340.db2.gz QIBUTGDBVVXLKM-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178649066 1027268658 /nfs/dbraw/zinc/26/86/58/1027268658.db2.gz FMWNTUCLEXPFOK-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000323832341 1027465654 /nfs/dbraw/zinc/46/56/54/1027465654.db2.gz IHIBYFHFRUWGNA-RTBURBONSA-N 1 0 327.428 3.938 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)cc1[N+](=O)[O-] ZINC000501785391 1027533471 /nfs/dbraw/zinc/53/34/71/1027533471.db2.gz PNJOGZPWKNIOPE-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000178653569 1027603676 /nfs/dbraw/zinc/60/36/76/1027603676.db2.gz GEQPJBLDPGWWCP-CYBMUJFWSA-N 1 0 328.368 3.607 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(Br)cc2)cccc1[N+](=O)[O-] ZINC000048018021 1027660476 /nfs/dbraw/zinc/66/04/76/1027660476.db2.gz OJSKUKOMJUPBAE-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000300241790 1027777089 /nfs/dbraw/zinc/77/70/89/1027777089.db2.gz RPZZFRIKFQXCSR-UWVGGRQHSA-N 1 0 330.215 3.940 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000612131499 1027898067 /nfs/dbraw/zinc/89/80/67/1027898067.db2.gz YLIKWORNXGXJFS-INIZCTEOSA-N 1 0 348.443 3.631 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@@H](C4CCCC4)C3)n2)cc1 ZINC000420958747 1027928023 /nfs/dbraw/zinc/92/80/23/1027928023.db2.gz CLPIMNJYUZYSMP-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000612194051 1027937548 /nfs/dbraw/zinc/93/75/48/1027937548.db2.gz QWTCMWPLKFXOGE-HNNXBMFYSA-N 1 0 346.814 3.904 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000178689651 1027991305 /nfs/dbraw/zinc/99/13/05/1027991305.db2.gz DIPWNNQXAKAFNW-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1cccc(OCCN2CCc3[nH]c4ccccc4c3C2)c1 ZINC000533512677 1027996123 /nfs/dbraw/zinc/99/61/23/1027996123.db2.gz LEAIDSLTDMOUEO-UHFFFAOYSA-N 1 0 337.379 3.513 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648643 1028110244 /nfs/dbraw/zinc/11/02/44/1028110244.db2.gz HKHOHHZCBJCWGN-ZFWWWQNUSA-N 1 0 336.395 3.849 20 5 EHBDRO CN1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000237169519 1028116254 /nfs/dbraw/zinc/11/62/54/1028116254.db2.gz HYHGWWKYRHHKLH-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000509972476 1028139144 /nfs/dbraw/zinc/13/91/44/1028139144.db2.gz QLTNZFGCNJJCSO-RVDMUPIBSA-N 1 0 326.396 3.934 20 5 EHBDRO COc1ccc(OCC[N@H+](C)Cc2cc(C)ccc2F)c([N+](=O)[O-])c1 ZINC000444743296 1028228377 /nfs/dbraw/zinc/22/83/77/1028228377.db2.gz YLYRCMXOVJZFGS-UHFFFAOYSA-N 1 0 348.374 3.562 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CC2CCC(F)(F)CC2)n1 ZINC000503954299 1028261494 /nfs/dbraw/zinc/26/14/94/1028261494.db2.gz VEQBIYSSVUKBLE-KBPBESRZSA-N 1 0 342.390 3.690 20 5 EHBDRO C[C@H](NC[C@@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333859 1028370811 /nfs/dbraw/zinc/37/08/11/1028370811.db2.gz WEXDMJSEEMJPAI-SMDDNHRTSA-N 1 0 331.441 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]34CCOC4)o2)c(Cl)c1 ZINC000421393938 1028374409 /nfs/dbraw/zinc/37/44/09/1028374409.db2.gz FOQIHNOIRRPWAQ-QGZVFWFLSA-N 1 0 348.786 3.873 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1OC ZINC000178730249 1028380404 /nfs/dbraw/zinc/38/04/04/1028380404.db2.gz UOMPMURVWLCADU-SFHVURJKSA-N 1 0 342.395 3.779 20 5 EHBDRO CC(C)[N@H+](CCC(=O)Nc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000064350091 1028477094 /nfs/dbraw/zinc/47/70/94/1028477094.db2.gz CZCXXMNYGYCGCQ-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO COCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000523702110 1028556794 /nfs/dbraw/zinc/55/67/94/1028556794.db2.gz FERTZQIZYRXNEQ-INIZCTEOSA-N 1 0 328.412 3.847 20 5 EHBDRO C[C@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000268842395 1028625906 /nfs/dbraw/zinc/62/59/06/1028625906.db2.gz FUPDCOXCKQTLEM-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO CC(C)[N@H+](C)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000523863821 1028676559 /nfs/dbraw/zinc/67/65/59/1028676559.db2.gz CMMQOLVKLVOXDL-UHFFFAOYSA-N 1 0 341.411 3.578 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2ncc[nH]2)C1 ZINC000347376207 1028805140 /nfs/dbraw/zinc/80/51/40/1028805140.db2.gz ZXLMWYKYWMGKIP-HFQYIWAZSA-N 1 0 326.400 3.601 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN(C)Cc1cc2ccccc2o1 ZINC000472280265 1028816395 /nfs/dbraw/zinc/81/63/95/1028816395.db2.gz SJNIGDSHAFOAJV-UHFFFAOYSA-N 1 0 326.352 3.982 20 5 EHBDRO C[C@@H]([NH2+]C1(C2CCC2)CC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593080359 1028937466 /nfs/dbraw/zinc/93/74/66/1028937466.db2.gz MDXBMDBQZOBMAH-LLVKDONJSA-N 1 0 328.372 3.628 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@]2(F)c2ccccc2)n1 ZINC000424333961 1028983309 /nfs/dbraw/zinc/98/33/09/1028983309.db2.gz YCQYQWIRDJHKLF-LHHMISFZSA-N 1 0 344.390 3.502 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CCOCC1 ZINC000504899292 1029026334 /nfs/dbraw/zinc/02/63/34/1029026334.db2.gz DIHGLRQCFKBROH-HNNXBMFYSA-N 1 0 338.473 3.872 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCSC1 ZINC000504900074 1029026782 /nfs/dbraw/zinc/02/67/82/1029026782.db2.gz QTGAXAVQQNQULG-QWHCGFSZSA-N 1 0 326.487 3.951 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCS1 ZINC000504912505 1029054333 /nfs/dbraw/zinc/05/43/33/1029054333.db2.gz WYPPPKRQWILUMS-OLZOCXBDSA-N 1 0 326.487 3.951 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCS1 ZINC000504912506 1029055898 /nfs/dbraw/zinc/05/58/98/1029055898.db2.gz WYPPPKRQWILUMS-QWHCGFSZSA-N 1 0 326.487 3.951 20 5 EHBDRO CCC[NH+](CCC)CCCc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000505008783 1029111533 /nfs/dbraw/zinc/11/15/33/1029111533.db2.gz JTJUECAKDZECSG-UHFFFAOYSA-N 1 0 332.404 3.699 20 5 EHBDRO C[N@H+](CCOc1ccc(Cl)cc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000524424535 1029180801 /nfs/dbraw/zinc/18/08/01/1029180801.db2.gz RWSGLMHGORRIAT-UHFFFAOYSA-N 1 0 334.803 3.802 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)Oc1cc(C)c(Br)cc1[N+](=O)[O-] ZINC001227999677 1029230495 /nfs/dbraw/zinc/23/04/95/1029230495.db2.gz GOGABVWAKLTWHD-LLVKDONJSA-N 1 0 345.237 3.775 20 5 EHBDRO CC1CC[NH+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)CC1 ZINC000052217540 1029436119 /nfs/dbraw/zinc/43/61/19/1029436119.db2.gz BJNQYTKJRRQGCR-UHFFFAOYSA-N 1 0 340.427 3.834 20 5 EHBDRO CC[NH2+]CCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414834147 1029482023 /nfs/dbraw/zinc/48/20/23/1029482023.db2.gz SVHYKYXOCWQVFL-UHFFFAOYSA-N 1 0 349.818 3.740 20 5 EHBDRO CC[C@@]1(O)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000428446353 1029668427 /nfs/dbraw/zinc/66/84/27/1029668427.db2.gz JRXQKGJHJCIPBN-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(Nc3ccc(F)cc3)CC2)cc1 ZINC000237853384 1029668998 /nfs/dbraw/zinc/66/89/98/1029668998.db2.gz SPPFRDAZQZHWJP-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192480552 1029684566 /nfs/dbraw/zinc/68/45/66/1029684566.db2.gz HDPGSRLYTSFHNX-TZMCWYRMSA-N 1 0 332.429 3.516 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000583391098 1029754982 /nfs/dbraw/zinc/75/49/82/1029754982.db2.gz KJQLQCICDWTYES-KSSFIOAISA-N 1 0 341.386 3.590 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441185395 1029895715 /nfs/dbraw/zinc/89/57/15/1029895715.db2.gz ZRAATVJVHHVDCU-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO CC(C)(CO)CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453268785 1030005521 /nfs/dbraw/zinc/00/55/21/1030005521.db2.gz BHUMIOVHGVZULW-GOSISDBHSA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192902778 1030013463 /nfs/dbraw/zinc/01/34/63/1030013463.db2.gz ZRMNDWGNGOGSDT-HXPMCKFVSA-N 1 0 342.443 3.543 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H](C)CC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453309406 1030081101 /nfs/dbraw/zinc/08/11/01/1030081101.db2.gz DUXWJMBWUJKUBT-SCLBCKFNSA-N 1 0 346.427 3.979 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453318878 1030097366 /nfs/dbraw/zinc/09/73/66/1030097366.db2.gz MEZBVTYBFFTMFO-CVAIRZPRSA-N 1 0 346.471 3.957 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453375888 1030198523 /nfs/dbraw/zinc/19/85/23/1030198523.db2.gz XNCMQKFMPIDPRC-XCRHUMRWSA-N 1 0 327.384 3.561 20 5 EHBDRO C[C@H](CC(C)(C)C)[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453407266 1030217005 /nfs/dbraw/zinc/21/70/05/1030217005.db2.gz DMEXAXLOFJADDH-CZUORRHYSA-N 1 0 330.432 3.832 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1ccc(F)cc1)CCC2 ZINC000447542930 1030278721 /nfs/dbraw/zinc/27/87/21/1030278721.db2.gz KNKPDLZMNUBRJI-SFHVURJKSA-N 1 0 330.359 3.780 20 5 EHBDRO CC1(C)C[C@H](C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453430618 1030285274 /nfs/dbraw/zinc/28/52/74/1030285274.db2.gz RBDGSESQOJRZIX-RHSMWYFYSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1CCCCN1C1CC1)C1CC1 ZINC000447592412 1030328456 /nfs/dbraw/zinc/32/84/56/1030328456.db2.gz LJEWLIJSKMNBDD-OALUTQOASA-N 1 0 343.471 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCCC[C@H]1n1cccn1)CCC2 ZINC000192923764 1030470995 /nfs/dbraw/zinc/47/09/95/1030470995.db2.gz QTJXKUZZAZMUDR-CEXWTWQISA-N 1 0 340.427 3.942 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)[NH+]2[C@@H](C)CC[C@@H]2C)n1 ZINC000526954268 1030503489 /nfs/dbraw/zinc/50/34/89/1030503489.db2.gz DPUKKFPPBRUGII-AVGNSLFASA-N 1 0 330.388 3.887 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000160181119 1030583733 /nfs/dbraw/zinc/58/37/33/1030583733.db2.gz SNCBRMBXSDWGQM-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H](CO)C1CCCCC1)C1CC1 ZINC000550896272 1030776819 /nfs/dbraw/zinc/77/68/19/1030776819.db2.gz ZUYXWATZUTWYJH-OALUTQOASA-N 1 0 346.471 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000527326340 1030798429 /nfs/dbraw/zinc/79/84/29/1030798429.db2.gz AZKQJVQQTGAQHB-NEPJUHHUSA-N 1 0 332.322 3.684 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cn2ccccc2n1 ZINC000550918197 1030799143 /nfs/dbraw/zinc/79/91/43/1030799143.db2.gz YYWTXKXHCWOUNJ-LBPRGKRZSA-N 1 0 344.802 3.789 20 5 EHBDRO C[N@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000343440272 1030900704 /nfs/dbraw/zinc/90/07/04/1030900704.db2.gz JFLAKDJQKYNELE-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@H]1CCC(C)(C)C1 ZINC000483101598 1030956057 /nfs/dbraw/zinc/95/60/57/1030956057.db2.gz HSJBNQRPOAINQG-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCCc2nc(C(C)C)no2)cc1[N+](=O)[O-] ZINC000160788380 1031023758 /nfs/dbraw/zinc/02/37/58/1031023758.db2.gz UZDYCZVGPXDUBB-CYBMUJFWSA-N 1 0 332.404 3.693 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+][C@@H]2CCOC2)cc1 ZINC000178995326 1031054153 /nfs/dbraw/zinc/05/41/53/1031054153.db2.gz YXGJRPSTRFYQSP-CQSZACIVSA-N 1 0 348.786 3.919 20 5 EHBDRO CSc1cc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])ccn1 ZINC000537936212 1032022040 /nfs/dbraw/zinc/02/20/40/1032022040.db2.gz GMAAFRPFYIQKFG-ZDUSSCGKSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1cc(N2CCOc3ccccc3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611921608 1033324790 /nfs/dbraw/zinc/32/47/90/1033324790.db2.gz MGTHCWWPGWOAEP-UHFFFAOYSA-N 1 0 335.363 3.850 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071951 1033325030 /nfs/dbraw/zinc/32/50/30/1033325030.db2.gz VNRSXUGSAJGJDY-KQIUPUNMSA-N 1 0 329.425 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCc1ccn(-c2ccccc2)n1 ZINC000594493044 1033394186 /nfs/dbraw/zinc/39/41/86/1033394186.db2.gz DWDFAMOBOJVMTC-IBGZPJMESA-N 1 0 348.406 3.600 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000594500300 1033401019 /nfs/dbraw/zinc/40/10/19/1033401019.db2.gz MNTBXMBAMVWNGJ-JKSUJKDBSA-N 1 0 328.343 3.835 20 5 EHBDRO Cc1cc(N2CCC[C@@H](OC(F)F)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000611931168 1033415023 /nfs/dbraw/zinc/41/50/23/1033415023.db2.gz YMZYCBVAWFYKTP-GFCCVEGCSA-N 1 0 337.326 3.659 20 5 EHBDRO O=C(N[C@@H]1CC[N@H+](CC2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000594647356 1033471811 /nfs/dbraw/zinc/47/18/11/1033471811.db2.gz VNVDJVDWXRYPJN-QGZVFWFLSA-N 1 0 345.446 3.602 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000594614735 1033477189 /nfs/dbraw/zinc/47/71/89/1033477189.db2.gz JWMLRAZKXKHOLW-GFCCVEGCSA-N 1 0 332.425 3.669 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000594977984 1033580929 /nfs/dbraw/zinc/58/09/29/1033580929.db2.gz PGAQYJMMUXDPCX-DBWMJRBXSA-N 1 0 329.444 3.605 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](COC)Cc1ccccc1 ZINC000472344372 1033598041 /nfs/dbraw/zinc/59/80/41/1033598041.db2.gz ATQQUNDXOAIEIX-HXUWFJFHSA-N 1 0 342.439 3.717 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1sc(C)nc1C ZINC000595014593 1033607522 /nfs/dbraw/zinc/60/75/22/1033607522.db2.gz BXBJYNOXIOECDC-JTQLQIEISA-N 1 0 335.429 3.570 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC2(O)CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000595001545 1033626095 /nfs/dbraw/zinc/62/60/95/1033626095.db2.gz WUQUQVLYKKKCJN-UHFFFAOYSA-N 1 0 342.386 3.748 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000595003263 1033628297 /nfs/dbraw/zinc/62/82/97/1033628297.db2.gz FKWJXWFHEUCCAW-RDTXWAMCSA-N 1 0 343.427 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnc(C(F)(F)F)nc1 ZINC000595062272 1033639029 /nfs/dbraw/zinc/63/90/29/1033639029.db2.gz VCJLVJFQJPWWFB-SNVBAGLBSA-N 1 0 340.305 3.563 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c(OC)c1 ZINC000598995130 1033647770 /nfs/dbraw/zinc/64/77/70/1033647770.db2.gz REVDBKIKLITVAB-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCCC12CCOCC2 ZINC000595037851 1033657754 /nfs/dbraw/zinc/65/77/54/1033657754.db2.gz DMSDNZPJJIAVOL-GUYCJALGSA-N 1 0 334.416 3.603 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000595102099 1033691181 /nfs/dbraw/zinc/69/11/81/1033691181.db2.gz JOBJYIRXROGIAE-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO C[C@@H](O)[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000595104749 1033691472 /nfs/dbraw/zinc/69/14/72/1033691472.db2.gz TXJDBQJMSZTFPB-SPYBWZPUSA-N 1 0 328.412 3.628 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@@H](C)O)cc1[N+](=O)[O-] ZINC000595102448 1033692198 /nfs/dbraw/zinc/69/21/98/1033692198.db2.gz IAGDEMLFJQFDGW-KSMMKXTCSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1 ZINC000595086689 1033698828 /nfs/dbraw/zinc/69/88/28/1033698828.db2.gz OFBJBPZCDDYDJV-GMBSWORKSA-N 1 0 342.443 3.699 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000599062370 1033700636 /nfs/dbraw/zinc/70/06/36/1033700636.db2.gz WMWRWZIYZQGOBA-KXBFYZLASA-N 1 0 340.423 3.647 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595092580 1033700974 /nfs/dbraw/zinc/70/09/74/1033700974.db2.gz LEBDJAFMXQIWAW-YGRLFVJLSA-N 1 0 328.359 3.935 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060972 1033701706 /nfs/dbraw/zinc/70/17/06/1033701706.db2.gz ICONOWLMTAMBHD-FZKQIMNGSA-N 1 0 330.384 3.642 20 5 EHBDRO O=[N+]([O-])c1c(NC2CC([NH+]3CCCCC3)C2)ccc2cnccc21 ZINC000599071403 1033712375 /nfs/dbraw/zinc/71/23/75/1033712375.db2.gz VIKCWMPJUWKVIH-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc3c(c2)[C@H](C[NH3+])CCC3)cc1[N+](=O)[O-] ZINC000595254966 1033723242 /nfs/dbraw/zinc/72/32/42/1033723242.db2.gz QHEKKKSHLNTRGC-HNNXBMFYSA-N 1 0 339.395 3.534 20 5 EHBDRO Cc1cc(N2CC[C@H]3CC[C@@H](C2)S3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000599134672 1033769744 /nfs/dbraw/zinc/76/97/44/1033769744.db2.gz MNQBXUHGBCKTEU-KGLIPLIRSA-N 1 0 329.425 3.926 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CC[N@@H+]2C2CCCC2)ccc2cnccc21 ZINC000599164787 1033779897 /nfs/dbraw/zinc/77/98/97/1033779897.db2.gz MQIAOQLDVRSXJF-HNNXBMFYSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595415711 1033790498 /nfs/dbraw/zinc/79/04/98/1033790498.db2.gz NGYIGOWSFDIYQK-GFCCVEGCSA-N 1 0 348.374 3.910 20 5 EHBDRO COCc1ccnc(N[C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000593698552 1033798940 /nfs/dbraw/zinc/79/89/40/1033798940.db2.gz SWDCGYPFAIFENM-RDJZCZTQSA-N 1 0 341.411 3.960 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000595491957 1033829198 /nfs/dbraw/zinc/82/91/98/1033829198.db2.gz IXZSAFYYYLFWRY-OAHLLOKOSA-N 1 0 348.374 3.992 20 5 EHBDRO C[C@@H]([NH2+][C@@H](CO)CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593718989 1033832581 /nfs/dbraw/zinc/83/25/81/1033832581.db2.gz SGMMQYCLNAVCLZ-VXGBXAGGSA-N 1 0 338.404 3.694 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cccc(C)c2C)c1 ZINC000593021848 1033839423 /nfs/dbraw/zinc/83/94/23/1033839423.db2.gz YQHQHDXLERWYRZ-CQSZACIVSA-N 1 0 342.395 3.849 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@H]1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595705742 1033955469 /nfs/dbraw/zinc/95/54/69/1033955469.db2.gz VUBJVJSDQZMPEV-KRWDZBQOSA-N 1 0 343.358 3.510 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2Cc3ccccc3[C@@H]2C)c([N+](=O)[O-])cc1F ZINC000595708565 1033955590 /nfs/dbraw/zinc/95/55/90/1033955590.db2.gz UBULHJPIBGJSBU-MEDUHNTESA-N 1 0 330.359 3.561 20 5 EHBDRO C[C@H](c1cc(F)ccc1F)N(C)CCOc1cccc([N+](=O)[O-])c1 ZINC000603855152 1033980551 /nfs/dbraw/zinc/98/05/51/1033980551.db2.gz KBBUYBQMLBOHNP-GFCCVEGCSA-N 1 0 336.338 3.945 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC(F)CC1 ZINC000595819085 1033993700 /nfs/dbraw/zinc/99/37/00/1033993700.db2.gz MEHNICQQNSHIMS-LKSINWNRSA-N 1 0 348.378 3.651 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000603868400 1033994756 /nfs/dbraw/zinc/99/47/56/1033994756.db2.gz LHPRXFQRZJDXCB-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450266852 1034013632 /nfs/dbraw/zinc/01/36/32/1034013632.db2.gz URJQVPLGJDOMNT-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CC1(C)C ZINC000595909474 1034025095 /nfs/dbraw/zinc/02/50/95/1034025095.db2.gz OLRVGBRNXHMSRK-WCQYABFASA-N 1 0 330.388 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c(Cl)c1 ZINC000595910273 1034029723 /nfs/dbraw/zinc/02/97/23/1034029723.db2.gz OEOWFIQVIOQIMU-CALCHBBNSA-N 1 0 336.819 3.641 20 5 EHBDRO C[NH2+]C[C@@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000596105244 1034065047 /nfs/dbraw/zinc/06/50/47/1034065047.db2.gz ICPLEMGWZMEIMQ-GFCCVEGCSA-N 1 0 349.818 3.738 20 5 EHBDRO C[C@@H]([NH2+]CCOCCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596093696 1034079690 /nfs/dbraw/zinc/07/96/90/1034079690.db2.gz DRXDJBUNJYDRGV-GFCCVEGCSA-N 1 0 338.404 3.960 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](COC)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000347353239 1034350261 /nfs/dbraw/zinc/35/02/61/1034350261.db2.gz OYFWCZGCFJEYFH-IEBWSBKVSA-N 1 0 328.412 3.893 20 5 EHBDRO CC[C@@H]([NH2+][C@H](COC)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000347353247 1034350421 /nfs/dbraw/zinc/35/04/21/1034350421.db2.gz OYFWCZGCFJEYFH-PKOBYXMFSA-N 1 0 328.412 3.893 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)CC1 ZINC000450487982 1034416984 /nfs/dbraw/zinc/41/69/84/1034416984.db2.gz NYNDIYYABCOHGT-AWEZNQCLSA-N 1 0 346.456 3.639 20 5 EHBDRO C[C@@H]1C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H](C)C1O ZINC000597206460 1034591577 /nfs/dbraw/zinc/59/15/77/1034591577.db2.gz RZQCLBRYFWZIPB-CHWSQXEVSA-N 1 0 346.452 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4COC[C@@H]4C3)s2)cc1 ZINC000597229664 1034611038 /nfs/dbraw/zinc/61/10/38/1034611038.db2.gz ICPRMVOVVVCWCA-GJZGRUSLSA-N 1 0 344.436 3.792 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000597225017 1034625785 /nfs/dbraw/zinc/62/57/85/1034625785.db2.gz LOTZPSJAFNQSCE-XZXOBPBMSA-N 1 0 330.428 3.889 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](Cc1ccccc1)N(C)C ZINC000534529345 1034646989 /nfs/dbraw/zinc/64/69/89/1034646989.db2.gz FJLRGMSKRCAPEL-VQIMIIECSA-N 1 0 341.455 3.727 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@H](Nc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000534530850 1034650398 /nfs/dbraw/zinc/65/03/98/1034650398.db2.gz READCXYWCOGFOB-GOSISDBHSA-N 1 0 334.379 3.742 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CNc3ccccc3C2)cc1[N+](=O)[O-] ZINC000593319496 1034658114 /nfs/dbraw/zinc/65/81/14/1034658114.db2.gz LTJVFEFTKAISQI-CZUORRHYSA-N 1 0 341.411 3.681 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-])C1CCCCC1 ZINC000411164576 1034809492 /nfs/dbraw/zinc/80/94/92/1034809492.db2.gz IAWZTSZGITVWDP-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](C[C@H]3CCOC3)C3CC3)o2)c1 ZINC000129993614 1034992211 /nfs/dbraw/zinc/99/22/11/1034992211.db2.gz WBIMACZECRSUEB-CQSZACIVSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC2(CC1)OCCc1ccsc12 ZINC000492403182 1035757974 /nfs/dbraw/zinc/75/79/74/1035757974.db2.gz UVSDLCIBFZOFCI-UHFFFAOYSA-N 1 0 344.436 3.720 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])c(C)c1OC ZINC000595499161 1035865532 /nfs/dbraw/zinc/86/55/32/1035865532.db2.gz VLHNWJGHMROROY-LBPRGKRZSA-N 1 0 348.374 3.910 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347456 1035932853 /nfs/dbraw/zinc/93/28/53/1035932853.db2.gz COJYULJOMAEZBW-HUUCEWRRSA-N 1 0 333.432 3.728 20 5 EHBDRO C[N@H+](CCc1nccs1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000180179085 1036059247 /nfs/dbraw/zinc/05/92/47/1036059247.db2.gz SNRIXSYFQGRPML-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)ccc1[N+](=O)[O-] ZINC000541389098 1036248222 /nfs/dbraw/zinc/24/82/22/1036248222.db2.gz NGVODROOSTVPPR-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO C[C@H]1C[C@@H](CO)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000589210586 1036313026 /nfs/dbraw/zinc/31/30/26/1036313026.db2.gz CGYVGCACTHSESY-KBPBESRZSA-N 1 0 346.452 3.916 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H](C)C[C@@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543616 1036421132 /nfs/dbraw/zinc/42/11/32/1036421132.db2.gz QILJPNDCGIBZQH-PJIJBLCYSA-N 1 0 346.427 3.836 20 5 EHBDRO O=[N+]([O-])c1sccc1NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000609132775 1036467466 /nfs/dbraw/zinc/46/74/66/1036467466.db2.gz QFNJWBMXHRBTTE-OAHLLOKOSA-N 1 0 331.441 3.633 20 5 EHBDRO COc1cc(C[NH2+][C@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])cc1F ZINC000464494188 1036496066 /nfs/dbraw/zinc/49/60/66/1036496066.db2.gz PAAABVPITJKJCU-QGZVFWFLSA-N 1 0 344.386 3.853 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1CCCC(F)(F)[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000414305424 1036557715 /nfs/dbraw/zinc/55/77/15/1036557715.db2.gz RTQOFKZHXBHJFL-KFWWJZLASA-N 1 0 328.359 3.574 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000170647942 1036659692 /nfs/dbraw/zinc/65/96/92/1036659692.db2.gz NOKSMWBHBKJRLS-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@](O)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000589950078 1036676524 /nfs/dbraw/zinc/67/65/24/1036676524.db2.gz UBEDLIUIXYWYDC-QEJZJMRPSA-N 1 0 346.349 3.872 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310892211 1036715626 /nfs/dbraw/zinc/71/56/26/1036715626.db2.gz KXYIFINVRKEYLD-LJQANCHMSA-N 1 0 340.427 3.622 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000414350211 1036880644 /nfs/dbraw/zinc/88/06/44/1036880644.db2.gz QGHJLRJELNHNGK-BBRMVZONSA-N 1 0 329.375 3.663 20 5 EHBDRO CCN(C)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000191290301 1036887441 /nfs/dbraw/zinc/88/74/41/1036887441.db2.gz DCNYJYNRJANPEO-AWEZNQCLSA-N 1 0 328.416 3.605 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000376448368 1036890228 /nfs/dbraw/zinc/89/02/28/1036890228.db2.gz MNAMAXKBEJQBJW-PXAZEXFGSA-N 1 0 346.456 3.734 20 5 EHBDRO Cc1ccsc1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237779041 1037026472 /nfs/dbraw/zinc/02/64/72/1037026472.db2.gz PAKDUQOZIVLSHL-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 ZINC000180639460 1037042763 /nfs/dbraw/zinc/04/27/63/1037042763.db2.gz WKGOQLKFZLDBFQ-MRXNPFEDSA-N 1 0 342.395 3.915 20 5 EHBDRO CN(C)C[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522967 1037089912 /nfs/dbraw/zinc/08/99/12/1037089912.db2.gz OCYDFFYHBAYBCI-MRXNPFEDSA-N 1 0 347.846 3.511 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000591061787 1037221791 /nfs/dbraw/zinc/22/17/91/1037221791.db2.gz IJRZIFUAFMCBLT-DOMZBBRYSA-N 1 0 342.399 3.828 20 5 EHBDRO C[C@@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443217777 1037226436 /nfs/dbraw/zinc/22/64/36/1037226436.db2.gz DOOIJPBCNHJQAK-UPJWGTAASA-N 1 0 330.388 3.502 20 5 EHBDRO Cc1ccnc(NCC[C@@H](C)[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000348350805 1037293897 /nfs/dbraw/zinc/29/38/97/1037293897.db2.gz OYMMHRXSAFRNBT-OAHLLOKOSA-N 1 0 328.416 3.621 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000541007165 1037363371 /nfs/dbraw/zinc/36/33/71/1037363371.db2.gz LSCMUDQQLLNDGI-UHFFFAOYSA-N 1 0 334.464 3.555 20 5 EHBDRO Cc1csc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000591347904 1037367791 /nfs/dbraw/zinc/36/77/91/1037367791.db2.gz YBZAMVKPGSIUPH-INIZCTEOSA-N 1 0 331.441 3.960 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCCC1 ZINC000129724177 1037426006 /nfs/dbraw/zinc/42/60/06/1037426006.db2.gz AYAIZAPNWOAWFB-LBPRGKRZSA-N 1 0 337.395 3.621 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1-c1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3C)no1 ZINC000591498938 1037449064 /nfs/dbraw/zinc/44/90/64/1037449064.db2.gz QNKKEUBHNFWILZ-AGUYFDCRSA-N 1 0 342.399 3.602 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000171128945 1037463992 /nfs/dbraw/zinc/46/39/92/1037463992.db2.gz QBOSJICQNUATGU-IBGZPJMESA-N 1 0 340.379 3.607 20 5 EHBDRO CCOC[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000188869426 1037521724 /nfs/dbraw/zinc/52/17/24/1037521724.db2.gz WQLGHYNZBCRVOB-INIZCTEOSA-N 1 0 349.456 3.869 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCCC[C@@H]1C ZINC000462925658 1037554898 /nfs/dbraw/zinc/55/48/98/1037554898.db2.gz CMUKFZHEYVCLEP-RYUDHWBXSA-N 1 0 343.374 3.871 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](C)CC1 ZINC000249836045 1037611795 /nfs/dbraw/zinc/61/17/95/1037611795.db2.gz RXSDBQYYTWVLNO-CHWSQXEVSA-N 1 0 330.388 3.828 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000031531336 1037644359 /nfs/dbraw/zinc/64/43/59/1037644359.db2.gz NUSUEVJRIDZAOE-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)N[C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000415932940 1037659186 /nfs/dbraw/zinc/65/91/86/1037659186.db2.gz NOESACTXSRXVPF-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000463034343 1037692082 /nfs/dbraw/zinc/69/20/82/1037692082.db2.gz FDAWHMYEHAFEON-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CCC(OCc2ccccc2)CC1 ZINC000051181755 1037744699 /nfs/dbraw/zinc/74/46/99/1037744699.db2.gz NHHBPCCSGIPNHQ-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341220722 1037781160 /nfs/dbraw/zinc/78/11/60/1037781160.db2.gz RCGYRZADZGPXMZ-QGZVFWFLSA-N 1 0 341.411 3.973 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000897460722 1037848968 /nfs/dbraw/zinc/84/89/68/1037848968.db2.gz VFYDQCNHPNURQJ-ZBFHGGJFSA-N 1 0 325.412 3.631 20 5 EHBDRO C[C@H](C[NH2+]Cc1cn(C)nc1C(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000897466133 1037879246 /nfs/dbraw/zinc/87/92/46/1037879246.db2.gz ORYRSEPUMKLQSD-CYBMUJFWSA-N 1 0 330.432 3.519 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000324800638 1037911157 /nfs/dbraw/zinc/91/11/57/1037911157.db2.gz QIZRXPVTUXKTEM-LJQANCHMSA-N 1 0 326.396 3.813 20 5 EHBDRO CC[C@H](CSC)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416956 1038133765 /nfs/dbraw/zinc/13/37/65/1038133765.db2.gz LTIQHKJPUSWSSO-LLVKDONJSA-N 1 0 347.278 3.931 20 5 EHBDRO CCC[N@H+](CC)C[C@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000461640658 1038545715 /nfs/dbraw/zinc/54/57/15/1038545715.db2.gz FZNUSTLGHAMEFM-LBPRGKRZSA-N 1 0 349.456 3.660 20 5 EHBDRO Cc1cc(NCc2ccccc2OCC[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC000461779958 1038605334 /nfs/dbraw/zinc/60/53/34/1038605334.db2.gz VWQSQINNQOKIII-UHFFFAOYSA-N 1 0 347.390 3.595 20 5 EHBDRO Cc1cc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461945034 1038676487 /nfs/dbraw/zinc/67/64/87/1038676487.db2.gz BODFIWQXKKHINU-NEPJUHHUSA-N 1 0 343.349 3.595 20 5 EHBDRO CC[C@H](C)[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000539313685 1038768415 /nfs/dbraw/zinc/76/84/15/1038768415.db2.gz AZQQHAMNOAPTJU-LRDDRELGSA-N 1 0 336.823 3.822 20 5 EHBDRO CC(C)(C)c1ccc(C(C)(C)[NH2+]CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000539303522 1038775435 /nfs/dbraw/zinc/77/54/35/1038775435.db2.gz DAYZUFALMSNVFM-UHFFFAOYSA-N 1 0 330.432 3.614 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)Cc1ccc(F)cc1 ZINC000041888282 1038788246 /nfs/dbraw/zinc/78/82/46/1038788246.db2.gz OOMXSHFCWBMUAQ-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO CC[NH+]1CCC(CN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000566346274 1038793662 /nfs/dbraw/zinc/79/36/62/1038793662.db2.gz SXOAIVDLYXSLEQ-OAHLLOKOSA-N 1 0 345.365 3.520 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000479863143 1038837328 /nfs/dbraw/zinc/83/73/28/1038837328.db2.gz QVIPTSWMEUZCKY-AEFFLSMTSA-N 1 0 341.455 3.727 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000479863145 1038837844 /nfs/dbraw/zinc/83/78/44/1038837844.db2.gz QVIPTSWMEUZCKY-FUHWJXTLSA-N 1 0 341.455 3.727 20 5 EHBDRO Cc1cccc2[nH]cc(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3F)c21 ZINC000479919245 1038897071 /nfs/dbraw/zinc/89/70/71/1038897071.db2.gz DNYNVQONGIVQOQ-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO CC(C)[C@H](CO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089113 1038901746 /nfs/dbraw/zinc/90/17/46/1038901746.db2.gz RNOIWMDGILABPR-PKOBYXMFSA-N 1 0 328.412 3.538 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@@H](C)C1 ZINC000246585154 1038913327 /nfs/dbraw/zinc/91/33/27/1038913327.db2.gz GHVULNVRYMBPBZ-STQMWFEESA-N 1 0 330.388 3.513 20 5 EHBDRO CCc1onc(C)c1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000927133236 1039130000 /nfs/dbraw/zinc/13/00/00/1039130000.db2.gz BBHPRSXCQBKQCQ-INIZCTEOSA-N 1 0 329.400 3.966 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCc1ccccc1F)C1CC1 ZINC000480085125 1039131853 /nfs/dbraw/zinc/13/18/53/1039131853.db2.gz CNXFXYCIBIKANL-SFHVURJKSA-N 1 0 328.387 3.887 20 5 EHBDRO COC(=O)c1csc([C@@H](C)N[C@@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000552275260 1039146792 /nfs/dbraw/zinc/14/67/92/1039146792.db2.gz PNLCMCUPRXDAGX-WDEREUQCSA-N 1 0 334.397 3.855 20 5 EHBDRO CC(C)N(CC[NH+]1CCCCCC1)Cc1csc([N+](=O)[O-])c1 ZINC000554276806 1039174218 /nfs/dbraw/zinc/17/42/18/1039174218.db2.gz FKXZVAKCLOMZNT-UHFFFAOYSA-N 1 0 325.478 3.743 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)cc1 ZINC000310088336 1039308325 /nfs/dbraw/zinc/30/83/25/1039308325.db2.gz PGYYOFYOGWMALW-QGZVFWFLSA-N 1 0 325.412 3.919 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480229738 1039312396 /nfs/dbraw/zinc/31/23/96/1039312396.db2.gz LZASLLIUCBINTP-DYVFJYSZSA-N 1 0 333.457 3.918 20 5 EHBDRO CO[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000478273250 1039339117 /nfs/dbraw/zinc/33/91/17/1039339117.db2.gz MKXCVXYVWRMZIV-MRXNPFEDSA-N 1 0 338.766 3.865 20 5 EHBDRO C[C@@H](O)[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000584634740 1039397402 /nfs/dbraw/zinc/39/74/02/1039397402.db2.gz JHDJPZBMCULTGG-PJIJBLCYSA-N 1 0 346.402 3.767 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CCO[C@@H](C4CC4)C3)s2)cc1 ZINC000485686074 1039423515 /nfs/dbraw/zinc/42/35/15/1039423515.db2.gz RNRFIWFGDWMQCK-QGZVFWFLSA-N 1 0 344.436 3.934 20 5 EHBDRO CCOc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485714336 1039456197 /nfs/dbraw/zinc/45/61/97/1039456197.db2.gz FQJZEKJCAXYRGR-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)cc1)Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000485734155 1039480247 /nfs/dbraw/zinc/48/02/47/1039480247.db2.gz BYYSSGHRQXQTIC-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO COC(=O)C(C)(C)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000512491947 1039501030 /nfs/dbraw/zinc/50/10/30/1039501030.db2.gz MXNDFSPTUMEOHA-UHFFFAOYSA-N 1 0 346.383 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3ccnc4ccccc34)c2c1 ZINC000554723054 1039648857 /nfs/dbraw/zinc/64/88/57/1039648857.db2.gz NSWDTYMLJYYDSA-UHFFFAOYSA-N 1 0 346.390 3.957 20 5 EHBDRO CCN1CCC([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000236921124 1039766815 /nfs/dbraw/zinc/76/68/15/1039766815.db2.gz XNGXQSDWGHPNBQ-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192827531 1039922641 /nfs/dbraw/zinc/92/26/41/1039922641.db2.gz PSZPQTGZAHGQFE-BFUOFWGJSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCOCC2CCC2)o1 ZINC000567533326 1040088912 /nfs/dbraw/zinc/08/89/12/1040088912.db2.gz VHZNDJRFOYOSIB-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO CC[NH+](CC)CCCCNc1ccc([N+](=O)[O-])cc1Br ZINC000486385033 1040102131 /nfs/dbraw/zinc/10/21/31/1040102131.db2.gz BALZCQXGITUJCI-UHFFFAOYSA-N 1 0 344.253 3.891 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccc(F)cc2)N(C)C)cc1[N+](=O)[O-] ZINC000480897014 1040144009 /nfs/dbraw/zinc/14/40/09/1040144009.db2.gz CZQPPFWYOCYOMZ-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO C[N@H+](CCSc1ncc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000432920518 1040180728 /nfs/dbraw/zinc/18/07/28/1040180728.db2.gz YIZYJDKOJPCYRK-UHFFFAOYSA-N 1 0 337.832 3.867 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000553582850 1040217390 /nfs/dbraw/zinc/21/73/90/1040217390.db2.gz DQHMWRIYWBDODN-NSHDSACASA-N 1 0 332.231 3.822 20 5 EHBDRO C[C@H](Cc1ccsc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584493181 1040250891 /nfs/dbraw/zinc/25/08/91/1040250891.db2.gz KIJARKQPOFAYSU-GFCCVEGCSA-N 1 0 329.425 3.901 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C[C@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481094405 1040348526 /nfs/dbraw/zinc/34/85/26/1040348526.db2.gz WSIOAFZNFFOXQO-RDBSUJKOSA-N 1 0 333.432 3.726 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)CCc1ccco1 ZINC000500060913 1040404986 /nfs/dbraw/zinc/40/49/86/1040404986.db2.gz FCHUXLKDFNTTHJ-UONOGXRCSA-N 1 0 345.399 3.516 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(CO)CC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000433061652 1040586731 /nfs/dbraw/zinc/58/67/31/1040586731.db2.gz QAQUDKFTVYZYJB-CQSZACIVSA-N 1 0 348.443 3.587 20 5 EHBDRO COc1cccc(OCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000490799470 1040747457 /nfs/dbraw/zinc/74/74/57/1040747457.db2.gz DSAUNMVYXKTBJR-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000500235204 1040780453 /nfs/dbraw/zinc/78/04/53/1040780453.db2.gz YPGLIILOOZPDPB-KRWDZBQOSA-N 1 0 346.402 3.551 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000600197036 1040813147 /nfs/dbraw/zinc/81/31/47/1040813147.db2.gz QDSCQURWABUJNA-RHSMWYFYSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001167752534 1040848882 /nfs/dbraw/zinc/84/88/82/1040848882.db2.gz VROPJDQSQSWJRH-ZDUSSCGKSA-N 1 0 346.406 3.959 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2cc(C)ccc2C[C@@H]1C ZINC000491026976 1040873125 /nfs/dbraw/zinc/87/31/25/1040873125.db2.gz AAROUCYDRVDZLY-ORAYPTAESA-N 1 0 326.396 3.935 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc1[N+](=O)[O-] ZINC000067183121 1040910433 /nfs/dbraw/zinc/91/04/33/1040910433.db2.gz HGTQKIKOAWOCOT-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@](C)(CO)Cc1ccccc1 ZINC000566713237 1041262552 /nfs/dbraw/zinc/26/25/52/1041262552.db2.gz HELRLUDLAIMHAW-JXFKEZNVSA-N 1 0 342.439 3.795 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000481713412 1041292137 /nfs/dbraw/zinc/29/21/37/1041292137.db2.gz CSBBCKXJXPSEQX-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CN(C[C@@H]1CCC3(CCCCC3)O1)CCO2 ZINC000571368348 1041295127 /nfs/dbraw/zinc/29/51/27/1041295127.db2.gz SDXVEXBQKNCHKH-KRWDZBQOSA-N 1 0 346.427 3.671 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH2+]C2CCCCC2)c2ccncc21 ZINC000025494938 1041461158 /nfs/dbraw/zinc/46/11/58/1041461158.db2.gz ULWOEASHZVWEEW-UHFFFAOYSA-N 1 0 328.416 3.867 20 5 EHBDRO Cc1ccc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000124579294 1041721971 /nfs/dbraw/zinc/72/19/71/1041721971.db2.gz YNXZDMHVBHTTJD-FQEVSTJZSA-N 1 0 340.423 3.849 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccsc1 ZINC000432328560 1042911687 /nfs/dbraw/zinc/91/16/87/1042911687.db2.gz KUTIHXSCQDXRSZ-INIZCTEOSA-N 1 0 342.424 3.919 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1COc3ccc(F)cc3C1)CCC2 ZINC000343962668 1042958155 /nfs/dbraw/zinc/95/81/55/1042958155.db2.gz AXWQDNHAXKVHCU-YJBOKZPZSA-N 1 0 342.370 3.705 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2cccnc2)C1 ZINC000569481325 1043005516 /nfs/dbraw/zinc/00/55/16/1043005516.db2.gz CWDUFETWSRFAOS-MRXNPFEDSA-N 1 0 341.411 3.767 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029808 1043220511 /nfs/dbraw/zinc/22/05/11/1043220511.db2.gz IHPPRCYEJUXYNH-JKSUJKDBSA-N 1 0 330.384 3.542 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2ccc(F)cc21 ZINC000344103136 1043254535 /nfs/dbraw/zinc/25/45/35/1043254535.db2.gz NYAHVOVPXYVYRX-KRWDZBQOSA-N 1 0 330.359 3.910 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132139 1043400913 /nfs/dbraw/zinc/40/09/13/1043400913.db2.gz RCKHGSWUZVNISL-HOTGVXAUSA-N 1 0 332.425 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@H]3Cc3ccccc3)nc2c1 ZINC000344698888 1044302115 /nfs/dbraw/zinc/30/21/15/1044302115.db2.gz IWGBGDOFWMHQHL-HNNXBMFYSA-N 1 0 336.395 3.678 20 5 EHBDRO Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC001658277488 1126261911 /nfs/dbraw/zinc/26/19/11/1126261911.db2.gz VJBRVAQFBYPHPR-QGZVFWFLSA-N 1 0 348.830 3.558 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CCO)CCCC3)o2)cc1 ZINC000072925947 1126933584 /nfs/dbraw/zinc/93/35/84/1126933584.db2.gz HGUMPQQRQHPEMY-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(c2ccccn2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090918696 1127125517 /nfs/dbraw/zinc/12/55/17/1127125517.db2.gz VPFRYAARLUZHMG-SFHVURJKSA-N 1 0 340.427 3.700 20 5 EHBDRO C[C@H]1CCC[C@@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000765308094 1127596516 /nfs/dbraw/zinc/59/65/16/1127596516.db2.gz VNARXYYIPISGNU-JKSUJKDBSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+]([C@H](C)c2ccccc2)CC1 ZINC000301318628 1127734586 /nfs/dbraw/zinc/73/45/86/1127734586.db2.gz PXWQHUKIAAHQGR-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@@H](CS(C)(=O)=O)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000172122017 1127771219 /nfs/dbraw/zinc/77/12/19/1127771219.db2.gz XNVXJPSFEAJCDO-AWEZNQCLSA-N 1 0 327.449 3.516 20 5 EHBDRO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553337307 1128411775 /nfs/dbraw/zinc/41/17/75/1128411775.db2.gz FJPYNSXREXBRDB-WCQYABFASA-N 1 0 343.349 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1 ZINC000326686162 1128430107 /nfs/dbraw/zinc/43/01/07/1128430107.db2.gz IUXMHICALQSZCN-IPMKNSEASA-N 1 0 332.444 3.543 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCC1 ZINC000273038038 1128435255 /nfs/dbraw/zinc/43/52/55/1128435255.db2.gz HSLHMRFOACECBI-LBPRGKRZSA-N 1 0 326.824 3.527 20 5 EHBDRO C[C@@H]1C[C@@H](CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000273187572 1128448235 /nfs/dbraw/zinc/44/82/35/1128448235.db2.gz GBBUOSBGWPYMFG-RVKKMQEKSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1cc(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301464536 1128457644 /nfs/dbraw/zinc/45/76/44/1128457644.db2.gz GRCKRABRBRMXNI-MRXNPFEDSA-N 1 0 349.818 3.972 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000301477347 1128467552 /nfs/dbraw/zinc/46/75/52/1128467552.db2.gz PFICKRBIHJXWEU-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428832 1128486286 /nfs/dbraw/zinc/48/62/86/1128486286.db2.gz OSHFTHORABYXHH-GDBMZVCRSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1ccnc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000301545490 1128495400 /nfs/dbraw/zinc/49/54/00/1128495400.db2.gz OSLFSWVMLAQOJF-WBVHZDCISA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1cnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c([N+](=O)[O-])c1 ZINC000301602406 1128518671 /nfs/dbraw/zinc/51/86/71/1128518671.db2.gz WHTMXMGDPLJALI-NVXWUHKLSA-N 1 0 340.427 3.621 20 5 EHBDRO CCCCCC(=O)NC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000273419895 1128525405 /nfs/dbraw/zinc/52/54/05/1128525405.db2.gz JFDUUUUMQNPOJT-UHFFFAOYSA-N 1 0 347.459 3.564 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000765849920 1128581612 /nfs/dbraw/zinc/58/16/12/1128581612.db2.gz UZBWDFUPODEAFB-YZGWKJHDSA-N 1 0 340.423 3.629 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(O)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765879844 1128637249 /nfs/dbraw/zinc/63/72/49/1128637249.db2.gz UJNOGAAQOBSQHQ-YWZLYKJASA-N 1 0 340.423 3.778 20 5 EHBDRO C[C@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000172619119 1128736510 /nfs/dbraw/zinc/73/65/10/1128736510.db2.gz JHKLFYKYDKZEEI-DOTOQJQBSA-N 1 0 347.462 3.943 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@@H]3COCC[C@H]3C2)cc1 ZINC000921781168 1128756411 /nfs/dbraw/zinc/75/64/11/1128756411.db2.gz XIGZRTQREOANFF-RCCFBDPRSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOCC(F)F)s2)cc1 ZINC000190889576 1120652920 /nfs/dbraw/zinc/65/29/20/1120652920.db2.gz WJOJFJFQWWLMNH-UHFFFAOYSA-N 1 0 342.367 3.695 20 5 EHBDRO COc1cc(C[NH2+]CC=C(C)C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000191630536 1120682692 /nfs/dbraw/zinc/68/26/92/1120682692.db2.gz GXNXTXAMSYJXHU-UHFFFAOYSA-N 1 0 348.321 3.600 20 5 EHBDRO C[C@H]1CCC[N@H+](CCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000303044237 1121118625 /nfs/dbraw/zinc/11/86/25/1121118625.db2.gz WWLMIWJDMPZCER-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cn1cc(-c2cccc([N+](=O)[O-])c2)cn1 ZINC000762145108 1121125522 /nfs/dbraw/zinc/12/55/22/1121125522.db2.gz SYHRRDHGJLWWOI-CQSZACIVSA-N 1 0 326.400 3.680 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000193454852 1121318460 /nfs/dbraw/zinc/31/84/60/1121318460.db2.gz VIVDZQFUMHBLJW-YVEFUNNKSA-N 1 0 346.456 3.734 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000194059415 1121764619 /nfs/dbraw/zinc/76/46/19/1121764619.db2.gz VYBNMYCDHLEGAO-HUUCEWRRSA-N 1 0 347.459 3.815 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000311667872 1129033839 /nfs/dbraw/zinc/03/38/39/1129033839.db2.gz XXRDLFGDAXRQLS-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C3CCCC3)C2)c2ccncc21 ZINC000301172535 1122242191 /nfs/dbraw/zinc/24/21/91/1122242191.db2.gz FBVFNPCQFCRFIX-ZDUSSCGKSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC001168521056 1122346236 /nfs/dbraw/zinc/34/62/36/1122346236.db2.gz YGHAYXAGCBQWPI-HNNXBMFYSA-N 1 0 333.432 3.872 20 5 EHBDRO C[N@@H+](Cc1cc2ccccc2o1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394433 1122596130 /nfs/dbraw/zinc/59/61/30/1122596130.db2.gz LYNXKZWHWHWQPB-QGZVFWFLSA-N 1 0 326.352 3.506 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000556130203 1122832382 /nfs/dbraw/zinc/83/23/82/1122832382.db2.gz KDCIWZQDGQJNCM-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO C[C@@H](CNc1cccc(F)c1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000919963680 1123248586 /nfs/dbraw/zinc/24/85/86/1123248586.db2.gz SLQLWQXCSMGWPT-ZDUSSCGKSA-N 1 0 329.375 3.593 20 5 EHBDRO CC[NH+](CC)Cc1ccc(-c2nc(-c3cccc([N+](=O)[O-])c3)no2)o1 ZINC000609604222 1123621570 /nfs/dbraw/zinc/62/15/70/1123621570.db2.gz AMWWYRKCRKIXHM-UHFFFAOYSA-N 1 0 342.355 3.747 20 5 EHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001843 1123710689 /nfs/dbraw/zinc/71/06/89/1123710689.db2.gz DSIHTARBBOQNJP-DYVFJYSZSA-N 1 0 334.416 3.862 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+][C@@H](C)CCO)cc2[N+](=O)[O-])cc1 ZINC000237573724 1123774040 /nfs/dbraw/zinc/77/40/40/1123774040.db2.gz HQDGSBNJDKQVTF-AWEZNQCLSA-N 1 0 346.452 3.915 20 5 EHBDRO CC(C)[C@@H](O)C(C)(C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090809970 1123790722 /nfs/dbraw/zinc/79/07/22/1123790722.db2.gz AULIWBRBFQQTJP-FUHWJXTLSA-N 1 0 334.460 3.549 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]CC(C)(C)O)cc2[N+](=O)[O-])cc1 ZINC000237775756 1123852457 /nfs/dbraw/zinc/85/24/57/1123852457.db2.gz AQUOICITMXPUBV-UHFFFAOYSA-N 1 0 346.452 3.915 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000615835146 1123884425 /nfs/dbraw/zinc/88/44/25/1123884425.db2.gz UDPFCAFSVYEZMW-NTEUORMPSA-N 1 0 348.406 3.974 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([C@@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047985 1129158705 /nfs/dbraw/zinc/15/87/05/1129158705.db2.gz LHFGRVBYLMKKKU-HUUCEWRRSA-N 1 0 341.411 3.704 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000078635514 1129174814 /nfs/dbraw/zinc/17/48/14/1129174814.db2.gz UCIKRUAMTYNVDT-INIZCTEOSA-N 1 0 330.384 3.853 20 5 EHBDRO CC[NH+](CC)[C@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000617727991 1124754054 /nfs/dbraw/zinc/75/40/54/1124754054.db2.gz QOEGEVASXWYMSV-QAPCUYQASA-N 1 0 349.475 3.571 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000272826467 1124945892 /nfs/dbraw/zinc/94/58/92/1124945892.db2.gz QGXCNTPQQQIVLW-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO Cc1cc(N[C@H]2CCOC3(CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272833450 1125046445 /nfs/dbraw/zinc/04/64/45/1125046445.db2.gz LJNCEBOJEVDPCP-ZDUSSCGKSA-N 1 0 327.384 3.965 20 5 EHBDRO CN1Cc2ccccc2[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000618572321 1125114627 /nfs/dbraw/zinc/11/46/27/1125114627.db2.gz TVPRCJXFFRPEMN-WOJBJXKFSA-N 1 0 337.423 3.749 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@H]2C[NH+]2CCCCC2)c1 ZINC000735492043 1131352876 /nfs/dbraw/zinc/35/28/76/1131352876.db2.gz NDIXVPPIUNDTJW-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1ccnc(NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000301261029 1125424558 /nfs/dbraw/zinc/42/45/58/1125424558.db2.gz BKHHYVPMWGGMDW-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C(F)(F)F ZINC000369968321 1129225224 /nfs/dbraw/zinc/22/52/24/1129225224.db2.gz YUEBOHNZJPHRLF-RYUDHWBXSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[N@H+](C)C1CC1 ZINC000301883780 1129265538 /nfs/dbraw/zinc/26/55/38/1129265538.db2.gz YGTOFLGYYAISGN-ZDUSSCGKSA-N 1 0 326.400 3.551 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027065 1129376413 /nfs/dbraw/zinc/37/64/13/1129376413.db2.gz YSYQPZBNUGZPQI-STQMWFEESA-N 1 0 330.388 3.655 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCO[C@@H]1CCCCO1 ZINC000922232197 1129383170 /nfs/dbraw/zinc/38/31/70/1129383170.db2.gz KLNAEDLTTPYUSR-WTQUMQLASA-N 1 0 334.416 3.521 20 5 EHBDRO CSc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+](C)C)cc1 ZINC000338837400 1129413426 /nfs/dbraw/zinc/41/34/26/1129413426.db2.gz OAINQKPXRPZTKB-MRXNPFEDSA-N 1 0 346.456 3.735 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000117343321 1129435059 /nfs/dbraw/zinc/43/50/59/1129435059.db2.gz MXDCOVBUOBUQGU-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@]2(C)CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543400013 1129460490 /nfs/dbraw/zinc/46/04/90/1129460490.db2.gz SPSZYAYTNANOBL-RTBURBONSA-N 1 0 344.411 3.998 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000389875895 1129593433 /nfs/dbraw/zinc/59/34/33/1129593433.db2.gz UEJMUDWLKJFOQG-GQIGUUNPSA-N 1 0 339.439 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000429033019 1129714448 /nfs/dbraw/zinc/71/44/48/1129714448.db2.gz YZWPIRXXCCQZSJ-QBWPOKONSA-N 1 0 331.460 3.626 20 5 EHBDRO Cc1cc(N2CCOC3(CCCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302185457 1129771750 /nfs/dbraw/zinc/77/17/50/1129771750.db2.gz PEDVQQOFYSNSKW-UHFFFAOYSA-N 1 0 341.411 3.991 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N2CC[C@H](C[NH+]3CCCC3)C2)c(Cl)c1 ZINC000302320065 1129776096 /nfs/dbraw/zinc/77/60/96/1129776096.db2.gz WFNMFKFIAFGOPY-LLVKDONJSA-N 1 0 344.242 3.824 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1F ZINC000056197010 1129806035 /nfs/dbraw/zinc/80/60/35/1129806035.db2.gz VMWPOULIDSQJPY-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2nc3ccccc3n2C(F)F)cc1 ZINC000347805632 1129833289 /nfs/dbraw/zinc/83/32/89/1129833289.db2.gz BLKOJXHGDMDVJN-UHFFFAOYSA-N 1 0 346.337 3.672 20 5 EHBDRO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475452 1129847837 /nfs/dbraw/zinc/84/78/37/1129847837.db2.gz RQXQHRXJYXVBLE-KFWWJZLASA-N 1 0 342.443 3.921 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H](O)c3ccc(F)cc3)CC2)cc1 ZINC000303989037 1129875186 /nfs/dbraw/zinc/87/51/86/1129875186.db2.gz KHHYBARTZFCMAB-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000282494894 1129947032 /nfs/dbraw/zinc/94/70/32/1129947032.db2.gz HWOHIMOPSQPMGF-RDTXWAMCSA-N 1 0 348.443 3.993 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)Cc2cccc(Cl)c2)cc1 ZINC000134289872 1129989939 /nfs/dbraw/zinc/98/99/39/1129989939.db2.gz OYIQWMNWWBEPMR-UHFFFAOYSA-N 1 0 334.803 3.633 20 5 EHBDRO CCCC(=O)NC[C@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538853 1130233235 /nfs/dbraw/zinc/23/32/35/1130233235.db2.gz ZFPVKUUNPBDOFW-HZPDHXFCSA-N 1 0 347.459 3.593 20 5 EHBDRO CC[C@H](C)[C@@H](O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000245976140 1130335563 /nfs/dbraw/zinc/33/55/63/1130335563.db2.gz OSXQVIVIVROWSG-ZOCIIQOWSA-N 1 0 328.412 3.681 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000246583670 1130393372 /nfs/dbraw/zinc/39/33/72/1130393372.db2.gz YUFQCASTCFSPRM-DOXZYTNZSA-N 1 0 328.412 3.546 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2cc3ccccc3o2)cc1[N+](=O)[O-] ZINC000175188054 1130411789 /nfs/dbraw/zinc/41/17/89/1130411789.db2.gz QJCFHAQFKLBEIC-UHFFFAOYSA-N 1 0 326.352 3.982 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000733302483 1131019216 /nfs/dbraw/zinc/01/92/16/1131019216.db2.gz XHQQQXLEQLNRGO-LBPRGKRZSA-N 1 0 334.445 3.881 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738241925 1131465835 /nfs/dbraw/zinc/46/58/35/1131465835.db2.gz VASOVEKMWDWZRQ-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000740881781 1131553045 /nfs/dbraw/zinc/55/30/45/1131553045.db2.gz CWSQXBYFLXWXKI-USXIJHARSA-N 1 0 336.407 3.759 20 5 EHBDRO COc1ccccc1C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899313 1131882464 /nfs/dbraw/zinc/88/24/64/1131882464.db2.gz WJQCPHKTMULORU-KRWDZBQOSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc3ocnc3c1)CC2 ZINC001172904036 1131885991 /nfs/dbraw/zinc/88/59/91/1131885991.db2.gz VKDHAUBCDVJUJP-MRXNPFEDSA-N 1 0 337.379 3.773 20 5 EHBDRO COC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172903407 1131886519 /nfs/dbraw/zinc/88/65/19/1131886519.db2.gz QYEPVTNXSTVULY-QUCCMNQESA-N 1 0 340.423 3.820 20 5 EHBDRO COc1ccc(F)c(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172905587 1131887750 /nfs/dbraw/zinc/88/77/50/1131887750.db2.gz SFZKKBUWQKNZPL-INIZCTEOSA-N 1 0 344.386 3.780 20 5 EHBDRO CCCOC1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172914295 1131902435 /nfs/dbraw/zinc/90/24/35/1131902435.db2.gz GMPJZBYCOHKLJG-QGZVFWFLSA-N 1 0 332.444 3.733 20 5 EHBDRO COC(C)(C)[C@@H]1CCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916390 1131903935 /nfs/dbraw/zinc/90/39/35/1131903935.db2.gz RLUIHQJUOXOBOH-WMZOPIPTSA-N 1 0 332.444 3.732 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000743386509 1131907873 /nfs/dbraw/zinc/90/78/73/1131907873.db2.gz IXPAVGQUQFQKJR-SFHVURJKSA-N 1 0 328.416 3.928 20 5 EHBDRO CCC[C@@]1(C)CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000743404698 1131917166 /nfs/dbraw/zinc/91/71/66/1131917166.db2.gz BQKOOTGWSMCVFX-SFHVURJKSA-N 1 0 343.431 3.713 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)NC(=[NH2+])c2cccc(C)c2)c1F ZINC001173194063 1131995734 /nfs/dbraw/zinc/99/57/34/1131995734.db2.gz XPOXWFXJDMPQSV-LBPRGKRZSA-N 1 0 345.374 3.597 20 5 EHBDRO COC(=O)c1cccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173216540 1132001917 /nfs/dbraw/zinc/00/19/17/1132001917.db2.gz CPKYOPAXZRMSSS-ZIAGYGMSSA-N 1 0 342.395 3.663 20 5 EHBDRO CSc1ccccc1OCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216498 1132002176 /nfs/dbraw/zinc/00/21/76/1132002176.db2.gz BXVUXTBGEHDSHO-CQSZACIVSA-N 1 0 346.452 3.916 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173219530 1132002887 /nfs/dbraw/zinc/00/28/87/1132002887.db2.gz CVYGZYRDUFNAMA-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220206 1132004448 /nfs/dbraw/zinc/00/44/48/1132004448.db2.gz VWKUCHHAZYCAJV-GJZGRUSLSA-N 1 0 328.412 3.842 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1ccncc1 ZINC001173225596 1132006259 /nfs/dbraw/zinc/00/62/59/1132006259.db2.gz SNXMLURZRNGXMS-HNNXBMFYSA-N 1 0 327.428 3.779 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1cccnc1 ZINC001173225585 1132006928 /nfs/dbraw/zinc/00/69/28/1132006928.db2.gz SETQQEVEXOPXMU-OAHLLOKOSA-N 1 0 327.428 3.779 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccccn2)CC1 ZINC001173226100 1132007225 /nfs/dbraw/zinc/00/72/25/1132007225.db2.gz HQCBXPXDEFQIJD-HNNXBMFYSA-N 1 0 325.412 3.800 20 5 EHBDRO Cc1ccccc1OCCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173214547 1132015239 /nfs/dbraw/zinc/01/52/39/1132015239.db2.gz OUWNQUMHGKIMHM-MRXNPFEDSA-N 1 0 328.412 3.893 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC001173214530 1132015290 /nfs/dbraw/zinc/01/52/90/1132015290.db2.gz OOUUPCLYLYWSIO-SJKOYZFVSA-N 1 0 330.359 3.778 20 5 EHBDRO Nc1cc2nc3ccccc3nc2cc1Nc1ccc2[nH+]ccn2c1 ZINC001174279334 1132295779 /nfs/dbraw/zinc/29/57/79/1132295779.db2.gz TZMZQYZPBMWTSL-UHFFFAOYSA-N 1 0 326.363 3.757 20 5 EHBDRO Cc1ncn(-c2ccc(C(C)(C)C)cc2[N+](=O)[O-])c1CSCC[NH3+] ZINC001168790699 1132539305 /nfs/dbraw/zinc/53/93/05/1132539305.db2.gz SMVDDBDZKWDBBQ-UHFFFAOYSA-N 1 0 348.472 3.578 20 5 EHBDRO COC(=O)[C@H]1CCCC[C@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860263 1132582949 /nfs/dbraw/zinc/58/29/49/1132582949.db2.gz VYKFJNJSGUQUPC-YJBOKZPZSA-N 1 0 346.427 3.539 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)C1 ZINC001168978201 1132618067 /nfs/dbraw/zinc/61/80/67/1132618067.db2.gz PTRAKQDYFAKPFR-DZGCQCFKSA-N 1 0 330.350 3.673 20 5 EHBDRO CC(C)(C)OC(=O)Nc1cccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)c1 ZINC001168961178 1132620384 /nfs/dbraw/zinc/62/03/84/1132620384.db2.gz HPEKCSNGWSTCTF-CABCVRRESA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@@H]2CCc3ccc(C(F)(F)F)cc32)C1 ZINC001168997597 1132627140 /nfs/dbraw/zinc/62/71/40/1132627140.db2.gz DVMIGJLCBANAIO-VZJVUDMVSA-N 1 0 328.334 3.728 20 5 EHBDRO CCCCCCOC(=O)CCCCC[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168987915 1132634883 /nfs/dbraw/zinc/63/48/83/1132634883.db2.gz LHDLSBGFXBEAND-IAGOWNOFSA-N 1 0 342.480 3.705 20 5 EHBDRO CCCCCCOC(=O)CCCCC[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168987917 1132634969 /nfs/dbraw/zinc/63/49/69/1132634969.db2.gz LHDLSBGFXBEAND-SJORKVTESA-N 1 0 342.480 3.705 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(c3noc4ccc(F)cc43)CC2)C1 ZINC001169038585 1132637838 /nfs/dbraw/zinc/63/78/38/1132637838.db2.gz ZTJHJHFURARBRN-DOMZBBRYSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040029 1132638139 /nfs/dbraw/zinc/63/81/39/1132638139.db2.gz XCAHBRMZIXAPMC-YPMHNXCESA-N 1 0 328.334 3.509 20 5 EHBDRO CC[C@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC001169090076 1132660169 /nfs/dbraw/zinc/66/01/69/1132660169.db2.gz DYUSBGWJUHRQQB-KRWDZBQOSA-N 1 0 345.468 3.753 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC001175898880 1132792271 /nfs/dbraw/zinc/79/22/71/1132792271.db2.gz XKYRTBQGIKZHGW-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H]1CCc2ccccc2[C@@H]1O ZINC001169619503 1132807384 /nfs/dbraw/zinc/80/73/84/1132807384.db2.gz ISTZFBUCEKRVAL-RTWAWAEBSA-N 1 0 325.476 3.743 20 5 EHBDRO CO[C@@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001169666275 1132813792 /nfs/dbraw/zinc/81/37/92/1132813792.db2.gz JMEVLRAYYSLEQZ-SFHVURJKSA-N 1 0 332.375 3.596 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804360385 1133064154 /nfs/dbraw/zinc/06/41/54/1133064154.db2.gz ILFAGDHELHBPAL-UHFFFAOYSA-N 1 0 325.840 3.805 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)COc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC001177463525 1133064894 /nfs/dbraw/zinc/06/48/94/1133064894.db2.gz BJORVFPWXUMRDR-OAHLLOKOSA-N 1 0 344.411 3.777 20 5 EHBDRO C[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC001178386535 1133161678 /nfs/dbraw/zinc/16/16/78/1133161678.db2.gz BUNLLEYCIZJKPH-QFBILLFUSA-N 1 0 339.439 3.562 20 5 EHBDRO Cc1nn(CN2CC=C(c3cc(C)cc(C)c3)CC2)c(C)c1[N+](=O)[O-] ZINC000769654088 1133325874 /nfs/dbraw/zinc/32/58/74/1133325874.db2.gz KXTVUDMBQNRTBM-UHFFFAOYSA-N 1 0 340.427 3.772 20 5 EHBDRO CC(C)C[C@@H](CN1CCCC1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001181933748 1133553188 /nfs/dbraw/zinc/55/31/88/1133553188.db2.gz OOJPQZMXJGFWEZ-HNNXBMFYSA-N 1 0 339.867 3.848 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1c(Cl)cc([N+](=O)[O-])cc1Cl)CC2 ZINC000772140665 1133647460 /nfs/dbraw/zinc/64/74/60/1133647460.db2.gz COZPUAMCDLHADP-UHFFFAOYSA-N 1 0 344.242 3.966 20 5 EHBDRO O=C(Nc1cc2cccnc2c2ncccc12)[C@@H]1CCC[N@@H+]1CC1CC1 ZINC001182558715 1133697007 /nfs/dbraw/zinc/69/70/07/1133697007.db2.gz ZGHBIIOTNMGEQY-SFHVURJKSA-N 1 0 346.434 3.596 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc(Cl)nc1 ZINC000786817199 1133910508 /nfs/dbraw/zinc/91/05/08/1133910508.db2.gz SOURXLRRBDYATQ-LCYFTJDESA-N 1 0 331.803 3.879 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000786813969 1133910572 /nfs/dbraw/zinc/91/05/72/1133910572.db2.gz NZRODZZDFJBHFY-KAMYIIQDSA-N 1 0 341.367 3.739 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1COC2(CCCCC2)O1 ZINC000786821905 1133911557 /nfs/dbraw/zinc/91/15/57/1133911557.db2.gz WIFPPDWACRINMY-BXBOZWQASA-N 1 0 346.427 3.664 20 5 EHBDRO O=C(O[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120055 1134081026 /nfs/dbraw/zinc/08/10/26/1134081026.db2.gz PQAPPXSIVUFZQG-TZMCWYRMSA-N 1 0 346.408 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000774879028 1134096572 /nfs/dbraw/zinc/09/65/72/1134096572.db2.gz GMVYUTLREGWSMK-ZDUSSCGKSA-N 1 0 345.330 3.632 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886600 1134099966 /nfs/dbraw/zinc/09/99/66/1134099966.db2.gz WGAZCGAXJHFDSH-CJNGLKHVSA-N 1 0 341.367 3.881 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2(C[NH+]3CCOCC3)CCCCC2)c1 ZINC001185676497 1134123861 /nfs/dbraw/zinc/12/38/61/1134123861.db2.gz CZZMTQFLTLBHHR-UHFFFAOYSA-N 1 0 347.459 3.598 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000788481271 1134130024 /nfs/dbraw/zinc/13/00/24/1134130024.db2.gz HFPCAGTVIXUVBJ-KRWDZBQOSA-N 1 0 343.402 3.835 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C12CCCC2 ZINC000788608989 1134145473 /nfs/dbraw/zinc/14/54/73/1134145473.db2.gz HMUQSLISTCORTG-OAUYIBNBSA-N 1 0 333.432 3.565 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000788580009 1134147399 /nfs/dbraw/zinc/14/73/99/1134147399.db2.gz JXUHDLQPDZAWPL-ZWKOTPCHSA-N 1 0 344.386 3.780 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H]2CSCCS2)c2cc([N+](=O)[O-])ccc21 ZINC000788584567 1134147852 /nfs/dbraw/zinc/14/78/52/1134147852.db2.gz KGSRLCOBPLUXDX-IUODEOHRSA-N 1 0 338.498 3.755 20 5 EHBDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774982217 1134176903 /nfs/dbraw/zinc/17/69/03/1134176903.db2.gz RASXMRULHYRVOE-RDTXWAMCSA-N 1 0 344.411 3.766 20 5 EHBDRO CC1(C)CCC[N@H+](CCNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC001186267469 1134190702 /nfs/dbraw/zinc/19/07/02/1134190702.db2.gz RFMZYEGXRXLPAQ-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH+]2CCC(F)(c3ccccc3)CC2)c1 ZINC000789308828 1134251923 /nfs/dbraw/zinc/25/19/23/1134251923.db2.gz HCGHOKCMMLEIFI-SFHVURJKSA-N 1 0 344.386 3.589 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)c2ccccc21 ZINC001186873537 1134264583 /nfs/dbraw/zinc/26/45/83/1134264583.db2.gz YFNDBCKTUNACBK-JKSUJKDBSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H](CO)CC3CCCC3)o2)c1 ZINC000509455859 1134601155 /nfs/dbraw/zinc/60/11/55/1134601155.db2.gz RBBADIBXYMGSNH-INIZCTEOSA-N 1 0 344.411 3.886 20 5 EHBDRO CCOC(=O)C1(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CCCC1 ZINC000792195483 1134666680 /nfs/dbraw/zinc/66/66/80/1134666680.db2.gz MXXVGDUBMUZKHM-OAHLLOKOSA-N 1 0 348.443 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[N@H+](CC3CCCCC3)CC2)c(F)c1 ZINC001190456577 1134703949 /nfs/dbraw/zinc/70/39/49/1134703949.db2.gz BGRLFOXHDKTYLQ-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO C[NH+]1CC(CNc2cnc3c4ccccc4c4ccccc4c3n2)C1 ZINC001170252129 1134732212 /nfs/dbraw/zinc/73/22/12/1134732212.db2.gz LBGKUPYXQRYJRD-UHFFFAOYSA-N 1 0 328.419 3.910 20 5 EHBDRO C[NH+]1CC(CNc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC001170254085 1134733112 /nfs/dbraw/zinc/73/31/12/1134733112.db2.gz HVHJIZXVMHJBIO-UHFFFAOYSA-N 1 0 329.425 3.720 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2csc(C)n2)c([N+](=O)[O-])c1 ZINC001170297709 1134737447 /nfs/dbraw/zinc/73/74/47/1134737447.db2.gz QTRVMDWFRWDREV-MNOVXSKESA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170298360 1134737967 /nfs/dbraw/zinc/73/79/67/1134737967.db2.gz JWILDUUQYKUEKD-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(F)cc2F)c([N+](=O)[O-])c1 ZINC001170299286 1134738169 /nfs/dbraw/zinc/73/81/69/1134738169.db2.gz UVLGQGZFZLNONE-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3cc(F)ccc32)c([N+](=O)[O-])c1 ZINC001170312733 1134744506 /nfs/dbraw/zinc/74/45/06/1134744506.db2.gz HKYMTPVXIKXUGN-SGTLLEGYSA-N 1 0 344.386 3.951 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC001170317305 1134746868 /nfs/dbraw/zinc/74/68/68/1134746868.db2.gz FDJIFDRAWSXGLZ-KSSFIOAISA-N 1 0 344.411 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2Cc3cccc(C)c3C2)c([N+](=O)[O-])c1 ZINC001170328696 1134749354 /nfs/dbraw/zinc/74/93/54/1134749354.db2.gz LMKCUEZSAQWWST-AWEZNQCLSA-N 1 0 326.396 3.859 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCc3cccnc32)c([N+](=O)[O-])c1 ZINC001170306557 1134752217 /nfs/dbraw/zinc/75/22/17/1134752217.db2.gz XLUXCPQRLRANMU-DYVFJYSZSA-N 1 0 341.411 3.597 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1cccnc1 ZINC001170306520 1134752242 /nfs/dbraw/zinc/75/22/42/1134752242.db2.gz WWEJNFIQUJRWFR-CXAGYDPISA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170306573 1134752360 /nfs/dbraw/zinc/75/23/60/1134752360.db2.gz XRQKWBSCTSNVDU-RDTXWAMCSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CCc3ccccc3CC2)c([N+](=O)[O-])c1 ZINC001170345252 1134759051 /nfs/dbraw/zinc/75/90/51/1134759051.db2.gz IZWWJDHOEVLARX-OAHLLOKOSA-N 1 0 340.423 3.635 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCc2ccccc21 ZINC000792869808 1134803795 /nfs/dbraw/zinc/80/37/95/1134803795.db2.gz DSBJYJYMHKJTCJ-GOSISDBHSA-N 1 0 341.367 3.844 20 5 EHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191443601 1134867791 /nfs/dbraw/zinc/86/77/91/1134867791.db2.gz CQSRDUZQAXIRIM-KXBFYZLASA-N 1 0 326.396 3.852 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000793238146 1134885774 /nfs/dbraw/zinc/88/57/74/1134885774.db2.gz OAQYAIVUXXLFTE-HKUYNNGSSA-N 1 0 328.412 3.895 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@H]2CCC(C)C)c([N+](=O)[O-])c1 ZINC001192157619 1134972102 /nfs/dbraw/zinc/97/21/02/1134972102.db2.gz HSPPPPCLWWYKRV-OAHLLOKOSA-N 1 0 336.432 3.883 20 5 EHBDRO Nc1ccc(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000804386698 1135052034 /nfs/dbraw/zinc/05/20/34/1135052034.db2.gz HFXUPWYHSHQWTH-MRXNPFEDSA-N 1 0 340.427 3.501 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC001192814494 1135058019 /nfs/dbraw/zinc/05/80/19/1135058019.db2.gz NDICGORWGKJWJV-OAHLLOKOSA-N 1 0 345.355 3.753 20 5 EHBDRO Cc1ccc(N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504171 1135093530 /nfs/dbraw/zinc/09/35/30/1135093530.db2.gz NMBHZFQLZVWSGQ-WDEREUQCSA-N 1 0 342.237 3.560 20 5 EHBDRO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ccc(N)cc1[N+](=O)[O-] ZINC000804620747 1135143821 /nfs/dbraw/zinc/14/38/21/1135143821.db2.gz UJYWJDXANQMESV-GOSISDBHSA-N 1 0 342.443 3.746 20 5 EHBDRO Cc1cc(C)c2c(c1)C[N@@H+](CCOc1ccc([N+](=O)[O-])cc1)CC2 ZINC001193526056 1135152366 /nfs/dbraw/zinc/15/23/66/1135152366.db2.gz HEKVSHSSYYVLSG-UHFFFAOYSA-N 1 0 326.396 3.649 20 5 EHBDRO CCC1(CC)[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1OC ZINC001194091441 1135231363 /nfs/dbraw/zinc/23/13/63/1135231363.db2.gz MOPADTJBXWQUQK-GJZGRUSLSA-N 1 0 326.824 3.932 20 5 EHBDRO CC(C)(C)OC(=O)CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001194477857 1135276963 /nfs/dbraw/zinc/27/69/63/1135276963.db2.gz RNVGJJPAIJFRMW-OAHLLOKOSA-N 1 0 334.416 3.506 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001195179241 1135378818 /nfs/dbraw/zinc/37/88/18/1135378818.db2.gz MYGITJPJDWZFNP-LXTVHRRPSA-N 1 0 333.432 3.726 20 5 EHBDRO Cc1c(C[N@@H+]2C[C@@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250331 1135399363 /nfs/dbraw/zinc/39/93/63/1135399363.db2.gz MBUCTEKVNBDKTA-BBRMVZONSA-N 1 0 348.443 3.703 20 5 EHBDRO Cc1c(C[N@H+]2CC[C@@H](C)[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495922 1135434113 /nfs/dbraw/zinc/43/41/13/1135434113.db2.gz AZTAXIBMQFYEQG-CZUORRHYSA-N 1 0 348.443 3.703 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001195756180 1135461251 /nfs/dbraw/zinc/46/12/51/1135461251.db2.gz DFFWBIWYEWMNJC-SJCJKPOMSA-N 1 0 345.374 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001197203120 1135659244 /nfs/dbraw/zinc/65/92/44/1135659244.db2.gz RNMMTTNYWJOCTP-CQSZACIVSA-N 1 0 333.388 3.905 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](Cn2ccnc2)c2ccccc2)cc1[N+](=O)[O-] ZINC001197275703 1135668703 /nfs/dbraw/zinc/66/87/03/1135668703.db2.gz VWERBNDPVHEGHK-SFHVURJKSA-N 1 0 336.395 3.631 20 5 EHBDRO CCC[C@@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOC1 ZINC000810017346 1135914542 /nfs/dbraw/zinc/91/45/42/1135914542.db2.gz VDAUJGPYDMANLI-CQSZACIVSA-N 1 0 333.215 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@H](C3CCOCC3)C2)c1 ZINC001201822639 1136067575 /nfs/dbraw/zinc/06/75/75/1136067575.db2.gz OIVUYXQKAAWTAU-ZWKOTPCHSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1ccncc1 ZINC000811483008 1136091582 /nfs/dbraw/zinc/09/15/82/1136091582.db2.gz AFIMWNXCJWNUMI-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482896 1136091629 /nfs/dbraw/zinc/09/16/29/1136091629.db2.gz WQNMISQFJUQGPI-OLZOCXBDSA-N 1 0 346.258 3.864 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCCC1 ZINC000811518761 1136098096 /nfs/dbraw/zinc/09/80/96/1136098096.db2.gz QAJDOOKIVRVQMJ-UHFFFAOYSA-N 1 0 326.824 3.935 20 5 EHBDRO CC[C@@H]1c2ccsc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275029 1136129231 /nfs/dbraw/zinc/12/92/31/1136129231.db2.gz FOMIBXORJSPDOV-HZPDHXFCSA-N 1 0 332.425 3.699 20 5 EHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277951 1136130719 /nfs/dbraw/zinc/13/07/19/1136130719.db2.gz RCXCWRVQXBIEEE-OALUTQOASA-N 1 0 326.396 3.774 20 5 EHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277954 1136131055 /nfs/dbraw/zinc/13/10/55/1136131055.db2.gz RCXCWRVQXBIEEE-RTBURBONSA-N 1 0 326.396 3.774 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCCO1 ZINC000338924310 1136180500 /nfs/dbraw/zinc/18/05/00/1136180500.db2.gz HCHNXCVGBPOZOT-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@H](Cc1ccc(Cl)cc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585344 1136442487 /nfs/dbraw/zinc/44/24/87/1136442487.db2.gz WASMTHCBEOFIGG-FZKQIMNGSA-N 1 0 348.830 3.845 20 5 EHBDRO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588192 1136445958 /nfs/dbraw/zinc/44/59/58/1136445958.db2.gz MDZFVILGWLIJNP-ZNZDAUKMSA-N 1 0 344.386 3.850 20 5 EHBDRO CCOc1ccccc1[C@@H](CC)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605371 1136467885 /nfs/dbraw/zinc/46/78/85/1136467885.db2.gz KXPJUJBOXLGKSM-MSOLQXFVSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606610 1136470527 /nfs/dbraw/zinc/47/05/27/1136470527.db2.gz YJSCDWIOZNNSBX-RDTXWAMCSA-N 1 0 344.411 3.766 20 5 EHBDRO CCc1ccc([C@@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640859 1136487894 /nfs/dbraw/zinc/48/78/94/1136487894.db2.gz VCSRRZJLDAJTLW-QUCCMNQESA-N 1 0 340.423 3.680 20 5 EHBDRO C[NH+](C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 ZINC000111195310 1136520349 /nfs/dbraw/zinc/52/03/49/1136520349.db2.gz XIQZUXGNAUJIBI-HNNXBMFYSA-N 1 0 342.424 3.919 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000111192911 1136520541 /nfs/dbraw/zinc/52/05/41/1136520541.db2.gz NYIDVLVZIIRBLT-UHFFFAOYSA-N 1 0 334.445 3.737 20 5 EHBDRO Cc1ccccc1OCCC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815577541 1136613126 /nfs/dbraw/zinc/61/31/26/1136613126.db2.gz SVCJCJAVPICXCM-AWEZNQCLSA-N 1 0 329.400 3.605 20 5 EHBDRO Cc1ccc2c(c1C)OC[C@@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591955 1136615783 /nfs/dbraw/zinc/61/57/83/1136615783.db2.gz VGTRAOUEDWLBCM-WBMJQRKESA-N 1 0 327.384 3.578 20 5 EHBDRO CCc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591288 1136616020 /nfs/dbraw/zinc/61/60/20/1136616020.db2.gz BZVHHWIDHYAFIU-SJKOYZFVSA-N 1 0 341.411 3.914 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)c1 ZINC000815626847 1136621294 /nfs/dbraw/zinc/62/12/94/1136621294.db2.gz NNWGDAOTYRUFTF-ZDUSSCGKSA-N 1 0 341.411 3.568 20 5 EHBDRO CCS(=O)(=O)C[C@H](C)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000113349623 1136697907 /nfs/dbraw/zinc/69/79/07/1136697907.db2.gz FUYIZILLNXIZRF-HNNXBMFYSA-N 1 0 341.476 3.906 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000776815347 1136698966 /nfs/dbraw/zinc/69/89/66/1136698966.db2.gz IXQRXLGKHCJNRX-ZBEGNZNMSA-N 1 0 343.408 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3ccsc3)CC2)cc1 ZINC000776882660 1136773275 /nfs/dbraw/zinc/77/32/75/1136773275.db2.gz PVUXBNYOTRKKTO-KRWDZBQOSA-N 1 0 332.425 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CC23CCSCC3)cc1Cl ZINC000817409691 1136805391 /nfs/dbraw/zinc/80/53/91/1136805391.db2.gz DUXUXKIKSGNFHI-GFCCVEGCSA-N 1 0 326.849 3.871 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000109839900 1136895789 /nfs/dbraw/zinc/89/57/89/1136895789.db2.gz UENAJHQRQGOMMZ-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(c3ccc(Cl)cc3)CC2)cc1 ZINC000819008613 1136899761 /nfs/dbraw/zinc/89/97/61/1136899761.db2.gz VMUYLUDTAFUYQM-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000819141568 1136913045 /nfs/dbraw/zinc/91/30/45/1136913045.db2.gz JDXVOKSQINKCSN-CORIIIEPSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)c1 ZINC000819141570 1136913048 /nfs/dbraw/zinc/91/30/48/1136913048.db2.gz JDXVOKSQINKCSN-NJZAAPMLSA-N 1 0 346.349 3.587 20 5 EHBDRO CCCOc1ccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000819257250 1136929209 /nfs/dbraw/zinc/92/92/09/1136929209.db2.gz BLZIALCLFWIKGH-LJQANCHMSA-N 1 0 344.411 3.515 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035858 1136934207 /nfs/dbraw/zinc/93/42/07/1136934207.db2.gz LVVHUJVNYVJDLT-GJZGRUSLSA-N 1 0 327.384 3.513 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000819314998 1136934537 /nfs/dbraw/zinc/93/45/37/1136934537.db2.gz PIFBMZGEAWDRSV-OALUTQOASA-N 1 0 326.396 3.604 20 5 EHBDRO Cc1cccc([C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000858363682 1136961889 /nfs/dbraw/zinc/96/18/89/1136961889.db2.gz YGTGFWNQPCFANW-RBUKOAKNSA-N 1 0 328.412 3.924 20 5 EHBDRO C[C@H]([NH2+][C@H](c1ccccn1)C1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858483980 1136972197 /nfs/dbraw/zinc/97/21/97/1136972197.db2.gz GBNVLZCAUWCQOS-SGTLLEGYSA-N 1 0 326.400 3.764 20 5 EHBDRO COC(=O)CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000173398679 1136999571 /nfs/dbraw/zinc/99/95/71/1136999571.db2.gz ASSXMSVBOZLZPS-KSSFIOAISA-N 1 0 342.395 3.940 20 5 EHBDRO Cc1cccc([C@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)c1 ZINC000859849271 1137034367 /nfs/dbraw/zinc/03/43/67/1137034367.db2.gz BXNSLGONYRIQRN-RTBURBONSA-N 1 0 328.412 3.924 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824554435 1137142639 /nfs/dbraw/zinc/14/26/39/1137142639.db2.gz GFQROAPFVZSPSQ-JTQLQIEISA-N 1 0 340.729 3.695 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCO[C@@H](c3ccncc3)C2)c1 ZINC000824949072 1137158889 /nfs/dbraw/zinc/15/88/89/1137158889.db2.gz XGIRVTLZIPFVQN-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1cc(CNc2ccc3c([nH+]2)CCC3)ccc1Br ZINC000825124579 1137166294 /nfs/dbraw/zinc/16/62/94/1137166294.db2.gz SKBMAFGNDBPBLH-UHFFFAOYSA-N 1 0 348.200 3.853 20 5 EHBDRO CN(C(=O)c1cc2ccccc2c2cccnc12)C1CCC([NH3+])CC1 ZINC000844205096 1137204112 /nfs/dbraw/zinc/20/41/12/1137204112.db2.gz NJXAGNJSQXFFHY-UHFFFAOYSA-N 1 0 333.435 3.730 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707002 1137239183 /nfs/dbraw/zinc/23/91/83/1137239183.db2.gz SBKSBRWXHGQUMZ-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO C[C@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000844925525 1137263270 /nfs/dbraw/zinc/26/32/70/1137263270.db2.gz QZAVDOHYRDNRPG-BBRMVZONSA-N 1 0 340.427 3.645 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)C[C@H](O)c1ccco1 ZINC000120777979 1137317407 /nfs/dbraw/zinc/31/74/07/1137317407.db2.gz ZVMPEDBWMGVUKR-CPUCHLNUSA-N 1 0 332.400 3.611 20 5 EHBDRO C[NH+]1CCC2(CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])CC2)CC1 ZINC000866054462 1137326864 /nfs/dbraw/zinc/32/68/64/1137326864.db2.gz BQAOKMNKWPJDCB-UHFFFAOYSA-N 1 0 339.386 3.845 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000846187185 1137340728 /nfs/dbraw/zinc/34/07/28/1137340728.db2.gz JSDZWXNSMNFWTE-DOXZYTNZSA-N 1 0 328.412 3.850 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000846187187 1137340759 /nfs/dbraw/zinc/34/07/59/1137340759.db2.gz JSDZWXNSMNFWTE-KHYOSLBOSA-N 1 0 328.412 3.850 20 5 EHBDRO Cc1cnc([C@@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866338785 1137347234 /nfs/dbraw/zinc/34/72/34/1137347234.db2.gz XOZQOLJNKQZMAK-WDEREUQCSA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1(c2ccccn2)CCC1 ZINC000866356654 1137349215 /nfs/dbraw/zinc/34/92/15/1137349215.db2.gz FJXSTOILFPSFAQ-CQSZACIVSA-N 1 0 343.402 3.771 20 5 EHBDRO C[C@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866480310 1137358161 /nfs/dbraw/zinc/35/81/61/1137358161.db2.gz CCEBFWXTTWYDHX-SUMWQHHRSA-N 1 0 333.432 3.567 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)C(C)(F)F ZINC000866544692 1137363742 /nfs/dbraw/zinc/36/37/42/1137363742.db2.gz ZGWJKJRWDATRKB-VXGBXAGGSA-N 1 0 330.379 3.546 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccnn1C ZINC000866613969 1137369687 /nfs/dbraw/zinc/36/96/87/1137369687.db2.gz KJRLFWKDYQKCSW-CHWSQXEVSA-N 1 0 334.445 3.550 20 5 EHBDRO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CC[NH2+]CC1 ZINC000868009509 1137393925 /nfs/dbraw/zinc/39/39/25/1137393925.db2.gz DYVJPFUPZGJXIY-AWEZNQCLSA-N 1 0 333.435 3.506 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCC12CCOCC2 ZINC000282758889 1137445900 /nfs/dbraw/zinc/44/59/00/1137445900.db2.gz OEAROGONXBJEIM-YJBOKZPZSA-N 1 0 332.444 3.855 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000773116724 1137466267 /nfs/dbraw/zinc/46/62/67/1137466267.db2.gz FWAQLNMVZLDGCW-GOSISDBHSA-N 1 0 326.396 3.813 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1ccco1)N(C)C ZINC000872018793 1137564929 /nfs/dbraw/zinc/56/49/29/1137564929.db2.gz PPHUCPMLPOTHPX-IUODEOHRSA-N 1 0 349.456 3.863 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCc2c1cnn2C ZINC000872021233 1137565204 /nfs/dbraw/zinc/56/52/04/1137565204.db2.gz OQRMTYYFUGJCPI-IAQYHMDHSA-N 1 0 346.456 3.778 20 5 EHBDRO C[C@@H]([NH2+]CCCc1nc2ccccc2[nH]1)c1c(F)cccc1[N+](=O)[O-] ZINC000872027402 1137566059 /nfs/dbraw/zinc/56/60/59/1137566059.db2.gz JKXOKLAVIGJGFL-GFCCVEGCSA-N 1 0 342.374 3.894 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@H](O)c1ccc(F)cc1 ZINC000872033256 1137566705 /nfs/dbraw/zinc/56/67/05/1137566705.db2.gz CAQLAQNRBJFWHW-RVPKQNPDSA-N 1 0 336.338 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCOC3(CCCC3)C2)cc1 ZINC000872048301 1137567850 /nfs/dbraw/zinc/56/78/50/1137567850.db2.gz IEGAXOPUCRITKX-KRWDZBQOSA-N 1 0 332.444 3.999 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc(CO)cc1 ZINC000872054164 1137568308 /nfs/dbraw/zinc/56/83/08/1137568308.db2.gz QEFHSBXJNMIZLR-ZDUSSCGKSA-N 1 0 346.452 3.702 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872080579 1137570237 /nfs/dbraw/zinc/57/02/37/1137570237.db2.gz AOQZSALRPKJKOZ-SUYBPPKGSA-N 1 0 345.374 3.700 20 5 EHBDRO Cc1c(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000873028436 1137588450 /nfs/dbraw/zinc/58/84/50/1137588450.db2.gz MGCBEJVKDQHJFV-OALUTQOASA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCc1noc2ccccc21 ZINC000873135084 1137591089 /nfs/dbraw/zinc/59/10/89/1137591089.db2.gz UAUGDGPIYVNJKP-UHFFFAOYSA-N 1 0 325.368 3.685 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876942071 1137665824 /nfs/dbraw/zinc/66/58/24/1137665824.db2.gz UHAINTUQHDFZTA-SEEARECTSA-N 1 0 344.415 3.700 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000876945380 1137665844 /nfs/dbraw/zinc/66/58/44/1137665844.db2.gz BNQCNJQYZJWGEL-VJBOLBCHSA-N 1 0 328.349 3.968 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(F)ccc1F ZINC000877054822 1137668878 /nfs/dbraw/zinc/66/88/78/1137668878.db2.gz LHMLOTIPWKXUCZ-ZEPSKSRBSA-N 1 0 336.342 3.514 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1c(F)cccc1Cl ZINC000877082107 1137669877 /nfs/dbraw/zinc/66/98/77/1137669877.db2.gz WBDAMRMALIOFJS-KPPDAEKUSA-N 1 0 338.770 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC3CCC4(CC4)CC3)CC2)cn1 ZINC000877697536 1137686061 /nfs/dbraw/zinc/68/60/61/1137686061.db2.gz KBUPUQYGYDNRLL-UHFFFAOYSA-N 1 0 344.459 3.519 20 5 EHBDRO CCC[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878055940 1137700855 /nfs/dbraw/zinc/70/08/55/1137700855.db2.gz SDJOXOFSMTWBFM-UHFFFAOYSA-N 1 0 336.779 3.673 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]2CCCC[C@H]12 ZINC000878398808 1137714253 /nfs/dbraw/zinc/71/42/53/1137714253.db2.gz DMVRHLXQHOMSCM-NFAWXSAZSA-N 1 0 342.399 3.655 20 5 EHBDRO C[C@H]1CC[C@]2(CC[N@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399661 1137714405 /nfs/dbraw/zinc/71/44/05/1137714405.db2.gz PNGCDXXNPJEVBO-UGSOOPFHSA-N 1 0 342.399 3.657 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878419434 1137715061 /nfs/dbraw/zinc/71/50/61/1137715061.db2.gz FDTGRPKWLDKNLW-UKRRQHHQSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]1C ZINC000878446546 1137716306 /nfs/dbraw/zinc/71/63/06/1137716306.db2.gz GNYSIRQZZLGKCH-DYEKYZERSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476033 1137717344 /nfs/dbraw/zinc/71/73/44/1137717344.db2.gz VJXRXJWQEBZFJR-OCCSQVGLSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699152 1137725545 /nfs/dbraw/zinc/72/55/45/1137725545.db2.gz NYOQHZFUAZQRBJ-SJCJKPOMSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@]12C[C@@H]1CCCC2 ZINC000879263093 1137742752 /nfs/dbraw/zinc/74/27/52/1137742752.db2.gz KVNWKXWACKOATH-XAYKYTGQSA-N 1 0 342.399 3.703 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)c([N+](=O)[O-])cc1F ZINC000879672058 1137754827 /nfs/dbraw/zinc/75/48/27/1137754827.db2.gz RGQADTSOLWMGTN-ZYHUDNBSSA-N 1 0 348.296 3.729 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3[C@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681206 1137755118 /nfs/dbraw/zinc/75/51/18/1137755118.db2.gz MLLAQDDASMJZCY-JZIBPQBNSA-N 1 0 342.399 3.758 20 5 EHBDRO COC[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000883317224 1137854416 /nfs/dbraw/zinc/85/44/16/1137854416.db2.gz YNHRZQNAQFHSKG-XBXGTLAGSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)CCC2 ZINC000331675287 1137916825 /nfs/dbraw/zinc/91/68/25/1137916825.db2.gz PQBPXXIKWUNCAJ-IPELMVKDSA-N 1 0 332.444 3.893 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348306221 1137924685 /nfs/dbraw/zinc/92/46/85/1137924685.db2.gz CPLYIJYKNYXWSY-NSHDSACASA-N 1 0 333.413 3.508 20 5 EHBDRO COc1ccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])C(C)(C)C)cc1 ZINC000886209601 1138059482 /nfs/dbraw/zinc/05/94/82/1138059482.db2.gz PQIAKPUGHYDJPX-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO C[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCCC1 ZINC000073158370 1138111540 /nfs/dbraw/zinc/11/15/40/1138111540.db2.gz ICAFXODBHMMUOO-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@]1(C)CCOC2(CCC2)C1 ZINC000886776450 1138138859 /nfs/dbraw/zinc/13/88/59/1138138859.db2.gz GOTQTPHKZQGABP-KSSFIOAISA-N 1 0 348.443 3.993 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324895 1138155039 /nfs/dbraw/zinc/15/50/39/1138155039.db2.gz MBNRSNNKAQZDDM-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2cc(F)ccc2n1C)c1ccc([N+](=O)[O-])cc1 ZINC000090044172 1138208537 /nfs/dbraw/zinc/20/85/37/1138208537.db2.gz RZVHDEAOSFOHTM-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO CCC[C@H]([NH2+]CC1(SC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000090112045 1138209517 /nfs/dbraw/zinc/20/95/17/1138209517.db2.gz WMSQJJCKRZKIMA-INIZCTEOSA-N 1 0 338.473 3.938 20 5 EHBDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001202749049 1138269943 /nfs/dbraw/zinc/26/99/43/1138269943.db2.gz GAKIXKGGYBABHU-KDYLLFBJSA-N 1 0 330.384 3.900 20 5 EHBDRO CCC[C@@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127424136 1138357200 /nfs/dbraw/zinc/35/72/00/1138357200.db2.gz TZWCMGNELWAFEP-QRQCRPRQSA-N 1 0 326.462 3.573 20 5 EHBDRO Cc1cc(F)ccc1C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337481897 1138581859 /nfs/dbraw/zinc/58/18/59/1138581859.db2.gz WGSLTBMDLOFFQO-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607350 1139144130 /nfs/dbraw/zinc/14/41/30/1139144130.db2.gz YQPOBXYELWYWTR-JKSUJKDBSA-N 1 0 349.475 3.765 20 5 EHBDRO Cc1ccc(CN(C)[C@@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281903 1139824329 /nfs/dbraw/zinc/82/43/29/1139824329.db2.gz BOLIXRGAGDXEAI-BSEYFRJRSA-N 1 0 346.452 3.834 20 5 EHBDRO COC(=O)CC[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000180674071 1139855130 /nfs/dbraw/zinc/85/51/30/1139855130.db2.gz VNTNPQGYUWNCSN-KSSFIOAISA-N 1 0 342.395 3.940 20 5 EHBDRO Cc1nc(C[C@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000182744514 1139989833 /nfs/dbraw/zinc/98/98/33/1139989833.db2.gz BWLNLPPWYBNUAD-UKRRQHHQSA-N 1 0 344.415 3.610 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185497052 1140152520 /nfs/dbraw/zinc/15/25/20/1140152520.db2.gz HHWXLCXMADBBHW-HNNXBMFYSA-N 1 0 326.396 3.639 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCNc2ccccc21 ZINC000192826180 1140553074 /nfs/dbraw/zinc/55/30/74/1140553074.db2.gz IUSKEACKZCVLGI-QGZVFWFLSA-N 1 0 327.384 3.640 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)c1ccco1 ZINC000266141093 1140646290 /nfs/dbraw/zinc/64/62/90/1140646290.db2.gz HFQMTTPYLOZJTA-LBPRGKRZSA-N 1 0 341.314 3.504 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781861 1140724250 /nfs/dbraw/zinc/72/42/50/1140724250.db2.gz NEASNZXHJZMKDP-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)C[C@H](CCO)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268998700 1141043317 /nfs/dbraw/zinc/04/33/17/1141043317.db2.gz UIVKENVXZYNXNC-MAUKXSAKSA-N 1 0 334.460 3.550 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000269386761 1141101796 /nfs/dbraw/zinc/10/17/96/1141101796.db2.gz WKCQGZFHHTUAMZ-DZGCQCFKSA-N 1 0 336.457 3.690 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684239 1141135150 /nfs/dbraw/zinc/13/51/50/1141135150.db2.gz SHZCKIMIUIZJOO-QZTJIDSGSA-N 1 0 330.359 3.604 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000270621358 1141246660 /nfs/dbraw/zinc/24/66/60/1141246660.db2.gz FRGWDYVMUSYYKQ-WMLDXEAASA-N 1 0 336.432 3.677 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C)nn(C)c1C ZINC000271121792 1141311163 /nfs/dbraw/zinc/31/11/63/1141311163.db2.gz JOUUZCONFAGIOU-CQSZACIVSA-N 1 0 348.472 3.606 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1CCOC2(CCC2)C1)C1CC1 ZINC000271450924 1141369685 /nfs/dbraw/zinc/36/96/85/1141369685.db2.gz DOOFBAJWBPHQJA-IRXDYDNUSA-N 1 0 330.428 3.607 20 5 EHBDRO C[C@H]1C[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000271562458 1141398961 /nfs/dbraw/zinc/39/89/61/1141398961.db2.gz WBJNJPDVSNYGHO-UONOGXRCSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H]1c1ccccc1 ZINC000348541161 1141548393 /nfs/dbraw/zinc/54/83/93/1141548393.db2.gz QQLHZEYAMTZNLR-SFHVURJKSA-N 1 0 339.395 3.679 20 5 EHBDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000283256953 1141580059 /nfs/dbraw/zinc/58/00/59/1141580059.db2.gz VTYNJFHSANYKID-LBPRGKRZSA-N 1 0 348.374 3.910 20 5 EHBDRO CNC(=O)CC[C@@H]1CCCC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836521 1141592807 /nfs/dbraw/zinc/59/28/07/1141592807.db2.gz CTTFELHQISFOJS-INIZCTEOSA-N 1 0 347.459 3.599 20 5 EHBDRO COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349059079 1141630914 /nfs/dbraw/zinc/63/09/14/1141630914.db2.gz BFCNHDZQEILWAF-VBKFSLOCSA-N 1 0 341.411 3.542 20 5 EHBDRO C[NH+](C)CCc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000120081190 1014183425 /nfs/dbraw/zinc/18/34/25/1014183425.db2.gz CKFJWZMZRMVZQH-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000610215074 1015005943 /nfs/dbraw/zinc/00/59/43/1015005943.db2.gz HNVKSADAKNJLIP-ZDUSSCGKSA-N 1 0 349.456 3.994 20 5 EHBDRO CSc1ccc([C@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000339591223 1015091955 /nfs/dbraw/zinc/09/19/55/1015091955.db2.gz ZBLLICCHTYDZMI-SFHVURJKSA-N 1 0 345.468 3.709 20 5 EHBDRO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C)c1cccc(O)c1 ZINC000471165707 1015183168 /nfs/dbraw/zinc/18/31/68/1015183168.db2.gz PXCYFRHWPPPERE-CQSZACIVSA-N 1 0 330.384 3.762 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000120523896 1015404599 /nfs/dbraw/zinc/40/45/99/1015404599.db2.gz YCHZNQKXWBZIJV-UGSOOPFHSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824581 1015438153 /nfs/dbraw/zinc/43/81/53/1015438153.db2.gz KRUQDRPNIAYHFF-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854382 1015778697 /nfs/dbraw/zinc/77/86/97/1015778697.db2.gz RFQIALBWLPNDKF-HNNXBMFYSA-N 1 0 341.411 3.577 20 5 EHBDRO COCCCOc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000154849853 1015857309 /nfs/dbraw/zinc/85/73/09/1015857309.db2.gz BPAMKLFDTUFSTP-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H]2Cn2cnc3ccccc32)c1 ZINC000339908755 1015881748 /nfs/dbraw/zinc/88/17/48/1015881748.db2.gz FLVVAGQVUXXFCJ-QGZVFWFLSA-N 1 0 336.395 3.609 20 5 EHBDRO C[N@H+](CCc1ccccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120786217 1016231359 /nfs/dbraw/zinc/23/13/59/1016231359.db2.gz DWMZCABVRVKCNO-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000060208941 1016271302 /nfs/dbraw/zinc/27/13/02/1016271302.db2.gz RIAJUFOFEIOLTR-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120836918 1016352812 /nfs/dbraw/zinc/35/28/12/1016352812.db2.gz DXSXNWJGDRJLCH-JKSUJKDBSA-N 1 0 345.399 3.516 20 5 EHBDRO CCOCOc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000782952647 1016833328 /nfs/dbraw/zinc/83/33/28/1016833328.db2.gz NEQFRLVSDYOGKV-CQSZACIVSA-N 1 0 330.384 3.818 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000414593699 1017003113 /nfs/dbraw/zinc/00/31/13/1017003113.db2.gz RCHOYPCIJBPWTM-IVZVJUQRSA-N 1 0 341.386 3.616 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1noc(-c2cc(C(F)(F)F)ccc2[N+](=O)[O-])n1 ZINC000414613077 1017027295 /nfs/dbraw/zinc/02/72/95/1017027295.db2.gz DOHDXWBKPVATLA-SNVBAGLBSA-N 1 0 344.293 3.710 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccccc1)C1(CO)CCCC1 ZINC000459533652 1032250972 /nfs/dbraw/zinc/25/09/72/1032250972.db2.gz PMSAXSLIOFZGEO-IBGZPJMESA-N 1 0 340.423 3.978 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000449191287 1032287885 /nfs/dbraw/zinc/28/78/85/1032287885.db2.gz XAQASNRNJSQBCB-YJBOKZPZSA-N 1 0 327.428 3.950 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1COc2ccccc21 ZINC000449202501 1032327184 /nfs/dbraw/zinc/32/71/84/1032327184.db2.gz FSIXXPHKJNQNDD-CKEIUWERSA-N 1 0 326.396 3.680 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835054 1032330828 /nfs/dbraw/zinc/33/08/28/1032330828.db2.gz ZGSGKAUHUBYGMZ-SJORKVTESA-N 1 0 333.476 3.922 20 5 EHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459651215 1032374480 /nfs/dbraw/zinc/37/44/80/1032374480.db2.gz OWOFNCQZZAXCHM-PZBABLGHSA-N 1 0 329.425 3.904 20 5 EHBDRO CC(C)O[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000584410000 1032442796 /nfs/dbraw/zinc/44/27/96/1032442796.db2.gz DVELGCDUSROAAN-OAHLLOKOSA-N 1 0 330.384 3.854 20 5 EHBDRO CCC[C@@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000459769290 1032460538 /nfs/dbraw/zinc/46/05/38/1032460538.db2.gz BPZUGVUUQDYUHW-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449401461 1032523989 /nfs/dbraw/zinc/52/39/89/1032523989.db2.gz HCVQZJTUUPQPPN-WMZOPIPTSA-N 1 0 325.412 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3=CCOCC3)s2)cc1 ZINC000449403549 1032525519 /nfs/dbraw/zinc/52/55/19/1032525519.db2.gz QONLGFGWSGHYSB-UHFFFAOYSA-N 1 0 330.409 3.760 20 5 EHBDRO CC[C@@H](C)[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)OC ZINC000449403238 1032525647 /nfs/dbraw/zinc/52/56/47/1032525647.db2.gz VLMVMGRRFQDXCF-WBMJQRKESA-N 1 0 349.456 3.869 20 5 EHBDRO C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cc(CO)cc([N+](=O)[O-])c2)cc1 ZINC000592987201 1032659500 /nfs/dbraw/zinc/65/95/00/1032659500.db2.gz WVGJLIYLYFYLQI-CQSZACIVSA-N 1 0 326.396 3.738 20 5 EHBDRO C[NH2+]CCN(C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414659181 1017107443 /nfs/dbraw/zinc/10/74/43/1017107443.db2.gz KQYQDBZUUGHDGA-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000247214559 1017138472 /nfs/dbraw/zinc/13/84/72/1017138472.db2.gz WALVXTPQOCDSRE-BHYGNILZSA-N 1 0 328.416 3.934 20 5 EHBDRO CC(C)([NH3+])CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414802697 1017204927 /nfs/dbraw/zinc/20/49/27/1017204927.db2.gz LGYOIZIDVJBHIS-UHFFFAOYSA-N 1 0 349.818 3.867 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CC1 ZINC000537419566 1032701235 /nfs/dbraw/zinc/70/12/35/1032701235.db2.gz CSIJEFDQLFSAJL-AWEZNQCLSA-N 1 0 339.395 3.591 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCOC3)C2)o1 ZINC000377237747 1017513209 /nfs/dbraw/zinc/51/32/09/1017513209.db2.gz JFZQRUOEUOTLIW-CABCVRRESA-N 1 0 342.395 3.713 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2cccnc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281277 1017608210 /nfs/dbraw/zinc/60/82/10/1017608210.db2.gz AHSLAZZDVOFQIO-DOMZBBRYSA-N 1 0 332.429 3.546 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@H](CCO)c1ccccc1 ZINC000893012394 1018155436 /nfs/dbraw/zinc/15/54/36/1018155436.db2.gz FTTFGACUMAUDME-AWEZNQCLSA-N 1 0 334.803 3.504 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NCCC[C@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000415699549 1018408099 /nfs/dbraw/zinc/40/80/99/1018408099.db2.gz JJQIWSGICSZVHZ-CYBMUJFWSA-N 1 0 348.447 3.546 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000560907437 1018637825 /nfs/dbraw/zinc/63/78/25/1018637825.db2.gz NJMSYNYWCXHKKG-KUHUBIRLSA-N 1 0 328.412 3.850 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000580212444 1018795116 /nfs/dbraw/zinc/79/51/16/1018795116.db2.gz MBGKNGNTHHDYCQ-INIZCTEOSA-N 1 0 341.411 3.944 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1NC1CC[NH+](Cc2ccncc2)CC1 ZINC000052447717 1018953888 /nfs/dbraw/zinc/95/38/88/1018953888.db2.gz SVHZKBRVLPKIKC-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO CC[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCC1 ZINC000052559549 1018999635 /nfs/dbraw/zinc/99/96/35/1018999635.db2.gz WDECQLFFWZDRQS-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182329594 1019064982 /nfs/dbraw/zinc/06/49/82/1019064982.db2.gz FIXOLYODEIKMGI-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000542725222 1019072812 /nfs/dbraw/zinc/07/28/12/1019072812.db2.gz ZOPHUXMGXXLCBB-ACJLOTCBSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000120616309 1019100852 /nfs/dbraw/zinc/10/08/52/1019100852.db2.gz KADLSLKVOUJDME-YPMHNXCESA-N 1 0 330.432 3.535 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@@H]1c1cccc(F)c1 ZINC000178865343 1019322229 /nfs/dbraw/zinc/32/22/29/1019322229.db2.gz VLDIJTJMASNIFK-VMDGZTHMSA-N 1 0 344.386 3.850 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000580469642 1019420919 /nfs/dbraw/zinc/42/09/19/1019420919.db2.gz BGKDOBMFDBQNMP-ZBFHGGJFSA-N 1 0 334.416 3.587 20 5 EHBDRO CCCCNC(=O)[C@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718429 1019737933 /nfs/dbraw/zinc/73/79/33/1019737933.db2.gz LAWUPBSGLNPYMT-HOTGVXAUSA-N 1 0 347.459 3.593 20 5 EHBDRO CCC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)COC1 ZINC000449596302 1032868289 /nfs/dbraw/zinc/86/82/89/1032868289.db2.gz AQJWITRTKNXOKA-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO C[C@]1(O)CCC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000280181131 1020171395 /nfs/dbraw/zinc/17/13/95/1020171395.db2.gz SWFLTCBTFGBSMI-NRFANRHFSA-N 1 0 337.419 3.683 20 5 EHBDRO C[C@H]1CC[C@H]([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922881 1020243470 /nfs/dbraw/zinc/24/34/70/1020243470.db2.gz GDFGLRSNFKFCJM-GJZGRUSLSA-N 1 0 344.411 3.838 20 5 EHBDRO CC(=O)c1cc(NC[C@H](C2CCCCC2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000581149177 1020485717 /nfs/dbraw/zinc/48/57/17/1020485717.db2.gz ZXESAXRISGWLRT-GOSISDBHSA-N 1 0 333.432 3.720 20 5 EHBDRO CCC1(CO)CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602473396 1032906472 /nfs/dbraw/zinc/90/64/72/1032906472.db2.gz QJBFNPOMRNISSI-UHFFFAOYSA-N 1 0 346.349 3.598 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000237019534 1020663578 /nfs/dbraw/zinc/66/35/78/1020663578.db2.gz XDQGLIRFMYYEOV-OAHLLOKOSA-N 1 0 328.368 3.607 20 5 EHBDRO C[C@@H]1COC[C@H](c2ccccc2)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000501038369 1020674291 /nfs/dbraw/zinc/67/42/91/1020674291.db2.gz JFAJFLWKWHLHFY-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO CO[C@H]([C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627033 1032923851 /nfs/dbraw/zinc/92/38/51/1032923851.db2.gz FOKDNRWCYAKQKN-KPZWWZAWSA-N 1 0 330.384 3.758 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2CCCO[C@@H]2c2ccccc2)cc1 ZINC000602521150 1032933536 /nfs/dbraw/zinc/93/35/36/1032933536.db2.gz NCXVDWNKWUUPAC-AZUAARDMSA-N 1 0 340.423 3.895 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC1CCSCC1 ZINC000602546431 1032957345 /nfs/dbraw/zinc/95/73/45/1032957345.db2.gz SFYATKWOHRDBAI-UHFFFAOYSA-N 1 0 334.363 3.846 20 5 EHBDRO C[C@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H](c2ccc(F)cc2)O1 ZINC000126664340 1021161983 /nfs/dbraw/zinc/16/19/83/1021161983.db2.gz QVRIKYISBNAMNH-SCLBCKFNSA-N 1 0 330.359 3.696 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1c(C)cccc1C ZINC000546225407 1021278240 /nfs/dbraw/zinc/27/82/40/1021278240.db2.gz IEDMJDOUCDYPFL-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000518582799 1021349454 /nfs/dbraw/zinc/34/94/54/1021349454.db2.gz XCMDCXZVEIAVMD-INIZCTEOSA-N 1 0 325.412 3.868 20 5 EHBDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)o1 ZINC000602572880 1032980008 /nfs/dbraw/zinc/98/00/08/1032980008.db2.gz YTIMQKJGJJPMIL-LLVKDONJSA-N 1 0 329.356 3.748 20 5 EHBDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)o1 ZINC000602572882 1032981509 /nfs/dbraw/zinc/98/15/09/1032981509.db2.gz YTIMQKJGJJPMIL-NSHDSACASA-N 1 0 329.356 3.748 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477441002 1021689803 /nfs/dbraw/zinc/68/98/03/1021689803.db2.gz UECRGPUSHLTDGJ-QGZVFWFLSA-N 1 0 340.379 3.703 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909881 1021694516 /nfs/dbraw/zinc/69/45/16/1021694516.db2.gz SFENHCSGPJICOC-CABCVRRESA-N 1 0 328.412 3.928 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909879 1021695945 /nfs/dbraw/zinc/69/59/45/1021695945.db2.gz SFENHCSGPJICOC-HUUCEWRRSA-N 1 0 328.412 3.928 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602581380 1032997884 /nfs/dbraw/zinc/99/78/84/1032997884.db2.gz JEHVEEHNNPNJEW-HIFRSBDPSA-N 1 0 346.349 3.907 20 5 EHBDRO CC(C)(CO)[C@H](C[NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000602583650 1033003451 /nfs/dbraw/zinc/00/34/51/1033003451.db2.gz SMWWPQHGVJLMBL-LJQANCHMSA-N 1 0 342.439 3.529 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)c2c1 ZINC000610538847 1021807606 /nfs/dbraw/zinc/80/76/06/1021807606.db2.gz VTRLDRGXIWOTFT-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610538843 1021808210 /nfs/dbraw/zinc/80/82/10/1021808210.db2.gz VGXZBDQGBPPRER-DOMZBBRYSA-N 1 0 347.365 3.803 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[N@@H+](C)C(C)C)n1 ZINC000178173219 1021926770 /nfs/dbraw/zinc/92/67/70/1021926770.db2.gz JFFCZMPLTSBBBL-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441353163 1022170638 /nfs/dbraw/zinc/17/06/38/1022170638.db2.gz GKKYYPSNKGKUJH-OAHLLOKOSA-N 1 0 325.840 3.554 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC ZINC000441419765 1022290385 /nfs/dbraw/zinc/29/03/85/1022290385.db2.gz UIRQLMQUNMNMCR-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187579971 1022356152 /nfs/dbraw/zinc/35/61/52/1022356152.db2.gz NTHYTJTUZOGIFI-CXAGYDPISA-N 1 0 328.416 3.616 20 5 EHBDRO C[N@H+](CCCCO)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000471819103 1022397866 /nfs/dbraw/zinc/39/78/66/1022397866.db2.gz BMDGEKPKJLSGDQ-UHFFFAOYSA-N 1 0 348.374 3.731 20 5 EHBDRO NC(=[NH2+])N(c1ccc(F)cc1)c1cc2cccnc2c2ncccc12 ZINC001167994839 1022421261 /nfs/dbraw/zinc/42/12/61/1022421261.db2.gz PECZWEXWAYAVIC-UHFFFAOYSA-N 1 0 331.354 3.954 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000517552664 1022439426 /nfs/dbraw/zinc/43/94/26/1022439426.db2.gz VRQJLKYNZCHZEI-MRXNPFEDSA-N 1 0 333.476 3.928 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000441429211 1022533843 /nfs/dbraw/zinc/53/38/43/1022533843.db2.gz NQMMMCVNPUAKIZ-HNNXBMFYSA-N 1 0 344.411 3.545 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)c([N+](=O)[O-])cc1F ZINC000184238326 1022607432 /nfs/dbraw/zinc/60/74/32/1022607432.db2.gz STUGILVDBIETCO-LBPRGKRZSA-N 1 0 348.374 3.511 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCC1 ZINC000602688713 1033069030 /nfs/dbraw/zinc/06/90/30/1033069030.db2.gz YHLAWLGWOIZNKB-QGZVFWFLSA-N 1 0 332.448 3.517 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)O1 ZINC000602690399 1033070551 /nfs/dbraw/zinc/07/05/51/1033070551.db2.gz LLQNFDORLKDHNZ-SCVCMEIPSA-N 1 0 332.322 3.517 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(C)(C)C ZINC000602676895 1033078805 /nfs/dbraw/zinc/07/88/05/1033078805.db2.gz UBGUHRMPHSSDSU-MRXNPFEDSA-N 1 0 334.464 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCO[C@H]3C3CC3)s2)cc1 ZINC000536339173 1022900221 /nfs/dbraw/zinc/90/02/21/1022900221.db2.gz ZMGUFBNMRGCZHY-AEFFLSMTSA-N 1 0 344.436 3.980 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000550276374 1022953604 /nfs/dbraw/zinc/95/36/04/1022953604.db2.gz LGFUJVLFMAICLS-SPQRHKFCSA-N 1 0 332.444 3.777 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@H+](Cc1ccccc1)[C@@H]1CCCC1(C)C ZINC000426809714 1023060462 /nfs/dbraw/zinc/06/04/62/1023060462.db2.gz FRBKJEPUGVGQFY-QGZVFWFLSA-N 1 0 342.443 3.909 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-] ZINC000276828307 1023084861 /nfs/dbraw/zinc/08/48/61/1023084861.db2.gz ANNUHGPSIKTHBJ-LBPRGKRZSA-N 1 0 345.355 3.753 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCO[C@@H]1CCCC[C@H]1C ZINC000509585635 1023092186 /nfs/dbraw/zinc/09/21/86/1023092186.db2.gz KLDMDWKBFHKNNP-RHSMWYFYSA-N 1 0 336.432 3.678 20 5 EHBDRO COCCC1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602720484 1033104750 /nfs/dbraw/zinc/10/47/50/1033104750.db2.gz ILZRVDIHBNNECW-UHFFFAOYSA-N 1 0 346.349 3.862 20 5 EHBDRO COC(=O)c1ccccc1CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000507171011 1023171682 /nfs/dbraw/zinc/17/16/82/1023171682.db2.gz ROHSYWJDCXVODS-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO COc1ccc(C[C@H](C)C[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000536417721 1023239947 /nfs/dbraw/zinc/23/99/47/1023239947.db2.gz XYVZCDZIYCUYPL-ZDUSSCGKSA-N 1 0 334.441 3.976 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000266856912 1023258774 /nfs/dbraw/zinc/25/87/74/1023258774.db2.gz KFHCEZZODZEGBY-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000058976213 1033149689 /nfs/dbraw/zinc/14/96/89/1033149689.db2.gz BZJFNHGQTLEDHP-IBGZPJMESA-N 1 0 340.423 3.853 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000535799468 1023646649 /nfs/dbraw/zinc/64/66/49/1023646649.db2.gz QDNHRWUFFNRLCY-GJZGRUSLSA-N 1 0 342.443 3.863 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000610809518 1023694932 /nfs/dbraw/zinc/69/49/32/1023694932.db2.gz FBMTZXALPVATNE-CQSZACIVSA-N 1 0 329.400 3.774 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000277086284 1023754304 /nfs/dbraw/zinc/75/43/04/1023754304.db2.gz AXSXTOMMHBHSEZ-QGZVFWFLSA-N 1 0 347.462 3.944 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCCC[C@H]1CCO ZINC000342055165 1023806978 /nfs/dbraw/zinc/80/69/78/1023806978.db2.gz YXYCIDMTOBYPLY-INIZCTEOSA-N 1 0 336.432 3.509 20 5 EHBDRO C[C@@H](c1ccccc1Cl)[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176211352 1023865898 /nfs/dbraw/zinc/86/58/98/1023865898.db2.gz WNOTYBFAELDSBN-LBPRGKRZSA-N 1 0 334.807 3.670 20 5 EHBDRO Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2C)ccc1C[NH+](C)C ZINC000458308179 1023910434 /nfs/dbraw/zinc/91/04/34/1023910434.db2.gz DRYJQPGGPBRBRT-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1[C@@H]2CC[C@H]1C[C@@H](c1ccccc1)C2 ZINC000602825200 1033193003 /nfs/dbraw/zinc/19/30/03/1033193003.db2.gz RGXIRRDYZJGMBF-BCDXTJNWSA-N 1 0 340.427 3.510 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000327480440 1024407706 /nfs/dbraw/zinc/40/77/06/1024407706.db2.gz DORUJHFKFJCWDX-CYBMUJFWSA-N 1 0 344.411 3.641 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC1CC[NH+]([C@@H](C)c2ccncc2)CC1 ZINC000425236342 1024488063 /nfs/dbraw/zinc/48/80/63/1024488063.db2.gz JUSFOBATSWYLCF-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717338 1024493001 /nfs/dbraw/zinc/49/30/01/1024493001.db2.gz UXNFTKTYNVEJRB-QAPCUYQASA-N 1 0 333.476 3.880 20 5 EHBDRO CCOc1ccccc1[C@@H](CC(C)C)[NH2+]CCn1ccc([N+](=O)[O-])n1 ZINC000342245292 1024537242 /nfs/dbraw/zinc/53/72/42/1024537242.db2.gz QQFJUNNBPXHFOO-MRXNPFEDSA-N 1 0 346.431 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC[C@@H]3CCCC3(F)F)nc2c1 ZINC000895544302 1024602759 /nfs/dbraw/zinc/60/27/59/1024602759.db2.gz IFWZCBSXWCLMNU-JTQLQIEISA-N 1 0 325.315 3.651 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCO1 ZINC000119656759 1024659570 /nfs/dbraw/zinc/65/95/70/1024659570.db2.gz WYAVDWSOZGHXDA-CVEARBPZSA-N 1 0 347.440 3.766 20 5 EHBDRO COc1cc(C[NH2+]CC[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000507942046 1024788166 /nfs/dbraw/zinc/78/81/66/1024788166.db2.gz PNZRFAFMNVVTKF-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948061 1025135488 /nfs/dbraw/zinc/13/54/88/1025135488.db2.gz QHTVJEGMJLQFPD-HZPDHXFCSA-N 1 0 333.476 3.928 20 5 EHBDRO COCC[C@H](C)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000414487654 1025158178 /nfs/dbraw/zinc/15/81/78/1025158178.db2.gz VNJGVPHLAHOJKB-ZDUSSCGKSA-N 1 0 348.399 3.626 20 5 EHBDRO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000515410670 1025220569 /nfs/dbraw/zinc/22/05/69/1025220569.db2.gz PPFOBYYESISMAD-ZCGYKAAXSA-N 1 0 326.396 3.993 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](Cc1c([N+](=O)[O-])ncn1C)C1CCCC1 ZINC000425440808 1025285564 /nfs/dbraw/zinc/28/55/64/1025285564.db2.gz CFJDDMVXZVKDGE-AWEZNQCLSA-N 1 0 328.416 3.834 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000515549597 1025342766 /nfs/dbraw/zinc/34/27/66/1025342766.db2.gz FWKODALYVNAGBP-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Cc3nccs3)C2)c(Cl)c1 ZINC000934332847 1025484574 /nfs/dbraw/zinc/48/45/74/1025484574.db2.gz MDKXFJSKDUIWGR-LLVKDONJSA-N 1 0 337.832 3.769 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451100303 1025561197 /nfs/dbraw/zinc/56/11/97/1025561197.db2.gz RXTRETPABOGACJ-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCCC[C@@H]([NH+]4CCCC4)C3)ccc2c1 ZINC000521664975 1025583491 /nfs/dbraw/zinc/58/34/91/1025583491.db2.gz HJQCLLAXIFPQGD-QGZVFWFLSA-N 1 0 340.427 3.598 20 5 EHBDRO C[NH+](C)CC1(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCCC1 ZINC000436355975 1025615222 /nfs/dbraw/zinc/61/52/22/1025615222.db2.gz UHLBIPDQQCPOKN-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)cc1 ZINC000281896176 1025650021 /nfs/dbraw/zinc/65/00/21/1025650021.db2.gz BEHOEPNUEIXAFU-INIZCTEOSA-N 1 0 340.427 3.507 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000347355960 1025699951 /nfs/dbraw/zinc/69/99/51/1025699951.db2.gz JUXCZMKUAAHYHB-SDNWHVSQSA-N 1 0 326.400 3.601 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425544177 1025703957 /nfs/dbraw/zinc/70/39/57/1025703957.db2.gz BTSWTBKYIUCRHH-KBXCAEBGSA-N 1 0 330.428 3.937 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000540750707 1025926177 /nfs/dbraw/zinc/92/61/77/1025926177.db2.gz MSGJJOXPVSQWQJ-ZDUSSCGKSA-N 1 0 340.379 3.972 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000451414559 1025949267 /nfs/dbraw/zinc/94/92/67/1025949267.db2.gz DKUJGGWMKARFBU-AWEZNQCLSA-N 1 0 332.404 3.949 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(N2CCCC2)n1 ZINC000611591853 1026014473 /nfs/dbraw/zinc/01/44/73/1026014473.db2.gz NQOSKKXVEIQTGA-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO CCc1cc(CCC[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)on1 ZINC000451543208 1026090796 /nfs/dbraw/zinc/09/07/96/1026090796.db2.gz BIEBIXJSJRVTDP-MRXNPFEDSA-N 1 0 343.427 3.957 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000530663483 1026177800 /nfs/dbraw/zinc/17/78/00/1026177800.db2.gz OWBOTJYPFXFRAD-LJQANCHMSA-N 1 0 325.412 3.696 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCCN(c2ccccc2)C1 ZINC000530663481 1026178073 /nfs/dbraw/zinc/17/80/73/1026178073.db2.gz OWBOTJYPFXFRAD-IBGZPJMESA-N 1 0 325.412 3.696 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2cccs2)on1 ZINC000511120016 1026205075 /nfs/dbraw/zinc/20/50/75/1026205075.db2.gz GUSWATXGEAKDGV-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000137512856 1026369483 /nfs/dbraw/zinc/36/94/83/1026369483.db2.gz KNTSUMGVDXLVHI-GJZGRUSLSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000452094865 1026473169 /nfs/dbraw/zinc/47/31/69/1026473169.db2.gz VRAQQDMVMLQIGW-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1cccc(C[C@@H](CO)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000466909862 1026565131 /nfs/dbraw/zinc/56/51/31/1026565131.db2.gz BCSZUTXKVBGQAR-SFHVURJKSA-N 1 0 342.439 3.720 20 5 EHBDRO CC[C@H](C)COc1cc([N+](=O)[O-])c(C[N@@H+]2CC[C@@H](C)C2)cc1OC ZINC001167602808 1027008894 /nfs/dbraw/zinc/00/88/94/1027008894.db2.gz QFMDWKXLGQLWAC-UONOGXRCSA-N 1 0 336.432 3.870 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000413172859 1027212565 /nfs/dbraw/zinc/21/25/65/1027212565.db2.gz GCZXUORFIXRFPA-UKRRQHHQSA-N 1 0 344.390 3.594 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531692811 1027243630 /nfs/dbraw/zinc/24/36/30/1027243630.db2.gz IHCGPVSXKWDFNP-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@H](O)C(F)(F)F)C1 ZINC000277845606 1027250046 /nfs/dbraw/zinc/25/00/46/1027250046.db2.gz SMMASRNHWLXDDK-ZOWXZIJZSA-N 1 0 346.349 3.599 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000531724498 1027272469 /nfs/dbraw/zinc/27/24/69/1027272469.db2.gz FIUAGSLUNASCLI-KCYZZUKISA-N 1 0 345.443 3.870 20 5 EHBDRO Cc1cc(N2CCC[C@@]3(CC[NH2+]C3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000420250999 1027430176 /nfs/dbraw/zinc/43/01/76/1027430176.db2.gz KLNSZYDRMVHFPJ-HNNXBMFYSA-N 1 0 343.349 3.502 20 5 EHBDRO CC(C)[NH+]1CCC(Oc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001225606994 1027508117 /nfs/dbraw/zinc/50/81/17/1027508117.db2.gz OYKLIPNWYAVVLM-UHFFFAOYSA-N 1 0 343.221 3.609 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@@H]([NH+]3CCCCC3)C2)cc1[N+](=O)[O-] ZINC000513732514 1027859011 /nfs/dbraw/zinc/85/90/11/1027859011.db2.gz GUGYUXGNYNPXDD-QGZVFWFLSA-N 1 0 331.460 3.778 20 5 EHBDRO CC[C@@H]1CCCCN1C(=O)[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178681144 1027868265 /nfs/dbraw/zinc/86/82/65/1027868265.db2.gz KLEXPDKRAPYGJK-YQQAZPJKSA-N 1 0 347.459 3.733 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2ncccc2c1[N+](=O)[O-] ZINC001167624556 1027909199 /nfs/dbraw/zinc/90/91/99/1027909199.db2.gz ATUCYXMLJYJQKX-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174576 1027912682 /nfs/dbraw/zinc/91/26/82/1027912682.db2.gz IUNWSAUQCFZRMA-CJNGLKHVSA-N 1 0 330.359 3.948 20 5 EHBDRO CC[C@](O)(CCC(F)(F)F)C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000897519345 1028033040 /nfs/dbraw/zinc/03/30/40/1028033040.db2.gz RDXGZUFBQCDYQV-HIFRSBDPSA-N 1 0 346.349 3.655 20 5 EHBDRO O=C(CCC[NH2+]Cc1ccc([N+](=O)[O-])cc1)Nc1ccc(Cl)cc1 ZINC000069833600 1028035138 /nfs/dbraw/zinc/03/51/38/1028035138.db2.gz OEMAPDHPBRRHDM-UHFFFAOYSA-N 1 0 347.802 3.757 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@@H]2CCCN(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407727 1028073627 /nfs/dbraw/zinc/07/36/27/1028073627.db2.gz ZFDRGSCLYMENOR-BEFAXECRSA-N 1 0 343.427 3.523 20 5 EHBDRO CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496888 1028085771 /nfs/dbraw/zinc/08/57/71/1028085771.db2.gz TUFRHUSGOXDCPR-DOTOQJQBSA-N 1 0 344.390 3.766 20 5 EHBDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636457 1028087277 /nfs/dbraw/zinc/08/72/77/1028087277.db2.gz DIKBJSFOCJYLQY-AWEZNQCLSA-N 1 0 338.411 3.843 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCOCC2 ZINC000248992744 1028161964 /nfs/dbraw/zinc/16/19/64/1028161964.db2.gz LJWJOSPUCDWIJR-FHLIZLRMSA-N 1 0 348.443 3.528 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144925 1028206980 /nfs/dbraw/zinc/20/69/80/1028206980.db2.gz IITODWJQSXXXPY-YJLNNSPDSA-N 1 0 325.412 3.739 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCC[C@H](C(C)C)C1 ZINC000444749215 1028237187 /nfs/dbraw/zinc/23/71/87/1028237187.db2.gz QOPYCIOTSDTLHZ-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263494 1028300496 /nfs/dbraw/zinc/30/04/96/1028300496.db2.gz ONIYCTQSCNLKDS-BBRMVZONSA-N 1 0 335.448 3.552 20 5 EHBDRO Cc1c(Cl)c(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nn1C ZINC000421387119 1028361322 /nfs/dbraw/zinc/36/13/22/1028361322.db2.gz SWOMULXEZTYQLA-AWEZNQCLSA-N 1 0 348.834 3.670 20 5 EHBDRO C[C@@]1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338931 1028373206 /nfs/dbraw/zinc/37/32/06/1028373206.db2.gz LFFWKPYINQUKJN-WOJBJXKFSA-N 1 0 339.439 3.664 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCSC[C@H]2c2ccccc2)cc1 ZINC000523790737 1028606195 /nfs/dbraw/zinc/60/61/95/1028606195.db2.gz XHMRWTWFJFHRRD-SFHVURJKSA-N 1 0 344.436 3.764 20 5 EHBDRO CC[C@H](Cc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424340328 1029018167 /nfs/dbraw/zinc/01/81/67/1029018167.db2.gz GDRSAKBMOOTYPC-CQSZACIVSA-N 1 0 344.415 3.832 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1[N+](=O)[O-] ZINC000504900221 1029026211 /nfs/dbraw/zinc/02/62/11/1029026211.db2.gz UDQIPQIYWRMXJB-KSSFIOAISA-N 1 0 338.448 3.831 20 5 EHBDRO CC[NH+](CC)CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000088734453 1029036088 /nfs/dbraw/zinc/03/60/88/1029036088.db2.gz YTQHEOMSYSFPAY-UHFFFAOYSA-N 1 0 333.251 3.791 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895987 1029043065 /nfs/dbraw/zinc/04/30/65/1029043065.db2.gz WQJPLFVKAOLWEM-CVEARBPZSA-N 1 0 349.475 3.765 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(C)[C@H](C)C1 ZINC000504920103 1029045730 /nfs/dbraw/zinc/04/57/30/1029045730.db2.gz NDIKXVVYSGJAEK-KFWWJZLASA-N 1 0 337.489 3.538 20 5 EHBDRO Cc1cc(C[NH3+])cc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000424435592 1029076687 /nfs/dbraw/zinc/07/66/87/1029076687.db2.gz LBKYKYXQXRHAHF-CYBMUJFWSA-N 1 0 342.399 3.553 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000532970069 1029119703 /nfs/dbraw/zinc/11/97/03/1029119703.db2.gz UKWAFLRJDVOPSI-CQSZACIVSA-N 1 0 339.823 3.697 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccsc1 ZINC000079871784 1029360634 /nfs/dbraw/zinc/36/06/34/1029360634.db2.gz JHJAFZXCRMAUDT-MRXNPFEDSA-N 1 0 342.424 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H](CO)c1ccccc1 ZINC000513828860 1029528336 /nfs/dbraw/zinc/52/83/36/1029528336.db2.gz QVVRQNNWCZEGAY-WDSOQIARSA-N 1 0 340.423 3.629 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122506 1029694897 /nfs/dbraw/zinc/69/48/97/1029694897.db2.gz IIDXBUDFIRTVRO-ZDUSSCGKSA-N 1 0 349.456 3.994 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000282059897 1029721246 /nfs/dbraw/zinc/72/12/46/1029721246.db2.gz MOUVGIPNKBJTIM-MRXNPFEDSA-N 1 0 340.427 3.507 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc(F)cc1[N+](=O)[O-] ZINC000525357042 1029809140 /nfs/dbraw/zinc/80/91/40/1029809140.db2.gz CVDDRSUYKHGXJL-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](OCC)c1ccccc1 ZINC000446836208 1029815814 /nfs/dbraw/zinc/81/58/14/1029815814.db2.gz SRWQPJGKOANARJ-IBGZPJMESA-N 1 0 344.411 3.861 20 5 EHBDRO CCC[C@@H](Cc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446842582 1029823938 /nfs/dbraw/zinc/82/39/38/1029823938.db2.gz XGOMDEZEZACVRP-HNNXBMFYSA-N 1 0 338.411 3.972 20 5 EHBDRO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525409446 1029840401 /nfs/dbraw/zinc/84/04/01/1029840401.db2.gz ZWWZRGJZHAADCE-OLMNPRSZSA-N 1 0 348.443 3.629 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756397 1029905732 /nfs/dbraw/zinc/90/57/32/1029905732.db2.gz NBDYRMSMXFYLAL-GDBMZVCRSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CCCCC2(F)F)n1 ZINC000453241028 1029917216 /nfs/dbraw/zinc/91/72/16/1029917216.db2.gz CXVBGLDDQSXXIU-BFHYXJOUSA-N 1 0 342.390 3.690 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2CCCCC2(F)F)n1 ZINC000453241035 1029918381 /nfs/dbraw/zinc/91/83/81/1029918381.db2.gz CXVBGLDDQSXXIU-MGPQQGTHSA-N 1 0 342.390 3.690 20 5 EHBDRO Cc1c(C[NH2+][C@@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000429707701 1029959935 /nfs/dbraw/zinc/95/99/35/1029959935.db2.gz BOUMMRSZCABGLO-SFHVURJKSA-N 1 0 328.412 3.753 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453263929 1029998318 /nfs/dbraw/zinc/99/83/18/1029998318.db2.gz VFCKEGIKTONELZ-WCQYABFASA-N 1 0 334.338 3.911 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@H](C)CCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453284388 1030026354 /nfs/dbraw/zinc/02/63/54/1030026354.db2.gz WBJHFFPPFASJSN-KUHUBIRLSA-N 1 0 346.427 3.838 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000192911159 1030036173 /nfs/dbraw/zinc/03/61/73/1030036173.db2.gz NOKQVKPYKYYNQA-KRWDZBQOSA-N 1 0 342.395 3.997 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@H](C)n2ccnc21 ZINC000453345460 1030131019 /nfs/dbraw/zinc/13/10/19/1030131019.db2.gz KAGZHGNDHCAWKS-MJBXVCDLSA-N 1 0 346.456 3.958 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CC1 ZINC000159425115 1030197599 /nfs/dbraw/zinc/19/75/99/1030197599.db2.gz PIXLQCCWHHSVPZ-UHFFFAOYSA-N 1 0 327.222 3.978 20 5 EHBDRO CCC1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)COC1 ZINC000453365935 1030183417 /nfs/dbraw/zinc/18/34/17/1030183417.db2.gz LWQHXGCJURDHGL-SFHVURJKSA-N 1 0 326.396 3.700 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367741 1030183477 /nfs/dbraw/zinc/18/34/77/1030183477.db2.gz MKRZPQMBHNLCGY-QRFRQXIXSA-N 1 0 344.455 3.809 20 5 EHBDRO Cc1cc(C)cc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447540246 1030275353 /nfs/dbraw/zinc/27/53/53/1030275353.db2.gz IYQTUHVFLGCITJ-ROUUACIJSA-N 1 0 342.443 3.724 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000245880907 1030278247 /nfs/dbraw/zinc/27/82/47/1030278247.db2.gz NQERNQCGGRZCJV-ATCWAGBWSA-N 1 0 330.388 3.559 20 5 EHBDRO CCc1ccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000447546230 1030280218 /nfs/dbraw/zinc/28/02/18/1030280218.db2.gz UGOLLQOSVMTLOR-GJZGRUSLSA-N 1 0 334.445 3.689 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCCO1 ZINC000482286606 1030307609 /nfs/dbraw/zinc/30/76/09/1030307609.db2.gz HAWNXVDHYGHUJC-HNNXBMFYSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1c[nH]c3ncccc13)CCC2 ZINC000447588491 1030324376 /nfs/dbraw/zinc/32/43/76/1030324376.db2.gz UOPQFIPXRQTHAX-GOSISDBHSA-N 1 0 336.395 3.681 20 5 EHBDRO CC1(C)CCC[C@]1(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000583637539 1030340154 /nfs/dbraw/zinc/34/01/54/1030340154.db2.gz YYBTYAOXLYTFIM-IBGZPJMESA-N 1 0 344.411 3.886 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CC2CCCCC2)CC1 ZINC000441284661 1030365320 /nfs/dbraw/zinc/36/53/20/1030365320.db2.gz WYCLEHRSPWHANT-MRXNPFEDSA-N 1 0 331.460 3.854 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000472297619 1030379999 /nfs/dbraw/zinc/37/99/99/1030379999.db2.gz WBIXLBSAGRSCPS-CYBMUJFWSA-N 1 0 329.400 3.913 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865356 1030396175 /nfs/dbraw/zinc/39/61/75/1030396175.db2.gz LXZZZZREEDBHIW-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000532210598 1030481578 /nfs/dbraw/zinc/48/15/78/1030481578.db2.gz HIBGJRWMLJVOTB-HUUCEWRRSA-N 1 0 325.412 3.697 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475691256 1030588017 /nfs/dbraw/zinc/58/80/17/1030588017.db2.gz GHNMILYFGPUNRQ-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243073 1030732072 /nfs/dbraw/zinc/73/20/72/1030732072.db2.gz MTEQUISHTPKSTK-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC[NH+](C2CCCC2)CC1 ZINC000160481052 1030787507 /nfs/dbraw/zinc/78/75/07/1030787507.db2.gz UHZQRHRWSUUHOS-OAHLLOKOSA-N 1 0 331.460 3.961 20 5 EHBDRO COc1ccc(OCC[N@@H+]2C[C@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073330 1030939625 /nfs/dbraw/zinc/93/96/25/1030939625.db2.gz XVXJDYUZOQPIGB-LIRRHRJNSA-N 1 0 342.395 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCc1nc(C(C)C)no1 ZINC000160795321 1031021560 /nfs/dbraw/zinc/02/15/60/1031021560.db2.gz MWRLHKMXWYWVNF-ZDUSSCGKSA-N 1 0 332.404 3.693 20 5 EHBDRO C[N@H+](CC[C@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000343480813 1031064416 /nfs/dbraw/zinc/06/44/16/1031064416.db2.gz ZWIBCAIETKYGFA-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO CCc1cnc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130425287 1031168541 /nfs/dbraw/zinc/16/85/41/1031168541.db2.gz RBRGPCFVHIFYJZ-OAHLLOKOSA-N 1 0 331.441 3.725 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000161104598 1031319365 /nfs/dbraw/zinc/31/93/65/1031319365.db2.gz JADVHWSIPTVMAQ-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090943 1031322680 /nfs/dbraw/zinc/32/26/80/1031322680.db2.gz GCKGMQDGBRQKRP-PNPHSEOMSA-N 1 0 330.359 3.915 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)Cc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000026223915 1031388072 /nfs/dbraw/zinc/38/80/72/1031388072.db2.gz CSLFYIAGTYRYGO-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477516167 1031623237 /nfs/dbraw/zinc/62/32/37/1031623237.db2.gz YDJVGTKOHKJVKL-MRXNPFEDSA-N 1 0 326.352 3.661 20 5 EHBDRO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737964 1031703828 /nfs/dbraw/zinc/70/38/28/1031703828.db2.gz HERGFMCDWSRMQA-JHJVBQTASA-N 1 0 330.388 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](CCO)c1ccccc1)CCC2 ZINC000278662886 1031873976 /nfs/dbraw/zinc/87/39/76/1031873976.db2.gz ITSSXHAUFQRXJQ-MOPGFXCFSA-N 1 0 326.396 3.686 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898071953 1033324317 /nfs/dbraw/zinc/32/43/17/1033324317.db2.gz VNRSXUGSAJGJDY-MFBWXBCUSA-N 1 0 329.425 3.629 20 5 EHBDRO Cc1cnc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000594508169 1033391516 /nfs/dbraw/zinc/39/15/16/1033391516.db2.gz BLISCWQNAPXWDI-IBGZPJMESA-N 1 0 339.439 3.760 20 5 EHBDRO COC(=O)c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000594500813 1033401872 /nfs/dbraw/zinc/40/18/72/1033401872.db2.gz BECUAGHVIQQEMO-QGZVFWFLSA-N 1 0 340.379 3.549 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502850 1033404362 /nfs/dbraw/zinc/40/43/62/1033404362.db2.gz QVDDHXUBJLVJEW-HZPDHXFCSA-N 1 0 340.379 3.704 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000594515333 1033423233 /nfs/dbraw/zinc/42/32/33/1033423233.db2.gz NVDXIIWDWBHGQH-JTDSTZFVSA-N 1 0 339.439 3.922 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000594614741 1033477757 /nfs/dbraw/zinc/47/77/57/1033477757.db2.gz JWMLRAZKXKHOLW-LBPRGKRZSA-N 1 0 332.425 3.669 20 5 EHBDRO COCc1cccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000179241348 1033492505 /nfs/dbraw/zinc/49/25/05/1033492505.db2.gz UOLOINGDDOHJLW-UHFFFAOYSA-N 1 0 326.396 3.906 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292783 1033556297 /nfs/dbraw/zinc/55/62/97/1033556297.db2.gz NEMYBXOUWMBCEA-RDJZCZTQSA-N 1 0 346.456 3.570 20 5 EHBDRO C[C@@]1(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1(F)F ZINC000594978649 1033581263 /nfs/dbraw/zinc/58/12/63/1033581263.db2.gz USRLBZZUMHIMSF-CYBMUJFWSA-N 1 0 336.285 3.721 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000595020174 1033611201 /nfs/dbraw/zinc/61/12/01/1033611201.db2.gz VJRHPSRTIHJJPJ-YJYMSZOUSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C(F)F)nc2)cc1[N+](=O)[O-] ZINC000595017917 1033612010 /nfs/dbraw/zinc/61/20/10/1033612010.db2.gz XKSBYWXPPWVECD-SNVBAGLBSA-N 1 0 337.326 3.787 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000594986230 1033620255 /nfs/dbraw/zinc/62/02/55/1033620255.db2.gz UMEVLBBIXNOVHE-WBMJQRKESA-N 1 0 347.440 3.766 20 5 EHBDRO CCOc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595008118 1033629867 /nfs/dbraw/zinc/62/98/67/1033629867.db2.gz AEXBJRRGANRKLY-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CO[C@H](C4CC4)C3)o2)cc1 ZINC000599007610 1033640055 /nfs/dbraw/zinc/64/00/55/1033640055.db2.gz QPLRZCUXFOCPRO-KDOFPFPSSA-N 1 0 328.368 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C)c1nc(C)cs1 ZINC000595032013 1033653102 /nfs/dbraw/zinc/65/31/02/1033653102.db2.gz LCAVIGHTWWIZNH-JQWIXIFHSA-N 1 0 335.429 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C)c1nc(C)cs1 ZINC000595032014 1033653553 /nfs/dbraw/zinc/65/35/53/1033653553.db2.gz LCAVIGHTWWIZNH-PWSUYJOCSA-N 1 0 335.429 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCO[C@H](C(C)(C)C)C1 ZINC000595035519 1033655575 /nfs/dbraw/zinc/65/55/75/1033655575.db2.gz LCQJPOOKKPIQDM-DCGLDWPTSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000595035691 1033655999 /nfs/dbraw/zinc/65/59/99/1033655999.db2.gz LCQJPOOKKPIQDM-GDZNZVCISA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000595036175 1033658483 /nfs/dbraw/zinc/65/84/83/1033658483.db2.gz QBDCSNNACBSUJF-SGTLLEGYSA-N 1 0 327.384 3.800 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1ncc(C)cc1C ZINC000595046704 1033665686 /nfs/dbraw/zinc/66/56/86/1033665686.db2.gz NILCKYRHCIQSMM-AWEZNQCLSA-N 1 0 329.400 3.509 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599019260 1033668160 /nfs/dbraw/zinc/66/81/60/1033668160.db2.gz CRISEDJTJZXVDK-SFHVURJKSA-N 1 0 327.384 3.548 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(C(F)(F)F)cnn1C ZINC000599061022 1033700357 /nfs/dbraw/zinc/70/03/57/1033700357.db2.gz NBKJOTLCXLPHKJ-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 ZINC000599075097 1033717068 /nfs/dbraw/zinc/71/70/68/1033717068.db2.gz SRYRARNGRWQEQA-WMZOPIPTSA-N 1 0 339.395 3.589 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000595370196 1033784889 /nfs/dbraw/zinc/78/48/89/1033784889.db2.gz DIDTYRKSVUZDRY-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO CCc1ccc([C@@H]2CCC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2)cc1 ZINC000595481786 1033807709 /nfs/dbraw/zinc/80/77/09/1033807709.db2.gz AVXGCRKHHIQODY-MRXNPFEDSA-N 1 0 329.400 3.833 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](C1CC1)C1CCOCC1)CCC2 ZINC000593714761 1033820768 /nfs/dbraw/zinc/82/07/68/1033820768.db2.gz AMVMKYOULKIRQO-RBUKOAKNSA-N 1 0 330.428 3.767 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC([NH2+]Cc2ccccc2)CC1 ZINC000595512691 1033836712 /nfs/dbraw/zinc/83/67/12/1033836712.db2.gz ZQXZUJWONZAZGV-MRXNPFEDSA-N 1 0 339.439 3.910 20 5 EHBDRO CCC(O)(CC)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000102425583 1033839576 /nfs/dbraw/zinc/83/95/76/1033839576.db2.gz WXEUTHJKCNLTEL-UHFFFAOYSA-N 1 0 348.399 3.504 20 5 EHBDRO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@H]1COc2ccccc2O1 ZINC000603838771 1033950847 /nfs/dbraw/zinc/95/08/47/1033950847.db2.gz HWYGQQXPKVOZCW-INIZCTEOSA-N 1 0 342.395 3.565 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000603859569 1033985358 /nfs/dbraw/zinc/98/53/58/1033985358.db2.gz CHFJCKHRSGXOMX-GASCZTMLSA-N 1 0 342.443 3.923 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2(C)C)c1[N+](=O)[O-] ZINC000599630711 1034055848 /nfs/dbraw/zinc/05/58/48/1034055848.db2.gz UWUDZXQGHKNUBJ-CQSZACIVSA-N 1 0 333.363 3.798 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C2CC2)cn1 ZINC000599695601 1034100299 /nfs/dbraw/zinc/10/02/99/1034100299.db2.gz DOQLEMXNDCORFJ-KRWDZBQOSA-N 1 0 347.802 3.893 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000604012698 1034135021 /nfs/dbraw/zinc/13/50/21/1034135021.db2.gz SWEIBASRFWZULU-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CC[N@@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596307889 1034162773 /nfs/dbraw/zinc/16/27/73/1034162773.db2.gz QDUZMCHGAHCXLB-CYBMUJFWSA-N 1 0 333.432 3.720 20 5 EHBDRO CCCC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@@H](C)c1ccccc1 ZINC000534133314 1034176519 /nfs/dbraw/zinc/17/65/19/1034176519.db2.gz FEFCJTOFZYSFLD-INIZCTEOSA-N 1 0 343.427 3.620 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000612131510 1034218038 /nfs/dbraw/zinc/21/80/38/1034218038.db2.gz YLIKWORNXGXJFS-MRXNPFEDSA-N 1 0 348.443 3.631 20 5 EHBDRO CCOc1cc(NCC2CC[NH+](CC3CC3)CC2)ccc1[N+](=O)[O-] ZINC000596561478 1034290331 /nfs/dbraw/zinc/29/03/31/1034290331.db2.gz DBPCLHLBNRLSGW-UHFFFAOYSA-N 1 0 333.432 3.527 20 5 EHBDRO CCOc1cccc(NCC2CC[NH+](CC3CC3)CC2)c1[N+](=O)[O-] ZINC000596562673 1034290371 /nfs/dbraw/zinc/29/03/71/1034290371.db2.gz NLUPQCGZLCCMGS-UHFFFAOYSA-N 1 0 333.432 3.527 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)c3ccc([N+](=O)[O-])cc3F)ccc21 ZINC000456283445 1034304747 /nfs/dbraw/zinc/30/47/47/1034304747.db2.gz SSGGTIUVHHJAOW-KRWDZBQOSA-N 1 0 343.358 3.535 20 5 EHBDRO CCN(CCC[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000061559353 1034347528 /nfs/dbraw/zinc/34/75/28/1034347528.db2.gz AAIGNGLKGHLVGO-UHFFFAOYSA-N 1 0 327.428 3.909 20 5 EHBDRO O=[N+]([O-])c1ncccc1NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000604508554 1034406333 /nfs/dbraw/zinc/40/63/33/1034406333.db2.gz GWOWTHFCUJJGJU-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+][C@@]2(C)CCOC2)cc1[N+](=O)[O-] ZINC000534455288 1034578885 /nfs/dbraw/zinc/57/88/85/1034578885.db2.gz LNIOGCAJUJUDLT-IBGZPJMESA-N 1 0 341.411 3.631 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCOc2ccc(O)cc2C1 ZINC000597232759 1034613059 /nfs/dbraw/zinc/61/30/59/1034613059.db2.gz WWWXWLHJKCQHDP-ZROIWOOFSA-N 1 0 340.379 3.598 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)c2ccccc2)c1 ZINC000251436046 1034646372 /nfs/dbraw/zinc/64/63/72/1034646372.db2.gz AVFBLVKAOMQSFP-MTQWCTHYSA-N 1 0 338.407 3.841 20 5 EHBDRO Cc1cccc(Cl)c1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000450875672 1034904089 /nfs/dbraw/zinc/90/40/89/1034904089.db2.gz GBCYCDWJXYNAFG-UHFFFAOYSA-N 1 0 334.807 3.590 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000167501486 1034939323 /nfs/dbraw/zinc/93/93/23/1034939323.db2.gz KGDZGDHGYZQDTE-OCCSQVGLSA-N 1 0 347.365 3.803 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC2(CCOCC2)[C@H]1C ZINC000612540180 1035044169 /nfs/dbraw/zinc/04/41/69/1035044169.db2.gz CBNNNOBZJPTFAT-OAHLLOKOSA-N 1 0 348.443 3.773 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc3c(c2)CCC(=O)N3)cccc1[N+](=O)[O-] ZINC000180004628 1035173519 /nfs/dbraw/zinc/17/35/19/1035173519.db2.gz JUKALHRMVIQIBC-CYBMUJFWSA-N 1 0 339.395 3.639 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000180042360 1035253864 /nfs/dbraw/zinc/25/38/64/1035253864.db2.gz ZORIYJUMPFODJC-UHFFFAOYSA-N 1 0 326.400 3.627 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540617673 1035507504 /nfs/dbraw/zinc/50/75/04/1035507504.db2.gz YDMKOOGMWOJDRA-DZGCQCFKSA-N 1 0 332.400 3.742 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000414102274 1035508531 /nfs/dbraw/zinc/50/85/31/1035508531.db2.gz XGTXPPDAUZMEML-KBPBESRZSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1cc(C[N@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])cc1F ZINC000463484350 1035551185 /nfs/dbraw/zinc/55/11/85/1035551185.db2.gz MCOFMUVYKJWUHH-UHFFFAOYSA-N 1 0 336.338 3.556 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CSc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000571761244 1035623832 /nfs/dbraw/zinc/62/38/32/1035623832.db2.gz CNTHVQUVMYBDLJ-DOMZBBRYSA-N 1 0 330.409 3.799 20 5 EHBDRO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000463561576 1035629697 /nfs/dbraw/zinc/62/96/97/1035629697.db2.gz BGELBQXTDJNEQE-ZCGYKAAXSA-N 1 0 326.396 3.993 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164525978 1035653376 /nfs/dbraw/zinc/65/33/76/1035653376.db2.gz KHVVKDNCTPWAQD-DZGCQCFKSA-N 1 0 349.431 3.563 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000540789165 1035683219 /nfs/dbraw/zinc/68/32/19/1035683219.db2.gz MWMVCGJOAUOAOG-OXXUSNJHSA-N 1 0 330.428 3.902 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@H](CO)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000588231257 1035829645 /nfs/dbraw/zinc/82/96/45/1035829645.db2.gz ZBKXUDLTYYHPFY-KXBFYZLASA-N 1 0 346.427 3.694 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000582577706 1035973491 /nfs/dbraw/zinc/97/34/91/1035973491.db2.gz WMUWAKFQLPQYBY-KYJSFNMBSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 ZINC000056196792 1036140438 /nfs/dbraw/zinc/14/04/38/1036140438.db2.gz MWZQCSAKVFBDGL-GJZGRUSLSA-N 1 0 345.443 3.641 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(C3CCC3)CC2)ccc1Br ZINC000697397569 1036213151 /nfs/dbraw/zinc/21/31/51/1036213151.db2.gz BDTZGFBDFIWEOZ-UHFFFAOYSA-N 1 0 325.206 3.780 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](O)C1CC1 ZINC000589197907 1036303271 /nfs/dbraw/zinc/30/32/71/1036303271.db2.gz APKPXVZOYXLAPY-MRXNPFEDSA-N 1 0 332.425 3.526 20 5 EHBDRO CCOC(=O)c1ccc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)o1 ZINC000589197478 1036304289 /nfs/dbraw/zinc/30/42/89/1036304289.db2.gz KNEKCFDIJCVQDQ-UKTHLTGXSA-N 1 0 344.367 3.558 20 5 EHBDRO C[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCCCC1 ZINC000030971742 1036330610 /nfs/dbraw/zinc/33/06/10/1036330610.db2.gz VLDXBWTZHBWVLH-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(CN(C)Cc2cccc(Cl)c2)c1 ZINC000589495387 1036436983 /nfs/dbraw/zinc/43/69/83/1036436983.db2.gz VLGLBYSRCJRYDF-UHFFFAOYSA-N 1 0 348.786 3.667 20 5 EHBDRO O=[N+]([O-])c1sccc1NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000609132774 1036468797 /nfs/dbraw/zinc/46/87/97/1036468797.db2.gz QFNJWBMXHRBTTE-HNNXBMFYSA-N 1 0 331.441 3.633 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](n2cc(Cl)cn2)C1 ZINC000589519799 1036487518 /nfs/dbraw/zinc/48/75/18/1036487518.db2.gz ANUWUELLRUGZPY-FUIJVIPGSA-N 1 0 346.818 3.795 20 5 EHBDRO C[C@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000170914139 1036494892 /nfs/dbraw/zinc/49/48/92/1036494892.db2.gz IOZADILFLUJVGL-AWEZNQCLSA-N 1 0 329.400 3.914 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000165640433 1036661991 /nfs/dbraw/zinc/66/19/91/1036661991.db2.gz JOEJQCJQVUTLTG-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CC[C@@](O)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000589950081 1036677015 /nfs/dbraw/zinc/67/70/15/1036677015.db2.gz UBEDLIUIXYWYDC-SNPRPXQTSA-N 1 0 346.349 3.872 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1CO ZINC000191179488 1036696832 /nfs/dbraw/zinc/69/68/32/1036696832.db2.gz JEGGOZVALSRULW-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180416244 1036774927 /nfs/dbraw/zinc/77/49/27/1036774927.db2.gz BJOSHONSNPBEHN-AWEZNQCLSA-N 1 0 336.395 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCCC[C@@H]2CCO)c1 ZINC000590180599 1036790129 /nfs/dbraw/zinc/79/01/29/1036790129.db2.gz LDQPXJAIFDMYAI-CYBMUJFWSA-N 1 0 346.349 3.741 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000539491135 1036808915 /nfs/dbraw/zinc/80/89/15/1036808915.db2.gz KNESJGAVOQJSNE-HNNXBMFYSA-N 1 0 333.432 3.872 20 5 EHBDRO COc1cccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1OC ZINC000165960045 1036817839 /nfs/dbraw/zinc/81/78/39/1036817839.db2.gz KFOFSIKJMZVUKA-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000414349212 1036849646 /nfs/dbraw/zinc/84/96/46/1036849646.db2.gz PARTVEGLXSIZMP-PBHICJAKSA-N 1 0 343.402 3.533 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C)C[C@H](C)C1 ZINC000443663759 1036978285 /nfs/dbraw/zinc/97/82/85/1036978285.db2.gz YVLVVXCRERNYMZ-KBPBESRZSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524446 1037093459 /nfs/dbraw/zinc/09/34/59/1037093459.db2.gz CZEUSYNOJDTJTF-WBMJQRKESA-N 1 0 334.803 3.502 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163395832 1037095042 /nfs/dbraw/zinc/09/50/42/1037095042.db2.gz OIDDBNWMHYVZHX-DOMZBBRYSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1ccc(-c2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206328 1037125628 /nfs/dbraw/zinc/12/56/28/1037125628.db2.gz WFRXGZGNSDPHSO-FRRDWIJNSA-N 1 0 330.388 3.887 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000493385480 1037309659 /nfs/dbraw/zinc/30/96/59/1037309659.db2.gz MGUHHDZIIDKNQQ-UHFFFAOYSA-N 1 0 333.432 3.662 20 5 EHBDRO CC(C)CC[C@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000472612206 1037385634 /nfs/dbraw/zinc/38/56/34/1037385634.db2.gz QTZWBQQEVYRCHA-CABCVRRESA-N 1 0 333.432 3.728 20 5 EHBDRO CCOCc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1 ZINC000575880969 1037436626 /nfs/dbraw/zinc/43/66/26/1037436626.db2.gz CDNPYNFIJIFLCB-SFHVURJKSA-N 1 0 326.396 3.908 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000152641800 1037445937 /nfs/dbraw/zinc/44/59/37/1037445937.db2.gz PGXVOZIMZJCGLE-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(OC(F)(F)F)cc2)cc1 ZINC000058093285 1037477213 /nfs/dbraw/zinc/47/72/13/1037477213.db2.gz SQICTCXPIWEFTO-UHFFFAOYSA-N 1 0 340.301 3.826 20 5 EHBDRO COC(=O)[C@@H](C)[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000177415284 1037521471 /nfs/dbraw/zinc/52/14/71/1037521471.db2.gz DAZLGBNQFLQYAC-KBXCAEBGSA-N 1 0 342.395 3.543 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000462903766 1037532597 /nfs/dbraw/zinc/53/25/97/1037532597.db2.gz BOMBTTVCNXAXSR-SFHVURJKSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000532518772 1037559127 /nfs/dbraw/zinc/55/91/27/1037559127.db2.gz UWNOFEHWLFBNRQ-LSDHHAIUSA-N 1 0 341.411 3.657 20 5 EHBDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000491661756 1037610416 /nfs/dbraw/zinc/61/04/16/1037610416.db2.gz JJJZSJPFPCGXHU-YOEHRIQHSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCNC(=O)CC1CCCCC1 ZINC000540186260 1037668859 /nfs/dbraw/zinc/66/88/59/1037668859.db2.gz PZECKFVFMDGLRQ-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC3(C2)CCCCC3)cccc1[N+](=O)[O-] ZINC000532576362 1037681719 /nfs/dbraw/zinc/68/17/19/1037681719.db2.gz AKMLKSBHJDRCMZ-HNNXBMFYSA-N 1 0 345.443 3.886 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000325663273 1037741550 /nfs/dbraw/zinc/74/15/50/1037741550.db2.gz NLNCBEDKHLYLAM-QGZVFWFLSA-N 1 0 328.416 3.793 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(CO)cc1 ZINC000592393172 1037934879 /nfs/dbraw/zinc/93/48/79/1037934879.db2.gz QPHYKMXENMQCQH-MRXNPFEDSA-N 1 0 346.452 3.748 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198795 1037944616 /nfs/dbraw/zinc/94/46/16/1037944616.db2.gz VEMHYIQHBODJLP-QGZVFWFLSA-N 1 0 332.400 3.616 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)[C@@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000540479658 1037991191 /nfs/dbraw/zinc/99/11/91/1037991191.db2.gz SLDORBLCEAGQJY-JLJPHGGASA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1cccc([C@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665181 1038500177 /nfs/dbraw/zinc/50/01/77/1038500177.db2.gz MXTWDYUMFMDDLD-HOCLYGCPSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1cc(NC[C@@H](C2CC2)[NH+](C)C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788119 1038610064 /nfs/dbraw/zinc/61/00/64/1038610064.db2.gz WHFSDPDYHYJLOG-AWEZNQCLSA-N 1 0 331.338 3.674 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477843979 1038949954 /nfs/dbraw/zinc/94/99/54/1038949954.db2.gz HGJYJXRPLOVDLB-JXFKEZNVSA-N 1 0 342.439 3.795 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCCC1 ZINC000477855848 1038964559 /nfs/dbraw/zinc/96/45/59/1038964559.db2.gz IZLXCYKKLQCUTI-AZUAARDMSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301453 1039086678 /nfs/dbraw/zinc/08/66/78/1039086678.db2.gz SDTQVNIZJGDDFK-OAHLLOKOSA-N 1 0 346.408 3.860 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852588 1039157919 /nfs/dbraw/zinc/15/79/19/1039157919.db2.gz JJMBAOCXCFRZDT-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000905853505 1039159038 /nfs/dbraw/zinc/15/90/38/1039159038.db2.gz RXTRETPABOGACJ-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000905852647 1039159118 /nfs/dbraw/zinc/15/91/18/1039159118.db2.gz LLLLHPVTUUUEJO-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])[nH]1 ZINC000488465421 1039206781 /nfs/dbraw/zinc/20/67/81/1039206781.db2.gz OHIZDSVDFHALTP-BFHYXJOUSA-N 1 0 345.447 3.898 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000570189657 1039261519 /nfs/dbraw/zinc/26/15/19/1039261519.db2.gz FKBQORGHIHZAQX-XSLAGTTESA-N 1 0 340.427 3.668 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H]1CC(C)(C)C ZINC000488687399 1039333756 /nfs/dbraw/zinc/33/37/56/1039333756.db2.gz ZPGZNLJVKWKDFJ-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000120267280 1039429863 /nfs/dbraw/zinc/42/98/63/1039429863.db2.gz LPCBHPOVZDDDJS-HNNXBMFYSA-N 1 0 347.802 3.588 20 5 EHBDRO CCOc1cccc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)c1 ZINC000554723292 1039645964 /nfs/dbraw/zinc/64/59/64/1039645964.db2.gz WWVNKRNPWLHAQP-UHFFFAOYSA-N 1 0 339.395 3.807 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cccc(CO)c1)CCCC2 ZINC000417312692 1039665807 /nfs/dbraw/zinc/66/58/07/1039665807.db2.gz ODTDKRMNAVTYNW-IBGZPJMESA-N 1 0 326.396 3.644 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC[C@@H](C)C1 ZINC000480613166 1039760008 /nfs/dbraw/zinc/76/00/08/1039760008.db2.gz MMCWZXDCVREWJW-JTDSTZFVSA-N 1 0 345.487 3.626 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1COc1ccc([C@H](C)[NH3+])cc1 ZINC000584776175 1039785608 /nfs/dbraw/zinc/78/56/08/1039785608.db2.gz KXJZYEMHXHGBMT-ZDUSSCGKSA-N 1 0 330.384 3.981 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298581 1039814647 /nfs/dbraw/zinc/81/46/47/1039814647.db2.gz WZEQYKDAVIBUKV-RYUDHWBXSA-N 1 0 341.839 3.943 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](Cc2ccccc2)CN(C)C)cc1[N+](=O)[O-] ZINC000480877126 1040123071 /nfs/dbraw/zinc/12/30/71/1040123071.db2.gz KMWMXUFDXYZVLE-QFBILLFUSA-N 1 0 341.455 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cccc(F)c3F)c2c1 ZINC000573477574 1040124152 /nfs/dbraw/zinc/12/41/52/1040124152.db2.gz IGKYGKMZGCTCPT-UHFFFAOYSA-N 1 0 331.322 3.687 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(Nc3ccc(F)cc3[N+](=O)[O-])cccc21 ZINC000432928685 1040200863 /nfs/dbraw/zinc/20/08/63/1040200863.db2.gz NWVHGAFAOWIHPY-HNNXBMFYSA-N 1 0 331.347 3.863 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481093931 1040349654 /nfs/dbraw/zinc/34/96/54/1040349654.db2.gz VJASSWJHYDEEQC-KGLIPLIRSA-N 1 0 333.432 3.728 20 5 EHBDRO C[C@@H]1C[C@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@@H+]1Cc1ccccc1 ZINC000511649214 1040400573 /nfs/dbraw/zinc/40/05/73/1040400573.db2.gz WCRKZIVYPNTJCS-WBVHZDCISA-N 1 0 340.427 3.702 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000481187224 1040452448 /nfs/dbraw/zinc/45/24/48/1040452448.db2.gz FTAMUCVNVSGJSQ-JGGQBBKZSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000490355376 1040523719 /nfs/dbraw/zinc/52/37/19/1040523719.db2.gz RVLZOBDLRYCXMO-KUHUBIRLSA-N 1 0 326.396 3.902 20 5 EHBDRO COCC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000555421067 1040557129 /nfs/dbraw/zinc/55/71/29/1040557129.db2.gz UBXDWZBRVSRZIG-UHFFFAOYSA-N 1 0 346.349 3.862 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(SC)CC1 ZINC000433069095 1040629148 /nfs/dbraw/zinc/62/91/48/1040629148.db2.gz RBJODVPZYUPJPN-GFCCVEGCSA-N 1 0 326.487 3.951 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(C)COC1 ZINC000600189641 1040798895 /nfs/dbraw/zinc/79/88/95/1040798895.db2.gz IIWAHLFKFZNEKZ-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO CCC[NH+]1CCC(N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433155871 1040938180 /nfs/dbraw/zinc/93/81/80/1040938180.db2.gz ZRXMXAKKYSYUOP-SFHVURJKSA-N 1 0 331.460 3.781 20 5 EHBDRO C[C@@H](COCC(F)(F)F)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433165007 1040953743 /nfs/dbraw/zinc/95/37/43/1040953743.db2.gz HCNAUDOAGVEAFI-HZMBPMFUSA-N 1 0 346.349 3.874 20 5 EHBDRO CCN(CC)C(=O)CCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433175619 1040976897 /nfs/dbraw/zinc/97/68/97/1040976897.db2.gz MPTMXRSOLXZZDI-KRWDZBQOSA-N 1 0 347.459 3.555 20 5 EHBDRO COCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCSC1 ZINC000433192870 1041039823 /nfs/dbraw/zinc/03/98/23/1041039823.db2.gz NIPYQCVJOWFMTD-CQSZACIVSA-N 1 0 344.864 3.592 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000433203875 1041059947 /nfs/dbraw/zinc/05/99/47/1041059947.db2.gz DEFMNVJFTSMFQZ-KRWDZBQOSA-N 1 0 345.374 3.731 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCc3cccc([N+](=O)[O-])c3)cccc21 ZINC000433205134 1041060800 /nfs/dbraw/zinc/06/08/00/1041060800.db2.gz JPWGXMFBLVWCCO-QGZVFWFLSA-N 1 0 327.384 3.592 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](CO)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433233677 1041122315 /nfs/dbraw/zinc/12/23/15/1041122315.db2.gz POJXNUQHAYCYIX-DNVCBOLYSA-N 1 0 340.423 3.510 20 5 EHBDRO CCC[C@](C)(CO)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000124082593 1041615908 /nfs/dbraw/zinc/61/59/08/1041615908.db2.gz FJHVGFPTQJFORI-GOSISDBHSA-N 1 0 348.399 3.504 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]Cc2csc(Br)c2)c1 ZINC000047892507 1042261833 /nfs/dbraw/zinc/26/18/33/1042261833.db2.gz XPBKNYIWQUXEAW-UHFFFAOYSA-N 1 0 327.203 3.709 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC000893492969 1042267642 /nfs/dbraw/zinc/26/76/42/1042267642.db2.gz VTNINXYAFXSJNP-CYBMUJFWSA-N 1 0 348.834 3.717 20 5 EHBDRO Cc1ccccc1[C@@H](C)[N@@H+](Cc1c([N+](=O)[O-])ncn1C)CC(C)C ZINC000342067409 1042801537 /nfs/dbraw/zinc/80/15/37/1042801537.db2.gz SITALTKDSACGOS-OAHLLOKOSA-N 1 0 330.432 3.856 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCNc3ccccc32)cc1[N+](=O)[O-] ZINC000278908605 1042905163 /nfs/dbraw/zinc/90/51/63/1042905163.db2.gz ZZJPYWVKWVBRTP-MRXNPFEDSA-N 1 0 327.384 3.640 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC3CC[NH+](C4CCCC4)CC3)ccnc21 ZINC000432326411 1042906109 /nfs/dbraw/zinc/90/61/09/1042906109.db2.gz BWJHRCLEJICFRN-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO Cc1ccc(Br)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000190299320 1042912216 /nfs/dbraw/zinc/91/22/16/1042912216.db2.gz RORXJAAASCWKJX-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO CCOC(CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)OCC ZINC000279010570 1043186370 /nfs/dbraw/zinc/18/63/70/1043186370.db2.gz GXKPKEYQUHJZNB-MRXNPFEDSA-N 1 0 336.432 3.696 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCCc2occc2C1 ZINC000344233002 1043490746 /nfs/dbraw/zinc/49/07/46/1043490746.db2.gz HEQMUEBXNGGQNV-UHFFFAOYSA-N 1 0 330.384 3.923 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898518 1043598934 /nfs/dbraw/zinc/59/89/34/1043598934.db2.gz YMKUBPLKMLTKQD-KDOFPFPSSA-N 1 0 328.416 3.926 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000344342318 1043690853 /nfs/dbraw/zinc/69/08/53/1043690853.db2.gz CWRAQAABAOESNC-UMVBOHGHSA-N 1 0 334.416 3.670 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C[C@H]2CCCCS2)c1 ZINC000344362179 1043741078 /nfs/dbraw/zinc/74/10/78/1043741078.db2.gz RRSOQLZQZJMCRX-GFCCVEGCSA-N 1 0 332.372 3.572 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542805 1044207593 /nfs/dbraw/zinc/20/75/93/1044207593.db2.gz QGJDBLKZLRGOQZ-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2c2cccc(Cl)c2)c1 ZINC000444792673 1127529633 /nfs/dbraw/zinc/52/96/33/1127529633.db2.gz FDTGEDXBUFABNB-MRXNPFEDSA-N 1 0 334.807 3.672 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000765331391 1127599103 /nfs/dbraw/zinc/59/91/03/1127599103.db2.gz BYKOQORFEQLLHY-LSDHHAIUSA-N 1 0 326.396 3.805 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765417879 1127608936 /nfs/dbraw/zinc/60/89/36/1127608936.db2.gz WFRIVPFCHCISTR-OAHLLOKOSA-N 1 0 325.412 3.617 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@@H](O)C34CCCC4)o2)c1 ZINC000552316937 1127749152 /nfs/dbraw/zinc/74/91/52/1127749152.db2.gz UQFHBRARUIUHOQ-GOSISDBHSA-N 1 0 342.395 3.734 20 5 EHBDRO Cc1ccnc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c1[N+](=O)[O-] ZINC000301545487 1128495800 /nfs/dbraw/zinc/49/58/00/1128495800.db2.gz OSLFSWVMLAQOJF-DOTOQJQBSA-N 1 0 340.427 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H](CC2CC2)c2ccccc2)cc1 ZINC000765845584 1128545249 /nfs/dbraw/zinc/54/52/49/1128545249.db2.gz QWJOPDIZOXKEDK-MOPGFXCFSA-N 1 0 326.396 3.759 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](C)[C@@H](C)C1 ZINC000123078930 1128562669 /nfs/dbraw/zinc/56/26/69/1128562669.db2.gz XWJJRVJVCAPJGK-AVGNSLFASA-N 1 0 330.388 3.684 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273502865 1128570690 /nfs/dbraw/zinc/57/06/90/1128570690.db2.gz POQQCRMTQAPXLJ-SJLPKXTDSA-N 1 0 330.359 3.744 20 5 EHBDRO CC[C@@H]([NH2+]C[C@]1(O)CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000765881481 1128637357 /nfs/dbraw/zinc/63/73/57/1128637357.db2.gz RPKZJYZFVGOLPK-WOJBJXKFSA-N 1 0 340.423 3.860 20 5 EHBDRO CO[C@](C)(C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000462801895 1128719336 /nfs/dbraw/zinc/71/93/36/1128719336.db2.gz DVCFRCPFOALLIO-LSBZLQRGSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1nc(NC[C@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000301627427 1128765197 /nfs/dbraw/zinc/76/51/97/1128765197.db2.gz HSGXPWOQXIOTCE-OAHLLOKOSA-N 1 0 330.388 3.530 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)C1 ZINC000338739710 1128803811 /nfs/dbraw/zinc/80/38/11/1128803811.db2.gz CVQMOFLISNROHZ-OAHLLOKOSA-N 1 0 343.349 3.536 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])c(C)n2)[NH+]2CCCC2)cc1 ZINC000301652106 1128848936 /nfs/dbraw/zinc/84/89/36/1128848936.db2.gz QKKSBOKFORGPTD-GOSISDBHSA-N 1 0 340.427 3.856 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000301661529 1128869361 /nfs/dbraw/zinc/86/93/61/1128869361.db2.gz UPZXIOFNNHEWJI-UHFFFAOYSA-N 1 0 340.427 3.683 20 5 EHBDRO Cc1nc(NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000301687897 1128914481 /nfs/dbraw/zinc/91/44/81/1128914481.db2.gz XLTWSAGWYOBJTN-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO Cc1ccnc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c1[N+](=O)[O-] ZINC000301685434 1128915067 /nfs/dbraw/zinc/91/50/67/1128915067.db2.gz VKBVJBFHRMFPRX-MRXNPFEDSA-N 1 0 346.475 3.779 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@](C)(O)c2cccs2)cc1[N+](=O)[O-] ZINC000153000666 1120527675 /nfs/dbraw/zinc/52/76/75/1120527675.db2.gz CFZOJEQNNISCJA-QGZVFWFLSA-N 1 0 334.441 3.777 20 5 EHBDRO C[C@H](CC1CCOCC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494523015 1120581261 /nfs/dbraw/zinc/58/12/61/1120581261.db2.gz IUIJZUFRHKJFSB-LLVKDONJSA-N 1 0 346.349 3.908 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2cc(F)ccc2C[C@@H]1C ZINC000542497099 1120790045 /nfs/dbraw/zinc/79/00/45/1120790045.db2.gz XDWMAVAVIXEWNJ-BBATYDOGSA-N 1 0 330.359 3.766 20 5 EHBDRO COc1ccc(C[NH+]2CCC(OCCC(C)C)CC2)cc1[N+](=O)[O-] ZINC000193106242 1120916796 /nfs/dbraw/zinc/91/67/96/1120916796.db2.gz DEBOULKRJVNJCK-UHFFFAOYSA-N 1 0 336.432 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H](O)c2c(F)cccc2F)C2CC2)c1 ZINC000153273226 1120933597 /nfs/dbraw/zinc/93/35/97/1120933597.db2.gz NUNMYXXLCUQYKX-KRWDZBQOSA-N 1 0 348.349 3.571 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000542545476 1121002260 /nfs/dbraw/zinc/00/22/60/1121002260.db2.gz QZIXZAOWLIHXJY-LSDHHAIUSA-N 1 0 344.411 3.764 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000495685596 1121362562 /nfs/dbraw/zinc/36/25/62/1121362562.db2.gz HTPNAASGOCUFJS-GFCCVEGCSA-N 1 0 329.356 3.624 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000487977172 1121419585 /nfs/dbraw/zinc/41/95/85/1121419585.db2.gz JKZRAOUNSOSTAC-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000301097916 1121604506 /nfs/dbraw/zinc/60/45/06/1121604506.db2.gz NUMCPMQGNKPQIF-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO CC1(c2ccccc2)CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153737019 1121630888 /nfs/dbraw/zinc/63/08/88/1121630888.db2.gz YNXKEULPLDPGHS-IBGZPJMESA-N 1 0 340.423 3.682 20 5 EHBDRO CSCCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000076764794 1121656751 /nfs/dbraw/zinc/65/67/51/1121656751.db2.gz ZZFGGYLZUPBNOQ-UHFFFAOYSA-N 1 0 337.470 3.951 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CC3CC3)CC2)c(C(F)(F)F)c1 ZINC000194038748 1121755595 /nfs/dbraw/zinc/75/55/95/1121755595.db2.gz VSPJTNWJSPUNCH-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CC(=O)c1c(NC[C@H](c2cccs2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207840 1121876185 /nfs/dbraw/zinc/87/61/85/1121876185.db2.gz ZZAXQRQPFRHTII-CQSZACIVSA-N 1 0 333.413 3.574 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(c3ccc([N+](=O)[O-])cc3F)C2)CC1 ZINC000301123741 1122036111 /nfs/dbraw/zinc/03/61/11/1122036111.db2.gz SBDVZJYSAWJBJY-OAHLLOKOSA-N 1 0 335.423 3.682 20 5 EHBDRO CC[C@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000077453481 1129032443 /nfs/dbraw/zinc/03/24/43/1129032443.db2.gz FJFDBHDZNOPWBF-LLVKDONJSA-N 1 0 338.791 3.759 20 5 EHBDRO COCCOc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000154079111 1122211115 /nfs/dbraw/zinc/21/11/15/1122211115.db2.gz OBMJVTCQOBWGMX-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1c(C[NH2+]CC2(c3ccccc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000917137607 1122531141 /nfs/dbraw/zinc/53/11/41/1122531141.db2.gz VWRYNXRYFFVTTO-UHFFFAOYSA-N 1 0 340.423 3.741 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154366846 1122583680 /nfs/dbraw/zinc/58/36/80/1122583680.db2.gz JODXWICKXRABEQ-HKUYNNGSSA-N 1 0 328.412 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000498889413 1123103099 /nfs/dbraw/zinc/10/30/99/1123103099.db2.gz BYCMVJRJIRIMLV-UHFFFAOYSA-N 1 0 342.395 3.591 20 5 EHBDRO CN(Cc1ccc([N+](=O)[O-])cc1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000074322116 1123291698 /nfs/dbraw/zinc/29/16/98/1123291698.db2.gz AQEKYWIGZCLROF-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO COc1ccccc1OCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000064350602 1123573328 /nfs/dbraw/zinc/57/33/28/1123573328.db2.gz KDQRZJMRZJIULX-UHFFFAOYSA-N 1 0 344.411 3.893 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOC1 ZINC000609600573 1123619619 /nfs/dbraw/zinc/61/96/19/1123619619.db2.gz JOOGARJZMASIBL-QGZVFWFLSA-N 1 0 332.425 3.840 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672694 1123641576 /nfs/dbraw/zinc/64/15/76/1123641576.db2.gz XXCWCCCRXYAPRV-NVXWUHKLSA-N 1 0 326.396 3.852 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2cccnc2[N+](=O)[O-])CC1 ZINC000609704131 1123648039 /nfs/dbraw/zinc/64/80/39/1123648039.db2.gz BHWZARRWMUJYIE-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000609891359 1123688005 /nfs/dbraw/zinc/68/80/05/1123688005.db2.gz AHPAYYPYGNLCNX-CHWSQXEVSA-N 1 0 340.855 3.813 20 5 EHBDRO C[C@H](NCc1c(F)cccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000180842852 1124087890 /nfs/dbraw/zinc/08/78/90/1124087890.db2.gz YRBBPGRTLSUWMZ-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccc(F)cc1)[NH+](C)C ZINC000080580386 1124534895 /nfs/dbraw/zinc/53/48/95/1124534895.db2.gz QRBUOTIANCWOGH-GOSISDBHSA-N 1 0 347.390 3.595 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000182212369 1125206913 /nfs/dbraw/zinc/20/69/13/1125206913.db2.gz PINUCQUVCHTGJB-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000182230292 1125222806 /nfs/dbraw/zinc/22/28/06/1125222806.db2.gz ADIFLJVHAMVOAI-OAHLLOKOSA-N 1 0 347.459 3.514 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182917013 1125400742 /nfs/dbraw/zinc/40/07/42/1125400742.db2.gz WYNOSICQFAETKU-OAHLLOKOSA-N 1 0 341.411 3.525 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CCC[N@@H+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000526306376 1129200922 /nfs/dbraw/zinc/20/09/22/1129200922.db2.gz DYNWAJZUDLEOMY-UHFFFAOYSA-N 1 0 347.459 3.665 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000301878815 1129252106 /nfs/dbraw/zinc/25/21/06/1129252106.db2.gz ORELWPSNDJSXRK-GDBMZVCRSA-N 1 0 332.791 3.501 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920387 1129365794 /nfs/dbraw/zinc/36/57/94/1129365794.db2.gz DUNUAIVXJGJKQZ-NEPJUHHUSA-N 1 0 343.374 3.729 20 5 EHBDRO CCOc1cccc(NC[C@H](c2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000543398088 1129459831 /nfs/dbraw/zinc/45/98/31/1129459831.db2.gz JQHLDPVDBSFRIJ-MRXNPFEDSA-N 1 0 329.400 3.708 20 5 EHBDRO Cc1nn(C)c(Nc2ccc(C[N@H+]3CCCC[C@H]3C)cc2)c1[N+](=O)[O-] ZINC000301986042 1129486168 /nfs/dbraw/zinc/48/61/68/1129486168.db2.gz JVGQTNLMHQHSLD-CYBMUJFWSA-N 1 0 343.431 3.755 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922540461 1129568713 /nfs/dbraw/zinc/56/87/13/1129568713.db2.gz JHYGVEYSHYOILR-LSDHHAIUSA-N 1 0 344.411 3.859 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155214249 1129619523 /nfs/dbraw/zinc/61/95/23/1129619523.db2.gz HNVBDBSFRRNCRH-KRWDZBQOSA-N 1 0 326.396 3.635 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390517919 1129621429 /nfs/dbraw/zinc/62/14/29/1129621429.db2.gz DUSIKLDDVRSAPL-JXFKEZNVSA-N 1 0 339.439 3.910 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCCC[C@@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000155975171 1129683935 /nfs/dbraw/zinc/68/39/35/1129683935.db2.gz HXFMPCRKEDGZKZ-ZVZYQTTQSA-N 1 0 328.416 3.934 20 5 EHBDRO CCC[NH2+][C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021819962 1129736397 /nfs/dbraw/zinc/73/63/97/1129736397.db2.gz DDUONRJPJUFCCH-INIZCTEOSA-N 1 0 347.802 3.928 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302061815 1129765965 /nfs/dbraw/zinc/76/59/65/1129765965.db2.gz UCGFKJRVXKVLCK-STQMWFEESA-N 1 0 348.403 3.568 20 5 EHBDRO Cc1cc(N[C@H]2c3ccccc3C[C@H]2O)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302140660 1129770110 /nfs/dbraw/zinc/77/01/10/1129770110.db2.gz FGXSZLZJZSLTOV-MOPGFXCFSA-N 1 0 335.363 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1NC1CC[NH+](C3CCCCC3)CC1)CCN2 ZINC000302889794 1129797096 /nfs/dbraw/zinc/79/70/96/1129797096.db2.gz PAZWPZQMJKHCCO-UHFFFAOYSA-N 1 0 344.459 3.772 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000056196899 1129805917 /nfs/dbraw/zinc/80/59/17/1129805917.db2.gz FJZVWWJBUHAAIJ-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1F ZINC000056197007 1129805936 /nfs/dbraw/zinc/80/59/36/1129805936.db2.gz VMWPOULIDSQJPY-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO CCC[N@H+](CCc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000766027953 1129839694 /nfs/dbraw/zinc/83/96/94/1129839694.db2.gz QHZJTLKXTKLMFU-UHFFFAOYSA-N 1 0 344.440 3.918 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@]2(CC=CCC2)C1 ZINC000303532713 1129852674 /nfs/dbraw/zinc/85/26/74/1129852674.db2.gz GEDUDFAOOCLTPT-DNVCBOLYSA-N 1 0 343.427 3.744 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000303584877 1129857330 /nfs/dbraw/zinc/85/73/30/1129857330.db2.gz FVMHXMNALOUFJY-HNNXBMFYSA-N 1 0 333.432 3.682 20 5 EHBDRO CC1(C)CN(Cc2ccc(Br)c([N+](=O)[O-])c2)CCS1 ZINC000162903772 1129911522 /nfs/dbraw/zinc/91/15/22/1129911522.db2.gz ILXHYZAVOZGEQH-UHFFFAOYSA-N 1 0 345.262 3.685 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1cccc(-n2cccn2)c1 ZINC001168749496 1129927256 /nfs/dbraw/zinc/92/72/56/1129927256.db2.gz GLYIBSVERJKFIB-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000133587754 1129953916 /nfs/dbraw/zinc/95/39/16/1129953916.db2.gz NDFLOTNZLVAZKD-FZMZJTMJSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC([NH+]2CCCC2)CC1 ZINC000429213404 1129983691 /nfs/dbraw/zinc/98/36/91/1129983691.db2.gz JZJVOJRXIDYBBC-UHFFFAOYSA-N 1 0 344.242 3.966 20 5 EHBDRO C[C@@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000701878122 1130178149 /nfs/dbraw/zinc/17/81/49/1130178149.db2.gz JYAIVDKNIFZNSQ-STQMWFEESA-N 1 0 337.420 3.501 20 5 EHBDRO C[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)N1CCc2sccc2C1 ZINC000173306286 1130204950 /nfs/dbraw/zinc/20/49/50/1130204950.db2.gz NOCZQMWYWQILOU-ZIAGYGMSSA-N 1 0 345.468 3.754 20 5 EHBDRO COc1ccc(COCCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173377588 1130220847 /nfs/dbraw/zinc/22/08/47/1130220847.db2.gz GXGKODZILIEBPV-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccccc2)C2CCOCC2)cs1 ZINC001168759183 1130432422 /nfs/dbraw/zinc/43/24/22/1130432422.db2.gz YYKOHPYCTSLUEL-KRWDZBQOSA-N 1 0 332.425 3.914 20 5 EHBDRO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892951 1130858195 /nfs/dbraw/zinc/85/81/95/1130858195.db2.gz LDMRXZVQNJNGRD-GQIGUUNPSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000742154510 1131694285 /nfs/dbraw/zinc/69/42/85/1131694285.db2.gz KMEYHTLHRXOUIZ-LSDHHAIUSA-N 1 0 328.416 3.926 20 5 EHBDRO Cn1cc([C@H](O)C[NH2+]Cc2c3ccccc3cc3ccccc32)cn1 ZINC000742376158 1131717955 /nfs/dbraw/zinc/71/79/55/1131717955.db2.gz NMDYIRXTXIHWGY-OAQYLSRUSA-N 1 0 331.419 3.550 20 5 EHBDRO COc1cccc(F)c1C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897920 1131880454 /nfs/dbraw/zinc/88/04/54/1131880454.db2.gz DLSPKRXURWSYKE-OAHLLOKOSA-N 1 0 344.386 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cccc(Cl)n1)CC2 ZINC001172900885 1131883590 /nfs/dbraw/zinc/88/35/90/1131883590.db2.gz HLRIKQBIAXMIHG-CQSZACIVSA-N 1 0 331.803 3.680 20 5 EHBDRO CC1(C)C[C@H](C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172906504 1131888287 /nfs/dbraw/zinc/88/82/87/1131888287.db2.gz XPADBEGXROXLEU-RHSMWYFYSA-N 1 0 332.444 3.637 20 5 EHBDRO CC[N@H+](CC(=O)OC(C)(C)C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921779 1131905854 /nfs/dbraw/zinc/90/58/54/1131905854.db2.gz SYTJZYDYWGZZPD-MRXNPFEDSA-N 1 0 348.443 3.506 20 5 EHBDRO Cc1ccc(C(=O)C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912049 1131917677 /nfs/dbraw/zinc/91/76/77/1131917677.db2.gz LMXSFYPHOLFHNP-SFHVURJKSA-N 1 0 338.407 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCc3ccc(O)cc31)CC2 ZINC001172911920 1131918199 /nfs/dbraw/zinc/91/81/99/1131918199.db2.gz KXQCHVPYBBNOJC-OXJNMPFZSA-N 1 0 338.407 3.825 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2ccccc2C)c1F ZINC001173175476 1131990881 /nfs/dbraw/zinc/99/08/81/1131990881.db2.gz OAUPBDRNJHSEHQ-CQSZACIVSA-N 1 0 346.402 3.814 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C(C)(C)c2cccnc2)c1F ZINC001173174656 1131991371 /nfs/dbraw/zinc/99/13/71/1131991371.db2.gz AERRXTQBPDNQFZ-LBPRGKRZSA-N 1 0 347.390 3.593 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@H]3CCC[C@H]3C2)c1F ZINC001173178278 1131992263 /nfs/dbraw/zinc/99/22/63/1131992263.db2.gz ACFXDYLKKMQTEN-MJBXVCDLSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2cccc(N)c2)c1F ZINC001173190808 1131995761 /nfs/dbraw/zinc/99/57/61/1131995761.db2.gz HGFJKIGKPQQILB-NEPJUHHUSA-N 1 0 347.390 3.607 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC(C(F)F)CC2)c1F ZINC001173197608 1131996837 /nfs/dbraw/zinc/99/68/37/1131996837.db2.gz VHZQMJQCGCKSNE-JTQLQIEISA-N 1 0 346.349 3.651 20 5 EHBDRO CSc1ccccc1OCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216497 1132002170 /nfs/dbraw/zinc/00/21/70/1132002170.db2.gz BXVUXTBGEHDSHO-AWEZNQCLSA-N 1 0 346.452 3.916 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)NC(=[NH2+])c1ccc(F)c(Cl)c1 ZINC001173221027 1132004056 /nfs/dbraw/zinc/00/40/56/1132004056.db2.gz FFDMDDOKUGOFMB-JTQLQIEISA-N 1 0 335.766 3.933 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC001173226266 1132006803 /nfs/dbraw/zinc/00/68/03/1132006803.db2.gz WRXLIIRFLWUSLI-MEDUHNTESA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c(C[NH3+])cc2cccc(F)c21 ZINC001173230577 1132009162 /nfs/dbraw/zinc/00/91/62/1132009162.db2.gz RYDNBBVJOKOKEN-LBPRGKRZSA-N 1 0 327.359 3.951 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ncccc1C(F)(F)F ZINC001173211153 1132013581 /nfs/dbraw/zinc/01/35/81/1132013581.db2.gz QAVOISXGUNFAIX-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1nc2ccccc2s1 ZINC001173212083 1132014017 /nfs/dbraw/zinc/01/40/17/1132014017.db2.gz WOYRJPDWQGBUOA-GFCCVEGCSA-N 1 0 327.409 3.925 20 5 EHBDRO C[C@@H]([NH2+]Cc1c2ccccc2cc2ccccc21)[C@@H]1CN(C)CCO1 ZINC000773403291 1132460082 /nfs/dbraw/zinc/46/00/82/1132460082.db2.gz DBMJKWGTOMSDND-ZHRRBRCNSA-N 1 0 334.463 3.802 20 5 EHBDRO C[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C[C@H]1CC1(C)C ZINC001174908309 1132501268 /nfs/dbraw/zinc/50/12/68/1132501268.db2.gz ZHHJKAJXEKURPT-LLVKDONJSA-N 1 0 327.222 3.835 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054565 1132551428 /nfs/dbraw/zinc/55/14/28/1132551428.db2.gz SRISFMQUXGQWFE-VUBDOFJKSA-N 1 0 331.416 3.600 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]C2(c3ccccc3C(F)(F)F)CC2)C1 ZINC001168977419 1132616897 /nfs/dbraw/zinc/61/68/97/1132616897.db2.gz JQGFSHUEVMVSAU-NWDGAFQWSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC001168976060 1132617053 /nfs/dbraw/zinc/61/70/53/1132617053.db2.gz YXQKYVLSERZMBZ-MOPGFXCFSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCSCc2ccccc2Cl)C1 ZINC001168970214 1132622523 /nfs/dbraw/zinc/62/25/23/1132622523.db2.gz GVFUDVICWSAVJO-OCCSQVGLSA-N 1 0 328.865 3.608 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039027 1132638435 /nfs/dbraw/zinc/63/84/35/1132638435.db2.gz MPANHCCZJQYBLO-YPMHNXCESA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025938 1132640949 /nfs/dbraw/zinc/64/09/49/1132640949.db2.gz KCLKROIDROIISD-IVMMDQJWSA-N 1 0 342.361 3.940 20 5 EHBDRO C[C@@H]1OC2(CC[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169056999 1132645380 /nfs/dbraw/zinc/64/53/80/1132645380.db2.gz UOWSZWUDNFWHSV-HRCADAONSA-N 1 0 330.428 3.514 20 5 EHBDRO CC1(C)C[C@@H](Nc2cnc(Cl)cc2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169149092 1132678177 /nfs/dbraw/zinc/67/81/77/1132678177.db2.gz YWIZOFNPVRBGPH-MEBBXXQBSA-N 1 0 326.828 3.599 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccc(F)c1)[NH+](C)C ZINC000804326549 1132765108 /nfs/dbraw/zinc/76/51/08/1132765108.db2.gz XTWXDBQPLGNNEB-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccccc1 ZINC000804326444 1132766509 /nfs/dbraw/zinc/76/65/09/1132766509.db2.gz TWDOTCGRHAIZMA-GOSISDBHSA-N 1 0 328.416 3.672 20 5 EHBDRO C[N@@H+]1CCC[C@H](CCNc2cc3ccc(Cl)nc3cc2[N+](=O)[O-])C1 ZINC001156385399 1132877080 /nfs/dbraw/zinc/87/70/80/1132877080.db2.gz FWDGPAHGPSUWCB-GFCCVEGCSA-N 1 0 348.834 3.940 20 5 EHBDRO CCC1(CC)C[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)CCS1 ZINC000767483065 1133009170 /nfs/dbraw/zinc/00/91/70/1133009170.db2.gz NUDJFGUMKANWDW-UHFFFAOYSA-N 1 0 334.445 3.510 20 5 EHBDRO CC1(C)C[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC(C)(C)C1 ZINC000767515940 1133011574 /nfs/dbraw/zinc/01/15/74/1133011574.db2.gz UCLKCACKBFXTOR-UHFFFAOYSA-N 1 0 343.431 3.569 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761573 1133048873 /nfs/dbraw/zinc/04/88/73/1133048873.db2.gz BGMBBGSIXKPNTB-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO C[C@]1(Cc2ccccc2)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937201 1133073418 /nfs/dbraw/zinc/07/34/18/1133073418.db2.gz YXRZKEPQVQGTDB-VQTJNVASSA-N 1 0 340.423 3.725 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCCOc1ccc(F)cc1 ZINC001177529965 1133075754 /nfs/dbraw/zinc/07/57/54/1133075754.db2.gz WUKVXDVGCJPUKH-UHFFFAOYSA-N 1 0 332.375 3.909 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)c1ccccc1 ZINC000768087350 1133090247 /nfs/dbraw/zinc/09/02/47/1133090247.db2.gz PNEFPZULJLEIFB-DOTOQJQBSA-N 1 0 346.452 3.789 20 5 EHBDRO COc1ccccc1OC[C@@H](C)C[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC001178228393 1133149191 /nfs/dbraw/zinc/14/91/91/1133149191.db2.gz FJIWCXZXJFHSEX-AWEZNQCLSA-N 1 0 344.411 3.717 20 5 EHBDRO Cc1c(C[NH2+]C[C@](C)(Cc2ccccc2)[C@H](C)O)cccc1[N+](=O)[O-] ZINC001178648213 1133188296 /nfs/dbraw/zinc/18/82/96/1133188296.db2.gz VDEOJRCWOKKVHA-JXFKEZNVSA-N 1 0 342.439 3.623 20 5 EHBDRO Cc1cc(C)cc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC001169999456 1133224209 /nfs/dbraw/zinc/22/42/09/1133224209.db2.gz GBLXQPYPHAKDHQ-HNNXBMFYSA-N 1 0 341.411 3.671 20 5 EHBDRO C[C@H](C[NH2+]Cc1cnc(-c2ccccc2)nc1)c1ccccc1[N+](=O)[O-] ZINC001179685274 1133270508 /nfs/dbraw/zinc/27/05/08/1133270508.db2.gz IVKBFMUCWNVBKE-OAHLLOKOSA-N 1 0 348.406 3.945 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccc3c1OCCO3)CCC2 ZINC000774241337 1133640454 /nfs/dbraw/zinc/64/04/54/1133640454.db2.gz CMSIJXRPLJSPEG-QGZVFWFLSA-N 1 0 340.379 3.533 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cccc1[N+](=O)[O-] ZINC000774382854 1133667786 /nfs/dbraw/zinc/66/77/86/1133667786.db2.gz VMHZMFSPWGQSNB-KRWDZBQOSA-N 1 0 341.367 3.979 20 5 EHBDRO CC(C)(C)C[C@@H]1C[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC001182752991 1133723331 /nfs/dbraw/zinc/72/33/31/1133723331.db2.gz DFJMAGSHMLSKOR-KBXCAEBGSA-N 1 0 331.460 3.978 20 5 EHBDRO Cc1ccc([C@@H]2C[C@H](C)[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126338 1133810795 /nfs/dbraw/zinc/81/07/95/1133810795.db2.gz PLEBESVGBBUXCQ-QKYXUNIQSA-N 1 0 340.423 3.815 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc(Cl)nc1 ZINC000786817201 1133910429 /nfs/dbraw/zinc/91/04/29/1133910429.db2.gz SOURXLRRBDYATQ-UKTHLTGXSA-N 1 0 331.803 3.879 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000786813484 1133910536 /nfs/dbraw/zinc/91/05/36/1133910536.db2.gz XMVARSFETAJQBE-LFIBNONCSA-N 1 0 348.406 3.974 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@](C)(O)c1ccccc1 ZINC000786820178 1133911491 /nfs/dbraw/zinc/91/14/91/1133911491.db2.gz GLCMDCAWWQZLLR-YFIXDKARSA-N 1 0 340.423 3.886 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000746667669 1133987899 /nfs/dbraw/zinc/98/78/99/1133987899.db2.gz ZVXRSWFEJTYKPH-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671277 1133989085 /nfs/dbraw/zinc/98/90/85/1133989085.db2.gz CBGLDUXAIQHNRI-OAHLLOKOSA-N 1 0 325.840 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccccc3F)C2)c([N+](=O)[O-])c1 ZINC000774880677 1134096456 /nfs/dbraw/zinc/09/64/56/1134096456.db2.gz JJLIVGUIWBXTMK-LBPRGKRZSA-N 1 0 345.330 3.632 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000788583390 1134147890 /nfs/dbraw/zinc/14/78/90/1134147890.db2.gz SSUWAKFHZGHGTD-CRAIPNDOSA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000788582852 1134148250 /nfs/dbraw/zinc/14/82/50/1134148250.db2.gz NRFUHZXHOARHPZ-FUHWJXTLSA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@H]([NH2+][C@@H](Cc1ccccc1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788640414 1134154554 /nfs/dbraw/zinc/15/45/54/1134154554.db2.gz AGJLPDXEBWDKTC-UGSOOPFHSA-N 1 0 325.412 3.849 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCOc2ccc(F)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788643298 1134155062 /nfs/dbraw/zinc/15/50/62/1134155062.db2.gz PQLAXFGJQQRFAC-ZBEGNZNMSA-N 1 0 345.374 3.881 20 5 EHBDRO C[C@H]([NH2+]C1CC(C)(c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788817550 1134176555 /nfs/dbraw/zinc/17/65/55/1134176555.db2.gz ZIXJLSRVNGGXMK-ISWZSGDOSA-N 1 0 325.412 3.948 20 5 EHBDRO Cc1cccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)c1 ZINC000775060038 1134273073 /nfs/dbraw/zinc/27/30/73/1134273073.db2.gz FSMQOYGZFUHCSW-OAHLLOKOSA-N 1 0 341.367 3.801 20 5 EHBDRO CCOc1cc(NC[C@H]2CC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC001187063691 1134291260 /nfs/dbraw/zinc/29/12/60/1134291260.db2.gz LXQTVXPCBATOPX-MRXNPFEDSA-N 1 0 333.432 3.812 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775371659 1134675210 /nfs/dbraw/zinc/67/52/10/1134675210.db2.gz OUNKCLWCLPPAAA-CVEARBPZSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170314375 1134745552 /nfs/dbraw/zinc/74/55/52/1134745552.db2.gz VAFJQZVOOYVCIS-OCBCSQNSSA-N 1 0 344.386 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)nc1 ZINC001170331378 1134750461 /nfs/dbraw/zinc/75/04/61/1134750461.db2.gz USGAAKUFDUYBQM-OSYLJGHBSA-N 1 0 338.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCCc2ccccn2)c([N+](=O)[O-])c1 ZINC001170306619 1134752126 /nfs/dbraw/zinc/75/21/26/1134752126.db2.gz YWKXNQVASKAIAF-OAHLLOKOSA-N 1 0 343.427 3.542 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340090 1134758463 /nfs/dbraw/zinc/75/84/63/1134758463.db2.gz DKJSTUQVEMFDHN-AAEUAGOBSA-N 1 0 346.349 3.809 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CC(c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC001170351607 1134760245 /nfs/dbraw/zinc/76/02/45/1134760245.db2.gz GKIOVCMRESETDW-CQSZACIVSA-N 1 0 326.396 3.634 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H]1CCC[C@@H]1c1ccc(C)cc1 ZINC001191214066 1134818665 /nfs/dbraw/zinc/81/86/65/1134818665.db2.gz MAZLJVQMBFBLOU-QZTJIDSGSA-N 1 0 342.443 3.676 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](C)[C@H]1c1ccc(C)cc1 ZINC001191184185 1134820920 /nfs/dbraw/zinc/82/09/20/1134820920.db2.gz VEFYAGDIAVMLPU-BEFAXECRSA-N 1 0 342.443 3.881 20 5 EHBDRO CCC[C@]1(C)CCCN(CC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC001191259243 1134827006 /nfs/dbraw/zinc/82/70/06/1134827006.db2.gz UKFCWSXVAIDMSB-GOSISDBHSA-N 1 0 333.432 3.744 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)NC(=O)OC(C)(C)C ZINC000793222785 1134876792 /nfs/dbraw/zinc/87/67/92/1134876792.db2.gz DPTBYHFZQVDCAQ-XXYUJHKVSA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1cccnc1F ZINC000793279187 1134901019 /nfs/dbraw/zinc/90/10/19/1134901019.db2.gz BBCCMOXNNIPPEN-BBRMVZONSA-N 1 0 329.375 3.630 20 5 EHBDRO CC(C)([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc([N+](=O)[O-])cc1 ZINC000775537523 1135034398 /nfs/dbraw/zinc/03/43/98/1135034398.db2.gz PJEILAGJNJJMST-UHFFFAOYSA-N 1 0 329.356 3.570 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000775539437 1135038707 /nfs/dbraw/zinc/03/87/07/1135038707.db2.gz LOCBASNONYCRCQ-RBUKOAKNSA-N 1 0 328.412 3.986 20 5 EHBDRO Cc1ccc(N[C@H]2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504169 1135093006 /nfs/dbraw/zinc/09/30/06/1135093006.db2.gz NMBHZFQLZVWSGQ-MNOVXSKESA-N 1 0 342.237 3.560 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000804556387 1135125648 /nfs/dbraw/zinc/12/56/48/1135125648.db2.gz WCSYYSPQQGTRQY-OAHLLOKOSA-N 1 0 346.475 3.658 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C12CCCCC2 ZINC001194092428 1135231753 /nfs/dbraw/zinc/23/17/53/1135231753.db2.gz OZJZPMZDXYNHMU-IRXDYDNUSA-N 1 0 336.407 3.951 20 5 EHBDRO CC(C)C[C@@]1(C)CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194536344 1135282977 /nfs/dbraw/zinc/28/29/77/1135282977.db2.gz ZQNQFLSDLOFSEP-GOSISDBHSA-N 1 0 333.432 3.824 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000775618556 1135335710 /nfs/dbraw/zinc/33/57/10/1135335710.db2.gz RLYGBIBTOYUNOY-NSHDSACASA-N 1 0 339.823 3.745 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@H](c3ccccc3F)C2)c1 ZINC001170535865 1135576224 /nfs/dbraw/zinc/57/62/24/1135576224.db2.gz IRTNWEXBWNMDTO-AWEZNQCLSA-N 1 0 330.359 3.602 20 5 EHBDRO C[C@]1(Cc2cccs2)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301959 1135796652 /nfs/dbraw/zinc/79/66/52/1135796652.db2.gz ZCKWGIQDQIPLQM-QZTJIDSGSA-N 1 0 346.452 3.787 20 5 EHBDRO C[C@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809700318 1135869100 /nfs/dbraw/zinc/86/91/00/1135869100.db2.gz CPTYFTGQFHIUPE-GXTWGEPZSA-N 1 0 326.824 3.764 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000809706092 1135875070 /nfs/dbraw/zinc/87/50/70/1135875070.db2.gz KVLPZAXPHUNZNZ-UHFFFAOYSA-N 1 0 349.774 3.716 20 5 EHBDRO CCC(CC)[C@H](C[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)N(C)C ZINC001199170657 1135884524 /nfs/dbraw/zinc/88/45/24/1135884524.db2.gz LZCHRVRIPWXFKP-LSSBLYJVSA-N 1 0 333.476 3.954 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000809748599 1135885049 /nfs/dbraw/zinc/88/50/49/1135885049.db2.gz WBTKNBZFPLJKHC-LBKOFNPBSA-N 1 0 326.396 3.711 20 5 EHBDRO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@H]1CCOC1 ZINC000809935408 1135902049 /nfs/dbraw/zinc/90/20/49/1135902049.db2.gz HDSFDUCTZHTNTG-SNVBAGLBSA-N 1 0 333.215 3.760 20 5 EHBDRO CN(CCOCC1CC1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809953052 1135905795 /nfs/dbraw/zinc/90/57/95/1135905795.db2.gz FIWGLFDJTMIQDQ-UHFFFAOYSA-N 1 0 333.215 3.760 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476106 1136096260 /nfs/dbraw/zinc/09/62/60/1136096260.db2.gz FLYYLAUNFFWELN-LLVKDONJSA-N 1 0 346.258 3.723 20 5 EHBDRO CC(C)([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650851 1136161941 /nfs/dbraw/zinc/16/19/41/1136161941.db2.gz QGPDLTATISZBJF-BXUZGUMPSA-N 1 0 346.349 3.920 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000850385614 1136247230 /nfs/dbraw/zinc/24/72/30/1136247230.db2.gz IOHUZHCFRMLPPH-AEFFLSMTSA-N 1 0 325.412 3.799 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850530499 1136280143 /nfs/dbraw/zinc/28/01/43/1136280143.db2.gz ZFAWPLCUODHMNX-IWEFOYFVSA-N 1 0 342.395 3.823 20 5 EHBDRO CCC[C@H]([NH2+]C[C@]12OCCC[C@H]1C2(F)F)c1cccc([N+](=O)[O-])c1 ZINC000850534082 1136281143 /nfs/dbraw/zinc/28/11/43/1136281143.db2.gz ILXFUVOJRBRIFP-XHSDSOJGSA-N 1 0 340.370 3.840 20 5 EHBDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585278 1136442345 /nfs/dbraw/zinc/44/23/45/1136442345.db2.gz SXEMQMUQDHNZJK-AZOIQLNYSA-N 1 0 344.386 3.645 20 5 EHBDRO CC(C)[C@@H](c1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581323 1136444840 /nfs/dbraw/zinc/44/48/40/1136444840.db2.gz CLIOXAAXPCXIEO-OALUTQOASA-N 1 0 328.412 3.957 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776587823 1136447095 /nfs/dbraw/zinc/44/70/95/1136447095.db2.gz OVMJBAXDFKHCDC-KUHUBIRLSA-N 1 0 326.396 3.854 20 5 EHBDRO CC1CC[NH+](CCCNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000338945963 1136459935 /nfs/dbraw/zinc/45/99/35/1136459935.db2.gz HFEWJXDWONDAGD-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852781093 1136485820 /nfs/dbraw/zinc/48/58/20/1136485820.db2.gz COZHTBMETQHFLX-GFCCVEGCSA-N 1 0 330.359 3.910 20 5 EHBDRO CC(C)Oc1cccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815561729 1136611288 /nfs/dbraw/zinc/61/12/88/1136611288.db2.gz OMZLELRTNHDHOR-CYBMUJFWSA-N 1 0 329.400 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3cccnc3CC2)c1 ZINC000817580313 1136823742 /nfs/dbraw/zinc/82/37/42/1136823742.db2.gz IFICVBWAHOADHG-CQSZACIVSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(c3ccccc3Cl)CC2)cc1 ZINC000819195871 1136921549 /nfs/dbraw/zinc/92/15/49/1136921549.db2.gz LVLOSSOQTGOUQO-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO Cc1ccc(SC[C@@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819239707 1136923749 /nfs/dbraw/zinc/92/37/49/1136923749.db2.gz VKJRWEDNEJFSQC-RDTXWAMCSA-N 1 0 346.452 3.707 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000819327394 1136931979 /nfs/dbraw/zinc/93/19/79/1136931979.db2.gz DJEOPHMBJKCWQK-MOPGFXCFSA-N 1 0 326.396 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[C@H]4C[C@H]4C3)CC2)cc1 ZINC000858442043 1136967974 /nfs/dbraw/zinc/96/79/74/1136967974.db2.gz CKWCAFNBDOQTBR-OWCLPIDISA-N 1 0 329.444 3.589 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(O)CCCC1 ZINC000825239682 1137170176 /nfs/dbraw/zinc/17/01/76/1137170176.db2.gz BWJOEZHMTPWMQL-UHFFFAOYSA-N 1 0 326.824 3.669 20 5 EHBDRO O=c1oc2cccc([N+](=O)[O-])c2n1C[N@@H+]1CCC[C@H]1C1CCCCC1 ZINC000794620132 1137221308 /nfs/dbraw/zinc/22/13/08/1137221308.db2.gz HXERPRMIJOFHMQ-AWEZNQCLSA-N 1 0 345.399 3.505 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCC1(CO)CCC1 ZINC000846104046 1137335515 /nfs/dbraw/zinc/33/55/15/1137335515.db2.gz CSTLIIQLUGSXSH-UHFFFAOYSA-N 1 0 333.215 3.544 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000846187189 1137340788 /nfs/dbraw/zinc/34/07/88/1137340788.db2.gz JSDZWXNSMNFWTE-YZVOILCLSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](c1cccnc1)C1CC1 ZINC000866312633 1137344850 /nfs/dbraw/zinc/34/48/50/1137344850.db2.gz PHJZMFOJXLNVKV-SGTLLEGYSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@H](CCc1cccnc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000866336487 1137347115 /nfs/dbraw/zinc/34/71/15/1137347115.db2.gz KEXIXCNYLQYUOX-CYBMUJFWSA-N 1 0 333.819 3.797 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC(C)(C)c1cccnc1 ZINC000866374701 1137350310 /nfs/dbraw/zinc/35/03/10/1137350310.db2.gz NENAQXMTLMSLIB-CYBMUJFWSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CC12CCSCC2 ZINC000866375599 1137350312 /nfs/dbraw/zinc/35/03/12/1137350312.db2.gz DGWGVHVNFKQPKE-JSGCOSHPSA-N 1 0 338.448 3.788 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC(C)(C)c1cccnc1 ZINC000866374702 1137350323 /nfs/dbraw/zinc/35/03/23/1137350323.db2.gz NENAQXMTLMSLIB-ZDUSSCGKSA-N 1 0 331.391 3.627 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])nc1 ZINC000866398053 1137351604 /nfs/dbraw/zinc/35/16/04/1137351604.db2.gz KQMFRZKBGBTJKK-CQSZACIVSA-N 1 0 345.418 3.936 20 5 EHBDRO C[C@H]([NH2+]C1CCC(OC(C)(C)C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866450582 1137356009 /nfs/dbraw/zinc/35/60/09/1137356009.db2.gz IWNWNLSKNSUALY-GRTSSRMGSA-N 1 0 335.448 3.954 20 5 EHBDRO COc1ccc2c(c1F)CC[C@@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866539585 1137363039 /nfs/dbraw/zinc/36/30/39/1137363039.db2.gz DGNIYWAAKYQXRK-HNNXBMFYSA-N 1 0 330.359 3.828 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000866539993 1137363221 /nfs/dbraw/zinc/36/32/21/1137363221.db2.gz IWZKVOTXWPFHJL-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccnn1C ZINC000866613971 1137369617 /nfs/dbraw/zinc/36/96/17/1137369617.db2.gz KJRLFWKDYQKCSW-OLZOCXBDSA-N 1 0 334.445 3.550 20 5 EHBDRO CC[C@H](C[C@@H](C)O)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635267 1137371485 /nfs/dbraw/zinc/37/14/85/1137371485.db2.gz OJXSGBHXYIOVLJ-BJZITVGISA-N 1 0 328.412 3.823 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(C(=O)OC(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000772976268 1137393215 /nfs/dbraw/zinc/39/32/15/1137393215.db2.gz FMCVUHTWCWNSRI-QGZVFWFLSA-N 1 0 349.431 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc2c1OCCO2 ZINC000772982500 1137408344 /nfs/dbraw/zinc/40/83/44/1137408344.db2.gz JHCZGDCSFNSLSU-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000339085550 1137431765 /nfs/dbraw/zinc/43/17/65/1137431765.db2.gz HDLJKLGXGVEXDQ-QWRGUYRKSA-N 1 0 332.322 3.518 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1c(F)cccc1F ZINC000773016436 1137459614 /nfs/dbraw/zinc/45/96/14/1137459614.db2.gz YKEBDFVJJNEROT-ZBEGNZNMSA-N 1 0 336.338 3.566 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001171625796 1137501203 /nfs/dbraw/zinc/50/12/03/1137501203.db2.gz DYEDQBLFBLBIBH-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740047 1137511117 /nfs/dbraw/zinc/51/11/17/1137511117.db2.gz ARGUWPFDJFFWPP-ZDUSSCGKSA-N 1 0 341.367 3.665 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171804859 1137513417 /nfs/dbraw/zinc/51/34/17/1137513417.db2.gz JMGFYLVOCLVSPE-ZBFHGGJFSA-N 1 0 345.443 3.824 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020791 1137565084 /nfs/dbraw/zinc/56/50/84/1137565084.db2.gz KKPINGGUGNTMOU-HUUCEWRRSA-N 1 0 343.402 3.911 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1ccc(C)o1 ZINC000872038448 1137566947 /nfs/dbraw/zinc/56/69/47/1137566947.db2.gz NQLHLVJMWZTTFF-FZMZJTMJSA-N 1 0 336.413 3.602 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000872039621 1137566960 /nfs/dbraw/zinc/56/69/60/1137566960.db2.gz UNLNMZFROVSPAH-XOPPTJLZSA-N 1 0 336.457 3.781 20 5 EHBDRO C[C@H]([NH2+]CC1(c2ccccn2)CCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070478 1137569576 /nfs/dbraw/zinc/56/95/76/1137569576.db2.gz DAZVXBVUVXGASW-ZDUSSCGKSA-N 1 0 329.375 3.901 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000872073171 1137569687 /nfs/dbraw/zinc/56/96/87/1137569687.db2.gz NXKSKFXTDNQELK-RDTXWAMCSA-N 1 0 345.443 3.802 20 5 EHBDRO Cc1cccc2nc(CC[NH2+][C@@H](C)c3c(F)cccc3[N+](=O)[O-])cn21 ZINC000872080550 1137570141 /nfs/dbraw/zinc/57/01/41/1137570141.db2.gz AFDSUCOXJRARIW-ZDUSSCGKSA-N 1 0 342.374 3.583 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@@H]3O2)cc1[N+](=O)[O-] ZINC000872109783 1137571762 /nfs/dbraw/zinc/57/17/62/1137571762.db2.gz RFQMPAKGIWVDKY-QEWYBTABSA-N 1 0 334.416 3.602 20 5 EHBDRO CC(C)OC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCC1 ZINC000872117364 1137572314 /nfs/dbraw/zinc/57/23/14/1137572314.db2.gz QHZLZOYASZHELG-UHFFFAOYSA-N 1 0 347.459 3.501 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000872217523 1137575917 /nfs/dbraw/zinc/57/59/17/1137575917.db2.gz YPYZXVINCDPESJ-QRVBRYPASA-N 1 0 326.396 3.554 20 5 EHBDRO CC(=O)c1ccc(N2CCC(C)([NH+]3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000872665992 1137582617 /nfs/dbraw/zinc/58/26/17/1137582617.db2.gz VGODWYDXAYIDOP-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000873115200 1137590380 /nfs/dbraw/zinc/59/03/80/1137590380.db2.gz JCWVOYOBWHCXJA-UHFFFAOYSA-N 1 0 325.412 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000873131391 1137590893 /nfs/dbraw/zinc/59/08/93/1137590893.db2.gz OZTZCKPWFBRXCU-QFBILLFUSA-N 1 0 341.411 3.617 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(CC[NH+](C)C)cc1 ZINC000874330032 1137613086 /nfs/dbraw/zinc/61/30/86/1137613086.db2.gz MCKXDYPKUSZLPA-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876937221 1137665797 /nfs/dbraw/zinc/66/57/97/1137665797.db2.gz SNTVBJSSTCJBER-NFOMZHRRSA-N 1 0 344.415 3.633 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CCCc4ccc(Cl)cc43)C2)c1 ZINC000877657058 1137684594 /nfs/dbraw/zinc/68/45/94/1137684594.db2.gz GTFAYCMTTXVAKB-KVULBXGLSA-N 1 0 346.818 3.815 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674379 1137685361 /nfs/dbraw/zinc/68/53/61/1137685361.db2.gz UZEFZZFBFXQWCS-MJGOQNOKSA-N 1 0 326.396 3.601 20 5 EHBDRO CC1([NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC(F)(F)C1 ZINC000877834848 1137692722 /nfs/dbraw/zinc/69/27/22/1137692722.db2.gz XXXQFAZSOVXSHA-UHFFFAOYSA-N 1 0 341.177 3.696 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878446568 1137716360 /nfs/dbraw/zinc/71/63/60/1137716360.db2.gz PDLUDBCLAGWANT-AWEZNQCLSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447921 1137716465 /nfs/dbraw/zinc/71/64/65/1137716465.db2.gz OVZLGIYKROZIIL-GXTWGEPZSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476031 1137717420 /nfs/dbraw/zinc/71/74/20/1137717420.db2.gz VJXRXJWQEBZFJR-GXTWGEPZSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878543501 1137719612 /nfs/dbraw/zinc/71/96/12/1137719612.db2.gz DMJQNIVOWYQCIK-ZDUSSCGKSA-N 1 0 344.415 3.903 20 5 EHBDRO CC(C)c1cc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)[nH]n1 ZINC000879918308 1137762450 /nfs/dbraw/zinc/76/24/50/1137762450.db2.gz ABSUNHPTQFYEBL-CQSZACIVSA-N 1 0 346.406 3.960 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000130200154 1137834856 /nfs/dbraw/zinc/83/48/56/1137834856.db2.gz OTGXWERYXALWKM-SFHVURJKSA-N 1 0 348.349 3.571 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000130272127 1137835749 /nfs/dbraw/zinc/83/57/49/1137835749.db2.gz CSKXPJNVCXATBV-SJKOYZFVSA-N 1 0 334.803 3.941 20 5 EHBDRO COCC1CC[NH+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000112355514 1137907253 /nfs/dbraw/zinc/90/72/53/1137907253.db2.gz QLIWKHGAUIDDNC-UHFFFAOYSA-N 1 0 337.419 3.805 20 5 EHBDRO CC[C@H]1C[C@@H](C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000332116791 1137932291 /nfs/dbraw/zinc/93/22/91/1137932291.db2.gz KIYKYZDVUBZFPB-RDJZCZTQSA-N 1 0 348.443 3.643 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000120271970 1137948007 /nfs/dbraw/zinc/94/80/07/1137948007.db2.gz ZMBRXYGVOYHCBP-KSSFIOAISA-N 1 0 344.411 3.686 20 5 EHBDRO CC(=O)c1cc(N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000884706365 1137969704 /nfs/dbraw/zinc/96/97/04/1137969704.db2.gz ANKMJIULZKQGRF-UHFFFAOYSA-N 1 0 342.399 3.521 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136957041 1138044582 /nfs/dbraw/zinc/04/45/82/1138044582.db2.gz VZOCPIFLSMIVGF-IBGZPJMESA-N 1 0 328.412 3.583 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](c2ncccn2)C1 ZINC000886685950 1138115051 /nfs/dbraw/zinc/11/50/51/1138115051.db2.gz HGJWUBWRTKQUAU-LSDHHAIUSA-N 1 0 326.400 3.634 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)c1 ZINC000075864316 1138129049 /nfs/dbraw/zinc/12/90/49/1138129049.db2.gz IGBQYBOENWCBDO-GOSISDBHSA-N 1 0 326.396 3.634 20 5 EHBDRO CSCC[C@@H](C)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089912547 1138207279 /nfs/dbraw/zinc/20/72/79/1138207279.db2.gz SVSFCAIPVPMOBO-GFCCVEGCSA-N 1 0 335.429 3.823 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCOC1 ZINC000093839720 1138241600 /nfs/dbraw/zinc/24/16/00/1138241600.db2.gz VXPGGHCOQSQFQD-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO CC(C)([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000348416546 1138283598 /nfs/dbraw/zinc/28/35/98/1138283598.db2.gz RYLXKLPDAJPPAU-UHFFFAOYSA-N 1 0 333.413 3.510 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CC(NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000302093631 1138711463 /nfs/dbraw/zinc/71/14/63/1138711463.db2.gz ONAZSFDREGXYCJ-GRTSSRMGSA-N 1 0 349.431 3.610 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[C@@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000150885748 1138989580 /nfs/dbraw/zinc/98/95/80/1138989580.db2.gz BBRCQKZKRCPGDK-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccccc2O)cc1[N+](=O)[O-] ZINC000153484569 1139139186 /nfs/dbraw/zinc/13/91/86/1139139186.db2.gz GAKUPQFLZNYFCK-ZDUSSCGKSA-N 1 0 330.384 3.592 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311274 1139566768 /nfs/dbraw/zinc/56/67/68/1139566768.db2.gz AYOJDMNMENZCKH-VTLRXDCVSA-N 1 0 348.443 3.876 20 5 EHBDRO CC1(O)CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000179722761 1139777215 /nfs/dbraw/zinc/77/72/15/1139777215.db2.gz YRNAHIKMDZZCTF-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO CC(C)[NH2+]C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000179834228 1139787967 /nfs/dbraw/zinc/78/79/67/1139787967.db2.gz AYTVMQYPIIDQDK-UHFFFAOYSA-N 1 0 343.427 3.817 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000182351076 1139967116 /nfs/dbraw/zinc/96/71/16/1139967116.db2.gz NBEFUMCQYOYQBW-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1c(CN[C@@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC000185722943 1140166764 /nfs/dbraw/zinc/16/67/64/1140166764.db2.gz DVMCVPBQPOBQTI-DOTOQJQBSA-N 1 0 331.460 3.646 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000190794323 1140418053 /nfs/dbraw/zinc/41/80/53/1140418053.db2.gz VCNIEWSUOBJLCL-CQSZACIVSA-N 1 0 328.416 3.685 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cnn(-c3ccccc3)c1)CCC2 ZINC000192643562 1140541963 /nfs/dbraw/zinc/54/19/63/1140541963.db2.gz YDENZTRSVBEPGX-HXUWFJFHSA-N 1 0 348.406 3.948 20 5 EHBDRO C[C@](O)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000192891090 1140554080 /nfs/dbraw/zinc/55/40/80/1140554080.db2.gz GUWNVZMLPILSBB-IRXDYDNUSA-N 1 0 332.425 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)CCC2 ZINC000192889922 1140554153 /nfs/dbraw/zinc/55/41/53/1140554153.db2.gz ZYBKDRGJLNGLGA-XLIONFOSSA-N 1 0 340.423 3.728 20 5 EHBDRO CC1CC[NH+](C2CCC(Nc3cc(N)ccc3[N+](=O)[O-])CC2)CC1 ZINC000193486365 1140576971 /nfs/dbraw/zinc/57/69/71/1140576971.db2.gz JHEVMFIGKXAPDS-UHFFFAOYSA-N 1 0 332.448 3.632 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)nc21 ZINC000266770386 1140723119 /nfs/dbraw/zinc/72/31/19/1140723119.db2.gz JGMXLEWUMATHJC-CYBMUJFWSA-N 1 0 325.368 3.938 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](O)c1cccc(F)c1 ZINC000267252563 1140772614 /nfs/dbraw/zinc/77/26/14/1140772614.db2.gz ZSSGJPFCSOWWBK-MGPLVRAMSA-N 1 0 338.766 3.599 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000267361069 1140782233 /nfs/dbraw/zinc/78/22/33/1140782233.db2.gz IGARZAJOZRCDQQ-DOTOQJQBSA-N 1 0 348.443 3.706 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[C@@H](C)O ZINC000271496463 1141381387 /nfs/dbraw/zinc/38/13/87/1141381387.db2.gz MODNGYSCTPXXPR-KGLIPLIRSA-N 1 0 340.489 3.852 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271512438 1141384684 /nfs/dbraw/zinc/38/46/84/1141384684.db2.gz STPOZRGGFBOENV-ROUUACIJSA-N 1 0 332.375 3.898 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518379 1141386232 /nfs/dbraw/zinc/38/62/32/1141386232.db2.gz PWECTCXBUYORTC-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)c1 ZINC000273880311 1141439336 /nfs/dbraw/zinc/43/93/36/1141439336.db2.gz XNEKPPYDDZKNJT-UHFFFAOYSA-N 1 0 326.396 3.515 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CC[C@@H]1c1ccccc1 ZINC000348527561 1141545731 /nfs/dbraw/zinc/54/57/31/1141545731.db2.gz TWHSHQNAUOMCAU-GOSISDBHSA-N 1 0 339.395 3.679 20 5 EHBDRO C[C@@H]1CN(c2ccc3ccc4ccc(Cl)nc4c3n2)[C@@H](C)C[N@@H+]1C ZINC001164643636 719204833 /nfs/dbraw/zinc/20/48/33/719204833.db2.gz ZVADVIGMJFPKTK-OLZOCXBDSA-N 1 0 340.858 3.965 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC2(CCOCC2)C1 ZINC000610215933 1015021687 /nfs/dbraw/zinc/02/16/87/1015021687.db2.gz NPHSVKFQDSCWPR-UHFFFAOYSA-N 1 0 348.443 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]([NH+]4CCCC4)C3)o2)cc1 ZINC000127043217 1015195004 /nfs/dbraw/zinc/19/50/04/1015195004.db2.gz OLZCVQAHQXPQSM-KRWDZBQOSA-N 1 0 341.411 3.525 20 5 EHBDRO CCn1nc(C)c(CN(Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1C ZINC000154258867 1015326873 /nfs/dbraw/zinc/32/68/73/1015326873.db2.gz VPLFEHBGZLJKON-UHFFFAOYSA-N 1 0 328.416 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](CO)C3)s2)cc1 ZINC000154589688 1015619834 /nfs/dbraw/zinc/61/98/34/1015619834.db2.gz LPKYKVMQWBASNC-ZDUSSCGKSA-N 1 0 332.425 3.528 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(CC[NH+](C)C)cc1 ZINC000449051413 1032127508 /nfs/dbraw/zinc/12/75/08/1032127508.db2.gz ACVQFAAYKICCAU-OAHLLOKOSA-N 1 0 327.428 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895402 1015910643 /nfs/dbraw/zinc/91/06/43/1015910643.db2.gz GWIYINRSQQWNND-FXAWDEMLSA-N 1 0 348.406 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1 ZINC001167123458 1016186169 /nfs/dbraw/zinc/18/61/69/1016186169.db2.gz UJDDKXKYFKSXMQ-GOSISDBHSA-N 1 0 344.386 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC001167123459 1016186298 /nfs/dbraw/zinc/18/62/98/1016186298.db2.gz UJDDKXKYFKSXMQ-SFHVURJKSA-N 1 0 344.386 3.820 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000177965129 1016498570 /nfs/dbraw/zinc/49/85/70/1016498570.db2.gz IXCQRQJIOAEEMN-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H](C)C[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700917 1016789257 /nfs/dbraw/zinc/78/92/57/1016789257.db2.gz RYZCYCWYQFVSDN-CVEARBPZSA-N 1 0 349.475 3.909 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279954 1016848719 /nfs/dbraw/zinc/84/87/19/1016848719.db2.gz RQJIRDKWDPAXNH-MJGOQNOKSA-N 1 0 325.412 3.520 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2[NH2+]CC[C@H]3CCCC[C@@H]32)n1 ZINC000904604345 1032154614 /nfs/dbraw/zinc/15/46/14/1032154614.db2.gz QEYCSSCYRNESIC-UHOFOFEASA-N 1 0 342.399 3.794 20 5 EHBDRO Cc1cc(N[C@H](C[NH+]2CCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000074739366 1032201337 /nfs/dbraw/zinc/20/13/37/1032201337.db2.gz FEKGAYXESJCTOE-MRXNPFEDSA-N 1 0 326.400 3.547 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C ZINC000449146224 1032247696 /nfs/dbraw/zinc/24/76/96/1032247696.db2.gz BJCKMUYYTHITTR-KYJSFNMBSA-N 1 0 334.460 3.957 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000449167688 1032260518 /nfs/dbraw/zinc/26/05/18/1032260518.db2.gz BEGDDTHLJIIORT-WBMJQRKESA-N 1 0 330.432 3.617 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C[C@H](C)O)c1ccccc1 ZINC000449192677 1032289323 /nfs/dbraw/zinc/28/93/23/1032289323.db2.gz UUQNPOFUQJFAGA-GJYPPUQNSA-N 1 0 342.439 3.670 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000449211478 1032314996 /nfs/dbraw/zinc/31/49/96/1032314996.db2.gz XSTITVVIAHIQDZ-BPAFIMBUSA-N 1 0 340.423 3.893 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1Cc2ccccc2C1)C1CC1 ZINC000536860205 1032358132 /nfs/dbraw/zinc/35/81/32/1032358132.db2.gz YFYDSVVQPFZBDH-HXUWFJFHSA-N 1 0 336.435 3.921 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)C2 ZINC000459732182 1032436746 /nfs/dbraw/zinc/43/67/46/1032436746.db2.gz RHIYNSVHUMMTPR-DZXKJOIRSA-N 1 0 338.407 3.764 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2c(F)ccc(F)c21 ZINC000449334531 1032469750 /nfs/dbraw/zinc/46/97/50/1032469750.db2.gz FCZFPQBLKOUIDE-XHDPSFHLSA-N 1 0 348.349 3.917 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCC(O)CC3)CC2)c(Cl)c1 ZINC000449369847 1032485609 /nfs/dbraw/zinc/48/56/09/1032485609.db2.gz VLASTWPZTOEBEL-UHFFFAOYSA-N 1 0 338.835 3.765 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] ZINC000376759394 1017093940 /nfs/dbraw/zinc/09/39/40/1017093940.db2.gz URRJYNDRSSIUBT-INIZCTEOSA-N 1 0 328.416 3.619 20 5 EHBDRO COc1cc(C[NH2+]CC[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1O ZINC000449379762 1032505837 /nfs/dbraw/zinc/50/58/37/1032505837.db2.gz UNEWKGUKCXOVRP-CQSZACIVSA-N 1 0 342.395 3.519 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000537290973 1032595121 /nfs/dbraw/zinc/59/51/21/1032595121.db2.gz UFNGJJRKNSDGKA-IBGZPJMESA-N 1 0 339.395 3.583 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000537307293 1032613628 /nfs/dbraw/zinc/61/36/28/1032613628.db2.gz PJNGFFZFRSMZQY-AYBZRNKSSA-N 1 0 346.471 3.693 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000449484317 1032635525 /nfs/dbraw/zinc/63/55/25/1032635525.db2.gz GGYQYEDPHOJTEF-SFHVURJKSA-N 1 0 342.443 3.978 20 5 EHBDRO COc1ccc(C2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)nc1 ZINC000593041484 1032675409 /nfs/dbraw/zinc/67/54/09/1032675409.db2.gz QKKXHQBVZLGNQU-CQSZACIVSA-N 1 0 341.411 3.939 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2cnc3n2CCCC3)cc1[N+](=O)[O-] ZINC000376770064 1017104857 /nfs/dbraw/zinc/10/48/57/1017104857.db2.gz YFYQXZWVSVJFGM-UHFFFAOYSA-N 1 0 328.416 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc4ccccn34)C2)cc1 ZINC000449501112 1032680986 /nfs/dbraw/zinc/68/09/86/1032680986.db2.gz OWKMUKZDFSLCQP-INIZCTEOSA-N 1 0 336.395 3.622 20 5 EHBDRO CCCn1cc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449505386 1032689718 /nfs/dbraw/zinc/68/97/18/1032689718.db2.gz XGDAWPCRAJUYET-KRWDZBQOSA-N 1 0 328.416 3.581 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H]1C ZINC000449509979 1032696927 /nfs/dbraw/zinc/69/69/27/1032696927.db2.gz WZTLOCVPCRFTSB-MLGOLLRUSA-N 1 0 347.440 3.575 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]CC1CCSCC1 ZINC000162230925 1032698526 /nfs/dbraw/zinc/69/85/26/1032698526.db2.gz VCYZNOKPNKLTEY-UHFFFAOYSA-N 1 0 345.262 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+]2CCCC2)cc1 ZINC000063466044 1017579043 /nfs/dbraw/zinc/57/90/43/1017579043.db2.gz GCDZTBLWIWPXPJ-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000177338556 1017647876 /nfs/dbraw/zinc/64/78/76/1017647876.db2.gz IHYVMXSLXYKAJW-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC(C)c1ccc([C@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C(C)C)cc1 ZINC000341020585 1017780276 /nfs/dbraw/zinc/78/02/76/1017780276.db2.gz UGFIHWIMVJPHKG-QGZVFWFLSA-N 1 0 330.432 3.939 20 5 EHBDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064343 1017973378 /nfs/dbraw/zinc/97/33/78/1017973378.db2.gz NANVFCRWJOEMKS-WFASDCNBSA-N 1 0 335.429 3.890 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)c1c(C)noc1C ZINC000468615155 1018231300 /nfs/dbraw/zinc/23/13/00/1018231300.db2.gz KKYXIUJVSNCIKQ-RPHSKFLZSA-N 1 0 329.400 3.996 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221182 1018819722 /nfs/dbraw/zinc/81/97/22/1018819722.db2.gz FFDWYDVQLLAHST-ICSRJNTNSA-N 1 0 339.439 3.562 20 5 EHBDRO COc1cccc(N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111392 1018973553 /nfs/dbraw/zinc/97/35/53/1018973553.db2.gz DFSMWKCWEXNGRC-ZBFHGGJFSA-N 1 0 341.411 3.678 20 5 EHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075197 1019000003 /nfs/dbraw/zinc/00/00/03/1019000003.db2.gz XGALUINHRBIZIA-SMDDNHRTSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@@H]1[C@H](C)C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000419379861 1019008309 /nfs/dbraw/zinc/00/83/09/1019008309.db2.gz XEZWWNMHLYQYCG-MCIONIFRSA-N 1 0 329.400 3.769 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000322407059 1019086759 /nfs/dbraw/zinc/08/67/59/1019086759.db2.gz XMEBHTCUMLYYBG-RYUDHWBXSA-N 1 0 329.322 3.652 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)Nc2cccc(C[NH3+])c2)cc1[N+](=O)[O-] ZINC000592444430 1032829227 /nfs/dbraw/zinc/82/92/27/1032829227.db2.gz BVEVHZHIXZAPAZ-UHFFFAOYSA-N 1 0 327.384 3.603 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)[C@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000275917565 1019622680 /nfs/dbraw/zinc/62/26/80/1019622680.db2.gz XPXJXEUAZSDTQT-CQSZACIVSA-N 1 0 347.459 3.521 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC000926114102 1019709981 /nfs/dbraw/zinc/70/99/81/1019709981.db2.gz UZJSOOAXNYQAJK-KRWDZBQOSA-N 1 0 338.835 3.586 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000610451454 1019805841 /nfs/dbraw/zinc/80/58/41/1019805841.db2.gz ASZBTRRAQCIFJD-OAHLLOKOSA-N 1 0 345.468 3.753 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CCC[N@H+](Cc2ccc(Cl)cc2)CC1 ZINC000247291425 1019939821 /nfs/dbraw/zinc/93/98/21/1019939821.db2.gz BCPNRJTYKKKQCE-UHFFFAOYSA-N 1 0 345.830 3.961 20 5 EHBDRO Cc1ccc2c(c1)CC[C@@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548829448 1032866644 /nfs/dbraw/zinc/86/66/44/1032866644.db2.gz JWYUDTRMQPOQPQ-INIZCTEOSA-N 1 0 339.395 3.509 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000126051046 1020157647 /nfs/dbraw/zinc/15/76/47/1020157647.db2.gz HSDPIBDXZAEAOS-MRXNPFEDSA-N 1 0 330.384 3.853 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC[C@H](O)CC1 ZINC000276059732 1020536427 /nfs/dbraw/zinc/53/64/27/1020536427.db2.gz SJBYRPNQBMCHBV-KOMQPUFPSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2c2nc3c([nH]2)CCCC3)cc1 ZINC000276109116 1020651618 /nfs/dbraw/zinc/65/16/18/1020651618.db2.gz WWVZVRDBTPSRDC-SFHVURJKSA-N 1 0 340.427 3.576 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413092219 1020679662 /nfs/dbraw/zinc/67/96/62/1020679662.db2.gz KUTCCMWTHRSAAQ-LLVKDONJSA-N 1 0 346.353 3.541 20 5 EHBDRO CC(C)(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549542 1032958202 /nfs/dbraw/zinc/95/82/02/1032958202.db2.gz DKFQMDQCTKHNJU-SJKOYZFVSA-N 1 0 347.415 3.667 20 5 EHBDRO CO[C@H]([C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633668 1032965374 /nfs/dbraw/zinc/96/53/74/1032965374.db2.gz UQPIZIORFVPSQV-KPZWWZAWSA-N 1 0 330.384 3.758 20 5 EHBDRO C[NH+](C)[C@H]1CC[C@H](Oc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC001226041660 1021497883 /nfs/dbraw/zinc/49/78/83/1021497883.db2.gz WFQNNUIFLTUDNT-UMSPYCQHSA-N 1 0 343.221 3.609 20 5 EHBDRO CC[N@H+](CCOc1ccccc1OC)Cc1ccccc1[N+](=O)[O-] ZINC000051180356 1021590260 /nfs/dbraw/zinc/59/02/60/1021590260.db2.gz QSVSBFDQWFMDBO-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCC(F)(F)C2)cc1Br ZINC000602577316 1032996362 /nfs/dbraw/zinc/99/63/62/1032996362.db2.gz RXSBREMIZYBXMY-ZCFIWIBFSA-N 1 0 341.177 3.696 20 5 EHBDRO CC(C)OC1CCC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602583050 1033001166 /nfs/dbraw/zinc/00/11/66/1033001166.db2.gz OQMOUZIREGUXOP-UHFFFAOYSA-N 1 0 333.388 3.562 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000127298556 1021763251 /nfs/dbraw/zinc/76/32/51/1021763251.db2.gz WJOPNVDKCULQMF-RDJZCZTQSA-N 1 0 332.444 3.997 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ccc([N+](=O)[O-])c(OC)c2)CC1 ZINC000543897375 1021950515 /nfs/dbraw/zinc/95/05/15/1021950515.db2.gz CTDZDEZJGSHPRW-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO C[C@@H]1C[C@@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602607308 1033023766 /nfs/dbraw/zinc/02/37/66/1033023766.db2.gz HWYOLZIMPMJWMH-NEPJUHHUSA-N 1 0 346.349 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3C[C@H](c4ccccc4F)C3)nc2c1 ZINC000602644394 1033034046 /nfs/dbraw/zinc/03/40/46/1033034046.db2.gz CHESZPHEHJNHSX-HAQNSBGRSA-N 1 0 341.342 3.911 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000517287580 1022214142 /nfs/dbraw/zinc/21/41/42/1022214142.db2.gz MSYJNNALQMBIPL-HOTGVXAUSA-N 1 0 345.399 3.563 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(-n2ccnc2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000175986148 1022374704 /nfs/dbraw/zinc/37/47/04/1022374704.db2.gz LKFYWIZTRKZYGD-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2CCSCC2)cc(C(F)(F)F)c1 ZINC000602638049 1033049353 /nfs/dbraw/zinc/04/93/53/1033049353.db2.gz BMULWSCYTRMZOQ-UHFFFAOYSA-N 1 0 334.363 3.846 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC[C@@H]1C ZINC000517722937 1022598499 /nfs/dbraw/zinc/59/84/99/1022598499.db2.gz HWCUTLJXQGKXTL-SOUVJXGZSA-N 1 0 338.473 3.728 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@]4(CCOC4)C3)o2)c1 ZINC000449688682 1033071791 /nfs/dbraw/zinc/07/17/91/1033071791.db2.gz WKOBRUBIWVMPCR-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO COc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1OC(C)C ZINC000480455342 1033071878 /nfs/dbraw/zinc/07/18/78/1033071878.db2.gz TVKYLKWPAZSVAA-UHFFFAOYSA-N 1 0 344.411 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCO[C@@H]3C3CC3)s2)cc1 ZINC000536339175 1022900458 /nfs/dbraw/zinc/90/04/58/1022900458.db2.gz ZMGUFBNMRGCZHY-SJLPKXTDSA-N 1 0 344.436 3.980 20 5 EHBDRO C[NH+](C)CCOc1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000506859292 1022965286 /nfs/dbraw/zinc/96/52/86/1022965286.db2.gz WBDZGHZBIBQTLU-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)c1cccc(O)c1 ZINC000178376397 1023132744 /nfs/dbraw/zinc/13/27/44/1023132744.db2.gz PTONWCDCIXORGK-CYBMUJFWSA-N 1 0 330.384 3.892 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](Cc1cccc(-n2cccn2)c1)C1CC1 ZINC000507170147 1023171730 /nfs/dbraw/zinc/17/17/30/1023171730.db2.gz ZLDBJXZGQPLITP-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO C[C@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CCCC1 ZINC000184634998 1023195812 /nfs/dbraw/zinc/19/58/12/1023195812.db2.gz FLSYABDUMKYJIB-ZDUSSCGKSA-N 1 0 329.400 3.961 20 5 EHBDRO C[C@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000266857561 1023259160 /nfs/dbraw/zinc/25/91/60/1023259160.db2.gz KFHCEZZODZEGBY-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO Cc1nc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610755081 1023454620 /nfs/dbraw/zinc/45/46/20/1023454620.db2.gz HVWXGXBRZPJEEI-KRWDZBQOSA-N 1 0 340.427 3.937 20 5 EHBDRO CCC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000548488332 1023496642 /nfs/dbraw/zinc/49/66/42/1023496642.db2.gz NRVKQVNJVSQZQB-WMLDXEAASA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)ccc1C[NH+](C)C ZINC000458284614 1023850900 /nfs/dbraw/zinc/85/09/00/1023850900.db2.gz MUBXFFOZSIOCCN-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1COc2c(C)cccc2C1 ZINC000574444250 1033169443 /nfs/dbraw/zinc/16/94/43/1033169443.db2.gz ZCVHFXRXRINQRB-HOCLYGCPSA-N 1 0 326.396 3.866 20 5 EHBDRO CC[NH+]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000505427074 1024104284 /nfs/dbraw/zinc/10/42/84/1024104284.db2.gz JZCUXJLYTHWYFH-UHFFFAOYSA-N 1 0 349.818 3.646 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccs1 ZINC000075469841 1024199181 /nfs/dbraw/zinc/19/91/81/1024199181.db2.gz MFMPLLPGXQCCOR-OAHLLOKOSA-N 1 0 342.424 3.919 20 5 EHBDRO CCn1ccnc1[C@H]1CCCC[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000280966409 1024465593 /nfs/dbraw/zinc/46/55/93/1024465593.db2.gz KCEPDCOTBSLRCM-QGZVFWFLSA-N 1 0 328.416 3.581 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000895827218 1024863100 /nfs/dbraw/zinc/86/31/00/1024863100.db2.gz HPTSUQYWAVQEPP-VMPITWQZSA-N 1 0 329.444 3.558 20 5 EHBDRO CN(Cc1cnn(C)c1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000119692779 1024864049 /nfs/dbraw/zinc/86/40/49/1024864049.db2.gz BAGYTBCCCNBHKI-UHFFFAOYSA-N 1 0 342.424 3.689 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@@H]4CCCO4)C3)o2)cc1 ZINC000895843872 1024891252 /nfs/dbraw/zinc/89/12/52/1024891252.db2.gz JESKMVLCRAJWGS-QAPCUYQASA-N 1 0 342.395 3.856 20 5 EHBDRO C[N@@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C[C@@H]1CCCOC1 ZINC000119708157 1024928215 /nfs/dbraw/zinc/92/82/15/1024928215.db2.gz GKMNAGPRWYLMSM-ZDUSSCGKSA-N 1 0 347.440 3.577 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000474469850 1025001292 /nfs/dbraw/zinc/00/12/92/1025001292.db2.gz IDBSKZNUJIJDNX-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(C)c1nccn1CCNc1nccc2c1cccc2[N+](=O)[O-] ZINC000895987992 1025043887 /nfs/dbraw/zinc/04/38/87/1025043887.db2.gz MDMAUKAIQUSQAE-UHFFFAOYSA-N 1 0 325.372 3.575 20 5 EHBDRO COC1(OC)CC2(C[N@H+](Cc3cccc([N+](=O)[O-])c3C)[C@@H]2C(C)C)C1 ZINC000895987853 1025045124 /nfs/dbraw/zinc/04/51/24/1025045124.db2.gz JJVFVQXOQDVVSG-QGZVFWFLSA-N 1 0 348.443 3.513 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C(C)C ZINC000120985757 1025072263 /nfs/dbraw/zinc/07/22/63/1025072263.db2.gz WACXHJCNIMVTQJ-QGZVFWFLSA-N 1 0 329.400 3.664 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000515208172 1025091251 /nfs/dbraw/zinc/09/12/51/1025091251.db2.gz RMCHPEHTYIKOCA-QMTMVMCOSA-N 1 0 341.411 3.869 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000521099629 1025203238 /nfs/dbraw/zinc/20/32/38/1025203238.db2.gz IARIESXULSDYSK-MRXNPFEDSA-N 1 0 348.447 3.679 20 5 EHBDRO COc1ccc(OCCC[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000511071774 1025218860 /nfs/dbraw/zinc/21/88/60/1025218860.db2.gz HSKIIAWOYVPBIR-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000158055614 1025334214 /nfs/dbraw/zinc/33/42/14/1025334214.db2.gz WLACQYAJHGHZNQ-INIZCTEOSA-N 1 0 326.396 3.635 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000442807781 1025484864 /nfs/dbraw/zinc/48/48/64/1025484864.db2.gz FQBZTOVTQMRKOZ-RUENVJTFSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@H](c3ccccc3)C2)n1 ZINC000436299187 1025564301 /nfs/dbraw/zinc/56/43/01/1025564301.db2.gz DXHVPPJNCAKQBQ-XSLAGTTESA-N 1 0 340.427 3.811 20 5 EHBDRO Cc1c(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000051531706 1025639146 /nfs/dbraw/zinc/63/91/46/1025639146.db2.gz AOMNSCQMHYUTJZ-HXUWFJFHSA-N 1 0 340.423 3.849 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)NCc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000442998380 1025639879 /nfs/dbraw/zinc/63/98/79/1025639879.db2.gz IZQFPNYHRGZZBV-KUHUBIRLSA-N 1 0 345.418 3.823 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386799 1025659400 /nfs/dbraw/zinc/65/94/00/1025659400.db2.gz ZWRYDRZNOZLUHN-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1OCCC[NH+]1CCCCC1 ZINC000582263391 1025695506 /nfs/dbraw/zinc/69/55/06/1025695506.db2.gz QVWYNADLVMKHRP-UHFFFAOYSA-N 1 0 343.221 3.612 20 5 EHBDRO CC(C)[NH+](CCN(C)Cc1ccc(Cl)cc1[N+](=O)[O-])C(C)C ZINC000505846397 1025852878 /nfs/dbraw/zinc/85/28/78/1025852878.db2.gz RKWALWXDPLCYKJ-UHFFFAOYSA-N 1 0 327.856 3.799 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451354533 1025860729 /nfs/dbraw/zinc/86/07/29/1025860729.db2.gz RZDMZDBNCRMFSJ-IAAVTCLWSA-N 1 0 332.444 3.980 20 5 EHBDRO Cc1cccc([C@@H]2CCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)c1C ZINC000472220186 1025916363 /nfs/dbraw/zinc/91/63/63/1025916363.db2.gz BNULGDLOLJITSW-SFHVURJKSA-N 1 0 328.416 3.635 20 5 EHBDRO Cc1nc(C)c(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000119796249 1025996825 /nfs/dbraw/zinc/99/68/25/1025996825.db2.gz KISVBPJYLQCNCQ-OAHLLOKOSA-N 1 0 331.441 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCO[C@@H]3CCCCO3)C2)cc1 ZINC000451550478 1026101126 /nfs/dbraw/zinc/10/11/26/1026101126.db2.gz RWDMXBSULQQXDV-PKOBYXMFSA-N 1 0 348.443 3.708 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(O)(C2CCC2)CC1 ZINC000897036081 1026256639 /nfs/dbraw/zinc/25/66/39/1026256639.db2.gz HZWDHQZRHBEFSW-QINSGFPZSA-N 1 0 330.428 3.625 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000125235490 1026334337 /nfs/dbraw/zinc/33/43/37/1026334337.db2.gz NRZVGXDTKSUBPZ-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3cccc([N+](=O)[O-])c3)c2C1 ZINC000158354319 1026360619 /nfs/dbraw/zinc/36/06/19/1026360619.db2.gz FJQZKBPEDATPDF-UHFFFAOYSA-N 1 0 339.395 3.819 20 5 EHBDRO C[NH+](C)CCOc1cccc(NCc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000783582616 1026686126 /nfs/dbraw/zinc/68/61/26/1026686126.db2.gz PBVNXHUNYIPFAH-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000163223511 1026808156 /nfs/dbraw/zinc/80/81/56/1026808156.db2.gz YLHSAKVQJHLGOV-BXUZGUMPSA-N 1 0 339.823 3.745 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000186435624 1026888584 /nfs/dbraw/zinc/88/85/84/1026888584.db2.gz HUIPULZLAVBCSN-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H](C)NC(=O)OC(C)(C)C ZINC000310435243 1027005604 /nfs/dbraw/zinc/00/56/04/1027005604.db2.gz OFOAGBQALWHMSP-AGIUHOORSA-N 1 0 337.420 3.547 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)cc2C)c1C ZINC000909596729 1027015569 /nfs/dbraw/zinc/01/55/69/1027015569.db2.gz SYRQBFFGLXVPPS-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)C1 ZINC000531692628 1027191254 /nfs/dbraw/zinc/19/12/54/1027191254.db2.gz REIQFWMWJYFPSN-SJLPKXTDSA-N 1 0 339.439 3.828 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413179892 1027203612 /nfs/dbraw/zinc/20/36/12/1027203612.db2.gz CTDGMWKASYSXQC-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000531696898 1027217089 /nfs/dbraw/zinc/21/70/89/1027217089.db2.gz JLYDSVZCHPDLGE-ZBFHGGJFSA-N 1 0 346.402 3.544 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000531696894 1027217399 /nfs/dbraw/zinc/21/73/99/1027217399.db2.gz JLYDSVZCHPDLGE-GOEBONIOSA-N 1 0 346.402 3.544 20 5 EHBDRO C[NH+](C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1cccs1 ZINC000729629834 1027369843 /nfs/dbraw/zinc/36/98/43/1027369843.db2.gz GFDZWPMVINMMMT-GFCCVEGCSA-N 1 0 348.453 3.981 20 5 EHBDRO COc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178659559 1027619190 /nfs/dbraw/zinc/61/91/90/1027619190.db2.gz AXRQXVDJDMDHOC-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000366701812 1027756857 /nfs/dbraw/zinc/75/68/57/1027756857.db2.gz ZLTCBUYUWHETKZ-KSSFIOAISA-N 1 0 325.412 3.741 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000612049434 1027782714 /nfs/dbraw/zinc/78/27/14/1027782714.db2.gz PNANRNDTLCLMIV-CXAGYDPISA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H](c2ccccc2F)C1 ZINC000503656012 1028007535 /nfs/dbraw/zinc/00/75/35/1028007535.db2.gz YMIGEBYZTAMROD-AWEZNQCLSA-N 1 0 330.359 3.602 20 5 EHBDRO CCc1ccc([C@@H](NCC[NH+]2CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612406303 1028065567 /nfs/dbraw/zinc/06/55/67/1028065567.db2.gz DDYNGXDCJXXKMX-IBGZPJMESA-N 1 0 343.427 3.525 20 5 EHBDRO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCC[C@H]1C ZINC000444677651 1028147530 /nfs/dbraw/zinc/14/75/30/1028147530.db2.gz QAQYSSVWMJBBAW-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440542366 1028227166 /nfs/dbraw/zinc/22/71/66/1028227166.db2.gz CFQGRQBNHURYSV-GJYPPUQNSA-N 1 0 330.428 3.764 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](N)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000423232350 1028298223 /nfs/dbraw/zinc/29/82/23/1028298223.db2.gz BYTXJAFFSWWZLW-QZTJIDSGSA-N 1 0 325.412 3.607 20 5 EHBDRO CC[NH2+][C@H](C)CN[C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423390904 1028405444 /nfs/dbraw/zinc/40/54/44/1028405444.db2.gz WLOQRHHONNYCPT-OLZOCXBDSA-N 1 0 333.457 3.972 20 5 EHBDRO C[C@@H](CO)[C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000077423171 1028483381 /nfs/dbraw/zinc/48/33/81/1028483381.db2.gz RPAXQPVNVIJCBL-WDEREUQCSA-N 1 0 338.791 3.615 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508516250 1028484051 /nfs/dbraw/zinc/48/40/51/1028484051.db2.gz KUVIPTPUAPDCEP-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615673 1028486022 /nfs/dbraw/zinc/48/60/22/1028486022.db2.gz ZTVQYZUBZNPVGL-QLFBSQMISA-N 1 0 335.423 3.571 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000573137673 1028550957 /nfs/dbraw/zinc/55/09/57/1028550957.db2.gz VZVXNSSXPJGLSO-DYVFJYSZSA-N 1 0 341.386 3.590 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@@H]1CN2CCC[C@H]2CO1 ZINC000729684802 1028554352 /nfs/dbraw/zinc/55/43/52/1028554352.db2.gz WWXALVNUZANNJU-VQTJNVASSA-N 1 0 346.474 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968708 1028590471 /nfs/dbraw/zinc/59/04/71/1028590471.db2.gz ZJHBSVBAMYGEFM-CQSZACIVSA-N 1 0 348.353 3.614 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCCC[C@H]1C ZINC000052101535 1028812799 /nfs/dbraw/zinc/81/27/99/1028812799.db2.gz KQMWYBSRTFEJKY-KGLIPLIRSA-N 1 0 328.416 3.818 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895988 1029042563 /nfs/dbraw/zinc/04/25/63/1029042563.db2.gz WQJPLFVKAOLWEM-HOTGVXAUSA-N 1 0 349.475 3.765 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](OC)C(C)C ZINC000504912268 1029054472 /nfs/dbraw/zinc/05/44/72/1029054472.db2.gz SZCYTJGCKTZDLF-DZGCQCFKSA-N 1 0 326.462 3.726 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000504929038 1029075227 /nfs/dbraw/zinc/07/52/27/1029075227.db2.gz GAQNXWDHYTZGFI-HNNXBMFYSA-N 1 0 349.475 3.909 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000052158069 1029142498 /nfs/dbraw/zinc/14/24/98/1029142498.db2.gz BWJKUASILJYURE-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C(C)(C)c1ccccc1 ZINC000508671782 1029206818 /nfs/dbraw/zinc/20/68/18/1029206818.db2.gz SSTBZMZKVWXBKO-UHFFFAOYSA-N 1 0 341.411 3.757 20 5 EHBDRO COc1cc(C[NH2+][C@H](CC(F)(F)F)C(C)C)c([N+](=O)[O-])cc1F ZINC000445903591 1029226082 /nfs/dbraw/zinc/22/60/82/1029226082.db2.gz MBADSPAJHVKEBI-LLVKDONJSA-N 1 0 338.301 3.809 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCC1CCOCC1 ZINC000513822443 1029524626 /nfs/dbraw/zinc/52/46/26/1029524626.db2.gz CDPCXAMUGQYHHI-FUHWJXTLSA-N 1 0 332.444 3.712 20 5 EHBDRO Cc1cc(-n2ccnc2)ccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000192152427 1029604739 /nfs/dbraw/zinc/60/47/39/1029604739.db2.gz BZULNZIOAIOQDB-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ccc([N+](=O)[O-])s2)CC1 ZINC000611764579 1029648237 /nfs/dbraw/zinc/64/82/37/1029648237.db2.gz FZCSXAGQYJTFSY-UHFFFAOYSA-N 1 0 325.478 3.995 20 5 EHBDRO C[C@@H](CCO)CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453230091 1029951307 /nfs/dbraw/zinc/95/13/07/1029951307.db2.gz GTUAFMUDTLAUMS-BEFAXECRSA-N 1 0 328.412 3.682 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257840 1029954232 /nfs/dbraw/zinc/95/42/32/1029954232.db2.gz ZMFIFAWYRINOJK-JQWIXIFHSA-N 1 0 338.795 3.778 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@H](C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453238811 1029967732 /nfs/dbraw/zinc/96/77/32/1029967732.db2.gz SWDPPRQJDSXFRK-IFXJQAMLSA-N 1 0 346.427 3.838 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC(C)CC1 ZINC000481971120 1030140296 /nfs/dbraw/zinc/14/02/96/1030140296.db2.gz FZJNZOJECPVUPP-QFBILLFUSA-N 1 0 345.487 3.626 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@H]1CCOC1 ZINC000453356781 1030149439 /nfs/dbraw/zinc/14/94/39/1030149439.db2.gz JCHIVNNDXDJVFY-GJZGRUSLSA-N 1 0 338.473 3.872 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000453367727 1030183055 /nfs/dbraw/zinc/18/30/55/1030183055.db2.gz MKRZPQMBHNLCGY-HQRMLTQVSA-N 1 0 344.455 3.809 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453370396 1030187935 /nfs/dbraw/zinc/18/79/35/1030187935.db2.gz NQLMDXYOILRARH-HHXXYDBFSA-N 1 0 341.411 3.951 20 5 EHBDRO C[C@@H]1CC[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)O1 ZINC000453408795 1030219931 /nfs/dbraw/zinc/21/99/31/1030219931.db2.gz NRHMTGORQABIAK-NIKGAXFTSA-N 1 0 326.396 3.841 20 5 EHBDRO CC1CC[NH+](CCCN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000447516939 1030239347 /nfs/dbraw/zinc/23/93/47/1030239347.db2.gz IOTJHWYOQRLQGB-IBGZPJMESA-N 1 0 331.460 3.684 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCSc2ccccc2)n1 ZINC000447514730 1030260577 /nfs/dbraw/zinc/26/05/77/1030260577.db2.gz HICCRBXSLAXGHK-JKSUJKDBSA-N 1 0 346.456 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1CCCCN1C1CC1)CCC2 ZINC000447595661 1030332042 /nfs/dbraw/zinc/33/20/42/1030332042.db2.gz ALUQELBBIJKYJZ-HKUYNNGSSA-N 1 0 329.444 3.579 20 5 EHBDRO CO[C@@H](CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000447598108 1030337138 /nfs/dbraw/zinc/33/71/38/1030337138.db2.gz HOEUVHTWEINCNG-KBPBESRZSA-N 1 0 332.322 3.529 20 5 EHBDRO C[NH+](C)CC1(CN[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCC1 ZINC000447601874 1030354839 /nfs/dbraw/zinc/35/48/39/1030354839.db2.gz ROHATBQVAPKILK-SFHVURJKSA-N 1 0 331.460 3.684 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2ccc(F)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000052486028 1030362773 /nfs/dbraw/zinc/36/27/73/1030362773.db2.gz QGLAIIWLPKZPEY-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO CSCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237508959 1030365472 /nfs/dbraw/zinc/36/54/72/1030365472.db2.gz RJWKFIQYCSQIST-UHFFFAOYSA-N 1 0 326.805 3.961 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCc1cccc(F)c1)C1CC1 ZINC000532200167 1030473005 /nfs/dbraw/zinc/47/30/05/1030473005.db2.gz CASVIJSKXRVZEU-SFHVURJKSA-N 1 0 328.387 3.887 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2coc3ccccc23)n1 ZINC000340450674 1030492015 /nfs/dbraw/zinc/49/20/15/1030492015.db2.gz NUGGMMZBDIFHMI-HZPDHXFCSA-N 1 0 340.383 3.811 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000482528261 1030507089 /nfs/dbraw/zinc/50/70/89/1030507089.db2.gz CGGABHNBCPDVMV-CYBMUJFWSA-N 1 0 332.375 3.944 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCC[C@H]1O ZINC000537687566 1030980330 /nfs/dbraw/zinc/98/03/30/1030980330.db2.gz HYTDQOLQYIBJPM-RHSMWYFYSA-N 1 0 346.452 3.916 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000483245072 1031051470 /nfs/dbraw/zinc/05/14/70/1031051470.db2.gz GVPCKCZBQIEQLU-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@H]3CCCS3)cs2)c1 ZINC000152610811 1031116397 /nfs/dbraw/zinc/11/63/97/1031116397.db2.gz YORYIQAYIFXVFF-CQSZACIVSA-N 1 0 335.454 3.704 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@H]3[C@@H]3CCCO3)o2)c1 ZINC000551586858 1031474776 /nfs/dbraw/zinc/47/47/76/1031474776.db2.gz SOZGVPJBAWIZNS-HKUYNNGSSA-N 1 0 342.395 3.998 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000161502042 1031579952 /nfs/dbraw/zinc/57/99/52/1031579952.db2.gz DGURAIKWTVKJPY-HKUYNNGSSA-N 1 0 328.412 3.802 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOc1ccc(F)cc1)C1CC1 ZINC000537918974 1032002548 /nfs/dbraw/zinc/00/25/48/1032002548.db2.gz YPYKATYCKFRGKZ-SFHVURJKSA-N 1 0 344.386 3.724 20 5 EHBDRO CCOc1cc(N(CC[NH+](C)C)Cc2cccs2)ccc1[N+](=O)[O-] ZINC000536646768 1032055408 /nfs/dbraw/zinc/05/54/08/1032055408.db2.gz QIMAQFQLIRXUSG-UHFFFAOYSA-N 1 0 349.456 3.623 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000594522495 1033429730 /nfs/dbraw/zinc/42/97/30/1033429730.db2.gz JGDBDJNXZPHINJ-INIZCTEOSA-N 1 0 328.368 3.525 20 5 EHBDRO CC[NH+](CC)[C@H](CNCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000061015195 1033432836 /nfs/dbraw/zinc/43/28/36/1033432836.db2.gz BGBNBSNFEKEVOL-LJQANCHMSA-N 1 0 327.428 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cc(F)ccc1OC(F)F ZINC000594929009 1033549156 /nfs/dbraw/zinc/54/91/56/1033549156.db2.gz JCMIFMKRLUNEEL-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293220 1033574968 /nfs/dbraw/zinc/57/49/68/1033574968.db2.gz TUIYLQZGPKCQBV-HIFRSBDPSA-N 1 0 348.472 3.816 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](OC2CCCC2)C(F)(F)F)cc1 ZINC000594969666 1033577873 /nfs/dbraw/zinc/57/78/73/1033577873.db2.gz YHZCNRMRTOXKIX-AWEZNQCLSA-N 1 0 332.322 3.575 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000594974762 1033579564 /nfs/dbraw/zinc/57/95/64/1033579564.db2.gz IFGXMMGSEORGOV-FJOVNSMMSA-N 1 0 338.407 3.770 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(CO)CC1 ZINC000594965773 1033605158 /nfs/dbraw/zinc/60/51/58/1033605158.db2.gz JPZDBNGJKMGEJQ-LBPRGKRZSA-N 1 0 332.425 3.574 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1sc(C)nc1C ZINC000595014594 1033607441 /nfs/dbraw/zinc/60/74/41/1033607441.db2.gz BXBJYNOXIOECDC-SNVBAGLBSA-N 1 0 335.429 3.570 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000595021343 1033614613 /nfs/dbraw/zinc/61/46/13/1033614613.db2.gz CGIPJXJLLIWKQT-KGLIPLIRSA-N 1 0 334.416 3.746 20 5 EHBDRO CC1(C)[C@@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1(F)F ZINC000594990790 1033621481 /nfs/dbraw/zinc/62/14/81/1033621481.db2.gz ADRJUQLDFIHKAP-LLVKDONJSA-N 1 0 336.285 3.577 20 5 EHBDRO CCOCc1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595004951 1033630031 /nfs/dbraw/zinc/63/00/31/1033630031.db2.gz UYSQQPODDPFHIL-CQSZACIVSA-N 1 0 344.411 3.991 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](c2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000595009653 1033632005 /nfs/dbraw/zinc/63/20/05/1033632005.db2.gz ZDZLOLRTBIZGMZ-IFXJQAMLSA-N 1 0 328.412 3.930 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCCCCC3)cc2)nc1 ZINC000063737615 1033641580 /nfs/dbraw/zinc/64/15/80/1033641580.db2.gz PYNNXPKFNCZUBG-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C1CC1)[C@H]1CCCCO1 ZINC000595044485 1033663164 /nfs/dbraw/zinc/66/31/64/1033663164.db2.gz ALYJPADQFRQXRL-BJOOFOGMSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2C)C2CC2)cn1 ZINC000599019261 1033667290 /nfs/dbraw/zinc/66/72/90/1033667290.db2.gz CRKJYTFYSBBIOO-GOSISDBHSA-N 1 0 327.384 3.548 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1noc2ccccc12 ZINC000595051872 1033667589 /nfs/dbraw/zinc/66/75/89/1033667589.db2.gz WHCAFIKPRZLUIB-LBPRGKRZSA-N 1 0 341.367 3.638 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)[C@H](C)c1ccccc1 ZINC000595099547 1033689349 /nfs/dbraw/zinc/68/93/49/1033689349.db2.gz NPYHBOICVYYVDS-ZRGWGRIASA-N 1 0 328.412 3.718 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(C2CCC2)cnn1C ZINC000595101924 1033690536 /nfs/dbraw/zinc/69/05/36/1033690536.db2.gz ZODCMVASFHWHNL-CYBMUJFWSA-N 1 0 328.416 3.755 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc3occc3c2)n1 ZINC000595075812 1033696592 /nfs/dbraw/zinc/69/65/92/1033696592.db2.gz YZXFZNLAQKAOTO-JKSUJKDBSA-N 1 0 340.383 3.811 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1cnn(C)c1 ZINC000595086690 1033698062 /nfs/dbraw/zinc/69/80/62/1033698062.db2.gz OFBJBPZCDDYDJV-QOKNQOGYSA-N 1 0 342.443 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595092577 1033700579 /nfs/dbraw/zinc/70/05/79/1033700579.db2.gz LEBDJAFMXQIWAW-HZMBPMFUSA-N 1 0 328.359 3.935 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](n1cccn1)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599055055 1033708080 /nfs/dbraw/zinc/70/80/80/1033708080.db2.gz FWULDFUSGOGESJ-UONOGXRCSA-N 1 0 342.321 3.636 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC(C)(C)c1ccc(C)cn1 ZINC000599069701 1033710548 /nfs/dbraw/zinc/71/05/48/1033710548.db2.gz VGTSHZKPPUTUSJ-AWEZNQCLSA-N 1 0 343.427 3.935 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN(Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000603836597 1033961805 /nfs/dbraw/zinc/96/18/05/1033961805.db2.gz LWNZXWGMOUQZPS-UHFFFAOYSA-N 1 0 339.439 3.529 20 5 EHBDRO O=[N+]([O-])c1ncccc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000603844740 1033967431 /nfs/dbraw/zinc/96/74/31/1033967431.db2.gz UMEDVPHRDGDJRC-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])C1 ZINC000603859507 1033984778 /nfs/dbraw/zinc/98/47/78/1033984778.db2.gz FVDLNYXLOGYQFE-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000603864284 1033992333 /nfs/dbraw/zinc/99/23/33/1033992333.db2.gz WMPUPACQUGVDRT-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594356 1034033205 /nfs/dbraw/zinc/03/32/05/1034033205.db2.gz GGPISTBYGQZJIB-JKIFEVAISA-N 1 0 348.443 3.956 20 5 EHBDRO CC1CC[NH+](CCNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000040444321 1034046949 /nfs/dbraw/zinc/04/69/49/1034046949.db2.gz QKZZSGGVTMHGTQ-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCc2ccccc21 ZINC000604012566 1034135279 /nfs/dbraw/zinc/13/52/79/1034135279.db2.gz QDMNZCXPSCWWHS-LJQANCHMSA-N 1 0 326.396 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(ccnc2N2CCC[C@@H]([NH+]3CCCC3)CC2)c1 ZINC000450342895 1034151674 /nfs/dbraw/zinc/15/16/74/1034151674.db2.gz BOMFPYYPLINJIL-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[N@@H+](C2CCCC2)CC1 ZINC000450346566 1034155696 /nfs/dbraw/zinc/15/56/96/1034155696.db2.gz NPKOXNQSLRRCJM-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000604435950 1034377633 /nfs/dbraw/zinc/37/76/33/1034377633.db2.gz OHAMOWXAWCUCHW-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCN(c3ccc(Cl)cc3)CC2)cc1 ZINC000604459648 1034392416 /nfs/dbraw/zinc/39/24/16/1034392416.db2.gz AYQMBHVABMNQEU-UHFFFAOYSA-N 1 0 345.830 3.613 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000604539630 1034417649 /nfs/dbraw/zinc/41/76/49/1034417649.db2.gz AEGKKFXKSPLVPD-LBPRGKRZSA-N 1 0 331.338 3.580 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCCn3nccc32)c2cc([N+](=O)[O-])ccc21 ZINC000601320382 1034452164 /nfs/dbraw/zinc/45/21/64/1034452164.db2.gz GDPSCIGVRYUYMV-HZPDHXFCSA-N 1 0 326.400 3.638 20 5 EHBDRO COc1cc(C)c([C@H](C)NCc2cc(F)ccc2[N+](=O)[O-])cc1OC ZINC000179622957 1034517566 /nfs/dbraw/zinc/51/75/66/1034517566.db2.gz JGLZOEJBQIBSBA-LBPRGKRZSA-N 1 0 348.374 3.910 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000310510719 1034531898 /nfs/dbraw/zinc/53/18/98/1034531898.db2.gz DHYUNJJBSDRJNN-CABCVRRESA-N 1 0 349.431 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C(F)(F)F)c1 ZINC000364082272 1034536652 /nfs/dbraw/zinc/53/66/52/1034536652.db2.gz FJABFKWGMOSRIJ-MNOVXSKESA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C(F)(F)F)c1 ZINC000364082271 1034536989 /nfs/dbraw/zinc/53/69/89/1034536989.db2.gz FJABFKWGMOSRIJ-GHMZBOCLSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000594515337 1034603572 /nfs/dbraw/zinc/60/35/72/1034603572.db2.gz NVSQIRPVUHDZFX-SCLBCKFNSA-N 1 0 325.412 3.933 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1=CCCOC1 ZINC000597205007 1034607952 /nfs/dbraw/zinc/60/79/52/1034607952.db2.gz BXJVHRIROMYZSM-UHFFFAOYSA-N 1 0 328.368 3.633 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC[C@@H]2CCc3ccccc3N2)c(F)c1 ZINC000593318901 1034654840 /nfs/dbraw/zinc/65/48/40/1034654840.db2.gz SADJYTVSSXSSTR-HNNXBMFYSA-N 1 0 329.375 3.641 20 5 EHBDRO CCO[C@H]1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C[C@H]1C ZINC000450745709 1034749206 /nfs/dbraw/zinc/74/92/06/1034749206.db2.gz PWCIDXMPZNXEDK-XIKOKIGWSA-N 1 0 329.400 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](NCCC[NH+]2CCCCC2)C(F)(F)F)cc1 ZINC000584474438 1034814043 /nfs/dbraw/zinc/81/40/43/1034814043.db2.gz RMHGNUUAFDOFKC-HNNXBMFYSA-N 1 0 345.365 3.664 20 5 EHBDRO Cc1cc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3C)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000450821280 1034849876 /nfs/dbraw/zinc/84/98/76/1034849876.db2.gz ACPZJJWMMZBZMI-YOGCLGLASA-N 1 0 343.349 3.959 20 5 EHBDRO COCCCOC1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000347354744 1034882009 /nfs/dbraw/zinc/88/20/09/1034882009.db2.gz IJCOPRVQEOXXIT-DTQAZKPQSA-N 1 0 348.443 3.516 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C2CCC(O)CC2)c2ccccc2)c1 ZINC000179966314 1035095789 /nfs/dbraw/zinc/09/57/89/1035095789.db2.gz AGISXRQMLBWLBP-KVZIAJEVSA-N 1 0 326.396 3.577 20 5 EHBDRO CCC[N@H+](CC)C[C@H](C)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000579902191 1035375390 /nfs/dbraw/zinc/37/53/90/1035375390.db2.gz WJNBEIIZYDWAHX-NSHDSACASA-N 1 0 331.363 3.729 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(Br)o1 ZINC000571686383 1035590423 /nfs/dbraw/zinc/59/04/23/1035590423.db2.gz HFESNARSVXRHLV-UHFFFAOYSA-N 1 0 339.189 3.625 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@H](OC)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271973793 1035593699 /nfs/dbraw/zinc/59/36/99/1035593699.db2.gz ICKBADDEYGPDSH-XIKOKIGWSA-N 1 0 348.374 3.608 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2ncccc2c1 ZINC000192976369 1035634505 /nfs/dbraw/zinc/63/45/05/1035634505.db2.gz ZAHGTQFRIBXDAR-UHFFFAOYSA-N 1 0 337.379 3.832 20 5 EHBDRO CCOc1cc(CN(C)CC[NH+](C(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000492420534 1035768354 /nfs/dbraw/zinc/76/83/54/1035768354.db2.gz ZIGDPADBFXKNKB-UHFFFAOYSA-N 1 0 337.464 3.544 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[N@H+]1[C@H](C)CCC[C@@H]1C ZINC000443946458 1035903605 /nfs/dbraw/zinc/90/36/05/1035903605.db2.gz LXOKJWJVWMIDIR-OKILXGFUSA-N 1 0 348.447 3.596 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000460347894 1035924419 /nfs/dbraw/zinc/92/44/19/1035924419.db2.gz DPGHDAVUPQMRLR-PBHICJAKSA-N 1 0 333.432 3.506 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361952 1036035627 /nfs/dbraw/zinc/03/56/27/1036035627.db2.gz JCMTYGUMJAHMCV-JKSUJKDBSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1cccc(NC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000152971819 1036036272 /nfs/dbraw/zinc/03/62/72/1036036272.db2.gz FLANNWNUPGOGIQ-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000589183631 1036295237 /nfs/dbraw/zinc/29/52/37/1036295237.db2.gz ZMMDGZKARBKPML-UHFFFAOYSA-N 1 0 348.443 3.705 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC=C(c2ccnn2C)CC1 ZINC000589185033 1036296503 /nfs/dbraw/zinc/29/65/03/1036296503.db2.gz QPQWYNXMDLEZPX-QINSGFPZSA-N 1 0 338.411 3.521 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@H](CCOC)C2)ccc1[N+](=O)[O-] ZINC000492867935 1036361435 /nfs/dbraw/zinc/36/14/35/1036361435.db2.gz CFWNVFQCOJKYOP-OAHLLOKOSA-N 1 0 336.432 3.632 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H](CCOC)C2)ccc1[N+](=O)[O-] ZINC000492867934 1036361883 /nfs/dbraw/zinc/36/18/83/1036361883.db2.gz CFWNVFQCOJKYOP-HNNXBMFYSA-N 1 0 336.432 3.632 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](C)C[C@@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543614 1036421657 /nfs/dbraw/zinc/42/16/57/1036421657.db2.gz QILJPNDCGIBZQH-IQUTYRLHSA-N 1 0 346.427 3.836 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(CN(Cc2ccccc2)C2CC2)c1 ZINC000589494205 1036438315 /nfs/dbraw/zinc/43/83/15/1036438315.db2.gz JMYZVGFFJQAVSA-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)s1 ZINC000541581302 1036453197 /nfs/dbraw/zinc/45/31/97/1036453197.db2.gz KSJVHKRBRFEXHC-LBPRGKRZSA-N 1 0 347.440 3.871 20 5 EHBDRO COc1cc(C[N@H+]2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000180270012 1036464276 /nfs/dbraw/zinc/46/42/76/1036464276.db2.gz HUXHVAAGIKUYGA-PHIMTYICSA-N 1 0 344.358 3.620 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)Nc1ccc([N+](=O)[O-])c(N)c1F)[NH+](C)C ZINC000589600657 1036544693 /nfs/dbraw/zinc/54/46/93/1036544693.db2.gz CUBVXLHZDNAUHU-KZULUSFZSA-N 1 0 346.406 3.728 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@@H]1C ZINC000541688172 1036560487 /nfs/dbraw/zinc/56/04/87/1036560487.db2.gz TYVXZHQKDIUGHO-CKFHNAJUSA-N 1 0 342.395 3.516 20 5 EHBDRO COc1cccc(OCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000443578816 1036576040 /nfs/dbraw/zinc/57/60/40/1036576040.db2.gz GZQHPDHTSXTBBO-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730850 1036679466 /nfs/dbraw/zinc/67/94/66/1036679466.db2.gz QXGRHFSAPVHZKC-DYVFJYSZSA-N 1 0 334.416 3.862 20 5 EHBDRO CC[C@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777050 1036769262 /nfs/dbraw/zinc/76/92/62/1036769262.db2.gz OMTNRTNBKAGCSV-RDTXWAMCSA-N 1 0 333.432 3.742 20 5 EHBDRO CSc1ccc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000180439395 1036826989 /nfs/dbraw/zinc/82/69/89/1036826989.db2.gz WKKWHNNJYFZLRN-GFCCVEGCSA-N 1 0 345.424 3.606 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@H]2[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000539511940 1036837880 /nfs/dbraw/zinc/83/78/80/1036837880.db2.gz JGJNHOMBZXTPJI-NVXWUHKLSA-N 1 0 332.425 3.975 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000376448370 1036887297 /nfs/dbraw/zinc/88/72/97/1036887297.db2.gz MNAMAXKBEJQBJW-SJCJKPOMSA-N 1 0 346.456 3.734 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([S@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220737 1036946742 /nfs/dbraw/zinc/94/67/42/1036946742.db2.gz QUERRIOMIHKXKL-MHECFPHRSA-N 1 0 346.452 3.963 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000542000358 1036963715 /nfs/dbraw/zinc/96/37/15/1036963715.db2.gz QQAAPLLRVDZNHW-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO CC(C)[C@@H]1OCCC[C@@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524373 1037095678 /nfs/dbraw/zinc/09/56/78/1037095678.db2.gz BXKCSXHPPRQLTB-CJNGLKHVSA-N 1 0 326.824 3.789 20 5 EHBDRO Cc1ccc(-c2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cc1[N+](=O)[O-] ZINC000443206332 1037131629 /nfs/dbraw/zinc/13/16/29/1037131629.db2.gz WFRXGZGNSDPHSO-XQQFMLRXSA-N 1 0 330.388 3.887 20 5 EHBDRO C[C@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740711 1037133771 /nfs/dbraw/zinc/13/37/71/1037133771.db2.gz CCZXNUSHEVDOAS-RTBURBONSA-N 1 0 326.396 3.843 20 5 EHBDRO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000590967233 1037144616 /nfs/dbraw/zinc/14/46/16/1037144616.db2.gz SEZAZVYJWSVZFB-BETUJISGSA-N 1 0 326.352 3.551 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(C(=O)c2ccccc2[N+](=O)[O-])CC1 ZINC000180758225 1037149575 /nfs/dbraw/zinc/14/95/75/1037149575.db2.gz BNAYFENRMINBGJ-UHFFFAOYSA-N 1 0 347.459 3.569 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000193023289 1037179018 /nfs/dbraw/zinc/17/90/18/1037179018.db2.gz FNFNVLNJWPOUSS-QGZVFWFLSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000532449030 1037302797 /nfs/dbraw/zinc/30/27/97/1037302797.db2.gz RKAVVSDRKJIKFX-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000462815810 1037435569 /nfs/dbraw/zinc/43/55/69/1037435569.db2.gz FBXHIINGBISJGE-CABCVRRESA-N 1 0 343.402 3.911 20 5 EHBDRO CC[NH+](CC)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491384609 1037436367 /nfs/dbraw/zinc/43/63/67/1037436367.db2.gz UQFYQZZVOHXSIX-IBGZPJMESA-N 1 0 327.428 3.616 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1c(Cl)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000493571965 1037459937 /nfs/dbraw/zinc/45/99/37/1037459937.db2.gz IXTSIEWHSLDEJL-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO CCc1ccc([C@H](NC[C@@H]2CCCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578054 1037514230 /nfs/dbraw/zinc/51/42/30/1037514230.db2.gz PUYIIQRLMNBUCR-HNAYVOBHSA-N 1 0 343.427 3.571 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CC[C@@H]2CCC[C@H]2C1 ZINC000532522761 1037548422 /nfs/dbraw/zinc/54/84/22/1037548422.db2.gz HVMOGMGFPYNLCF-WBTNSWJXSA-N 1 0 345.443 3.870 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000491571348 1037566409 /nfs/dbraw/zinc/56/64/09/1037566409.db2.gz CJTABBAAXZFNBN-ZDUSSCGKSA-N 1 0 328.359 3.909 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC(C)(C)C ZINC000532549549 1037589844 /nfs/dbraw/zinc/58/98/44/1037589844.db2.gz UGDVWDNTVCHCAK-SNVBAGLBSA-N 1 0 327.812 3.553 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC(C)(C)CC1 ZINC000532581713 1037699244 /nfs/dbraw/zinc/69/92/44/1037699244.db2.gz QYQDIWRQEDMOIC-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO CCc1ccc([C@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000463062977 1037715250 /nfs/dbraw/zinc/71/52/50/1037715250.db2.gz ZZKBUQHJSORGLI-KRWDZBQOSA-N 1 0 328.416 3.575 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000157658966 1037795618 /nfs/dbraw/zinc/79/56/18/1037795618.db2.gz CCTQZLLSPLHGJU-ZWKOTPCHSA-N 1 0 332.375 3.898 20 5 EHBDRO C[C@@H](C[NH2+]Cc1c(Cl)n[nH]c1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897458560 1037795795 /nfs/dbraw/zinc/79/57/95/1037795795.db2.gz BHQXRXLVYNTCIA-JTQLQIEISA-N 1 0 334.807 3.742 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540326440 1037823415 /nfs/dbraw/zinc/82/34/15/1037823415.db2.gz WXZGTDBLLWPRPV-WMLDXEAASA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1[N+](=O)[O-] ZINC000897465280 1037872214 /nfs/dbraw/zinc/87/22/14/1037872214.db2.gz VDQWEGONPSYVIE-KGLIPLIRSA-N 1 0 335.407 3.937 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000494177425 1037881554 /nfs/dbraw/zinc/88/15/54/1037881554.db2.gz XBVXNCPSIWACEA-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000492039874 1037914825 /nfs/dbraw/zinc/91/48/25/1037914825.db2.gz DEMYBWITHUHYAB-WRLNGNIRSA-N 1 0 341.386 3.616 20 5 EHBDRO C[C@@H]1SCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592380675 1037951103 /nfs/dbraw/zinc/95/11/03/1037951103.db2.gz PAUVZNUEVRNFBN-IINYFYTJSA-N 1 0 335.454 3.702 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOC1 ZINC000540600138 1038132143 /nfs/dbraw/zinc/13/21/43/1038132143.db2.gz BOOFJNMJLRYCES-KRWDZBQOSA-N 1 0 332.425 3.840 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc(-c2ccco2)s1 ZINC000549407183 1038309776 /nfs/dbraw/zinc/30/97/76/1038309776.db2.gz CSBCCMWBTGMQCM-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(C4CC4)CCOCC3)o2)cc1 ZINC000363800014 1038467847 /nfs/dbraw/zinc/46/78/47/1038467847.db2.gz VISXOIDXHODCRV-UHFFFAOYSA-N 1 0 342.395 3.904 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC([NH+]2CCCC2)CC1 ZINC000470174505 1038468264 /nfs/dbraw/zinc/46/82/64/1038468264.db2.gz LKOIBKHNXXCDEU-SSZFMOIBSA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000538703352 1038477343 /nfs/dbraw/zinc/47/73/43/1038477343.db2.gz CHGRVUMKJLFKTJ-CQSZACIVSA-N 1 0 342.395 3.867 20 5 EHBDRO C[C@@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739852 1038503657 /nfs/dbraw/zinc/50/36/57/1038503657.db2.gz NRWLYCVRFHPQIN-CQSZACIVSA-N 1 0 345.468 3.849 20 5 EHBDRO CC[C@H](C)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000539313683 1038768249 /nfs/dbraw/zinc/76/82/49/1038768249.db2.gz AZQQHAMNOAPTJU-BLLLJJGKSA-N 1 0 336.823 3.822 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2cccc(F)c2)N(C)C)cccc1[N+](=O)[O-] ZINC000479847019 1038803209 /nfs/dbraw/zinc/80/32/09/1038803209.db2.gz AHMUPHWJWZGIAD-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO COc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)C2)cc1F ZINC000500493663 1038828000 /nfs/dbraw/zinc/82/80/00/1038828000.db2.gz DUMPRYHDSZZTKB-HDJSIYSDSA-N 1 0 348.349 3.917 20 5 EHBDRO COc1ccc([C@H]2C[C@H]([NH2+]Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000500505981 1038867806 /nfs/dbraw/zinc/86/78/06/1038867806.db2.gz BBMHNHMDJUPAQI-SHTZXODSSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@@H](c3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000485473037 1039136082 /nfs/dbraw/zinc/13/60/82/1039136082.db2.gz HMALGUOIWVHCKB-PBHICJAKSA-N 1 0 326.396 3.981 20 5 EHBDRO O=C(C[NH2+]Cc1c2ccccc2cc2ccccc21)NCc1ccco1 ZINC000030641945 1039136972 /nfs/dbraw/zinc/13/69/72/1039136972.db2.gz MMLBHMLJUWJAOP-UHFFFAOYSA-N 1 0 344.414 3.992 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000480225474 1039324431 /nfs/dbraw/zinc/32/44/31/1039324431.db2.gz KRBJRADTIVGWIP-MRXNPFEDSA-N 1 0 339.439 3.612 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1F)c1ccc(Cl)cc1 ZINC000478273246 1039339403 /nfs/dbraw/zinc/33/94/03/1039339403.db2.gz MKXCVXYVWRMZIV-INIZCTEOSA-N 1 0 338.766 3.865 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478328257 1039373705 /nfs/dbraw/zinc/37/37/05/1039373705.db2.gz PCWOAYNCGHODCG-APPDUMDISA-N 1 0 336.338 3.739 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)cc1[N+](=O)[O-] ZINC000480276679 1039374278 /nfs/dbraw/zinc/37/42/78/1039374278.db2.gz HUXATSLBNYDUIL-GUYCJALGSA-N 1 0 333.457 3.918 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000120267413 1039404249 /nfs/dbraw/zinc/40/42/49/1039404249.db2.gz LPCBHPOVZDDDJS-OAHLLOKOSA-N 1 0 347.802 3.588 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2c2ccccc2)c2c(c1)COCO2 ZINC000054669941 1039447791 /nfs/dbraw/zinc/44/77/91/1039447791.db2.gz QORLRXRZTAMMRP-SFHVURJKSA-N 1 0 340.379 3.798 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417299054 1039640612 /nfs/dbraw/zinc/64/06/12/1039640612.db2.gz LWWQGSVIOKMSFY-QZTJIDSGSA-N 1 0 343.427 3.848 20 5 EHBDRO Cc1cc(C[C@@H](C)[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000417312937 1039670201 /nfs/dbraw/zinc/67/02/01/1039670201.db2.gz UCXDSOJUPVPIEI-KZULUSFZSA-N 1 0 328.416 3.615 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCO[C@@H](C3CC3)C1)CCCC2 ZINC000417346589 1039707755 /nfs/dbraw/zinc/70/77/55/1039707755.db2.gz ULPSZSCQRDUJIA-KFKAGJAMSA-N 1 0 330.428 3.910 20 5 EHBDRO CCOC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)C ZINC000549708987 1039715081 /nfs/dbraw/zinc/71/50/81/1039715081.db2.gz MGBKZLVAMZRJEB-AWEZNQCLSA-N 1 0 334.338 3.764 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCc1ccc2ccccc2n1 ZINC000566474131 1039762300 /nfs/dbraw/zinc/76/23/00/1039762300.db2.gz FJXCDEQZDOHHKD-LJQANCHMSA-N 1 0 333.391 3.963 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(F)c2cccnc12 ZINC000554834886 1039810306 /nfs/dbraw/zinc/81/03/06/1039810306.db2.gz MMCFFTVNGNWZON-UHFFFAOYSA-N 1 0 339.370 3.957 20 5 EHBDRO COc1ccc([C@H](C)C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000549809207 1039927397 /nfs/dbraw/zinc/92/73/97/1039927397.db2.gz AHYACSUGECUIJP-OAHLLOKOSA-N 1 0 328.412 3.881 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000489495471 1040040432 /nfs/dbraw/zinc/04/04/32/1040040432.db2.gz JJBPHZUQGQRICA-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN(C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000480871976 1040107949 /nfs/dbraw/zinc/10/79/49/1040107949.db2.gz WELMNQOSVAQMSD-HNNXBMFYSA-N 1 0 345.418 3.825 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000490034290 1040300662 /nfs/dbraw/zinc/30/06/62/1040300662.db2.gz VBXTYPPEPKBEFF-PBHICJAKSA-N 1 0 326.396 3.981 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1 ZINC000490019318 1040310507 /nfs/dbraw/zinc/31/05/07/1040310507.db2.gz JGWSERDMQYZCOK-SFHVURJKSA-N 1 0 325.412 3.714 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481093935 1040349751 /nfs/dbraw/zinc/34/97/51/1040349751.db2.gz VJASSWJHYDEEQC-ZIAGYGMSSA-N 1 0 333.432 3.728 20 5 EHBDRO C[NH+](C)[C@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490130764 1040365146 /nfs/dbraw/zinc/36/51/46/1040365146.db2.gz OJAKAUPAAHNFTQ-UXHICEINSA-N 1 0 339.439 3.614 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@H]2CCCCO2)c2ccccc2)c1 ZINC000490183780 1040371864 /nfs/dbraw/zinc/37/18/64/1040371864.db2.gz BNZLHRXEWBXDAR-MOPGFXCFSA-N 1 0 326.396 3.843 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC000486772276 1040427484 /nfs/dbraw/zinc/42/74/84/1040427484.db2.gz KPEPJLIIRNVDEB-AWEZNQCLSA-N 1 0 349.431 3.587 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000481195099 1040474303 /nfs/dbraw/zinc/47/43/03/1040474303.db2.gz WVWSBKUHLCHVPG-NQBHXWOUSA-N 1 0 339.823 3.601 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCC(=O)OC(C)(C)C ZINC000468744821 1040489527 /nfs/dbraw/zinc/48/95/27/1040489527.db2.gz PFFCTEAXQIAEHK-SDNWHVSQSA-N 1 0 334.416 3.710 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000490309111 1040490934 /nfs/dbraw/zinc/49/09/34/1040490934.db2.gz SMQHYRDCWDFNQD-YYIAUSFCSA-N 1 0 331.460 3.993 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1(C)COC1 ZINC000600188266 1040779752 /nfs/dbraw/zinc/77/97/52/1040779752.db2.gz BKOMGVAKDYHMFW-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CC[C@H]3CC[C@@H](C2)S3)c1 ZINC000600190349 1040799638 /nfs/dbraw/zinc/79/96/38/1040799638.db2.gz OQXGIESABJKDRI-OLZOCXBDSA-N 1 0 344.383 3.666 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541545023 1040925335 /nfs/dbraw/zinc/92/53/35/1040925335.db2.gz HIBLNSCQMPDPIF-OALUTQOASA-N 1 0 346.427 3.980 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cccc3c2OCO3)c2cc([N+](=O)[O-])ccc21 ZINC000433155788 1040938085 /nfs/dbraw/zinc/93/80/85/1040938085.db2.gz ZBGAQHMLIWWKFE-INIZCTEOSA-N 1 0 340.379 3.836 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2[nH]c(=O)oc2c1 ZINC000586789275 1041022279 /nfs/dbraw/zinc/02/22/79/1041022279.db2.gz LTMFBCMQBGTTJL-GHMZBOCLSA-N 1 0 327.340 3.853 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc3[nH]c(=O)oc3c2)cccc1[N+](=O)[O-] ZINC000586793754 1041029128 /nfs/dbraw/zinc/02/91/28/1041029128.db2.gz HPRLXGXEGGCIDT-LLVKDONJSA-N 1 0 327.340 3.601 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CC3(SC)CC3)o2)c([N+](=O)[O-])c1 ZINC000433192443 1041032784 /nfs/dbraw/zinc/03/27/84/1041032784.db2.gz LNBGYUJUHJFSML-UHFFFAOYSA-N 1 0 348.424 3.849 20 5 EHBDRO CCC[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000512855696 1041116577 /nfs/dbraw/zinc/11/65/77/1041116577.db2.gz JAOOJUOZTHSQTI-SFHVURJKSA-N 1 0 330.384 3.904 20 5 EHBDRO CCC[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOC1 ZINC000512855694 1041117714 /nfs/dbraw/zinc/11/77/14/1041117714.db2.gz JAOOJUOZTHSQTI-GOSISDBHSA-N 1 0 330.384 3.904 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433280614 1041191834 /nfs/dbraw/zinc/19/18/34/1041191834.db2.gz CYWKJKAEVKYTSO-DNVCBOLYSA-N 1 0 340.423 3.683 20 5 EHBDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433295453 1041248090 /nfs/dbraw/zinc/24/80/90/1041248090.db2.gz DMNSNURCXGDWBW-SJORKVTESA-N 1 0 334.460 3.950 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ccccc2)C2(CO)CCC2)cc1 ZINC000433316141 1041288263 /nfs/dbraw/zinc/28/82/63/1041288263.db2.gz DPUZPUPTAFDDIF-IBGZPJMESA-N 1 0 340.423 3.631 20 5 EHBDRO CCn1nccc1C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000278837762 1041574645 /nfs/dbraw/zinc/57/46/45/1041574645.db2.gz IZAYSLZUGVSQPH-CQSZACIVSA-N 1 0 328.416 3.752 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000181746222 1041901100 /nfs/dbraw/zinc/90/11/00/1041901100.db2.gz ZUUPPXMNVUSZPT-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO COc1cccc(NC2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000107714158 1041961586 /nfs/dbraw/zinc/96/15/86/1041961586.db2.gz LCBAEVKMWVSWIG-UHFFFAOYSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](C3CC3)C3CCCC3)o2)cc1 ZINC000107791064 1041972689 /nfs/dbraw/zinc/97/26/89/1041972689.db2.gz CFAVKWAJMBIUQJ-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO CC(C)c1ccccc1C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001167779543 1042142818 /nfs/dbraw/zinc/14/28/18/1042142818.db2.gz UYNRDIASYROEFN-MRXNPFEDSA-N 1 0 340.427 3.800 20 5 EHBDRO CCc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+](C)C)cc1 ZINC000111176621 1042239078 /nfs/dbraw/zinc/23/90/78/1042239078.db2.gz BWACYBHFPZXWIW-QGZVFWFLSA-N 1 0 328.416 3.575 20 5 EHBDRO C[C@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1nccs1 ZINC000184397941 1042511333 /nfs/dbraw/zinc/51/13/33/1042511333.db2.gz KCFFMMANJBQNMY-NSHDSACASA-N 1 0 344.396 3.600 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOC2(CCCCC2)C1 ZINC000136718628 1042522998 /nfs/dbraw/zinc/52/29/98/1042522998.db2.gz KPPLLKSSUTUSKL-INIZCTEOSA-N 1 0 348.443 3.965 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000120337240 1042597083 /nfs/dbraw/zinc/59/70/83/1042597083.db2.gz ONGYAITWBKTXEJ-MRXNPFEDSA-N 1 0 328.368 3.955 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032645 1042607385 /nfs/dbraw/zinc/60/73/85/1042607385.db2.gz SPQUPQLHOYTZMS-ZFWWWQNUSA-N 1 0 331.441 3.979 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000432314036 1042797459 /nfs/dbraw/zinc/79/74/59/1042797459.db2.gz MWAKCUFBNLYSIY-GOSISDBHSA-N 1 0 336.395 3.858 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000343985121 1043065143 /nfs/dbraw/zinc/06/51/43/1043065143.db2.gz VQNCEPPAFHXXJF-CQSZACIVSA-N 1 0 329.400 3.504 20 5 EHBDRO Cn1ncc2c1CCC[C@@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279105193 1043354929 /nfs/dbraw/zinc/35/49/29/1043354929.db2.gz OTHDYAPVPSNGAP-IRXDYDNUSA-N 1 0 340.427 3.718 20 5 EHBDRO Cn1ncc2c1CCC[C@H]2[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279105194 1043356393 /nfs/dbraw/zinc/35/63/93/1043356393.db2.gz OTHDYAPVPSNGAP-SJORKVTESA-N 1 0 340.427 3.718 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@@H+]1C ZINC000090095026 1043367795 /nfs/dbraw/zinc/36/77/95/1043367795.db2.gz WVBSFPKPIMBFMF-ZBFHGGJFSA-N 1 0 340.427 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@H+](C3CC3)C3CCCC3)c2)cc1 ZINC000728896140 1043522652 /nfs/dbraw/zinc/52/26/52/1043522652.db2.gz DOSSABADMTYFCS-UHFFFAOYSA-N 1 0 326.400 3.823 20 5 EHBDRO Cc1n[nH]cc1CCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279226044 1043603048 /nfs/dbraw/zinc/60/30/48/1043603048.db2.gz ZLUAIPGEGJSDRN-KRWDZBQOSA-N 1 0 328.416 3.571 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc([N+](=O)[O-])[nH]1 ZINC000344437057 1044007193 /nfs/dbraw/zinc/00/71/93/1044007193.db2.gz HWNLFUDTHCMFLX-UHFFFAOYSA-N 1 0 342.399 3.551 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210857 1044162436 /nfs/dbraw/zinc/16/24/36/1044162436.db2.gz FWIQXLHOROAZRZ-IAGOWNOFSA-N 1 0 331.460 3.681 20 5 EHBDRO CC(C)[NH+]1CCC(NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000279517271 1044168318 /nfs/dbraw/zinc/16/83/18/1044168318.db2.gz NZVASDVLEWWGER-UHFFFAOYSA-N 1 0 345.365 3.576 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCOC3(CCOCC3)C2)cc1[N+](=O)[O-] ZINC000344879059 1044642621 /nfs/dbraw/zinc/64/26/21/1044642621.db2.gz JWEJFMFRMFQYMR-MRXNPFEDSA-N 1 0 348.443 3.536 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000183356211 1125537870 /nfs/dbraw/zinc/53/78/70/1125537870.db2.gz KSXGAWXYRACGGD-LSDHHAIUSA-N 1 0 341.411 3.624 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000163223387 1125695933 /nfs/dbraw/zinc/69/59/33/1125695933.db2.gz YLHSAKVQJHLGOV-FZMZJTMJSA-N 1 0 339.823 3.745 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072746571 1126872236 /nfs/dbraw/zinc/87/22/36/1126872236.db2.gz WUIUWBHSLTUBGM-MOPGFXCFSA-N 1 0 326.396 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC4C[C@@H]5CC3C[C@H](C4)C5)nc2c1 ZINC000083169562 1127220388 /nfs/dbraw/zinc/22/03/88/1127220388.db2.gz RVYGYEJJJQVPPU-DOOHLRMFSA-N 1 0 327.384 3.747 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000552137793 1127618390 /nfs/dbraw/zinc/61/83/90/1127618390.db2.gz NAHXLJCRUSDESP-XLCPLWEUSA-N 1 0 332.444 3.729 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000301349201 1127739055 /nfs/dbraw/zinc/73/90/55/1127739055.db2.gz LYXYDEPYHIIDIY-HNNXBMFYSA-N 1 0 349.362 3.585 20 5 EHBDRO CC(C)OCC[NH+]1CCC(Nc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301484656 1128480447 /nfs/dbraw/zinc/48/04/47/1128480447.db2.gz VQJUVCLODWHBHB-UHFFFAOYSA-N 1 0 341.839 3.550 20 5 EHBDRO Cc1cnc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564047 1128494688 /nfs/dbraw/zinc/49/46/88/1128494688.db2.gz VRNPDEUWRPYHDB-NVXWUHKLSA-N 1 0 340.427 3.763 20 5 EHBDRO CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765848596 1128559595 /nfs/dbraw/zinc/55/95/95/1128559595.db2.gz ICAUTYRTXMLRHE-OALUTQOASA-N 1 0 346.402 3.624 20 5 EHBDRO Cc1c(C[NH2+]C2CCN(c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000327134372 1128666273 /nfs/dbraw/zinc/66/62/73/1128666273.db2.gz UJNRQUKBQFAFEE-UHFFFAOYSA-N 1 0 325.412 3.662 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123253234 1128735533 /nfs/dbraw/zinc/73/55/33/1128735533.db2.gz VBUYBISOJBIEKD-HUUCEWRRSA-N 1 0 328.412 3.928 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])c(C)n2)[NH+]2CCCC2)cc1 ZINC000301652107 1128847769 /nfs/dbraw/zinc/84/77/69/1128847769.db2.gz QKKSBOKFORGPTD-SFHVURJKSA-N 1 0 340.427 3.856 20 5 EHBDRO Cc1nc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651000 1128847937 /nfs/dbraw/zinc/84/79/37/1128847937.db2.gz JUODLXGCXRDQAN-CXAGYDPISA-N 1 0 346.456 3.855 20 5 EHBDRO COc1ccc(CNc2cccc(C[NH+]3CCCC3)c2)cc1[N+](=O)[O-] ZINC001648846069 1120052633 /nfs/dbraw/zinc/05/26/33/1120052633.db2.gz HEGAMOQVTOADCI-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000494439044 1120566898 /nfs/dbraw/zinc/56/68/98/1120566898.db2.gz YRBSBBGJNZNADX-HOTGVXAUSA-N 1 0 332.425 3.572 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NC1(c2cccc(C)c2)COC1 ZINC001168474866 1120923859 /nfs/dbraw/zinc/92/38/59/1120923859.db2.gz PXWYTRBVAQCLIW-UHFFFAOYSA-N 1 0 325.476 3.929 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301067847 1121303476 /nfs/dbraw/zinc/30/34/76/1121303476.db2.gz RIFJBPIMMTXEGV-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO Cc1cnc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039571 1128977077 /nfs/dbraw/zinc/97/70/77/1128977077.db2.gz DWZQUFWAEDXCEL-DOTOQJQBSA-N 1 0 340.427 3.621 20 5 EHBDRO COc1cc(NCCC[N@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000301718609 1128980475 /nfs/dbraw/zinc/98/04/75/1128980475.db2.gz DKLRJPJQKQHGRB-UHFFFAOYSA-N 1 0 347.390 3.677 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000090540829 1121403812 /nfs/dbraw/zinc/40/38/12/1121403812.db2.gz ZUSRWJPZZBESAI-JJRVBVJISA-N 1 0 336.457 3.609 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000301085830 1121518500 /nfs/dbraw/zinc/51/85/00/1121518500.db2.gz XBTOILLVVKMTPH-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO C[C@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC[C@@H]1C ZINC000122683561 1121522703 /nfs/dbraw/zinc/52/27/03/1121522703.db2.gz ZBHGKOVUIYECET-KBPBESRZSA-N 1 0 329.400 3.770 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CCN(C2CCCC2)C1)C1CC1 ZINC000153682098 1121581622 /nfs/dbraw/zinc/58/16/22/1121581622.db2.gz OPGAJSYCQGAFOS-MJGOQNOKSA-N 1 0 343.471 3.522 20 5 EHBDRO O=c1[nH]c2ccccc2cc1C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153291073 1121641404 /nfs/dbraw/zinc/64/14/04/1121641404.db2.gz WATBHEHMJAQIDJ-UHFFFAOYSA-N 1 0 349.390 3.601 20 5 EHBDRO Cc1ccc([C@H](CNc2ncc(Cl)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000301730713 1129010436 /nfs/dbraw/zinc/01/04/36/1129010436.db2.gz DEQNGRVOVZUEIG-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc(F)cc2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000301137419 1122097490 /nfs/dbraw/zinc/09/74/90/1122097490.db2.gz CFLDSGHSZXXJTJ-MRXNPFEDSA-N 1 0 333.363 3.884 20 5 EHBDRO C[C@@H]1C[C@@H](c2cccc(F)c2)[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154373303 1122586574 /nfs/dbraw/zinc/58/65/74/1122586574.db2.gz RYXQVYFTNQFPSG-VMDGZTHMSA-N 1 0 344.386 3.850 20 5 EHBDRO COc1ncc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000556574803 1123041836 /nfs/dbraw/zinc/04/18/36/1123041836.db2.gz SMTFYEONGIUGHV-NSHDSACASA-N 1 0 335.791 3.811 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000007783634 1123353527 /nfs/dbraw/zinc/35/35/27/1123353527.db2.gz JRUPGCONNROUFJ-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO Cc1ccc([C@H](CNc2ncc([N+](=O)[O-])s2)[NH+]2CCCC2)cc1 ZINC000195511785 1123504616 /nfs/dbraw/zinc/50/46/16/1123504616.db2.gz ZBDDSHOPXCWZRE-AWEZNQCLSA-N 1 0 332.429 3.609 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCS[C@H](c2ccccc2)C1 ZINC000609800298 1123664410 /nfs/dbraw/zinc/66/44/10/1123664410.db2.gz AARZVUOZDYHWAU-SFHVURJKSA-N 1 0 344.436 3.764 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1ccsc1 ZINC000619754104 1125395342 /nfs/dbraw/zinc/39/53/42/1125395342.db2.gz CHUQBCSSMZUQEO-RYUDHWBXSA-N 1 0 333.413 3.724 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CCOc2ccccc21 ZINC000619846217 1125416222 /nfs/dbraw/zinc/41/62/22/1125416222.db2.gz FANHWGMBHCWYSN-MRXNPFEDSA-N 1 0 326.396 3.635 20 5 EHBDRO CCOC(=O)CC[C@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687112 1129180817 /nfs/dbraw/zinc/18/08/17/1129180817.db2.gz SBJSPKZBTVGACV-CXOKCQFOSA-N 1 0 346.427 3.663 20 5 EHBDRO CO[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000453212468 1129181337 /nfs/dbraw/zinc/18/13/37/1129181337.db2.gz HYINARBATSVLEE-KBPBESRZSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1ccccc1[N+](=O)[O-] ZINC000078989338 1129220706 /nfs/dbraw/zinc/22/07/06/1129220706.db2.gz YFZSZBYULWLLHS-QWHCGFSZSA-N 1 0 328.368 3.778 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301861151 1129228732 /nfs/dbraw/zinc/22/87/32/1129228732.db2.gz KVYVAYVJWSTQGX-OAHLLOKOSA-N 1 0 326.400 3.551 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301886396 1129265549 /nfs/dbraw/zinc/26/55/49/1129265549.db2.gz QDLXAORJQGXZPF-OAHLLOKOSA-N 1 0 340.427 3.801 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602939 1129278053 /nfs/dbraw/zinc/27/80/53/1129278053.db2.gz OOZBPHORPQZRLD-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247736 1129371379 /nfs/dbraw/zinc/37/13/79/1129371379.db2.gz HYTRUVCPMJZSAN-UONOGXRCSA-N 1 0 333.432 3.598 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000131034387 1129406437 /nfs/dbraw/zinc/40/64/37/1129406437.db2.gz DWCAJJLIZWRJNF-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1nccn1-c1ccc([C@@H](C)Nc2ncc(C)cc2[N+](=O)[O-])cc1 ZINC000086187639 1129423836 /nfs/dbraw/zinc/42/38/36/1129423836.db2.gz YDYSHVRRMGCQRB-CYBMUJFWSA-N 1 0 337.383 3.965 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418037 1129474827 /nfs/dbraw/zinc/47/48/27/1129474827.db2.gz MFRPFGRKJBZBSX-HOTGVXAUSA-N 1 0 349.475 3.909 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000543427517 1129482968 /nfs/dbraw/zinc/48/29/68/1129482968.db2.gz BHVFJDDAZVMMES-LSDHHAIUSA-N 1 0 332.400 3.795 20 5 EHBDRO CCC[C@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494515 1129492189 /nfs/dbraw/zinc/49/21/89/1129492189.db2.gz DFTCOBWYXOJIAK-CABCVRRESA-N 1 0 333.432 3.742 20 5 EHBDRO CCCC(C)(C)[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000555070247 1129529125 /nfs/dbraw/zinc/52/91/25/1129529125.db2.gz ACKGPPFPIGKFQN-UHFFFAOYSA-N 1 0 336.461 3.934 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000327948572 1129539982 /nfs/dbraw/zinc/53/99/82/1129539982.db2.gz BLZQUFXLEHCQSE-RCCFBDPRSA-N 1 0 348.443 3.509 20 5 EHBDRO COCc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000154258362 1129543826 /nfs/dbraw/zinc/54/38/26/1129543826.db2.gz UAKCPSVCPGCUJU-UHFFFAOYSA-N 1 0 326.396 3.906 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2nc3ccc(F)cc3s2)c1 ZINC000428869126 1129556952 /nfs/dbraw/zinc/55/69/52/1129556952.db2.gz UCHJSRAQWFKWFN-UHFFFAOYSA-N 1 0 331.372 3.676 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922540460 1129567996 /nfs/dbraw/zinc/56/79/96/1129567996.db2.gz JHYGVEYSHYOILR-HUUCEWRRSA-N 1 0 344.411 3.859 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802856 1129590480 /nfs/dbraw/zinc/59/04/80/1129590480.db2.gz YFWXURGDCNIZEK-MLGOLLRUSA-N 1 0 346.818 3.576 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000389940436 1129597056 /nfs/dbraw/zinc/59/70/56/1129597056.db2.gz MJLCSFBRBSKXQI-INIZCTEOSA-N 1 0 328.412 3.988 20 5 EHBDRO Cc1cc(F)ccc1[C@H](C)NCc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000922671698 1129621246 /nfs/dbraw/zinc/62/12/46/1129621246.db2.gz RXNYDDKVRZKVTN-LBPRGKRZSA-N 1 0 346.358 3.760 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390518309 1129621683 /nfs/dbraw/zinc/62/16/83/1129621683.db2.gz DUSIKLDDVRSAPL-OXJNMPFZSA-N 1 0 339.439 3.910 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N(C)Cc1ccccc1 ZINC000390571401 1129624200 /nfs/dbraw/zinc/62/42/00/1129624200.db2.gz TZIJQQDDUYCUOL-CVEARBPZSA-N 1 0 327.428 3.766 20 5 EHBDRO COc1ccc(C[NH+]2CC(C)C2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000555339507 1129628808 /nfs/dbraw/zinc/62/88/08/1129628808.db2.gz BITPHVNHFNUUFA-UHFFFAOYSA-N 1 0 342.395 3.634 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])nc1 ZINC000390849043 1129638367 /nfs/dbraw/zinc/63/83/67/1129638367.db2.gz HVQFYKDTGNBKTI-KRWDZBQOSA-N 1 0 340.427 3.702 20 5 EHBDRO COc1ccc2oc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)cc2c1 ZINC000124999411 1129651608 /nfs/dbraw/zinc/65/16/08/1129651608.db2.gz AJMKOUAAPHSVFT-UHFFFAOYSA-N 1 0 326.352 3.682 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304727 1129660044 /nfs/dbraw/zinc/66/00/44/1129660044.db2.gz UJLAKCPTEFGDAT-CABCVRRESA-N 1 0 333.432 3.742 20 5 EHBDRO CCC[C@@H]([NH2+]CCCn1nc(C)cc1C)c1cccc([N+](=O)[O-])c1 ZINC000156379016 1129713347 /nfs/dbraw/zinc/71/33/47/1129713347.db2.gz BXRZBGQNKWHQRV-GOSISDBHSA-N 1 0 330.432 3.929 20 5 EHBDRO Cc1cc(N[C@@H](C)C[C@H](O)c2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302088404 1129766918 /nfs/dbraw/zinc/76/69/18/1129766918.db2.gz OJOHFICLBUSSNZ-SJCJKPOMSA-N 1 0 341.367 3.969 20 5 EHBDRO COc1cc(N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081754 1129767313 /nfs/dbraw/zinc/76/73/13/1129767313.db2.gz YATLHLGMSTZHQX-CVEARBPZSA-N 1 0 347.459 3.694 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000302268906 1129774806 /nfs/dbraw/zinc/77/48/06/1129774806.db2.gz GPNOAGSTHSFZQL-YGRLFVJLSA-N 1 0 344.242 3.822 20 5 EHBDRO C[C@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)C[NH+]1CCCCC1 ZINC000302945224 1129800381 /nfs/dbraw/zinc/80/03/81/1129800381.db2.gz IWZSYGGXRYWLBN-CQSZACIVSA-N 1 0 328.416 3.677 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196347 1129805717 /nfs/dbraw/zinc/80/57/17/1129805717.db2.gz NSKJMSZBBOGRFI-STQMWFEESA-N 1 0 345.374 3.720 20 5 EHBDRO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000227525030 1129911884 /nfs/dbraw/zinc/91/18/84/1129911884.db2.gz SUDWGEYMFBSNFY-ZNMIVQPWSA-N 1 0 342.443 3.921 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCc2nc3ccccc3n2C(F)F)c1 ZINC000347842795 1129915410 /nfs/dbraw/zinc/91/54/10/1129915410.db2.gz SSPAJMXNPLULDQ-UHFFFAOYSA-N 1 0 346.337 3.672 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000132869108 1129920573 /nfs/dbraw/zinc/92/05/73/1129920573.db2.gz HLUNUZNSKPBFFV-CQSZACIVSA-N 1 0 345.468 3.674 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328717 1130207671 /nfs/dbraw/zinc/20/76/71/1130207671.db2.gz YVWLGZGODDJRDQ-STQMWFEESA-N 1 0 339.395 3.891 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN2CC)cc1[N+](=O)[O-] ZINC000245503907 1130224542 /nfs/dbraw/zinc/22/45/42/1130224542.db2.gz JAKUJWWHJAJSBM-ZBFHGGJFSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000245528189 1130230701 /nfs/dbraw/zinc/23/07/01/1130230701.db2.gz QJIXSGDGBJIGTC-HOTGVXAUSA-N 1 0 342.443 3.652 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000174146410 1130337636 /nfs/dbraw/zinc/33/76/36/1130337636.db2.gz BVEBATMNHSYBEI-KGLIPLIRSA-N 1 0 333.432 3.789 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174200813 1130340682 /nfs/dbraw/zinc/34/06/82/1130340682.db2.gz AXDGODWIZOQRKZ-KRWDZBQOSA-N 1 0 330.388 3.657 20 5 EHBDRO CC(C)(C)OC(=O)c1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000174630101 1130373733 /nfs/dbraw/zinc/37/37/33/1130373733.db2.gz MICMJPVDNKCUEB-UHFFFAOYSA-N 1 0 342.395 3.840 20 5 EHBDRO COCCN1CC[C@@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000730818388 1130742354 /nfs/dbraw/zinc/74/23/54/1130742354.db2.gz SDYOEOIQRIIRKW-LJQANCHMSA-N 1 0 334.463 3.803 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NCC1C[NH+](Cc2ccccc2)C1 ZINC000716191277 1131160605 /nfs/dbraw/zinc/16/06/05/1131160605.db2.gz ZGYJIFKJWLKXAG-UHFFFAOYSA-N 1 0 348.406 3.687 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CCO)C2CC2)s1 ZINC000741258528 1131590747 /nfs/dbraw/zinc/59/07/47/1131590747.db2.gz NHGOTLPHQMXUIG-OAHLLOKOSA-N 1 0 332.425 3.574 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCC2([NH+](C)C)CCCCCC2)c1 ZINC000741747506 1131639422 /nfs/dbraw/zinc/63/94/22/1131639422.db2.gz URMQEEFBLHTKES-UHFFFAOYSA-N 1 0 339.411 3.809 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CC[C@H](C[NH+]4CCCCC4)C3)sc2c1 ZINC000742417999 1131722125 /nfs/dbraw/zinc/72/21/25/1131722125.db2.gz JCKAFXYGMOSVPS-CYBMUJFWSA-N 1 0 346.456 3.517 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1F ZINC000742715067 1131784457 /nfs/dbraw/zinc/78/44/57/1131784457.db2.gz RAYZFNPIKSSNKM-IUODEOHRSA-N 1 0 342.367 3.536 20 5 EHBDRO C[NH2+]Cc1ccc(N[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172909126 1131880508 /nfs/dbraw/zinc/88/05/08/1131880508.db2.gz GKJAXNICKBIIQZ-SFHVURJKSA-N 1 0 325.412 3.674 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(O)c1 ZINC001172897980 1131880567 /nfs/dbraw/zinc/88/05/67/1131880567.db2.gz FQOJMQWHRDHWKY-CXAGYDPISA-N 1 0 326.396 3.899 20 5 EHBDRO [NH3+]Cc1ccc2nn([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)cc2c1 ZINC001172897849 1131881332 /nfs/dbraw/zinc/88/13/32/1131881332.db2.gz CIFVIJXGAAFJQC-KRWDZBQOSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1COCc3ccccc31)CC2 ZINC001172899697 1131882069 /nfs/dbraw/zinc/88/20/69/1131882069.db2.gz FABOIONZOMNHMT-FXAWDEMLSA-N 1 0 338.407 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1COCc3ccccc31)CC2 ZINC001172899699 1131882841 /nfs/dbraw/zinc/88/28/41/1131882841.db2.gz FABOIONZOMNHMT-PXNSSMCTSA-N 1 0 338.407 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOCc1ccccc1)CC2 ZINC001172900471 1131883893 /nfs/dbraw/zinc/88/38/93/1131883893.db2.gz UDBDGHCRRRUAFG-IBGZPJMESA-N 1 0 340.423 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC[C@H](O)c1ccccc1)CC2 ZINC001172901877 1131885364 /nfs/dbraw/zinc/88/53/64/1131885364.db2.gz QOLPDNAGAJYPET-QUCCMNQESA-N 1 0 340.423 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCc3cnccc31)CC2 ZINC001172905360 1131886183 /nfs/dbraw/zinc/88/61/83/1131886183.db2.gz JEZNNWKHHHKGRD-YLJYHZDGSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cccc3ncoc31)CC2 ZINC001172903707 1131886392 /nfs/dbraw/zinc/88/63/92/1131886392.db2.gz SPGKLQGEZQJBDX-INIZCTEOSA-N 1 0 337.379 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H](c1cccnc1)C1CC1)CC2 ZINC001172903232 1131887005 /nfs/dbraw/zinc/88/70/05/1131887005.db2.gz POXDQXFTCGMXHT-QUCCMNQESA-N 1 0 337.423 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(Cc3cccnc3)CC1)CC2 ZINC001172905800 1131887167 /nfs/dbraw/zinc/88/71/67/1131887167.db2.gz KUMAUAMDHIZFTG-SFHVURJKSA-N 1 0 337.423 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](c3ccncc3)C1)CC2 ZINC001172911305 1131917867 /nfs/dbraw/zinc/91/78/67/1131917867.db2.gz SECGJTKBRZQOTF-OALUTQOASA-N 1 0 337.423 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC1(c3ccccn3)CC1)CC2 ZINC001172913541 1131918960 /nfs/dbraw/zinc/91/89/60/1131918960.db2.gz WXLNEQPQXKWBGC-KRWDZBQOSA-N 1 0 337.423 3.559 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000743475667 1131928859 /nfs/dbraw/zinc/92/88/59/1131928859.db2.gz WKYLVXQHAZOLKY-CHWSQXEVSA-N 1 0 339.395 3.526 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccccc2C)c1F ZINC001173175706 1131991400 /nfs/dbraw/zinc/99/14/00/1131991400.db2.gz RCBPZFVGFDZVBC-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CCC3(CCC3)CC2)c1F ZINC001173180472 1131992165 /nfs/dbraw/zinc/99/21/65/1131992165.db2.gz KZLXAAOJLHDGBP-ZDUSSCGKSA-N 1 0 336.407 3.940 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCCC23CCC3)c1F ZINC001173187357 1131993294 /nfs/dbraw/zinc/99/32/94/1131993294.db2.gz ZZIMVSRAOZHCIJ-MLGOLLRUSA-N 1 0 336.407 3.986 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCN(C)c1ccccc1 ZINC001173214902 1132001045 /nfs/dbraw/zinc/00/10/45/1132001045.db2.gz RIVAYFYXTOOOKS-MRXNPFEDSA-N 1 0 327.428 3.642 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173215792 1132001670 /nfs/dbraw/zinc/00/16/70/1132001670.db2.gz ZUSGWNKVKYRVIJ-GJZGRUSLSA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)nc1 ZINC001173215604 1132002411 /nfs/dbraw/zinc/00/24/11/1132002411.db2.gz XHTKEBZKSAGSSX-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2cc(F)cc(F)c21 ZINC001173220258 1132004304 /nfs/dbraw/zinc/00/43/04/1132004304.db2.gz WSXKNVDYUIYDLT-ZBEGNZNMSA-N 1 0 348.349 3.917 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2cc(F)cc(F)c21 ZINC001173220257 1132004315 /nfs/dbraw/zinc/00/43/15/1132004315.db2.gz WSXKNVDYUIYDLT-MEDUHNTESA-N 1 0 348.349 3.917 20 5 EHBDRO COc1cccc2c1c(C[NH3+])cn2[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173221840 1132004801 /nfs/dbraw/zinc/00/48/01/1132004801.db2.gz QHBAZKUEICKQIN-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2ccc(F)cc2)C1 ZINC001173227265 1132006619 /nfs/dbraw/zinc/00/66/19/1132006619.db2.gz PAWLSDDAARZWTF-LIRRHRJNSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC001173232283 1132008869 /nfs/dbraw/zinc/00/88/69/1132008869.db2.gz AGTAKDGXOQJYAH-KUHUBIRLSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001173230954 1132009534 /nfs/dbraw/zinc/00/95/34/1132009534.db2.gz WSRNGQJXCAMGPY-FZKQIMNGSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](C(=O)c2ccccc2)C1 ZINC001173233809 1132010399 /nfs/dbraw/zinc/01/03/99/1132010399.db2.gz YYWJXLCQEINBSN-YJBOKZPZSA-N 1 0 338.407 3.731 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C(C)(C)C(=O)c1ccccc1 ZINC001173212346 1132013943 /nfs/dbraw/zinc/01/39/43/1132013943.db2.gz ZVDVDSVLUFCATB-CQSZACIVSA-N 1 0 326.396 3.777 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1ccccc1Cl ZINC001173210795 1132014100 /nfs/dbraw/zinc/01/41/00/1132014100.db2.gz NOAUNJXKAFNIII-CYBMUJFWSA-N 1 0 334.803 3.848 20 5 EHBDRO [NH3+]Cc1cc2cc(Cl)ccc2n1-c1cc(Cl)ncc1[N+](=O)[O-] ZINC001155989137 1132429435 /nfs/dbraw/zinc/42/94/35/1132429435.db2.gz AJAQYBLDOSPNCL-UHFFFAOYSA-N 1 0 337.166 3.699 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054563 1132551073 /nfs/dbraw/zinc/55/10/73/1132551073.db2.gz SRISFMQUXGQWFE-NMONBKHDSA-N 1 0 331.416 3.600 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001168976224 1132617281 /nfs/dbraw/zinc/61/72/81/1132617281.db2.gz ZWIDGGLBZCTULX-NOZJJQNGSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC001168966798 1132621735 /nfs/dbraw/zinc/62/17/35/1132621735.db2.gz LFPZFNHTVUYULP-RBUKOAKNSA-N 1 0 340.423 3.801 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168967625 1132622565 /nfs/dbraw/zinc/62/25/65/1132622565.db2.gz RKTAZUJKQVXJMP-BXUZGUMPSA-N 1 0 341.249 3.719 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168975974 1132624724 /nfs/dbraw/zinc/62/47/24/1132624724.db2.gz XVHLSLUBWGREFY-BXUZGUMPSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3ccc(C(F)(F)F)cc32)C1 ZINC001168997596 1132627251 /nfs/dbraw/zinc/62/72/51/1132627251.db2.gz DVMIGJLCBANAIO-RIEGTJTDSA-N 1 0 328.334 3.728 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)c(Br)c1 ZINC001168997440 1132627554 /nfs/dbraw/zinc/62/75/54/1132627554.db2.gz ZKGPBSRLMXIFKW-UMNHJUIQSA-N 1 0 345.212 3.684 20 5 EHBDRO Cc1cnc(C[NH3+])n1-c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC001169029880 1132635924 /nfs/dbraw/zinc/63/59/24/1132635924.db2.gz WXEWDAWOWLPYJP-UHFFFAOYSA-N 1 0 340.408 3.699 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3cccc(F)c32)C1 ZINC001169041127 1132638583 /nfs/dbraw/zinc/63/85/83/1132638583.db2.gz BCCWBDVOTMHAJX-ZFWWWQNUSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(c3nc4ccccc4s3)CC2)C1 ZINC001169025915 1132640875 /nfs/dbraw/zinc/64/08/75/1132640875.db2.gz JWRPEHDFXKETNW-UKRRQHHQSA-N 1 0 345.468 3.921 20 5 EHBDRO CN(C)c1ccc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)c([N+](=O)[O-])c1 ZINC001169153782 1132679965 /nfs/dbraw/zinc/67/99/65/1132679965.db2.gz UDZIWIWSKNTQST-UGSOOPFHSA-N 1 0 334.464 3.616 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@]12CCCO2 ZINC001175688862 1132738383 /nfs/dbraw/zinc/73/83/83/1132738383.db2.gz QHOKSLPJFCKFNY-MSOLQXFVSA-N 1 0 334.416 3.573 20 5 EHBDRO [NH3+]CCc1cn(-c2ccc([N+](=O)[O-])c3ccccc32)c2cccnc12 ZINC001169710005 1132830164 /nfs/dbraw/zinc/83/01/64/1132830164.db2.gz UUGBTNPRTCIVLY-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO O=[N+]([O-])c1cc(NCC23CC[NH+](CC2)CC3)cc(C(F)(F)F)c1 ZINC001169795929 1132861347 /nfs/dbraw/zinc/86/13/47/1132861347.db2.gz HZETYMYHTFDPAV-UHFFFAOYSA-N 1 0 329.322 3.511 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766840 1133049789 /nfs/dbraw/zinc/04/97/89/1133049789.db2.gz XXEMFNDEPUFUHT-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO COc1ccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])cc1F ZINC000768199343 1133106061 /nfs/dbraw/zinc/10/60/61/1133106061.db2.gz HEWGQNBZEWLRCY-ALCCZGGFSA-N 1 0 330.359 3.888 20 5 EHBDRO CCC(CC)(CO)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001178212804 1133143448 /nfs/dbraw/zinc/14/34/48/1133143448.db2.gz MMFJNOHKFOOFCK-UHFFFAOYSA-N 1 0 332.400 3.743 20 5 EHBDRO COc1ccccc1CC[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768541871 1133153923 /nfs/dbraw/zinc/15/39/23/1133153923.db2.gz MDRNVWLBYFHXIU-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001420 1133241267 /nfs/dbraw/zinc/24/12/67/1133241267.db2.gz KODWAIVWIVCRNR-ZWKOTPCHSA-N 1 0 348.443 3.821 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cc3ccc(F)cc3[nH]c2=O)cc1[N+](=O)[O-] ZINC001179385927 1133249290 /nfs/dbraw/zinc/24/92/90/1133249290.db2.gz FGFXEDAAEIQMTE-UHFFFAOYSA-N 1 0 341.342 3.586 20 5 EHBDRO CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)C[C@H](O)c1ccc(C)cc1 ZINC000769483877 1133289316 /nfs/dbraw/zinc/28/93/16/1133289316.db2.gz QQJFNTVGECPOTR-IBGZPJMESA-N 1 0 328.412 3.767 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000769446282 1133292901 /nfs/dbraw/zinc/29/29/01/1133292901.db2.gz LUIADKGRZAHMBF-GFCCVEGCSA-N 1 0 336.775 3.729 20 5 EHBDRO C[C@H](C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC001180497206 1133385373 /nfs/dbraw/zinc/38/53/73/1133385373.db2.gz FAGCTGSRNYWZTB-MRXNPFEDSA-N 1 0 331.460 3.933 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000774407583 1133673636 /nfs/dbraw/zinc/67/36/36/1133673636.db2.gz BCDULDSTTMJCAH-MOPGFXCFSA-N 1 0 344.411 3.624 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H]([NH+]2[C@H](C)CC[C@H]2C)C1 ZINC000774517578 1133702787 /nfs/dbraw/zinc/70/27/87/1133702787.db2.gz HNBGPFDUYJUPOT-RKVPGOIHSA-N 1 0 347.459 3.583 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CC(CC2CCOCC2)C1 ZINC001183560896 1133823788 /nfs/dbraw/zinc/82/37/88/1133823788.db2.gz JJDWPKSTJUUGRR-DHDCSXOGSA-N 1 0 330.428 3.747 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000786810827 1133909756 /nfs/dbraw/zinc/90/97/56/1133909756.db2.gz BFNJSSBJNYOEKH-FHLIRTJZSA-N 1 0 346.814 3.975 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1C[C@H]1C1CCCC1 ZINC001184373624 1133932505 /nfs/dbraw/zinc/93/25/05/1133932505.db2.gz BLDGLYGNMBLKDL-SIIHOXLZSA-N 1 0 345.443 3.728 20 5 EHBDRO Cc1ccccc1C[N@H+](Cn1ncc2cc([N+](=O)[O-])ccc21)C1CC1 ZINC000746710448 1134051392 /nfs/dbraw/zinc/05/13/92/1134051392.db2.gz FBLYENATWFBCPB-UHFFFAOYSA-N 1 0 336.395 3.875 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000788537324 1134139193 /nfs/dbraw/zinc/13/91/93/1134139193.db2.gz JHXSKLJVBLQITR-QZTJIDSGSA-N 1 0 332.375 3.582 20 5 EHBDRO Cc1ccccc1O[C@H](C)C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788611377 1134145392 /nfs/dbraw/zinc/14/53/92/1134145392.db2.gz KEGYVOMTOBUEFP-ZIAGYGMSSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000788581212 1134147165 /nfs/dbraw/zinc/14/71/65/1134147165.db2.gz TWUBPNGSWZNPOG-AZUAARDMSA-N 1 0 340.423 3.815 20 5 EHBDRO Cc1ccccc1C1(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000788586289 1134148263 /nfs/dbraw/zinc/14/82/63/1134148263.db2.gz AIVCMNKWCIAWNP-CQSZACIVSA-N 1 0 325.412 3.868 20 5 EHBDRO CC[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000788629343 1134153660 /nfs/dbraw/zinc/15/36/60/1134153660.db2.gz TULYRBPZKLWEJO-JSGCOSHPSA-N 1 0 347.390 3.824 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694561 1134163923 /nfs/dbraw/zinc/16/39/23/1134163923.db2.gz WATSOADGMNQKOA-KGLIPLIRSA-N 1 0 325.412 3.633 20 5 EHBDRO CC[C@H]1CN(c2sccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC001186070003 1134164752 /nfs/dbraw/zinc/16/47/52/1134164752.db2.gz MEBJYLAZTLMMTA-HNNXBMFYSA-N 1 0 331.441 3.757 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788754586 1134165225 /nfs/dbraw/zinc/16/52/25/1134165225.db2.gz QLSRDTJRWYCVOD-CKFHNAJUSA-N 1 0 342.443 3.519 20 5 EHBDRO CCOc1cc(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001187081318 1134296784 /nfs/dbraw/zinc/29/67/84/1134296784.db2.gz JYHZBSPREAUCQG-OAHLLOKOSA-N 1 0 333.432 3.812 20 5 EHBDRO CCCCC[C@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000775316067 1134628213 /nfs/dbraw/zinc/62/82/13/1134628213.db2.gz MQTNVYGMPHIUMV-SFHVURJKSA-N 1 0 343.427 3.668 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C2CC2)C2CCC(C)CC2)c1 ZINC001190398836 1134690903 /nfs/dbraw/zinc/69/09/03/1134690903.db2.gz DBQAVPIZIITTLB-UHFFFAOYSA-N 1 0 346.427 3.925 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2csc(C)n2)c([N+](=O)[O-])c1 ZINC001170297708 1134736956 /nfs/dbraw/zinc/73/69/56/1134736956.db2.gz QTRVMDWFRWDREV-GHMZBOCLSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C)cc2F)c([N+](=O)[O-])c1 ZINC001170304470 1134738670 /nfs/dbraw/zinc/73/86/70/1134738670.db2.gz CDYFQNKYLLGSIR-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccncc1 ZINC001170304264 1134739062 /nfs/dbraw/zinc/73/90/62/1134739062.db2.gz ARNYZKCLOLQFFE-CXAGYDPISA-N 1 0 329.400 3.670 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccn1 ZINC001170304719 1134740042 /nfs/dbraw/zinc/74/00/42/1134740042.db2.gz GGSBPTCSSSKXPM-CJNGLKHVSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170347090 1134760037 /nfs/dbraw/zinc/76/00/37/1134760037.db2.gz QCDNSUIFYCCBNI-HNNXBMFYSA-N 1 0 340.423 3.983 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCC[N@@H+]2CCCC[C@H]2C)c1 ZINC000747207156 1135162806 /nfs/dbraw/zinc/16/28/06/1135162806.db2.gz HKTIEOOOSIYCRN-CYBMUJFWSA-N 1 0 339.411 3.809 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477553 1135276809 /nfs/dbraw/zinc/27/68/09/1135276809.db2.gz MLIQADZJDBLRQC-ZHALLVOQSA-N 1 0 345.487 3.752 20 5 EHBDRO COCC(C)(C)CCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000806175917 1135399321 /nfs/dbraw/zinc/39/93/21/1135399321.db2.gz ILKNSZIFUKOOPQ-UHFFFAOYSA-N 1 0 349.475 3.606 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCO2 ZINC001196302202 1135544454 /nfs/dbraw/zinc/54/44/54/1135544454.db2.gz IUWUNCKTDXLHNK-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613091 1135589426 /nfs/dbraw/zinc/58/94/26/1135589426.db2.gz HTUWVHRXYYYZRL-NQHOJNORSA-N 1 0 332.400 3.560 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1NC1CC[NH+](CC2CCCCC2)CC1 ZINC000807946922 1135594314 /nfs/dbraw/zinc/59/43/14/1135594314.db2.gz ZGBLNUBQURWXKX-UHFFFAOYSA-N 1 0 349.479 3.576 20 5 EHBDRO Cc1ccc(CNC[C@H](C(C)C)[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC001199161541 1135884221 /nfs/dbraw/zinc/88/42/21/1135884221.db2.gz JWEAKKMCGHMAMY-LJQANCHMSA-N 1 0 333.476 3.893 20 5 EHBDRO CC(C)c1ccc(C(=O)O[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810836981 1136011483 /nfs/dbraw/zinc/01/14/83/1136011483.db2.gz JQJQZJOYOGOLAM-LSDHHAIUSA-N 1 0 332.400 3.502 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@H](OC(C)C)C1(C)C ZINC001201887874 1136070044 /nfs/dbraw/zinc/07/00/44/1136070044.db2.gz DGUPGSHSGKUGAR-IRXDYDNUSA-N 1 0 336.432 3.675 20 5 EHBDRO C[C@H]1CCC[N@H+](CCNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811473922 1136095895 /nfs/dbraw/zinc/09/58/95/1136095895.db2.gz QTAJEAPOBLEXLW-NSHDSACASA-N 1 0 346.258 3.723 20 5 EHBDRO CC[C@H](C)[N@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811477081 1136096161 /nfs/dbraw/zinc/09/61/61/1136096161.db2.gz DKXMSMVWPGSGIR-JTQLQIEISA-N 1 0 334.247 3.722 20 5 EHBDRO Cc1cnn(-c2cc[nH+]cc2NCc2cc([N+](=O)[O-])ccc2Cl)c1 ZINC000776251922 1136101908 /nfs/dbraw/zinc/10/19/08/1136101908.db2.gz CTNBLGYLCUWVFR-UHFFFAOYSA-N 1 0 343.774 3.749 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254067 1136104716 /nfs/dbraw/zinc/10/47/16/1136104716.db2.gz QYEVCQLEMUGIGX-ZWKOTPCHSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H](c1cccc(Cl)c1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274958 1136129237 /nfs/dbraw/zinc/12/92/37/1136129237.db2.gz DYSRNZCYUMMEPZ-SJCJKPOMSA-N 1 0 334.803 3.975 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000776279849 1136133797 /nfs/dbraw/zinc/13/37/97/1136133797.db2.gz ZELIPEADOGLSBY-DNVCBOLYSA-N 1 0 328.412 3.938 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1cc([N+](=O)[O-])cc2cc[nH]c21 ZINC001170681063 1136221724 /nfs/dbraw/zinc/22/17/24/1136221724.db2.gz DTQZLSWBOIZPLN-LBPRGKRZSA-N 1 0 347.378 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3COC4(CCC4)C3)o2)cc1 ZINC000850367544 1136242460 /nfs/dbraw/zinc/24/24/60/1136242460.db2.gz MSKUGQXXJPZVOM-AWEZNQCLSA-N 1 0 328.368 3.656 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411565 1136252695 /nfs/dbraw/zinc/25/26/95/1136252695.db2.gz FPXNOEVYJQMOJB-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc3c(c2)CCCO3)cc1[N+](=O)[O-] ZINC000850429904 1136257583 /nfs/dbraw/zinc/25/75/83/1136257583.db2.gz HAEOUKUBAQRKAP-CYBMUJFWSA-N 1 0 342.395 3.779 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@H](O)c1ccc(F)cc1 ZINC000850437086 1136258688 /nfs/dbraw/zinc/25/86/88/1136258688.db2.gz ZCJWUWGRTRDVRM-PZROIBLQSA-N 1 0 348.374 3.515 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CC[NH+](C(C)(C)C)CC1 ZINC000850444158 1136259886 /nfs/dbraw/zinc/25/98/86/1136259886.db2.gz XAEBBXZUPWPFMR-CYBMUJFWSA-N 1 0 335.448 3.517 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@](C)(O)c1ccccc1 ZINC000850462397 1136264180 /nfs/dbraw/zinc/26/41/80/1136264180.db2.gz NYKQYMIBXZROPK-LIRRHRJNSA-N 1 0 344.411 3.552 20 5 EHBDRO CSCC1(CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000850506351 1136273728 /nfs/dbraw/zinc/27/37/28/1136273728.db2.gz JJRSDVNEXVLCFA-UHFFFAOYSA-N 1 0 349.500 3.687 20 5 EHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](C)[C@@H](O)c1ccccc1 ZINC000852066245 1136430910 /nfs/dbraw/zinc/43/09/10/1136430910.db2.gz MXBDBMKSLIXGSA-SCLBCKFNSA-N 1 0 332.375 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](O)c2ccc(Cl)cc2)c(Cl)c1 ZINC000814299303 1136437692 /nfs/dbraw/zinc/43/76/92/1136437692.db2.gz ABKKXODVLVSOEC-HNNXBMFYSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H](C)[N@@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776585019 1136442294 /nfs/dbraw/zinc/44/22/94/1136442294.db2.gz QXZCMFQLLSPSJU-XAUMDUMWSA-N 1 0 340.423 3.815 20 5 EHBDRO CCC[N@@H+](Cc1ccc(F)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579114 1136444352 /nfs/dbraw/zinc/44/43/52/1136444352.db2.gz JSVSBMABOUKHCD-SFHVURJKSA-N 1 0 332.375 3.680 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](CC)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776586085 1136445521 /nfs/dbraw/zinc/44/55/21/1136445521.db2.gz JLVZGAKNDBVMJS-ICSRJNTNSA-N 1 0 342.439 3.971 20 5 EHBDRO CC[C@H](Cc1ccc(C)cc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588697 1136453098 /nfs/dbraw/zinc/45/30/98/1136453098.db2.gz NXTNMRJAGUIMAG-QUCCMNQESA-N 1 0 342.439 3.890 20 5 EHBDRO CC1(C)C[C@@]1([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000852772706 1136485039 /nfs/dbraw/zinc/48/50/39/1136485039.db2.gz QAHNOMXCYZZGJW-IEBWSBKVSA-N 1 0 326.396 3.543 20 5 EHBDRO CC1(C)C[C@]1([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000852771735 1136485086 /nfs/dbraw/zinc/48/50/86/1136485086.db2.gz CJUMNAUDOWEHOP-HKUYNNGSSA-N 1 0 326.396 3.543 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)c1ccc2c(c1)CCCO2 ZINC000852780171 1136485986 /nfs/dbraw/zinc/48/59/86/1136485986.db2.gz ICEOULYDVATPCQ-CYBMUJFWSA-N 1 0 342.395 3.779 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1SCCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815587117 1136615176 /nfs/dbraw/zinc/61/51/76/1136615176.db2.gz ZYELPBYLRSSUGW-KZULUSFZSA-N 1 0 343.452 3.858 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CSCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571056 1136617483 /nfs/dbraw/zinc/61/74/83/1136617483.db2.gz SQWRCTJLNGTEQO-BZNIZROVSA-N 1 0 329.425 3.816 20 5 EHBDRO C[C@@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815617747 1136619450 /nfs/dbraw/zinc/61/94/50/1136619450.db2.gz UUEOBNMRFGUGSS-NVPAJSRCSA-N 1 0 341.411 3.575 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)c1ccc(CC[NH+](C)C)cc1 ZINC000854509916 1136622122 /nfs/dbraw/zinc/62/21/22/1136622122.db2.gz DFSPSIMKLQINPM-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000776753790 1136643207 /nfs/dbraw/zinc/64/32/07/1136643207.db2.gz GYDDVGSMQSCXRL-ZNMIVQPWSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000114110706 1136774566 /nfs/dbraw/zinc/77/45/66/1136774566.db2.gz MPTLHGGCXVPKGD-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414679 1136806532 /nfs/dbraw/zinc/80/65/32/1136806532.db2.gz ICZMXEJNNGWRTH-NEPJUHHUSA-N 1 0 333.215 3.949 20 5 EHBDRO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC000339000369 1136825198 /nfs/dbraw/zinc/82/51/98/1136825198.db2.gz LRNAODBBBOLARG-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818979450 1136895928 /nfs/dbraw/zinc/89/59/28/1136895928.db2.gz MPHGTZHUYQACBY-BEFAXECRSA-N 1 0 342.439 3.974 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000819143114 1136912773 /nfs/dbraw/zinc/91/27/73/1136912773.db2.gz ZTCYCHIHZNGWGO-UXIGCNINSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@H](C(F)(F)F)C2)c1 ZINC000819141571 1136912823 /nfs/dbraw/zinc/91/28/23/1136912823.db2.gz JDXVOKSQINKCSN-OSAQELSMSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000819279506 1136931140 /nfs/dbraw/zinc/93/11/40/1136931140.db2.gz MPAOCQPPHBPRMH-POZUXBRTSA-N 1 0 344.386 3.693 20 5 EHBDRO Cc1ccc(C2(C[NH2+]C[C@@H](O)c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000819339052 1136932808 /nfs/dbraw/zinc/93/28/08/1136932808.db2.gz KBVLBHIVHPTUCR-LJQANCHMSA-N 1 0 340.423 3.566 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCCC1 ZINC001170929197 1136948734 /nfs/dbraw/zinc/94/87/34/1136948734.db2.gz KKUZGOBNFIHTOT-MRXNPFEDSA-N 1 0 340.851 3.915 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1c(C)ccc([N+](=O)[O-])c1C ZINC000820608500 1136999956 /nfs/dbraw/zinc/99/99/56/1136999956.db2.gz ISBFZICPZSOIQU-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO Cc1cc(OCC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)c(C)c(C)[nH+]1 ZINC000820695816 1137001778 /nfs/dbraw/zinc/00/17/78/1137001778.db2.gz KRZDTBMILYRDGK-UHFFFAOYSA-N 1 0 349.774 3.586 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@@](C)(O)c1ccccc1 ZINC000822516310 1137063883 /nfs/dbraw/zinc/06/38/83/1137063883.db2.gz KGRXZPJUEDXXFO-QGZVFWFLSA-N 1 0 334.803 3.588 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C[NH+](C)C)c(C)c1 ZINC000823546285 1137103827 /nfs/dbraw/zinc/10/38/27/1137103827.db2.gz KQIQZVCUOKPVGE-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CC(F)(F)CCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000824477215 1137139137 /nfs/dbraw/zinc/13/91/37/1137139137.db2.gz LILHNXHNKQSGCF-UHFFFAOYSA-N 1 0 327.375 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@]3(CCSC3)C2)c1 ZINC000825214890 1137169116 /nfs/dbraw/zinc/16/91/16/1137169116.db2.gz ABTKUSHICKWATE-OAHLLOKOSA-N 1 0 326.849 3.967 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000120469696 1137272266 /nfs/dbraw/zinc/27/22/66/1137272266.db2.gz SMWYEFKOTCRDRF-YVEFUNNKSA-N 1 0 334.803 3.941 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@H]1CCC[C@H](C)C1 ZINC001171188382 1137297505 /nfs/dbraw/zinc/29/75/05/1137297505.db2.gz BKHCZRLCYNWANS-QEJZJMRPSA-N 1 0 333.432 3.646 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000865778865 1137310934 /nfs/dbraw/zinc/31/09/34/1137310934.db2.gz ZKIBUCBPHUIEPO-HKBKRHGFSA-N 1 0 330.428 3.795 20 5 EHBDRO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)F ZINC000865799919 1137312654 /nfs/dbraw/zinc/31/26/54/1137312654.db2.gz FNUPUSXLAXRHIO-YPMHNXCESA-N 1 0 325.359 3.595 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](Cc2cccnc2)C2CCCC2)cs1 ZINC000865833118 1137315122 /nfs/dbraw/zinc/31/51/22/1137315122.db2.gz AQQIROAVUJSGNL-INIZCTEOSA-N 1 0 331.441 3.942 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866309509 1137344233 /nfs/dbraw/zinc/34/42/33/1137344233.db2.gz PKRSJWQCDFUTHW-QWRGUYRKSA-N 1 0 335.379 3.663 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000866367120 1137349990 /nfs/dbraw/zinc/34/99/90/1137349990.db2.gz GBSWSXCIAGZMMK-RNCFNFMXSA-N 1 0 335.206 3.838 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCc1noc2ccccc12 ZINC000866384837 1137350942 /nfs/dbraw/zinc/35/09/42/1137350942.db2.gz DOHXCQGNPUHOKT-LBPRGKRZSA-N 1 0 343.358 3.638 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccnn1C ZINC000866613972 1137369554 /nfs/dbraw/zinc/36/95/54/1137369554.db2.gz KJRLFWKDYQKCSW-QWHCGFSZSA-N 1 0 334.445 3.550 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000773133446 1137467453 /nfs/dbraw/zinc/46/74/53/1137467453.db2.gz FYEGVYSDFQPWHP-BJKJVOPESA-N 1 0 338.498 3.933 20 5 EHBDRO C[C@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001171741353 1137511182 /nfs/dbraw/zinc/51/11/82/1137511182.db2.gz NMLIPYJQUVXDPC-HNNXBMFYSA-N 1 0 326.396 3.635 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCc1c[nH]nc1C ZINC000872019865 1137565124 /nfs/dbraw/zinc/56/51/24/1137565124.db2.gz ATEUMQFJFRCJSD-LBPRGKRZSA-N 1 0 334.445 3.632 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOCC(F)(F)F ZINC000872027118 1137565960 /nfs/dbraw/zinc/56/59/60/1137565960.db2.gz HNWCIETYYLIERA-SECBINFHSA-N 1 0 338.351 3.546 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038694 1137566882 /nfs/dbraw/zinc/56/68/82/1137566882.db2.gz OZMBRPKQGUDYRT-HIFRSBDPSA-N 1 0 332.375 3.551 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](CO)c1ccccc1 ZINC000872038943 1137566904 /nfs/dbraw/zinc/56/69/04/1137566904.db2.gz BTZXDCLDAVEOMN-HIFRSBDPSA-N 1 0 346.452 3.743 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1ccsc1 ZINC000872037787 1137566995 /nfs/dbraw/zinc/56/69/95/1137566995.db2.gz IEJCXHAIDRVGMU-IINYFYTJSA-N 1 0 338.454 3.762 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1c2ccccc2C[C@H]1O ZINC000872043012 1137567164 /nfs/dbraw/zinc/56/71/64/1137567164.db2.gz VBRLAHITHNETHM-LSKLOWJMSA-N 1 0 344.436 3.626 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1cccc(F)c1 ZINC000872048737 1137567771 /nfs/dbraw/zinc/56/77/71/1137567771.db2.gz LAWKYIBGSUKNQU-WVQJBOLRSA-N 1 0 336.338 3.646 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC)C(F)(F)F ZINC000872056868 1137568460 /nfs/dbraw/zinc/56/84/60/1137568460.db2.gz UXNOOXFUNQRORQ-PELKAZGASA-N 1 0 338.351 3.545 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000872059970 1137568777 /nfs/dbraw/zinc/56/87/77/1137568777.db2.gz KZQVHAHEQFWOLI-HOCLYGCPSA-N 1 0 340.851 3.974 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872074744 1137569922 /nfs/dbraw/zinc/56/99/22/1137569922.db2.gz HAVVDNAFEARCRB-VHSXEESVSA-N 1 0 338.301 3.742 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)[C@@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088460 1137570572 /nfs/dbraw/zinc/57/05/72/1137570572.db2.gz OWXBWGBOBUASNS-DCGLDWPTSA-N 1 0 332.375 3.549 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](CCCO)c1ccccc1 ZINC000873059118 1137589049 /nfs/dbraw/zinc/58/90/49/1137589049.db2.gz NORCEBLIXYUQJH-GOSISDBHSA-N 1 0 328.412 3.815 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000873060599 1137589275 /nfs/dbraw/zinc/58/92/75/1137589275.db2.gz JVYSJSABODVPNM-HNNXBMFYSA-N 1 0 338.766 3.519 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)C[C@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000873096947 1137590015 /nfs/dbraw/zinc/59/00/15/1137590015.db2.gz BLURANRJZWIGRV-XIKOKIGWSA-N 1 0 332.375 3.644 20 5 EHBDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876937222 1137665770 /nfs/dbraw/zinc/66/57/70/1137665770.db2.gz SNTVBJSSTCJBER-WLYUNCDWSA-N 1 0 344.415 3.633 20 5 EHBDRO CCC[C@@H](CCc1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877054201 1137668896 /nfs/dbraw/zinc/66/88/96/1137668896.db2.gz DLMYAJJJJJEQNU-AOCRQIFASA-N 1 0 342.443 3.886 20 5 EHBDRO C[C@H]1CCCc2ccccc2[C@@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877373593 1137674797 /nfs/dbraw/zinc/67/47/97/1137674797.db2.gz FCECDFSYWRBJQK-AOEDZNLZSA-N 1 0 340.427 3.798 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3c(Cl)oc4ccccc43)C2)c1 ZINC000877652167 1137684444 /nfs/dbraw/zinc/68/44/44/1137684444.db2.gz DDQWVACSCKOFMW-UHFFFAOYSA-N 1 0 346.774 3.684 20 5 EHBDRO CC[C@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878183166 1137706167 /nfs/dbraw/zinc/70/61/67/1137706167.db2.gz CSHMOSWWOUFWTQ-JTQLQIEISA-N 1 0 336.779 3.530 20 5 EHBDRO CCC[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878187146 1137706227 /nfs/dbraw/zinc/70/62/27/1137706227.db2.gz QVBSNZFPSUBVIU-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC1CCC(C)([NH+](C)C)CC1 ZINC000879609005 1137752312 /nfs/dbraw/zinc/75/23/12/1137752312.db2.gz JFVQWXUHINIBCL-UHFFFAOYSA-N 1 0 348.447 3.542 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC[C@H]2CCCC2(F)F)n1 ZINC000883274642 1137851942 /nfs/dbraw/zinc/85/19/42/1137851942.db2.gz QSDUOKXPCBCYLR-MGPQQGTHSA-N 1 0 342.390 3.690 20 5 EHBDRO CCOc1cc(N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)ccc1[N+](=O)[O-] ZINC000884707638 1137969749 /nfs/dbraw/zinc/96/97/49/1137969749.db2.gz TUWKGHLIXMQNSW-UHFFFAOYSA-N 1 0 344.415 3.717 20 5 EHBDRO Cc1nc(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)[nH]c1C ZINC000886668146 1138111660 /nfs/dbraw/zinc/11/16/60/1138111660.db2.gz OAALUVTWQLCTHL-UHFFFAOYSA-N 1 0 328.416 3.623 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000075866244 1138128922 /nfs/dbraw/zinc/12/89/22/1138128922.db2.gz QUJKZRWZOPFAAZ-KRWDZBQOSA-N 1 0 326.396 3.634 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@]1(C)CCOC2(CCC2)C1 ZINC000886776448 1138138696 /nfs/dbraw/zinc/13/86/96/1138138696.db2.gz GOTQTPHKZQGABP-KBXCAEBGSA-N 1 0 348.443 3.993 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2(CCC2)C1 ZINC000123520498 1138271069 /nfs/dbraw/zinc/27/10/69/1138271069.db2.gz GLQGHIJUJPCACI-GFCCVEGCSA-N 1 0 328.372 3.582 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000124728969 1138293576 /nfs/dbraw/zinc/29/35/76/1138293576.db2.gz RGDXIMALXZBQFY-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO CCC[C@H]([NH2+]CC[S@@](=O)C(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000127423910 1138357107 /nfs/dbraw/zinc/35/71/07/1138357107.db2.gz TZWCMGNELWAFEP-NYHFZMIOSA-N 1 0 326.462 3.573 20 5 EHBDRO Cc1nc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)sc1C ZINC000127683203 1138367020 /nfs/dbraw/zinc/36/70/20/1138367020.db2.gz ZTXQMEAIRAVJIC-MRXNPFEDSA-N 1 0 345.468 3.822 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000136673655 1138808510 /nfs/dbraw/zinc/80/85/10/1138808510.db2.gz PWSDMLBGYYSJAB-OAHLLOKOSA-N 1 0 334.416 3.575 20 5 EHBDRO Cc1ccccc1NC(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181812851 1139933205 /nfs/dbraw/zinc/93/32/05/1139933205.db2.gz NYMYRYHMRAQXAE-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO CC(C)OC(=O)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000181830005 1139934929 /nfs/dbraw/zinc/93/49/29/1139934929.db2.gz ABIDEVPFCSYUBV-SFHVURJKSA-N 1 0 342.395 3.767 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865690 1140174605 /nfs/dbraw/zinc/17/46/05/1140174605.db2.gz GIMJCOKFJFJNJP-CQSZACIVSA-N 1 0 330.388 3.799 20 5 EHBDRO CCOC(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000186532528 1140208779 /nfs/dbraw/zinc/20/87/79/1140208779.db2.gz OKXQMWBTSCBDLP-UHFFFAOYSA-N 1 0 335.429 3.623 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000191491736 1140466917 /nfs/dbraw/zinc/46/69/17/1140466917.db2.gz KAWVFQXLVKNGHY-UHFFFAOYSA-N 1 0 330.432 3.574 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCO[C@@H]1c1ccc(Cl)cc1 ZINC000192024837 1140497868 /nfs/dbraw/zinc/49/78/68/1140497868.db2.gz JPDQFSMCKZKDQM-DOTOQJQBSA-N 1 0 332.787 3.868 20 5 EHBDRO C[C@H](O)c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192723982 1140547091 /nfs/dbraw/zinc/54/70/91/1140547091.db2.gz HMAYABNBDWIFCQ-ORAYPTAESA-N 1 0 326.396 3.815 20 5 EHBDRO CC(C)[N@H+](C)Cc1ccccc1CNc1cc(N)ccc1[N+](=O)[O-] ZINC000192779334 1140550190 /nfs/dbraw/zinc/55/01/90/1140550190.db2.gz APAXZDFMFUUBRW-UHFFFAOYSA-N 1 0 328.416 3.629 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000268872553 1141015583 /nfs/dbraw/zinc/01/55/83/1141015583.db2.gz GMEOEYBRQKQORE-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000269198030 1141077099 /nfs/dbraw/zinc/07/70/99/1141077099.db2.gz XBJPIZWTSMEZGI-UHFFFAOYSA-N 1 0 341.411 3.621 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667643 1141253351 /nfs/dbraw/zinc/25/33/51/1141253351.db2.gz PUWIRWCJPKVYCF-DOMZBBRYSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000270891851 1141280559 /nfs/dbraw/zinc/28/05/59/1141280559.db2.gz PGJQAJVQSXMVLO-GXTWGEPZSA-N 1 0 341.415 3.531 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCn1ccnc1C ZINC000271123911 1141310187 /nfs/dbraw/zinc/31/01/87/1141310187.db2.gz KBOULLAXMXXTKZ-HNNXBMFYSA-N 1 0 348.472 3.650 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(c3noc(C(C)C)n3)CC2)cc1[N+](=O)[O-] ZINC000271169551 1141317146 /nfs/dbraw/zinc/31/71/46/1141317146.db2.gz LKUDSPDDEPLPNU-UHFFFAOYSA-N 1 0 344.415 3.789 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000271445037 1141368969 /nfs/dbraw/zinc/36/89/69/1141368969.db2.gz FLWYICUGCOJWNH-XCMOZONUSA-N 1 0 332.425 3.744 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc([S@](C)=O)cc1 ZINC000271454715 1141371142 /nfs/dbraw/zinc/37/11/42/1141371142.db2.gz GPHBILIPEDXGEK-BTELXILVSA-N 1 0 332.425 3.744 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])ccc1OC ZINC000348631336 1141557525 /nfs/dbraw/zinc/55/75/25/1141557525.db2.gz CNMZIVJLNKXOFQ-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc3ccc4ccc(Cl)nc4c3n2)C1 ZINC001165039508 721891825 /nfs/dbraw/zinc/89/18/25/721891825.db2.gz MTJZVCOXCGAWHS-OAHLLOKOSA-N 1 0 340.858 3.967 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)c1nc2ccccc2c(Cl)c1[N+](=O)[O-] ZINC001165041466 721933416 /nfs/dbraw/zinc/93/34/16/721933416.db2.gz YIOYNARIFADOBO-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H]([NH+]3CCCC3)CC2)ccc1Cl ZINC000153995649 1014765422 /nfs/dbraw/zinc/76/54/22/1014765422.db2.gz OXECSCTYHBGQMS-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000510088135 1014939983 /nfs/dbraw/zinc/93/99/83/1014939983.db2.gz SLQXXSDYVWDQHR-UHFFFAOYSA-N 1 0 348.443 3.705 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000430216301 1015042141 /nfs/dbraw/zinc/04/21/41/1015042141.db2.gz FCZXOWMJYURMRP-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000183272010 1125498211 /nfs/dbraw/zinc/49/82/11/1125498211.db2.gz MREADICLPWUUHN-FJIDUMEYSA-N 1 0 330.428 3.983 20 5 EHBDRO COc1ccc(-c2ccc(C[N@@H+]3CCC34CCC4)o2)c([N+](=O)[O-])c1 ZINC000536677802 1032120323 /nfs/dbraw/zinc/12/03/23/1032120323.db2.gz KNHPXYQMUJJOMN-UHFFFAOYSA-N 1 0 328.368 3.992 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCC[C@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000533511377 1015850404 /nfs/dbraw/zinc/85/04/04/1015850404.db2.gz FADKVYRIQZXYOJ-OLMMMNRUSA-N 1 0 331.460 3.993 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941315 1016159952 /nfs/dbraw/zinc/15/99/52/1016159952.db2.gz ZFYSHGAABDHQLO-OLZOCXBDSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944284 1016193471 /nfs/dbraw/zinc/19/34/71/1016193471.db2.gz UGWKHLIUPLNLSS-ALKREAHSSA-N 1 0 329.444 3.605 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152025 1016491419 /nfs/dbraw/zinc/49/14/19/1016491419.db2.gz IXEATXZKRJCMPF-RDTXWAMCSA-N 1 0 341.411 3.971 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCOC1 ZINC000120181212 1016746007 /nfs/dbraw/zinc/74/60/07/1016746007.db2.gz NHMDCPGZCXHYKK-INIZCTEOSA-N 1 0 336.775 3.777 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1cc(Cl)ccc1[N+](=O)[O-] ZINC000782939485 1016785187 /nfs/dbraw/zinc/78/51/87/1016785187.db2.gz QKAXKYXJCMZDEM-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(C[NH+](C)C)cc1F ZINC000414482107 1016862757 /nfs/dbraw/zinc/86/27/57/1016862757.db2.gz DAGYWRUFESRBDL-UHFFFAOYSA-N 1 0 347.390 3.806 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000449076957 1032167769 /nfs/dbraw/zinc/16/77/69/1032167769.db2.gz VGGXZZYRFXFRQO-CHWSQXEVSA-N 1 0 328.368 3.605 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000449107391 1032186568 /nfs/dbraw/zinc/18/65/68/1032186568.db2.gz MFWTZCUIKWYVSV-HNNXBMFYSA-N 1 0 340.423 3.856 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000538198638 1032214463 /nfs/dbraw/zinc/21/44/63/1032214463.db2.gz RNHZBLYSZYJBIB-OLZOCXBDSA-N 1 0 339.395 3.891 20 5 EHBDRO Cc1cc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)ncc1[N+](=O)[O-] ZINC000074744955 1032217257 /nfs/dbraw/zinc/21/72/57/1032217257.db2.gz FFQMNQASMHBQOT-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO COc1cccc(C[C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449145403 1032247847 /nfs/dbraw/zinc/24/78/47/1032247847.db2.gz XTEMKDGDWVHPNY-HUUCEWRRSA-N 1 0 328.412 3.755 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCc2cc(F)c(F)c(F)c21 ZINC000449167724 1032260548 /nfs/dbraw/zinc/26/05/48/1032260548.db2.gz KRMHVVMNSBNSJY-CYBMUJFWSA-N 1 0 336.313 3.832 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N(C)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000538276622 1032265813 /nfs/dbraw/zinc/26/58/13/1032265813.db2.gz KZFJUFYQQWDBAX-OAHLLOKOSA-N 1 0 347.459 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC[NH+](C3CCC3)CC1)CCC2 ZINC000278745108 1032279470 /nfs/dbraw/zinc/27/94/70/1032279470.db2.gz NOEGGZYHTVRXHR-IBGZPJMESA-N 1 0 329.444 3.579 20 5 EHBDRO CCOc1cccc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449203949 1032307499 /nfs/dbraw/zinc/30/74/99/1032307499.db2.gz HUNJZLMNGAHONL-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1ccccc1[N+](=O)[O-] ZINC000449201934 1032327244 /nfs/dbraw/zinc/32/72/44/1032327244.db2.gz HVBBDSPDIGMNRY-AWEZNQCLSA-N 1 0 342.395 3.997 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459645383 1032367678 /nfs/dbraw/zinc/36/76/78/1032367678.db2.gz GKDWITWLUBHBKE-NWDGAFQWSA-N 1 0 331.441 3.822 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC2([C@H](C)CCO)CCC2)cc1[N+](=O)[O-] ZINC000538446798 1032375105 /nfs/dbraw/zinc/37/51/05/1032375105.db2.gz YMRSVGKWAZSXEU-OAHLLOKOSA-N 1 0 334.460 3.997 20 5 EHBDRO CCO[C@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449287710 1032404377 /nfs/dbraw/zinc/40/43/77/1032404377.db2.gz LCOHCPGAIHTMTO-DNVCBOLYSA-N 1 0 328.412 3.893 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000449333725 1032444792 /nfs/dbraw/zinc/44/47/92/1032444792.db2.gz VQPWHYFTEWTGGC-UKRRQHHQSA-N 1 0 348.830 3.545 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccnn1C1CCCC1 ZINC000449313903 1032448198 /nfs/dbraw/zinc/44/81/98/1032448198.db2.gz PZYJGJPLGRLGKC-UHFFFAOYSA-N 1 0 328.416 3.581 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459809547 1032472795 /nfs/dbraw/zinc/47/27/95/1032472795.db2.gz STBLSYGCUSGJAU-XJKSGUPXSA-N 1 0 333.432 3.789 20 5 EHBDRO C[C@@H](CCCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449410329 1032532980 /nfs/dbraw/zinc/53/29/80/1032532980.db2.gz YRXSYNFBWXDDBL-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)NCCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537176988 1032548657 /nfs/dbraw/zinc/54/86/57/1032548657.db2.gz INDSVDABLPQOJA-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO CC/C=C/C[NH2+]Cc1cc(OC)c(OCC(F)(F)F)cc1[N+](=O)[O-] ZINC000449453263 1032569567 /nfs/dbraw/zinc/56/95/67/1032569567.db2.gz HSCCJNROLSSWCZ-SNAWJCMRSA-N 1 0 348.321 3.600 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000449478756 1032601540 /nfs/dbraw/zinc/60/15/40/1032601540.db2.gz KYZUVZMXIAMZGX-MJSCBBHESA-N 1 0 330.428 3.937 20 5 EHBDRO COC[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449482435 1032630302 /nfs/dbraw/zinc/63/03/02/1032630302.db2.gz YMOALJRKUUUIJV-ZDUSSCGKSA-N 1 0 340.832 3.830 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892729822 1017241544 /nfs/dbraw/zinc/24/15/44/1017241544.db2.gz CBQVLHWCORKEHC-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H](O)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000136138210 1017264599 /nfs/dbraw/zinc/26/45/99/1017264599.db2.gz QIXMDUJCPJFPTE-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181552654 1017712728 /nfs/dbraw/zinc/71/27/28/1017712728.db2.gz PZJBGRIUOIVRTN-GDIGMMSISA-N 1 0 328.412 3.628 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[NH2+]C1CCCCCC1 ZINC000415308520 1017864262 /nfs/dbraw/zinc/86/42/62/1017864262.db2.gz ZYIJKJUXGZMHSW-UHFFFAOYSA-N 1 0 348.447 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544022 1032736778 /nfs/dbraw/zinc/73/67/78/1032736778.db2.gz VAWJUWVJTBOIIH-YOEHRIQHSA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000449530311 1032740790 /nfs/dbraw/zinc/74/07/90/1032740790.db2.gz ALXDBTCHUOVEGA-DTAYJBSDSA-N 1 0 339.395 3.513 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000415509741 1018117492 /nfs/dbraw/zinc/11/74/92/1018117492.db2.gz XDLBEIKJHQHENX-KRWDZBQOSA-N 1 0 342.399 3.505 20 5 EHBDRO COc1cc(F)cc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000468615716 1018221121 /nfs/dbraw/zinc/22/11/21/1018221121.db2.gz QWURKSHBXWYRHV-AWNIVKPZSA-N 1 0 330.359 3.936 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCCCN1C(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701341 1018411448 /nfs/dbraw/zinc/41/14/48/1018411448.db2.gz NYZJDRWXYNBZSV-DOMZBBRYSA-N 1 0 348.447 3.626 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072748 1032764009 /nfs/dbraw/zinc/76/40/09/1032764009.db2.gz KEAMYLBHTGPGTP-OAHLLOKOSA-N 1 0 328.416 3.821 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CC(C)(C)c3ccccc32)c1[N+](=O)[O-] ZINC000893143592 1018623507 /nfs/dbraw/zinc/62/35/07/1018623507.db2.gz LOLRMYZCYBWSQL-OAHLLOKOSA-N 1 0 342.395 3.821 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC000579495027 1018841413 /nfs/dbraw/zinc/84/14/13/1018841413.db2.gz KKWHGSPJLZSUFI-ZDUSSCGKSA-N 1 0 337.301 3.786 20 5 EHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410599 1018934000 /nfs/dbraw/zinc/93/40/00/1018934000.db2.gz VJCAACNBIZWXAK-ZYHUDNBSSA-N 1 0 344.358 3.825 20 5 EHBDRO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])nc1 ZINC000398038051 1018957781 /nfs/dbraw/zinc/95/77/81/1018957781.db2.gz QQMKBLFHUZSJRT-QGZVFWFLSA-N 1 0 328.416 3.558 20 5 EHBDRO C[C@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637259 1019010511 /nfs/dbraw/zinc/01/05/11/1019010511.db2.gz SHBRLPZFBRZXLD-LPHOPBHVSA-N 1 0 339.439 3.738 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000610420562 1019023972 /nfs/dbraw/zinc/02/39/72/1019023972.db2.gz RZCJLPGKCDXRCC-SWLSCSKDSA-N 1 0 347.365 3.803 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120590271 1019074353 /nfs/dbraw/zinc/07/43/53/1019074353.db2.gz LJOUMRRAWKOZFI-CHWSQXEVSA-N 1 0 330.432 3.535 20 5 EHBDRO CC[C@@H](CSC)[N@H+](C)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000576571700 1019274384 /nfs/dbraw/zinc/27/43/84/1019274384.db2.gz XBHOVMKLOAHZEK-AWEZNQCLSA-N 1 0 326.462 3.955 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CCC[C@@H](CO)C1 ZINC000579628287 1019329702 /nfs/dbraw/zinc/32/97/02/1019329702.db2.gz MLLFPJVMIRFMDO-ZMMAXQRCSA-N 1 0 346.471 3.694 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CCCC[N@@H+]2C2CC2)ccc2ncccc21 ZINC000433803703 1019647371 /nfs/dbraw/zinc/64/73/71/1019647371.db2.gz NGLOZNNAGBBSQN-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H](C)C1 ZINC000119225856 1019719598 /nfs/dbraw/zinc/71/95/98/1019719598.db2.gz UHBSGQKSPGHLDT-JTNHKYCSSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000182803361 1019747729 /nfs/dbraw/zinc/74/77/29/1019747729.db2.gz DFVPQKYQLNKJSS-IRXDYDNUSA-N 1 0 331.460 3.915 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000594045439 1032874914 /nfs/dbraw/zinc/87/49/14/1032874914.db2.gz YASGYVMLXKQYSQ-LLVKDONJSA-N 1 0 328.359 3.907 20 5 EHBDRO C[N@H+](CCC1CCOCC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602470391 1032906280 /nfs/dbraw/zinc/90/62/80/1032906280.db2.gz DSXHIZLNAZQQIA-UHFFFAOYSA-N 1 0 346.349 3.862 20 5 EHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C1Cc2ccccc2C1 ZINC000511670556 1020757966 /nfs/dbraw/zinc/75/79/66/1020757966.db2.gz JDOCQZPQIVVATB-UHFFFAOYSA-N 1 0 348.349 3.795 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CC[C@@H]4CCC[C@H]4C3)CC2)cn1 ZINC000602555416 1032969970 /nfs/dbraw/zinc/96/99/70/1032969970.db2.gz HMKWHFGXXWDWTI-YQQAZPJKSA-N 1 0 344.459 3.517 20 5 EHBDRO CCOc1cc(C[NH+]2CCc3ccccc3CC2)ccc1[N+](=O)[O-] ZINC000519679655 1021604288 /nfs/dbraw/zinc/60/42/88/1021604288.db2.gz GRGYOCIZWMPZJQ-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO COc1cc(C[NH2+]C2CC(c3ccccc3C)C2)c([N+](=O)[O-])cc1O ZINC000341433488 1021879714 /nfs/dbraw/zinc/87/97/14/1021879714.db2.gz JAABATAVAHXACG-UHFFFAOYSA-N 1 0 342.395 3.653 20 5 EHBDRO COc1ccc(OC)c([C@H]2CCCN2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000015312402 1021881222 /nfs/dbraw/zinc/88/12/22/1021881222.db2.gz SYZRITZPRADBMK-GOSISDBHSA-N 1 0 342.395 3.949 20 5 EHBDRO C[C@@H]1CC[NH2+]C[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414910389 1022021589 /nfs/dbraw/zinc/02/15/89/1022021589.db2.gz COSOXRMXUBGYDE-BZNIZROVSA-N 1 0 349.818 3.596 20 5 EHBDRO CCC(O)(CC)CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000471787803 1022205467 /nfs/dbraw/zinc/20/54/67/1022205467.db2.gz NPSKPUHRTPJYGS-NVXWUHKLSA-N 1 0 334.460 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@@H]3CCCC(F)(F)C3)nc2c1 ZINC000602652521 1033040796 /nfs/dbraw/zinc/04/07/96/1033040796.db2.gz MDGJPWWIVTXTDQ-SNVBAGLBSA-N 1 0 325.315 3.651 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000178238735 1022251692 /nfs/dbraw/zinc/25/16/92/1022251692.db2.gz USLVLCDGRSJRDU-MRXNPFEDSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccc(Cl)nc1)C1CC1 ZINC000178247123 1022279973 /nfs/dbraw/zinc/27/99/73/1022279973.db2.gz YTTHLUXSYVWVTA-HNNXBMFYSA-N 1 0 331.803 3.754 20 5 EHBDRO CCOC1CC(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000602638128 1033049194 /nfs/dbraw/zinc/04/91/94/1033049194.db2.gz CTFDYZJIHQJTCC-UHFFFAOYSA-N 1 0 332.322 3.518 20 5 EHBDRO CCC(O)(CC)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000471821289 1022419704 /nfs/dbraw/zinc/41/97/04/1022419704.db2.gz KICPOCMNZXFJDR-UHFFFAOYSA-N 1 0 332.400 3.886 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@@H](CCO)CC1 ZINC000602693291 1033074008 /nfs/dbraw/zinc/07/40/08/1033074008.db2.gz FJXRZFUUQHYYNG-GFCCVEGCSA-N 1 0 346.349 3.598 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000430828656 1022747186 /nfs/dbraw/zinc/74/71/86/1022747186.db2.gz CABBDKZTFJCNOH-DOTOQJQBSA-N 1 0 347.459 3.534 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Oc2ccc(F)nc2)CC1 ZINC000276771436 1022763583 /nfs/dbraw/zinc/76/35/83/1022763583.db2.gz HYLLVLGSHVHVHD-ZDUSSCGKSA-N 1 0 345.374 3.733 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)c1 ZINC000438563097 1022793127 /nfs/dbraw/zinc/79/31/27/1022793127.db2.gz SAFXHYSZZXACHI-LENZSSGSSA-N 1 0 340.427 3.749 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000518065274 1022968030 /nfs/dbraw/zinc/96/80/30/1022968030.db2.gz AWPZETYCBSEWTL-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000509573910 1023071330 /nfs/dbraw/zinc/07/13/30/1023071330.db2.gz WBFUMSOYDPMNPZ-OAHLLOKOSA-N 1 0 349.475 3.594 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CC[C@@H](CO)CC2)s1 ZINC000151415997 1023125403 /nfs/dbraw/zinc/12/54/03/1023125403.db2.gz PZDHYGBWAJGKDC-HDJSIYSDSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1c(C[N@H+](C)C[C@@H]2OCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000507256800 1023213848 /nfs/dbraw/zinc/21/38/48/1023213848.db2.gz LSXQUUSYZKGNSZ-IBGZPJMESA-N 1 0 326.396 3.649 20 5 EHBDRO CCOC(=O)C1CCC([NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000602752954 1033145717 /nfs/dbraw/zinc/14/57/17/1033145717.db2.gz ZJJAHFGZRUUBEL-OOHWJJMZSA-N 1 0 348.443 3.627 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC000610805602 1023702003 /nfs/dbraw/zinc/70/20/03/1023702003.db2.gz WDUQEIZOMMOCIB-HNNXBMFYSA-N 1 0 325.412 3.570 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+][C@H]1CCCC2(CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000897773691 1033160170 /nfs/dbraw/zinc/16/01/70/1033160170.db2.gz LKMJKFXDHKUQCB-DOTOQJQBSA-N 1 0 340.427 3.730 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818799 1023782342 /nfs/dbraw/zinc/78/23/42/1023782342.db2.gz SJTBIYJDLPQPAP-RYUDHWBXSA-N 1 0 340.383 3.897 20 5 EHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500303 1024242808 /nfs/dbraw/zinc/24/28/08/1024242808.db2.gz SMICETROQZKRJV-GWCFXTLKSA-N 1 0 327.222 3.978 20 5 EHBDRO C[NH+](C)CC[C@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000895319335 1024282193 /nfs/dbraw/zinc/28/21/93/1024282193.db2.gz HSMJYMOIGBGOIU-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000248548762 1024299083 /nfs/dbraw/zinc/29/90/83/1024299083.db2.gz GXQJTLBXQIGZSW-XUJVJEKNSA-N 1 0 330.388 3.559 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCCN1C1CC1 ZINC000434789206 1024427866 /nfs/dbraw/zinc/42/78/66/1024427866.db2.gz MKTLNDCRAKGUNQ-FERCGXDMSA-N 1 0 329.444 3.605 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)C(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000342216860 1024436663 /nfs/dbraw/zinc/43/66/63/1024436663.db2.gz VRLIRMLLRZPZIV-UHFFFAOYSA-N 1 0 347.459 3.666 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOC[C@H]2C2CC2)s1 ZINC000538735735 1024497292 /nfs/dbraw/zinc/49/72/92/1024497292.db2.gz YDZFCNFNFZISFA-KRWDZBQOSA-N 1 0 344.436 3.934 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NCCCCC[NH+]1CCCCC1 ZINC000434960515 1024527903 /nfs/dbraw/zinc/52/79/03/1024527903.db2.gz UKITVIZLYNYUQM-UHFFFAOYSA-N 1 0 326.828 3.711 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C1(CCO)CCCCC1 ZINC000474290629 1024699420 /nfs/dbraw/zinc/69/94/20/1024699420.db2.gz IYINCPYALLGULG-UHFFFAOYSA-N 1 0 336.432 3.557 20 5 EHBDRO CCCCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])Cc1ccc(F)cc1 ZINC000611568323 1024750715 /nfs/dbraw/zinc/75/07/15/1024750715.db2.gz WKNYTIXVOIEURR-UHFFFAOYSA-N 1 0 348.422 3.931 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]([C@@H]4CCCO4)C3)o2)c1 ZINC000895842269 1024888547 /nfs/dbraw/zinc/88/85/47/1024888547.db2.gz CXSNEHVLSPXVNY-YJBOKZPZSA-N 1 0 342.395 3.856 20 5 EHBDRO COC1([C@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCCC1 ZINC000514930342 1024908592 /nfs/dbraw/zinc/90/85/92/1024908592.db2.gz BWGSJUCFJYRYQH-ZDUSSCGKSA-N 1 0 331.416 3.556 20 5 EHBDRO COc1cc(NCCCC[N@@H+]2CCCC[C@@H]2C)c(F)cc1[N+](=O)[O-] ZINC000508264021 1024993909 /nfs/dbraw/zinc/99/39/09/1024993909.db2.gz JVWPBTYMNAZZNO-ZDUSSCGKSA-N 1 0 339.411 3.809 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1C[C@H](C)O[C@@H](c2ccsc2)C1 ZINC000248616797 1025043692 /nfs/dbraw/zinc/04/36/92/1025043692.db2.gz MBTWCLVYGLKWIZ-SUMWQHHRSA-N 1 0 332.425 3.927 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC2(CO)CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346882444 1025254437 /nfs/dbraw/zinc/25/44/37/1025254437.db2.gz XXPOQIDYRWACFT-SFHVURJKSA-N 1 0 344.411 3.592 20 5 EHBDRO CC1(C)C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccco1 ZINC000602924159 1033270909 /nfs/dbraw/zinc/27/09/09/1033270909.db2.gz BGZYHAAZRWLHFN-KRWDZBQOSA-N 1 0 343.383 3.600 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@@H]2OCCC[C@H]12 ZINC000439060398 1025517783 /nfs/dbraw/zinc/51/77/83/1025517783.db2.gz VAIPYOKVHSEROB-KQTLUZQSSA-N 1 0 336.457 3.623 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436387725 1025653195 /nfs/dbraw/zinc/65/31/95/1025653195.db2.gz KUFNTGBNNWZQJM-UHFFFAOYSA-N 1 0 346.353 3.541 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000521819156 1025707245 /nfs/dbraw/zinc/70/72/45/1025707245.db2.gz UHKHHWMBKMTBLC-HXUWFJFHSA-N 1 0 341.455 3.638 20 5 EHBDRO Cc1ccc2nc(C[NH2+]CCCCc3ccc([N+](=O)[O-])cc3)cn2c1 ZINC000516074603 1025953163 /nfs/dbraw/zinc/95/31/63/1025953163.db2.gz UFWDTPJOKPAKDD-UHFFFAOYSA-N 1 0 338.411 3.663 20 5 EHBDRO CC(C)[N@H+](CCCO[C@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000338234136 1025982771 /nfs/dbraw/zinc/98/27/71/1025982771.db2.gz WECKRRXDQZXXCZ-SFHVURJKSA-N 1 0 336.432 3.739 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@H]2CCCO[C@@H]2C1(C)C ZINC000451480217 1025996800 /nfs/dbraw/zinc/99/68/00/1025996800.db2.gz PQUIVNNTUQBODP-NXHRZFHOSA-N 1 0 348.443 3.675 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nc2ccc(F)cc2o1 ZINC000511110409 1026077218 /nfs/dbraw/zinc/07/72/18/1026077218.db2.gz YJPMUDKGLBYWTJ-UHFFFAOYSA-N 1 0 329.331 3.550 20 5 EHBDRO CCOC(=O)CCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544905 1026091393 /nfs/dbraw/zinc/09/13/93/1026091393.db2.gz GEDVJZGBYYYQFD-MRXNPFEDSA-N 1 0 334.416 3.508 20 5 EHBDRO C[C@@H]1CC[C@@](CO)([N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100777 1026374833 /nfs/dbraw/zinc/37/48/33/1026374833.db2.gz VCGUXVDPVGHTRM-IAQYHMDHSA-N 1 0 346.349 3.597 20 5 EHBDRO CC(C)(C)C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067682 1026461485 /nfs/dbraw/zinc/46/14/85/1026461485.db2.gz ANXGCSRRGIAFLO-ZDUSSCGKSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000452095893 1026473271 /nfs/dbraw/zinc/47/32/71/1026473271.db2.gz WOZVXVOXVWVQFL-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO COCCC[C@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000475346511 1026503994 /nfs/dbraw/zinc/50/39/94/1026503994.db2.gz HGMOUWRBTUSVLM-GOSISDBHSA-N 1 0 328.412 3.722 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](c2cccs2)[NH+]2CCCC2)c1 ZINC000531148227 1026633953 /nfs/dbraw/zinc/63/39/53/1026633953.db2.gz RYOIZHQJSOMKOP-MRXNPFEDSA-N 1 0 347.440 3.914 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CCCO)[C@@H]1CCCc2ccccc21 ZINC000531164059 1026636689 /nfs/dbraw/zinc/63/66/89/1026636689.db2.gz NHOVJQJFRLQHAR-HXUWFJFHSA-N 1 0 340.423 3.857 20 5 EHBDRO C[C@H]1COCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277719218 1026670519 /nfs/dbraw/zinc/67/05/19/1026670519.db2.gz JBELWOVLZPWBLU-WFASDCNBSA-N 1 0 332.425 3.838 20 5 EHBDRO COc1cccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158630386 1026748868 /nfs/dbraw/zinc/74/88/68/1026748868.db2.gz DKBZIFXMKVLZFH-SFHVURJKSA-N 1 0 326.396 3.714 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCC[C@@H](C)C1 ZINC000301382738 1026784552 /nfs/dbraw/zinc/78/45/52/1026784552.db2.gz VGTHVIIEVNFOKO-NEPJUHHUSA-N 1 0 343.374 3.729 20 5 EHBDRO CC(C)N(CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C(C)C ZINC000480080391 1026982753 /nfs/dbraw/zinc/98/27/53/1026982753.db2.gz LFHJVVCXMBTUMR-GOSISDBHSA-N 1 0 333.476 3.624 20 5 EHBDRO C[C@@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178641321 1026990994 /nfs/dbraw/zinc/99/09/94/1026990994.db2.gz MBGGUVOCMCBGAQ-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531587150 1027076499 /nfs/dbraw/zinc/07/64/99/1027076499.db2.gz PLWMDMAKACANPA-CQSZACIVSA-N 1 0 334.416 3.719 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2F)CC1 ZINC000413144735 1027129492 /nfs/dbraw/zinc/12/94/92/1027129492.db2.gz KUDFRYPGNKCDNZ-ZDUSSCGKSA-N 1 0 344.390 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccc3c[nH]nc3c1)CCC2 ZINC000342816030 1027361864 /nfs/dbraw/zinc/36/18/64/1027361864.db2.gz SLIYTDFDKDCMDZ-GOSISDBHSA-N 1 0 336.395 3.681 20 5 EHBDRO C[NH+](C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccco1 ZINC000729629933 1027371328 /nfs/dbraw/zinc/37/13/28/1027371328.db2.gz QXKCHFIQCXWOQY-LBPRGKRZSA-N 1 0 332.385 3.512 20 5 EHBDRO COc1ccc(COCCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178653460 1027603510 /nfs/dbraw/zinc/60/35/10/1027603510.db2.gz ZSPZCQDLJCDRMM-OAHLLOKOSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1nc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781586 1027788291 /nfs/dbraw/zinc/78/82/91/1027788291.db2.gz BQOJWUNUAQKKFM-PBHICJAKSA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](CC(F)(F)F)C1 ZINC000420944262 1027901830 /nfs/dbraw/zinc/90/18/30/1027901830.db2.gz JGUSDVNDJBDTGX-LBPRGKRZSA-N 1 0 332.322 3.638 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@@H](CC(F)F)c2ccccc2)c1 ZINC000421000853 1027981443 /nfs/dbraw/zinc/98/14/43/1027981443.db2.gz WOCSYYYPPLEVJL-INIZCTEOSA-N 1 0 336.338 3.960 20 5 EHBDRO CC(C)c1ccc(C(=O)NCc2ccc([C@@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000422890459 1028026739 /nfs/dbraw/zinc/02/67/39/1028026739.db2.gz SIFABXOSXGRAOT-CYBMUJFWSA-N 1 0 341.411 3.668 20 5 EHBDRO Cc1cnc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000078625295 1028041941 /nfs/dbraw/zinc/04/19/41/1028041941.db2.gz LHHUBKIHZJYZKS-HNNXBMFYSA-N 1 0 330.388 3.530 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691015 1028162934 /nfs/dbraw/zinc/16/29/34/1028162934.db2.gz WRENWHMBJIWOAU-JKSUJKDBSA-N 1 0 346.431 3.545 20 5 EHBDRO COC[C@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467118633 1028206138 /nfs/dbraw/zinc/20/61/38/1028206138.db2.gz PCYQZFXXZNOEFF-HNNXBMFYSA-N 1 0 336.432 3.631 20 5 EHBDRO C[C@@H](NC[C@@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246327 1028306036 /nfs/dbraw/zinc/30/60/36/1028306036.db2.gz ZDHNCBILQWSZOZ-OLZOCXBDSA-N 1 0 331.441 3.726 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@@H]2CCO[C@@H]21 ZINC000130296285 1028375333 /nfs/dbraw/zinc/37/53/33/1028375333.db2.gz SDHAOCBRJSFQAQ-OYMYKWPDSA-N 1 0 344.455 3.709 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423376549 1028397592 /nfs/dbraw/zinc/39/75/92/1028397592.db2.gz YFRBKQRDPVDEGO-FZKQIMNGSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2CCCC(F)(F)C2)n1 ZINC000502593271 1028410000 /nfs/dbraw/zinc/41/00/00/1028410000.db2.gz BVXHXZCGFCPGRB-HZSPNIEDSA-N 1 0 342.390 3.690 20 5 EHBDRO CCc1ccc([C@H](N[C@H]2CCC[C@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375035 1028412323 /nfs/dbraw/zinc/41/23/23/1028412323.db2.gz IPIWAEXTGNMUPC-YZVOILCLSA-N 1 0 343.427 3.699 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H]1CCC[C@H](CO)C1 ZINC000840979887 1028471408 /nfs/dbraw/zinc/47/14/08/1028471408.db2.gz VHQVTOOIVPYRAR-JOYOIKCWSA-N 1 0 333.215 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](n3ncc4ccccc43)C2)cc1F ZINC000366969947 1028489856 /nfs/dbraw/zinc/48/98/56/1028489856.db2.gz OSFQMSUUZDBSBH-HNNXBMFYSA-N 1 0 340.358 3.531 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](C)C1(OC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000421877146 1028877946 /nfs/dbraw/zinc/87/79/46/1028877946.db2.gz LIOWBPMKMZCMMF-WMLDXEAASA-N 1 0 336.432 3.610 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CC[C@H]2O)ccc1Oc1ccccc1Cl ZINC000424195909 1028883726 /nfs/dbraw/zinc/88/37/26/1028883726.db2.gz DWFMAPHHPGOJLI-UKRRQHHQSA-N 1 0 348.786 3.653 20 5 EHBDRO CO[C@H]1C[C@H]2C[C@H]([NH2+]CCc3ccc(Cl)cc3[N+](=O)[O-])C[C@H]2C1 ZINC000424281334 1028954046 /nfs/dbraw/zinc/95/40/46/1028954046.db2.gz NCJUHMYKVRRDBY-WBIXOSHYSA-N 1 0 338.835 3.584 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N(C)C1CC1 ZINC000504899156 1029026567 /nfs/dbraw/zinc/02/65/67/1029026567.db2.gz BLUJULSVVANRKO-KBPBESRZSA-N 1 0 337.489 3.538 20 5 EHBDRO COc1cc(C[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000524276551 1029049192 /nfs/dbraw/zinc/04/91/92/1029049192.db2.gz WTUWIIQZOBLOFT-UHFFFAOYSA-N 1 0 332.347 3.683 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCNc1ccccn1 ZINC000504905013 1029050353 /nfs/dbraw/zinc/05/03/53/1029050353.db2.gz AJZHAUQISUNZHR-AWEZNQCLSA-N 1 0 346.456 3.562 20 5 EHBDRO Cc1ccc(CNC[C@H]2CC[N@@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409448 1029068268 /nfs/dbraw/zinc/06/82/68/1029068268.db2.gz YLPAHORNASLSPR-GOSISDBHSA-N 1 0 331.460 3.790 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)C1CC[NH+](C(C)C)CC1 ZINC000524599735 1029356788 /nfs/dbraw/zinc/35/67/88/1029356788.db2.gz PTHFFWKUROYEQH-UHFFFAOYSA-N 1 0 349.475 3.687 20 5 EHBDRO CC1(C)CCCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000446086146 1029376613 /nfs/dbraw/zinc/37/66/13/1029376613.db2.gz YDZUKHMNHGXJBP-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCOc2cccc(C(F)(F)F)c2)c1 ZINC000237850680 1029453589 /nfs/dbraw/zinc/45/35/89/1029453589.db2.gz HSIQPGIQIJXVNG-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c(OC)c1 ZINC000278240383 1029768948 /nfs/dbraw/zinc/76/89/48/1029768948.db2.gz LHTRAVVVKORPTP-GOSISDBHSA-N 1 0 342.395 3.779 20 5 EHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446837581 1029807400 /nfs/dbraw/zinc/80/74/00/1029807400.db2.gz YHCBSHJHIJUNGD-SECBINFHSA-N 1 0 330.310 3.682 20 5 EHBDRO C[C@H](CCc1ccc(F)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446845158 1029824369 /nfs/dbraw/zinc/82/43/69/1029824369.db2.gz YHMZDMGTNSJUIW-GFCCVEGCSA-N 1 0 342.374 3.721 20 5 EHBDRO C[C@H](CCc1ccsc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446844735 1029824737 /nfs/dbraw/zinc/82/47/37/1029824737.db2.gz VPKRAFZRNJAKQR-LLVKDONJSA-N 1 0 330.413 3.644 20 5 EHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525410913 1029840145 /nfs/dbraw/zinc/84/01/45/1029840145.db2.gz PNTGINFIEMKSLV-CGTJXYLNSA-N 1 0 348.443 3.629 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000533853477 1029919001 /nfs/dbraw/zinc/91/90/01/1029919001.db2.gz IICJQSJENWMHLU-IBGZPJMESA-N 1 0 339.439 3.995 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@H](C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453238813 1029966663 /nfs/dbraw/zinc/96/66/63/1029966663.db2.gz SWDPPRQJDSXFRK-LIRRHRJNSA-N 1 0 346.427 3.838 20 5 EHBDRO C[C@@H](CCCCO)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453288606 1030030275 /nfs/dbraw/zinc/03/02/75/1030030275.db2.gz POEICHMGSDUQRY-HNAYVOBHSA-N 1 0 328.412 3.825 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453327701 1030109178 /nfs/dbraw/zinc/10/91/78/1030109178.db2.gz AYEMUHMFZQKXRI-SFHVURJKSA-N 1 0 344.411 3.592 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H](C)n2ccnc21 ZINC000453345452 1030131563 /nfs/dbraw/zinc/13/15/63/1030131563.db2.gz KAGZHGNDHCAWKS-BFHYXJOUSA-N 1 0 346.456 3.958 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453363887 1030178299 /nfs/dbraw/zinc/17/82/99/1030178299.db2.gz ROEMIINLBHECRJ-FDQGKXFDSA-N 1 0 327.384 3.561 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000525868288 1030183253 /nfs/dbraw/zinc/18/32/53/1030183253.db2.gz UBRDIDGMTADPRU-IAGOWNOFSA-N 1 0 326.396 3.900 20 5 EHBDRO CSc1ccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447533906 1030269747 /nfs/dbraw/zinc/26/97/47/1030269747.db2.gz ZFSYFYUYFVQDQE-JKSUJKDBSA-N 1 0 346.456 3.787 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000447540883 1030275436 /nfs/dbraw/zinc/27/54/36/1030275436.db2.gz DVYMACUCCSGRDF-ZWKOTPCHSA-N 1 0 345.468 3.926 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)n1 ZINC000447563380 1030308834 /nfs/dbraw/zinc/30/88/34/1030308834.db2.gz PQZLMLWLMPNODL-JZAWBGDQSA-N 1 0 332.448 3.833 20 5 EHBDRO CC(C)[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128667950 1030401262 /nfs/dbraw/zinc/40/12/62/1030401262.db2.gz UQXHYZLPGKUNHX-MRXNPFEDSA-N 1 0 337.395 3.573 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894737 1030774618 /nfs/dbraw/zinc/77/46/18/1030774618.db2.gz GOMVSSDVNMRYBR-RBUKOAKNSA-N 1 0 326.396 3.699 20 5 EHBDRO C[C@@H]([NH2+]CC1(O)CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000482886859 1030783612 /nfs/dbraw/zinc/78/36/12/1030783612.db2.gz HSTHXFOYEJNTQY-GFCCVEGCSA-N 1 0 332.425 3.889 20 5 EHBDRO COc1ccc(OCC[N@@H+]2C[C@@H](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073327 1030939276 /nfs/dbraw/zinc/93/92/76/1030939276.db2.gz XVXJDYUZOQPIGB-KUHUBIRLSA-N 1 0 342.395 3.675 20 5 EHBDRO CCC1(CC)CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000485688245 1030950262 /nfs/dbraw/zinc/95/02/62/1030950262.db2.gz PJTLTEPMZZQNQF-UHFFFAOYSA-N 1 0 334.416 3.864 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483226984 1031040297 /nfs/dbraw/zinc/04/02/97/1031040297.db2.gz JGSULRNQKXRNSW-CQSZACIVSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccncc1CCC[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000583899077 1031074199 /nfs/dbraw/zinc/07/41/99/1031074199.db2.gz ALSJXPLLFRQKLW-UHFFFAOYSA-N 1 0 338.411 3.544 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](CC1CC1)CC1CCC1 ZINC000483276239 1031083510 /nfs/dbraw/zinc/08/35/10/1031083510.db2.gz DVIIHCBJZOSCMU-UHFFFAOYSA-N 1 0 345.443 3.744 20 5 EHBDRO COc1cccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1OC ZINC000192701018 1031259749 /nfs/dbraw/zinc/25/97/49/1031259749.db2.gz YNQIQMZOFRVKRZ-KRWDZBQOSA-N 1 0 342.395 3.779 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C12CCC2 ZINC000483742199 1031312743 /nfs/dbraw/zinc/31/27/43/1031312743.db2.gz JFGRTQCXHALQGF-NZSAHSFTSA-N 1 0 344.455 3.853 20 5 EHBDRO CC[C@@H](N[C@@H]1CC[N@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807237 1031341844 /nfs/dbraw/zinc/34/18/44/1031341844.db2.gz LZSWMABKDKUVPZ-IEBWSBKVSA-N 1 0 331.460 3.900 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161242803 1031428331 /nfs/dbraw/zinc/42/83/31/1031428331.db2.gz WRIXLILWBLKQTR-BXUZGUMPSA-N 1 0 343.349 3.534 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468945 1031587151 /nfs/dbraw/zinc/58/71/51/1031587151.db2.gz BWONYPJNWXYMHT-JOYOIKCWSA-N 1 0 342.367 3.600 20 5 EHBDRO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737963 1031705214 /nfs/dbraw/zinc/70/52/14/1031705214.db2.gz HERGFMCDWSRMQA-FRRDWIJNSA-N 1 0 330.388 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CC[C@@H]4CCCC[C@@H]4[NH2+]3)n2)s1 ZINC000904110276 1031735015 /nfs/dbraw/zinc/73/50/15/1031735015.db2.gz QVZGCMQWAYALEB-DCAQKATOSA-N 1 0 334.401 3.690 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000584126590 1031768039 /nfs/dbraw/zinc/76/80/39/1031768039.db2.gz NJJQFDQGYJGRRB-INIZCTEOSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CCC(OC(F)F)CC1 ZINC000594505779 1033407149 /nfs/dbraw/zinc/40/71/49/1033407149.db2.gz AINQJDPPPKAUGJ-MGULZYLOSA-N 1 0 326.343 3.722 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](C)[C@@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000235737348 1033409901 /nfs/dbraw/zinc/40/99/01/1033409901.db2.gz FAUQPZUEACTAGG-QWRGUYRKSA-N 1 0 342.237 3.560 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)[C@H]1CCCCO1 ZINC000594510178 1033415680 /nfs/dbraw/zinc/41/56/80/1033415680.db2.gz HYIYBPVVVGLGRP-NIKGAXFTSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCCN3CCCC[C@@H]13)CCC2 ZINC000594518577 1033425218 /nfs/dbraw/zinc/42/52/18/1033425218.db2.gz IDLAHZAROJBWGZ-QYZOEREBSA-N 1 0 329.444 3.579 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594603456 1033448760 /nfs/dbraw/zinc/44/87/60/1033448760.db2.gz VJSZVSRQCIOUKG-RDJZCZTQSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292779 1033555163 /nfs/dbraw/zinc/55/51/63/1033555163.db2.gz NEMYBXOUWMBCEA-NVXWUHKLSA-N 1 0 346.456 3.570 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000594974763 1033580583 /nfs/dbraw/zinc/58/05/83/1033580583.db2.gz IFGXMMGSEORGOV-KXQQJKGRSA-N 1 0 338.407 3.770 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cc1[N+](=O)[O-] ZINC000594939678 1033589011 /nfs/dbraw/zinc/58/90/11/1033589011.db2.gz OYBCROSKROGQRI-CYBMUJFWSA-N 1 0 328.416 3.755 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2cnccc2C)cc1[N+](=O)[O-] ZINC000595072649 1033646180 /nfs/dbraw/zinc/64/61/80/1033646180.db2.gz JHDUDZSVURZNHF-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027125 1033649395 /nfs/dbraw/zinc/64/93/95/1033649395.db2.gz PZEJMXUMYVIQNR-AFAVFJNCSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[C@H](C)[NH+]1CCCCC1 ZINC000595032288 1033653438 /nfs/dbraw/zinc/65/34/38/1033653438.db2.gz MCIYFACWUPUEPL-GJZGRUSLSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](C)c1c(C)noc1C ZINC000595035038 1033655721 /nfs/dbraw/zinc/65/57/21/1033655721.db2.gz GMLKMSHAFHKRJQ-QWRGUYRKSA-N 1 0 333.388 3.663 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000595042422 1033660167 /nfs/dbraw/zinc/66/01/67/1033660167.db2.gz GAELUDXHHAKGMZ-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599036526 1033661501 /nfs/dbraw/zinc/66/15/01/1033661501.db2.gz UINUXBZYLUPYCX-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO COc1cc(C[NH2+]CC2(C(F)(F)F)CCCC2)c([N+](=O)[O-])cc1O ZINC000599014044 1033662715 /nfs/dbraw/zinc/66/27/15/1033662715.db2.gz NQZQVARNNOMUPT-UHFFFAOYSA-N 1 0 348.321 3.521 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)C1(O)CCCC1 ZINC000595051807 1033667492 /nfs/dbraw/zinc/66/74/92/1033667492.db2.gz OGYGBWMJQSRXMX-CYBMUJFWSA-N 1 0 336.432 3.585 20 5 EHBDRO CC[C@H]([NH2+]CC1(CC(=O)NC)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000595105954 1033691798 /nfs/dbraw/zinc/69/17/98/1033691798.db2.gz UZJTZGIMARVPGZ-KRWDZBQOSA-N 1 0 347.459 3.722 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595101249 1033692388 /nfs/dbraw/zinc/69/23/88/1033692388.db2.gz CPRMHLBZSKSZKX-DNVCBOLYSA-N 1 0 325.412 3.520 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@@H]2c2ccccc2)n1 ZINC000595088389 1033698447 /nfs/dbraw/zinc/69/84/47/1033698447.db2.gz BNEBPLJGABLBTD-BDXSIMOUSA-N 1 0 340.427 3.811 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])OC)c1 ZINC000599058767 1033698604 /nfs/dbraw/zinc/69/86/04/1033698604.db2.gz UZNOHCOSIILPBV-IEBWSBKVSA-N 1 0 342.395 3.568 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc3c(c2)[C@@H](C[NH3+])CCC3)cc1[N+](=O)[O-] ZINC000595254967 1033723049 /nfs/dbraw/zinc/72/30/49/1033723049.db2.gz QHEKKKSHLNTRGC-OAHLLOKOSA-N 1 0 339.395 3.534 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093026 1033731204 /nfs/dbraw/zinc/73/12/04/1033731204.db2.gz MEDBTRPCEIIGQC-XIKOKIGWSA-N 1 0 327.384 3.800 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@H](c3cc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000595356400 1033782353 /nfs/dbraw/zinc/78/23/53/1033782353.db2.gz LZCUFSDEAHPHAH-AWEZNQCLSA-N 1 0 340.383 3.752 20 5 EHBDRO C[C@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595411001 1033788332 /nfs/dbraw/zinc/78/83/32/1033788332.db2.gz KZEOFRPQLJYDQL-CQSZACIVSA-N 1 0 332.375 3.507 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cc(C)sc2C)c1 ZINC000593021340 1033836197 /nfs/dbraw/zinc/83/61/97/1033836197.db2.gz VZWOZILEWAOQLX-NSHDSACASA-N 1 0 348.424 3.911 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cccc(C)c2C)c1 ZINC000593021847 1033839213 /nfs/dbraw/zinc/83/92/13/1033839213.db2.gz YQHQHDXLERWYRZ-AWEZNQCLSA-N 1 0 342.395 3.849 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000608782307 1033886150 /nfs/dbraw/zinc/88/61/50/1033886150.db2.gz BPSHYQFFSIMSOS-KRWDZBQOSA-N 1 0 334.416 3.910 20 5 EHBDRO C[C@@H](CO)[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670816 1033943887 /nfs/dbraw/zinc/94/38/87/1033943887.db2.gz DNPVLWXDCHTWLD-NHYWBVRUSA-N 1 0 346.349 3.597 20 5 EHBDRO CC[NH+](CC)CCOc1ccc(CNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000603859202 1033983166 /nfs/dbraw/zinc/98/31/66/1033983166.db2.gz SJOQSJXUAIYHBV-UHFFFAOYSA-N 1 0 343.427 3.928 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754775 1033985063 /nfs/dbraw/zinc/98/50/63/1033985063.db2.gz BULVCDAIMWZLBJ-QWHCGFSZSA-N 1 0 348.378 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H](C4CCC4)C3)o2)cc1 ZINC000595839449 1034004407 /nfs/dbraw/zinc/00/44/07/1034004407.db2.gz YMGJOYDFBOOJOV-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584501 1034025270 /nfs/dbraw/zinc/02/52/70/1034025270.db2.gz ADZICILGQCIYDR-KFWWJZLASA-N 1 0 348.443 3.956 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097528 1034061044 /nfs/dbraw/zinc/06/10/44/1034061044.db2.gz YSLCWDCUIXHZLA-DOTOQJQBSA-N 1 0 331.460 3.676 20 5 EHBDRO CCOc1ccc([C@@H](C)NCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000179394442 1034278205 /nfs/dbraw/zinc/27/82/05/1034278205.db2.gz YEFFQSSWOCYCOE-OAHLLOKOSA-N 1 0 335.448 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596569739 1034291688 /nfs/dbraw/zinc/29/16/88/1034291688.db2.gz DMABIKMGFMDNKH-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCc3cc(N)ccc32)cc1[N+](=O)[O-] ZINC000596649923 1034345456 /nfs/dbraw/zinc/34/54/56/1034345456.db2.gz DRMFZBROZBTYLG-YVEFUNNKSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H](N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000596648779 1034346983 /nfs/dbraw/zinc/34/69/83/1034346983.db2.gz FONPWUITPSWKAI-UPRAQXHNSA-N 1 0 343.402 3.530 20 5 EHBDRO O=[N+]([O-])c1ncccc1NCc1ccc(C[NH+]2CCCCCC2)cc1 ZINC000604495100 1034399437 /nfs/dbraw/zinc/39/94/37/1034399437.db2.gz CLAUUBJFUPRFOL-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000612194079 1034436189 /nfs/dbraw/zinc/43/61/89/1034436189.db2.gz XJGLHTGUFXSCMO-QGZVFWFLSA-N 1 0 326.396 3.559 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2c(s1)CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000179688672 1034563693 /nfs/dbraw/zinc/56/36/93/1034563693.db2.gz UREWIFKZSVNDNA-LBPRGKRZSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC=C(C(C)(C)C)CC1 ZINC000534660720 1034782098 /nfs/dbraw/zinc/78/20/98/1034782098.db2.gz GZTBCBHXZJJTIM-UHFFFAOYSA-N 1 0 345.443 3.910 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@H]1c1ccccc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411126029 1034796272 /nfs/dbraw/zinc/79/62/72/1034796272.db2.gz NIMQJHVMDDJNKW-GOSISDBHSA-N 1 0 339.395 3.761 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000172170624 1034848970 /nfs/dbraw/zinc/84/89/70/1034848970.db2.gz ZWAXAGOWODDEBL-GHMZBOCLSA-N 1 0 339.823 3.744 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@H]1C ZINC000612530867 1035036019 /nfs/dbraw/zinc/03/60/19/1035036019.db2.gz ZBFSZOHKGMNFCC-SOZUMNATSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC000612578797 1035074892 /nfs/dbraw/zinc/07/48/92/1035074892.db2.gz JVLZQHKOGIZSFI-HXUWFJFHSA-N 1 0 339.439 3.610 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N2CCCC2)o1 ZINC000154053320 1035100351 /nfs/dbraw/zinc/10/03/51/1035100351.db2.gz XTDNMJIUVQPJRB-MAUKXSAKSA-N 1 0 343.427 3.984 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)c1ccc(F)cc1 ZINC000066434489 1035458129 /nfs/dbraw/zinc/45/81/29/1035458129.db2.gz XAKXQKQRFXCMFC-GOSISDBHSA-N 1 0 332.375 3.678 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000078338121 1035537141 /nfs/dbraw/zinc/53/71/41/1035537141.db2.gz YOQVSVIAXRKXSG-CJNGLKHVSA-N 1 0 346.456 3.855 20 5 EHBDRO C[C@@H]1CCN(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000540803557 1035695968 /nfs/dbraw/zinc/69/59/68/1035695968.db2.gz DURBKDBQIBOHNS-CQSZACIVSA-N 1 0 345.468 3.755 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1cccs1 ZINC000029871575 1035771379 /nfs/dbraw/zinc/77/13/79/1035771379.db2.gz UYJXSLKGWUVHFW-OAHLLOKOSA-N 1 0 342.424 3.919 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000588232720 1035832455 /nfs/dbraw/zinc/83/24/55/1035832455.db2.gz YYWYVAXISQSRRE-DOMZBBRYSA-N 1 0 334.803 3.675 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000271415234 1035856714 /nfs/dbraw/zinc/85/67/14/1035856714.db2.gz ARLBTOQYRNVHIQ-HNNXBMFYSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@H](C)c2cccc(O)c2)ccc1[N+](=O)[O-] ZINC000492517683 1035908669 /nfs/dbraw/zinc/90/86/69/1035908669.db2.gz YLZFRYKVOXQTSA-CYBMUJFWSA-N 1 0 330.384 3.892 20 5 EHBDRO CCOC[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180154143 1035920180 /nfs/dbraw/zinc/92/01/80/1035920180.db2.gz XDDRNGFZXLRDQO-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347101 1035923092 /nfs/dbraw/zinc/92/30/92/1035923092.db2.gz IKFXEFGSWKAAAK-HOTGVXAUSA-N 1 0 344.415 3.949 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2cccc(OC)c2)ccc1[N+](=O)[O-] ZINC000492609648 1036043644 /nfs/dbraw/zinc/04/36/44/1036043644.db2.gz UNFHBNMFCXDIJP-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1cc(C[N@H+](C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000464102838 1036126346 /nfs/dbraw/zinc/12/63/46/1036126346.db2.gz BZSGYKIFVYYGOL-CYBMUJFWSA-N 1 0 332.375 3.978 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)CCSCC)ccc1[N+](=O)[O-] ZINC000492721854 1036230128 /nfs/dbraw/zinc/23/01/28/1036230128.db2.gz LQBHTZCCRJZGHQ-ZDUSSCGKSA-N 1 0 326.462 3.957 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C(C)C)[C@H](O)C(F)(F)F ZINC000589162657 1036288433 /nfs/dbraw/zinc/28/84/33/1036288433.db2.gz SIHFOKLGWQVUPA-SWHYSGLUSA-N 1 0 334.338 3.502 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@]2(C)OCCc3sccc32)cc1[N+](=O)[O-] ZINC000589325777 1036343820 /nfs/dbraw/zinc/34/38/20/1036343820.db2.gz YBDBHLMVHGTSSF-QGZVFWFLSA-N 1 0 332.425 3.542 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000535414881 1036479860 /nfs/dbraw/zinc/47/98/60/1036479860.db2.gz IHDALAFAIFHIEF-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CCC(O)(CC)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180330252 1036684646 /nfs/dbraw/zinc/68/46/46/1036684646.db2.gz OORUCXKQSPUUSG-GOSISDBHSA-N 1 0 328.412 3.825 20 5 EHBDRO C[C@@H](CNc1cccc(F)c1[N+](=O)[O-])[N@@H+]1CCc2sccc2C1 ZINC000057138166 1036719135 /nfs/dbraw/zinc/71/91/35/1036719135.db2.gz NIXOZLGOYZZSBM-NSHDSACASA-N 1 0 335.404 3.654 20 5 EHBDRO Cc1c(Cl)cccc1NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180452153 1036842413 /nfs/dbraw/zinc/84/24/13/1036842413.db2.gz SEVONTAEXKPZNF-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158942832 1036888134 /nfs/dbraw/zinc/88/81/34/1036888134.db2.gz NKKBWZBLPCXRJP-LJQANCHMSA-N 1 0 340.423 3.757 20 5 EHBDRO CC(C)[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CCOCC1 ZINC000089912638 1036973194 /nfs/dbraw/zinc/97/31/94/1036973194.db2.gz FOFNQJOLZDTLOL-UHFFFAOYSA-N 1 0 345.399 3.639 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@H](CC)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000152851956 1036999548 /nfs/dbraw/zinc/99/95/48/1036999548.db2.gz BNFYZLXCVRCXAT-ZBFHGGJFSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(Oc3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000351026125 1037009738 /nfs/dbraw/zinc/00/97/38/1037009738.db2.gz BDFIUQVPBZECSG-UHFFFAOYSA-N 1 0 326.396 3.947 20 5 EHBDRO COC(=O)CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000180674108 1037071146 /nfs/dbraw/zinc/07/11/46/1037071146.db2.gz VNTNPQGYUWNCSN-KBXCAEBGSA-N 1 0 342.395 3.940 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc(OC)c(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000193023273 1037179583 /nfs/dbraw/zinc/17/95/83/1037179583.db2.gz FNFNVLNJWPOUSS-KRWDZBQOSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCc2cscn2)c2ccccc2)c1 ZINC000180790822 1037189848 /nfs/dbraw/zinc/18/98/48/1037189848.db2.gz ZDYAGHLFCHXPQP-SFHVURJKSA-N 1 0 339.420 3.973 20 5 EHBDRO COc1cc(C[N@H+](CC(C)C)C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000045751591 1037302547 /nfs/dbraw/zinc/30/25/47/1037302547.db2.gz GKYNSYWCLXJYIV-UHFFFAOYSA-N 1 0 344.358 3.825 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)Oc1ccc(F)cc1 ZINC000462738066 1037345325 /nfs/dbraw/zinc/34/53/25/1037345325.db2.gz KQZGJVDZFOZQHK-ZDUSSCGKSA-N 1 0 348.374 3.690 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccc(Cl)c1 ZINC000045897799 1037497264 /nfs/dbraw/zinc/49/72/64/1037497264.db2.gz XLFRLJZFIXFKFM-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCOC1 ZINC000462877890 1037506168 /nfs/dbraw/zinc/50/61/68/1037506168.db2.gz RKQVJPVFCDRHSG-MRXNPFEDSA-N 1 0 330.384 3.854 20 5 EHBDRO C[C@H](C[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000532518769 1037559701 /nfs/dbraw/zinc/55/97/01/1037559701.db2.gz UWNOFEHWLFBNRQ-CABCVRRESA-N 1 0 341.411 3.657 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CC(=O)OC(C)(C)C ZINC000468638373 1037614567 /nfs/dbraw/zinc/61/45/67/1037614567.db2.gz NYFYAEFLMHDIMT-KADHNRKRSA-N 1 0 334.416 3.708 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCC2 ZINC000540169145 1037635546 /nfs/dbraw/zinc/63/55/46/1037635546.db2.gz QOGKBRWYXRHKNG-GFCCVEGCSA-N 1 0 332.425 3.875 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000463051290 1037700204 /nfs/dbraw/zinc/70/02/04/1037700204.db2.gz ALMWSRZQENBKGE-GOSISDBHSA-N 1 0 340.427 3.856 20 5 EHBDRO C[C@H](C[NH2+]Cc1c(Cl)n[nH]c1C1CC1)c1ccccc1[N+](=O)[O-] ZINC000897458561 1037796350 /nfs/dbraw/zinc/79/63/50/1037796350.db2.gz BHQXRXLVYNTCIA-SNVBAGLBSA-N 1 0 334.807 3.742 20 5 EHBDRO CC(C)[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000026266650 1037809441 /nfs/dbraw/zinc/80/94/41/1037809441.db2.gz KRDBVXKSZIIVHX-IBGZPJMESA-N 1 0 341.411 3.910 20 5 EHBDRO C[C@H](C[NH2+]Cc1cnc(C(C)(C)C)nc1)c1ccccc1[N+](=O)[O-] ZINC000897463504 1037867416 /nfs/dbraw/zinc/86/74/16/1037867416.db2.gz HIWSIBAEYVQUMJ-CYBMUJFWSA-N 1 0 328.416 3.576 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386800 1037877960 /nfs/dbraw/zinc/87/79/60/1037877960.db2.gz ZWRYDRZNOZLUHN-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](CC(=O)Nc1ccccc1)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897466231 1037878615 /nfs/dbraw/zinc/87/86/15/1037878615.db2.gz PYTDCEWVGOFHAB-HUUCEWRRSA-N 1 0 341.411 3.705 20 5 EHBDRO COc1ccccc1C(C)(C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000103483774 1037887987 /nfs/dbraw/zinc/88/79/87/1037887987.db2.gz FDFKGTRPQBNBGU-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(CO)cc1 ZINC000592392857 1037934692 /nfs/dbraw/zinc/93/46/92/1037934692.db2.gz AADBUJSDBJPUSJ-MJGOQNOKSA-N 1 0 340.423 3.588 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000592396008 1037939838 /nfs/dbraw/zinc/93/98/38/1037939838.db2.gz FNLJJRNEEOTOEP-BHIYHBOVSA-N 1 0 341.411 3.951 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CC[C@H](C(=O)OC(C)(C)C)C1 ZINC000592380796 1037951052 /nfs/dbraw/zinc/95/10/52/1037951052.db2.gz ZPMCKOYIFRUYSS-DZGCQCFKSA-N 1 0 334.416 3.503 20 5 EHBDRO CC(C)[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592527487 1038024353 /nfs/dbraw/zinc/02/43/53/1038024353.db2.gz HIBCBLGAESCBOM-PDFOZTTASA-N 1 0 330.428 3.551 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(c3c[nH]cn3)CC2)cc1C(F)(F)F ZINC000378275643 1038363985 /nfs/dbraw/zinc/36/39/85/1038363985.db2.gz WEJOJPCOLQURTJ-UHFFFAOYSA-N 1 0 340.305 3.721 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2)cc1F ZINC000538712189 1038485036 /nfs/dbraw/zinc/48/50/36/1038485036.db2.gz OSHOZPCYKYLCIY-LLVKDONJSA-N 1 0 334.347 3.602 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000378632457 1038796087 /nfs/dbraw/zinc/79/60/87/1038796087.db2.gz KEYNUPZZXPQNHE-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000552051773 1038895563 /nfs/dbraw/zinc/89/55/63/1038895563.db2.gz GGKXFYAEYHHQNG-ZDUSSCGKSA-N 1 0 339.395 3.545 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CCC[N@@H+](C(C)C)C2)c([N+](=O)[O-])c1 ZINC000479944146 1038921485 /nfs/dbraw/zinc/92/14/85/1038921485.db2.gz AXRUKVZLKQXLDD-CQSZACIVSA-N 1 0 333.432 3.720 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000570049087 1038954083 /nfs/dbraw/zinc/95/40/83/1038954083.db2.gz AMEJIPMHBDAAGJ-UHFFFAOYSA-N 1 0 346.408 3.509 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)sc1C ZINC000192964551 1039082576 /nfs/dbraw/zinc/08/25/76/1039082576.db2.gz KOLRPKVSXYEMCE-INIZCTEOSA-N 1 0 331.441 3.878 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000905852646 1039160278 /nfs/dbraw/zinc/16/02/78/1039160278.db2.gz LLLLHPVTUUUEJO-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478044382 1039163828 /nfs/dbraw/zinc/16/38/28/1039163828.db2.gz CBGAOCHPYHLVGU-INIZCTEOSA-N 1 0 336.823 3.774 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000488555051 1039266701 /nfs/dbraw/zinc/26/67/01/1039266701.db2.gz OUOXMRAVOCFHFY-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO C[C@@H]([NH2+]CCCN1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253207 1039340841 /nfs/dbraw/zinc/34/08/41/1039340841.db2.gz VHPBZYMNWBXPRN-MRXNPFEDSA-N 1 0 339.439 3.694 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1ccccc1F)[C@H](C)O ZINC000584634738 1039395744 /nfs/dbraw/zinc/39/57/44/1039395744.db2.gz JHDJPZBMCULTGG-BIENJYKASA-N 1 0 346.402 3.767 20 5 EHBDRO Cc1nccn1CCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302858 1039643627 /nfs/dbraw/zinc/64/36/27/1039643627.db2.gz BYUSKSAVSDSADJ-SFHVURJKSA-N 1 0 328.416 3.547 20 5 EHBDRO COc1ncccc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417308073 1039659392 /nfs/dbraw/zinc/65/93/92/1039659392.db2.gz DYDDTUZPDGVUPJ-QGZVFWFLSA-N 1 0 327.384 3.556 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417311965 1039666094 /nfs/dbraw/zinc/66/60/94/1039666094.db2.gz MUSOAMLXGLQJOV-LJQANCHMSA-N 1 0 342.443 3.937 20 5 EHBDRO Cc1cc(C[C@@H](C)[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000417312939 1039668850 /nfs/dbraw/zinc/66/88/50/1039668850.db2.gz UCXDSOJUPVPIEI-XIKOKIGWSA-N 1 0 328.416 3.615 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000150743647 1039931973 /nfs/dbraw/zinc/93/19/73/1039931973.db2.gz BRJCZCMMWAUUKI-AWEZNQCLSA-N 1 0 347.415 3.547 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000192831861 1040073123 /nfs/dbraw/zinc/07/31/23/1040073123.db2.gz NVDMXHKSPWCUGO-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO CC(C)[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000029113009 1040138475 /nfs/dbraw/zinc/13/84/75/1040138475.db2.gz ROHJRKNRRDYQNL-LJQANCHMSA-N 1 0 341.411 3.545 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000490090505 1040350034 /nfs/dbraw/zinc/35/00/34/1040350034.db2.gz QYWQOGNWXCKOIC-JZXOWHBKSA-N 1 0 331.460 3.911 20 5 EHBDRO CCC[C@@H]([NH2+]CC1(CO)CC2(CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000433062292 1040583606 /nfs/dbraw/zinc/58/36/06/1040583606.db2.gz SSNUUWJMBOKILT-QGZVFWFLSA-N 1 0 332.444 3.968 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848855 1040594582 /nfs/dbraw/zinc/59/45/82/1040594582.db2.gz JRULVDWBAONMII-SJKOYZFVSA-N 1 0 342.399 3.887 20 5 EHBDRO CN(C)C1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000418117795 1040600458 /nfs/dbraw/zinc/60/04/58/1040600458.db2.gz UJOQGSNVGNBFNY-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H](C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000553935457 1040608247 /nfs/dbraw/zinc/60/82/47/1040608247.db2.gz CMEBPWFANGUMAT-HOTGVXAUSA-N 1 0 328.412 3.581 20 5 EHBDRO CO[C@H](CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433075773 1040636001 /nfs/dbraw/zinc/63/60/01/1040636001.db2.gz LGUYIHQBZIQUMA-UONOGXRCSA-N 1 0 346.349 3.874 20 5 EHBDRO C[C@@H]1OCC[C@]1(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000542315260 1040735734 /nfs/dbraw/zinc/73/57/34/1040735734.db2.gz CWVVFDHHRVQJTG-SJCJKPOMSA-N 1 0 332.425 3.980 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](CO)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433101649 1040739783 /nfs/dbraw/zinc/73/97/83/1040739783.db2.gz POJXNUQHAYCYIX-KXBFYZLASA-N 1 0 340.423 3.510 20 5 EHBDRO COc1ccc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000490826951 1040751977 /nfs/dbraw/zinc/75/19/77/1040751977.db2.gz MRLBIDXVFVAQDT-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1nccn1C[C@H](C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115158 1040781018 /nfs/dbraw/zinc/78/10/18/1040781018.db2.gz HVUCDKTWRGWGNW-ACJLOTCBSA-N 1 0 342.443 3.748 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001167750762 1040799027 /nfs/dbraw/zinc/79/90/27/1040799027.db2.gz BJCOJKPGPVIOBD-CQSZACIVSA-N 1 0 332.448 3.545 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc3c(c2)OCO3)c2cc([N+](=O)[O-])ccc21 ZINC000433145629 1040901238 /nfs/dbraw/zinc/90/12/38/1040901238.db2.gz IEUKOOYDYSPYQH-INIZCTEOSA-N 1 0 340.379 3.836 20 5 EHBDRO CC(C)(C)[NH+]1CCC(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192972013 1040926499 /nfs/dbraw/zinc/92/64/99/1040926499.db2.gz JWVRCNUYEUXVPO-SFHVURJKSA-N 1 0 331.460 3.825 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cccc3c2OCO3)c2cc([N+](=O)[O-])ccc21 ZINC000433155789 1040936836 /nfs/dbraw/zinc/93/68/36/1040936836.db2.gz ZBGAQHMLIWWKFE-MRXNPFEDSA-N 1 0 340.379 3.836 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCC[C@H]21 ZINC000555721022 1041043942 /nfs/dbraw/zinc/04/39/42/1041043942.db2.gz FJQLBDLEXLWSPX-HUUCEWRRSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC(C)(C)[C@H]2CCC[C@@H]21 ZINC000555721206 1041058695 /nfs/dbraw/zinc/05/86/95/1041058695.db2.gz IRYKRCZGHRZCSG-RDJZCZTQSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1cc(F)c(Cl)cc1Cl ZINC000181642044 1041159964 /nfs/dbraw/zinc/15/99/64/1041159964.db2.gz WKRJYOBXUDWRMC-MRVPVSSYSA-N 1 0 347.177 3.588 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433280615 1041191798 /nfs/dbraw/zinc/19/17/98/1041191798.db2.gz CYWKJKAEVKYTSO-HNAYVOBHSA-N 1 0 340.423 3.683 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CCCC(F)(F)C1 ZINC000500350765 1041193769 /nfs/dbraw/zinc/19/37/69/1041193769.db2.gz APJDCMZLLUQIDT-GFCCVEGCSA-N 1 0 328.359 3.909 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2ccc(C(C)=O)cc2[N+](=O)[O-])c1 ZINC000138677441 1041199607 /nfs/dbraw/zinc/19/96/07/1041199607.db2.gz GESGGFKSRIMJTD-UHFFFAOYSA-N 1 0 341.411 3.861 20 5 EHBDRO CC(C)[NH+]1CCC(N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433284385 1041232698 /nfs/dbraw/zinc/23/26/98/1041232698.db2.gz JURZNFZENCDRJD-GOSISDBHSA-N 1 0 331.460 3.780 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481699348 1041263525 /nfs/dbraw/zinc/26/35/25/1041263525.db2.gz VHYOQSVHSWWMPK-HXUWFJFHSA-N 1 0 338.407 3.925 20 5 EHBDRO C[C@H](CCNc1ccnc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000432166825 1041677709 /nfs/dbraw/zinc/67/77/09/1041677709.db2.gz NLOITTQRHAQHPR-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181782601 1042107354 /nfs/dbraw/zinc/10/73/54/1042107354.db2.gz QSZJEXHPJNUOEZ-GDIGMMSISA-N 1 0 325.412 3.691 20 5 EHBDRO C[C@H]([NH2+]Cc1cnc(-c2ccncc2)s1)c1cccc([N+](=O)[O-])c1 ZINC000343887367 1042464159 /nfs/dbraw/zinc/46/41/59/1042464159.db2.gz JHVXIWIIWCOONP-LBPRGKRZSA-N 1 0 340.408 3.964 20 5 EHBDRO COc1c(C)cnc(CN(C)[C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000067226843 1042774554 /nfs/dbraw/zinc/77/45/54/1042774554.db2.gz DWRMDDDGBOMJGN-CQSZACIVSA-N 1 0 329.400 3.808 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc(NC(C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000165662536 1042876825 /nfs/dbraw/zinc/87/68/25/1042876825.db2.gz OWCKUPGOCUVNMB-IBGZPJMESA-N 1 0 341.411 3.837 20 5 EHBDRO C[C@H](NCc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1nccs1 ZINC000279442590 1044088684 /nfs/dbraw/zinc/08/86/84/1044088684.db2.gz HPVNNFQPSBQNIC-QMMMGPOBSA-N 1 0 331.319 3.921 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000500460238 1044862645 /nfs/dbraw/zinc/86/26/45/1044862645.db2.gz XAGBOIFEOUOCBO-CYBMUJFWSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183483390 1125575332 /nfs/dbraw/zinc/57/53/32/1125575332.db2.gz AOVMADCQUGKJKQ-CYBMUJFWSA-N 1 0 330.432 3.537 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCCC2)cn1 ZINC000072883568 1126910995 /nfs/dbraw/zinc/91/09/95/1126910995.db2.gz LHAQLLAYGUGOTN-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO CCC[C@@H](O)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000112377573 1127184224 /nfs/dbraw/zinc/18/42/24/1127184224.db2.gz YTPJCIXTKITHIK-OAHLLOKOSA-N 1 0 348.374 3.777 20 5 EHBDRO C[C@H](C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000764570639 1127507383 /nfs/dbraw/zinc/50/73/83/1127507383.db2.gz JBRVRZXNSDVWCX-MRXNPFEDSA-N 1 0 339.439 3.957 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000765331387 1127599053 /nfs/dbraw/zinc/59/90/53/1127599053.db2.gz BYKOQORFEQLLHY-HUUCEWRRSA-N 1 0 326.396 3.805 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@H]2CCC[N@H+](Cc3ccccc3)C2)c(Cl)c1 ZINC000301293615 1127734444 /nfs/dbraw/zinc/73/44/44/1127734444.db2.gz WEBDZMDMOCAHHJ-AWEZNQCLSA-N 1 0 346.818 3.720 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301361248 1127742088 /nfs/dbraw/zinc/74/20/88/1127742088.db2.gz LYZMSTSLDQHGDA-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NCc1cccc(C[NH+]2CCCC2)c1 ZINC000153571598 1128464360 /nfs/dbraw/zinc/46/43/60/1128464360.db2.gz MICAJDMSUKLRII-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO COc1cc(N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609979 1128518159 /nfs/dbraw/zinc/51/81/59/1128518159.db2.gz BUCFYTUYAXOSQV-WMLDXEAASA-N 1 0 341.411 3.678 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765848522 1128559124 /nfs/dbraw/zinc/55/91/24/1128559124.db2.gz HKHIXBIBVTYKIC-ZNZDAUKMSA-N 1 0 326.396 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H](CC2CC2)c2ccccc2)cc1 ZINC000765845587 1128545286 /nfs/dbraw/zinc/54/52/86/1128545286.db2.gz QWJOPDIZOXKEDK-RBUKOAKNSA-N 1 0 326.396 3.759 20 5 EHBDRO CC(C)[C@@H](CO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089111 1128615364 /nfs/dbraw/zinc/61/53/64/1128615364.db2.gz RNOIWMDGILABPR-IEBWSBKVSA-N 1 0 328.412 3.538 20 5 EHBDRO C[N@@H+]1CC[C@H](c2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000624749437 1128627288 /nfs/dbraw/zinc/62/72/88/1128627288.db2.gz MUCGIVLQYZJOGR-ZDUSSCGKSA-N 1 0 330.391 3.857 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@]1(O)CCCc2ccccc21 ZINC000765875760 1128629355 /nfs/dbraw/zinc/62/93/55/1128629355.db2.gz FXMWDMAZLDXBQW-MGPUTAFESA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N1CCC(CC[N@H+]2CCCC[C@@H]2C)CC1 ZINC000301650620 1128849575 /nfs/dbraw/zinc/84/95/75/1128849575.db2.gz GIMSDZFLZNMKGH-INIZCTEOSA-N 1 0 346.475 3.779 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H](C)C1 ZINC000765955601 1128916188 /nfs/dbraw/zinc/91/61/88/1128916188.db2.gz AAHPZVQJWPXIDZ-ZRGWGRIASA-N 1 0 331.460 3.978 20 5 EHBDRO COC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCCC1 ZINC000494514639 1120575129 /nfs/dbraw/zinc/57/51/29/1120575129.db2.gz YFSFMPXJWGSPNJ-HNNXBMFYSA-N 1 0 346.349 3.908 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC[C@@H](C)CO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496405 1120758597 /nfs/dbraw/zinc/75/85/97/1120758597.db2.gz PQTSZOTVRPDGHM-KUHUBIRLSA-N 1 0 346.427 3.838 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)CCc1ccccc1 ZINC000542519345 1120886064 /nfs/dbraw/zinc/88/60/64/1120886064.db2.gz ROPJHBHQIWMFHB-FQEVSTJZSA-N 1 0 342.439 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C/C=C\c3ccncc3)CC2)cc1 ZINC000494948282 1120909968 /nfs/dbraw/zinc/90/99/68/1120909968.db2.gz BTBPEFGYBBJPCR-UPHRSURJSA-N 1 0 339.395 3.546 20 5 EHBDRO C[C@H](CO)CCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494956157 1120914189 /nfs/dbraw/zinc/91/41/89/1120914189.db2.gz UHCZUWMOCCCTMC-KXBFYZLASA-N 1 0 328.412 3.682 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000495007012 1120930083 /nfs/dbraw/zinc/93/00/83/1120930083.db2.gz IDPDQHCFKSJJPH-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO COc1cc(CN2CCc3c(cccc3[N+](=O)[O-])C2)ccc1SC ZINC000153274926 1120931498 /nfs/dbraw/zinc/93/14/98/1120931498.db2.gz IJCLQMNDSZOHGV-UHFFFAOYSA-N 1 0 344.436 3.884 20 5 EHBDRO COc1ccc(OCC[N@H+](C)Cc2ccc(F)cc2C)c([N+](=O)[O-])c1 ZINC000487965410 1121390117 /nfs/dbraw/zinc/39/01/17/1121390117.db2.gz SMEQNMAOWKJACS-UHFFFAOYSA-N 1 0 348.374 3.562 20 5 EHBDRO CC(C)COC(=O)N1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000495746417 1121397305 /nfs/dbraw/zinc/39/73/05/1121397305.db2.gz DADYNNGOJNKKGQ-AWEZNQCLSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccnn1C1CCC1 ZINC000921976880 1128989768 /nfs/dbraw/zinc/98/97/68/1128989768.db2.gz SECRRFRLZYOBNV-UHFFFAOYSA-N 1 0 334.807 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2/C=C\c2ccccc2)cc1 ZINC000780400263 1121575328 /nfs/dbraw/zinc/57/53/28/1121575328.db2.gz UQZPVQNKRTVKJO-QQXWZLKESA-N 1 0 338.407 3.806 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccccc2[N+](=O)[O-])sc2nc(C)nc(C)c12 ZINC000915683565 1121583829 /nfs/dbraw/zinc/58/38/29/1121583829.db2.gz WEEQEXKNODRIHX-UHFFFAOYSA-N 1 0 342.424 3.815 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000090654303 1121669497 /nfs/dbraw/zinc/66/94/97/1121669497.db2.gz YUFQCASTCFSPRM-QMTMVMCOSA-N 1 0 328.412 3.546 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301163738 1122218022 /nfs/dbraw/zinc/21/80/22/1122218022.db2.gz CEDFAIJMMKEYQD-INIZCTEOSA-N 1 0 343.402 3.710 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c(F)c1 ZINC000301184171 1122298904 /nfs/dbraw/zinc/29/89/04/1122298904.db2.gz IWJTWWCDUWYRKK-INIZCTEOSA-N 1 0 343.402 3.710 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(OC3CCCCC3)CC2)c1 ZINC000125456682 1122317205 /nfs/dbraw/zinc/31/72/05/1122317205.db2.gz RDOXSWJOPYYIFC-UHFFFAOYSA-N 1 0 348.443 3.787 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCCC[C@@H]1O ZINC000497157479 1122354800 /nfs/dbraw/zinc/35/48/00/1122354800.db2.gz AFRLKOUSTVCDGC-YJBOKZPZSA-N 1 0 344.411 3.838 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCC[C@H]1O ZINC000497264039 1122428718 /nfs/dbraw/zinc/42/87/18/1122428718.db2.gz VZSCOOCIXQXDGY-KBXCAEBGSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[NH+]1CCCCC1 ZINC000917840216 1122691054 /nfs/dbraw/zinc/69/10/54/1122691054.db2.gz QEZGBFVVPNRHSS-MRXNPFEDSA-N 1 0 347.462 3.992 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@H](O)C(F)(F)F ZINC000498356654 1122884727 /nfs/dbraw/zinc/88/47/27/1122884727.db2.gz ZVZRRRLASKOMQL-OCCSQVGLSA-N 1 0 334.338 3.510 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]C[C@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000556251722 1122898128 /nfs/dbraw/zinc/89/81/28/1122898128.db2.gz DYGZFADFHLFCOO-WBVHZDCISA-N 1 0 342.443 3.834 20 5 EHBDRO COc1ccc(C[NH2+]CCCOc2c(C)cccc2C)cc1[N+](=O)[O-] ZINC000609287700 1122939597 /nfs/dbraw/zinc/93/95/97/1122939597.db2.gz URMLCICXBMQZPQ-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000556580066 1123043382 /nfs/dbraw/zinc/04/33/82/1123043382.db2.gz BXNQPONQFHNABI-VHKYSDTDSA-N 1 0 340.423 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1 ZINC000498900589 1123108492 /nfs/dbraw/zinc/10/84/92/1123108492.db2.gz JTTOGXSUROSRTG-UHFFFAOYSA-N 1 0 326.396 3.755 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000195131965 1123165316 /nfs/dbraw/zinc/16/53/16/1123165316.db2.gz BTHPXNWILXEPAA-SJLPKXTDSA-N 1 0 339.439 3.768 20 5 EHBDRO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000556896391 1123173340 /nfs/dbraw/zinc/17/33/40/1123173340.db2.gz VWVFKWYFGVRFAG-JQHSSLGASA-N 1 0 332.444 3.929 20 5 EHBDRO CC[C@H](C[NH+]1CCCC1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000609839853 1123678263 /nfs/dbraw/zinc/67/82/63/1123678263.db2.gz CGWNOJZZGPTZQR-GFCCVEGCSA-N 1 0 331.338 3.900 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](CCO)CCc1ccccc1 ZINC000615835597 1123884273 /nfs/dbraw/zinc/88/42/73/1123884273.db2.gz UPKAFMCRTKIXJU-SAPNQHFASA-N 1 0 340.423 3.535 20 5 EHBDRO Cc1cc(N(C)CC2CCN(c3cc[nH+]cc3)CC2)ccc1[N+](=O)[O-] ZINC000499657429 1129178961 /nfs/dbraw/zinc/17/89/61/1129178961.db2.gz ZLMUXKKHXVYAHY-UHFFFAOYSA-N 1 0 340.427 3.651 20 5 EHBDRO Cc1cc(NC[C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000181523101 1124908249 /nfs/dbraw/zinc/90/82/49/1124908249.db2.gz NHXJIQACTKVSQI-HNNXBMFYSA-N 1 0 337.379 3.639 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[NH2+]Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000183084301 1125435857 /nfs/dbraw/zinc/43/58/57/1125435857.db2.gz MGBRKBGLKXYKQT-NXEZZACHSA-N 1 0 332.347 3.729 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000078705059 1129185271 /nfs/dbraw/zinc/18/52/71/1129185271.db2.gz WCCGVAYIWYEXKR-UHFFFAOYSA-N 1 0 344.386 3.820 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000255954995 1129237848 /nfs/dbraw/zinc/23/78/48/1129237848.db2.gz YQKXGEKHLKTQKS-DXCKQFNASA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000079723989 1129289597 /nfs/dbraw/zinc/28/95/97/1129289597.db2.gz HXZJONFXGSFGDQ-LLVKDONJSA-N 1 0 348.786 3.870 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000131027257 1129376295 /nfs/dbraw/zinc/37/62/95/1129376295.db2.gz YSYQPZBNUGZPQI-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H](C)c1ccco1 ZINC000069070380 1129420698 /nfs/dbraw/zinc/42/06/98/1129420698.db2.gz HACRBZABMGNPOG-CYBMUJFWSA-N 1 0 331.372 3.518 20 5 EHBDRO CCC[C@H]1CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466461842 1129468185 /nfs/dbraw/zinc/46/81/85/1129468185.db2.gz ANCHQWZWTXNCCJ-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@H]1CCC[C@](CNc2ncc([N+](=O)[O-])cc2Cl)([NH+](C)C)C1 ZINC000317839097 1129475691 /nfs/dbraw/zinc/47/56/91/1129475691.db2.gz QTULVHQYBCDBLD-NHYWBVRUSA-N 1 0 326.828 3.566 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000543458652 1129501448 /nfs/dbraw/zinc/50/14/48/1129501448.db2.gz IYJTZFSDBQKRET-DYVFJYSZSA-N 1 0 334.416 3.757 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CC[C@@H](C(F)(F)F)O1 ZINC000922455790 1129537919 /nfs/dbraw/zinc/53/79/19/1129537919.db2.gz XITPHFANFXJIFN-LBXBEFBNSA-N 1 0 344.333 3.698 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2ccc3c(c2)ncn3C)cc1[N+](=O)[O-] ZINC000922482525 1129550694 /nfs/dbraw/zinc/55/06/94/1129550694.db2.gz NKEWRFYDFPMWTD-UHFFFAOYSA-N 1 0 338.411 3.895 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(Cc3csc([N+](=O)[O-])c3)C2)CC1 ZINC000154708921 1129582150 /nfs/dbraw/zinc/58/21/50/1129582150.db2.gz PHTRIJRTFXQBAV-OAHLLOKOSA-N 1 0 337.489 3.600 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000389875899 1129593693 /nfs/dbraw/zinc/59/36/93/1129593693.db2.gz UEJMUDWLKJFOQG-TWOQFEAHSA-N 1 0 339.439 3.766 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)N(C)C)c1 ZINC000154971299 1129602514 /nfs/dbraw/zinc/60/25/14/1129602514.db2.gz SXKUKTHZPGPJSM-LIRRHRJNSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccc([C@@H](C)NCc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000508975853 1129604728 /nfs/dbraw/zinc/60/47/28/1129604728.db2.gz CZZDMFSFBUJTMK-SECBINFHSA-N 1 0 340.301 3.872 20 5 EHBDRO COc1cc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000390668984 1129628769 /nfs/dbraw/zinc/62/87/69/1129628769.db2.gz XNNOQZMXLADPOI-CYBMUJFWSA-N 1 0 347.390 3.675 20 5 EHBDRO Cc1cnn(CC2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000330735045 1129644336 /nfs/dbraw/zinc/64/43/36/1129644336.db2.gz VQVWIDRIQJDMRZ-MRXNPFEDSA-N 1 0 342.443 3.881 20 5 EHBDRO CO[C@@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384165 1129674394 /nfs/dbraw/zinc/67/43/94/1129674394.db2.gz QWCRPNPRXCMMBZ-BLLLJJGKSA-N 1 0 347.440 3.718 20 5 EHBDRO COC(=O)CC[N@@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470172487 1129681165 /nfs/dbraw/zinc/68/11/65/1129681165.db2.gz XJKZBBXQBHZXSE-XNTDXEJSSA-N 1 0 334.416 3.519 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCCC[C@@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000155974952 1129683746 /nfs/dbraw/zinc/68/37/46/1129683746.db2.gz HXFMPCRKEDGZKZ-LESCRADOSA-N 1 0 328.416 3.934 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156534129 1129722999 /nfs/dbraw/zinc/72/29/99/1129722999.db2.gz YBPJBHAWOHZKHF-CJNGLKHVSA-N 1 0 332.400 3.795 20 5 EHBDRO CCC(C)(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000156875807 1129741471 /nfs/dbraw/zinc/74/14/71/1129741471.db2.gz DOELQVPQOVMRMG-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](c1cccs1)N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000096990607 1129753928 /nfs/dbraw/zinc/75/39/28/1129753928.db2.gz MQRSKXOTSPYBMP-LLVKDONJSA-N 1 0 344.396 3.899 20 5 EHBDRO C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302040817 1129765149 /nfs/dbraw/zinc/76/51/49/1129765149.db2.gz HYTJPRWNDBIZAP-NEPJUHHUSA-N 1 0 339.386 3.938 20 5 EHBDRO Cc1n[nH]cc1CCCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000302183225 1129771865 /nfs/dbraw/zinc/77/18/65/1129771865.db2.gz OMBJVGJPAXJUPD-UHFFFAOYSA-N 1 0 325.372 3.528 20 5 EHBDRO Cc1ccc([C@H](CNc2c3c(ccc2[N+](=O)[O-])NCC3)[NH+](C)C)cc1 ZINC000302882445 1129797163 /nfs/dbraw/zinc/79/71/63/1129797163.db2.gz JYTISDFPXRSFBF-SFHVURJKSA-N 1 0 340.427 3.586 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000056196708 1129806170 /nfs/dbraw/zinc/80/61/70/1129806170.db2.gz KBEJRSLEWBUAJG-MNOVXSKESA-N 1 0 349.337 3.551 20 5 EHBDRO CC[C@@H]([NH2+]CCN1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC001168742007 1129843305 /nfs/dbraw/zinc/84/33/05/1129843305.db2.gz ZABPAQWXLQVTDE-GOSISDBHSA-N 1 0 325.412 3.698 20 5 EHBDRO C[C@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475455 1129848283 /nfs/dbraw/zinc/84/82/83/1129848283.db2.gz RQXQHRXJYXVBLE-QLFBSQMISA-N 1 0 342.443 3.921 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC001168750312 1129939395 /nfs/dbraw/zinc/93/93/95/1129939395.db2.gz JTTWWACMPHLRIJ-GFCCVEGCSA-N 1 0 328.397 3.693 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@@H]21 ZINC000133725492 1129961157 /nfs/dbraw/zinc/96/11/57/1129961157.db2.gz VMMSMZOUGUFLHJ-RISCZKNCSA-N 1 0 343.349 3.534 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000245519301 1130228625 /nfs/dbraw/zinc/22/86/25/1130228625.db2.gz BEWGPCRDPQMALN-ZVZYQTTQSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2cc(F)ccc2n1C)c1cccc([N+](=O)[O-])c1 ZINC000173429272 1130230051 /nfs/dbraw/zinc/23/00/51/1130230051.db2.gz XRIMZWDXSBKVCG-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173451310 1130232692 /nfs/dbraw/zinc/23/26/92/1130232692.db2.gz NOEXCQILTHUYBJ-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2Br)cc1 ZINC000040675912 1130242598 /nfs/dbraw/zinc/24/25/98/1130242598.db2.gz BYIHYQBCDXZGLM-UHFFFAOYSA-N 1 0 335.201 3.690 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000245710536 1130297507 /nfs/dbraw/zinc/29/75/07/1130297507.db2.gz FGHSMVRJFPVCSV-SWLSCSKDSA-N 1 0 341.415 3.531 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000245870564 1130324925 /nfs/dbraw/zinc/32/49/25/1130324925.db2.gz LADHCOQOQBCUBU-MZTNWIODSA-N 1 0 346.427 3.602 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000245987157 1130335870 /nfs/dbraw/zinc/33/58/70/1130335870.db2.gz QFCLJLXJDVBIHZ-OXJNMPFZSA-N 1 0 339.439 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000736628314 1131428808 /nfs/dbraw/zinc/42/88/08/1131428808.db2.gz IWCKXCLQPKAKMK-CQSZACIVSA-N 1 0 332.350 3.938 20 5 EHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057486 1131461949 /nfs/dbraw/zinc/46/19/49/1131461949.db2.gz RJVNCKDXBOWOOH-YOEHRIQHSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NCC3C[NH+](Cc4ccccc4)C3)ccnc21 ZINC000716300966 1131547150 /nfs/dbraw/zinc/54/71/50/1131547150.db2.gz XUMDJORLYRFTMG-UHFFFAOYSA-N 1 0 348.406 3.687 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[N@@H+](C4CCCC4)CC3)sc2c1 ZINC000737420412 1131589083 /nfs/dbraw/zinc/58/90/83/1131589083.db2.gz HJOOABIIOMDDMZ-UHFFFAOYSA-N 1 0 346.456 3.659 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCOC3CCC3)o2)c([N+](=O)[O-])c1 ZINC000742386357 1131714171 /nfs/dbraw/zinc/71/41/71/1131714171.db2.gz BLCAMFVFZRYVJV-UHFFFAOYSA-N 1 0 346.383 3.522 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000742430918 1131729515 /nfs/dbraw/zinc/72/95/15/1131729515.db2.gz YQXGLFNVXOLSFG-INIZCTEOSA-N 1 0 343.402 3.692 20 5 EHBDRO CCC(C)(C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007300 1131934814 /nfs/dbraw/zinc/93/48/14/1131934814.db2.gz JSDLPUWGOAKLHB-UHFFFAOYSA-N 1 0 327.375 3.620 20 5 EHBDRO CCC[N@H+](CC)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014365 1131935440 /nfs/dbraw/zinc/93/54/40/1131935440.db2.gz PVIPNBAVKYPGLR-UHFFFAOYSA-N 1 0 327.375 3.574 20 5 EHBDRO CC(C)C[C@@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173008487 1131936175 /nfs/dbraw/zinc/93/61/75/1131936175.db2.gz ACVVPJIGEBOTNY-GFCCVEGCSA-N 1 0 341.402 3.866 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2cccc(O)c2)c1F ZINC001173175504 1131991392 /nfs/dbraw/zinc/99/13/92/1131991392.db2.gz CWLYHCJBMQBZIC-VXGBXAGGSA-N 1 0 348.374 3.730 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccccn1 ZINC001173181877 1131992477 /nfs/dbraw/zinc/99/24/77/1131992477.db2.gz FGBPOJVIOVSWAO-OCCSQVGLSA-N 1 0 347.390 3.809 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccnc1 ZINC001173187735 1131993354 /nfs/dbraw/zinc/99/33/54/1131993354.db2.gz GHQUYVQTUKQQAQ-WFASDCNBSA-N 1 0 347.390 3.809 20 5 EHBDRO Cc1cnccc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223347 1132005174 /nfs/dbraw/zinc/00/51/74/1132005174.db2.gz IDMLJGXGJJFAJA-AUUYWEPGSA-N 1 0 325.412 3.970 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173223218 1132005339 /nfs/dbraw/zinc/00/53/39/1132005339.db2.gz HCUPIZMRRLGNJW-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cnc(-c2ccc(C[NH3+])cc2)c1 ZINC001173225213 1132006000 /nfs/dbraw/zinc/00/60/00/1132006000.db2.gz IKRMYTLNKJTMOF-CQSZACIVSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2ccc(F)cc2)C1 ZINC001173227262 1132006988 /nfs/dbraw/zinc/00/69/88/1132006988.db2.gz PAWLSDDAARZWTF-IFXJQAMLSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1cccc(N(C)C)c1 ZINC001173229694 1132007552 /nfs/dbraw/zinc/00/75/52/1132007552.db2.gz PFKMCSZHRJHXSY-CABCVRRESA-N 1 0 327.428 3.943 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1CC(=O)OC(C)(C)C ZINC001173231926 1132008887 /nfs/dbraw/zinc/00/88/87/1132008887.db2.gz OXGXYWDDKSEECK-YOEHRIQHSA-N 1 0 348.443 3.722 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCc1cn(C)c2ccccc12 ZINC001173234430 1132010544 /nfs/dbraw/zinc/01/05/44/1132010544.db2.gz OQYCRCVZLDXMEN-OAHLLOKOSA-N 1 0 337.423 3.850 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCOc2ccc(-c3ccccc3)cc2)C1 ZINC001168977450 1132617398 /nfs/dbraw/zinc/61/73/98/1132617398.db2.gz JXMBIHGTYVZNSF-APWZRJJASA-N 1 0 340.423 3.767 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCC[C@@]3(CCc4c3cccc4F)C2)C1 ZINC001169051292 1132643306 /nfs/dbraw/zinc/64/33/06/1132643306.db2.gz CTWPQZDOQGJCSE-ZRGWGRIASA-N 1 0 332.419 3.551 20 5 EHBDRO Cc1cccc([C@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001169197576 1132688768 /nfs/dbraw/zinc/68/87/68/1132688768.db2.gz OOQPNRATFPIKCZ-KRWDZBQOSA-N 1 0 326.396 3.772 20 5 EHBDRO CCC1(CC)CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC001169431006 1132761720 /nfs/dbraw/zinc/76/17/20/1132761720.db2.gz PZHZJFVIIIZKTO-CQSZACIVSA-N 1 0 333.432 3.824 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccccc1 ZINC000804326445 1132766837 /nfs/dbraw/zinc/76/68/37/1132766837.db2.gz TWDOTCGRHAIZMA-SFHVURJKSA-N 1 0 328.416 3.672 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc2c(n1)[nH]cc2[N+](=O)[O-] ZINC001169683728 1132818067 /nfs/dbraw/zinc/81/80/67/1132818067.db2.gz NVZIPQFDZWZMBX-CQSZACIVSA-N 1 0 337.383 3.711 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767761321 1133049143 /nfs/dbraw/zinc/04/91/43/1133049143.db2.gz JXOLTSQMKMJXOL-MRXNPFEDSA-N 1 0 343.431 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c1 ZINC000773705255 1133095309 /nfs/dbraw/zinc/09/53/09/1133095309.db2.gz UQUJVVMDMQUHKX-KBPBESRZSA-N 1 0 338.835 3.887 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001412 1133241164 /nfs/dbraw/zinc/24/11/64/1133241164.db2.gz KODWAIVWIVCRNR-MSOLQXFVSA-N 1 0 348.443 3.821 20 5 EHBDRO CCCC[N@H+](CCOC)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000769390002 1133275508 /nfs/dbraw/zinc/27/55/08/1133275508.db2.gz TWAXVYGQPYXLNK-UHFFFAOYSA-N 1 0 345.237 3.606 20 5 EHBDRO COc1cncc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC001181878489 1133545602 /nfs/dbraw/zinc/54/56/02/1133545602.db2.gz BCJVVKRWLAEECG-INIZCTEOSA-N 1 0 341.411 3.686 20 5 EHBDRO Cc1ccncc1[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000771387331 1133551391 /nfs/dbraw/zinc/55/13/91/1133551391.db2.gz JDSZBLYFVIRDMY-OAHLLOKOSA-N 1 0 340.427 3.618 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(C)CCCCC1 ZINC001182160039 1133580643 /nfs/dbraw/zinc/58/06/43/1133580643.db2.gz DVZAOSCJGHRFSI-CQSZACIVSA-N 1 0 333.432 3.872 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C1(O)CCCC1 ZINC001182371012 1133645952 /nfs/dbraw/zinc/64/59/52/1133645952.db2.gz XWVYFOBKSFTMQK-OAHLLOKOSA-N 1 0 334.460 3.837 20 5 EHBDRO Cc1ccc([C@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000774408862 1133673623 /nfs/dbraw/zinc/67/36/23/1133673623.db2.gz JRCZJJBTCHYNBN-OALUTQOASA-N 1 0 326.396 3.678 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774518643 1133703773 /nfs/dbraw/zinc/70/37/73/1133703773.db2.gz WLRZXSHHTDXFCL-HIFRSBDPSA-N 1 0 329.375 3.981 20 5 EHBDRO CC1(C)C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C(C)(C)O1 ZINC001183980438 1133884736 /nfs/dbraw/zinc/88/47/36/1133884736.db2.gz ANMQVEWQWBCDSO-GFCCVEGCSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000746666411 1133985194 /nfs/dbraw/zinc/98/51/94/1133985194.db2.gz MQWQZKRXFNWNIV-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC001184839178 1133996492 /nfs/dbraw/zinc/99/64/92/1133996492.db2.gz DIWOTZCYRAENNB-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1CCCC[C@H]1C ZINC001184856778 1133999417 /nfs/dbraw/zinc/99/94/17/1133999417.db2.gz LQXLJTGQOXGAQO-GHMZBOCLSA-N 1 0 346.353 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC[C@H]([NH+]2CCCC2)C1 ZINC001184874888 1134001029 /nfs/dbraw/zinc/00/10/29/1134001029.db2.gz XCXGYCYZCFGVIP-NSHDSACASA-N 1 0 344.242 3.966 20 5 EHBDRO C[C@H]([NH2+]CCCCN(C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788562965 1134143304 /nfs/dbraw/zinc/14/33/04/1134143304.db2.gz MKSNGPKFGMZYRT-HNNXBMFYSA-N 1 0 342.443 3.744 20 5 EHBDRO C[C@H]([NH2+]CCCCOCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788585927 1134147964 /nfs/dbraw/zinc/14/79/64/1134147964.db2.gz XTAVBJMQZZKIQZ-HNNXBMFYSA-N 1 0 343.427 3.825 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788691437 1134157492 /nfs/dbraw/zinc/15/74/92/1134157492.db2.gz ZRELSCQYJNQGHH-LLVKDONJSA-N 1 0 347.365 3.838 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670164 1134159866 /nfs/dbraw/zinc/15/98/66/1134159866.db2.gz SQFUMQBDUUGQIR-GTNSWQLSSA-N 1 0 349.818 3.869 20 5 EHBDRO C[C@H](NC[C@@H]1CCC[N@@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804150 1134171180 /nfs/dbraw/zinc/17/11/80/1134171180.db2.gz VBTXNANVUQWXDV-YOEHRIQHSA-N 1 0 346.475 3.625 20 5 EHBDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815721 1134176053 /nfs/dbraw/zinc/17/60/53/1134176053.db2.gz DPAYQIPTXJRSAC-QFYYESIMSA-N 1 0 345.374 3.663 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2[N@H+](C)CCCC2(C)C)c([N+](=O)[O-])c1 ZINC001186368658 1134203257 /nfs/dbraw/zinc/20/32/57/1134203257.db2.gz VEIKZOBUQKEOOT-QGZVFWFLSA-N 1 0 333.432 3.720 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000789361224 1134263708 /nfs/dbraw/zinc/26/37/08/1134263708.db2.gz GBILQVVQVILIGF-RTBURBONSA-N 1 0 328.412 3.932 20 5 EHBDRO C[NH+](C)[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C12CCC2 ZINC001187025450 1134284305 /nfs/dbraw/zinc/28/43/05/1134284305.db2.gz PVGAHOHRINWYND-KBPBESRZSA-N 1 0 325.359 3.817 20 5 EHBDRO C[N@@H+]1C[C@@H]2CC[C@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC001187913800 1134395983 /nfs/dbraw/zinc/39/59/83/1134395983.db2.gz QCYXKPKVKRNJLG-NGZCFLSTSA-N 1 0 330.215 3.654 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3cc(O)ccc3C2)cc1Cl ZINC000775171094 1134474814 /nfs/dbraw/zinc/47/48/14/1134474814.db2.gz GIDLKWRQWCVXPU-AWEZNQCLSA-N 1 0 332.787 3.601 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CSCC[N@H+](C)Cc1ccccc1 ZINC001189216252 1134560003 /nfs/dbraw/zinc/56/00/03/1134560003.db2.gz YFAFXBWNMIOEAI-UHFFFAOYSA-N 1 0 346.452 3.969 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775371662 1134674982 /nfs/dbraw/zinc/67/49/82/1134674982.db2.gz OUNKCLWCLPPAAA-JKSUJKDBSA-N 1 0 326.824 3.932 20 5 EHBDRO CC[C@](C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000775389519 1134704633 /nfs/dbraw/zinc/70/46/33/1134704633.db2.gz GNOPUDKIGQKCPN-IBGZPJMESA-N 1 0 341.411 3.757 20 5 EHBDRO CCCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccc(C)o1 ZINC001190588760 1134723410 /nfs/dbraw/zinc/72/34/10/1134723410.db2.gz DUWGOTYWFCQKFE-AWEZNQCLSA-N 1 0 334.420 3.864 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cccc(C)c2C)c([N+](=O)[O-])c1 ZINC001170296697 1134737643 /nfs/dbraw/zinc/73/76/43/1134737643.db2.gz HQLVZVNMQBSPBL-CQSZACIVSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)n2ccc3ccc(C[NH3+])cc32)c([N+](=O)[O-])c1 ZINC001170296687 1134737649 /nfs/dbraw/zinc/73/76/49/1134737649.db2.gz HNKNZRCKVANSJO-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CC2(C)CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170309299 1134753319 /nfs/dbraw/zinc/75/33/19/1134753319.db2.gz PYWOMHPRLAWTRP-NSHDSACASA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3cc(F)ccc3C2)c([N+](=O)[O-])c1 ZINC001170352300 1134754422 /nfs/dbraw/zinc/75/44/22/1134754422.db2.gz LTNWDSCRFBZQNA-CYBMUJFWSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345842 1134759782 /nfs/dbraw/zinc/75/97/82/1134759782.db2.gz MXANIWHQPWSNIJ-KDOFPFPSSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3c(F)cccc3C2)c([N+](=O)[O-])c1 ZINC001170351728 1134760883 /nfs/dbraw/zinc/76/08/83/1134760883.db2.gz HIEJGDNUWRGUHS-CYBMUJFWSA-N 1 0 344.386 3.732 20 5 EHBDRO CO[C@@H]1[C@H](C)[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397971 1134764272 /nfs/dbraw/zinc/76/42/72/1134764272.db2.gz BWVPFEYDSAIGLM-CSMYWGQOSA-N 1 0 336.432 3.531 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c1 ZINC001191075712 1134788718 /nfs/dbraw/zinc/78/87/18/1134788718.db2.gz CLXJFNCSLIKQJW-IOASZLSFSA-N 1 0 332.400 3.534 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)[C@@H](C)Cc2cccs2)c1 ZINC001191465279 1134876095 /nfs/dbraw/zinc/87/60/95/1134876095.db2.gz YSDLGKBALDWXLN-LBPRGKRZSA-N 1 0 348.424 3.506 20 5 EHBDRO C[C@@H](Cc1cccs1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001191464696 1134876135 /nfs/dbraw/zinc/87/61/35/1134876135.db2.gz MVBUOYHJEBPXEB-NSHDSACASA-N 1 0 330.413 3.596 20 5 EHBDRO Cc1ccc([C@@H](CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000804386902 1135052182 /nfs/dbraw/zinc/05/21/82/1135052182.db2.gz JDVIYDRXKBWBAK-MRXNPFEDSA-N 1 0 344.371 3.526 20 5 EHBDRO COc1cc(C)c([N+](=O)[O-])cc1NC1CC(C)(C)[NH+](C)C(C)(C)C1 ZINC001170452117 1135080463 /nfs/dbraw/zinc/08/04/63/1135080463.db2.gz YMQRNXBWAWEHEK-UHFFFAOYSA-N 1 0 335.448 3.975 20 5 EHBDRO Cc1ccc(N[C@@H]2CC[N@H+](C)[C@H](C)C2)c([N+](=O)[O-])c1Br ZINC000804504168 1135093442 /nfs/dbraw/zinc/09/34/42/1135093442.db2.gz NMBHZFQLZVWSGQ-GHMZBOCLSA-N 1 0 342.237 3.560 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccc(N)cc2[N+](=O)[O-])CC1)CC(C)C ZINC000804592089 1135127965 /nfs/dbraw/zinc/12/79/65/1135127965.db2.gz WWXYKNLFJWAMBE-UHFFFAOYSA-N 1 0 348.491 3.761 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001193808054 1135187437 /nfs/dbraw/zinc/18/74/37/1135187437.db2.gz QKKIGXFNEZGWBH-AWEZNQCLSA-N 1 0 333.432 3.682 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781935 1135199737 /nfs/dbraw/zinc/19/97/37/1135199737.db2.gz LBNHQALBKBOHIH-VXGBXAGGSA-N 1 0 348.359 3.637 20 5 EHBDRO C[C@@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804814199 1135203083 /nfs/dbraw/zinc/20/30/83/1135203083.db2.gz ZYCKENUMWVHASF-YPMHNXCESA-N 1 0 343.349 3.677 20 5 EHBDRO CCC1(CC)[C@H](OC)C[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001194091444 1135231423 /nfs/dbraw/zinc/23/14/23/1135231423.db2.gz MOPADTJBXWQUQK-LSDHHAIUSA-N 1 0 326.824 3.932 20 5 EHBDRO O=C(CN1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1)c1ccccc1F ZINC001194477776 1135276342 /nfs/dbraw/zinc/27/63/42/1135276342.db2.gz QMGIVSOFHMCRFP-OAHLLOKOSA-N 1 0 342.370 3.796 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1cccs1)[NH+](C)C ZINC000807916401 1135588846 /nfs/dbraw/zinc/58/88/46/1135588846.db2.gz SAPLZVUDEXTIPQ-OAHLLOKOSA-N 1 0 333.413 3.574 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613673 1135589242 /nfs/dbraw/zinc/58/92/42/1135589242.db2.gz KVZAUSKWLRDCPT-LPUOJRKPSA-N 1 0 331.416 3.600 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1ccc(F)cc1)[NH+](C)C ZINC000807928793 1135591702 /nfs/dbraw/zinc/59/17/02/1135591702.db2.gz IIBHSIIJCNJMNW-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO C[C@@]1(C2CCCCC2)CC[N@@H+]1CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001197238025 1135663672 /nfs/dbraw/zinc/66/36/72/1135663672.db2.gz CQLCQDPPPVFUCT-SFHVURJKSA-N 1 0 331.416 3.578 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCOc1c(C)cccc1C ZINC001199571670 1135912128 /nfs/dbraw/zinc/91/21/28/1135912128.db2.gz UMTIXTUGJIDRFV-UHFFFAOYSA-N 1 0 328.412 3.997 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)c1ccco1 ZINC001199866244 1135935803 /nfs/dbraw/zinc/93/58/03/1135935803.db2.gz XAYBPSGTFMUYPP-SFHVURJKSA-N 1 0 345.443 3.977 20 5 EHBDRO CCC(CC)(CO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001201504258 1136029354 /nfs/dbraw/zinc/02/93/54/1136029354.db2.gz SNCBHCUKOKRSED-UHFFFAOYSA-N 1 0 332.400 3.743 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@@H](C3CCOCC3)C2)c1 ZINC001201822636 1136067862 /nfs/dbraw/zinc/06/78/62/1136067862.db2.gz OIVUYXQKAAWTAU-QZTJIDSGSA-N 1 0 332.444 3.712 20 5 EHBDRO CO[C@H]1C[C@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483478 1136092128 /nfs/dbraw/zinc/09/21/28/1136092128.db2.gz JYKADJLSOLKYEW-RYUDHWBXSA-N 1 0 333.215 3.805 20 5 EHBDRO CC[C@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000811474159 1136095832 /nfs/dbraw/zinc/09/58/32/1136095832.db2.gz VUOGYMVOCWTTCX-CYBMUJFWSA-N 1 0 346.258 3.866 20 5 EHBDRO C[C@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000811474813 1136096371 /nfs/dbraw/zinc/09/63/71/1136096371.db2.gz BVUZLGBVOKIRRS-LLVKDONJSA-N 1 0 346.258 3.866 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506561 1136101581 /nfs/dbraw/zinc/10/15/81/1136101581.db2.gz AEACYQKTXFQHAQ-NSHDSACASA-N 1 0 346.258 3.722 20 5 EHBDRO CSC1(CNc2cc(C)c([N+](=O)[O-])cc2Cl)CC[NH+](C)CC1 ZINC000811854296 1136147408 /nfs/dbraw/zinc/14/74/08/1136147408.db2.gz VPFJRGWZMZFWEX-UHFFFAOYSA-N 1 0 343.880 3.796 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2COc2ccccc2)cc1F ZINC001170648564 1136153846 /nfs/dbraw/zinc/15/38/46/1136153846.db2.gz ANWHZLKKWIAKLP-HNNXBMFYSA-N 1 0 330.359 3.777 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3COC4(CCC4)C3)o2)c1 ZINC000850367820 1136242294 /nfs/dbraw/zinc/24/22/94/1136242294.db2.gz QDMVYNGUCXGHON-CQSZACIVSA-N 1 0 328.368 3.656 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3COC4(CCC4)C3)o2)c1 ZINC000850367818 1136242416 /nfs/dbraw/zinc/24/24/16/1136242416.db2.gz QDMVYNGUCXGHON-AWEZNQCLSA-N 1 0 328.368 3.656 20 5 EHBDRO Cn1ncc(C2CCC2)c1CNCc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850391159 1136247582 /nfs/dbraw/zinc/24/75/82/1136247582.db2.gz GNTNAKDUIICVSF-UHFFFAOYSA-N 1 0 334.807 3.539 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812847472 1136259499 /nfs/dbraw/zinc/25/94/99/1136259499.db2.gz DDMSFPDZTCEGED-AUUYWEPGSA-N 1 0 344.411 3.547 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812853108 1136262904 /nfs/dbraw/zinc/26/29/04/1136262904.db2.gz AOSLJJQSAGCMBL-BEFAXECRSA-N 1 0 328.412 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCC[C@@H]4C[C@@H]43)CC2)cc1 ZINC000850532998 1136280655 /nfs/dbraw/zinc/28/06/55/1136280655.db2.gz ZKWODDKAYCHRTM-VCBZYWHSSA-N 1 0 329.444 3.589 20 5 EHBDRO CC(C)[C@@H](O)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553738 1136284346 /nfs/dbraw/zinc/28/43/46/1136284346.db2.gz CACWDPNOHAMSAL-FASAQXTFSA-N 1 0 343.427 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)c(F)c1 ZINC000747840760 1136307119 /nfs/dbraw/zinc/30/71/19/1136307119.db2.gz SRKSQGUKILHNLQ-OALUTQOASA-N 1 0 344.386 3.822 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@H](c4ccccc4)C3)c2c1 ZINC000814226333 1136425772 /nfs/dbraw/zinc/42/57/72/1136425772.db2.gz VIQITTZAYISYIL-KRWDZBQOSA-N 1 0 336.395 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583104 1136441601 /nfs/dbraw/zinc/44/16/01/1136441601.db2.gz WJNYXEAIAMOZGM-QAPCUYQASA-N 1 0 346.814 3.771 20 5 EHBDRO Cc1ccc(C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1C ZINC000776584685 1136442319 /nfs/dbraw/zinc/44/23/19/1136442319.db2.gz ORUNKPLGJWDNEY-HXUWFJFHSA-N 1 0 340.423 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000776578112 1136443369 /nfs/dbraw/zinc/44/33/69/1136443369.db2.gz DLDWMERNLVLFJB-SFHVURJKSA-N 1 0 330.384 3.666 20 5 EHBDRO CCC[N@@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580680 1136444915 /nfs/dbraw/zinc/44/49/15/1136444915.db2.gz YXEQQHWIAUNLAR-GOSISDBHSA-N 1 0 332.375 3.680 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccc(F)c1 ZINC000776591053 1136451164 /nfs/dbraw/zinc/45/11/64/1136451164.db2.gz GIIUWOLGLOPWRV-VMDGZTHMSA-N 1 0 344.386 3.850 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591984 1136453064 /nfs/dbraw/zinc/45/30/64/1136453064.db2.gz NPISFMFRSPXBHL-ZMYBRWDISA-N 1 0 326.396 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000776593706 1136454423 /nfs/dbraw/zinc/45/44/23/1136454423.db2.gz WPQSEXMAZMXUNJ-MOPGFXCFSA-N 1 0 344.386 3.898 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]([C@@H]2CCC[NH2+]C2)C1 ZINC000853016247 1136498483 /nfs/dbraw/zinc/49/84/83/1136498483.db2.gz UURTZDKTQLZAQS-ZIAGYGMSSA-N 1 0 339.386 3.748 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1ccsc1 ZINC000338958004 1136587288 /nfs/dbraw/zinc/58/72/88/1136587288.db2.gz NONXQHVAHVHYAQ-UHFFFAOYSA-N 1 0 342.424 3.721 20 5 EHBDRO CC(C)OCc1ccccc1C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815566137 1136611775 /nfs/dbraw/zinc/61/17/75/1136611775.db2.gz JRVHDKWZJLNKDI-CQSZACIVSA-N 1 0 343.427 3.953 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3ccc(Cl)o3)CC2)cc1 ZINC000776745854 1136622982 /nfs/dbraw/zinc/62/29/82/1136622982.db2.gz NLSYJEFLPDEIEX-UHFFFAOYSA-N 1 0 335.791 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCCc2ccc(Cl)cc2)cc1 ZINC000818991229 1136897930 /nfs/dbraw/zinc/89/79/30/1136897930.db2.gz ZYWGAWFVXUKODL-KRWDZBQOSA-N 1 0 334.803 3.504 20 5 EHBDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819079429 1136911900 /nfs/dbraw/zinc/91/19/00/1136911900.db2.gz ACCGJGDJUBLPNO-SJLPKXTDSA-N 1 0 348.830 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCCCCc2ccc(F)cc2)cc1 ZINC000819244285 1136924068 /nfs/dbraw/zinc/92/40/68/1136924068.db2.gz MIVFWODTUYYVMU-IBGZPJMESA-N 1 0 346.402 3.770 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Oc3ccc(C4CC4)cn3)C2)cc1 ZINC000858014452 1136931685 /nfs/dbraw/zinc/93/16/85/1136931685.db2.gz LKFVOUMUNOEPGK-SFHVURJKSA-N 1 0 339.395 3.521 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000819314504 1136934683 /nfs/dbraw/zinc/93/46/83/1136934683.db2.gz DJEOPHMBJKCWQK-RBUKOAKNSA-N 1 0 326.396 3.604 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000859830158 1137033289 /nfs/dbraw/zinc/03/32/89/1137033289.db2.gz NECOVKJHNUFIMG-LOKDSWTASA-N 1 0 333.215 3.803 20 5 EHBDRO CC[NH2+]Cc1cccc(Nc2cc(C(=O)OCC)cc([N+](=O)[O-])c2)c1 ZINC001159956862 1137040355 /nfs/dbraw/zinc/04/03/55/1137040355.db2.gz UFUZXNIEBICNST-UHFFFAOYSA-N 1 0 343.383 3.625 20 5 EHBDRO O=[N+]([O-])c1cccc(OCCN2CCc3cccc(Cl)c3C2)c1 ZINC001171008100 1137088905 /nfs/dbraw/zinc/08/89/05/1137088905.db2.gz QMIJGUWOMYLDLE-UHFFFAOYSA-N 1 0 332.787 3.685 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(-n2c3ccccc3c3c2C[C@@H]([NH3+])CC3)c1F ZINC001171097884 1137194584 /nfs/dbraw/zinc/19/45/84/1137194584.db2.gz DTPYWJWRLMFAJK-LBPRGKRZSA-N 1 0 339.370 3.802 20 5 EHBDRO Cc1c(CN2C[C@H]3CCC[N@@H+]3Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000864005478 1137211260 /nfs/dbraw/zinc/21/12/60/1137211260.db2.gz YEDZRNRXCBIXPA-GOSISDBHSA-N 1 0 337.423 3.888 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794703080 1137236193 /nfs/dbraw/zinc/23/61/93/1137236193.db2.gz HUULDCARRMMYHY-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCSCCC(F)(F)F)c(F)c1 ZINC000865788385 1137311940 /nfs/dbraw/zinc/31/19/40/1137311940.db2.gz PCZAFWFEOYWEIJ-UHFFFAOYSA-N 1 0 326.315 3.509 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866326046 1137345683 /nfs/dbraw/zinc/34/56/83/1137345683.db2.gz HUHNBDGDSVHVMI-IAOVAPTHSA-N 1 0 338.423 3.848 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000866389979 1137351094 /nfs/dbraw/zinc/35/10/94/1137351094.db2.gz JWYHTPMCZFBKIY-DIFFPNOSSA-N 1 0 330.359 3.648 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H]1CC2(CO1)CCOCC2)c1cccc([N+](=O)[O-])c1 ZINC000866532239 1137362048 /nfs/dbraw/zinc/36/20/48/1137362048.db2.gz VNLDBMDUIJSDIJ-MSOLQXFVSA-N 1 0 348.443 3.611 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1cc(C)c([N+](=O)[O-])cn1)c1ccsc1 ZINC000348179970 1137451353 /nfs/dbraw/zinc/45/13/53/1137451353.db2.gz NLCBYOXHZIAYEA-HNNXBMFYSA-N 1 0 334.445 3.855 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[C@@H](C[NH+]3CCCCC3)C2)ccc1Cl ZINC000122700193 1137461220 /nfs/dbraw/zinc/46/12/20/1137461220.db2.gz RWFCCALFRUVOIP-HNNXBMFYSA-N 1 0 337.851 3.556 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@]1(O)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000773097630 1137465532 /nfs/dbraw/zinc/46/55/32/1137465532.db2.gz HELPCCXZLHODQT-UXHICEINSA-N 1 0 340.423 3.860 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccccc2OC1 ZINC000511021225 1137471372 /nfs/dbraw/zinc/47/13/72/1137471372.db2.gz ZDYNKNUJWPPMKH-QAPCUYQASA-N 1 0 340.423 3.899 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001649160324 1137479567 /nfs/dbraw/zinc/47/95/67/1137479567.db2.gz XEZRRVDWFPADKS-KRWDZBQOSA-N 1 0 348.406 3.829 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCCC[C@@H]2C2CCC2)c([N+](=O)[O-])c1 ZINC001171752312 1137508484 /nfs/dbraw/zinc/50/84/84/1137508484.db2.gz RPNQPBZMXFDXFL-MRXNPFEDSA-N 1 0 334.416 3.637 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H]2CCCC23CCCCC3)c1 ZINC001171930481 1137521537 /nfs/dbraw/zinc/52/15/37/1137521537.db2.gz GLBOWQAHZGUEPK-KRWDZBQOSA-N 1 0 346.427 3.974 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1ccco1)N(C)C ZINC000872018794 1137564852 /nfs/dbraw/zinc/56/48/52/1137564852.db2.gz PPHUCPMLPOTHPX-SWLSCSKDSA-N 1 0 349.456 3.863 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCCc2c1cnn2C ZINC000872021230 1137565166 /nfs/dbraw/zinc/56/51/66/1137565166.db2.gz OQRMTYYFUGJCPI-ABAIWWIYSA-N 1 0 346.456 3.778 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1nc(C)cs1 ZINC000872021186 1137565179 /nfs/dbraw/zinc/56/51/79/1137565179.db2.gz OEXIWGNSANVGEK-NSHDSACASA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1ccc(F)cc1 ZINC000872033258 1137566616 /nfs/dbraw/zinc/56/66/16/1137566616.db2.gz CAQLAQNRBJFWHW-WVQJBOLRSA-N 1 0 336.338 3.646 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCOC1 ZINC000872065717 1137569357 /nfs/dbraw/zinc/56/93/57/1137569357.db2.gz AIQIVWMAACTFSS-SWLSCSKDSA-N 1 0 346.349 3.908 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCC(F)(F)[C@H]1O ZINC000872080355 1137570165 /nfs/dbraw/zinc/57/01/65/1137570165.db2.gz PVTNVBWNTJZXOM-BHYNMZESSA-N 1 0 346.399 3.516 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1cccc(F)c1)c1ccccc1[N+](=O)[O-] ZINC000872129597 1137573098 /nfs/dbraw/zinc/57/30/98/1137573098.db2.gz REMXLQIKFZEWMM-QWHCGFSZSA-N 1 0 345.374 3.802 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2cc(F)cc(Cl)c2)cccc1[N+](=O)[O-] ZINC000873116214 1137590519 /nfs/dbraw/zinc/59/05/19/1137590519.db2.gz YINXKXNGZLCSGF-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(F)ccc1F ZINC000877054821 1137668835 /nfs/dbraw/zinc/66/88/35/1137668835.db2.gz LHMLOTIPWKXUCZ-PPUFBPAQSA-N 1 0 336.342 3.514 20 5 EHBDRO CSC(C)(C)C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000877064619 1137669184 /nfs/dbraw/zinc/66/91/84/1137669184.db2.gz CDUMEOJLGVTCDV-UHFFFAOYSA-N 1 0 339.280 3.650 20 5 EHBDRO CSc1ccc([C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877497175 1137678601 /nfs/dbraw/zinc/67/86/01/1137678601.db2.gz INQSHMVSGATRII-XGNXJENSSA-N 1 0 332.429 3.568 20 5 EHBDRO C[C@@]1(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@]1(F)Cl ZINC000877610955 1137682789 /nfs/dbraw/zinc/68/27/89/1137682789.db2.gz MRZOESBOUUGAMA-ZIAGYGMSSA-N 1 0 327.743 3.530 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 ZINC000126717562 1137689106 /nfs/dbraw/zinc/68/91/06/1137689106.db2.gz QFRRFGZFIZSMRV-BXKDBHETSA-N 1 0 326.805 3.694 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877795372 1137690345 /nfs/dbraw/zinc/69/03/45/1137690345.db2.gz IDRBXWDDQHAWNN-ZDUSSCGKSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCCOCC3CC3)cs2)c1 ZINC000113315456 1137912532 /nfs/dbraw/zinc/91/25/32/1137912532.db2.gz DRUSLYXLUDORDG-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)nc1 ZINC001202682827 1137925748 /nfs/dbraw/zinc/92/57/48/1137925748.db2.gz GFWQKRUJAZOJFM-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000332034160 1137929411 /nfs/dbraw/zinc/92/94/11/1137929411.db2.gz ZVOFYHWMPOOBNR-UUKVCBHOSA-N 1 0 332.444 3.917 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000332487283 1137945290 /nfs/dbraw/zinc/94/52/90/1137945290.db2.gz YIGSWDHPALKSFE-GFCCVEGCSA-N 1 0 334.807 3.843 20 5 EHBDRO COc1ccccc1[C@H]1CCC[N@H+](Cc2cccnc2[N+](=O)[O-])CC1 ZINC000886310344 1138066233 /nfs/dbraw/zinc/06/62/33/1138066233.db2.gz JWXBOGMCQZVIHG-HNNXBMFYSA-N 1 0 341.411 3.768 20 5 EHBDRO C[C@]1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886344753 1138069404 /nfs/dbraw/zinc/06/94/04/1138069404.db2.gz KXQANSUCGAFSQQ-GINYUPMKSA-N 1 0 330.428 3.937 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)[C@@H]3C)O2)cccc1[N+](=O)[O-] ZINC000886772359 1138137467 /nfs/dbraw/zinc/13/74/67/1138137467.db2.gz XGUVRZFXZGMNAX-KSPMYQCISA-N 1 0 348.443 3.526 20 5 EHBDRO CCC[C@@H](CCO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000080524346 1138163148 /nfs/dbraw/zinc/16/31/48/1138163148.db2.gz UADUISCVNFAMLS-ZDUSSCGKSA-N 1 0 349.456 3.607 20 5 EHBDRO O=C(CC[NH2+][C@H](c1cccs1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000336967961 1138437415 /nfs/dbraw/zinc/43/74/15/1138437415.db2.gz AGEVQRFKNFNFSZ-KRWDZBQOSA-N 1 0 345.424 3.726 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000131391835 1138514771 /nfs/dbraw/zinc/51/47/71/1138514771.db2.gz YGNNDRSILASFPD-ZDUSSCGKSA-N 1 0 327.384 3.629 20 5 EHBDRO COc1cc(C[NH2+]CC2CCC(F)(F)CC2)c([N+](=O)[O-])cc1OC ZINC000337285998 1138520351 /nfs/dbraw/zinc/52/03/51/1138520351.db2.gz KHDMWSYFRMTXLH-UHFFFAOYSA-N 1 0 344.358 3.527 20 5 EHBDRO C[C@H](O)C1CC[NH+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000264733575 1138620884 /nfs/dbraw/zinc/62/08/84/1138620884.db2.gz QHLYZUCTZANMBH-AWEZNQCLSA-N 1 0 337.419 3.539 20 5 EHBDRO COc1cc(C[NH2+]Cc2csc3ccccc23)c([N+](=O)[O-])cc1O ZINC000337879573 1138689366 /nfs/dbraw/zinc/68/93/66/1138689366.db2.gz SWTOONMSDWJCSO-UHFFFAOYSA-N 1 0 344.392 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](Cc2ccccn2)c2cccnc2)cc1 ZINC000338203903 1138786544 /nfs/dbraw/zinc/78/65/44/1138786544.db2.gz QMRLGTDPLZFBLJ-HXUWFJFHSA-N 1 0 348.406 3.501 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000152521598 1139096523 /nfs/dbraw/zinc/09/65/23/1139096523.db2.gz RMDDDLCJDYHJDD-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO CC(C)(CO)CCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174426002 1139419159 /nfs/dbraw/zinc/41/91/59/1139419159.db2.gz BWXAOOVOPKAAPZ-UHFFFAOYSA-N 1 0 349.456 3.607 20 5 EHBDRO Cc1ccc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)cc1[N+](=O)[O-] ZINC000174645683 1139432769 /nfs/dbraw/zinc/43/27/69/1139432769.db2.gz YXMDBFNBVXOVDN-UHFFFAOYSA-N 1 0 344.386 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2C[C@H](O)c2cccs2)cc1 ZINC000175851023 1139522925 /nfs/dbraw/zinc/52/29/25/1139522925.db2.gz MMMWFNBRIUKGCB-SJORKVTESA-N 1 0 346.452 3.787 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000175987920 1139533056 /nfs/dbraw/zinc/53/30/56/1139533056.db2.gz JCRKOZXPYICMRC-UHFFFAOYSA-N 1 0 336.338 3.907 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)s1 ZINC000181842256 1139935702 /nfs/dbraw/zinc/93/57/02/1139935702.db2.gz WTQNUIARCLMNRJ-LLVKDONJSA-N 1 0 348.424 3.911 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189953029 1140373857 /nfs/dbraw/zinc/37/38/57/1140373857.db2.gz YNZHTKOVVKBFOO-HNNXBMFYSA-N 1 0 347.459 3.522 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000192891045 1140553893 /nfs/dbraw/zinc/55/38/93/1140553893.db2.gz GUWNVZMLPILSBB-IAGOWNOFSA-N 1 0 332.425 3.531 20 5 EHBDRO CC(C)(O)c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193305005 1140571232 /nfs/dbraw/zinc/57/12/32/1140571232.db2.gz WNZSBCHJPYRMKR-IBGZPJMESA-N 1 0 340.423 3.989 20 5 EHBDRO COc1cccc(N2CC[C@H]([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000267453772 1140793061 /nfs/dbraw/zinc/79/30/61/1140793061.db2.gz SFJVIVCRBJBIJM-HOCLYGCPSA-N 1 0 341.411 3.533 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccccc1OCCOC)c1cccc([N+](=O)[O-])c1 ZINC000268846098 1141006835 /nfs/dbraw/zinc/00/68/35/1141006835.db2.gz OOCVEAWURFFMAP-GOSISDBHSA-N 1 0 344.411 3.861 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000269038369 1141052237 /nfs/dbraw/zinc/05/22/37/1141052237.db2.gz SVCCKDVZLWGODC-CZUORRHYSA-N 1 0 341.411 3.684 20 5 EHBDRO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@H]1CCC[NH2+]C1 ZINC000269217104 1141080546 /nfs/dbraw/zinc/08/05/46/1141080546.db2.gz RADOEEXMFMZLDS-ZBFHGGJFSA-N 1 0 333.435 3.506 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672660 1141133783 /nfs/dbraw/zinc/13/37/83/1141133783.db2.gz RKPNDQBAFOYLGJ-IIDMSEBBSA-N 1 0 329.444 3.605 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCn1ccnc1C ZINC000271123912 1141310786 /nfs/dbraw/zinc/31/07/86/1141310786.db2.gz KBOULLAXMXXTKZ-OAHLLOKOSA-N 1 0 348.472 3.650 20 5 EHBDRO C[C@H]1C[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258090 1141334962 /nfs/dbraw/zinc/33/49/62/1141334962.db2.gz ACNPFXXMGUQUQT-QWHCGFSZSA-N 1 0 347.440 3.623 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCOC2(CCC2)C1 ZINC000271508830 1141383706 /nfs/dbraw/zinc/38/37/06/1141383706.db2.gz NLKOLUBNTNPXFC-CGTJXYLNSA-N 1 0 344.455 3.997 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000271508837 1141383753 /nfs/dbraw/zinc/38/37/53/1141383753.db2.gz NLKOLUBNTNPXFC-RYQLBKOJSA-N 1 0 344.455 3.997 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000271570748 1141399406 /nfs/dbraw/zinc/39/94/06/1141399406.db2.gz PPVIKYURCIGDQZ-AOIWGVFYSA-N 1 0 332.444 3.709 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCc2cnc(C3CC3)nc2)cc1[N+](=O)[O-] ZINC000339503156 1014599517 /nfs/dbraw/zinc/59/95/17/1014599517.db2.gz BYFSMQLMULKZLN-UHFFFAOYSA-N 1 0 340.427 3.718 20 5 EHBDRO CSC[C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000430189062 1014697358 /nfs/dbraw/zinc/69/73/58/1014697358.db2.gz CTHXVZABDBZQIX-NSHDSACASA-N 1 0 346.399 3.771 20 5 EHBDRO C[C@H](Cn1cccn1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000608836350 1014703933 /nfs/dbraw/zinc/70/39/33/1014703933.db2.gz NNKGVQGPAFWUBP-CYBMUJFWSA-N 1 0 342.424 3.698 20 5 EHBDRO COc1ccc(COCC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000091741005 1015640526 /nfs/dbraw/zinc/64/05/26/1015640526.db2.gz MUJOEPCSLYGEIR-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO CC[C@@H](C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680282 1032122947 /nfs/dbraw/zinc/12/29/47/1032122947.db2.gz LMBDJUNXJWBDFN-DOTOQJQBSA-N 1 0 340.427 3.670 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)o1 ZINC000609598531 1015789629 /nfs/dbraw/zinc/78/96/29/1015789629.db2.gz WOZZIDIQYKZBLE-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO CCOc1cc(NC[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471250935 1016130176 /nfs/dbraw/zinc/13/01/76/1016130176.db2.gz PGEYHLMWIPUGHN-KRWDZBQOSA-N 1 0 329.400 3.708 20 5 EHBDRO C[NH2+]Cc1cn(-c2cc([N+](=O)[O-])cc(Cl)n2)c2ccc(C)cc12 ZINC001167121308 1016165388 /nfs/dbraw/zinc/16/53/88/1016165388.db2.gz JHIPBAFVOBUTDU-UHFFFAOYSA-N 1 0 330.775 3.615 20 5 EHBDRO C[NH2+]Cc1cn(-c2ncnc3ccc([N+](=O)[O-])cc32)c2ccc(C)cc12 ZINC001167123630 1016188017 /nfs/dbraw/zinc/18/80/17/1016188017.db2.gz NCNYTLBKKUTYTG-UHFFFAOYSA-N 1 0 347.378 3.510 20 5 EHBDRO CC(C)(O)C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000189941848 1016782985 /nfs/dbraw/zinc/78/29/85/1016782985.db2.gz QPMGDMZRKJCTFV-UHFFFAOYSA-N 1 0 330.384 3.590 20 5 EHBDRO CC(C)[C@@H]1[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527944 1016954169 /nfs/dbraw/zinc/95/41/69/1016954169.db2.gz NJYBVTZHILJHEM-YEODSOHDSA-N 1 0 330.428 3.745 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1c(C)nn(C)c1C ZINC000449167686 1032260365 /nfs/dbraw/zinc/26/03/65/1032260365.db2.gz BEGDDTHLJIIORT-LRDDRELGSA-N 1 0 330.432 3.617 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@@H]2CC=C(c3ccc(Cl)cc3)CC2)c1 ZINC000449191527 1032285683 /nfs/dbraw/zinc/28/56/83/1032285683.db2.gz KJJMSHAOGXBERW-MRXNPFEDSA-N 1 0 346.818 3.670 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593517 1032314869 /nfs/dbraw/zinc/31/48/69/1032314869.db2.gz VOYBOPWMXNVOAE-ACJLOTCBSA-N 1 0 334.416 3.710 20 5 EHBDRO CC(C)[C@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000449223158 1032339794 /nfs/dbraw/zinc/33/97/94/1032339794.db2.gz JJFCNZVLJXUWHV-LRDDRELGSA-N 1 0 344.415 3.773 20 5 EHBDRO CC[N@H+](C[C@@H]1COc2ccccc2O1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189007 1032368403 /nfs/dbraw/zinc/36/84/03/1032368403.db2.gz FKGWQLJOKCEKOP-LSDHHAIUSA-N 1 0 342.395 3.818 20 5 EHBDRO Cc1cc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000449270987 1032391202 /nfs/dbraw/zinc/39/12/02/1032391202.db2.gz DVBPCKRKQDXUKV-HNNXBMFYSA-N 1 0 328.412 3.681 20 5 EHBDRO C[C@@H](Cc1ccoc1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000449287128 1032406385 /nfs/dbraw/zinc/40/63/85/1032406385.db2.gz JORHFYCYCNLDJC-JTQLQIEISA-N 1 0 328.290 3.927 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)OCCc2sccc21 ZINC000449337004 1032474493 /nfs/dbraw/zinc/47/44/93/1032474493.db2.gz OXJRHSNZMJOWGV-FZKQIMNGSA-N 1 0 346.452 3.665 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000090078925 1032570393 /nfs/dbraw/zinc/57/03/93/1032570393.db2.gz ZNZWKGDZISYYFF-JKSUJKDBSA-N 1 0 336.338 3.647 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](CO)c1ccccc1 ZINC000449460828 1032577205 /nfs/dbraw/zinc/57/72/05/1032577205.db2.gz ZYNGXDJNWKVRJB-HVEPWOEZSA-N 1 0 326.396 3.664 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656210 1017108209 /nfs/dbraw/zinc/10/82/09/1017108209.db2.gz HZWKOUGIYNJYFY-ZFWWWQNUSA-N 1 0 345.468 3.883 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@@H](CCC[NH3+])c1ccccc1 ZINC000414667948 1017117974 /nfs/dbraw/zinc/11/79/74/1017117974.db2.gz YEFOXUNLDUGHIO-INIZCTEOSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH2+]C2(c3nccs3)CCCC2)cc1 ZINC000177167792 1017593955 /nfs/dbraw/zinc/59/39/55/1017593955.db2.gz WQDXIPGINFVBIK-UHFFFAOYSA-N 1 0 347.440 3.879 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2cccnc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000610281278 1017608055 /nfs/dbraw/zinc/60/80/55/1017608055.db2.gz AHSLAZZDVOFQIO-IUODEOHRSA-N 1 0 332.429 3.546 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000177481573 1017679265 /nfs/dbraw/zinc/67/92/65/1017679265.db2.gz OKSOUZHUSCNGTL-ZNMIVQPWSA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316595 1018160129 /nfs/dbraw/zinc/16/01/29/1018160129.db2.gz CQFSGVYEVSFNEH-RHSMWYFYSA-N 1 0 343.427 3.627 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000377837605 1018453984 /nfs/dbraw/zinc/45/39/84/1018453984.db2.gz PADPXEUYJWROBJ-INIZCTEOSA-N 1 0 342.443 3.890 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)Nc1cccc(Cl)c1 ZINC000015548915 1018756990 /nfs/dbraw/zinc/75/69/90/1018756990.db2.gz ZFEATQULNHRVDI-LBPRGKRZSA-N 1 0 347.802 3.880 20 5 EHBDRO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cn1 ZINC000398004828 1018950641 /nfs/dbraw/zinc/95/06/41/1018950641.db2.gz AMIFQUGJTKUNFV-QGZVFWFLSA-N 1 0 328.416 3.558 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610420390 1019008810 /nfs/dbraw/zinc/00/88/10/1019008810.db2.gz FMJCYKJSXTZWAZ-HZPDHXFCSA-N 1 0 325.412 3.772 20 5 EHBDRO COc1cc(C)ccc1[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000536861833 1019374034 /nfs/dbraw/zinc/37/40/34/1019374034.db2.gz DSCGGCMCAZBWOA-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000473525749 1019384195 /nfs/dbraw/zinc/38/41/95/1019384195.db2.gz ZTAAAIXVJSGBIA-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1c(C[N@@H+]2CCCN(c3ccccc3F)CC2)cccc1[N+](=O)[O-] ZINC000513368520 1019589126 /nfs/dbraw/zinc/58/91/26/1019589126.db2.gz WJESYXOHHLOTIR-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N(CC(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000537175596 1019639449 /nfs/dbraw/zinc/63/94/49/1019639449.db2.gz RKNUOAYACXKCLH-MRXNPFEDSA-N 1 0 349.475 3.694 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1cccc(C(=O)NC)c1)c1cccc([N+](=O)[O-])c1 ZINC000155879962 1020121712 /nfs/dbraw/zinc/12/17/12/1020121712.db2.gz FWOUGINPQJCPBO-GOSISDBHSA-N 1 0 341.411 3.585 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc3nccnc3c2)C2CC2)c1 ZINC000602441201 1032888943 /nfs/dbraw/zinc/88/89/43/1032888943.db2.gz VYHMPLBORWGZGU-UHFFFAOYSA-N 1 0 334.379 3.703 20 5 EHBDRO Cc1cc(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)cc([N+](=O)[O-])c1 ZINC000345884616 1020575092 /nfs/dbraw/zinc/57/50/92/1020575092.db2.gz LPZVYRKNRJCUGG-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N3CCC([NH+]4CCCCC4)CC3)c2c1 ZINC000413075835 1020649706 /nfs/dbraw/zinc/64/97/06/1020649706.db2.gz LEACSGZVTGTWOB-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCN(c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000426289914 1021196705 /nfs/dbraw/zinc/19/67/05/1021196705.db2.gz NSCVCXLRLBNMJK-GJZGRUSLSA-N 1 0 343.402 3.972 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000439255051 1021300930 /nfs/dbraw/zinc/30/09/30/1021300930.db2.gz FSBDQVXNNDQMTN-LJQANCHMSA-N 1 0 328.412 3.758 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H]1CCN2C(=O)c1ccc2cc3ccccc3cc2c1 ZINC001270139439 1021365202 /nfs/dbraw/zinc/36/52/02/1021365202.db2.gz ACDHOFHILPMGQL-SFTDATJTSA-N 1 0 330.431 3.912 20 5 EHBDRO COc1cc(C[N@H+](C)CCCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000439478874 1021471581 /nfs/dbraw/zinc/47/15/81/1021471581.db2.gz PADBZKCQPWUSLI-UHFFFAOYSA-N 1 0 344.411 3.642 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@@H]1CCCCO1 ZINC000602595505 1032990919 /nfs/dbraw/zinc/99/09/19/1032990919.db2.gz BNGQLVXSZUFKOS-ZDUSSCGKSA-N 1 0 332.322 3.662 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@]12C[C@H]1COC21CCC1 ZINC000933384966 1021590619 /nfs/dbraw/zinc/59/06/19/1021590619.db2.gz FDOGBAGDCGBRHL-ZUZCIYMTSA-N 1 0 343.210 3.703 20 5 EHBDRO COc1cc(C[N@@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670755 1021640231 /nfs/dbraw/zinc/64/02/31/1021640231.db2.gz RHBUNVPQVBMEIP-KBPBESRZSA-N 1 0 334.416 3.623 20 5 EHBDRO COc1ccc(C[NH+]2CCC(n3c(C)ccc3C)CC2)cc1[N+](=O)[O-] ZINC000337682444 1021860269 /nfs/dbraw/zinc/86/02/69/1021860269.db2.gz NWDKUSHHRPSJHV-UHFFFAOYSA-N 1 0 343.427 3.859 20 5 EHBDRO Cc1ccc([C@H](CNc2ncccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000141071334 1033011952 /nfs/dbraw/zinc/01/19/52/1033011952.db2.gz XQEOJCIXURNGFB-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516937609 1021872996 /nfs/dbraw/zinc/87/29/96/1021872996.db2.gz LUAWFUIYGPBPEM-BBRMVZONSA-N 1 0 342.395 3.648 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCC[C@H]3CCOC3)cs2)c1 ZINC000449682493 1033033571 /nfs/dbraw/zinc/03/35/71/1033033571.db2.gz LPQFJPQQOBXAGE-ZDUSSCGKSA-N 1 0 347.440 3.625 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000441376166 1022197268 /nfs/dbraw/zinc/19/72/68/1022197268.db2.gz CRXZIMFDZPHRPW-CGZBRXJRSA-N 1 0 331.460 3.852 20 5 EHBDRO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[C@H]1c1cccs1 ZINC000602636094 1033047047 /nfs/dbraw/zinc/04/70/47/1033047047.db2.gz FVWOQULEGVEKOZ-WCFLWFBJSA-N 1 0 342.424 3.814 20 5 EHBDRO C[C@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968577 1022520720 /nfs/dbraw/zinc/52/07/20/1022520720.db2.gz SNCIJFJQJCVWMF-STQMWFEESA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1cnc(C2CC2)o1 ZINC000449703165 1033065681 /nfs/dbraw/zinc/06/56/81/1033065681.db2.gz FNCJFKBSKLQGER-RHSMWYFYSA-N 1 0 341.411 3.961 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)O1 ZINC000602690098 1033070959 /nfs/dbraw/zinc/07/09/59/1033070959.db2.gz LLQNFDORLKDHNZ-FOGDFJRCSA-N 1 0 332.322 3.517 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)O1 ZINC000602690097 1033071086 /nfs/dbraw/zinc/07/10/86/1033071086.db2.gz LLQNFDORLKDHNZ-CKYFFXLPSA-N 1 0 332.322 3.517 20 5 EHBDRO CC1(C2([NH2+]Cc3cc(Br)c([N+](=O)[O-])s3)CC2)CC1 ZINC000602683301 1033083274 /nfs/dbraw/zinc/08/32/74/1033083274.db2.gz VFTWMHOULWGUAH-UHFFFAOYSA-N 1 0 331.235 3.841 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449717910 1033093426 /nfs/dbraw/zinc/09/34/26/1033093426.db2.gz FIKUEQYMCJRHHQ-GDBMZVCRSA-N 1 0 334.460 3.693 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000550276372 1022954497 /nfs/dbraw/zinc/95/44/97/1022954497.db2.gz LGFUJVLFMAICLS-KAPURRDVSA-N 1 0 332.444 3.777 20 5 EHBDRO CC(C)O[C@@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602701239 1033089935 /nfs/dbraw/zinc/08/99/35/1033089935.db2.gz ISVRDYQSWYVUBY-CYBMUJFWSA-N 1 0 332.322 3.613 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccccc2OC)ccc1[N+](=O)[O-] ZINC000276854829 1023223988 /nfs/dbraw/zinc/22/39/88/1023223988.db2.gz FKPGVNHYLOUBFC-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729740 1033118158 /nfs/dbraw/zinc/11/81/58/1033118158.db2.gz CAHQMEWWSUYBLG-PKOBYXMFSA-N 1 0 326.396 3.601 20 5 EHBDRO Cc1cc(Cc2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957892 1023476040 /nfs/dbraw/zinc/47/60/40/1023476040.db2.gz RLZMSMCAIJCYDB-HZSPNIEDSA-N 1 0 344.415 3.811 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(C(=O)C(C)(C)C)CC1 ZINC000610799334 1023682316 /nfs/dbraw/zinc/68/23/16/1023682316.db2.gz SKCXLGUFSQYXJU-AWEZNQCLSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000610805598 1023702387 /nfs/dbraw/zinc/70/23/87/1023702387.db2.gz UOIVNHWUFYCZRC-HNNXBMFYSA-N 1 0 325.412 3.570 20 5 EHBDRO CCO[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000610930483 1023877300 /nfs/dbraw/zinc/87/73/00/1023877300.db2.gz SMUSNBJDDDJKOQ-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208804 1023916000 /nfs/dbraw/zinc/91/60/00/1023916000.db2.gz CVDHJCWXCLDDMP-LJQANCHMSA-N 1 0 342.395 3.819 20 5 EHBDRO C[C@H]1CCC[N@@H+](C(C)(C)CNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000342109487 1024072516 /nfs/dbraw/zinc/07/25/16/1024072516.db2.gz GTAAANSAYIBCJT-NSHDSACASA-N 1 0 349.460 3.522 20 5 EHBDRO COc1ccc(C[C@H](C)C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1F ZINC000546306677 1024106479 /nfs/dbraw/zinc/10/64/79/1024106479.db2.gz AVXKGQVRMXDTBF-ZDUSSCGKSA-N 1 0 332.375 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+](CCc2ccc(F)cc2)C2CC2)cc1 ZINC000522659412 1024162256 /nfs/dbraw/zinc/16/22/56/1024162256.db2.gz TWVLHNYBXHLXFN-UHFFFAOYSA-N 1 0 328.387 3.984 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@H](C)C[C@@H](C)C1 ZINC000443643642 1024306968 /nfs/dbraw/zinc/30/69/68/1024306968.db2.gz SEOLYIDDGLRGJV-UONOGXRCSA-N 1 0 333.432 3.600 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@@H](OCC(C)C)C2(C)C)cc1[N+](=O)[O-] ZINC000538399230 1024329510 /nfs/dbraw/zinc/32/95/10/1024329510.db2.gz ZZSMMZQNWVNZNI-DLBZAZTESA-N 1 0 336.432 3.533 20 5 EHBDRO CCOc1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000380731448 1024461330 /nfs/dbraw/zinc/46/13/30/1024461330.db2.gz INBDJGVYWVZIIW-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO CCOc1cccc(NC[C@@H](c2ccco2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000346213329 1024504737 /nfs/dbraw/zinc/50/47/37/1024504737.db2.gz WPDDHEGIDCQJSE-HNNXBMFYSA-N 1 0 345.399 3.836 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581237 1024638666 /nfs/dbraw/zinc/63/86/66/1024638666.db2.gz MNEWZKZQSMPCEW-UZGISAJGSA-N 1 0 329.425 3.944 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000895581231 1024639138 /nfs/dbraw/zinc/63/91/38/1024639138.db2.gz MNEWZKZQSMPCEW-BMQCOBNYSA-N 1 0 329.425 3.944 20 5 EHBDRO Cc1nc2ccc(C[NH2+]CCOc3ccc([N+](=O)[O-])cc3)cc2s1 ZINC000514665651 1024656828 /nfs/dbraw/zinc/65/68/28/1024656828.db2.gz VLZJPSCCXOHWPM-UHFFFAOYSA-N 1 0 343.408 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000065535761 1024660855 /nfs/dbraw/zinc/66/08/55/1024660855.db2.gz YYTAKNUEFDFEIT-SFHVURJKSA-N 1 0 330.359 3.950 20 5 EHBDRO O=[N+]([O-])c1cnc(NCc2ccc(C[NH+]3CCCC3)cc2)c(Cl)c1 ZINC000346378106 1024693875 /nfs/dbraw/zinc/69/38/75/1024693875.db2.gz XLWWHIKRRFSDPZ-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1Cc1ccccc1 ZINC000025358678 1024703412 /nfs/dbraw/zinc/70/34/12/1024703412.db2.gz AJSALENWOUKFEH-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)ccn1 ZINC000342297947 1024764569 /nfs/dbraw/zinc/76/45/69/1024764569.db2.gz KJZNWLYNGGQFOH-CYBMUJFWSA-N 1 0 329.400 3.973 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cs1 ZINC000602888064 1033237272 /nfs/dbraw/zinc/23/72/72/1033237272.db2.gz OVOJCPROQNASFJ-CQSZACIVSA-N 1 0 340.408 3.589 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cccc1[N+](=O)[O-] ZINC000602886871 1033237432 /nfs/dbraw/zinc/23/74/32/1033237432.db2.gz JPISQKBYXZBWTP-KRWDZBQOSA-N 1 0 348.406 3.836 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]([C@@H]4CCCO4)C3)o2)cc1 ZINC000895843873 1024890032 /nfs/dbraw/zinc/89/00/32/1024890032.db2.gz JESKMVLCRAJWGS-YJBOKZPZSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]([C@H]3CCCO3)C2)o1 ZINC000895843996 1024890917 /nfs/dbraw/zinc/89/09/17/1024890917.db2.gz KXBZGBSLIKLNMI-RDTXWAMCSA-N 1 0 342.395 3.856 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC2(CCO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000427976890 1024919586 /nfs/dbraw/zinc/91/95/86/1024919586.db2.gz KGOJCVWHIQXHOR-GOSISDBHSA-N 1 0 344.411 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2)C[C@H]2CCCO2)c1 ZINC000053221415 1024988389 /nfs/dbraw/zinc/98/83/89/1024988389.db2.gz HKXQARNNDUIZHN-LJQANCHMSA-N 1 0 326.396 3.776 20 5 EHBDRO CC[N@@H+]1C[C@@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000346782357 1025092939 /nfs/dbraw/zinc/09/29/39/1025092939.db2.gz YFRBDNSSSVLVKL-HZPDHXFCSA-N 1 0 347.462 3.943 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000521063259 1025193319 /nfs/dbraw/zinc/19/33/19/1025193319.db2.gz NTXOIVBDEVOQGU-CYBMUJFWSA-N 1 0 331.803 3.941 20 5 EHBDRO CSc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000281557579 1025228191 /nfs/dbraw/zinc/22/81/91/1025228191.db2.gz XYZVMMJEPKWGLS-SJKOYZFVSA-N 1 0 332.425 3.701 20 5 EHBDRO CCN1CCCC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175843 1025248035 /nfs/dbraw/zinc/24/80/35/1025248035.db2.gz YWGYTLLQRQNCTP-KRWDZBQOSA-N 1 0 343.427 3.819 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccc(N2CCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000442823365 1025501072 /nfs/dbraw/zinc/50/10/72/1025501072.db2.gz ZVRFLALWLRJAEJ-SFHVURJKSA-N 1 0 339.395 3.572 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2cccc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000563286672 1025607906 /nfs/dbraw/zinc/60/79/06/1025607906.db2.gz BTUPGHLNQPHDFC-IBGZPJMESA-N 1 0 326.396 3.563 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000026478221 1025659125 /nfs/dbraw/zinc/65/91/25/1025659125.db2.gz HEEKVOKEPUDIPW-GXTWGEPZSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)[C@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000439128815 1025789476 /nfs/dbraw/zinc/78/94/76/1025789476.db2.gz PKKNKPZHMUKKLE-BFUOFWGJSA-N 1 0 341.411 3.901 20 5 EHBDRO CCn1cnc2c1CCN(c1c(Cl)cc([N+](=O)[O-])cc1Cl)C2 ZINC000896650444 1025802739 /nfs/dbraw/zinc/80/27/39/1025802739.db2.gz HTLVEJMEBZMUHD-UHFFFAOYSA-N 1 0 341.198 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCCCCC[NH+]3CCCCC3)ccc2c1 ZINC000521960264 1025827296 /nfs/dbraw/zinc/82/72/96/1025827296.db2.gz NVGAUBFHRVLRDZ-UHFFFAOYSA-N 1 0 342.443 3.633 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H]1CCC12CCCC2 ZINC000451464269 1026011244 /nfs/dbraw/zinc/01/12/44/1026011244.db2.gz YRQKSAWIKPCUGI-INIZCTEOSA-N 1 0 331.416 3.544 20 5 EHBDRO Cc1cnn(CCCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130062134 1026255674 /nfs/dbraw/zinc/25/56/74/1026255674.db2.gz PWPVGFVREYSKSF-UHFFFAOYSA-N 1 0 342.443 3.935 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000452081438 1026480499 /nfs/dbraw/zinc/48/04/99/1026480499.db2.gz JWCIBXMJBKVDOW-HNNXBMFYSA-N 1 0 336.432 3.631 20 5 EHBDRO C[C@H](Cc1ccsc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001167582125 1026525390 /nfs/dbraw/zinc/52/53/90/1026525390.db2.gz KYTAXLXQPXEXBG-CQSZACIVSA-N 1 0 334.441 3.988 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccccc2[N+](=O)[O-])cc1Br ZINC000127873552 1026599070 /nfs/dbraw/zinc/59/90/70/1026599070.db2.gz AIYSMKYAYVLBKR-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041892 1026680365 /nfs/dbraw/zinc/68/03/65/1026680365.db2.gz SPEZHJMTPANVMC-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H]1Cn1cnc2ccccc21 ZINC000339905658 1026734065 /nfs/dbraw/zinc/73/40/65/1026734065.db2.gz ACRSNBYAROOWAZ-INIZCTEOSA-N 1 0 336.395 3.609 20 5 EHBDRO CC(C)c1ccc(CN[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200573 1027078520 /nfs/dbraw/zinc/07/85/20/1027078520.db2.gz CPVROQRQISIXSF-JKSUJKDBSA-N 1 0 333.476 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCc3ccc(O)cc3)o2)cc1 ZINC000520214168 1027181048 /nfs/dbraw/zinc/18/10/48/1027181048.db2.gz IDQHHQSTRQWSGJ-UHFFFAOYSA-N 1 0 338.363 3.893 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c(OC)c1 ZINC000531694207 1027247097 /nfs/dbraw/zinc/24/70/97/1027247097.db2.gz HYNXVULVADASAR-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1csc(C2([NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CCC2)n1 ZINC000453173636 1027495200 /nfs/dbraw/zinc/49/52/00/1027495200.db2.gz KVCOSQPUOCCVFA-LBPRGKRZSA-N 1 0 331.441 3.960 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)N(C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000178681922 1027871085 /nfs/dbraw/zinc/87/10/85/1027871085.db2.gz DMZTVNLMJGKQPM-CABCVRRESA-N 1 0 335.448 3.588 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@H](C4CCCC4)C3)n2)c1 ZINC000420960211 1027928275 /nfs/dbraw/zinc/92/82/75/1027928275.db2.gz GLPDDEAHNBPUQK-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCC[C@H]2c2ccccc2)c1 ZINC000277930375 1027968753 /nfs/dbraw/zinc/96/87/53/1027968753.db2.gz YPYZXVINCDPESJ-OTWHNJEPSA-N 1 0 326.396 3.554 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000178687209 1027970168 /nfs/dbraw/zinc/97/01/68/1027970168.db2.gz JABCKJXFUBVLMC-STQMWFEESA-N 1 0 345.374 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCCCC3)cc2)cn1 ZINC000078596264 1028008947 /nfs/dbraw/zinc/00/89/47/1028008947.db2.gz WIAQIMWZZIKFIT-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO COc1cc(C)c(C[C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000502252492 1028024930 /nfs/dbraw/zinc/02/49/30/1028024930.db2.gz KUJVJDZYSUTONR-AWEZNQCLSA-N 1 0 344.411 3.641 20 5 EHBDRO Cc1cccc([C@H]2CC[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)C2)c1 ZINC000444686840 1028134902 /nfs/dbraw/zinc/13/49/02/1028134902.db2.gz UGPUFONVAGBZJM-HNNXBMFYSA-N 1 0 336.395 3.769 20 5 EHBDRO COCC1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000502373277 1028172451 /nfs/dbraw/zinc/17/24/51/1028172451.db2.gz LZTVJYQZZRGWST-RDJZCZTQSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN[C@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144922 1028206185 /nfs/dbraw/zinc/20/61/85/1028206185.db2.gz IITODWJQSXXXPY-FNHZYXHNSA-N 1 0 325.412 3.739 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2c2cccc(Cl)c2)n1 ZINC000444806581 1028279463 /nfs/dbraw/zinc/27/94/63/1028279463.db2.gz UXLYTBLWNUYVCD-HNNXBMFYSA-N 1 0 334.807 3.672 20 5 EHBDRO O=C(CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)Nc1ccccc1 ZINC000130194120 1028367238 /nfs/dbraw/zinc/36/72/38/1028367238.db2.gz UKXUDUNRSXDLQX-UHFFFAOYSA-N 1 0 339.395 3.588 20 5 EHBDRO C[NH2+]Cc1ccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000423703814 1028592684 /nfs/dbraw/zinc/59/26/84/1028592684.db2.gz IORYDTMMSPHODQ-UHFFFAOYSA-N 1 0 327.384 3.690 20 5 EHBDRO CC(C)[NH2+]Cc1cn(-c2ccccc2)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000061554800 1028693863 /nfs/dbraw/zinc/69/38/63/1028693863.db2.gz QRRKIUHILMRZFO-UHFFFAOYSA-N 1 0 336.395 3.946 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521289 1028709985 /nfs/dbraw/zinc/70/99/85/1028709985.db2.gz KECRQWJUEYAWFG-HNNXBMFYSA-N 1 0 342.395 3.602 20 5 EHBDRO [NH3+]C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1CCCC1 ZINC000423957963 1028714973 /nfs/dbraw/zinc/71/49/73/1028714973.db2.gz LXNHVGFYIYHRCC-LJQANCHMSA-N 1 0 333.435 3.635 20 5 EHBDRO C[C@@H](NC(=O)CC[C@H]([NH3+])CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000424103366 1028787153 /nfs/dbraw/zinc/78/71/53/1028787153.db2.gz SHRLHILEYVPKSH-PBHICJAKSA-N 1 0 347.459 3.850 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000162463721 1028831450 /nfs/dbraw/zinc/83/14/50/1028831450.db2.gz YNSOUXLKJDFRDA-HNNXBMFYSA-N 1 0 340.427 3.831 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+][C@@H]2CC[C@H]2O)cc1 ZINC000424206540 1028890230 /nfs/dbraw/zinc/89/02/30/1028890230.db2.gz WSUGFKWVCWIQNK-GDBMZVCRSA-N 1 0 348.786 3.653 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000424333957 1028984222 /nfs/dbraw/zinc/98/42/22/1028984222.db2.gz YCQYQWIRDJHKLF-BVIKNXMNSA-N 1 0 344.390 3.502 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)c1ccccc1 ZINC000504894244 1029039215 /nfs/dbraw/zinc/03/92/15/1029039215.db2.gz KTBSIYZADHUFGO-HOTGVXAUSA-N 1 0 346.452 3.789 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(C)[C@@H](C)C1 ZINC000504920106 1029045565 /nfs/dbraw/zinc/04/55/65/1029045565.db2.gz NDIKXVVYSGJAEK-ZNMIVQPWSA-N 1 0 337.489 3.538 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(C)[C@H](C)C1 ZINC000504920104 1029045903 /nfs/dbraw/zinc/04/59/03/1029045903.db2.gz NDIKXVVYSGJAEK-RBSFLKMASA-N 1 0 337.489 3.538 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912414 1029055052 /nfs/dbraw/zinc/05/50/52/1029055052.db2.gz VYOCRIWNPWZXNL-BBRMVZONSA-N 1 0 326.462 3.606 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@H]1C(C)(C)C ZINC000532969601 1029115771 /nfs/dbraw/zinc/11/57/71/1029115771.db2.gz JZHTZHYUPDNGPH-INIZCTEOSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CCCC2)C1 ZINC000445864897 1029195391 /nfs/dbraw/zinc/19/53/91/1029195391.db2.gz ZVIDRGSUZDLUSB-AWEZNQCLSA-N 1 0 331.416 3.578 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2cccc(C(F)(F)F)c2)cc1 ZINC000237850597 1029454314 /nfs/dbraw/zinc/45/43/14/1029454314.db2.gz GZVIORDTPGKGQE-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000524894993 1029588386 /nfs/dbraw/zinc/58/83/86/1029588386.db2.gz ZHDFBNKVZALTKC-KBAYOESNSA-N 1 0 332.444 3.929 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042870 1029660236 /nfs/dbraw/zinc/66/02/36/1029660236.db2.gz GECBPPXFLXQJQY-KUHUBIRLSA-N 1 0 326.396 3.727 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c[nH]2)cc1 ZINC000343224678 1029809510 /nfs/dbraw/zinc/80/95/10/1029809510.db2.gz ZHHILLBFKWLAIZ-CYBMUJFWSA-N 1 0 342.399 3.550 20 5 EHBDRO CC(C)(C)[C@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000446829777 1029813662 /nfs/dbraw/zinc/81/36/62/1029813662.db2.gz LIEJAJIRYNGYJO-INIZCTEOSA-N 1 0 334.441 3.820 20 5 EHBDRO CC[C@@H]([NH2+]CCCN(C)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000156388479 1029821510 /nfs/dbraw/zinc/82/15/10/1029821510.db2.gz YWHBOWMMZQCTCV-CQSZACIVSA-N 1 0 333.354 3.520 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000520294732 1029950733 /nfs/dbraw/zinc/95/07/33/1029950733.db2.gz OOTZLPDOTQKXDD-UHFFFAOYSA-N 1 0 348.447 3.588 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000453278941 1030020259 /nfs/dbraw/zinc/02/02/59/1030020259.db2.gz DEWCTZUURBAKHT-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)C1CC1 ZINC000453318487 1030095734 /nfs/dbraw/zinc/09/57/34/1030095734.db2.gz MCOGOHWWWBFYPK-YJBOKZPZSA-N 1 0 344.455 3.855 20 5 EHBDRO C[C@@H]1CCN(Cc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000525781217 1030118466 /nfs/dbraw/zinc/11/84/66/1030118466.db2.gz WYKVZGMWQWFGMT-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccs1 ZINC000447529083 1030249513 /nfs/dbraw/zinc/24/95/13/1030249513.db2.gz LBMPAUBUZRGHTB-KGLIPLIRSA-N 1 0 348.472 3.904 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(C3CC3)cc2)n1 ZINC000447603876 1030359413 /nfs/dbraw/zinc/35/94/13/1030359413.db2.gz ZDZWRZOLPJRPBJ-ROUUACIJSA-N 1 0 340.427 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCC[C@H]1n1cccn1)CCC2 ZINC000192923792 1030476728 /nfs/dbraw/zinc/47/67/28/1030476728.db2.gz QTJXKUZZAZMUDR-GUDVDZBRSA-N 1 0 340.427 3.942 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000249174528 1030752278 /nfs/dbraw/zinc/75/22/78/1030752278.db2.gz DMVQMUCLMFZRPO-NJZAAPMLSA-N 1 0 346.349 3.729 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H](CO)C(C)(C)C ZINC000537658514 1030902573 /nfs/dbraw/zinc/90/25/73/1030902573.db2.gz JXOKMNLDEWKRNP-KRWDZBQOSA-N 1 0 332.400 3.694 20 5 EHBDRO CCc1nnc(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)[nH]1 ZINC000190680084 1030914167 /nfs/dbraw/zinc/91/41/67/1030914167.db2.gz QNHYSRFMYKFVGO-ZDUSSCGKSA-N 1 0 343.431 3.524 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368404 1031019471 /nfs/dbraw/zinc/01/94/71/1031019471.db2.gz UUHUZWZUHKMIIL-GJZGRUSLSA-N 1 0 344.411 3.980 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@@H+]1C ZINC000161118885 1031336468 /nfs/dbraw/zinc/33/64/68/1031336468.db2.gz OYIGLBRRJYIXCG-PWSUYJOCSA-N 1 0 331.338 3.533 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1F ZINC000584004257 1031384109 /nfs/dbraw/zinc/38/41/09/1031384109.db2.gz FLSWVGNFWKLOSV-MRXNPFEDSA-N 1 0 330.359 3.562 20 5 EHBDRO CC(C)CC[C@@](C)(O)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484137816 1031476298 /nfs/dbraw/zinc/47/62/98/1031476298.db2.gz UBYWTDDZHQEGEO-PKOBYXMFSA-N 1 0 334.460 3.693 20 5 EHBDRO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278597151 1031580786 /nfs/dbraw/zinc/58/07/86/1031580786.db2.gz AIWYYLKEJZULCT-DIFFPNOSSA-N 1 0 328.416 3.710 20 5 EHBDRO C[C@H](NCc1ccc(C(F)(F)F)cn1)c1ccccc1[N+](=O)[O-] ZINC000278616967 1031667637 /nfs/dbraw/zinc/66/76/37/1031667637.db2.gz FUJVGHDNSJNOCV-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@H]1c1ccsc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000052803849 1031698887 /nfs/dbraw/zinc/69/88/87/1031698887.db2.gz VQNLZJHPJKCVAH-INIZCTEOSA-N 1 0 345.424 3.822 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H](C)C1 ZINC000248540693 1031908788 /nfs/dbraw/zinc/90/87/88/1031908788.db2.gz BKIHHQNVFDFWMQ-XUJVJEKNSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000537887530 1031990416 /nfs/dbraw/zinc/99/04/16/1031990416.db2.gz WLZWAQKBORMIFO-MAUKXSAKSA-N 1 0 343.427 3.743 20 5 EHBDRO C[C@H](COCC(F)(F)F)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278699050 1032053431 /nfs/dbraw/zinc/05/34/31/1032053431.db2.gz KVQLHVRKUBJWIX-QMTHXVAHSA-N 1 0 332.322 3.529 20 5 EHBDRO CC(C)Oc1ccc([C@H](O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173422202 1033315170 /nfs/dbraw/zinc/31/51/70/1033315170.db2.gz HGABEKULIADHPE-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594518716 1033424374 /nfs/dbraw/zinc/42/43/74/1033424374.db2.gz JHEYIISXIRJLLL-USXIJHARSA-N 1 0 347.459 3.661 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000594519916 1033427171 /nfs/dbraw/zinc/42/71/71/1033427171.db2.gz MPXAJHWHCMHZRD-NVXWUHKLSA-N 1 0 332.444 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c2ncccc12 ZINC000594596671 1033444220 /nfs/dbraw/zinc/44/42/20/1033444220.db2.gz BAYAFLHWZJROQO-RHSMWYFYSA-N 1 0 326.400 3.572 20 5 EHBDRO COC[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000594969937 1033577111 /nfs/dbraw/zinc/57/71/11/1033577111.db2.gz UOGVBCCKHWTWQL-OTIVFRFGSA-N 1 0 342.395 3.594 20 5 EHBDRO COc1ccc(C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000059385978 1033603673 /nfs/dbraw/zinc/60/36/73/1033603673.db2.gz VFIOJVVXBFFEBO-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)F)nc1 ZINC000595019155 1033612883 /nfs/dbraw/zinc/61/28/83/1033612883.db2.gz IYVYAEUYMLSNJE-NSHDSACASA-N 1 0 337.326 3.657 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccc1)[C@@H](O)C(C)C ZINC000594991079 1033621097 /nfs/dbraw/zinc/62/10/97/1033621097.db2.gz ZHFWSYVYYRAZTL-OALUTQOASA-N 1 0 328.412 3.751 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)ccc1C ZINC000595008055 1033630856 /nfs/dbraw/zinc/63/08/56/1033630856.db2.gz OZKHZXRSPUFJTK-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595007156 1033630960 /nfs/dbraw/zinc/63/09/60/1033630960.db2.gz KFJKEDAUUPPYMO-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO C/C=C/C[NH2+]Cc1ccc(OC)c(OCc2ccc([N+](=O)[O-])cc2)c1 ZINC000599004460 1033637955 /nfs/dbraw/zinc/63/79/55/1033637955.db2.gz FAGRSMFQEZNENE-ONEGZZNKSA-N 1 0 342.395 3.848 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)cc1[N+](=O)[O-] ZINC000061110780 1033642498 /nfs/dbraw/zinc/64/24/98/1033642498.db2.gz NWOOFOXVYGSQFU-ZDUSSCGKSA-N 1 0 339.395 3.639 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595073564 1033648343 /nfs/dbraw/zinc/64/83/43/1033648343.db2.gz NKJXZUQIOQCOQS-APWZRJJASA-N 1 0 339.439 3.842 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCCC12CCOCC2 ZINC000595037848 1033657508 /nfs/dbraw/zinc/65/75/08/1033657508.db2.gz DMSDNZPJJIAVOL-CXAGYDPISA-N 1 0 334.416 3.603 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCc1ncccc1C ZINC000595041696 1033659717 /nfs/dbraw/zinc/65/97/17/1033659717.db2.gz OIGRYBKUIALTEG-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@H]3CCCc4scnc43)c2c1 ZINC000599047531 1033675029 /nfs/dbraw/zinc/67/50/29/1033675029.db2.gz ZUFWWIOMGXPOGZ-HNNXBMFYSA-N 1 0 342.424 3.742 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)[C@@H](C)c1ccccc1 ZINC000595098165 1033689163 /nfs/dbraw/zinc/68/91/63/1033689163.db2.gz BKLMBQNFPMTJGF-GUXCAODWSA-N 1 0 342.439 3.670 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cccc1[N+](=O)[O-] ZINC000595100046 1033689830 /nfs/dbraw/zinc/68/98/30/1033689830.db2.gz TTXUYTDYSCRGMP-CYBMUJFWSA-N 1 0 328.416 3.755 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](c2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000595102446 1033692451 /nfs/dbraw/zinc/69/24/51/1033692451.db2.gz IAGDEMLFJQFDGW-CKFHNAJUSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089278 1033698976 /nfs/dbraw/zinc/69/89/76/1033698976.db2.gz NBWMPSDUGGHEPQ-UZLBHIALSA-N 1 0 340.423 3.682 20 5 EHBDRO CC(C)[C@H](O)[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000595094127 1033700511 /nfs/dbraw/zinc/70/05/11/1033700511.db2.gz DMXGPIYZBRUHFH-RLLQIKCJSA-N 1 0 340.423 3.930 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](n1cccn1)C(F)(F)F ZINC000599053932 1033706382 /nfs/dbraw/zinc/70/63/82/1033706382.db2.gz BAMDBHGJVIUABI-RISCZKNCSA-N 1 0 342.321 3.554 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1Cc2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 ZINC000599075096 1033716260 /nfs/dbraw/zinc/71/62/60/1033716260.db2.gz SRYRARNGRWQEQA-SJLPKXTDSA-N 1 0 339.395 3.589 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CO[C@H](C2CC2)C1 ZINC000599086258 1033726367 /nfs/dbraw/zinc/72/63/67/1033726367.db2.gz ZQMQWLCQCDRQOJ-YCPHGPKFSA-N 1 0 336.457 3.623 20 5 EHBDRO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000595330862 1033729849 /nfs/dbraw/zinc/72/98/49/1033729849.db2.gz MZJZNLQYGHSMGD-UAGQMJEPSA-N 1 0 336.407 3.759 20 5 EHBDRO C[C@@H](COCC1CC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000593682191 1033751188 /nfs/dbraw/zinc/75/11/88/1033751188.db2.gz QIMTUDDPJBBAHV-ZDUSSCGKSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@H](c3cc4ccccc4[nH]3)C2)c1[N+](=O)[O-] ZINC000595356401 1033781293 /nfs/dbraw/zinc/78/12/93/1033781293.db2.gz LZCUFSDEAHPHAH-CQSZACIVSA-N 1 0 340.383 3.752 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@H]1OCCc2sccc21 ZINC000595509002 1033836413 /nfs/dbraw/zinc/83/64/13/1033836413.db2.gz DRPYMXCBRWLUMM-MGPLVRAMSA-N 1 0 336.388 3.588 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnc(C(F)(F)F)nc2)cc1[N+](=O)[O-] ZINC000593021360 1033837202 /nfs/dbraw/zinc/83/72/02/1033837202.db2.gz WETAQDICAWGBEZ-SNVBAGLBSA-N 1 0 340.305 3.563 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1 ZINC000593022266 1033839982 /nfs/dbraw/zinc/83/99/82/1033839982.db2.gz XNVIZUQKTDMJFO-ZIAGYGMSSA-N 1 0 342.395 3.663 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@]2(C)Cc2ccccc2F)c1[N+](=O)[O-] ZINC000595562790 1033844621 /nfs/dbraw/zinc/84/46/21/1033844621.db2.gz MAOBLHNUBQZPIM-QGZVFWFLSA-N 1 0 333.363 3.628 20 5 EHBDRO CN1CCC[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000608836045 1033910383 /nfs/dbraw/zinc/91/03/83/1033910383.db2.gz FBYCMQYXTURSTD-AWEZNQCLSA-N 1 0 331.441 3.507 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000603868409 1033994472 /nfs/dbraw/zinc/99/44/72/1033994472.db2.gz LOSRLTIUPDCWJX-GOSISDBHSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590222 1034028533 /nfs/dbraw/zinc/02/85/33/1034028533.db2.gz VWYRBWFEUOOVTH-CJNGLKHVSA-N 1 0 348.443 3.703 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000595910285 1034029761 /nfs/dbraw/zinc/02/97/61/1034029761.db2.gz OHSKCOHIZAAZSG-ZYSHUDEJSA-N 1 0 330.428 3.857 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000595868708 1034031794 /nfs/dbraw/zinc/03/17/94/1034031794.db2.gz YPFNQBAGHRAYTA-GXTWGEPZSA-N 1 0 330.388 3.798 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000595867716 1034032817 /nfs/dbraw/zinc/03/28/17/1034032817.db2.gz OXNOOOMTYAQDKQ-GXTWGEPZSA-N 1 0 330.388 3.798 20 5 EHBDRO O=[N+]([O-])c1cc(NC2CC[NH+](CC3CC3)CC2)ccc1C(F)(F)F ZINC000596087450 1034077191 /nfs/dbraw/zinc/07/71/91/1034077191.db2.gz CINSZQWQHRPTIG-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000169151601 1034103959 /nfs/dbraw/zinc/10/39/59/1034103959.db2.gz OHWDJZOGAWSWNA-RBUKOAKNSA-N 1 0 328.412 3.933 20 5 EHBDRO COc1ccccc1C[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000604012364 1034135807 /nfs/dbraw/zinc/13/58/07/1034135807.db2.gz IVTQMBPVALLDMG-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO Cc1cccc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)c1[N+](=O)[O-] ZINC000456265011 1034264400 /nfs/dbraw/zinc/26/44/00/1034264400.db2.gz HKYAZULDFWDAHE-KRWDZBQOSA-N 1 0 339.395 3.704 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)o1 ZINC000604266301 1034309593 /nfs/dbraw/zinc/30/95/93/1034309593.db2.gz YZXIUPIHXSNJRA-CYBMUJFWSA-N 1 0 345.399 3.521 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435882 1034379560 /nfs/dbraw/zinc/37/95/60/1034379560.db2.gz CJFQXNNXBGLRGE-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+][C@]2(C)CCOC2)cc1[N+](=O)[O-] ZINC000534455290 1034578939 /nfs/dbraw/zinc/57/89/39/1034578939.db2.gz LNIOGCAJUJUDLT-LJQANCHMSA-N 1 0 341.411 3.631 20 5 EHBDRO C[C@H]1C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)C1O ZINC000597206462 1034592254 /nfs/dbraw/zinc/59/22/54/1034592254.db2.gz RZQCLBRYFWZIPB-STQMWFEESA-N 1 0 346.452 3.772 20 5 EHBDRO C[C@@]12COC[C@@H]1C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210918 1034593772 /nfs/dbraw/zinc/59/37/72/1034593772.db2.gz ITTOXXHLTGWVBJ-SCLBCKFNSA-N 1 0 344.436 3.792 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC[C@H]1C ZINC000480622398 1034696961 /nfs/dbraw/zinc/69/69/61/1034696961.db2.gz XYWCUHSQXJTGRH-MDZRGWNJSA-N 1 0 345.487 3.768 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc(C(F)F)c3)CC2)n1 ZINC000365313277 1035028208 /nfs/dbraw/zinc/02/82/08/1035028208.db2.gz BEKPMNRCKSYUDR-UHFFFAOYSA-N 1 0 336.342 3.566 20 5 EHBDRO Cc1cc(NC[C@@H]2CCC[N@@H+](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000580866992 1035465419 /nfs/dbraw/zinc/46/54/19/1035465419.db2.gz DALRKDSHCADPIF-NSHDSACASA-N 1 0 331.338 3.676 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@H]3CCC[C@@H](CO)C3)o2)c1 ZINC000581196824 1035479031 /nfs/dbraw/zinc/47/90/31/1035479031.db2.gz ZCOOJVQGGNOMFN-LSDHHAIUSA-N 1 0 344.411 3.743 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223240 1035511398 /nfs/dbraw/zinc/51/13/98/1035511398.db2.gz KJPKBMVZVVPMOW-MOPGFXCFSA-N 1 0 328.412 3.825 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H]1CCCCC12CCCC2 ZINC000463447790 1035514854 /nfs/dbraw/zinc/51/48/54/1035514854.db2.gz ZTZGDDGMTKVSNN-KRWDZBQOSA-N 1 0 345.443 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000152026751 1035534381 /nfs/dbraw/zinc/53/43/81/1035534381.db2.gz CWDRZUGPMYBRTQ-INIZCTEOSA-N 1 0 349.818 3.768 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000571580724 1035542328 /nfs/dbraw/zinc/54/23/28/1035542328.db2.gz ASAJBERRFHDOMN-KXBFYZLASA-N 1 0 337.423 3.698 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]2c2cccnc2)cc1 ZINC000588203883 1035821024 /nfs/dbraw/zinc/82/10/24/1035821024.db2.gz MQKPJKMNLNSHDR-SFHVURJKSA-N 1 0 327.384 3.596 20 5 EHBDRO Cc1nnsc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000492460293 1035843184 /nfs/dbraw/zinc/84/31/84/1035843184.db2.gz IQIWKVPOULUWEO-UHFFFAOYSA-N 1 0 346.437 3.773 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1(C2CCC2)CCC1 ZINC000414174445 1035893094 /nfs/dbraw/zinc/89/30/94/1035893094.db2.gz HLIBKPHLSMNLKI-CYBMUJFWSA-N 1 0 331.416 3.624 20 5 EHBDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347906 1035940764 /nfs/dbraw/zinc/94/07/64/1035940764.db2.gz DSRCGZRVXRABCS-GJZGRUSLSA-N 1 0 333.432 3.872 20 5 EHBDRO CC1(C)CCC[N@H+](CCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000443956881 1035944498 /nfs/dbraw/zinc/94/44/98/1035944498.db2.gz BSOKAUSCWMIMSK-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OC)C23CCC3)cc1[N+](=O)[O-] ZINC000414188415 1035957245 /nfs/dbraw/zinc/95/72/45/1035957245.db2.gz QGHPNFFBJXXYNY-AFAVFJNCSA-N 1 0 334.416 3.602 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000443958076 1035981909 /nfs/dbraw/zinc/98/19/09/1035981909.db2.gz LNHWZFBNSZXQEK-KGLIPLIRSA-N 1 0 348.447 3.596 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630727 1036063661 /nfs/dbraw/zinc/06/36/61/1036063661.db2.gz DNYIMVCWWHBMAJ-JSGCOSHPSA-N 1 0 346.818 3.891 20 5 EHBDRO CCOc1cc(C[N@H+](C[C@H]2CCCO2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000492654889 1036114436 /nfs/dbraw/zinc/11/44/36/1036114436.db2.gz OLQWJGKNLHLUPK-QGZVFWFLSA-N 1 0 348.443 3.917 20 5 EHBDRO CC(C)[N@H+](CCCC(=O)OC(C)(C)C)Cc1ccc([N+](=O)[O-])cc1 ZINC000541282696 1036165044 /nfs/dbraw/zinc/16/50/44/1036165044.db2.gz PBXPPFPFBQBMRI-UHFFFAOYSA-N 1 0 336.432 3.927 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589111660 1036257898 /nfs/dbraw/zinc/25/78/98/1036257898.db2.gz MYGIDEIQNNQWEM-LBPRGKRZSA-N 1 0 345.365 3.782 20 5 EHBDRO CC(C)(C)[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000054397279 1036364580 /nfs/dbraw/zinc/36/45/80/1036364580.db2.gz XUBLTDOAGQWPNA-KRWDZBQOSA-N 1 0 341.411 3.571 20 5 EHBDRO CCCC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000541594112 1036479062 /nfs/dbraw/zinc/47/90/62/1036479062.db2.gz QAZWFMSPZWXOAG-MRXNPFEDSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1csnn1 ZINC000414293529 1036494806 /nfs/dbraw/zinc/49/48/06/1036494806.db2.gz CYPFUKIPSPWTGU-OUCADQQQSA-N 1 0 332.429 3.508 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000493053208 1036602582 /nfs/dbraw/zinc/60/25/82/1036602582.db2.gz MKUNFSADTGIXLI-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000783775819 1036811059 /nfs/dbraw/zinc/81/10/59/1036811059.db2.gz IULOMQVTLBHQSY-GRYCIOLGSA-N 1 0 340.807 3.553 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000180446328 1036840570 /nfs/dbraw/zinc/84/05/70/1036840570.db2.gz XCISZVNMBRDMSX-LBPRGKRZSA-N 1 0 347.802 3.928 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000171562297 1036876085 /nfs/dbraw/zinc/87/60/85/1036876085.db2.gz DHNFNLDCYDCXIZ-UHFFFAOYSA-N 1 0 347.462 3.802 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ccc(N)cc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000376448372 1036887721 /nfs/dbraw/zinc/88/77/21/1036887721.db2.gz MNAMAXKBEJQBJW-SJKOYZFVSA-N 1 0 346.456 3.734 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000152857637 1036997549 /nfs/dbraw/zinc/99/75/49/1036997549.db2.gz OXMLZPNPKKFNHV-CABCVRRESA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000542049073 1037026056 /nfs/dbraw/zinc/02/60/56/1037026056.db2.gz QBNUFHDVKNYMBN-QILLFSRXSA-N 1 0 345.443 3.742 20 5 EHBDRO Cc1cc(N2CCC[C@@]3(CCCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542123339 1037086000 /nfs/dbraw/zinc/08/60/00/1037086000.db2.gz QXAPHZXWOYAEPE-LJQANCHMSA-N 1 0 341.411 3.848 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524443 1037092772 /nfs/dbraw/zinc/09/27/72/1037092772.db2.gz CZEUSYNOJDTJTF-MLGOLLRUSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cccc(C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761525471 1037109330 /nfs/dbraw/zinc/10/93/30/1037109330.db2.gz KFESUZDJDOQIGB-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[NH+]1CCCCCC1 ZINC000539845392 1037273299 /nfs/dbraw/zinc/27/32/99/1037273299.db2.gz BMZZLSJEXHMTRV-UHFFFAOYSA-N 1 0 347.459 3.516 20 5 EHBDRO C[C@@H]1OCC[C@]1(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000542314674 1037281145 /nfs/dbraw/zinc/28/11/45/1037281145.db2.gz VKHIKGRWAXNFNI-SJCJKPOMSA-N 1 0 332.425 3.980 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180888066 1037285489 /nfs/dbraw/zinc/28/54/89/1037285489.db2.gz BUJXNGGBVBRQRP-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000532470202 1037414765 /nfs/dbraw/zinc/41/47/65/1037414765.db2.gz CFUNJGIUYAJXOM-FDQGKXFDSA-N 1 0 345.443 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CCOCC3)o2)c(Cl)c1 ZINC000171050727 1037429461 /nfs/dbraw/zinc/42/94/61/1037429461.db2.gz WVUJLNAXEUMFQR-UHFFFAOYSA-N 1 0 336.775 3.777 20 5 EHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462830210 1037432246 /nfs/dbraw/zinc/43/22/46/1037432246.db2.gz AWQWOQCUZOVTNW-RYUDHWBXSA-N 1 0 343.374 3.871 20 5 EHBDRO CC[N@@H+]1CCC[C@@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423960 1037451217 /nfs/dbraw/zinc/45/12/17/1037451217.db2.gz QGJNIIPLHOMHMM-WOJBJXKFSA-N 1 0 339.439 3.758 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000171128209 1037469828 /nfs/dbraw/zinc/46/98/28/1037469828.db2.gz NVDXSNQQSKPHTQ-CYBMUJFWSA-N 1 0 328.368 3.621 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCOC1 ZINC000462879862 1037509147 /nfs/dbraw/zinc/50/91/47/1037509147.db2.gz ZXISFSIMGZXSBO-CQSZACIVSA-N 1 0 330.384 3.854 20 5 EHBDRO C=Cc1ccc(CC[NH2+]Cc2cc(OC)c(OC)cc2[N+](=O)[O-])cc1 ZINC000462915690 1037545187 /nfs/dbraw/zinc/54/51/87/1037545187.db2.gz YUHBXIMCEAHSGG-UHFFFAOYSA-N 1 0 342.395 3.587 20 5 EHBDRO CCC(CC)[N@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CC1 ZINC000532528661 1037551395 /nfs/dbraw/zinc/55/13/95/1037551395.db2.gz RRGVWEPZOBSAKF-UHFFFAOYSA-N 1 0 347.415 3.546 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)CC1(CO)CC1 ZINC000188952402 1037575071 /nfs/dbraw/zinc/57/50/71/1037575071.db2.gz HDNLPYNATKJQNF-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000532551551 1037601158 /nfs/dbraw/zinc/60/11/58/1037601158.db2.gz VTCIVONPLRXUSE-QAPCUYQASA-N 1 0 328.412 3.812 20 5 EHBDRO C[NH2+]Cc1ccccc1NC(=O)N[C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000415907235 1037617991 /nfs/dbraw/zinc/61/79/91/1037617991.db2.gz AVANBFVJKJARJM-CYBMUJFWSA-N 1 0 342.399 3.505 20 5 EHBDRO COc1cc(F)c([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000540150522 1037621798 /nfs/dbraw/zinc/62/17/98/1037621798.db2.gz GKDSVGXZMXYZBZ-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(C3CC3)cc2)c([N+](=O)[O-])cc1OC ZINC000191682370 1037741628 /nfs/dbraw/zinc/74/16/28/1037741628.db2.gz BKORLEMYZAUIJR-UHFFFAOYSA-N 1 0 342.395 3.779 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000341220721 1037781312 /nfs/dbraw/zinc/78/13/12/1037781312.db2.gz RCGYRZADZGPXMZ-KRWDZBQOSA-N 1 0 341.411 3.973 20 5 EHBDRO COC(=O)CC(C)(C)C[C@@H](C)[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897459517 1037836133 /nfs/dbraw/zinc/83/61/33/1037836133.db2.gz ACURGCGITCJUFW-ZIAGYGMSSA-N 1 0 336.432 3.656 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c(C)c1 ZINC000341253569 1037837890 /nfs/dbraw/zinc/83/78/90/1037837890.db2.gz CPPSBXJCKRBVCR-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO Cc1ccccc1C1([NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000592139419 1037860365 /nfs/dbraw/zinc/86/03/65/1037860365.db2.gz FTRLPCSQWCTRSS-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](O)[C@@H]2CCc2ccccc2)cs1 ZINC000592165651 1037909479 /nfs/dbraw/zinc/90/94/79/1037909479.db2.gz DIOPGRXXXQOAPK-IRXDYDNUSA-N 1 0 346.452 3.614 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540397873 1037912101 /nfs/dbraw/zinc/91/21/01/1037912101.db2.gz JZZMGCHSWVCINY-LKCYJCQHSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000540476818 1037985727 /nfs/dbraw/zinc/98/57/27/1037985727.db2.gz TWVKPPVCMVBJBB-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO CC(C)c1nnc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)s1 ZINC000492101299 1038000177 /nfs/dbraw/zinc/00/01/77/1038000177.db2.gz BFJKUAPQUMSLNU-UHFFFAOYSA-N 1 0 340.836 3.555 20 5 EHBDRO Cc1c(NC(=O)C[C@H](c2ccccc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000416124180 1038194855 /nfs/dbraw/zinc/19/48/55/1038194855.db2.gz NIRVHJHIXISXKF-QGZVFWFLSA-N 1 0 327.384 3.535 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCN2CCCC2)s1 ZINC000538689620 1038480023 /nfs/dbraw/zinc/48/00/23/1038480023.db2.gz DVUOPVBYQSAMIJ-UHFFFAOYSA-N 1 0 331.441 3.509 20 5 EHBDRO Cc1cc(NCCN2CCc3sccc3C2)c(F)cc1[N+](=O)[O-] ZINC000461778748 1038605533 /nfs/dbraw/zinc/60/55/33/1038605533.db2.gz PFWAYBCXKVCWIQ-UHFFFAOYSA-N 1 0 335.404 3.574 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](C)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961577 1038698700 /nfs/dbraw/zinc/69/87/00/1038698700.db2.gz XUMUGMBNYAFZQO-MNOVXSKESA-N 1 0 331.338 3.817 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893255213 1038738117 /nfs/dbraw/zinc/73/81/17/1038738117.db2.gz HHUKGPZNYMDYDI-DZGCQCFKSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1cnc2ccccc2c1N1CC[NH+](C2CCCCC2)CC1 ZINC000488122443 1038897307 /nfs/dbraw/zinc/89/73/07/1038897307.db2.gz HRMHSCBNQWIVQH-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccc(Cl)s1 ZINC000015294292 1039089029 /nfs/dbraw/zinc/08/90/29/1039089029.db2.gz FVBWXVFIZLHYEN-UHFFFAOYSA-N 1 0 326.805 3.950 20 5 EHBDRO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036467 1039139207 /nfs/dbraw/zinc/13/92/07/1039139207.db2.gz KXFXPUSGZAADQS-YJBOKZPZSA-N 1 0 328.416 3.573 20 5 EHBDRO CC(C)[C@H](c1ccccc1Cl)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000478044383 1039164438 /nfs/dbraw/zinc/16/44/38/1039164438.db2.gz CBGAOCHPYHLVGU-MRXNPFEDSA-N 1 0 336.823 3.774 20 5 EHBDRO COc1cc(CN2CCSC[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507309 1039175831 /nfs/dbraw/zinc/17/58/31/1039175831.db2.gz VMYOVDMQUYROFQ-QGZVFWFLSA-N 1 0 344.436 3.894 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2SCCc3ccccc32)c(F)c1 ZINC000478246055 1039319549 /nfs/dbraw/zinc/31/95/49/1039319549.db2.gz BCWSLXDAGHUURG-KRWDZBQOSA-N 1 0 332.400 3.854 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3nccs3)CC2)cc1[N+](=O)[O-] ZINC000090217618 1039374552 /nfs/dbraw/zinc/37/45/52/1039374552.db2.gz BAVOPJCYRLVKJO-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO CC(C)(C)c1ccc([C@@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478429962 1039436102 /nfs/dbraw/zinc/43/61/02/1039436102.db2.gz QJGDQKWPQAIORI-KRWDZBQOSA-N 1 0 342.443 3.926 20 5 EHBDRO CCCC[N@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000488894141 1039457973 /nfs/dbraw/zinc/45/79/73/1039457973.db2.gz HXBRKNPXADLBNG-UHFFFAOYSA-N 1 0 335.451 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCOC3)s2)cc1 ZINC000237989419 1039470073 /nfs/dbraw/zinc/47/00/73/1039470073.db2.gz ODBIRLGFNVLCGX-ZDUSSCGKSA-N 1 0 332.425 3.840 20 5 EHBDRO CC[NH+](CC)[C@@H](CNCc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000236853808 1039489126 /nfs/dbraw/zinc/48/91/26/1039489126.db2.gz YTKPJLHYFGVAHY-INIZCTEOSA-N 1 0 333.457 3.829 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(F)c3cccnc23)cccc1[N+](=O)[O-] ZINC000480456457 1039559828 /nfs/dbraw/zinc/55/98/28/1039559828.db2.gz QIUIXUCISKIXSH-UHFFFAOYSA-N 1 0 325.343 3.880 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCOC[C@@H]1CCCO1)CCCC2 ZINC000417309996 1039664074 /nfs/dbraw/zinc/66/40/74/1039664074.db2.gz GSSCNKWTKADRGR-HKUYNNGSSA-N 1 0 348.443 3.538 20 5 EHBDRO Cc1n[nH]cc1CCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417333776 1039690602 /nfs/dbraw/zinc/69/06/02/1039690602.db2.gz ZCWLUDRIAOPXGP-GOSISDBHSA-N 1 0 328.416 3.616 20 5 EHBDRO CS[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000129405900 1039766066 /nfs/dbraw/zinc/76/60/66/1039766066.db2.gz IECRKCPWFORBFN-YJBOKZPZSA-N 1 0 349.500 3.827 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](CCO)c2ccc(Cl)cc2)cc1 ZINC000347419677 1039862674 /nfs/dbraw/zinc/86/26/74/1039862674.db2.gz CMFXPJCELYWTMC-KRWDZBQOSA-N 1 0 334.803 3.504 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@H](C)C[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700919 1039923796 /nfs/dbraw/zinc/92/37/96/1039923796.db2.gz RYZCYCWYQFVSDN-HZPDHXFCSA-N 1 0 349.475 3.909 20 5 EHBDRO C[C@H]([N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000027132778 1039939799 /nfs/dbraw/zinc/93/97/99/1039939799.db2.gz YQPXAALNJPQEOL-JTQLQIEISA-N 1 0 327.812 3.553 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000553619731 1040265210 /nfs/dbraw/zinc/26/52/10/1040265210.db2.gz ZXONDTCUGSCIFK-QYJAPNMZSA-N 1 0 343.349 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H]2C2CCC2)c1 ZINC000512622029 1040293440 /nfs/dbraw/zinc/29/34/40/1040293440.db2.gz HPWZCJADNDPVJS-CQSZACIVSA-N 1 0 326.343 3.961 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)[C@@H]1C[C@H]1c1ccccc1 ZINC000555233454 1040321656 /nfs/dbraw/zinc/32/16/56/1040321656.db2.gz WKUIJPWLPQMIHI-JVPBZIDWSA-N 1 0 326.396 3.755 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)o1 ZINC000190339171 1040381774 /nfs/dbraw/zinc/38/17/74/1040381774.db2.gz QJUCHUPTKQSBCL-SIIHOXLZSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCc2ccccc2C1 ZINC000481130207 1040388025 /nfs/dbraw/zinc/38/80/25/1040388025.db2.gz ZZIIZQGBWGAPDX-CVEARBPZSA-N 1 0 339.439 3.692 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070430 1040434296 /nfs/dbraw/zinc/43/42/96/1040434296.db2.gz BJRNXKRCHVMLRM-HNNXBMFYSA-N 1 0 333.432 3.968 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075412 1040435063 /nfs/dbraw/zinc/43/50/63/1040435063.db2.gz PLUASMGBLMDSKW-IIAWOOMASA-N 1 0 331.416 3.576 20 5 EHBDRO CC(C)(CC[NH+]1CCCCCC1)NCc1ccc([N+](=O)[O-])cc1F ZINC000479595829 1040435925 /nfs/dbraw/zinc/43/59/25/1040435925.db2.gz XHABLWDTXFSNTQ-UHFFFAOYSA-N 1 0 337.439 3.868 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000486785934 1040460958 /nfs/dbraw/zinc/46/09/58/1040460958.db2.gz FQJTXCRMPJJNTR-AWEZNQCLSA-N 1 0 349.431 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc(CN(CCO)[C@H]2CCCc3ccccc32)c(F)c1 ZINC000490375983 1040531563 /nfs/dbraw/zinc/53/15/63/1040531563.db2.gz VVPSSOWETBSLDK-IBGZPJMESA-N 1 0 344.386 3.606 20 5 EHBDRO Cc1c(C[N@@H+](C[C@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000553952462 1040625885 /nfs/dbraw/zinc/62/58/85/1040625885.db2.gz UXDQJBYKQXXMMI-HOTGVXAUSA-N 1 0 342.439 3.890 20 5 EHBDRO Cc1nc(C)c(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)s1 ZINC000487199253 1040785289 /nfs/dbraw/zinc/78/52/89/1040785289.db2.gz GYZYVXWFSFZIIN-UHFFFAOYSA-N 1 0 345.346 3.977 20 5 EHBDRO CC[C@H](C)[C@@H](O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236980378 1040790034 /nfs/dbraw/zinc/79/00/34/1040790034.db2.gz BVSUVOGHAYQZOI-LRDDRELGSA-N 1 0 334.441 3.820 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078763 1040885951 /nfs/dbraw/zinc/88/59/51/1040885951.db2.gz QATRPIVWONYKFH-CVEARBPZSA-N 1 0 349.450 3.820 20 5 EHBDRO CC1(C)C[C@H](NC2CC[NH+](CC3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000433154340 1040921055 /nfs/dbraw/zinc/92/10/55/1040921055.db2.gz ZBZKAYMXQWGLPA-IBGZPJMESA-N 1 0 343.471 3.781 20 5 EHBDRO CN(C)c1ncccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433154903 1040923189 /nfs/dbraw/zinc/92/31/89/1040923189.db2.gz VLAZCHGIEBBZCZ-KRWDZBQOSA-N 1 0 340.427 3.568 20 5 EHBDRO C[C@H](CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150150 1040928292 /nfs/dbraw/zinc/92/82/92/1040928292.db2.gz VRRFTATWRBMZSS-KDOFPFPSSA-N 1 0 331.460 3.639 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2[nH]c(=O)oc2c1 ZINC000586789277 1041021490 /nfs/dbraw/zinc/02/14/90/1041021490.db2.gz LTMFBCMQBGTTJL-QWRGUYRKSA-N 1 0 327.340 3.853 20 5 EHBDRO Cc1ccc(CNc2cccc3c2OCC[C@@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000433200104 1041050652 /nfs/dbraw/zinc/05/06/52/1041050652.db2.gz OIKFVZQNXAITGZ-KRWDZBQOSA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1ccc(CNc2cccc3c2OCC[C@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000433200205 1041051762 /nfs/dbraw/zinc/05/17/62/1041051762.db2.gz OIKFVZQNXAITGZ-QGZVFWFLSA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1cc(N2CC[C@H]([NH+]3CCCC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000566692450 1041201275 /nfs/dbraw/zinc/20/12/75/1041201275.db2.gz YCUMCNBFWPSHBO-LBPRGKRZSA-N 1 0 343.349 3.597 20 5 EHBDRO CC(C)[NH+]1CCC(N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433284388 1041234570 /nfs/dbraw/zinc/23/45/70/1041234570.db2.gz JURZNFZENCDRJD-SFHVURJKSA-N 1 0 331.460 3.780 20 5 EHBDRO Cc1cccc(NCC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433285573 1041235352 /nfs/dbraw/zinc/23/53/52/1041235352.db2.gz IFDUPBLBIHQMRW-QGZVFWFLSA-N 1 0 340.427 3.722 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@]2(C)CCCC[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000433305200 1041247575 /nfs/dbraw/zinc/24/75/75/1041247575.db2.gz PDLXVBIACBOBTL-JENIJYKNSA-N 1 0 332.444 3.848 20 5 EHBDRO CC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CC1(C)C ZINC000419314209 1041252281 /nfs/dbraw/zinc/25/22/81/1041252281.db2.gz HOLVBZFZVWIMCZ-KBPBESRZSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1[N+](=O)[O-] ZINC000433325262 1041301483 /nfs/dbraw/zinc/30/14/83/1041301483.db2.gz IBFCRBBQVXUTFE-GFCCVEGCSA-N 1 0 326.356 3.737 20 5 EHBDRO CCC[C@@](C)(CO)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000124082375 1041615927 /nfs/dbraw/zinc/61/59/27/1041615927.db2.gz FJHVGFPTQJFORI-SFHVURJKSA-N 1 0 348.399 3.504 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000047452767 1041643013 /nfs/dbraw/zinc/64/30/13/1041643013.db2.gz NKTRMIPFKBVVHY-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1 ZINC000181828666 1042478588 /nfs/dbraw/zinc/47/85/88/1042478588.db2.gz UVOCZHXASBFMEH-UHFFFAOYSA-N 1 0 334.464 3.637 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C3(CO)CC3)cc2[N+](=O)[O-])cc1 ZINC000120358726 1042647233 /nfs/dbraw/zinc/64/72/33/1042647233.db2.gz QZLRFNMCRMHUMN-UHFFFAOYSA-N 1 0 344.436 3.669 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165434996 1042814518 /nfs/dbraw/zinc/81/45/18/1042814518.db2.gz SEUBGSDNDNVAGX-STQMWFEESA-N 1 0 342.399 3.806 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)c1 ZINC000122126935 1042862650 /nfs/dbraw/zinc/86/26/50/1042862650.db2.gz PXORFWZJNQVXQJ-KUHUBIRLSA-N 1 0 343.427 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCC2)cc1OC(F)F ZINC000549617639 1042931010 /nfs/dbraw/zinc/93/10/10/1042931010.db2.gz STFJSKAAAAUSMG-UHFFFAOYSA-N 1 0 343.374 3.874 20 5 EHBDRO Cc1ccc(CN2CCC[C@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164292 1043546055 /nfs/dbraw/zinc/54/60/55/1043546055.db2.gz BYRFRQJXBVRYNS-LJQANCHMSA-N 1 0 345.487 3.847 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cnn1C ZINC000279209480 1043570688 /nfs/dbraw/zinc/57/06/88/1043570688.db2.gz YAJHMCQRQPFBNY-PIGZYNQJSA-N 1 0 328.416 3.710 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239359 1043639903 /nfs/dbraw/zinc/63/99/03/1043639903.db2.gz JWOLGSLRJKRMCZ-JMSVASOKSA-N 1 0 330.388 3.874 20 5 EHBDRO Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1C ZINC001659390741 1126263494 /nfs/dbraw/zinc/26/34/94/1126263494.db2.gz YBSJGZPOYSEERG-MRXNPFEDSA-N 1 0 348.830 3.558 20 5 EHBDRO CCCC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCC1 ZINC000184884741 1126706560 /nfs/dbraw/zinc/70/65/60/1126706560.db2.gz TWXAJPGDOBXAPC-QGZVFWFLSA-N 1 0 334.416 3.910 20 5 EHBDRO CCOC(=O)C(C)(C)N(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000552055370 1127551833 /nfs/dbraw/zinc/55/18/33/1127551833.db2.gz KIOAKRZZYRNVED-UHFFFAOYSA-N 1 0 346.383 3.628 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765009861 1127564889 /nfs/dbraw/zinc/56/48/89/1127564889.db2.gz FCWOHAVZQLIJAZ-HNNXBMFYSA-N 1 0 348.472 3.818 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1ccccc1 ZINC000301279158 1127631478 /nfs/dbraw/zinc/63/14/78/1127631478.db2.gz NGGIRIFVLRWJKD-LBPRGKRZSA-N 1 0 334.807 3.576 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171389 1127799040 /nfs/dbraw/zinc/79/90/40/1127799040.db2.gz UHIUAKVAROPBOS-RYUDHWBXSA-N 1 0 330.388 3.874 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])cc1C)[NH+](C)C ZINC000301448999 1127892477 /nfs/dbraw/zinc/89/24/77/1127892477.db2.gz RUMMKKPWIPGWLZ-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO COc1cc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)ccc1[N+](=O)[O-] ZINC000301568750 1128498055 /nfs/dbraw/zinc/49/80/55/1128498055.db2.gz XEMCVUWMSJTRLK-MRXNPFEDSA-N 1 0 347.459 3.696 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301567428 1128498182 /nfs/dbraw/zinc/49/81/82/1128498182.db2.gz KBXQKMSBTKOTBV-GHMZBOCLSA-N 1 0 342.237 3.642 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765849804 1128581567 /nfs/dbraw/zinc/58/15/67/1128581567.db2.gz QYQCRXXKFBDQMK-QZTJIDSGSA-N 1 0 326.396 3.640 20 5 EHBDRO CC(C)[C@@H](CO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089112 1128615387 /nfs/dbraw/zinc/61/53/87/1128615387.db2.gz RNOIWMDGILABPR-MJGOQNOKSA-N 1 0 328.412 3.538 20 5 EHBDRO Cc1ccc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000273585634 1128600844 /nfs/dbraw/zinc/60/08/44/1128600844.db2.gz BQCLMKSSUZINTN-UHFFFAOYSA-N 1 0 340.423 3.823 20 5 EHBDRO C[N@@H+]1CC[C@@H](c2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000624749436 1128627507 /nfs/dbraw/zinc/62/75/07/1128627507.db2.gz MUCGIVLQYZJOGR-CYBMUJFWSA-N 1 0 330.391 3.857 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000462793146 1128715170 /nfs/dbraw/zinc/71/51/70/1128715170.db2.gz YJEMMGASFUQBGE-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC[C@H]([NH2+]Cc1cnn(CC2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000921817548 1128785765 /nfs/dbraw/zinc/78/57/65/1128785765.db2.gz KTLZIMIHUWGLHY-SFHVURJKSA-N 1 0 328.416 3.832 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1ccc(C)cc1C ZINC001648946623 1120248161 /nfs/dbraw/zinc/24/81/61/1120248161.db2.gz SBPOQZPNBHLHGJ-UHFFFAOYSA-N 1 0 328.412 3.943 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nc(C(C)(C)C)no1 ZINC000191573500 1120679583 /nfs/dbraw/zinc/67/95/83/1120679583.db2.gz WLXPVLJVQDJWCM-CHWSQXEVSA-N 1 0 346.431 3.947 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H](O)c2ccc(F)cc2F)C2CC2)c1 ZINC000153327308 1120965601 /nfs/dbraw/zinc/96/56/01/1120965601.db2.gz RHDZMKZRDSJDBW-GOSISDBHSA-N 1 0 348.349 3.571 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000542545473 1121002148 /nfs/dbraw/zinc/00/21/48/1121002148.db2.gz QZIXZAOWLIHXJY-HUUCEWRRSA-N 1 0 344.411 3.764 20 5 EHBDRO Cc1nc([C@@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cs1 ZINC000272260960 1121139001 /nfs/dbraw/zinc/13/90/01/1121139001.db2.gz AOISXRYGJHQVDH-SECBINFHSA-N 1 0 325.821 3.906 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)[C@H]3CCCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000542977378 1128982362 /nfs/dbraw/zinc/98/23/62/1128982362.db2.gz FSJCNUHSBLNQES-JOQOYGCGSA-N 1 0 345.443 3.742 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccc([N+](=O)[O-])cc2F)cc1 ZINC000487977432 1121419349 /nfs/dbraw/zinc/41/93/49/1121419349.db2.gz JRGKRIWTSSTYND-UHFFFAOYSA-N 1 0 347.390 3.677 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311162901 1128984816 /nfs/dbraw/zinc/98/48/16/1128984816.db2.gz PZIWBSAGHGOIJV-MRXNPFEDSA-N 1 0 341.411 3.537 20 5 EHBDRO CCOc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OCC ZINC000609222576 1121523375 /nfs/dbraw/zinc/52/33/75/1121523375.db2.gz RQXSNDQVDVMRQB-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724055 1128994008 /nfs/dbraw/zinc/99/40/08/1128994008.db2.gz OOUGQRCVZABZGV-WCQYABFASA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@H]([NH+]2CCCC2)C1 ZINC000301095853 1121596531 /nfs/dbraw/zinc/59/65/31/1121596531.db2.gz MRLGVMWOPPJPQR-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(Cl)cc3c2OCC3)cc1 ZINC000322583008 1121658642 /nfs/dbraw/zinc/65/86/42/1121658642.db2.gz UVQWOZBGPYDBRM-UHFFFAOYSA-N 1 0 332.787 3.515 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000090653955 1121669689 /nfs/dbraw/zinc/66/96/89/1121669689.db2.gz DMEUQOLFEGEQMJ-QMTMVMCOSA-N 1 0 328.412 3.546 20 5 EHBDRO C[C@H](O)[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536206 1121683623 /nfs/dbraw/zinc/68/36/23/1121683623.db2.gz OCUXWHABLIVFPY-STQMWFEESA-N 1 0 332.425 3.526 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000193855421 1121721683 /nfs/dbraw/zinc/72/16/83/1121721683.db2.gz CSKRLVIBGUYMCU-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000194014063 1121752855 /nfs/dbraw/zinc/75/28/55/1121752855.db2.gz FYTVYQZDXQHHIN-HNNXBMFYSA-N 1 0 327.384 3.583 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143281 1121784361 /nfs/dbraw/zinc/78/43/61/1121784361.db2.gz OXLCSTUULHJZSO-DOMZBBRYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(=O)c1c(NC[C@@H](c2cccs2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207838 1121876298 /nfs/dbraw/zinc/87/62/98/1121876298.db2.gz ZZAXQRQPFRHTII-AWEZNQCLSA-N 1 0 333.413 3.574 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000917092487 1122493837 /nfs/dbraw/zinc/49/38/37/1122493837.db2.gz VHCAJSZOYLPBBT-UHFFFAOYSA-N 1 0 325.840 3.805 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC(CCC[NH+]2CCCC2)CC1 ZINC000301779392 1129061222 /nfs/dbraw/zinc/06/12/22/1129061222.db2.gz IEIRDHGRNSIYSK-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC(=O)c1ccc(NC[C@]2([NH+](C)C)CCC[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000497648374 1122616233 /nfs/dbraw/zinc/61/62/33/1122616233.db2.gz SGKXHURWVMWBHO-ACJLOTCBSA-N 1 0 333.432 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1cccs1)N(C)C ZINC000155069881 1123130224 /nfs/dbraw/zinc/13/02/24/1123130224.db2.gz KOZOUQVCKGFFEZ-CJNGLKHVSA-N 1 0 333.457 3.918 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1cccs1)N(C)C ZINC000155070081 1123130237 /nfs/dbraw/zinc/13/02/37/1123130237.db2.gz KOZOUQVCKGFFEZ-CZUORRHYSA-N 1 0 333.457 3.918 20 5 EHBDRO COC[C@@H]1CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000556909062 1123196395 /nfs/dbraw/zinc/19/63/95/1123196395.db2.gz UVWFDJWBVDYRSI-LBPRGKRZSA-N 1 0 336.775 3.729 20 5 EHBDRO CN(c1ccccc1)C1CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065956307 1129114781 /nfs/dbraw/zinc/11/47/81/1129114781.db2.gz RNAAAUDVXJSCML-UHFFFAOYSA-N 1 0 325.412 3.696 20 5 EHBDRO CCC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C[C@H]1CCCCO1 ZINC000609314337 1123354749 /nfs/dbraw/zinc/35/47/49/1123354749.db2.gz DNXVISRUMCSBLO-GOSISDBHSA-N 1 0 336.432 3.645 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+]2CCCC2)cc1 ZINC000609383690 1123567515 /nfs/dbraw/zinc/56/75/15/1123567515.db2.gz HTHTYWULAKLZAZ-GOSISDBHSA-N 1 0 340.427 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)cc1 ZINC000609916593 1123692052 /nfs/dbraw/zinc/69/20/52/1123692052.db2.gz ZRTSHNMBEUJKNB-KRWDZBQOSA-N 1 0 328.387 3.841 20 5 EHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000610001844 1123710538 /nfs/dbraw/zinc/71/05/38/1123710538.db2.gz DSIHTARBBOQNJP-GUYCJALGSA-N 1 0 334.416 3.862 20 5 EHBDRO CC(C)([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000179600574 1123800237 /nfs/dbraw/zinc/80/02/37/1123800237.db2.gz KGGUARYWKHHOMR-UHFFFAOYSA-N 1 0 347.802 3.712 20 5 EHBDRO Cn1cc(C[NH2+]CCC2=CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237910768 1123914738 /nfs/dbraw/zinc/91/47/38/1123914738.db2.gz XXTRLHUEQBKHFK-UHFFFAOYSA-N 1 0 340.427 3.975 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2ccnn2C)C(C)C)cccc1[N+](=O)[O-] ZINC000615967236 1123919458 /nfs/dbraw/zinc/91/94/58/1123919458.db2.gz WYZHBOALTWTEIR-HOCLYGCPSA-N 1 0 330.432 3.727 20 5 EHBDRO Cc1cc(NC[C@H](c2ccco2)[NH+]2CCCCC2)ncc1[N+](=O)[O-] ZINC000080585023 1124534940 /nfs/dbraw/zinc/53/49/40/1124534940.db2.gz RGKNRXDMKYUSDP-OAHLLOKOSA-N 1 0 330.388 3.530 20 5 EHBDRO C[C@@H](C(=O)Nc1cccc(C[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1F ZINC000182644361 1125349104 /nfs/dbraw/zinc/34/91/04/1125349104.db2.gz CLHKKHHYGPSZDA-GFCCVEGCSA-N 1 0 345.374 3.538 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000182917038 1125400823 /nfs/dbraw/zinc/40/08/23/1125400823.db2.gz WYNOSICQFAETKU-HNNXBMFYSA-N 1 0 341.411 3.525 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000182947070 1125404305 /nfs/dbraw/zinc/40/43/05/1125404305.db2.gz SUHYITKDXIUBRL-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC[C@H](C)[C@@H](C)[NH2+]Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000183084319 1125435463 /nfs/dbraw/zinc/43/54/63/1125435463.db2.gz MGBRKBGLKXYKQT-VHSXEESVSA-N 1 0 332.347 3.729 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@@H+]1C1CC1 ZINC000301846026 1129192301 /nfs/dbraw/zinc/19/23/01/1129192301.db2.gz ALBPLEWMCWDQED-UKRRQHHQSA-N 1 0 338.411 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)nc1-c1ccccc1 ZINC000301880115 1129249896 /nfs/dbraw/zinc/24/98/96/1129249896.db2.gz PCZQYXPTVMVTRD-CVEARBPZSA-N 1 0 338.411 3.696 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C(C)C)C2CCCC2)cccc1[N+](=O)[O-] ZINC000068449286 1129371748 /nfs/dbraw/zinc/37/17/48/1129371748.db2.gz QEBOKEMHOGNRQS-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@]2(C)CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543400011 1129460658 /nfs/dbraw/zinc/46/06/58/1129460658.db2.gz SPSZYAYTNANOBL-RBUKOAKNSA-N 1 0 344.411 3.998 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000328113002 1129548459 /nfs/dbraw/zinc/54/84/59/1129548459.db2.gz UYTPKRJJDIVYOW-NUJGCVRESA-N 1 0 348.443 3.509 20 5 EHBDRO CCN(CC)c1ncc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000922543795 1129569227 /nfs/dbraw/zinc/56/92/27/1129569227.db2.gz VHVBFASAXSFPOD-GFCCVEGCSA-N 1 0 334.445 3.748 20 5 EHBDRO C[C@@H](O)CC[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000093481656 1129590444 /nfs/dbraw/zinc/59/04/44/1129590444.db2.gz WQZOHBGGYQFGQC-CYBMUJFWSA-N 1 0 348.374 3.729 20 5 EHBDRO Cc1ccc(CN2CCO[C@@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638060 1129597657 /nfs/dbraw/zinc/59/76/57/1129597657.db2.gz AFONHTKGFSENQT-FQEVSTJZSA-N 1 0 338.407 3.577 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964471 1129602052 /nfs/dbraw/zinc/60/20/52/1129602052.db2.gz WOADWVKXAQVIIQ-WMLDXEAASA-N 1 0 329.400 3.676 20 5 EHBDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000093870959 1129606388 /nfs/dbraw/zinc/60/63/88/1129606388.db2.gz IVSKNOBZTSCLSP-LBPRGKRZSA-N 1 0 342.461 3.576 20 5 EHBDRO C[N@H+](CCn1cccn1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000125251158 1129674073 /nfs/dbraw/zinc/67/40/73/1129674073.db2.gz KAHOIZYLBTWDJJ-UHFFFAOYSA-N 1 0 342.424 3.652 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCC[C@@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000155953816 1129682397 /nfs/dbraw/zinc/68/23/97/1129682397.db2.gz WALVXTPQOCDSRE-XIRDDKMYSA-N 1 0 328.416 3.934 20 5 EHBDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000132403543 1129898622 /nfs/dbraw/zinc/89/86/22/1129898622.db2.gz LJYQSGXYTKVIHI-CYBMUJFWSA-N 1 0 330.384 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]3[C@@H]3CCCO3)o2)cc1 ZINC000556620410 1129913854 /nfs/dbraw/zinc/91/38/54/1129913854.db2.gz ZXHACWCQRLSJRR-MJGOQNOKSA-N 1 0 342.395 3.998 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509049 1129974530 /nfs/dbraw/zinc/97/45/30/1129974530.db2.gz SQGZRWBBRNFERJ-DLBZAZTESA-N 1 0 328.416 3.837 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000700734691 1130066873 /nfs/dbraw/zinc/06/68/73/1130066873.db2.gz RVHFNMFCPNEHPF-DVOMOZLQSA-N 1 0 349.431 3.643 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCCC1 ZINC000039536600 1130139739 /nfs/dbraw/zinc/13/97/39/1130139739.db2.gz VRTYTRAFFISYBO-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO CC[C@@H](NCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000173212258 1130196816 /nfs/dbraw/zinc/19/68/16/1130196816.db2.gz BTBXBYQTRUUUIP-CQSZACIVSA-N 1 0 349.337 3.552 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccco1 ZINC000173363647 1130219264 /nfs/dbraw/zinc/21/92/64/1130219264.db2.gz MYYMDQJYYMCLPG-RHSMWYFYSA-N 1 0 331.416 3.922 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@H](C)O1 ZINC000245557744 1130237536 /nfs/dbraw/zinc/23/75/36/1130237536.db2.gz AZYCNJAXBFQCSM-DABQJJPHSA-N 1 0 347.440 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000173867794 1130321628 /nfs/dbraw/zinc/32/16/28/1130321628.db2.gz RZYFLCUNUNJIAV-AWEZNQCLSA-N 1 0 337.851 3.556 20 5 EHBDRO C[C@H](C[NH+]1CCCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000042322226 1130383468 /nfs/dbraw/zinc/38/34/68/1130383468.db2.gz LBFVWCUVCYRIOB-LLVKDONJSA-N 1 0 342.237 3.644 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208669 1130779681 /nfs/dbraw/zinc/77/96/81/1130779681.db2.gz CSRIBIGJRIOEQO-RYUDHWBXSA-N 1 0 334.445 3.737 20 5 EHBDRO CC[C@H](C)[C@@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150031 1131693340 /nfs/dbraw/zinc/69/33/40/1131693340.db2.gz TYFOILBQSHBOSC-HOCLYGCPSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOC3CCC3)s2)cc1 ZINC000742387758 1131714128 /nfs/dbraw/zinc/71/41/28/1131714128.db2.gz VVDYQXMLHIIMAK-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1ccccc1F)CC2 ZINC001172897123 1131880315 /nfs/dbraw/zinc/88/03/15/1131880315.db2.gz XKXCABZLYBSVQG-QGZVFWFLSA-N 1 0 328.387 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(Cl)nc1)CC2 ZINC001172896952 1131881303 /nfs/dbraw/zinc/88/13/03/1131881303.db2.gz UVCXRLMGYSJELU-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCC1(O)CCCCC1)CC2 ZINC001172899525 1131882347 /nfs/dbraw/zinc/88/23/47/1131882347.db2.gz OAEITDBJUBCJSA-KRWDZBQOSA-N 1 0 332.444 3.517 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172901094 1131883644 /nfs/dbraw/zinc/88/36/44/1131883644.db2.gz JJSDFNLWUIGXGD-HKUYNNGSSA-N 1 0 325.412 3.978 20 5 EHBDRO CC(=O)[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172901661 1131884536 /nfs/dbraw/zinc/88/45/36/1131884536.db2.gz PRNYAYTUACMKCI-AZUAARDMSA-N 1 0 338.407 3.762 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172902366 1131884818 /nfs/dbraw/zinc/88/48/18/1131884818.db2.gz XTGBLMHVJCFABP-PBHICJAKSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCc3cnccc31)CC2 ZINC001172905357 1131885819 /nfs/dbraw/zinc/88/58/19/1131885819.db2.gz JEZNNWKHHHKGRD-FXAWDEMLSA-N 1 0 337.423 3.904 20 5 EHBDRO CCCCCN1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172916522 1131904091 /nfs/dbraw/zinc/90/40/91/1131904091.db2.gz TWIYJNDBZKITQD-IBGZPJMESA-N 1 0 345.487 3.650 20 5 EHBDRO C[NH2+]Cc1cccc(N[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172920975 1131905173 /nfs/dbraw/zinc/90/51/73/1131905173.db2.gz MXWYLWUFPZIAKN-QGZVFWFLSA-N 1 0 325.412 3.674 20 5 EHBDRO COc1cccc2c1C[N@@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172921012 1131905820 /nfs/dbraw/zinc/90/58/20/1131905820.db2.gz NXVUQSHNRNJYDO-QGZVFWFLSA-N 1 0 338.407 3.867 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOc1cccc(F)c1)CC2 ZINC001172911959 1131917740 /nfs/dbraw/zinc/91/77/40/1131917740.db2.gz LAUNEQFMEJDFGQ-QGZVFWFLSA-N 1 0 344.386 3.650 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2ccc(O)cc2)c1F ZINC001173180595 1131992381 /nfs/dbraw/zinc/99/23/81/1131992381.db2.gz WZSWYDHLNNPQLE-RYUDHWBXSA-N 1 0 348.374 3.730 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001173189250 1131994882 /nfs/dbraw/zinc/99/48/82/1131994882.db2.gz JXACYPBALGSAIC-QWRGUYRKSA-N 1 0 346.349 3.651 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2)c1F ZINC001173194209 1131995368 /nfs/dbraw/zinc/99/53/68/1131995368.db2.gz YTZPEULTTIGPDG-DUVNUKRYSA-N 1 0 344.386 3.819 20 5 EHBDRO CCOC(=O)c1csc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173219271 1132002839 /nfs/dbraw/zinc/00/28/39/1132002839.db2.gz AGAHLAORDUQAPP-GFCCVEGCSA-N 1 0 348.424 3.554 20 5 EHBDRO COCCc1cccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173218427 1132003687 /nfs/dbraw/zinc/00/36/87/1132003687.db2.gz JRZLTYDYRYSMIU-OAHLLOKOSA-N 1 0 328.412 3.505 20 5 EHBDRO CCOC(=O)[C@]1(C)CCCC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223253 1132005621 /nfs/dbraw/zinc/00/56/21/1132005621.db2.gz ZEFPSUGKFYKGCA-DNVCBOLYSA-N 1 0 348.443 3.581 20 5 EHBDRO Cc1noc2ccc(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)cc12 ZINC001173222618 1132005931 /nfs/dbraw/zinc/00/59/31/1132005931.db2.gz XTFAWFLQWZROCO-GFCCVEGCSA-N 1 0 325.368 3.765 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccccn2)CC1 ZINC001173226104 1132006912 /nfs/dbraw/zinc/00/69/12/1132006912.db2.gz HQCBXPXDEFQIJD-OAHLLOKOSA-N 1 0 325.412 3.800 20 5 EHBDRO Cc1ccnc(C2(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173230187 1132007802 /nfs/dbraw/zinc/00/78/02/1132007802.db2.gz ROHBEDQEKNMKFV-OAHLLOKOSA-N 1 0 325.412 3.551 20 5 EHBDRO Cc1cncc([C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229273 1132008067 /nfs/dbraw/zinc/00/80/67/1132008067.db2.gz SEOMDEIXXWYZDX-AUUYWEPGSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(c2ccccc2)CC1 ZINC001173231973 1132008939 /nfs/dbraw/zinc/00/89/39/1132008939.db2.gz BQUJILQXXWZLOY-MRXNPFEDSA-N 1 0 339.439 3.784 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ncccc1F)C1CC1 ZINC001173230557 1132009275 /nfs/dbraw/zinc/00/92/75/1132009275.db2.gz RXMFQNAMAZRWFE-SJCJKPOMSA-N 1 0 329.375 3.801 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173212995 1132013965 /nfs/dbraw/zinc/01/39/65/1132013965.db2.gz FBNWQUPRDVACSR-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c2cc(Cl)ccc2nc1C[NH3+] ZINC001173214508 1132014639 /nfs/dbraw/zinc/01/46/39/1132014639.db2.gz OJISQYDYCKHJFO-LLVKDONJSA-N 1 0 344.802 3.860 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2c(F)cccc21 ZINC001173214529 1132015274 /nfs/dbraw/zinc/01/52/74/1132015274.db2.gz OOUUPCLYLYWSIO-SJCJKPOMSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1ccc(OCC[N@H+]2Cc3ccccc3[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000744385192 1132086231 /nfs/dbraw/zinc/08/62/31/1132086231.db2.gz MXXGFTSPRNBWMS-AWEZNQCLSA-N 1 0 342.395 3.602 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccc(C)nc1 ZINC001174282938 1132297327 /nfs/dbraw/zinc/29/73/27/1132297327.db2.gz ZDTZXEVQDBNKCY-UHFFFAOYSA-N 1 0 344.418 3.947 20 5 EHBDRO COc1cc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)c(OC)nn1 ZINC001174354121 1132318121 /nfs/dbraw/zinc/31/81/21/1132318121.db2.gz XDHHAUZAYGRZEI-UHFFFAOYSA-N 1 0 347.378 3.521 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746027041 1132350864 /nfs/dbraw/zinc/35/08/64/1132350864.db2.gz UNIYPAWQKBTLCK-UHFFFAOYSA-N 1 0 342.374 3.952 20 5 EHBDRO CC(C)CC[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCC1 ZINC000746064581 1132362561 /nfs/dbraw/zinc/36/25/61/1132362561.db2.gz NDZDMMMTDGLLTC-UHFFFAOYSA-N 1 0 347.415 3.751 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@H](C)C1CCCCC1 ZINC001175229302 1132601986 /nfs/dbraw/zinc/60/19/86/1132601986.db2.gz NXYRXZVCJYAISE-HNNXBMFYSA-N 1 0 347.459 3.990 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@@H](c2ccc(F)cc2)C1(C)C ZINC001175231029 1132602447 /nfs/dbraw/zinc/60/24/47/1132602447.db2.gz ZQKVSDZEWUUWLZ-INIZCTEOSA-N 1 0 346.406 3.507 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168978657 1132617738 /nfs/dbraw/zinc/61/77/38/1132617738.db2.gz UBCHZXFDNJQYBD-NEPJUHHUSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cc(-c3cccc(Cl)c3)no2)C1 ZINC001168983828 1132619029 /nfs/dbraw/zinc/61/90/29/1132619029.db2.gz LKUZYDACGKWBNH-SMDDNHRTSA-N 1 0 335.791 3.530 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009704 1132631566 /nfs/dbraw/zinc/63/15/66/1132631566.db2.gz XHOMEXLSPXELQL-RBUKOAKNSA-N 1 0 325.412 3.529 20 5 EHBDRO Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169024901 1132640656 /nfs/dbraw/zinc/64/06/56/1132640656.db2.gz SHPVFCHEDHPRNL-AEFFLSMTSA-N 1 0 328.456 3.720 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3ccc(F)cc32)C1 ZINC001169049671 1132642901 /nfs/dbraw/zinc/64/29/01/1132642901.db2.gz XSMDBWXZLLUZOM-CJNGLKHVSA-N 1 0 345.418 3.865 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cc3cnccc3o2)cc1[N+](=O)[O-] ZINC001175638578 1132719738 /nfs/dbraw/zinc/71/97/38/1132719738.db2.gz ODPKVKGYHYKNHT-LLVKDONJSA-N 1 0 327.340 3.595 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(Nc3cc([N+](=O)[O-])ccc3F)cccc21 ZINC001175737410 1132748984 /nfs/dbraw/zinc/74/89/84/1132748984.db2.gz SFNROOFLRQHVOF-INIZCTEOSA-N 1 0 331.347 3.863 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnc(-c2ccccc2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC001176027710 1132823485 /nfs/dbraw/zinc/82/34/85/1132823485.db2.gz BOSGQXCQTTVGFP-CQSZACIVSA-N 1 0 334.379 3.903 20 5 EHBDRO CC(C)[C@@](O)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001176036383 1132825404 /nfs/dbraw/zinc/82/54/04/1132825404.db2.gz LCKDBRAELFVWQO-KXBFYZLASA-N 1 0 328.412 3.789 20 5 EHBDRO C[NH+](C)CCC(C)(C)Nc1c(Br)cc(F)cc1[N+](=O)[O-] ZINC001169718430 1132833654 /nfs/dbraw/zinc/83/36/54/1132833654.db2.gz ULVDVWWZFMYJSF-UHFFFAOYSA-N 1 0 348.216 3.639 20 5 EHBDRO Cc1ccc(F)c(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001169822142 1132870808 /nfs/dbraw/zinc/87/08/08/1132870808.db2.gz SDZHTTMUACJEDG-UHFFFAOYSA-N 1 0 332.375 3.943 20 5 EHBDRO COc1cc[nH+]c(NCc2ccc(-c3ccccc3[N+](=O)[O-])o2)c1 ZINC001178382993 1133161418 /nfs/dbraw/zinc/16/14/18/1133161418.db2.gz SWVFABKBSJFFGP-UHFFFAOYSA-N 1 0 325.324 3.871 20 5 EHBDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178558036 1133181126 /nfs/dbraw/zinc/18/11/26/1133181126.db2.gz WZZVXNVXEDJJGQ-WDEREUQCSA-N 1 0 327.222 3.883 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C[C@@H]1CCCC1(F)F ZINC001178746000 1133194927 /nfs/dbraw/zinc/19/49/27/1133194927.db2.gz BIVHCWDNRSPHDP-VIFPVBQESA-N 1 0 349.175 3.882 20 5 EHBDRO CCC[C@H](C)[C@@H](CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179082355 1133227589 /nfs/dbraw/zinc/22/75/89/1133227589.db2.gz XLBQUFAJJXQODY-SUMWQHHRSA-N 1 0 332.400 3.742 20 5 EHBDRO C[N@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)C(C1CC1)C1CC1 ZINC000769192626 1133233508 /nfs/dbraw/zinc/23/35/08/1133233508.db2.gz MVZJDSYUOYKZBJ-UHFFFAOYSA-N 1 0 339.233 3.978 20 5 EHBDRO C[C@@H]1COCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000769455710 1133294623 /nfs/dbraw/zinc/29/46/23/1133294623.db2.gz JLWATHFTVWMJCA-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C1CC(c2ccc(F)cc2F)C1 ZINC001180311258 1133355427 /nfs/dbraw/zinc/35/54/27/1133355427.db2.gz ZQIQZWJGCNDPMQ-UHFFFAOYSA-N 1 0 348.349 3.917 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001182327205 1133634221 /nfs/dbraw/zinc/63/42/21/1133634221.db2.gz QCMOPJHWXLYMDT-AWEZNQCLSA-N 1 0 345.365 3.528 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H](O)c2cc(F)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000785608243 1133726306 /nfs/dbraw/zinc/72/63/06/1133726306.db2.gz FUJJEOMZLWVXMW-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COc2cc(F)ccc2C1 ZINC001182960479 1133751592 /nfs/dbraw/zinc/75/15/92/1133751592.db2.gz RZDYKXUBHWXLEI-DYVFJYSZSA-N 1 0 344.386 3.648 20 5 EHBDRO Cc1ccnc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC001183596790 1133832710 /nfs/dbraw/zinc/83/27/10/1133832710.db2.gz CQRNYCIEBJSXAU-CRAIPNDOSA-N 1 0 325.412 3.799 20 5 EHBDRO COC(=O)CC[C@@H]1CCC[N@H+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)C1 ZINC001183631245 1133839466 /nfs/dbraw/zinc/83/94/66/1133839466.db2.gz QIQOAOGRRADIJI-QZFKAFNDSA-N 1 0 346.427 3.663 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](CCO)c1cccs1 ZINC000786816008 1133910364 /nfs/dbraw/zinc/91/03/64/1133910364.db2.gz VEQWRPPVOMSCPU-DDKJEQMHSA-N 1 0 332.425 3.773 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1ccc(F)cc1 ZINC000786819387 1133911175 /nfs/dbraw/zinc/91/11/75/1133911175.db2.gz BVYCCROTPWBWHT-NRJHKNTJSA-N 1 0 344.386 3.635 20 5 EHBDRO C[C@@H](OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877270 1133916227 /nfs/dbraw/zinc/91/62/27/1133916227.db2.gz CDKQUPUZLPHLKS-DYVFJYSZSA-N 1 0 332.400 3.606 20 5 EHBDRO C[C@@H](OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000786879803 1133922971 /nfs/dbraw/zinc/92/29/71/1133922971.db2.gz DVQCHOSYMBRABG-CXAGYDPISA-N 1 0 332.400 3.606 20 5 EHBDRO CCC(CC)[C@H](CNc1nccc2c1cccc2[N+](=O)[O-])[NH+](C)C ZINC001184740580 1133986260 /nfs/dbraw/zinc/98/62/60/1133986260.db2.gz REFLJVMQSBUXCL-KRWDZBQOSA-N 1 0 330.432 3.921 20 5 EHBDRO COc1ccccc1CC[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746667345 1133986950 /nfs/dbraw/zinc/98/69/50/1133986950.db2.gz YZFBSCWOLIKGDH-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000774835382 1134036872 /nfs/dbraw/zinc/03/68/72/1134036872.db2.gz KTMKDNLHIFCJAA-UHFFFAOYSA-N 1 0 341.367 3.710 20 5 EHBDRO O=C(O[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000788120039 1134080112 /nfs/dbraw/zinc/08/01/12/1134080112.db2.gz PQAPPXSIVUFZQG-GXTWGEPZSA-N 1 0 346.408 3.593 20 5 EHBDRO C[C@H]([NH2+]CCc1csc(C(C)(C)C)n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788690199 1134157582 /nfs/dbraw/zinc/15/75/82/1134157582.db2.gz WMUOIXXBLGRIEG-NSHDSACASA-N 1 0 348.472 3.824 20 5 EHBDRO CCO[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000788772829 1134173832 /nfs/dbraw/zinc/17/38/32/1134173832.db2.gz BIJBGHUJPVTSAC-ACJLOTCBSA-N 1 0 329.400 3.605 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCCC[C@@H]2[C@@H]2CCOC2)c1 ZINC000788984033 1134200392 /nfs/dbraw/zinc/20/03/92/1134200392.db2.gz MILATKUZXTVXES-SRCQZFHVSA-N 1 0 338.835 3.933 20 5 EHBDRO CN(c1cccc(C(F)(F)F)c1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC001186422525 1134216711 /nfs/dbraw/zinc/21/67/11/1134216711.db2.gz WUTDDUQFVJFWCA-FOSCPWQOSA-N 1 0 343.349 3.675 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC001187371701 1134328075 /nfs/dbraw/zinc/32/80/75/1134328075.db2.gz RLNROLMKIIQTDZ-UHFFFAOYSA-N 1 0 334.445 3.879 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCC1 ZINC000789778251 1134333295 /nfs/dbraw/zinc/33/32/95/1134333295.db2.gz HOZPRYSOABTDHH-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000775387312 1134701212 /nfs/dbraw/zinc/70/12/12/1134701212.db2.gz WYBUIKIVMRGEHD-ZNZDAUKMSA-N 1 0 326.396 3.541 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(F)c(C)c2)c([N+](=O)[O-])c1 ZINC001170295772 1134737212 /nfs/dbraw/zinc/73/72/12/1134737212.db2.gz DYZKXRFYEDJJIJ-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170297796 1134738187 /nfs/dbraw/zinc/73/81/87/1134738187.db2.gz SGXVNXAAYPWVPN-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2c(C)cccc2C)c([N+](=O)[O-])c1 ZINC001170304479 1134738960 /nfs/dbraw/zinc/73/89/60/1134738960.db2.gz CHDBOBGHMASYEP-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3sccc32)c([N+](=O)[O-])c1 ZINC001170326361 1134748533 /nfs/dbraw/zinc/74/85/33/1134748533.db2.gz HXRZVCBMIGBULY-NHYWBVRUSA-N 1 0 332.425 3.873 20 5 EHBDRO O=[N+]([O-])c1ncccc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170330526 1134750414 /nfs/dbraw/zinc/75/04/14/1134750414.db2.gz ABHXEFLWDQNEPQ-OSYLJGHBSA-N 1 0 338.411 3.597 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1cccnc1 ZINC001170306522 1134752516 /nfs/dbraw/zinc/75/25/16/1134752516.db2.gz WWEJNFIQUJRWFR-GUYCJALGSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(Cl)Cl ZINC000792909803 1134823240 /nfs/dbraw/zinc/82/32/40/1134823240.db2.gz OZJDRHWDGDUFFF-UONOGXRCSA-N 1 0 345.226 3.619 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnn(C[NH+]3CCC(C4CC4)CC3)c2)c1 ZINC000793632239 1134975484 /nfs/dbraw/zinc/97/54/84/1134975484.db2.gz RROBYLNNOMAVLD-UHFFFAOYSA-N 1 0 326.400 3.538 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617518 1135041087 /nfs/dbraw/zinc/04/10/87/1135041087.db2.gz UPOSFOPNHBMSFY-ZWKOTPCHSA-N 1 0 348.349 3.647 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2ccc3nsnc3c2[N+](=O)[O-])CC1(C)C ZINC001170451465 1135073053 /nfs/dbraw/zinc/07/30/53/1135073053.db2.gz NLTBGBCWUMZTKT-UHFFFAOYSA-N 1 0 349.460 3.663 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H]1OC ZINC001194091443 1135231924 /nfs/dbraw/zinc/23/19/24/1135231924.db2.gz MOPADTJBXWQUQK-HUUCEWRRSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H](c1ccccc1)[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CCCC1 ZINC001194176596 1135237990 /nfs/dbraw/zinc/23/79/90/1135237990.db2.gz OMVVTGCARCXUED-CQSZACIVSA-N 1 0 328.416 3.834 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H](C)C(C)(C)C ZINC001197601742 1135713820 /nfs/dbraw/zinc/71/38/20/1135713820.db2.gz KHLSFVDDEDBNST-CQSZACIVSA-N 1 0 335.448 3.846 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1Cl ZINC001197657407 1135717321 /nfs/dbraw/zinc/71/73/21/1135717321.db2.gz BGXZXRSYRWXCJX-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1COc2ccccc2[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728428 1135723803 /nfs/dbraw/zinc/72/38/03/1135723803.db2.gz DUCARYJTAXLGNT-YQVWRLOYSA-N 1 0 342.395 3.520 20 5 EHBDRO [NH3+]CCN(Cc1csc(Cl)c1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000809736441 1135874401 /nfs/dbraw/zinc/87/44/01/1135874401.db2.gz UYZOPKAGUPLDOA-UHFFFAOYSA-N 1 0 346.239 3.928 20 5 EHBDRO C[C@H](CO)[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCC1 ZINC000809999426 1135912430 /nfs/dbraw/zinc/91/24/30/1135912430.db2.gz HLFBNPMPKMLSDK-SNVBAGLBSA-N 1 0 347.242 3.885 20 5 EHBDRO CC1(C2CC2)CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000810064577 1135919823 /nfs/dbraw/zinc/91/98/23/1135919823.db2.gz KRGKGMBMLWCXRK-UHFFFAOYSA-N 1 0 349.406 3.575 20 5 EHBDRO CC(C)[C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001201692462 1136057441 /nfs/dbraw/zinc/05/74/41/1136057441.db2.gz AJVSCKVJEGZGCQ-GOEBONIOSA-N 1 0 326.824 3.584 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811373796 1136077994 /nfs/dbraw/zinc/07/79/94/1136077994.db2.gz OIBDEQKTXYJRPL-UHFFFAOYSA-N 1 0 349.214 3.790 20 5 EHBDRO C[C@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@@H]1O ZINC000811483105 1136091275 /nfs/dbraw/zinc/09/12/75/1136091275.db2.gz BWNCBPXZKNGYLH-DZGCQCFKSA-N 1 0 347.242 3.932 20 5 EHBDRO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2ccccc21 ZINC000776270563 1136123700 /nfs/dbraw/zinc/12/37/00/1136123700.db2.gz CTNWEHDRUXFYBE-RBUKOAKNSA-N 1 0 326.396 3.638 20 5 EHBDRO CC(C)[C@H]1c2ccccc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276666 1136131200 /nfs/dbraw/zinc/13/12/00/1136131200.db2.gz IRXVKSUNGNNAQF-UXHICEINSA-N 1 0 340.423 3.884 20 5 EHBDRO C[N@@H+](Cc1cccc2ccccc21)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776278274 1136133603 /nfs/dbraw/zinc/13/36/03/1136133603.db2.gz TTWUJJGIZSTBFB-HXUWFJFHSA-N 1 0 336.391 3.913 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2SCCS2)o1 ZINC000850401528 1136249977 /nfs/dbraw/zinc/24/99/77/1136249977.db2.gz IGWGTMYNXWOWBE-UHFFFAOYSA-N 1 0 336.438 3.751 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@H](O)c1ccc(C)cc1 ZINC000850468342 1136265317 /nfs/dbraw/zinc/26/53/17/1136265317.db2.gz BOMPPMDNXVNXJC-NJSLBKSFSA-N 1 0 344.411 3.685 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@](C)(O)c1ccccc1 ZINC000850477247 1136266912 /nfs/dbraw/zinc/26/69/12/1136266912.db2.gz RVHFBJJGKQXJLT-KSMMKXTCSA-N 1 0 344.411 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000813792391 1136363127 /nfs/dbraw/zinc/36/31/27/1136363127.db2.gz XYPWABKATJMUGU-AWEZNQCLSA-N 1 0 349.793 3.756 20 5 EHBDRO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000776580724 1136445110 /nfs/dbraw/zinc/44/51/10/1136445110.db2.gz ZGNAYPLDXVBUNY-UGSOOPFHSA-N 1 0 332.375 3.850 20 5 EHBDRO Cc1ccc(C(C)(C)C[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776586919 1136449424 /nfs/dbraw/zinc/44/94/24/1136449424.db2.gz AJAXYPYTNQVEMC-IBGZPJMESA-N 1 0 342.439 3.846 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H](c2ccco2)C1 ZINC000776589713 1136452944 /nfs/dbraw/zinc/45/29/44/1136452944.db2.gz VUPNDISZUILLIL-COXVUDFISA-N 1 0 330.384 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H](c2ccccc2)C2CCC2)cc1 ZINC000776591785 1136453034 /nfs/dbraw/zinc/45/30/34/1136453034.db2.gz HDXLLIQWLBYVTD-OALUTQOASA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1 ZINC000776606715 1136469781 /nfs/dbraw/zinc/46/97/81/1136469781.db2.gz ZZOKUGQEBBXDAF-INIZCTEOSA-N 1 0 332.787 3.561 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000776606654 1136470333 /nfs/dbraw/zinc/47/03/33/1136470333.db2.gz YVFFMIDYHKVJFT-RBUKOAKNSA-N 1 0 342.439 3.974 20 5 EHBDRO CC1(C)C[C@]1([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000852771737 1136484951 /nfs/dbraw/zinc/48/49/51/1136484951.db2.gz CJUMNAUDOWEHOP-MJGOQNOKSA-N 1 0 326.396 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000814641831 1136488098 /nfs/dbraw/zinc/48/80/98/1136488098.db2.gz LLGDTLVAUICKSI-PKOBYXMFSA-N 1 0 326.396 3.508 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000853243199 1136521657 /nfs/dbraw/zinc/52/16/57/1136521657.db2.gz ZAUHYXVILTUQDZ-UHFFFAOYSA-N 1 0 327.375 3.843 20 5 EHBDRO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000853618900 1136549737 /nfs/dbraw/zinc/54/97/37/1136549737.db2.gz OQWZVURJABSUPL-WCQYABFASA-N 1 0 325.359 3.595 20 5 EHBDRO Cc1cc(C)cc(OCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815568822 1136612299 /nfs/dbraw/zinc/61/22/99/1136612299.db2.gz VYRLCOHWUKDWSN-AWEZNQCLSA-N 1 0 329.400 3.523 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776752138 1136634346 /nfs/dbraw/zinc/63/43/46/1136634346.db2.gz ISUITBWLGWBVMB-LZWOXQAQSA-N 1 0 349.431 3.502 20 5 EHBDRO CC(C)c1ccc(C(=O)NCC(C)(C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC001135262285 1136647823 /nfs/dbraw/zinc/64/78/23/1136647823.db2.gz QCYJZRDUFOZCLO-UHFFFAOYSA-N 1 0 347.459 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2C2CC2)cc1Cl ZINC000816656710 1136745586 /nfs/dbraw/zinc/74/55/86/1136745586.db2.gz BJKUDHNADSIPBZ-INIZCTEOSA-N 1 0 336.819 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCC[C@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000817906657 1136845219 /nfs/dbraw/zinc/84/52/19/1136845219.db2.gz AQHNUWHMHALHJT-BHYGNILZSA-N 1 0 337.851 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCC[C@H]2[C@H]2CCCC[NH2+]2)c1 ZINC000817906662 1136845323 /nfs/dbraw/zinc/84/53/23/1136845323.db2.gz AQHNUWHMHALHJT-USXIJHARSA-N 1 0 337.851 3.649 20 5 EHBDRO CC[C@@H](CSc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819187751 1136921007 /nfs/dbraw/zinc/92/10/07/1136921007.db2.gz RXHVSROKYUESTF-YJBOKZPZSA-N 1 0 346.452 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(c3ccccc3Cl)CC2)c1 ZINC000819195569 1136922239 /nfs/dbraw/zinc/92/22/39/1136922239.db2.gz GFUQJMBXNXFISJ-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCC[C@H](c3ccccc3)C2)c1 ZINC000819262539 1136929816 /nfs/dbraw/zinc/92/98/16/1136929816.db2.gz OBZLSYDBNXJGFB-ILZDJORESA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CC[C@@H](c3cccc(F)c3)C2)cc1 ZINC000819280256 1136930637 /nfs/dbraw/zinc/93/06/37/1136930637.db2.gz ZOKISBNTIPDZIO-SZVBFZGTSA-N 1 0 344.386 3.693 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2C[C@@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000822807746 1137075075 /nfs/dbraw/zinc/07/50/75/1137075075.db2.gz FYFXULNJYNCFOR-CQDKDKBSSA-N 1 0 328.372 3.546 20 5 EHBDRO O=C(O[C@@H]1CC[N@@H+]2CCC[C@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738639 1137075962 /nfs/dbraw/zinc/07/59/62/1137075962.db2.gz CGGKGMVJLWTJDV-GOEBONIOSA-N 1 0 340.379 3.532 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2c(C)c(F)ccc2[N+](=O)[O-])c1 ZINC000843840497 1137185682 /nfs/dbraw/zinc/18/56/82/1137185682.db2.gz CSUPOPJWGQAMKU-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2(c3ccccc3Cl)CCC2)cc1 ZINC000844350516 1137214146 /nfs/dbraw/zinc/21/41/46/1137214146.db2.gz HBTVHXVDICBIDH-KRWDZBQOSA-N 1 0 346.814 3.951 20 5 EHBDRO COc1cc(C)c(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000865787281 1137311848 /nfs/dbraw/zinc/31/18/48/1137311848.db2.gz KHESUAVOXTVIOR-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCC3)CC2)c(C(F)F)c1 ZINC000865861377 1137317201 /nfs/dbraw/zinc/31/72/01/1137317201.db2.gz NHCKDIXTWAVPMM-UHFFFAOYSA-N 1 0 325.359 3.961 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@]34CCC[C@H]3OCC4)o2)c1 ZINC000865860272 1137317350 /nfs/dbraw/zinc/31/73/50/1137317350.db2.gz UHGXTCCEZBEDKX-MSOLQXFVSA-N 1 0 328.368 3.656 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCc2c1cccc2O ZINC000866260868 1137340188 /nfs/dbraw/zinc/34/01/88/1137340188.db2.gz OBXAZRBNPQTUBR-BDJLRTHQSA-N 1 0 330.359 3.648 20 5 EHBDRO CC(C)OC1CCC([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866309987 1137344174 /nfs/dbraw/zinc/34/41/74/1137344174.db2.gz RMNSSRLMDGWTKE-NVPAJSRCSA-N 1 0 338.423 3.991 20 5 EHBDRO Cn1cc([C@H]2C[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)CC2(C)C)cn1 ZINC000846933902 1137376264 /nfs/dbraw/zinc/37/62/64/1137376264.db2.gz XZIOEUMSLZXKQW-CQSZACIVSA-N 1 0 348.834 3.607 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1nccc2c1cccc2[N+](=O)[O-] ZINC001171301216 1137403290 /nfs/dbraw/zinc/40/32/90/1137403290.db2.gz MIGFCVYXCBPMKM-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO CCC(=O)c1ccc(N2CCCC[C@H]([NH+]3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000795093354 1137462638 /nfs/dbraw/zinc/46/26/38/1137462638.db2.gz LXWZGXDNAQEVFJ-INIZCTEOSA-N 1 0 345.443 3.642 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2cnc(C)s2)cc1[N+](=O)[O-] ZINC000773081121 1137464169 /nfs/dbraw/zinc/46/41/69/1137464169.db2.gz KUTPKRLSBXADNP-NSHDSACASA-N 1 0 335.429 3.652 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)cc1[N+](=O)[O-] ZINC000773134444 1137467461 /nfs/dbraw/zinc/46/74/61/1137467461.db2.gz JJMKOPUAKZLINO-YOENINGUSA-N 1 0 338.498 3.933 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)cccc1[N+](=O)[O-] ZINC000773140844 1137468605 /nfs/dbraw/zinc/46/86/05/1137468605.db2.gz VPDZPVOPQHKYKT-YOENINGUSA-N 1 0 338.498 3.933 20 5 EHBDRO COc1ccc(C[NH2+]C2CCc3ccccc3CC2)cc1[N+](=O)[O-] ZINC001649160890 1137487152 /nfs/dbraw/zinc/48/71/52/1137487152.db2.gz HMWTYWJAAOZRFN-UHFFFAOYSA-N 1 0 326.396 3.641 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCc2ccccc21 ZINC001171740043 1137511341 /nfs/dbraw/zinc/51/13/41/1137511341.db2.gz ARGUWPFDJFFWPP-CYBMUJFWSA-N 1 0 341.367 3.665 20 5 EHBDRO C[C@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033038 1137566620 /nfs/dbraw/zinc/56/66/20/1137566620.db2.gz AYNNCZPWEFRYRL-LBPRGKRZSA-N 1 0 349.381 3.785 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1c(F)cccc1[N+](=O)[O-] ZINC000872037735 1137566977 /nfs/dbraw/zinc/56/69/77/1137566977.db2.gz FQQRDPIBCNGGGC-NSHDSACASA-N 1 0 333.319 3.535 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC)C(F)(F)F ZINC000872056873 1137568555 /nfs/dbraw/zinc/56/85/55/1137568555.db2.gz UXNOOXFUNQRORQ-QPUJVOFHSA-N 1 0 338.351 3.545 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1c2ccccc2C[C@@H]1O ZINC000872084899 1137570484 /nfs/dbraw/zinc/57/04/84/1137570484.db2.gz VBRLAHITHNETHM-VOZBZGINSA-N 1 0 344.436 3.626 20 5 EHBDRO CCc1noc(C2CCC([NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000872128384 1137572966 /nfs/dbraw/zinc/57/29/66/1137572966.db2.gz NQZWSOLWVOBLEZ-HSBZDZAISA-N 1 0 344.415 3.917 20 5 EHBDRO Cc1nccnc1[C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000872133162 1137573467 /nfs/dbraw/zinc/57/34/67/1137573467.db2.gz KVPCEKKOYSYMEQ-ZOBUZTSGSA-N 1 0 340.427 3.755 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000872134413 1137573593 /nfs/dbraw/zinc/57/35/93/1137573593.db2.gz WBPWOYKQZUJVTH-LNLFQRSKSA-N 1 0 326.396 3.684 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873014704 1137588124 /nfs/dbraw/zinc/58/81/24/1137588124.db2.gz SXALBOCBSKCWMK-UHFFFAOYSA-N 1 0 341.411 3.850 20 5 EHBDRO Cc1c(C[NH2+]CCc2cccc(C(F)(F)F)n2)cccc1[N+](=O)[O-] ZINC000873128032 1137590764 /nfs/dbraw/zinc/59/07/64/1137590764.db2.gz AIJDQMZYTHRMIA-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124849181 1137611038 /nfs/dbraw/zinc/61/10/38/1137611038.db2.gz VGWVFTCNMXKBMF-ZWKOTPCHSA-N 1 0 332.375 3.898 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000125441640 1137634582 /nfs/dbraw/zinc/63/45/82/1137634582.db2.gz PIXRFKBFQPJWCE-RTBURBONSA-N 1 0 344.411 3.768 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000876945377 1137665865 /nfs/dbraw/zinc/66/58/65/1137665865.db2.gz BNQCNJQYZJWGEL-IFMYKAFSSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(C2CC2)c1 ZINC000877557278 1137681097 /nfs/dbraw/zinc/68/10/97/1137681097.db2.gz JMZGAPLYRCAERH-CDEQTRAXSA-N 1 0 326.400 3.723 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000877795371 1137690167 /nfs/dbraw/zinc/69/01/67/1137690167.db2.gz IDRBXWDDQHAWNN-CYBMUJFWSA-N 1 0 346.349 3.597 20 5 EHBDRO CC1(C)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878132507 1137703879 /nfs/dbraw/zinc/70/38/79/1137703879.db2.gz XOBLBVZQILNYSI-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878149624 1137704482 /nfs/dbraw/zinc/70/44/82/1137704482.db2.gz ZXLJFZXZSXNQJX-KRWDZBQOSA-N 1 0 330.388 3.657 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066650 1137736900 /nfs/dbraw/zinc/73/69/00/1137736900.db2.gz QMBGXUOBVWUHQV-PYLYLYNFSA-N 1 0 342.399 3.823 20 5 EHBDRO C[C@@H](NCc1ccc(F)cc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880100129 1137768084 /nfs/dbraw/zinc/76/80/84/1137768084.db2.gz SEFZSTKPXZTNHX-SECBINFHSA-N 1 0 343.280 3.999 20 5 EHBDRO Cc1cc(N2CC[C@@H](c3nccs3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000882858325 1137835909 /nfs/dbraw/zinc/83/59/09/1137835909.db2.gz FCFSLQOQJBIFQB-GFCCVEGCSA-N 1 0 340.408 3.902 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000130503333 1137838806 /nfs/dbraw/zinc/83/88/06/1137838806.db2.gz SFHQECOOSAHQRF-GUYCJALGSA-N 1 0 332.400 3.913 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](C)C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000130503964 1137838844 /nfs/dbraw/zinc/83/88/44/1137838844.db2.gz SFHQECOOSAHQRF-CXAGYDPISA-N 1 0 332.400 3.913 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000130535203 1137839146 /nfs/dbraw/zinc/83/91/46/1137839146.db2.gz YSPCJVOLBCMNEU-MSOLQXFVSA-N 1 0 344.411 3.768 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000882964212 1137839953 /nfs/dbraw/zinc/83/99/53/1137839953.db2.gz WGQZFMBCSKRMIP-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C1CCC3(COC3)CC1)CCCC2 ZINC000883382945 1137858611 /nfs/dbraw/zinc/85/86/11/1137858611.db2.gz QMSNIYPBZMQNRJ-SFHVURJKSA-N 1 0 330.428 3.911 20 5 EHBDRO CC(C)c1csc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000331573828 1137913062 /nfs/dbraw/zinc/91/30/62/1137913062.db2.gz IXJZROJOVMQUDJ-GXTWGEPZSA-N 1 0 349.460 3.645 20 5 EHBDRO CCC[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000114724229 1137918665 /nfs/dbraw/zinc/91/86/65/1137918665.db2.gz SBRXSRLWOZHFOV-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO CC(=O)Oc1ccc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000135242192 1137964970 /nfs/dbraw/zinc/96/49/70/1137964970.db2.gz NBRFQHYWDSROIV-UHFFFAOYSA-N 1 0 340.379 3.685 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1OC ZINC000885926347 1138025627 /nfs/dbraw/zinc/02/56/27/1138025627.db2.gz BCBCNOSKKPXAFQ-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CO[C@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000886057879 1138036329 /nfs/dbraw/zinc/03/63/29/1138036329.db2.gz ZZJUWEJYGYUSDR-GJZGRUSLSA-N 1 0 326.824 3.728 20 5 EHBDRO Cc1cc(NCc2cccc(C[NH+]3CCCC3)c2)ncc1[N+](=O)[O-] ZINC000074739840 1138123928 /nfs/dbraw/zinc/12/39/28/1138123928.db2.gz SMRKWKSHAWMQDJ-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000076650763 1138133412 /nfs/dbraw/zinc/13/34/12/1138133412.db2.gz JDGILBBULNRHCU-UHFFFAOYSA-N 1 0 332.404 3.903 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)[C@@H]3C)O2)cc1[N+](=O)[O-] ZINC000886771665 1138137374 /nfs/dbraw/zinc/13/73/74/1138137374.db2.gz LSRGLTPSSQJCQC-BBHOWBALSA-N 1 0 348.443 3.526 20 5 EHBDRO C[C@]1(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886776477 1138138828 /nfs/dbraw/zinc/13/88/28/1138138828.db2.gz HRXCAVJSRVSVPK-AEFFLSMTSA-N 1 0 330.428 3.911 20 5 EHBDRO C[C@@H]([NH2+]C[C@]1(C)CCOC2(CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000886776998 1138138907 /nfs/dbraw/zinc/13/89/07/1138138907.db2.gz VNSYUSWOIUSDMU-CXAGYDPISA-N 1 0 333.432 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H]([C@H]3CCCO3)C2)c1 ZINC000886818105 1138148713 /nfs/dbraw/zinc/14/87/13/1138148713.db2.gz ALHNLERLMDNSSR-XHDPSFHLSA-N 1 0 344.333 3.615 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2c(cccc2F)n1C)c1ccc([N+](=O)[O-])cc1 ZINC000089674594 1138203248 /nfs/dbraw/zinc/20/32/48/1138203248.db2.gz IDDJSRCPHQNTGS-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO CC[C@H](CSC)[N@H+](C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091097772 1138215892 /nfs/dbraw/zinc/21/58/92/1138215892.db2.gz JIJYNMQIDYHUPF-CQSZACIVSA-N 1 0 335.429 3.823 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000092066266 1138224371 /nfs/dbraw/zinc/22/43/71/1138224371.db2.gz WKYNLOMPHWPJDJ-GBNVKOLXSA-N 1 0 341.455 3.557 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093337387 1138235968 /nfs/dbraw/zinc/23/59/68/1138235968.db2.gz LNPXNYORBZLKJI-CYBMUJFWSA-N 1 0 347.440 3.577 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000124183561 1138280758 /nfs/dbraw/zinc/28/07/58/1138280758.db2.gz ZLKRRLUVTDQAMU-UHFFFAOYSA-N 1 0 348.443 3.627 20 5 EHBDRO CC[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092477 1138711317 /nfs/dbraw/zinc/71/13/17/1138711317.db2.gz FEKLVSBBTSXTAX-GXTWGEPZSA-N 1 0 337.420 3.549 20 5 EHBDRO Cc1ccc2c(C[N@@H+](C)Cc3ccccc3[N+](=O)[O-])ccc(O)c2n1 ZINC000338236940 1138797578 /nfs/dbraw/zinc/79/75/78/1138797578.db2.gz PJCHCRHDJDRSLW-UHFFFAOYSA-N 1 0 337.379 3.789 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743776 1139106212 /nfs/dbraw/zinc/10/62/12/1139106212.db2.gz NXZPLSONPVDFBG-SJKOYZFVSA-N 1 0 348.374 3.517 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCCCCn2cccn2)C2CC2)c1 ZINC000153290634 1139131003 /nfs/dbraw/zinc/13/10/03/1139131003.db2.gz QAUWUEQQURCAEA-UHFFFAOYSA-N 1 0 328.416 3.626 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000153573840 1139142264 /nfs/dbraw/zinc/14/22/64/1139142264.db2.gz AXAQCAYVNXTYNM-CQSZACIVSA-N 1 0 343.427 3.910 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2C)cc1[N+](=O)[O-] ZINC000153749896 1139150960 /nfs/dbraw/zinc/15/09/60/1139150960.db2.gz GQFIYOVMVJDOFD-KDOFPFPSSA-N 1 0 344.411 3.686 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc([S@](C)=O)cc1 ZINC000178686191 1139712360 /nfs/dbraw/zinc/71/23/60/1139712360.db2.gz ABTVUTXBCLRPPT-PSVOKBTDSA-N 1 0 332.425 3.744 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969225 1140070378 /nfs/dbraw/zinc/07/03/78/1140070378.db2.gz MTEKMBKLVLBYKU-JTQLQIEISA-N 1 0 325.821 3.940 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)cc1[N+](=O)[O-] ZINC000186617386 1140213796 /nfs/dbraw/zinc/21/37/96/1140213796.db2.gz OCXWBTMQYISGIV-AWEZNQCLSA-N 1 0 328.412 3.981 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192669844 1140543255 /nfs/dbraw/zinc/54/32/55/1140543255.db2.gz IBDZTRKVWFPSAD-IBGZPJMESA-N 1 0 339.395 3.720 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192887843 1140554230 /nfs/dbraw/zinc/55/42/30/1140554230.db2.gz PHTJRSFCLMEBOC-DOTOQJQBSA-N 1 0 332.425 3.531 20 5 EHBDRO C[C@H](CCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000266153065 1140648719 /nfs/dbraw/zinc/64/87/19/1140648719.db2.gz LCCIBZPCTWXTAJ-LLVKDONJSA-N 1 0 338.791 3.616 20 5 EHBDRO COc1cccc(N2CC[C@H]([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000266851050 1140729691 /nfs/dbraw/zinc/72/96/91/1140729691.db2.gz IWGLTNNEVBNLQB-HOCLYGCPSA-N 1 0 341.411 3.533 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000271669382 1141415645 /nfs/dbraw/zinc/41/56/45/1141415645.db2.gz MSOSIWPZBKKUTA-INIZCTEOSA-N 1 0 327.384 3.583 20 5 EHBDRO CCC[C@H]([NH2+]CCc1cn2c(n1)SCC2)c1cccc([N+](=O)[O-])c1 ZINC000274355824 1141502394 /nfs/dbraw/zinc/50/23/94/1141502394.db2.gz HGGVLVOFNNOOKM-INIZCTEOSA-N 1 0 346.456 3.571 20 5 EHBDRO Cn1cc(C[N@H+](C)C2CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000157491295 1014468653 /nfs/dbraw/zinc/46/86/53/1014468653.db2.gz SYHFBGHZGKFGMO-UHFFFAOYSA-N 1 0 328.416 3.760 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449061039 1032103982 /nfs/dbraw/zinc/10/39/82/1032103982.db2.gz HISJTNMNDPEJCA-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820336 1015016459 /nfs/dbraw/zinc/01/64/59/1015016459.db2.gz QEQGBOHBUQOJKT-YRNVUSSQSA-N 1 0 326.396 3.757 20 5 EHBDRO C[C@@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302040823 1015123474 /nfs/dbraw/zinc/12/34/74/1015123474.db2.gz HYTJPRWNDBIZAP-VXGBXAGGSA-N 1 0 339.386 3.938 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cn[nH]c1 ZINC000339791006 1015675461 /nfs/dbraw/zinc/67/54/61/1015675461.db2.gz FXBMHRQAXRQKDB-NSHDSACASA-N 1 0 328.397 3.897 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C1CC1)[C@@H]1CCCc2ccccc21 ZINC001167707975 1016409439 /nfs/dbraw/zinc/40/94/39/1016409439.db2.gz IXFSSFGTNQFINF-GOSISDBHSA-N 1 0 340.427 3.642 20 5 EHBDRO COc1ccc(CC(C)(C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000189455826 1016518908 /nfs/dbraw/zinc/51/89/08/1016518908.db2.gz PTXGAJNAQVJLHY-UHFFFAOYSA-N 1 0 344.411 3.723 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)C1 ZINC001167278940 1016982209 /nfs/dbraw/zinc/98/22/09/1016982209.db2.gz ZOKWAPXVEUEXQF-AWEZNQCLSA-N 1 0 329.425 3.862 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000538169636 1032191607 /nfs/dbraw/zinc/19/16/07/1032191607.db2.gz XSUMPWLLRVXKCV-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1cc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)ncc1[N+](=O)[O-] ZINC000074744958 1032206004 /nfs/dbraw/zinc/20/60/04/1032206004.db2.gz FFQMNQASMHBQOT-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000449211481 1032314838 /nfs/dbraw/zinc/31/48/38/1032314838.db2.gz XSTITVVIAHIQDZ-ZTNFWEORSA-N 1 0 340.423 3.893 20 5 EHBDRO CC[N@H+](C[C@H]1COc2ccccc2O1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189004 1032368320 /nfs/dbraw/zinc/36/83/20/1032368320.db2.gz FKGWQLJOKCEKOP-CABCVRRESA-N 1 0 342.395 3.818 20 5 EHBDRO COc1ccc([C@H](C)[C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000536883245 1032388352 /nfs/dbraw/zinc/38/83/52/1032388352.db2.gz UTFFSYDUVNCISI-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)c1ccsc1 ZINC000026720218 1032396306 /nfs/dbraw/zinc/39/63/06/1032396306.db2.gz OIEWVVZTFXLRCG-QGZVFWFLSA-N 1 0 342.424 3.919 20 5 EHBDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449277672 1032396688 /nfs/dbraw/zinc/39/66/88/1032396688.db2.gz GMIWZSQLXNWQMH-WMLDXEAASA-N 1 0 326.396 3.948 20 5 EHBDRO CCO[C@@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449287709 1032404243 /nfs/dbraw/zinc/40/42/43/1032404243.db2.gz LCOHCPGAIHTMTO-BEFAXECRSA-N 1 0 328.412 3.893 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000449287679 1032404679 /nfs/dbraw/zinc/40/46/79/1032404679.db2.gz XMHOWFQNZBJAIP-BPAFIMBUSA-N 1 0 340.423 3.893 20 5 EHBDRO COc1ccc(-c2ccc(C[N@@H+]3C[C@@H]4C[C@H]3CS4)o2)c([N+](=O)[O-])c1 ZINC000459747956 1032443904 /nfs/dbraw/zinc/44/39/04/1032443904.db2.gz HLJJQNXGGLKXCB-FZMZJTMJSA-N 1 0 346.408 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCC[C@H]3CCC[NH2+]3)o2)c(Cl)c1 ZINC000414906906 1017301450 /nfs/dbraw/zinc/30/14/50/1017301450.db2.gz QAFGQNYXZOTSHP-GFCCVEGCSA-N 1 0 349.818 3.740 20 5 EHBDRO C[C@@H](CCCO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449407166 1032529992 /nfs/dbraw/zinc/52/99/92/1032529992.db2.gz FULJLFGVIDCCMR-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000537176113 1032548736 /nfs/dbraw/zinc/54/87/36/1032548736.db2.gz QWYMHHVBUQRCAM-ZDUSSCGKSA-N 1 0 345.374 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CC3)CC2)nc1-c1ccccc1 ZINC000090069826 1032556165 /nfs/dbraw/zinc/55/61/65/1032556165.db2.gz HJQFSQGEZHPYHU-UHFFFAOYSA-N 1 0 338.411 3.696 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC000449438674 1032582537 /nfs/dbraw/zinc/58/25/37/1032582537.db2.gz RIFJZEKVGUORFY-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2csc([N+](=O)[O-])c2)OCCc2ccccc21 ZINC000573253471 1032604782 /nfs/dbraw/zinc/60/47/82/1032604782.db2.gz PAUMFAWSEIFHGA-QGZVFWFLSA-N 1 0 332.425 3.624 20 5 EHBDRO COCC1(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000592372675 1032672074 /nfs/dbraw/zinc/67/20/74/1032672074.db2.gz JIIIUDUOZDXYQM-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947343 1017347869 /nfs/dbraw/zinc/34/78/69/1017347869.db2.gz KSHWCMUUFSKSCW-QWHCGFSZSA-N 1 0 331.441 3.553 20 5 EHBDRO Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000134948792 1017733260 /nfs/dbraw/zinc/73/32/60/1017733260.db2.gz XMSSMWZBJATGFU-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000593462824 1032719987 /nfs/dbraw/zinc/71/99/87/1032719987.db2.gz GVKVOSGGQIRCQU-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C(C)(C)c2cccc(C)c2)c1[N+](=O)[O-] ZINC000893018386 1018174962 /nfs/dbraw/zinc/17/49/62/1018174962.db2.gz KIYHQDAJAJTKFO-UHFFFAOYSA-N 1 0 330.384 3.642 20 5 EHBDRO CC[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000118866655 1018544438 /nfs/dbraw/zinc/54/44/38/1018544438.db2.gz DJEJMQDPYMIZCT-DOTOQJQBSA-N 1 0 326.400 3.627 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3ccc4cccnc4n3)CC2)c1 ZINC000594020569 1032791219 /nfs/dbraw/zinc/79/12/19/1032791219.db2.gz IZAWMOIGVAAVCJ-UHFFFAOYSA-N 1 0 348.406 3.918 20 5 EHBDRO CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000379622588 1019002442 /nfs/dbraw/zinc/00/24/42/1019002442.db2.gz GVULMOORMNXHNO-UHFFFAOYSA-N 1 0 327.428 3.595 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000513116427 1019027613 /nfs/dbraw/zinc/02/76/13/1019027613.db2.gz FIAIFFAEYZQBBF-INIZCTEOSA-N 1 0 345.468 3.849 20 5 EHBDRO C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCC2)no1 ZINC000261697334 1019387961 /nfs/dbraw/zinc/38/79/61/1019387961.db2.gz HXFYYAXKYMLAKL-JTQLQIEISA-N 1 0 334.401 3.559 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1C ZINC000433787061 1019614686 /nfs/dbraw/zinc/61/46/86/1019614686.db2.gz QRCANEKPRYHQEH-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2[C@@H]3Cc4ccccc4[C@@H]32)c1 ZINC000580676924 1019830423 /nfs/dbraw/zinc/83/04/23/1019830423.db2.gz FWWBKDXYKUMXIE-HYVNUMGLSA-N 1 0 346.333 3.624 20 5 EHBDRO CCc1ncc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000449608819 1032873521 /nfs/dbraw/zinc/87/35/21/1032873521.db2.gz KJYUADHZLBLXGR-CZUORRHYSA-N 1 0 329.400 3.646 20 5 EHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@H]1CCN(c2ccccc2)C1 ZINC000602440625 1032890447 /nfs/dbraw/zinc/89/04/47/1032890447.db2.gz QNHYCXNBOCGUQN-MRXNPFEDSA-N 1 0 325.412 3.553 20 5 EHBDRO CCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000513696723 1020479183 /nfs/dbraw/zinc/47/91/83/1020479183.db2.gz CUHJWSMVZPVUDX-QGZVFWFLSA-N 1 0 342.443 3.978 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H](C)O ZINC000513703171 1020635997 /nfs/dbraw/zinc/63/59/97/1020635997.db2.gz RIARMZNYAZXZTC-CYBMUJFWSA-N 1 0 334.441 3.915 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H](C)Cc1ccc(C)cc1 ZINC001167453972 1020659135 /nfs/dbraw/zinc/65/91/35/1020659135.db2.gz PKACUIPBTDIAQD-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000326000036 1020666686 /nfs/dbraw/zinc/66/66/86/1020666686.db2.gz FPJKKVDKPRFDTG-BHIYHBOVSA-N 1 0 332.444 3.809 20 5 EHBDRO CCC[NH+]1CCC(CNc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413105336 1020689344 /nfs/dbraw/zinc/68/93/44/1020689344.db2.gz NOZFQFONAXADDT-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000507430728 1021261515 /nfs/dbraw/zinc/26/15/15/1021261515.db2.gz UILNLJHBDMYBEA-CIRFHOKZSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H]1Oc2cc(F)ccc2[C@@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000518606311 1021367177 /nfs/dbraw/zinc/36/71/77/1021367177.db2.gz JWACGEYOHVPWHR-FCXJHPCESA-N 1 0 328.343 3.859 20 5 EHBDRO CC[NH+](CC)CCCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581671495 1021426670 /nfs/dbraw/zinc/42/66/70/1021426670.db2.gz WPASVWSKZQDSLH-CQSZACIVSA-N 1 0 333.354 3.520 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CCCN(C)c2ccccc21 ZINC000449654021 1032978931 /nfs/dbraw/zinc/97/89/31/1032978931.db2.gz UTHLDUFSPLXUGM-GOSISDBHSA-N 1 0 325.412 3.964 20 5 EHBDRO Cc1ccc([C@H]2[C@@H](C)CCC[N@@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477787 1021459345 /nfs/dbraw/zinc/45/93/45/1021459345.db2.gz HVEYZHABZJGNCI-WMLDXEAASA-N 1 0 328.416 3.610 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000507714656 1021467678 /nfs/dbraw/zinc/46/76/78/1021467678.db2.gz PEBGDKCOWBTJAN-QGZVFWFLSA-N 1 0 326.396 3.804 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000426403201 1021505271 /nfs/dbraw/zinc/50/52/71/1021505271.db2.gz FNOFYLPSKBNPGD-KBPBESRZSA-N 1 0 344.411 3.981 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])cn1 ZINC000602551050 1032985785 /nfs/dbraw/zinc/98/57/85/1032985785.db2.gz LKGRBWHNDVVEIK-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO COC[C@@H](C)C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000518780858 1021541379 /nfs/dbraw/zinc/54/13/79/1021541379.db2.gz CTMGPHOCYBKGSD-HNNXBMFYSA-N 1 0 343.427 3.735 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1C)CC2 ZINC000439793483 1021718078 /nfs/dbraw/zinc/71/80/78/1021718078.db2.gz NIZCTAVYBOMTIQ-UHFFFAOYSA-N 1 0 326.396 3.513 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000276664504 1022067682 /nfs/dbraw/zinc/06/76/82/1022067682.db2.gz XCJFMSUXRVYJCF-CQSZACIVSA-N 1 0 328.416 3.685 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000302159532 1022159894 /nfs/dbraw/zinc/15/98/94/1022159894.db2.gz ONNNCLCCSKJVNR-CYBMUJFWSA-N 1 0 327.388 3.503 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@]3(CCOC3)C2)o1 ZINC000449684934 1033037836 /nfs/dbraw/zinc/03/78/36/1033037836.db2.gz MEWRTBIWXSOELE-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1nc2ccc(F)cc2o1 ZINC000517330667 1022262689 /nfs/dbraw/zinc/26/26/89/1022262689.db2.gz OTHHZBWWTNVYGU-UHFFFAOYSA-N 1 0 329.331 3.550 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000550098072 1022426008 /nfs/dbraw/zinc/42/60/08/1022426008.db2.gz WIDQXLYWRWYVIR-GOEBONIOSA-N 1 0 334.416 3.587 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCC2(F)CCC2)cc1Br ZINC000602667858 1033066127 /nfs/dbraw/zinc/06/61/27/1033066127.db2.gz VBMJTTZSVJIMDB-UHFFFAOYSA-N 1 0 337.214 3.791 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602695449 1033077113 /nfs/dbraw/zinc/07/71/13/1033077113.db2.gz WGVJKGKGWLJMLT-SJORKVTESA-N 1 0 346.475 3.763 20 5 EHBDRO CC(C)c1ccc(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000510582741 1022692744 /nfs/dbraw/zinc/69/27/44/1022692744.db2.gz UVSCBFAXXWJEJO-UHFFFAOYSA-N 1 0 338.411 3.927 20 5 EHBDRO CCN(CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CCC(F)(F)F ZINC000426035099 1022718755 /nfs/dbraw/zinc/71/87/55/1022718755.db2.gz IDLLVSPKLSLDKV-LBPRGKRZSA-N 1 0 333.354 3.520 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000430821823 1022735912 /nfs/dbraw/zinc/73/59/12/1022735912.db2.gz OKJHNQTXJQWZGZ-MAUKXSAKSA-N 1 0 347.459 3.534 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000426056716 1022773988 /nfs/dbraw/zinc/77/39/88/1022773988.db2.gz BUCZRVKMASDLBH-HIFRSBDPSA-N 1 0 326.396 3.812 20 5 EHBDRO CC(C)C1(C)CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000426748920 1023019618 /nfs/dbraw/zinc/01/96/18/1023019618.db2.gz BCIWQOFLTCDAPY-UHFFFAOYSA-N 1 0 334.416 3.719 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000507007821 1023073895 /nfs/dbraw/zinc/07/38/95/1023073895.db2.gz QJQGRMXYQGBGPK-XJKSGUPXSA-N 1 0 329.375 3.981 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N[C@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310201114 1023100315 /nfs/dbraw/zinc/10/03/15/1023100315.db2.gz SIMCCXTVQDBFQW-ZDUSSCGKSA-N 1 0 333.338 3.559 20 5 EHBDRO Cc1ccc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)n2c1 ZINC000507170847 1023172160 /nfs/dbraw/zinc/17/21/60/1023172160.db2.gz QTPSDHDCVUTBGR-UHFFFAOYSA-N 1 0 338.411 3.962 20 5 EHBDRO O=[N+]([O-])c1sccc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000063263194 1033134659 /nfs/dbraw/zinc/13/46/59/1033134659.db2.gz WFNBFPHOBIZTEG-UHFFFAOYSA-N 1 0 335.404 3.872 20 5 EHBDRO CCOc1ccc2c(c1)[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000610811058 1023710900 /nfs/dbraw/zinc/71/09/00/1023710900.db2.gz FBVZINBBBRKWMV-GOSISDBHSA-N 1 0 342.395 3.649 20 5 EHBDRO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000449752520 1033170398 /nfs/dbraw/zinc/17/03/98/1033170398.db2.gz CLDWSYDQKBWUMQ-HZPDHXFCSA-N 1 0 347.440 3.766 20 5 EHBDRO Cc1nccn1CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000119439966 1024018427 /nfs/dbraw/zinc/01/84/27/1024018427.db2.gz HJWCYBSMHFEIQT-UHFFFAOYSA-N 1 0 330.432 3.791 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000439262692 1024066200 /nfs/dbraw/zinc/06/62/00/1024066200.db2.gz PSDDLPZWYRTDEL-IBGZPJMESA-N 1 0 328.412 3.758 20 5 EHBDRO C[C@@H]1CCC[N@@H+](C(C)(C)CNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000342109485 1024072114 /nfs/dbraw/zinc/07/21/14/1024072114.db2.gz GTAAANSAYIBCJT-LLVKDONJSA-N 1 0 349.460 3.522 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@@H]12 ZINC000248425520 1024087684 /nfs/dbraw/zinc/08/76/84/1024087684.db2.gz NZSRKSJTHQZOJM-KCXAZCMYSA-N 1 0 342.399 3.655 20 5 EHBDRO Cn1cc(C[NH2+][C@H]2CC(C)(C)CCc3ccccc32)c([N+](=O)[O-])n1 ZINC000602823305 1033190991 /nfs/dbraw/zinc/19/09/91/1033190991.db2.gz CFKHCNPCSDBOMI-INIZCTEOSA-N 1 0 328.416 3.522 20 5 EHBDRO COc1ccc([C@H](CNc2sccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000302011633 1024304682 /nfs/dbraw/zinc/30/46/82/1024304682.db2.gz YVVDKDNHGYBCHB-INIZCTEOSA-N 1 0 347.440 3.914 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000277247228 1024326814 /nfs/dbraw/zinc/32/68/14/1024326814.db2.gz PYUYPHVJQZWDDH-OAHLLOKOSA-N 1 0 330.432 3.827 20 5 EHBDRO Cn1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2F)c2ccc(F)cc21 ZINC000472052390 1024503306 /nfs/dbraw/zinc/50/33/06/1024503306.db2.gz DJCXTUJIAHRVJR-UHFFFAOYSA-N 1 0 345.349 3.697 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2cccc(F)c2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000024107780 1024594336 /nfs/dbraw/zinc/59/43/36/1024594336.db2.gz AEHKRXGFRBJTLP-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO CN(Cc1cccs1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000505601888 1024619903 /nfs/dbraw/zinc/61/99/03/1024619903.db2.gz JSLQBZOOUDIAIY-UHFFFAOYSA-N 1 0 328.340 3.890 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCSC[C@H]23)c(C(F)F)c1 ZINC000895567680 1024623972 /nfs/dbraw/zinc/62/39/72/1024623972.db2.gz GQVFMDOQZNHBDC-UONOGXRCSA-N 1 0 343.399 3.524 20 5 EHBDRO COc1ccc([C@H](OC)[C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000538966778 1024642574 /nfs/dbraw/zinc/64/25/74/1024642574.db2.gz DTTOHDIPUWORFE-IFXJQAMLSA-N 1 0 344.411 3.778 20 5 EHBDRO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000065535121 1024658917 /nfs/dbraw/zinc/65/89/17/1024658917.db2.gz ILUUZTHZGUAMQW-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO C[N@@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000435229768 1024716153 /nfs/dbraw/zinc/71/61/53/1024716153.db2.gz LDZLUXJOYBNZEO-UHFFFAOYSA-N 1 0 349.818 3.646 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(CN2CCOCC2)cc1 ZINC000435243255 1024724778 /nfs/dbraw/zinc/72/47/78/1024724778.db2.gz SHRFLIJWTREUCB-UHFFFAOYSA-N 1 0 348.786 3.873 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]C2(C3CC3)CCC2)cc1Br ZINC000895902380 1024959932 /nfs/dbraw/zinc/95/99/32/1024959932.db2.gz YEPMWABEAQQHJX-UHFFFAOYSA-N 1 0 331.235 3.841 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000157631157 1024973959 /nfs/dbraw/zinc/97/39/59/1024973959.db2.gz WKEDNGMSSMLYTC-ZDUSSCGKSA-N 1 0 348.786 3.607 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@@H]23)s1 ZINC000249987749 1033252675 /nfs/dbraw/zinc/25/26/75/1033252675.db2.gz ZKLSYVXIEAAJSM-YSVLISHTSA-N 1 0 344.436 3.980 20 5 EHBDRO Cc1ccccc1[C@@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000515203795 1025089285 /nfs/dbraw/zinc/08/92/85/1025089285.db2.gz NNSTWEJVRMKVHE-RTBURBONSA-N 1 0 326.396 3.604 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccco2)s1 ZINC000520892693 1025112566 /nfs/dbraw/zinc/11/25/66/1025112566.db2.gz IHARGWQDTAFZKA-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000248621793 1025200417 /nfs/dbraw/zinc/20/04/17/1025200417.db2.gz AVCUQWUMTZAXCC-YZVOILCLSA-N 1 0 327.428 3.937 20 5 EHBDRO C[C@@H](CO)[NH2+]Cc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000121190951 1025285811 /nfs/dbraw/zinc/28/58/11/1025285811.db2.gz RRUIIDYPKSXJPO-NSHDSACASA-N 1 0 336.775 3.511 20 5 EHBDRO COC(=O)[C@H](CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000425460238 1025364729 /nfs/dbraw/zinc/36/47/29/1025364729.db2.gz QPJRHSJKKDTYKY-RDTXWAMCSA-N 1 0 342.395 3.592 20 5 EHBDRO CC(C)CC[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CC1 ZINC000046512373 1033284646 /nfs/dbraw/zinc/28/46/46/1033284646.db2.gz RNSPHXAOKQNRPB-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000451100839 1025563193 /nfs/dbraw/zinc/56/31/93/1025563193.db2.gz YKDXNRQGHYFRRL-GJZGRUSLSA-N 1 0 347.459 3.815 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000582201758 1025571882 /nfs/dbraw/zinc/57/18/82/1025571882.db2.gz GXVLFHPKKWPXPT-PQUAAJSLSA-N 1 0 331.460 3.852 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056652 1025620881 /nfs/dbraw/zinc/62/08/81/1025620881.db2.gz BCTYOOSJPPJNRL-GOEBONIOSA-N 1 0 341.411 3.971 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)NCc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000442998377 1025640523 /nfs/dbraw/zinc/64/05/23/1025640523.db2.gz IZQFPNYHRGZZBV-IFXJQAMLSA-N 1 0 345.418 3.823 20 5 EHBDRO COCC1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000281926218 1025714868 /nfs/dbraw/zinc/71/48/68/1025714868.db2.gz HCPTYUCBINIRFA-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO Cc1c(C[N@@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cccc1[N+](=O)[O-] ZINC000425547188 1025721757 /nfs/dbraw/zinc/72/17/57/1025721757.db2.gz FNZVVYYCLFFIPU-SFHVURJKSA-N 1 0 330.428 3.684 20 5 EHBDRO C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H](c1ccccc1)[NH+](C)C ZINC000439126865 1025784757 /nfs/dbraw/zinc/78/47/57/1025784757.db2.gz FXXNPQCHZPERPX-NHYWBVRUSA-N 1 0 334.807 3.747 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000505855007 1025981025 /nfs/dbraw/zinc/98/10/25/1025981025.db2.gz AEDHELUDVFLGMY-INIZCTEOSA-N 1 0 342.395 3.504 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516193387 1026101439 /nfs/dbraw/zinc/10/14/39/1026101439.db2.gz LEZCCSJLLVIQMG-INIZCTEOSA-N 1 0 336.395 3.530 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCS1 ZINC000896950253 1026147580 /nfs/dbraw/zinc/14/75/80/1026147580.db2.gz AGEIBPUPMBFOIG-BXKDBHETSA-N 1 0 334.363 3.987 20 5 EHBDRO CC[C@]1(CO)CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475114612 1026210106 /nfs/dbraw/zinc/21/01/06/1026210106.db2.gz AHHGJOGXMCHIHL-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2c2ccc(Cl)cc2)c1 ZINC000451732149 1026238019 /nfs/dbraw/zinc/23/80/19/1026238019.db2.gz GDPWLDRZJWEAPV-INIZCTEOSA-N 1 0 334.807 3.672 20 5 EHBDRO CC(C)[C@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000475211812 1026390644 /nfs/dbraw/zinc/39/06/44/1026390644.db2.gz BFECLBHZJIWITH-SFHVURJKSA-N 1 0 342.443 3.868 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@]3(CCSC3)C2)c(F)c1 ZINC000451959294 1026395549 /nfs/dbraw/zinc/39/55/49/1026395549.db2.gz ASKWNGZOUHHWCJ-HNNXBMFYSA-N 1 0 328.384 3.592 20 5 EHBDRO C[NH+]1CCC2(CCN2c2c(Cl)c(Cl)ccc2[N+](=O)[O-])CC1 ZINC000897133258 1026397197 /nfs/dbraw/zinc/39/71/97/1026397197.db2.gz IQFURXWTPPTWAW-UHFFFAOYSA-N 1 0 330.215 3.576 20 5 EHBDRO CCO[C@@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452015105 1026436566 /nfs/dbraw/zinc/43/65/66/1026436566.db2.gz JIWMFGYOIRWWJL-ZIAGYGMSSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000452074972 1026464480 /nfs/dbraw/zinc/46/44/80/1026464480.db2.gz BKEKHZNAJPECQP-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475335379 1026488426 /nfs/dbraw/zinc/48/84/26/1026488426.db2.gz GSJRULCDHDXABT-CQSZACIVSA-N 1 0 331.416 3.675 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)c(F)c1 ZINC000339427159 1026560831 /nfs/dbraw/zinc/56/08/31/1026560831.db2.gz FCXGMRJPZBQOOL-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO COc1cccc(C[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000121278780 1026590032 /nfs/dbraw/zinc/59/00/32/1026590032.db2.gz MWEFURWWZLCKEU-FQEVSTJZSA-N 1 0 340.423 3.757 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000479567966 1026703752 /nfs/dbraw/zinc/70/37/52/1026703752.db2.gz WINZXAYZXXKEKB-UHFFFAOYSA-N 1 0 348.447 3.551 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2ccc(SC)cc2)c1[N+](=O)[O-] ZINC000894245627 1027187136 /nfs/dbraw/zinc/18/71/36/1027187136.db2.gz MWVHCDZUVROWTA-LLVKDONJSA-N 1 0 348.424 3.882 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 ZINC000178643269 1027196145 /nfs/dbraw/zinc/19/61/45/1027196145.db2.gz ZEOSKRPJNDLEFX-KBPBESRZSA-N 1 0 345.468 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000076581269 1027301530 /nfs/dbraw/zinc/30/15/30/1027301530.db2.gz ZARNWUUYFIEVPW-FQEVSTJZSA-N 1 0 349.390 3.748 20 5 EHBDRO CSc1ccccc1[C@@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501521788 1027335691 /nfs/dbraw/zinc/33/56/91/1027335691.db2.gz HQIYMHCBMVXGBY-GFCCVEGCSA-N 1 0 345.424 3.606 20 5 EHBDRO CC[C@H]([NH2+]CCc1nn(C)c2ccccc12)c1cccc([N+](=O)[O-])c1 ZINC000186475350 1027366962 /nfs/dbraw/zinc/36/69/62/1027366962.db2.gz ADOXUVRLUYMDND-KRWDZBQOSA-N 1 0 338.411 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCN3CC=CCC3)s2)cc1 ZINC000475503726 1027485497 /nfs/dbraw/zinc/48/54/97/1027485497.db2.gz SPGRUVGFDXNFKL-UHFFFAOYSA-N 1 0 343.452 3.675 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@]4(C3)CCCOC4)o2)c1 ZINC000342836342 1027551479 /nfs/dbraw/zinc/55/14/79/1027551479.db2.gz JIGKTGMJYWKXFW-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO Cc1cc(C)cc(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000501897826 1027636995 /nfs/dbraw/zinc/63/69/95/1027636995.db2.gz FIPVZBOKOUUSDW-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000475567987 1027645795 /nfs/dbraw/zinc/64/57/95/1027645795.db2.gz FILFLYNCUKPIIL-HUUCEWRRSA-N 1 0 348.447 3.596 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000366690875 1027740918 /nfs/dbraw/zinc/74/09/18/1027740918.db2.gz BDGZKTYHLCPECG-KSSFIOAISA-N 1 0 325.412 3.741 20 5 EHBDRO CC(C)C[C@@H](CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@H](C)c1ccccc1 ZINC000347326222 1027970781 /nfs/dbraw/zinc/97/07/81/1027970781.db2.gz WWRZQWCBGVLCKN-ZBFHGGJFSA-N 1 0 345.447 3.506 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000444747554 1028235118 /nfs/dbraw/zinc/23/51/18/1028235118.db2.gz AKZFWPPVAXBZGO-AWEZNQCLSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCOC1 ZINC000503942115 1028247496 /nfs/dbraw/zinc/24/74/96/1028247496.db2.gz BOCVFLXNXOBZMN-DZGCQCFKSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCOC1 ZINC000503953258 1028260855 /nfs/dbraw/zinc/26/08/55/1028260855.db2.gz RSRHIROHDRJAEM-UONOGXRCSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](C3CC3)CC2)c(C(F)(F)F)c1 ZINC000444866049 1028354326 /nfs/dbraw/zinc/35/43/26/1028354326.db2.gz VDHJVXNCIMGJCG-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CCCC[C@@H](C[NH3+])N[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423304403 1028359828 /nfs/dbraw/zinc/35/98/28/1028359828.db2.gz YRAHKPJFUVAIAG-PKOBYXMFSA-N 1 0 327.428 3.791 20 5 EHBDRO COCC[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@H](C)c1ccccc1 ZINC000519917718 1028379123 /nfs/dbraw/zinc/37/91/23/1028379123.db2.gz FRSJTXCCESYBLK-MRXNPFEDSA-N 1 0 344.411 3.683 20 5 EHBDRO C[C@H](Nc1cccc(OCC[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000324839415 1028609445 /nfs/dbraw/zinc/60/94/45/1028609445.db2.gz HVWXSBFWWRJGNL-AWEZNQCLSA-N 1 0 329.400 3.708 20 5 EHBDRO C[C@@H]1CC[C@@H]([N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000429592999 1028882298 /nfs/dbraw/zinc/88/22/98/1028882298.db2.gz RHUGFYJFCTXPGQ-UKRRQHHQSA-N 1 0 329.400 3.913 20 5 EHBDRO C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424347808 1029028129 /nfs/dbraw/zinc/02/81/29/1029028129.db2.gz SJYWYDICCBNUEA-QXMHVHEDSA-N 1 0 328.372 3.656 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCNc1ccccn1 ZINC000504905014 1029051304 /nfs/dbraw/zinc/05/13/04/1029051304.db2.gz AJZHAUQISUNZHR-CQSZACIVSA-N 1 0 346.456 3.562 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](OC)C(C)C ZINC000504912271 1029056655 /nfs/dbraw/zinc/05/66/55/1029056655.db2.gz SZCYTJGCKTZDLF-ZFWWWQNUSA-N 1 0 326.462 3.726 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000505267895 1029423915 /nfs/dbraw/zinc/42/39/15/1029423915.db2.gz XCGSVVSWHAKVAI-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCC1CCOCC1 ZINC000513822442 1029524076 /nfs/dbraw/zinc/52/40/76/1029524076.db2.gz CDPCXAMUGQYHHI-AEFFLSMTSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428442184 1029623719 /nfs/dbraw/zinc/62/37/19/1029623719.db2.gz SVQRGYCXVJVQES-BEBFYNPSSA-N 1 0 340.423 3.957 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@@H](C)[C@@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042873 1029660928 /nfs/dbraw/zinc/66/09/28/1029660928.db2.gz GECBPPXFLXQJQY-LIRRHRJNSA-N 1 0 326.396 3.727 20 5 EHBDRO CC[C@@H](O)C[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC000441059129 1029719951 /nfs/dbraw/zinc/71/99/51/1029719951.db2.gz IJGYMGYUABMCMK-GOSISDBHSA-N 1 0 328.412 3.676 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CCC[C@H](c2ncc3n2CCCC3)C1 ZINC000282059892 1029721439 /nfs/dbraw/zinc/72/14/39/1029721439.db2.gz MOUVGIPNKBJTIM-INIZCTEOSA-N 1 0 340.427 3.507 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c(OC)c1 ZINC000278240387 1029768439 /nfs/dbraw/zinc/76/84/39/1029768439.db2.gz LHTRAVVVKORPTP-SFHVURJKSA-N 1 0 342.395 3.779 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H](OC)C(C)C)o2)c([N+](=O)[O-])c1 ZINC000525289940 1029781648 /nfs/dbraw/zinc/78/16/48/1029781648.db2.gz DVZDSHSEZPQLSY-GOSISDBHSA-N 1 0 348.399 3.624 20 5 EHBDRO COc1cc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])ccc1C ZINC000446828346 1029812164 /nfs/dbraw/zinc/81/21/64/1029812164.db2.gz TXRXKXKBLCEAQB-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441174195 1029875763 /nfs/dbraw/zinc/87/57/63/1029875763.db2.gz DGCYMIVJYLVTLN-OAHLLOKOSA-N 1 0 344.411 3.984 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000453258969 1029991070 /nfs/dbraw/zinc/99/10/70/1029991070.db2.gz OLQCGVJUYYOPBC-OCCSQVGLSA-N 1 0 334.338 3.993 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000441215842 1030009775 /nfs/dbraw/zinc/00/97/75/1030009775.db2.gz GBDNGXBYHKZIFV-MRXNPFEDSA-N 1 0 325.412 3.868 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000531953824 1030126525 /nfs/dbraw/zinc/12/65/25/1030126525.db2.gz VWMLFFARAZKOKO-HUUCEWRRSA-N 1 0 325.412 3.697 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CC)[C@@H](O)CC ZINC000453380884 1030160630 /nfs/dbraw/zinc/16/06/30/1030160630.db2.gz RTAKCAIZKOYDRP-IPYPFGDCSA-N 1 0 326.462 3.605 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1cnc(C2CC2)o1)C1CC1 ZINC000453380190 1030202791 /nfs/dbraw/zinc/20/27/91/1030202791.db2.gz ZELNETKONSDMFI-INIZCTEOSA-N 1 0 327.384 3.571 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000447540881 1030276523 /nfs/dbraw/zinc/27/65/23/1030276523.db2.gz DVYMACUCCSGRDF-ROUUACIJSA-N 1 0 345.468 3.926 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(-n2ccnn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000159865495 1030395113 /nfs/dbraw/zinc/39/51/13/1030395113.db2.gz LXZZZZREEDBHIW-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000532194204 1030468353 /nfs/dbraw/zinc/46/83/53/1030468353.db2.gz MWZRTTCVGCLFRP-CYBMUJFWSA-N 1 0 327.384 3.794 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1)N(C)C ZINC000482507802 1030486953 /nfs/dbraw/zinc/48/69/53/1030486953.db2.gz IGYCNRXPJDGQIN-OLZOCXBDSA-N 1 0 333.457 3.924 20 5 EHBDRO C[C@@H]([NH2+][C@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000161832107 1030489543 /nfs/dbraw/zinc/48/95/43/1030489543.db2.gz FVSCFGWOOWITQI-MLGOLLRUSA-N 1 0 349.431 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCCOC3)s2)cc1 ZINC000237989584 1030710679 /nfs/dbraw/zinc/71/06/79/1030710679.db2.gz ODBIRLGFNVLCGX-CYBMUJFWSA-N 1 0 332.425 3.840 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(CC[NH+](C)C)Cc1ccccc1F ZINC000583899511 1031073410 /nfs/dbraw/zinc/07/34/10/1031073410.db2.gz SYKSONGGMNEAAQ-UHFFFAOYSA-N 1 0 345.418 3.606 20 5 EHBDRO C[C@H](CCNc1ccc([N+](=O)[O-])c2cnccc12)[NH+]1CCCCC1 ZINC000302124794 1031252083 /nfs/dbraw/zinc/25/20/83/1031252083.db2.gz FMQVDVQSBLXEJX-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC000611797337 1031288922 /nfs/dbraw/zinc/28/89/22/1031288922.db2.gz UZYDNWKXJSGFCJ-ZIAGYGMSSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]C[C@]2(C)CCOC3(CCC3)C2)cc([N+](=O)[O-])c1 ZINC000903218343 1031293522 /nfs/dbraw/zinc/29/35/22/1031293522.db2.gz BDACRKPQMPEOEA-RDTXWAMCSA-N 1 0 348.443 3.993 20 5 EHBDRO CCOc1cc(N2CCC(C[NH+]3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000536187967 1031381396 /nfs/dbraw/zinc/38/13/96/1031381396.db2.gz LUCNNVGBBBLKIX-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000568531593 1031669781 /nfs/dbraw/zinc/66/97/81/1031669781.db2.gz HTKQQXQUPOZWCK-HKUYNNGSSA-N 1 0 343.402 3.614 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000760189991 1031990346 /nfs/dbraw/zinc/99/03/46/1031990346.db2.gz SJGQMLSUEOABSP-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950663 1032035340 /nfs/dbraw/zinc/03/53/40/1032035340.db2.gz HTEWZVLQVWMNJN-IAGOWNOFSA-N 1 0 333.476 3.922 20 5 EHBDRO COc1ccc2c(c1)OC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000537946252 1032053569 /nfs/dbraw/zinc/05/35/69/1032053569.db2.gz WCIFIMXJFHWAOJ-XJKSGUPXSA-N 1 0 342.395 3.566 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000061015194 1033432494 /nfs/dbraw/zinc/43/24/94/1033432494.db2.gz JDOUJXBHRBYGJY-LJQANCHMSA-N 1 0 327.428 3.768 20 5 EHBDRO CSCC(C)(C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000898304309 1033445898 /nfs/dbraw/zinc/44/58/98/1033445898.db2.gz BSMIBPNGQHPRCX-UHFFFAOYSA-N 1 0 339.280 3.650 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@]34C[C@H]3CCC4)o2)c([N+](=O)[O-])c1 ZINC000594954058 1033595771 /nfs/dbraw/zinc/59/57/71/1033595771.db2.gz XAOQAXVFQHTVPK-KZULUSFZSA-N 1 0 328.368 3.896 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](COC)Cc1ccccc1 ZINC000472344371 1033597860 /nfs/dbraw/zinc/59/78/60/1033597860.db2.gz ATQQUNDXOAIEIX-FQEVSTJZSA-N 1 0 342.439 3.717 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3COC(C)(C)C3)o2)c([N+](=O)[O-])c1 ZINC000594962798 1033603438 /nfs/dbraw/zinc/60/34/38/1033603438.db2.gz KGDNFEHEYRMVGY-GFCCVEGCSA-N 1 0 346.383 3.521 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC[C@@H]3CCCOC3)o2)c1 ZINC000598984853 1033609278 /nfs/dbraw/zinc/60/92/78/1033609278.db2.gz DQCLUNXMYJMHIB-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CCC1 ZINC000595022193 1033614934 /nfs/dbraw/zinc/61/49/34/1033614934.db2.gz KPSOZYZBSWAJCC-AWEZNQCLSA-N 1 0 336.432 3.851 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054951 1033632975 /nfs/dbraw/zinc/63/29/75/1033632975.db2.gz XRZZHCUCIULDMU-UKRRQHHQSA-N 1 0 335.448 3.517 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2 ZINC000599001366 1033634222 /nfs/dbraw/zinc/63/42/22/1033634222.db2.gz RZTZMAQXJGVUNO-UHFFFAOYSA-N 1 0 344.358 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CO[C@H](C4CC4)C3)o2)cc1 ZINC000599007611 1033640988 /nfs/dbraw/zinc/64/09/88/1033640988.db2.gz QPLRZCUXFOCPRO-KSSFIOAISA-N 1 0 328.368 3.512 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595064818 1033641664 /nfs/dbraw/zinc/64/16/64/1033641664.db2.gz BOLKJAHABDUSTA-FZKQIMNGSA-N 1 0 330.384 3.642 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000595066250 1033644378 /nfs/dbraw/zinc/64/43/78/1033644378.db2.gz HBGCPSHQOOIUKG-RDTXWAMCSA-N 1 0 344.411 3.950 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000595071433 1033646322 /nfs/dbraw/zinc/64/63/22/1033646322.db2.gz ZBLQSUIHUACVBM-WDSOQIARSA-N 1 0 326.396 3.841 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595070510 1033646661 /nfs/dbraw/zinc/64/66/61/1033646661.db2.gz VKQLYUDVQKKESE-ACJLOTCBSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C)c1ncc(C)s1 ZINC000595034327 1033656178 /nfs/dbraw/zinc/65/61/78/1033656178.db2.gz VGFYUMZYGMYGBS-ZYHUDNBSSA-N 1 0 335.429 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1ncc(C)cc1C ZINC000595046705 1033664791 /nfs/dbraw/zinc/66/47/91/1033664791.db2.gz NILCKYRHCIQSMM-CQSZACIVSA-N 1 0 329.400 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1noc3ccccc13)CCC2 ZINC000595052003 1033667027 /nfs/dbraw/zinc/66/70/27/1033667027.db2.gz ZZVSGNXTOCEFGO-QGZVFWFLSA-N 1 0 337.379 3.946 20 5 EHBDRO Cc1csc([C@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000599046701 1033678351 /nfs/dbraw/zinc/67/83/51/1033678351.db2.gz KQQYNGHVANYEKC-NSHDSACASA-N 1 0 330.413 3.734 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)[C@H](C)c1ccccc1 ZINC000595098166 1033689645 /nfs/dbraw/zinc/68/96/45/1033689645.db2.gz BKLMBQNFPMTJGF-JXXFODFXSA-N 1 0 342.439 3.670 20 5 EHBDRO CC[C@@H]([NH2+]CC1(CC(=O)NC)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000595105955 1033691815 /nfs/dbraw/zinc/69/18/15/1033691815.db2.gz UZJTZGIMARVPGZ-QGZVFWFLSA-N 1 0 347.459 3.722 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(C2CCC2)cnn1C ZINC000595101926 1033691976 /nfs/dbraw/zinc/69/19/76/1033691976.db2.gz ZODCMVASFHWHNL-ZDUSSCGKSA-N 1 0 328.416 3.755 20 5 EHBDRO O=[N+]([O-])c1c(NC2CC[NH+](C3CCCC3)CC2)ccc2cnccc21 ZINC000599055769 1033697151 /nfs/dbraw/zinc/69/71/51/1033697151.db2.gz QOHYSABAVFNAJJ-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000595077186 1033697292 /nfs/dbraw/zinc/69/72/92/1033697292.db2.gz MYUQICLXOBZPLJ-FNHZYXHNSA-N 1 0 326.396 3.818 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060973 1033700726 /nfs/dbraw/zinc/70/07/26/1033700726.db2.gz ICONOWLMTAMBHD-SCLBCKFNSA-N 1 0 330.384 3.642 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2Cc3ccccc3CO2)cc1[N+](=O)[O-] ZINC000599062506 1033701676 /nfs/dbraw/zinc/70/16/76/1033701676.db2.gz XHDTTZHUYQJQDS-KSSFIOAISA-N 1 0 326.396 3.695 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C2CCC2)cnn1C ZINC000595096555 1033704273 /nfs/dbraw/zinc/70/42/73/1033704273.db2.gz BLUVINKDXVZPRY-AWEZNQCLSA-N 1 0 342.443 3.707 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)C1CC1 ZINC000599073230 1033713933 /nfs/dbraw/zinc/71/39/33/1033713933.db2.gz FZISCXQZCBIZTK-RTBURBONSA-N 1 0 343.471 3.522 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CO[C@@H](C2CC2)C1 ZINC000599086257 1033725858 /nfs/dbraw/zinc/72/58/58/1033725858.db2.gz ZQMQWLCQCDRQOJ-IJEWVQPXSA-N 1 0 336.457 3.623 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)ccc2cnccc21 ZINC000599097333 1033732642 /nfs/dbraw/zinc/73/26/42/1033732642.db2.gz BTIBFRCCZYXRKE-NVXWUHKLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000595343394 1033736231 /nfs/dbraw/zinc/73/62/31/1033736231.db2.gz QBZXIUHVAYEXIB-GOSISDBHSA-N 1 0 344.386 3.606 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC4(C3)CCCCC4)n2)c1 ZINC000129923103 1033812869 /nfs/dbraw/zinc/81/28/69/1033812869.db2.gz JKMZOBPORCKTKG-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000550665500 1033836222 /nfs/dbraw/zinc/83/62/22/1033836222.db2.gz KRUQTVFYVBMCOE-UYAOXDASSA-N 1 0 339.439 3.562 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CCc2ccccc21 ZINC000593094820 1033932617 /nfs/dbraw/zinc/93/26/17/1033932617.db2.gz IJGQHBOYITZDCI-CYBMUJFWSA-N 1 0 337.379 3.898 20 5 EHBDRO Cc1nccc([C@@H]2CCC[N@@H+]([C@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834321 1033959911 /nfs/dbraw/zinc/95/99/11/1033959911.db2.gz QNUWPUOEJHIVET-CZUORRHYSA-N 1 0 326.400 3.634 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000603849850 1033973145 /nfs/dbraw/zinc/97/31/45/1033973145.db2.gz WPKXTOBAPKVGLJ-UHFFFAOYSA-N 1 0 332.404 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH2+][C@H](c2ccccn2)C2CCC2)cc1 ZINC000599570538 1034003188 /nfs/dbraw/zinc/00/31/88/1034003188.db2.gz ZNHLJDYVQNMTPR-IBGZPJMESA-N 1 0 341.411 3.890 20 5 EHBDRO CCc1cc(CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)on1 ZINC000450289316 1034030781 /nfs/dbraw/zinc/03/07/81/1034030781.db2.gz UUMSUEUATJXBHH-UHFFFAOYSA-N 1 0 331.416 3.988 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097529 1034060553 /nfs/dbraw/zinc/06/05/53/1034060553.db2.gz YSLCWDCUIXHZLA-NVXWUHKLSA-N 1 0 331.460 3.676 20 5 EHBDRO COc1cc(NCC2CC[NH+](C3CC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596213126 1034122146 /nfs/dbraw/zinc/12/21/46/1034122146.db2.gz SMYYNUXJFBHOTA-UHFFFAOYSA-N 1 0 339.823 3.543 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000179371749 1034162524 /nfs/dbraw/zinc/16/25/24/1034162524.db2.gz IKVWHXWNEZJVGS-VXGBXAGGSA-N 1 0 347.440 3.951 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000441425849 1034314528 /nfs/dbraw/zinc/31/45/28/1034314528.db2.gz BTLOVOUEIOEITA-AWEZNQCLSA-N 1 0 328.412 3.975 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(N)c1 ZINC000596650614 1034348975 /nfs/dbraw/zinc/34/89/75/1034348975.db2.gz LXPPIZGRJLVZAM-HNNXBMFYSA-N 1 0 331.441 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCn2nccc21 ZINC000601319998 1034450683 /nfs/dbraw/zinc/45/06/83/1034450683.db2.gz CJLQRRUAMZCJRW-UAGQMJEPSA-N 1 0 340.427 3.627 20 5 EHBDRO CC(=O)c1ccc2c(c1)CC[N@H+]([C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534475662 1034600986 /nfs/dbraw/zinc/60/09/86/1034600986.db2.gz PWFNYBVTRCXBMM-CQSZACIVSA-N 1 0 338.407 3.959 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC3(COC3)C2)s1 ZINC000597230095 1034610974 /nfs/dbraw/zinc/61/09/74/1034610974.db2.gz POLBMDQBSLOLJU-UHFFFAOYSA-N 1 0 330.409 3.546 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000601962271 1034841366 /nfs/dbraw/zinc/84/13/66/1034841366.db2.gz CIHBDORBQSYQLC-LBPRGKRZSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000411471834 1034892058 /nfs/dbraw/zinc/89/20/58/1034892058.db2.gz GCZRAAAREBTDJP-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000411470475 1034897310 /nfs/dbraw/zinc/89/73/10/1034897310.db2.gz CERULVIPXHNFAQ-GJZGRUSLSA-N 1 0 341.411 3.605 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@H]1C ZINC000612530864 1035036236 /nfs/dbraw/zinc/03/62/36/1035036236.db2.gz ZBFSZOHKGMNFCC-FTLABTOESA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCO[C@@H](c2ccccc2)C1 ZINC000612577378 1035072562 /nfs/dbraw/zinc/07/25/62/1035072562.db2.gz BZDOYKPCWPCTSW-LJQANCHMSA-N 1 0 326.396 3.867 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3CCO[C@@H]3C13CCC3)CCC2 ZINC000248753909 1035536550 /nfs/dbraw/zinc/53/65/50/1035536550.db2.gz CHCJRZSZSMLRPZ-DDBAPUKQSA-N 1 0 328.412 3.519 20 5 EHBDRO Cc1cc(NC[C@H]2CC[N@@H+](C(C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000540648373 1035536812 /nfs/dbraw/zinc/53/68/12/1035536812.db2.gz USCXHWPHPWHCSH-CQSZACIVSA-N 1 0 328.416 3.594 20 5 EHBDRO C[N@@H+]1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000571573348 1035539348 /nfs/dbraw/zinc/53/93/48/1035539348.db2.gz RJBZRLUDQCVAFT-AEFFLSMTSA-N 1 0 345.830 3.783 20 5 EHBDRO CC(C)[C@@H](CO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000571916890 1035783032 /nfs/dbraw/zinc/78/30/32/1035783032.db2.gz LHQHDFLIEOSKDW-CQSZACIVSA-N 1 0 334.441 3.677 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000588232601 1035831151 /nfs/dbraw/zinc/83/11/51/1035831151.db2.gz QGZIJLHCIKBWSB-UKRRQHHQSA-N 1 0 348.830 3.983 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000588232723 1035832291 /nfs/dbraw/zinc/83/22/91/1035832291.db2.gz YYWYVAXISQSRRE-WFASDCNBSA-N 1 0 334.803 3.675 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000588232507 1035833365 /nfs/dbraw/zinc/83/33/65/1035833365.db2.gz KJZUWEUZFHUZKN-CZUORRHYSA-N 1 0 348.830 3.983 20 5 EHBDRO CC[C@H](C)[N@H+](C)CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047256 1035957448 /nfs/dbraw/zinc/95/74/48/1035957448.db2.gz YTZPWSOFVASMBX-FZMZJTMJSA-N 1 0 333.354 3.518 20 5 EHBDRO CCOc1cc(C[N@H+](C[C@@H]2CCCO2)C2CCCC2)ccc1[N+](=O)[O-] ZINC000492654888 1036113766 /nfs/dbraw/zinc/11/37/66/1036113766.db2.gz OLQWJGKNLHLUPK-KRWDZBQOSA-N 1 0 348.443 3.917 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201739 1036140315 /nfs/dbraw/zinc/14/03/15/1036140315.db2.gz YEWDODNKXBSBLW-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO CCC(CC)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CC1 ZINC000165334908 1036413840 /nfs/dbraw/zinc/41/38/40/1036413840.db2.gz CWEZICQQSDWWSA-UHFFFAOYSA-N 1 0 339.823 3.840 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@H+](C)C[C@H](C)c2ccccc2)c1 ZINC000589497026 1036438239 /nfs/dbraw/zinc/43/82/39/1036438239.db2.gz GUNLPVIMUAKAFK-AWEZNQCLSA-N 1 0 342.395 3.617 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@H+]1CCCC[C@@H]1C ZINC000180334767 1036695344 /nfs/dbraw/zinc/69/53/44/1036695344.db2.gz AKKXLMYYLJCSSV-HNNXBMFYSA-N 1 0 347.459 3.514 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1)N(C)C ZINC000443008633 1036794058 /nfs/dbraw/zinc/79/40/58/1036794058.db2.gz GZNMZXXGYBGRAL-KXBFYZLASA-N 1 0 327.428 3.684 20 5 EHBDRO C[C@@H](O)C(C)(C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000539521260 1036856995 /nfs/dbraw/zinc/85/69/95/1036856995.db2.gz XUERTMURKSCFIR-GFCCVEGCSA-N 1 0 348.374 3.775 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000590601502 1036965649 /nfs/dbraw/zinc/96/56/49/1036965649.db2.gz CMFLOQUQYJZZCG-XJKSGUPXSA-N 1 0 328.416 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3[nH]nc4ccccc43)C2)cc1 ZINC000590659590 1036995970 /nfs/dbraw/zinc/99/59/70/1036995970.db2.gz QWZVOJQKOKWIPB-OAHLLOKOSA-N 1 0 336.395 3.851 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)cccc1[N+](=O)[O-] ZINC000180645858 1037034609 /nfs/dbraw/zinc/03/46/09/1037034609.db2.gz HHVWGSZXOVECPZ-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])c1 ZINC000180708086 1037112136 /nfs/dbraw/zinc/11/21/36/1037112136.db2.gz KVUZTLHVMTWXJY-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO CCCC(C)(C)[N@H+](CCn1cc([N+](=O)[O-])cn1)Cc1cccs1 ZINC000549080647 1037146061 /nfs/dbraw/zinc/14/60/61/1037146061.db2.gz BBDNJLQBGCNQPL-UHFFFAOYSA-N 1 0 336.461 3.934 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1C ZINC000493282110 1037217264 /nfs/dbraw/zinc/21/72/64/1037217264.db2.gz SDXYCQBBINWWBQ-OLZOCXBDSA-N 1 0 325.840 3.553 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](c1cccs1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000193024490 1037270965 /nfs/dbraw/zinc/27/09/65/1037270965.db2.gz CEVOBRLZLLUOEO-HZPDHXFCSA-N 1 0 333.457 4.000 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2CC[C@@H]2c2ccccc2)n1 ZINC000595088392 1037312247 /nfs/dbraw/zinc/31/22/47/1037312247.db2.gz BNEBPLJGABLBTD-ZJPYXAASSA-N 1 0 340.427 3.811 20 5 EHBDRO C[C@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181033619 1037400648 /nfs/dbraw/zinc/40/06/48/1037400648.db2.gz ULLBQGQGAUAUTG-AWEZNQCLSA-N 1 0 336.395 3.846 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000532470207 1037413880 /nfs/dbraw/zinc/41/38/80/1037413880.db2.gz CFUNJGIUYAJXOM-XCRHUMRWSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000271839872 1037429575 /nfs/dbraw/zinc/42/95/75/1037429575.db2.gz ZBMAQOVLQRHPLV-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000271839869 1037432518 /nfs/dbraw/zinc/43/25/18/1037432518.db2.gz ZBMAQOVLQRHPLV-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1OC ZINC000532476526 1037515003 /nfs/dbraw/zinc/51/50/03/1037515003.db2.gz MWTITXXTIRGZNG-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CC[C@H]2CCC[C@@H]2C1 ZINC000532522759 1037547746 /nfs/dbraw/zinc/54/77/46/1037547746.db2.gz HVMOGMGFPYNLCF-KCYZZUKISA-N 1 0 345.443 3.870 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](c2ccccc2)[NH+]2CCCC2)c1 ZINC000462922079 1037558400 /nfs/dbraw/zinc/55/84/00/1037558400.db2.gz HKKNOPGVNFOQLS-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000045951468 1037583802 /nfs/dbraw/zinc/58/38/02/1037583802.db2.gz HVHXCBFHPXNIBE-OAHLLOKOSA-N 1 0 348.447 3.679 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000031538817 1037638246 /nfs/dbraw/zinc/63/82/46/1037638246.db2.gz NWBXCUXMBJHHQV-UHFFFAOYSA-N 1 0 327.384 3.689 20 5 EHBDRO Cc1cc(N2CC3(C[C@H]2C)CCOCC3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000591992611 1037780110 /nfs/dbraw/zinc/78/01/10/1037780110.db2.gz QUUBITAUBWTMBB-CQSZACIVSA-N 1 0 341.411 3.847 20 5 EHBDRO O=[N+]([O-])c1ccc(Sc2ccc(N[C@H]3C[NH2+]CC[C@H]3F)cc2)cc1 ZINC001168227203 1037813504 /nfs/dbraw/zinc/81/35/04/1037813504.db2.gz XCRCNTBGXUBMNR-SJORKVTESA-N 1 0 347.415 3.858 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1 ZINC000058525627 1038045801 /nfs/dbraw/zinc/04/58/01/1038045801.db2.gz WDQKNQZWBVGHTH-GOSISDBHSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000104151672 1038267651 /nfs/dbraw/zinc/26/76/51/1038267651.db2.gz IESVBPLDOHXXSO-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO [NH3+]Cc1cnn(-c2cnc3c4ccccc4c4ccccc4c3n2)c1 ZINC001168257293 1038289153 /nfs/dbraw/zinc/28/91/53/1038289153.db2.gz RNEWBQZJQMYUAX-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)c1 ZINC000461405800 1038401790 /nfs/dbraw/zinc/40/17/90/1038401790.db2.gz ZIWUULMUAACREN-UHFFFAOYSA-N 1 0 347.365 3.855 20 5 EHBDRO O=C(C[NH2+][C@@H](c1ccccc1)C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000104701884 1038489307 /nfs/dbraw/zinc/48/93/07/1038489307.db2.gz NEAYWTWCQRIPSG-IBGZPJMESA-N 1 0 339.395 3.664 20 5 EHBDRO CC[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000461734527 1038581956 /nfs/dbraw/zinc/58/19/56/1038581956.db2.gz UPPDJTBUMQFMGW-UHFFFAOYSA-N 1 0 331.338 3.818 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000539297941 1038764960 /nfs/dbraw/zinc/76/49/60/1038764960.db2.gz XAJLFOUHCSCRHV-QAPCUYQASA-N 1 0 330.359 3.601 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000480503520 1039613828 /nfs/dbraw/zinc/61/38/28/1039613828.db2.gz YNPWDQVEZYSQQI-ILCZHQDMSA-N 1 0 332.444 3.919 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417320312 1039677433 /nfs/dbraw/zinc/67/74/33/1039677433.db2.gz JJTQTCHQSONBTD-QGZVFWFLSA-N 1 0 327.384 3.556 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H](O)c2ccc(Cl)cc2Cl)c1 ZINC000111394796 1039728791 /nfs/dbraw/zinc/72/87/91/1039728791.db2.gz PZBJLLVHAIIACN-HNNXBMFYSA-N 1 0 341.194 3.725 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1COCc2ccccc21)C1CC1 ZINC000417364461 1039730903 /nfs/dbraw/zinc/73/09/03/1039730903.db2.gz MVUHVKZPWQPQJD-MOPGFXCFSA-N 1 0 338.407 3.777 20 5 EHBDRO Cc1ccc(CN(C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000007902851 1039732267 /nfs/dbraw/zinc/73/22/67/1039732267.db2.gz DOFZWEABJLKYFN-UHFFFAOYSA-N 1 0 347.802 3.627 20 5 EHBDRO COC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCC1 ZINC000480659861 1039850158 /nfs/dbraw/zinc/85/01/58/1039850158.db2.gz NNVLPZUPPFSOGJ-KRWDZBQOSA-N 1 0 332.444 3.855 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)CCCC(F)(F)F)c1[N+](=O)[O-] ZINC000894028787 1039995848 /nfs/dbraw/zinc/99/58/48/1039995848.db2.gz JHLBJNPGJSLHEY-VIFPVBQESA-N 1 0 336.310 3.520 20 5 EHBDRO C[C@H]([NH2+]CC1(N2CCSCC2)CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000480779651 1040002379 /nfs/dbraw/zinc/00/23/79/1040002379.db2.gz ODEZMISARNSNRJ-HNNXBMFYSA-N 1 0 349.500 3.607 20 5 EHBDRO COC1CCC(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1 ZINC000894082062 1040037325 /nfs/dbraw/zinc/03/73/25/1040037325.db2.gz PNPBUXDTKXUOTE-UHFFFAOYSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500075414 1040433756 /nfs/dbraw/zinc/43/37/56/1040433756.db2.gz PLUASMGBLMDSKW-YCPHGPKFSA-N 1 0 331.416 3.576 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481184756 1040446989 /nfs/dbraw/zinc/44/69/89/1040446989.db2.gz TVVOPVFLNODLGR-HOCLYGCPSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062301 1040583969 /nfs/dbraw/zinc/58/39/69/1040583969.db2.gz SUIZOFDZNNGMAK-ITDKRANNSA-N 1 0 342.399 3.874 20 5 EHBDRO C[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(F)F)C(C1CC1)C1CC1 ZINC000512709740 1040589614 /nfs/dbraw/zinc/58/96/14/1040589614.db2.gz FJWXXAXLHLXYSL-UHFFFAOYSA-N 1 0 326.343 3.817 20 5 EHBDRO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000418118967 1040613391 /nfs/dbraw/zinc/61/33/91/1040613391.db2.gz WTZIEDSWNJRVBF-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO C[NH+](C)C1(CNc2ccc(Br)cc2[N+](=O)[O-])CCCC1 ZINC000110450307 1041038379 /nfs/dbraw/zinc/03/83/79/1041038379.db2.gz XQNLUKKUPTWOGH-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCCN(c2ccccc2)C1 ZINC000433201790 1041056321 /nfs/dbraw/zinc/05/63/21/1041056321.db2.gz YFJFBHXVKIOZEK-QGZVFWFLSA-N 1 0 339.439 3.909 20 5 EHBDRO C[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1cc(F)c(Cl)cc1Cl ZINC000181642023 1041160538 /nfs/dbraw/zinc/16/05/38/1041160538.db2.gz WKRJYOBXUDWRMC-QMMMGPOBSA-N 1 0 347.177 3.588 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC000110596440 1041206192 /nfs/dbraw/zinc/20/61/92/1041206192.db2.gz CXOLOGVNABDPAQ-ALOPSCKCSA-N 1 0 338.411 3.597 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](CO)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433286166 1041222032 /nfs/dbraw/zinc/22/20/32/1041222032.db2.gz UFRXWXZZOMGPSC-ZWKOTPCHSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1ccccn1 ZINC000181771141 1042082417 /nfs/dbraw/zinc/08/24/17/1042082417.db2.gz BVVWNHMFLIEBCQ-CYBMUJFWSA-N 1 0 338.367 3.538 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1C[C@H](C)CC[C@H]1C(C)C ZINC000541614935 1042202187 /nfs/dbraw/zinc/20/21/87/1042202187.db2.gz VYBCEWCALQCCKE-VNQPRFMTSA-N 1 0 347.459 3.892 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC000893492588 1042266187 /nfs/dbraw/zinc/26/61/87/1042266187.db2.gz QVCAYJPHGGEPQN-GFCCVEGCSA-N 1 0 348.834 3.717 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000181828624 1042478203 /nfs/dbraw/zinc/47/82/03/1042478203.db2.gz FLFVTINMGNVCTR-INIZCTEOSA-N 1 0 330.384 3.723 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000128530742 1042628203 /nfs/dbraw/zinc/62/82/03/1042628203.db2.gz JBSWACGEGXERNN-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000128530103 1042628859 /nfs/dbraw/zinc/62/88/59/1042628859.db2.gz XOACSBFVCBMOSV-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1csc([C@H](C)C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000893563026 1042662575 /nfs/dbraw/zinc/66/25/75/1042662575.db2.gz HNNRSGPMAUBIJS-SECBINFHSA-N 1 0 325.821 3.906 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(NCC[NH+]3CCSCC3)cc2)cc1 ZINC001167836732 1043043008 /nfs/dbraw/zinc/04/30/08/1043043008.db2.gz FTLRLKMTYQEXRE-UHFFFAOYSA-N 1 0 343.452 3.723 20 5 EHBDRO CC(C)CC[N@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1CC1 ZINC000728896180 1043523190 /nfs/dbraw/zinc/52/31/90/1043523190.db2.gz FBEFKDARYBEEGE-UHFFFAOYSA-N 1 0 328.416 3.926 20 5 EHBDRO CCCOc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000236830941 1043556162 /nfs/dbraw/zinc/55/61/62/1043556162.db2.gz AGJAJTABBGLOPD-UHFFFAOYSA-N 1 0 344.411 3.990 20 5 EHBDRO C[C@H](O)c1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178544011 1043634894 /nfs/dbraw/zinc/63/48/94/1043634894.db2.gz DNNMZXOSQKHVHP-LIRRHRJNSA-N 1 0 340.423 3.759 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239365 1043639540 /nfs/dbraw/zinc/63/95/40/1043639540.db2.gz JWOLGSLRJKRMCZ-ZOWXZIJZSA-N 1 0 330.388 3.874 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000344321934 1043662471 /nfs/dbraw/zinc/66/24/71/1043662471.db2.gz GDSISAWILKIQDB-CYBMUJFWSA-N 1 0 338.791 3.579 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2ccc([Si](C)(C)C)cc2)cc1[N+](=O)[O-] ZINC001203161961 1043891421 /nfs/dbraw/zinc/89/14/21/1043891421.db2.gz SWQYKTRXMOXGGO-UHFFFAOYSA-N 1 0 342.515 3.781 20 5 EHBDRO Cc1ccc([C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)N2CCCC2)o1 ZINC000183645013 1125636143 /nfs/dbraw/zinc/63/61/43/1125636143.db2.gz NXDXFMJYOLWREY-SFHVURJKSA-N 1 0 343.427 3.731 20 5 EHBDRO C[N@H+](CCc1ccncc1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000183754795 1125773622 /nfs/dbraw/zinc/77/36/22/1125773622.db2.gz ZFBVXHGAQAQHLG-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO CCCN(CC[NH+](CC)CC)C(=O)/C(C)=C/c1ccc([N+](=O)[O-])cc1 ZINC000763769514 1126777300 /nfs/dbraw/zinc/77/73/00/1126777300.db2.gz MAPXUZQGAGEFII-FOCLMDBBSA-N 1 0 347.459 3.579 20 5 EHBDRO CCc1ccc(C(=O)Nc2ccc(CC[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC000081942936 1126801554 /nfs/dbraw/zinc/80/15/54/1126801554.db2.gz PGEQZGUNURDUBO-UHFFFAOYSA-N 1 0 341.411 3.514 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H](c2ccco2)N2CCCCC2)c1 ZINC000072726067 1126867809 /nfs/dbraw/zinc/86/78/09/1126867809.db2.gz GGJZMWXXDLVTLV-QGZVFWFLSA-N 1 0 329.400 3.505 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072746576 1126872229 /nfs/dbraw/zinc/87/22/29/1126872229.db2.gz WUIUWBHSLTUBGM-OALUTQOASA-N 1 0 326.396 3.913 20 5 EHBDRO C[C@@H]1C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)S1 ZINC000072771186 1126877783 /nfs/dbraw/zinc/87/77/83/1126877783.db2.gz DGRNNWVMYOGKEA-BETUJISGSA-N 1 0 347.440 3.618 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC000764434257 1127493704 /nfs/dbraw/zinc/49/37/04/1127493704.db2.gz VSZQTDUYNXQJDG-ZRGWGRIASA-N 1 0 331.460 3.978 20 5 EHBDRO Cc1nn(C[N@H+](C)CCCc2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764888595 1127545928 /nfs/dbraw/zinc/54/59/28/1127545928.db2.gz HFIMVEWUAQMVHU-UHFFFAOYSA-N 1 0 338.411 3.775 20 5 EHBDRO C[C@H]1CCCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765341980 1127600293 /nfs/dbraw/zinc/60/02/93/1127600293.db2.gz AYCUWCGGIHXYGD-HOTGVXAUSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000765333903 1127599568 /nfs/dbraw/zinc/59/95/68/1127599568.db2.gz NAEMEIGYMGQGHH-GJZGRUSLSA-N 1 0 326.396 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000265553862 1127690616 /nfs/dbraw/zinc/69/06/16/1127690616.db2.gz HMPUCLUTFCBNEP-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1cccc(F)c1[N+](=O)[O-] ZINC000301428412 1127764843 /nfs/dbraw/zinc/76/48/43/1127764843.db2.gz HTUCVKUPYFYMKO-MRXNPFEDSA-N 1 0 343.402 3.692 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@@H+]2CCc3sccc3C2)c1 ZINC000338644308 1127968742 /nfs/dbraw/zinc/96/87/42/1127968742.db2.gz FOAQLISWYSQFHP-GFCCVEGCSA-N 1 0 347.440 3.524 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000301443287 1128077054 /nfs/dbraw/zinc/07/70/54/1128077054.db2.gz VAJAUWOWVMEJHE-DOMZBBRYSA-N 1 0 332.429 3.546 20 5 EHBDRO CNC(=O)[C@H]1CCC[C@@H]1[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000765798010 1128380292 /nfs/dbraw/zinc/38/02/92/1128380292.db2.gz UFYBVNIKSQIHOM-FPOVZHCZSA-N 1 0 332.447 3.997 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H](c1ccc(Cl)cc1)[NH+](C)C ZINC000301477348 1128468224 /nfs/dbraw/zinc/46/82/24/1128468224.db2.gz PFICKRBIHJXWEU-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1ccnc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000301562898 1128494589 /nfs/dbraw/zinc/49/45/89/1128494589.db2.gz IWOZSXXQNCVHOU-NVXWUHKLSA-N 1 0 340.427 3.621 20 5 EHBDRO COc1cccc([C@H](CNc2cc(C)ccc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301586502 1128499542 /nfs/dbraw/zinc/49/95/42/1128499542.db2.gz VSNUGEPOUQCGCV-SFHVURJKSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)cc([N+](=O)[O-])c1 ZINC000123096448 1128586798 /nfs/dbraw/zinc/58/67/98/1128586798.db2.gz NBBMTDBIQUQIGI-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO CCCN(CC[NH+]1CCCCC1)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000554050129 1128605904 /nfs/dbraw/zinc/60/59/04/1128605904.db2.gz FRMGKSRJQGFETI-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO COc1cc(C)c([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000123155007 1128659566 /nfs/dbraw/zinc/65/95/66/1128659566.db2.gz UUBWEQIFSUDUEV-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO COCC[C@@H](Cc1cccc(F)c1)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123161432 1128660269 /nfs/dbraw/zinc/66/02/69/1128660269.db2.gz SHPHDCCBNCAWFA-SFHVURJKSA-N 1 0 346.402 3.514 20 5 EHBDRO COc1cccc(CCC[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000554846809 1128717099 /nfs/dbraw/zinc/71/70/99/1128717099.db2.gz IZYFINAOFBNTQQ-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCN1c2ccccc2C[C@H]1C ZINC001648938431 1120238293 /nfs/dbraw/zinc/23/82/93/1120238293.db2.gz QWZBDRGVUOBNHS-OAHLLOKOSA-N 1 0 339.439 3.752 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1 ZINC000494621277 1120700934 /nfs/dbraw/zinc/70/09/34/1120700934.db2.gz QTDCFDCAGRSBST-CEXWTWQISA-N 1 0 344.455 3.855 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000252212276 1120819409 /nfs/dbraw/zinc/81/94/09/1120819409.db2.gz WRRBBFCFKMLGID-WMZOPIPTSA-N 1 0 331.460 3.681 20 5 EHBDRO CC(C)[N@@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)CC1CCC1 ZINC000193207787 1120983336 /nfs/dbraw/zinc/98/33/36/1120983336.db2.gz AUWFFLQFAUWMFL-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193234584 1120995673 /nfs/dbraw/zinc/99/56/73/1120995673.db2.gz GPSGCVFDLDCBBI-QWHCGFSZSA-N 1 0 327.384 3.965 20 5 EHBDRO COc1cnccc1[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193328999 1121114116 /nfs/dbraw/zinc/11/41/16/1121114116.db2.gz ZHJXEFBNHUXVMP-YVEFUNNKSA-N 1 0 327.384 3.727 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000495460724 1121217253 /nfs/dbraw/zinc/21/72/53/1121217253.db2.gz LPHNDXLBKPWGHE-KRWDZBQOSA-N 1 0 326.396 3.585 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000495492509 1121231606 /nfs/dbraw/zinc/23/16/06/1121231606.db2.gz MLROMLWVTDXBJG-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3ccc([N+](=O)[O-])cc3F)cc2)CC1 ZINC000915212298 1121248978 /nfs/dbraw/zinc/24/89/78/1121248978.db2.gz ONSVOGSSKKBNFR-UHFFFAOYSA-N 1 0 344.390 3.619 20 5 EHBDRO Cc1cc(F)ccc1CN(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000487952026 1121342874 /nfs/dbraw/zinc/34/28/74/1121342874.db2.gz CMVAFCQBSDASQH-UHFFFAOYSA-N 1 0 346.358 3.541 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@H]2c2ccccc2)cc1 ZINC000762632412 1121389073 /nfs/dbraw/zinc/38/90/73/1121389073.db2.gz ISOBYQUINFZCMX-OALUTQOASA-N 1 0 326.396 3.855 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)cccc1[N+](=O)[O-] ZINC000542977376 1128982485 /nfs/dbraw/zinc/98/24/85/1128982485.db2.gz FSJCNUHSBLNQES-JCKWVBRZSA-N 1 0 345.443 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@H]2COCC[C@H]2C1 ZINC000921976309 1128989105 /nfs/dbraw/zinc/98/91/05/1128989105.db2.gz NBAVAFAASXDRKM-OFQRWUPVSA-N 1 0 338.835 3.586 20 5 EHBDRO Cc1csc(CCNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)n1 ZINC000322376026 1121645435 /nfs/dbraw/zinc/64/54/35/1121645435.db2.gz KMQHMJXOEOMWTA-UHFFFAOYSA-N 1 0 328.397 3.871 20 5 EHBDRO CC(=O)c1c(NC[C@H](c2ccc(F)cc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763203088 1121869507 /nfs/dbraw/zinc/86/95/07/1121869507.db2.gz KFXXITCTJYPIID-QGZVFWFLSA-N 1 0 345.374 3.651 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnc2)cc1 ZINC000194415332 1121884144 /nfs/dbraw/zinc/88/41/44/1121884144.db2.gz QQBJNNSZTKSXGH-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnc2)cc1 ZINC000194415321 1121884332 /nfs/dbraw/zinc/88/43/32/1121884332.db2.gz QQBJNNSZTKSXGH-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CCC[C@H]([NH2+]CCc1cn2ccccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000130627234 1121944923 /nfs/dbraw/zinc/94/49/23/1121944923.db2.gz BXOSDGZJEZZJLB-SFHVURJKSA-N 1 0 338.411 3.916 20 5 EHBDRO COc1cc(NC2CC[NH+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000301163173 1122217728 /nfs/dbraw/zinc/21/77/28/1122217728.db2.gz BAQXPFPOOBADNZ-UHFFFAOYSA-N 1 0 341.411 3.680 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2cc(F)ccc2[N+](=O)[O-])c1 ZINC000917087090 1122490971 /nfs/dbraw/zinc/49/09/71/1122490971.db2.gz QDNOISIUONMIMZ-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H](c2ccccc2)C2CCC2)c1 ZINC000154522935 1122684484 /nfs/dbraw/zinc/68/44/84/1122684484.db2.gz VRTMSMSSAABKJP-OALUTQOASA-N 1 0 326.396 3.759 20 5 EHBDRO Cc1cccc(NC(=O)C[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000556162142 1122849119 /nfs/dbraw/zinc/84/91/19/1122849119.db2.gz IOYLJKHELNBHNU-CABCVRRESA-N 1 0 341.411 3.971 20 5 EHBDRO C[NH+](C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000301794644 1129084136 /nfs/dbraw/zinc/08/41/36/1129084136.db2.gz PWNPQHPBVMUTAL-OAHLLOKOSA-N 1 0 339.317 3.727 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000918738972 1122902101 /nfs/dbraw/zinc/90/21/01/1122902101.db2.gz RETHBZMBWIQSAI-UHFFFAOYSA-N 1 0 332.375 3.807 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(OCC[NH+]3CCCC3)cc2)s1 ZINC000609513842 1123597353 /nfs/dbraw/zinc/59/73/53/1123597353.db2.gz XEIOVJWCIYPAIB-UHFFFAOYSA-N 1 0 347.440 3.743 20 5 EHBDRO C[NH+](C)C1(CNc2ncc([N+](=O)[O-])cc2Cl)CCCCCC1 ZINC000609890567 1123687532 /nfs/dbraw/zinc/68/75/32/1123687532.db2.gz MUYWMBJFPZMZJQ-UHFFFAOYSA-N 1 0 326.828 3.710 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615966697 1123919538 /nfs/dbraw/zinc/91/95/38/1123919538.db2.gz IDNVRAPCVJGOEF-ZBFHGGJFSA-N 1 0 330.432 3.727 20 5 EHBDRO C[C@@H](C[NH+]1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1ccccc1 ZINC000735077182 1131307138 /nfs/dbraw/zinc/30/71/38/1131307138.db2.gz GZNGZIZNYXLWQS-INIZCTEOSA-N 1 0 325.412 3.521 20 5 EHBDRO Cc1cc(NCCCOCC(F)(F)F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000181455418 1124854439 /nfs/dbraw/zinc/85/44/39/1124854439.db2.gz YKOHHXHZGDULQA-UHFFFAOYSA-N 1 0 343.305 3.832 20 5 EHBDRO CCc1cccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181806893 1125045680 /nfs/dbraw/zinc/04/56/80/1125045680.db2.gz FFERCPFERVZTDZ-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCO[C@@H]21 ZINC000618569917 1125114878 /nfs/dbraw/zinc/11/48/78/1125114878.db2.gz GZYIPTVNKOBTOD-HPBDAGMYSA-N 1 0 330.428 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC[C@@H]2C[NH+]2CCCCC2)c1 ZINC000735492046 1131353602 /nfs/dbraw/zinc/35/36/02/1131353602.db2.gz NDIXVPPIUNDTJW-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO[C@H]1C1CC1 ZINC000543242306 1129365783 /nfs/dbraw/zinc/36/57/83/1129365783.db2.gz JYRCIKWWZPTKFE-RBUKOAKNSA-N 1 0 342.395 3.902 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(c3cccc(F)c3[N+](=O)[O-])C2)CC1 ZINC000301977649 1129464806 /nfs/dbraw/zinc/46/48/06/1129464806.db2.gz FZOWOWBVJJKXAH-OAHLLOKOSA-N 1 0 335.423 3.682 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000922540143 1129568244 /nfs/dbraw/zinc/56/82/44/1129568244.db2.gz GTRFHDNWSGEFDH-AUUYWEPGSA-N 1 0 342.395 3.613 20 5 EHBDRO CCC1(CO)CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093591941 1129595162 /nfs/dbraw/zinc/59/51/62/1129595162.db2.gz YZVRXYPMPYJHPE-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@@H](Nc3ccccc3)C2)c(F)c1 ZINC000508990535 1129620993 /nfs/dbraw/zinc/62/09/93/1129620993.db2.gz JTGULZVCEJPSLD-CQSZACIVSA-N 1 0 347.365 3.950 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)C2(C[NH+](C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000331118918 1129653226 /nfs/dbraw/zinc/65/32/26/1129653226.db2.gz AGZVBEULARIUAS-HNNXBMFYSA-N 1 0 347.459 3.593 20 5 EHBDRO C[N@H+](CCn1cccn1)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000125279316 1129676229 /nfs/dbraw/zinc/67/62/29/1129676229.db2.gz VLRWAAOWJNATJB-UHFFFAOYSA-N 1 0 342.424 3.652 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CCC3(CCOCC3)O2)cc1[N+](=O)[O-] ZINC000922814104 1129676419 /nfs/dbraw/zinc/67/64/19/1129676419.db2.gz QJNMYCCSZUUJGE-MRXNPFEDSA-N 1 0 348.443 3.536 20 5 EHBDRO CCC[NH2+][C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021819960 1129736014 /nfs/dbraw/zinc/73/60/14/1129736014.db2.gz DDUONRJPJUFCCH-MRXNPFEDSA-N 1 0 347.802 3.928 20 5 EHBDRO C[C@@H](c1cccs1)N(C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000096990606 1129753656 /nfs/dbraw/zinc/75/36/56/1129753656.db2.gz MQRSKXOTSPYBMP-NSHDSACASA-N 1 0 344.396 3.899 20 5 EHBDRO Cc1cc(N2CC[C@]3(O)CCCC[C@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302066815 1129766259 /nfs/dbraw/zinc/76/62/59/1129766259.db2.gz FKQBODPHPLSWKL-IFXJQAMLSA-N 1 0 341.411 3.583 20 5 EHBDRO Cc1cc(NC[C@H]2CSCCS2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302078303 1129766567 /nfs/dbraw/zinc/76/65/67/1129766567.db2.gz KGDBNUGCNYYVOW-LBPRGKRZSA-N 1 0 335.454 3.712 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000302755985 1129789860 /nfs/dbraw/zinc/78/98/60/1129789860.db2.gz GDPGUKBJAMHOOU-HNNXBMFYSA-N 1 0 331.803 3.935 20 5 EHBDRO Cc1cc(NCC2(c3ccccn3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302852172 1129795309 /nfs/dbraw/zinc/79/53/09/1129795309.db2.gz JHQSKFRUYFXLPD-UHFFFAOYSA-N 1 0 334.379 3.990 20 5 EHBDRO CCOc1cc(CN2Cc3ccccc3O[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000429163988 1129906181 /nfs/dbraw/zinc/90/61/81/1129906181.db2.gz WGLBVXBCSAKAOO-AWEZNQCLSA-N 1 0 342.395 3.777 20 5 EHBDRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000305148328 1129912926 /nfs/dbraw/zinc/91/29/26/1129912926.db2.gz OACHXSSPPBXHFS-RLFYNMQTSA-N 1 0 328.412 3.800 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(F)cc3cccnc32)cc1 ZINC000132796147 1129918176 /nfs/dbraw/zinc/91/81/76/1129918176.db2.gz JIIPNAXRVPWHTG-UHFFFAOYSA-N 1 0 325.343 3.614 20 5 EHBDRO COc1cc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)ccc1OC(C)C ZINC000058093452 1129927250 /nfs/dbraw/zinc/92/72/50/1129927250.db2.gz WZBDVQLHMSCLGM-UHFFFAOYSA-N 1 0 344.411 3.723 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)CNC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000305881270 1129929982 /nfs/dbraw/zinc/92/99/82/1129929982.db2.gz BDWYJZWJJGBRCF-DOMZBBRYSA-N 1 0 337.420 3.549 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](c2cnn(C)c2)C(C)C)cc1[N+](=O)[O-] ZINC000922891843 1130019413 /nfs/dbraw/zinc/01/94/13/1130019413.db2.gz LOEHJUKNVISICN-SFHVURJKSA-N 1 0 330.432 3.939 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000008196752 1130039076 /nfs/dbraw/zinc/03/90/76/1130039076.db2.gz HNTSCCUYRDSTEV-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO C[C@H](CN(C)C(=O)OC(C)(C)C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000701880043 1130178006 /nfs/dbraw/zinc/17/80/06/1130178006.db2.gz UYPJRTDGDDNNFP-OLZOCXBDSA-N 1 0 337.420 3.501 20 5 EHBDRO Cc1cccc([C@H](C)[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000245448544 1130209217 /nfs/dbraw/zinc/20/92/17/1130209217.db2.gz MXTWDYUMFMDDLD-GOEBONIOSA-N 1 0 326.400 3.546 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[C@@H](O)C3)s2)cc1 ZINC000174430106 1130358756 /nfs/dbraw/zinc/35/87/56/1130358756.db2.gz AVOQGTKDBNYRQY-CZUORRHYSA-N 1 0 346.452 3.964 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc([N+](=O)[O-])c1 ZINC000766194133 1131161344 /nfs/dbraw/zinc/16/13/44/1131161344.db2.gz QBTXFGHERFRWBB-INIZCTEOSA-N 1 0 329.356 3.786 20 5 EHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057474 1131461761 /nfs/dbraw/zinc/46/17/61/1131461761.db2.gz RJVNCKDXBOWOOH-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253924 1131464626 /nfs/dbraw/zinc/46/46/26/1131464626.db2.gz JGKOCTGGKYHMCV-HNNXBMFYSA-N 1 0 328.416 3.928 20 5 EHBDRO O=[N+]([O-])c1c(NCC2C[NH+](Cc3ccccc3)C2)ccc2ncccc21 ZINC000716296651 1131498843 /nfs/dbraw/zinc/49/88/43/1131498843.db2.gz FVBPYBKUPUBUBP-UHFFFAOYSA-N 1 0 348.406 3.687 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1F ZINC000742430920 1131729978 /nfs/dbraw/zinc/72/99/78/1131729978.db2.gz YQXGLFNVXOLSFG-MRXNPFEDSA-N 1 0 343.402 3.692 20 5 EHBDRO CCCCN(CC)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900624 1131883430 /nfs/dbraw/zinc/88/34/30/1131883430.db2.gz WXALFGKAFPQYPN-SFHVURJKSA-N 1 0 333.476 3.554 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172901095 1131883521 /nfs/dbraw/zinc/88/35/21/1131883521.db2.gz JJSDFNLWUIGXGD-IEBWSBKVSA-N 1 0 325.412 3.978 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cncc(F)c1 ZINC001172900071 1131883904 /nfs/dbraw/zinc/88/39/04/1131883904.db2.gz BQCOUNWTKSYDDD-SJKOYZFVSA-N 1 0 329.375 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCCc3cccnc31)CC2 ZINC001172901992 1131884785 /nfs/dbraw/zinc/88/47/85/1131884785.db2.gz SDGHDKFKRULEPL-IEBWSBKVSA-N 1 0 337.423 3.904 20 5 EHBDRO [NH3+]Cc1nn([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc12 ZINC001172902124 1131885487 /nfs/dbraw/zinc/88/54/87/1131885487.db2.gz VQIHHMQTEXPCLE-HNNXBMFYSA-N 1 0 336.395 3.523 20 5 EHBDRO COc1cccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1F ZINC001172904032 1131886194 /nfs/dbraw/zinc/88/61/94/1131886194.db2.gz VFIPIZCIWPODHO-MRXNPFEDSA-N 1 0 344.386 3.780 20 5 EHBDRO [NH3+]Cc1ccc2cn([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)nc2c1 ZINC001172904606 1131886910 /nfs/dbraw/zinc/88/69/10/1131886910.db2.gz YSBMALXFUUCIPM-QGZVFWFLSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCOc3ccccc3C1)CC2 ZINC001172916409 1131903865 /nfs/dbraw/zinc/90/38/65/1131903865.db2.gz RMOBNOSBEUGUGA-GOSISDBHSA-N 1 0 338.407 3.737 20 5 EHBDRO CC[N@H+](Cc1cccnc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916379 1131904115 /nfs/dbraw/zinc/90/41/15/1131904115.db2.gz RJHXDCXLJCEUAU-SFHVURJKSA-N 1 0 325.412 3.759 20 5 EHBDRO CC(=O)c1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172912309 1131918152 /nfs/dbraw/zinc/91/81/52/1131918152.db2.gz NCLZXZRIBIKOES-IBGZPJMESA-N 1 0 338.407 3.835 20 5 EHBDRO CC[C@H](C)[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011934 1131935785 /nfs/dbraw/zinc/93/57/85/1131935785.db2.gz AYZLGINLTQGOJA-NSHDSACASA-N 1 0 327.375 3.572 20 5 EHBDRO C[N@H+](C1CCCC1)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173018352 1131936402 /nfs/dbraw/zinc/93/64/02/1131936402.db2.gz RUKJQQVJYWBAIO-UHFFFAOYSA-N 1 0 339.386 3.716 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2cccc(O)c2)c1F ZINC001173175502 1131990587 /nfs/dbraw/zinc/99/05/87/1131990587.db2.gz CWLYHCJBMQBZIC-NWDGAFQWSA-N 1 0 348.374 3.730 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC[C@@H](F)CC2)c1F ZINC001173174911 1131991243 /nfs/dbraw/zinc/99/12/43/1131991243.db2.gz FZQQPFFDMNGIJP-UTUOFQBUSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)NC(=[NH2+])c2cccc(C)c2)c1F ZINC001173194062 1131995175 /nfs/dbraw/zinc/99/51/75/1131995175.db2.gz XPOXWFXJDMPQSV-GFCCVEGCSA-N 1 0 345.374 3.597 20 5 EHBDRO COc1cc(F)c(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC001173216377 1132001790 /nfs/dbraw/zinc/00/17/90/1132001790.db2.gz IYUBHZIPYCHNAE-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173215793 1132002361 /nfs/dbraw/zinc/00/23/61/1132002361.db2.gz ZUSGWNKVKYRVIJ-HUUCEWRRSA-N 1 0 344.411 3.592 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173217807 1132002455 /nfs/dbraw/zinc/00/24/55/1132002455.db2.gz GGUMRZSONZWNJG-KBXCAEBGSA-N 1 0 326.396 3.948 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173218016 1132002554 /nfs/dbraw/zinc/00/25/54/1132002554.db2.gz IOEQSHUQIGAWJM-UGSOOPFHSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)C[C@H]1c1ccccc1 ZINC001173223477 1132004950 /nfs/dbraw/zinc/00/49/50/1132004950.db2.gz ANFJYUGABFRLNS-JXFKEZNVSA-N 1 0 339.439 3.515 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)c1ncccc1F ZINC001173226748 1132006627 /nfs/dbraw/zinc/00/66/27/1132006627.db2.gz ZIRFGNASPYFPJD-CYBMUJFWSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2c(F)cc(F)cc21 ZINC001173227576 1132007638 /nfs/dbraw/zinc/00/76/38/1132007638.db2.gz HBGFFUATNRPKCL-DIFFPNOSSA-N 1 0 348.349 3.917 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(Cc2ccncc2)CC1 ZINC001173229958 1132008004 /nfs/dbraw/zinc/00/80/04/1132008004.db2.gz CHGNENBSLQWXEW-MRXNPFEDSA-N 1 0 339.439 3.876 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1cccnc1F)C1CC1 ZINC001173229592 1132008024 /nfs/dbraw/zinc/00/80/24/1132008024.db2.gz NXTGBRNRVBHVRH-SJCJKPOMSA-N 1 0 329.375 3.801 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230670 1132009233 /nfs/dbraw/zinc/00/92/33/1132009233.db2.gz TYHPNKMEALALBU-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC001173233666 1132010572 /nfs/dbraw/zinc/01/05/72/1132010572.db2.gz XWPUUVUEXUNBAF-HNNXBMFYSA-N 1 0 340.423 3.983 20 5 EHBDRO COc1cccc(CC[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173235296 1132010868 /nfs/dbraw/zinc/01/08/68/1132010868.db2.gz VXMYHTXKUWQYSS-OAHLLOKOSA-N 1 0 328.412 3.709 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1ccc(O)cc1 ZINC001175050863 1132549929 /nfs/dbraw/zinc/54/99/29/1132549929.db2.gz HYCAHEFMAGIRRY-UHFFFAOYSA-N 1 0 345.402 3.950 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052531 1132549976 /nfs/dbraw/zinc/54/99/76/1132549976.db2.gz HAWVDZIQYFGLBP-BAABZTOOSA-N 1 0 349.406 3.741 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H](C)C1CCCCC1 ZINC001175229303 1132601323 /nfs/dbraw/zinc/60/13/23/1132601323.db2.gz NXYRXZVCJYAISE-OAHLLOKOSA-N 1 0 347.459 3.990 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168976737 1132617097 /nfs/dbraw/zinc/61/70/97/1132617097.db2.gz FYNVRYCASRVWKO-TUAOUCFPSA-N 1 0 327.222 3.545 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(C(F)(F)F)c1 ZINC001168986255 1132619918 /nfs/dbraw/zinc/61/99/18/1132619918.db2.gz XJBSDVFBOJWEHN-SMDDNHRTSA-N 1 0 330.350 3.976 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(C(F)(F)F)c1 ZINC001168986250 1132620466 /nfs/dbraw/zinc/62/04/66/1132620466.db2.gz XJBSDVFBOJWEHN-BXUZGUMPSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2c(Cl)cccc2C(F)(F)F)C1 ZINC001168972627 1132623289 /nfs/dbraw/zinc/62/32/89/1132623289.db2.gz NNKSZHARHWLXIB-NXEZZACHSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001168972681 1132623378 /nfs/dbraw/zinc/62/33/78/1132623378.db2.gz NQULLJBABBLTDH-ONGXEEELSA-N 1 0 336.741 3.894 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)c(Br)c1 ZINC001168997438 1132627113 /nfs/dbraw/zinc/62/71/13/1132627113.db2.gz ZKGPBSRLMXIFKW-JBLDHEPKSA-N 1 0 345.212 3.684 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)c(Br)c1 ZINC001168997437 1132627293 /nfs/dbraw/zinc/62/72/93/1132627293.db2.gz ZKGPBSRLMXIFKW-HOSYDEDBSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H]2CCOc3cc(C(F)(F)F)ccc32)C1 ZINC001168999475 1132627728 /nfs/dbraw/zinc/62/77/28/1132627728.db2.gz UFTUXQRBLLOFSD-QKCSRTOESA-N 1 0 344.333 3.564 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001169005896 1132629803 /nfs/dbraw/zinc/62/98/03/1132629803.db2.gz VQQPYZZNIBOFRD-BYCMXARLSA-N 1 0 341.249 3.935 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC3(CCCc4ccccc43)CC2)C1 ZINC001169010049 1132631376 /nfs/dbraw/zinc/63/13/76/1132631376.db2.gz AOABSPZCUPCVTO-AEFFLSMTSA-N 1 0 328.456 3.802 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990236 1132634872 /nfs/dbraw/zinc/63/48/72/1132634872.db2.gz YUOIIIBSAMEHOZ-RBSFLKMASA-N 1 0 330.432 3.700 20 5 EHBDRO C[N@H+](CCc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057914 1132646139 /nfs/dbraw/zinc/64/61/39/1132646139.db2.gz YXKXZQDVZAAALQ-ZFWWWQNUSA-N 1 0 330.350 3.625 20 5 EHBDRO CC1(C)C[C@@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@@](C)(C[NH3+])C1 ZINC001169142962 1132674241 /nfs/dbraw/zinc/67/42/41/1132674241.db2.gz IPECSGCNNZCWPC-QLJPJBMISA-N 1 0 349.460 3.555 20 5 EHBDRO COc1c(F)cc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169148262 1132678140 /nfs/dbraw/zinc/67/81/40/1132678140.db2.gz VLRZUWIXTAWMHD-SJKOYZFVSA-N 1 0 339.411 3.698 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1NCc1c(Cl)cncc1Cl)C[NH2+]C2 ZINC001169186317 1132686995 /nfs/dbraw/zinc/68/69/95/1132686995.db2.gz XRJSFESDTMLEHC-UHFFFAOYSA-N 1 0 339.182 3.512 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC001175991591 1132809122 /nfs/dbraw/zinc/80/91/22/1132809122.db2.gz GMGXTXFECAQKHM-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc2c(n1)[nH]cc2[N+](=O)[O-] ZINC001169683726 1132818091 /nfs/dbraw/zinc/81/80/91/1132818091.db2.gz NVZIPQFDZWZMBX-AWEZNQCLSA-N 1 0 337.383 3.711 20 5 EHBDRO CC(=O)N1CC=C(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)CC1 ZINC001176036483 1132825272 /nfs/dbraw/zinc/82/52/72/1132825272.db2.gz VRXQCZSUGXZLLB-UHFFFAOYSA-N 1 0 332.407 3.518 20 5 EHBDRO C[N@H+](CCc1ccc2c(c1)OCO2)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001176184241 1132858999 /nfs/dbraw/zinc/85/89/99/1132858999.db2.gz HIRORSRPHMCHFQ-UHFFFAOYSA-N 1 0 348.786 3.651 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NC[C@@H](CO)Cc1ccccc1 ZINC001169902908 1132893511 /nfs/dbraw/zinc/89/35/11/1132893511.db2.gz AQUHUDUXPAHICI-IBGZPJMESA-N 1 0 327.492 3.546 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@H+]1CCCC[C@H]1C ZINC000804352039 1132979174 /nfs/dbraw/zinc/97/91/74/1132979174.db2.gz NEQQGUYATWCMCX-CQSZACIVSA-N 1 0 333.432 3.864 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766838 1133050040 /nfs/dbraw/zinc/05/00/40/1133050040.db2.gz XXEMFNDEPUFUHT-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCC[C@@H]1C ZINC000768103672 1133095027 /nfs/dbraw/zinc/09/50/27/1133095027.db2.gz VEIGEJQBHMNAKX-LSDHHAIUSA-N 1 0 337.489 3.539 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccc(Cl)nc1 ZINC001178326202 1133160226 /nfs/dbraw/zinc/16/02/26/1133160226.db2.gz DLGGTNQYNVERAX-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO C[C@@H]1CCc2nc(C[NH2+]CCc3ccccc3[N+](=O)[O-])sc2C1 ZINC001178609604 1133185532 /nfs/dbraw/zinc/18/55/32/1133185532.db2.gz IMMNCLDZLQESON-GFCCVEGCSA-N 1 0 331.441 3.508 20 5 EHBDRO CC1(C)OCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001178754565 1133195957 /nfs/dbraw/zinc/19/59/57/1133195957.db2.gz QUIVCZRXCCDNJC-MRXNPFEDSA-N 1 0 332.425 3.980 20 5 EHBDRO CCOC(=O)CC(C)(C)C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001181878411 1133545566 /nfs/dbraw/zinc/54/55/66/1133545566.db2.gz ACGUVXYIXMWTOM-MRXNPFEDSA-N 1 0 348.443 3.754 20 5 EHBDRO Cc1cc(N2CCCC3(CC[NH+](C)CC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000798405725 1133604269 /nfs/dbraw/zinc/60/42/69/1133604269.db2.gz ZZEILQIZQSMZLE-UHFFFAOYSA-N 1 0 337.851 3.869 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000774146920 1133622104 /nfs/dbraw/zinc/62/21/04/1133622104.db2.gz JPAKVNZKPKFYBM-XYPHTWIQSA-N 1 0 346.406 3.807 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC001183865836 1133872929 /nfs/dbraw/zinc/87/29/29/1133872929.db2.gz VRJCQMPIQHPEOS-UHFFFAOYSA-N 1 0 331.460 3.662 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[C@H](C2CC2)O1 ZINC001184056389 1133891460 /nfs/dbraw/zinc/89/14/60/1133891460.db2.gz POGKVHYCZSAZBK-GXTWGEPZSA-N 1 0 345.226 3.949 20 5 EHBDRO Nc1ccc(NCC2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000786789570 1133904137 /nfs/dbraw/zinc/90/41/37/1133904137.db2.gz GSMSVZFFQRPBQX-UHFFFAOYSA-N 1 0 340.427 3.501 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccc2c1OCCO2 ZINC000786815415 1133910324 /nfs/dbraw/zinc/91/03/24/1133910324.db2.gz SJQMVCNKDDOMBM-GXDHUFHOSA-N 1 0 340.379 3.559 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1cc(C)oc1C ZINC000786812134 1133910354 /nfs/dbraw/zinc/91/03/54/1133910354.db2.gz GTKCNORSQXJEQB-RNNBRSHQSA-N 1 0 344.411 3.705 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)C[C@H](O)c1ccco1 ZINC000786820526 1133911246 /nfs/dbraw/zinc/91/12/46/1133911246.db2.gz KKQNIUVLRWYAJG-QGRJPZFESA-N 1 0 330.384 3.693 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376085 1133932861 /nfs/dbraw/zinc/93/28/61/1133932861.db2.gz ZSOVJZWVMRGHHT-PTNGSMBKSA-N 1 0 331.460 3.851 20 5 EHBDRO CC[C@@H](CNc1ccc([N+](=O)[O-])cc1Br)[NH+]1CCCC1 ZINC001184820429 1133994897 /nfs/dbraw/zinc/99/48/97/1133994897.db2.gz JUCBNHYPZHXCRG-NSHDSACASA-N 1 0 342.237 3.644 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1c(F)cc([N+](=O)[O-])cc1F ZINC001184874473 1134001303 /nfs/dbraw/zinc/00/13/03/1134001303.db2.gz OKRJSKAXXDPFCF-GFCCVEGCSA-N 1 0 327.375 3.940 20 5 EHBDRO O=[N+]([O-])c1ccccc1Nc1ccc(CC[NH+]2CCSCC2)cc1 ZINC001185099243 1134029116 /nfs/dbraw/zinc/02/91/16/1134029116.db2.gz YMFKDXWDZACBQT-UHFFFAOYSA-N 1 0 343.452 3.930 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1cc(F)ccc1[N+](=O)[O-] ZINC000746707730 1134038309 /nfs/dbraw/zinc/03/83/09/1134038309.db2.gz NMUMDBXPINZIEH-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO CC(C)[NH+](CCCNc1nc2c(cc1[N+](=O)[O-])CCCC2)C(C)C ZINC001185620871 1134118400 /nfs/dbraw/zinc/11/84/00/1134118400.db2.gz OCGIWVIARJUWLD-UHFFFAOYSA-N 1 0 334.464 3.789 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000788574824 1134147053 /nfs/dbraw/zinc/14/70/53/1134147053.db2.gz BDJCYRWQLJCUBT-MSOLQXFVSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@](O)(C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000788583392 1134148176 /nfs/dbraw/zinc/14/81/76/1134148176.db2.gz SSUWAKFHZGHGTD-QAPCUYQASA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788749545 1134164676 /nfs/dbraw/zinc/16/46/76/1134164676.db2.gz GUCJDFJFEZNJCR-AXHNFQJDSA-N 1 0 341.411 3.748 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCCC1 ZINC000789387486 1134261556 /nfs/dbraw/zinc/26/15/56/1134261556.db2.gz IAIQUTBNTVSVRS-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cccc1[N+](=O)[O-] ZINC000790695282 1134453951 /nfs/dbraw/zinc/45/39/51/1134453951.db2.gz MHZMVTVIMVMKNL-CYBMUJFWSA-N 1 0 329.356 3.971 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001170148495 1134508890 /nfs/dbraw/zinc/50/88/90/1134508890.db2.gz IIWNYKQWSOVEFM-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO CCOC(=O)C1(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000792196024 1134667254 /nfs/dbraw/zinc/66/72/54/1134667254.db2.gz POOZHHVFVXNCQZ-RVDMUPIBSA-N 1 0 346.427 3.711 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCCC12CCOCC2 ZINC001170195304 1134711364 /nfs/dbraw/zinc/71/13/64/1134711364.db2.gz TXBBJNSUTTUKOQ-QGZVFWFLSA-N 1 0 332.444 3.666 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCc2ccccc2)c([N+](=O)[O-])c1 ZINC001170298603 1134738139 /nfs/dbraw/zinc/73/81/39/1134738139.db2.gz MYKUFMICFZPLGT-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC001170298301 1134738303 /nfs/dbraw/zinc/73/83/03/1134738303.db2.gz IPCYCVIPLWWGCD-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170305680 1134739579 /nfs/dbraw/zinc/73/95/79/1134739579.db2.gz PKQUBQXBADMEFM-IFXJQAMLSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3c2cccc3F)c([N+](=O)[O-])c1 ZINC001170305491 1134740019 /nfs/dbraw/zinc/74/00/19/1134740019.db2.gz LRNPNEDMWAFSER-SGTLLEGYSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170313840 1134745363 /nfs/dbraw/zinc/74/53/63/1134745363.db2.gz RZCRPNDLGYMNMS-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO CC[C@@H](C)[NH+]1CCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC001170316299 1134745447 /nfs/dbraw/zinc/74/54/47/1134745447.db2.gz WGMSFYCLZNMNMT-GFCCVEGCSA-N 1 0 345.365 3.530 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c([N+](=O)[O-])c1 ZINC001170328256 1134749815 /nfs/dbraw/zinc/74/98/15/1134749815.db2.gz IPLPAMYHZXNYEC-YVEFUNNKSA-N 1 0 342.395 3.517 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334092 1134751364 /nfs/dbraw/zinc/75/13/64/1134751364.db2.gz BDHZDVCKBOOIAA-LNSITVRQSA-N 1 0 340.370 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2Cc3ccccc3C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170353119 1134753712 /nfs/dbraw/zinc/75/37/12/1134753712.db2.gz WGZOCBFUQGLFNY-CABCVRRESA-N 1 0 340.423 3.981 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCCc2ccccc21 ZINC000792869812 1134804318 /nfs/dbraw/zinc/80/43/18/1134804318.db2.gz DSBJYJYMHKJTCJ-SFHVURJKSA-N 1 0 341.367 3.844 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@H]2CCC(C)C)c([N+](=O)[O-])c1 ZINC001192157618 1134972079 /nfs/dbraw/zinc/97/20/79/1134972079.db2.gz HSPPPPCLWWYKRV-HNNXBMFYSA-N 1 0 336.432 3.883 20 5 EHBDRO COc1cc([N+](=O)[O-])c(NC2CC(C)(C)[NH+](C)C(C)(C)C2)cc1F ZINC001170451912 1135089340 /nfs/dbraw/zinc/08/93/40/1135089340.db2.gz SULIIDNFQSNMDX-UHFFFAOYSA-N 1 0 339.411 3.806 20 5 EHBDRO C[C@@H]1C[C@@H](C)C[NH+](CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)C1 ZINC001194477551 1135276667 /nfs/dbraw/zinc/27/66/67/1135276667.db2.gz MLIQADZJDBLRQC-LMMKCTJWSA-N 1 0 345.487 3.752 20 5 EHBDRO CC(C)C[C@]1(C)CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC001194536345 1135283042 /nfs/dbraw/zinc/28/30/42/1135283042.db2.gz ZQNQFLSDLOFSEP-SFHVURJKSA-N 1 0 333.432 3.824 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@]3(CCSC3)C2)cc1 ZINC001195093188 1135368620 /nfs/dbraw/zinc/36/86/20/1135368620.db2.gz IABQWOUUZVTZJY-QGZVFWFLSA-N 1 0 336.457 3.583 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001195179240 1135378537 /nfs/dbraw/zinc/37/85/37/1135378537.db2.gz MYGITJPJDWZFNP-CBBWQLFWSA-N 1 0 333.432 3.726 20 5 EHBDRO CC1(C)CCC[C@@](CO)([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC001196219484 1135534065 /nfs/dbraw/zinc/53/40/65/1135534065.db2.gz YQBZILIHYXLWTF-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cncc4ccccc43)c2c1 ZINC000808452163 1135669928 /nfs/dbraw/zinc/66/99/28/1135669928.db2.gz AHYKDLJOVKJEFH-UHFFFAOYSA-N 1 0 346.390 3.957 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccn2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC001197657265 1135717440 /nfs/dbraw/zinc/71/74/40/1135717440.db2.gz AKKAEGZMJUVZRO-AWEZNQCLSA-N 1 0 334.379 3.903 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809689231 1135871787 /nfs/dbraw/zinc/87/17/87/1135871787.db2.gz LGLGQEMGSLVEOT-QGZVFWFLSA-N 1 0 334.803 3.634 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809951444 1135905361 /nfs/dbraw/zinc/90/53/61/1135905361.db2.gz CFLGUTPKEZODLC-UHFFFAOYSA-N 1 0 346.258 3.818 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC3(CCC3)[C@@H]2[C@H]2CCCO2)ccc1Cl ZINC000810093560 1135920266 /nfs/dbraw/zinc/92/02/66/1135920266.db2.gz OCYLLNWFZZDZNT-CVEARBPZSA-N 1 0 336.819 3.782 20 5 EHBDRO CCCC[C@H](C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000810125324 1135923992 /nfs/dbraw/zinc/92/39/92/1135923992.db2.gz UAZLBYOOLZEISB-LBPRGKRZSA-N 1 0 325.384 3.573 20 5 EHBDRO COCC1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCCCC1 ZINC000810178321 1135934611 /nfs/dbraw/zinc/93/46/11/1135934611.db2.gz RWRKHMAJEUZGQE-UHFFFAOYSA-N 1 0 326.824 3.935 20 5 EHBDRO Cc1ncc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)s1 ZINC001201549730 1136035835 /nfs/dbraw/zinc/03/58/35/1136035835.db2.gz QEUIMJADHKJFDC-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO COc1ccc([C@@H](OC)[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001201704133 1136054511 /nfs/dbraw/zinc/05/45/11/1136054511.db2.gz MEJGGIOMYRQDKY-KUHUBIRLSA-N 1 0 344.411 3.778 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473614 1136095693 /nfs/dbraw/zinc/09/56/93/1136095693.db2.gz FMLBPMLWTSDUBB-LLVKDONJSA-N 1 0 346.258 3.866 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCCC[C@H]1O ZINC000811480848 1136097679 /nfs/dbraw/zinc/09/76/79/1136097679.db2.gz IBKAHRZSDRZNSD-TVQRCGJNSA-N 1 0 333.215 3.542 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811506560 1136101730 /nfs/dbraw/zinc/10/17/30/1136101730.db2.gz AEACYQKTXFQHAQ-LLVKDONJSA-N 1 0 346.258 3.722 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274957 1136128926 /nfs/dbraw/zinc/12/89/26/1136128926.db2.gz DYSRNZCYUMMEPZ-PXAZEXFGSA-N 1 0 334.803 3.975 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000812772950 1136244933 /nfs/dbraw/zinc/24/49/33/1136244933.db2.gz SXDZGPROOBCXOI-CQSZACIVSA-N 1 0 333.215 3.806 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850530497 1136279830 /nfs/dbraw/zinc/27/98/30/1136279830.db2.gz ZFAWPLCUODHMNX-BJOOFOGMSA-N 1 0 342.395 3.823 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000852034815 1136428448 /nfs/dbraw/zinc/42/84/48/1136428448.db2.gz JFHDHUVTBJXUFX-MSOLQXFVSA-N 1 0 332.375 3.582 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585086 1136442446 /nfs/dbraw/zinc/44/24/46/1136442446.db2.gz SOJQKJJBLLGUMZ-LJHODMEESA-N 1 0 326.396 3.506 20 5 EHBDRO CCC[N@@H+](Cc1ccc(F)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579113 1136444312 /nfs/dbraw/zinc/44/43/12/1136444312.db2.gz JSVSBMABOUKHCD-GOSISDBHSA-N 1 0 332.375 3.680 20 5 EHBDRO CC(C)[N@@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580029 1136444539 /nfs/dbraw/zinc/44/45/39/1136444539.db2.gz QPEQVZPXECSFCO-SFHVURJKSA-N 1 0 332.375 3.678 20 5 EHBDRO CCc1ccc(C(C)(C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776604299 1136466132 /nfs/dbraw/zinc/46/61/32/1136466132.db2.gz AYNYXGLDBBPXAW-SFHVURJKSA-N 1 0 328.412 3.716 20 5 EHBDRO Cc1cccc2c1CCC[C@H]2[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000853126137 1136512314 /nfs/dbraw/zinc/51/23/14/1136512314.db2.gz BXHDUDWFAPKGGD-RTBURBONSA-N 1 0 326.396 3.604 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)C2)C1 ZINC000814909438 1136523643 /nfs/dbraw/zinc/52/36/43/1136523643.db2.gz LMNYJUWOWWITNQ-HNNXBMFYSA-N 1 0 343.349 3.536 20 5 EHBDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591286 1136616028 /nfs/dbraw/zinc/61/60/28/1136616028.db2.gz BZVHHWIDHYAFIU-PXAZEXFGSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc2c(s1)CCCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570302 1136617449 /nfs/dbraw/zinc/61/74/49/1136617449.db2.gz YPMHLHKKHDMPEA-LLVKDONJSA-N 1 0 331.441 3.968 20 5 EHBDRO Cc1ccc(OCCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815572472 1136618005 /nfs/dbraw/zinc/61/80/05/1136618005.db2.gz DQQHONGYDVNFNO-AWEZNQCLSA-N 1 0 329.400 3.605 20 5 EHBDRO Cc1ccc(SC[C@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819239706 1136923746 /nfs/dbraw/zinc/92/37/46/1136923746.db2.gz VKJRWEDNEJFSQC-KSSFIOAISA-N 1 0 346.452 3.707 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]Cc2ccc(C3CCC3)cc2)c1 ZINC000819262748 1136929981 /nfs/dbraw/zinc/92/99/81/1136929981.db2.gz OGVPXRULCKVALA-LJQANCHMSA-N 1 0 326.396 3.686 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CC[C@H](c3cccc(F)c3)C2)c1 ZINC000819279507 1136930973 /nfs/dbraw/zinc/93/09/73/1136930973.db2.gz MPAOCQPPHBPRMH-UCLAIMLFSA-N 1 0 344.386 3.693 20 5 EHBDRO Cc1ccc(-c2noc([C@@H]3C[C@H]4CCCC[C@H]4[NH2+]3)n2)cc1[N+](=O)[O-] ZINC000822722290 1137071736 /nfs/dbraw/zinc/07/17/36/1137071736.db2.gz DFNTVGKTJDIVMK-BNOWGMLFSA-N 1 0 328.372 3.546 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc4c(n3)[nH]cc4[N+](=O)[O-])c2c1 ZINC001171163831 1137275088 /nfs/dbraw/zinc/27/50/88/1137275088.db2.gz FPZLRNCLKZPWNH-LBPRGKRZSA-N 1 0 349.394 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c(C(F)F)c1 ZINC000865548355 1137294033 /nfs/dbraw/zinc/29/40/33/1137294033.db2.gz FPDBMTHOFAHYBW-CYBMUJFWSA-N 1 0 339.386 3.987 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H](C[NH+]3CCCCC3)C2)c(C(F)F)c1 ZINC000865561388 1137295505 /nfs/dbraw/zinc/29/55/05/1137295505.db2.gz MFLTXEHNVLDDGH-ZDUSSCGKSA-N 1 0 339.386 3.845 20 5 EHBDRO CSC1(CNc2cc(Cl)c(F)cc2[N+](=O)[O-])CC[NH+](C)CC1 ZINC000845548591 1137298832 /nfs/dbraw/zinc/29/88/32/1137298832.db2.gz KJOCWGSHFUAXLM-UHFFFAOYSA-N 1 0 347.843 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](C3CC3)CC2)c(C(F)F)c1 ZINC000865732037 1137307577 /nfs/dbraw/zinc/30/75/77/1137307577.db2.gz QDUYEOYPZRFQEK-UHFFFAOYSA-N 1 0 325.359 3.819 20 5 EHBDRO CSC1(CNc2ccc([N+](=O)[O-])cc2C(F)F)CC[NH+](C)CC1 ZINC000865817632 1137314049 /nfs/dbraw/zinc/31/40/49/1137314049.db2.gz LLZNDLHQKJQZRL-UHFFFAOYSA-N 1 0 345.415 3.772 20 5 EHBDRO COCC[C@H]([NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccco1 ZINC000866338163 1137347176 /nfs/dbraw/zinc/34/71/76/1137347176.db2.gz YBJGDFPWWZXRJV-WFASDCNBSA-N 1 0 336.363 3.625 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000866367753 1137349961 /nfs/dbraw/zinc/34/99/61/1137349961.db2.gz OHFGTQBAFBLNSJ-UONOGXRCSA-N 1 0 336.407 3.604 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](C)[C@@](C)(O)c1ccccc1 ZINC000866383416 1137350712 /nfs/dbraw/zinc/35/07/12/1137350712.db2.gz LSPDJWYXQBNCKO-PJIJBLCYSA-N 1 0 346.402 3.551 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866541077 1137363112 /nfs/dbraw/zinc/36/31/12/1137363112.db2.gz VVOXQYOJJOEOFA-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866540196 1137363265 /nfs/dbraw/zinc/36/32/65/1137363265.db2.gz KTLWTKFSBJFCAI-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCSCCC(F)(F)F ZINC000866542634 1137363421 /nfs/dbraw/zinc/36/34/21/1137363421.db2.gz KNDKBIMZZWVFTD-GFCCVEGCSA-N 1 0 334.363 3.857 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCO2 ZINC000772979695 1137398299 /nfs/dbraw/zinc/39/82/99/1137398299.db2.gz SPWIXCOERLWSDM-SFHVURJKSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000715136652 1137476261 /nfs/dbraw/zinc/47/62/61/1137476261.db2.gz MEPOUFSSBFWQQP-YDHLFZDLSA-N 1 0 349.431 3.549 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123322601 1137511569 /nfs/dbraw/zinc/51/15/69/1137511569.db2.gz LAJMTNKSTQKJKT-AWEZNQCLSA-N 1 0 343.383 3.656 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CN[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)C1 ZINC000872023193 1137565391 /nfs/dbraw/zinc/56/53/91/1137565391.db2.gz CZRCRVJCVPEKQF-KBPBESRZSA-N 1 0 337.489 3.699 20 5 EHBDRO C[C@H]([NH2+]CCCCNc1ccccn1)c1c(F)cccc1[N+](=O)[O-] ZINC000872032434 1137566577 /nfs/dbraw/zinc/56/65/77/1137566577.db2.gz TZSFDNOULYBPDG-ZDUSSCGKSA-N 1 0 332.379 3.672 20 5 EHBDRO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042542 1137567289 /nfs/dbraw/zinc/56/72/89/1137567289.db2.gz BZSVAPIEGCCEGA-XNJGSVPQSA-N 1 0 332.375 3.897 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C[C@H](C)O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872043223 1137567356 /nfs/dbraw/zinc/56/73/56/1137567356.db2.gz HPAYUNWATDAJJP-LZWOXQAQSA-N 1 0 346.402 3.939 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCOC3(CCCC3)C2)cc1 ZINC000872048302 1137567842 /nfs/dbraw/zinc/56/78/42/1137567842.db2.gz IEGAXOPUCRITKX-QGZVFWFLSA-N 1 0 332.444 3.999 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000872059971 1137568691 /nfs/dbraw/zinc/56/86/91/1137568691.db2.gz KZQVHAHEQFWOLI-ZBFHGGJFSA-N 1 0 340.851 3.974 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)Cc1ccccn1 ZINC000872084433 1137570439 /nfs/dbraw/zinc/57/04/39/1137570439.db2.gz SBQGPTFLILGRTC-STQMWFEESA-N 1 0 331.441 3.994 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cnccc1C ZINC000872084683 1137570461 /nfs/dbraw/zinc/57/04/61/1137570461.db2.gz KBSXBKWCGGLCMS-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ncc(Cl)s1)C1CC1 ZINC000872115955 1137572209 /nfs/dbraw/zinc/57/22/09/1137572209.db2.gz NLFPYQMNBIHTRU-LBPRGKRZSA-N 1 0 337.832 3.816 20 5 EHBDRO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873060852 1137589230 /nfs/dbraw/zinc/58/92/30/1137589230.db2.gz CXKHFIJARAFIEO-QGZVFWFLSA-N 1 0 342.395 3.834 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cc(N)cc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000873288603 1137596512 /nfs/dbraw/zinc/59/65/12/1137596512.db2.gz JHBSDZJMMHPILD-QGZVFWFLSA-N 1 0 329.375 3.828 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C(C)C ZINC000877024926 1137667951 /nfs/dbraw/zinc/66/79/51/1137667951.db2.gz SPXZAUYLEQSZCZ-JTTJXQCZSA-N 1 0 328.416 3.790 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CCC[C@@H](c4ccccc4)C3)C2)c1 ZINC000877475087 1137677501 /nfs/dbraw/zinc/67/75/01/1137677501.db2.gz LTLUYUICJAVZAL-MRLCAUJQSA-N 1 0 340.427 3.811 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(C4CCC4)cc3)C2)c1 ZINC000877475613 1137677514 /nfs/dbraw/zinc/67/75/14/1137677514.db2.gz JWNZOUBJERCBQZ-UHFFFAOYSA-N 1 0 326.400 3.552 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CCCc4ccc(Cl)cc43)C2)c1 ZINC000877661766 1137684773 /nfs/dbraw/zinc/68/47/73/1137684773.db2.gz GTFAYCMTTXVAKB-MQBCKMQZSA-N 1 0 346.818 3.815 20 5 EHBDRO C[C@@H]1C[C@H](C)[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878127043 1137703544 /nfs/dbraw/zinc/70/35/44/1137703544.db2.gz XFIXYFZREWFYDK-ZJUUUORDSA-N 1 0 336.779 3.529 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878188203 1137706285 /nfs/dbraw/zinc/70/62/85/1137706285.db2.gz MBQNFXHBVWSJNH-AOOOYVTPSA-N 1 0 336.779 3.671 20 5 EHBDRO Cn1cc(C[NH2+][C@@H](c2ccccc2)C2CCCCC2)c([N+](=O)[O-])n1 ZINC000878327022 1137711142 /nfs/dbraw/zinc/71/11/42/1137711142.db2.gz XJANHTTVJIFZLQ-KRWDZBQOSA-N 1 0 328.416 3.740 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2nc(C)ccc2[N+](=O)[O-])CC1 ZINC000882817068 1137835018 /nfs/dbraw/zinc/83/50/18/1137835018.db2.gz MJPDUGNKVHCELH-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO COc1ccc(C2CC2)cc1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000883265788 1137851539 /nfs/dbraw/zinc/85/15/39/1137851539.db2.gz LABCRDZVAZAEMR-LBPRGKRZSA-N 1 0 341.411 3.914 20 5 EHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000331849601 1137922825 /nfs/dbraw/zinc/92/28/25/1137922825.db2.gz CURAICFXJMVQFA-LJISPDSOSA-N 1 0 338.477 3.539 20 5 EHBDRO COCC[C@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282917913 1137955703 /nfs/dbraw/zinc/95/57/03/1137955703.db2.gz XSXUDWDXCVXYPH-DOMZBBRYSA-N 1 0 326.824 3.586 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)NCCCCC[NH+]2CCCCC2)c1C ZINC000888916735 1138039914 /nfs/dbraw/zinc/03/99/14/1138039914.db2.gz JCEANGCWQOIHJX-UHFFFAOYSA-N 1 0 347.459 3.598 20 5 EHBDRO CO[C@H]1CCC[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CC1 ZINC000886119141 1138048713 /nfs/dbraw/zinc/04/87/13/1138048713.db2.gz YTXNUZGTDFJLFD-ZBFHGGJFSA-N 1 0 331.416 3.556 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324882 1138155154 /nfs/dbraw/zinc/15/51/54/1138155154.db2.gz MBNRSNNKAQZDDM-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3F)CCOCC2)cc1 ZINC000089803237 1138205634 /nfs/dbraw/zinc/20/56/34/1138205634.db2.gz ATRHZROTONRADM-UHFFFAOYSA-N 1 0 348.349 3.669 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770287 1138240905 /nfs/dbraw/zinc/24/09/05/1138240905.db2.gz BKCGETOOGFJFSP-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1cccc([N+](=O)[O-])c1 ZINC000128726146 1138396361 /nfs/dbraw/zinc/39/63/61/1138396361.db2.gz ZCKOCECIBHXLGG-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])o1 ZINC000131347972 1138511942 /nfs/dbraw/zinc/51/19/42/1138511942.db2.gz VLKHPJUEGYATHL-OAHLLOKOSA-N 1 0 346.383 3.550 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H](Cc1ccccn1)c1cccnc1 ZINC000338168620 1138772747 /nfs/dbraw/zinc/77/27/47/1138772747.db2.gz CHIYGNCVXMNHDW-IBGZPJMESA-N 1 0 348.406 3.501 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(COC)cc2)cc1[N+](=O)[O-] ZINC000152735786 1139106788 /nfs/dbraw/zinc/10/67/88/1139106788.db2.gz STVINMOGGWVGAB-CQSZACIVSA-N 1 0 344.411 3.991 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311271 1139566729 /nfs/dbraw/zinc/56/67/29/1139566729.db2.gz AYOJDMNMENZCKH-QHZMEWJKSA-N 1 0 348.443 3.876 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000177317385 1139611923 /nfs/dbraw/zinc/61/19/23/1139611923.db2.gz LVFHQFVWKVEHHC-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627607 1139769387 /nfs/dbraw/zinc/76/93/87/1139769387.db2.gz QCOJKNZTCZWMNS-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO CC(C)Oc1cccc([C@@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000179672429 1139774024 /nfs/dbraw/zinc/77/40/24/1139774024.db2.gz QBCDPPMJCBVRNE-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000183986437 1140071659 /nfs/dbraw/zinc/07/16/59/1140071659.db2.gz PZYVTLZSIALICJ-GOEBONIOSA-N 1 0 336.432 3.993 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000184009912 1140074099 /nfs/dbraw/zinc/07/40/99/1140074099.db2.gz YDISQABVBKCBEH-SNVBAGLBSA-N 1 0 325.821 3.940 20 5 EHBDRO CC1(C)OCc2cc(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)ccc2O1 ZINC000186406394 1140202860 /nfs/dbraw/zinc/20/28/60/1140202860.db2.gz KPUZKKQIWICTCE-UHFFFAOYSA-N 1 0 328.368 3.530 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1nccs1 ZINC000186749590 1140220338 /nfs/dbraw/zinc/22/03/38/1140220338.db2.gz JTFXKNWRNZKHDK-WFASDCNBSA-N 1 0 331.441 3.766 20 5 EHBDRO CC(C)(C)c1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000777445091 1140300928 /nfs/dbraw/zinc/30/09/28/1140300928.db2.gz FFJGUDHPHGHWIP-OAHLLOKOSA-N 1 0 334.441 3.777 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCS2 ZINC000191528828 1140470482 /nfs/dbraw/zinc/47/04/82/1140470482.db2.gz RLCLROSRIWUAMD-INIZCTEOSA-N 1 0 330.409 3.930 20 5 EHBDRO COC(=O)Nc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000266794313 1140725004 /nfs/dbraw/zinc/72/50/04/1140725004.db2.gz QHRDBWWBRUYERI-CYBMUJFWSA-N 1 0 343.383 3.666 20 5 EHBDRO COC(=O)Nc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000266795829 1140725085 /nfs/dbraw/zinc/72/50/85/1140725085.db2.gz QHRDBWWBRUYERI-ZDUSSCGKSA-N 1 0 343.383 3.666 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1c2ccccc2C[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000269126624 1141069346 /nfs/dbraw/zinc/06/93/46/1141069346.db2.gz YSQKEXXWYNHPGQ-IPMKNSEASA-N 1 0 326.396 3.684 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c1 ZINC000270399727 1141218047 /nfs/dbraw/zinc/21/80/47/1141218047.db2.gz VTIRCFZBPHNVRP-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(CC)CC1 ZINC000271136029 1141312897 /nfs/dbraw/zinc/31/28/97/1141312897.db2.gz NDCRGNFPKFTAEW-CQSZACIVSA-N 1 0 337.489 3.539 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccncc1 ZINC000271136740 1141313154 /nfs/dbraw/zinc/31/31/54/1141313154.db2.gz NIKXHEMQDUAYGN-OAHLLOKOSA-N 1 0 331.441 3.693 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCOC3(CCC3)C2)cc1[N+](=O)[O-] ZINC000271515338 1141385564 /nfs/dbraw/zinc/38/55/64/1141385564.db2.gz OPZBABKBORKYRR-DZGCQCFKSA-N 1 0 334.416 3.746 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000271669385 1141415353 /nfs/dbraw/zinc/41/53/53/1141415353.db2.gz MSOSIWPZBKKUTA-MRXNPFEDSA-N 1 0 327.384 3.583 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl ZINC000271844834 1141420764 /nfs/dbraw/zinc/42/07/64/1141420764.db2.gz WQJSHGWMRMFBFI-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO CNC(=O)CC[C@H]1CCCC[N@@H+]1Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000348836522 1141592740 /nfs/dbraw/zinc/59/27/40/1141592740.db2.gz CTTFELHQISFOJS-MRXNPFEDSA-N 1 0 347.459 3.599 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000537967423 1032068694 /nfs/dbraw/zinc/06/86/94/1032068694.db2.gz JDKXDCZWAQGUBS-ZDUSSCGKSA-N 1 0 347.390 3.530 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1[N+](=O)[O-] ZINC000183262770 1125484366 /nfs/dbraw/zinc/48/43/66/1125484366.db2.gz OVWYUUIVBRRIIJ-PLYYQAHHSA-N 1 0 330.428 3.902 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000339408834 1014372062 /nfs/dbraw/zinc/37/20/62/1014372062.db2.gz DTSGLDSPVLBPST-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000430219550 1015071127 /nfs/dbraw/zinc/07/11/27/1015071127.db2.gz OCOLMYKJASUBJX-SFHVURJKSA-N 1 0 326.396 3.714 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCCC2)nc1 ZINC000198603963 1125492520 /nfs/dbraw/zinc/49/25/20/1125492520.db2.gz BKSBHALYFBGCMP-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)Cc1cccc2[nH]ccc21 ZINC000430239314 1015182871 /nfs/dbraw/zinc/18/28/71/1015182871.db2.gz SFCWJUZKPXPLKM-UHFFFAOYSA-N 1 0 325.368 3.717 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000120614788 1015708296 /nfs/dbraw/zinc/70/82/96/1015708296.db2.gz RDNIXPKNXFWRFW-STQMWFEESA-N 1 0 330.432 3.535 20 5 EHBDRO Cc1c(NC(=O)CC[NH+](CC(C)C)CC(C)C)cccc1[N+](=O)[O-] ZINC000060090268 1015822490 /nfs/dbraw/zinc/82/24/90/1015822490.db2.gz SPDXSPLNMOLXMY-UHFFFAOYSA-N 1 0 335.448 3.846 20 5 EHBDRO C[C@@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384731 1016121995 /nfs/dbraw/zinc/12/19/95/1016121995.db2.gz KDLXXJFYCIOTSV-LFPIHBKWSA-N 1 0 346.452 3.568 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccncn2)CC1 ZINC000414473817 1016768427 /nfs/dbraw/zinc/76/84/27/1016768427.db2.gz WJACBSLIIBQEOG-PTNGSMBKSA-N 1 0 338.411 3.668 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1ccc(Cl)c([N+](=O)[O-])c1 ZINC000782940239 1016781890 /nfs/dbraw/zinc/78/18/90/1016781890.db2.gz TYXNDIBUUCCSLE-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO CN(C)[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000237030546 1016802354 /nfs/dbraw/zinc/80/23/54/1016802354.db2.gz IVDSPPCALIDVAQ-QGZVFWFLSA-N 1 0 345.468 3.753 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)c1ccc(F)cc1 ZINC000414526132 1016953369 /nfs/dbraw/zinc/95/33/69/1016953369.db2.gz KOHRHRNZCQJVBF-ZGUWOUCSSA-N 1 0 344.386 3.503 20 5 EHBDRO C[C@@H](CC[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000376651104 1016954826 /nfs/dbraw/zinc/95/48/26/1016954826.db2.gz JOMDNCHTNUZNQL-HNNXBMFYSA-N 1 0 328.416 3.622 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@H](CO)C2)s1 ZINC000414564490 1016961951 /nfs/dbraw/zinc/96/19/51/1016961951.db2.gz DPRUIMIXJSCWLJ-KBPBESRZSA-N 1 0 346.452 3.964 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000484973645 1032176927 /nfs/dbraw/zinc/17/69/27/1032176927.db2.gz YRPLEGIYBMNTKE-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CCOc1ccc(OCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000538176987 1032197097 /nfs/dbraw/zinc/19/70/97/1032197097.db2.gz WYINTCGFOOXZOE-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOc2ccc(F)cc21 ZINC000449121745 1032215087 /nfs/dbraw/zinc/21/50/87/1032215087.db2.gz IVKNOMPNIZOEGW-LRDDRELGSA-N 1 0 330.359 3.778 20 5 EHBDRO Cc1c([C@H](C)N[C@@H](C[NH+](C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368979 1032251798 /nfs/dbraw/zinc/25/17/98/1032251798.db2.gz PVQVZKDNOAOGGV-KSSFIOAISA-N 1 0 345.418 3.996 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449174618 1032266616 /nfs/dbraw/zinc/26/66/16/1032266616.db2.gz PMPLTBOJYPPPAH-CABCVRRESA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCCO)c1ccccc1 ZINC000449162843 1032278844 /nfs/dbraw/zinc/27/88/44/1032278844.db2.gz UGKSJSHBTNVALU-QAPCUYQASA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C ZINC000449251088 1032358209 /nfs/dbraw/zinc/35/82/09/1032358209.db2.gz QSGBNJMILMKJQN-GQIGUUNPSA-N 1 0 341.455 3.807 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000449266801 1032387250 /nfs/dbraw/zinc/38/72/50/1032387250.db2.gz XMHOWFQNZBJAIP-QKYXUNIQSA-N 1 0 340.423 3.893 20 5 EHBDRO COc1cc(N2CCC(C[NH+]3CCCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000610275520 1017278778 /nfs/dbraw/zinc/27/87/78/1017278778.db2.gz XPEPWHZEDVAEQX-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC1 ZINC000459803688 1032482591 /nfs/dbraw/zinc/48/25/91/1032482591.db2.gz NXAGBNWPQCQUQR-HNNXBMFYSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@H]4CC[C@@H](C3)[NH2+]4)s2)cc1 ZINC000414661782 1017111110 /nfs/dbraw/zinc/11/11/10/1017111110.db2.gz QDQGIPPNXHEJHT-CABCVRRESA-N 1 0 343.452 3.650 20 5 EHBDRO COC(C)(C)C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610271697 1017161954 /nfs/dbraw/zinc/16/19/54/1017161954.db2.gz XMODVEHSDAHPTH-UHFFFAOYSA-N 1 0 343.427 3.877 20 5 EHBDRO CC(C)Cn1nccc1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000592363665 1032684762 /nfs/dbraw/zinc/68/47/62/1032684762.db2.gz JIGWSFWRBFPIFJ-UHFFFAOYSA-N 1 0 330.432 3.560 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593456720 1032699350 /nfs/dbraw/zinc/69/93/50/1032699350.db2.gz FWIKTDUWMAXEPS-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3c[nH]c4ncccc34)CC2)cc1 ZINC000118837576 1017627792 /nfs/dbraw/zinc/62/77/92/1017627792.db2.gz QBYGMVSTOJODBN-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C/c1ccc([N+](=O)[O-])cc1 ZINC000177346746 1017649227 /nfs/dbraw/zinc/64/92/27/1017649227.db2.gz ZIEXWGQQUGEBKB-DHZHZOJOSA-N 1 0 339.395 3.617 20 5 EHBDRO COc1cc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)cc(OC)c1 ZINC000123331185 1017826987 /nfs/dbraw/zinc/82/69/87/1017826987.db2.gz DUBAHIPZNZEDFU-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO C[C@H](CCc1n[nH]c2ccccc21)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000541153047 1017879225 /nfs/dbraw/zinc/87/92/25/1017879225.db2.gz DWUUFMKUIMEAAZ-CQSZACIVSA-N 1 0 338.411 3.625 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3nc[nH]c3C2)c2ccccc2)c1 ZINC000377799749 1018394631 /nfs/dbraw/zinc/39/46/31/1018394631.db2.gz YWSRMZCRZGKJLG-UZLBHIALSA-N 1 0 348.406 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[NH+]3C4CCCC3CCC4)o2)cc1 ZINC000610370100 1018541026 /nfs/dbraw/zinc/54/10/26/1018541026.db2.gz UQEWISUIWDCBKY-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000592404655 1032777717 /nfs/dbraw/zinc/77/77/17/1032777717.db2.gz VQQYKBMYYYSHDZ-AEGPPILISA-N 1 0 334.416 3.756 20 5 EHBDRO C[C@H]([NH2+][C@@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997947 1018935459 /nfs/dbraw/zinc/93/54/59/1018935459.db2.gz CRGBNLRVOJOOIM-TXPKVOOTSA-N 1 0 339.439 3.908 20 5 EHBDRO Cc1c(C[NH+]2CCC(c3ccc(O)cc3)CC2)cccc1[N+](=O)[O-] ZINC000052467497 1018960584 /nfs/dbraw/zinc/96/05/84/1018960584.db2.gz RFKRXEYHGFBMGW-UHFFFAOYSA-N 1 0 326.396 3.988 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccccc1F ZINC000592402474 1032796949 /nfs/dbraw/zinc/79/69/49/1032796949.db2.gz HMPJIQVBDMOLDB-KDOFPFPSSA-N 1 0 346.402 3.768 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)[nH]c1C(C)C ZINC000894192634 1019103945 /nfs/dbraw/zinc/10/39/45/1019103945.db2.gz HAMSXTAQVADYMU-LBPRGKRZSA-N 1 0 345.399 3.684 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1cccc([N+](=O)[O-])c1 ZINC000610451269 1019770832 /nfs/dbraw/zinc/77/08/32/1019770832.db2.gz KOVXXJPJVVQJAI-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO Cc1cc2nc3ccc(N(C)C)cc3nc2cc1Nc1c[nH+]cn1C ZINC001211250038 1019797982 /nfs/dbraw/zinc/79/79/82/1019797982.db2.gz FKLZZGMPPBUWQL-UHFFFAOYSA-N 1 0 332.411 3.635 20 5 EHBDRO CC[NH+](CC)CCN(CC(C)C)C(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000579820243 1019929911 /nfs/dbraw/zinc/92/99/11/1019929911.db2.gz DPGIPCWRBIXDBP-INIZCTEOSA-N 1 0 349.475 3.525 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)C1CCC(F)(F)CC1 ZINC000594045441 1032875721 /nfs/dbraw/zinc/87/57/21/1032875721.db2.gz YASGYVMLXKQYSQ-NSHDSACASA-N 1 0 328.359 3.907 20 5 EHBDRO COc1cc2c(cc1OC)[C@@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC000602438213 1032890509 /nfs/dbraw/zinc/89/05/09/1032890509.db2.gz CDWBHRQKKYCWQB-KRWDZBQOSA-N 1 0 342.395 3.731 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000090770663 1020914953 /nfs/dbraw/zinc/91/49/53/1020914953.db2.gz WZBVLHODUZRSMB-RDTXWAMCSA-N 1 0 326.396 3.759 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000537967422 1021025548 /nfs/dbraw/zinc/02/55/48/1021025548.db2.gz JDKXDCZWAQGUBS-CYBMUJFWSA-N 1 0 347.390 3.530 20 5 EHBDRO CCOC(=O)CC1CC[NH+](Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000507368590 1021224923 /nfs/dbraw/zinc/22/49/23/1021224923.db2.gz ARHJKULOLJTXJS-UHFFFAOYSA-N 1 0 348.443 3.883 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000439261148 1021284877 /nfs/dbraw/zinc/28/48/77/1021284877.db2.gz QKVDIVRMHFPURT-IBGZPJMESA-N 1 0 328.412 3.758 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCOC[C@@H]1Cc1ccccc1 ZINC000507685692 1021434940 /nfs/dbraw/zinc/43/49/40/1021434940.db2.gz ULEVWCKOYIUJQE-SMTIMMHKSA-N 1 0 338.407 3.552 20 5 EHBDRO C[C@@H](CC[NH3+])[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414897592 1021516398 /nfs/dbraw/zinc/51/63/98/1021516398.db2.gz RWGCAALBHGRHMM-LBPRGKRZSA-N 1 0 349.818 3.867 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2ccc([N+](=O)[O-])nc2)c2cccs2)CC1 ZINC000550299673 1021522905 /nfs/dbraw/zinc/52/29/05/1021522905.db2.gz JNFONUDBFNZYKJ-HNNXBMFYSA-N 1 0 346.456 3.936 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH2+]C2([C@H]3CCCCO3)CC2)c1 ZINC000933375687 1021561011 /nfs/dbraw/zinc/56/10/11/1021561011.db2.gz MFSLYEWPJOWNCD-CQSZACIVSA-N 1 0 344.333 3.805 20 5 EHBDRO Cn1cc(C[N@H+](C)C[C@@H]2CC=CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000519670682 1021611451 /nfs/dbraw/zinc/61/14/51/1021611451.db2.gz LOQQJBXNYAZFBP-OAHLLOKOSA-N 1 0 340.427 3.783 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602601391 1032995118 /nfs/dbraw/zinc/99/51/18/1032995118.db2.gz KSACGIJXUOUYTI-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCCO2 ZINC000090910175 1021694113 /nfs/dbraw/zinc/69/41/13/1021694113.db2.gz JEQQTEVPYVALCO-SFHVURJKSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000090910082 1021696476 /nfs/dbraw/zinc/69/64/76/1021696476.db2.gz SGQQTUZUWDROCC-KRWDZBQOSA-N 1 0 344.411 3.895 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H]1CCN2C(=O)c1cccc2cc3ccccc3cc21 ZINC001270531656 1021714208 /nfs/dbraw/zinc/71/42/08/1021714208.db2.gz PSCSJFJANRTCLA-SFTDATJTSA-N 1 0 330.431 3.912 20 5 EHBDRO CC(C)c1[nH+]c(CN(C)Cc2ccccc2[N+](=O)[O-])c2ccccn21 ZINC000519820371 1021714723 /nfs/dbraw/zinc/71/47/23/1021714723.db2.gz FGAKDZIKKOSDCE-UHFFFAOYSA-N 1 0 338.411 3.998 20 5 EHBDRO C[C@@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610538627 1021819649 /nfs/dbraw/zinc/81/96/49/1021819649.db2.gz YBKGZFPMCCXXRY-DNVCBOLYSA-N 1 0 336.395 3.883 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@H]1CCO[C@@H](C2CC2)C1 ZINC000602617026 1033009596 /nfs/dbraw/zinc/00/95/96/1033009596.db2.gz MYFBZVSDBZIPHS-DZGCQCFKSA-N 1 0 344.333 3.661 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H](CCCc2ccccc2)C1 ZINC000441181639 1022040490 /nfs/dbraw/zinc/04/04/90/1022040490.db2.gz SQEWJVZXVMZLKH-KRWDZBQOSA-N 1 0 342.443 3.563 20 5 EHBDRO COCC1(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000517143809 1022068442 /nfs/dbraw/zinc/06/84/42/1022068442.db2.gz DPFQGMBVTFWWHM-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](C2CCC(C)CC2)CC1 ZINC000441376165 1022196589 /nfs/dbraw/zinc/19/65/89/1022196589.db2.gz CRXZIMFDZPHRPW-AQFXKWCLSA-N 1 0 331.460 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[C@H]3CCOC3)o2)cc1 ZINC000449684255 1033039183 /nfs/dbraw/zinc/03/91/83/1033039183.db2.gz OWPSPCNHNYORBG-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000178238720 1022250498 /nfs/dbraw/zinc/25/04/98/1022250498.db2.gz USLVLCDGRSJRDU-INIZCTEOSA-N 1 0 330.384 3.723 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602637294 1033046311 /nfs/dbraw/zinc/04/63/11/1033046311.db2.gz LSZSOYQFBNDYCU-CQSZACIVSA-N 1 0 345.365 3.530 20 5 EHBDRO C[C@H]1[C@@H](CO)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968576 1022520785 /nfs/dbraw/zinc/52/07/85/1022520785.db2.gz SNCIJFJQJCVWMF-QWHCGFSZSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@H]3CO)s2)cc1 ZINC000449702877 1033063746 /nfs/dbraw/zinc/06/37/46/1033063746.db2.gz DWQJOHBJCJWFIX-BBRMVZONSA-N 1 0 332.425 3.574 20 5 EHBDRO CC(C)=CCC[C@@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602682977 1033082640 /nfs/dbraw/zinc/08/26/40/1033082640.db2.gz ZJNADYUQYKNFRS-OAHLLOKOSA-N 1 0 332.448 3.683 20 5 EHBDRO Cn1cc(C[NH2+]C2CC(C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000550255254 1022872007 /nfs/dbraw/zinc/87/20/07/1022872007.db2.gz QRYOORFTEYOJDI-UHFFFAOYSA-N 1 0 342.443 3.910 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNCC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000509573908 1023071818 /nfs/dbraw/zinc/07/18/18/1023071818.db2.gz WBFUMSOYDPMNPZ-HNNXBMFYSA-N 1 0 349.475 3.594 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@H]1C ZINC000509578314 1023075987 /nfs/dbraw/zinc/07/59/87/1023075987.db2.gz HFKSEQCLGDTGAR-LIBAHTEVSA-N 1 0 348.349 3.916 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000426201168 1023084798 /nfs/dbraw/zinc/08/47/98/1023084798.db2.gz MQVKFLVAAKLZJU-UHFFFAOYSA-N 1 0 326.824 3.765 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCCO1 ZINC000506438193 1023140186 /nfs/dbraw/zinc/14/01/86/1023140186.db2.gz HAWNXVDHYGHUJC-OAHLLOKOSA-N 1 0 332.425 3.934 20 5 EHBDRO CN(Cc1cccc2c1OC(C)(C)C2)Cc1ccccc1[N+](=O)[O-] ZINC000507145111 1023147103 /nfs/dbraw/zinc/14/71/03/1023147103.db2.gz QZNKXDAQQJESHU-UHFFFAOYSA-N 1 0 326.396 3.940 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC3([C@@H]4CCCCO4)CCC3)nc2c1 ZINC000602744184 1033111002 /nfs/dbraw/zinc/11/10/02/1033111002.db2.gz YYFKXTMTVCPDDH-INIZCTEOSA-N 1 0 345.399 3.565 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H]2c2c(C)n[nH]c2C)ccc1[N+](=O)[O-] ZINC000276960195 1023478295 /nfs/dbraw/zinc/47/82/95/1023478295.db2.gz VIOOYRKPWKFGGN-INIZCTEOSA-N 1 0 344.415 3.671 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000510967794 1023540944 /nfs/dbraw/zinc/54/09/44/1023540944.db2.gz MAQYVKWTHCGQCF-AWEZNQCLSA-N 1 0 348.443 3.957 20 5 EHBDRO CC(=O)c1ccc(NC2CC[NH+](CC3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000063282688 1033148512 /nfs/dbraw/zinc/14/85/12/1033148512.db2.gz IECITNXHWXXRTP-UHFFFAOYSA-N 1 0 345.443 3.864 20 5 EHBDRO CC(C)C[C@@H]([NH2+]Cc1c([N+](=O)[O-])ncn1C)c1ccc(Cl)cc1 ZINC000341908404 1023680009 /nfs/dbraw/zinc/68/00/09/1023680009.db2.gz PYPKUJGYCGANJR-CQSZACIVSA-N 1 0 336.823 3.859 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1ccccc1Cl ZINC000602768222 1033164630 /nfs/dbraw/zinc/16/46/30/1033164630.db2.gz YCFYFOJAHQNBSX-HNNXBMFYSA-N 1 0 334.807 3.590 20 5 EHBDRO CCSc1ccc([C@H](C)[NH2+]CCn2c(C)ncc2[N+](=O)[O-])cc1 ZINC000602798515 1033172267 /nfs/dbraw/zinc/17/22/67/1033172267.db2.gz CPFBZLIEUDGIFR-LBPRGKRZSA-N 1 0 334.445 3.563 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOC(F)(F)F ZINC000474060856 1023963351 /nfs/dbraw/zinc/96/33/51/1023963351.db2.gz RRFSJPDAXAIDQA-SNVBAGLBSA-N 1 0 338.351 3.592 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000449764287 1033176964 /nfs/dbraw/zinc/17/69/64/1033176964.db2.gz AIBPMFIJCRLVGO-QGZVFWFLSA-N 1 0 346.452 3.958 20 5 EHBDRO C[C@@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000522664118 1024157595 /nfs/dbraw/zinc/15/75/95/1024157595.db2.gz JHMUDXNISKBJAE-INIZCTEOSA-N 1 0 325.412 3.521 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N[C@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000538276639 1024276488 /nfs/dbraw/zinc/27/64/88/1024276488.db2.gz LHNNXHWUCZCBSQ-CVEARBPZSA-N 1 0 349.475 3.885 20 5 EHBDRO CC(C)[C@@H](O)C1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000538488154 1024397116 /nfs/dbraw/zinc/39/71/16/1024397116.db2.gz RJSDUQXHEYPKQK-GOSISDBHSA-N 1 0 344.411 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CC34CC(O)C4)o2)c(Cl)c1 ZINC000897851104 1033210282 /nfs/dbraw/zinc/21/02/82/1033210282.db2.gz PHJMXVIIMUZYEX-PCHQZIJMSA-N 1 0 348.786 3.511 20 5 EHBDRO C[N@H+](CCCCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000435051760 1024581617 /nfs/dbraw/zinc/58/16/17/1024581617.db2.gz YGWNPTLZLXLXBI-UHFFFAOYSA-N 1 0 334.441 3.918 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895581233 1024638283 /nfs/dbraw/zinc/63/82/83/1024638283.db2.gz MNEWZKZQSMPCEW-CTXBLAANSA-N 1 0 329.425 3.944 20 5 EHBDRO CC[C@@](C)([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(F)cc1 ZINC000895693563 1024729421 /nfs/dbraw/zinc/72/94/21/1024729421.db2.gz GTOLQNXSYJHEQX-GOSISDBHSA-N 1 0 348.374 3.863 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000514892759 1024839137 /nfs/dbraw/zinc/83/91/37/1024839137.db2.gz BAPUVPWRCTZNCY-KBPBESRZSA-N 1 0 348.447 3.542 20 5 EHBDRO CC(C)(C)[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001168403614 1033248306 /nfs/dbraw/zinc/24/83/06/1033248306.db2.gz OKKXDRKYBTXSNA-LLVKDONJSA-N 1 0 339.823 3.555 20 5 EHBDRO Cc1nn(C(C)C)cc1C[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000281470026 1025079666 /nfs/dbraw/zinc/07/96/66/1025079666.db2.gz URARGOOOIUYFBG-UHFFFAOYSA-N 1 0 336.823 3.666 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3C[C@@H]4CCC[C@H]34)cs2)c1 ZINC000897952466 1033259557 /nfs/dbraw/zinc/25/95/57/1033259557.db2.gz GRIRILLYCPDBSO-KNXALSJPSA-N 1 0 329.425 3.997 20 5 EHBDRO CC[C@@H]([NH2+][C@H](CCOC)Cc1ccco1)c1cccc([N+](=O)[O-])c1 ZINC000346810063 1025131280 /nfs/dbraw/zinc/13/12/80/1025131280.db2.gz QOTOFKVAIZUWIM-CRAIPNDOSA-N 1 0 332.400 3.876 20 5 EHBDRO COC1CCC([N@H+](C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000265216815 1025133563 /nfs/dbraw/zinc/13/35/63/1025133563.db2.gz NLKVEYJLYLOVEX-UHFFFAOYSA-N 1 0 336.432 3.771 20 5 EHBDRO C[C@H](CC[NH+](C)C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000520981275 1025157878 /nfs/dbraw/zinc/15/78/78/1025157878.db2.gz YMJZLUCKZPOCQP-CQSZACIVSA-N 1 0 341.411 3.578 20 5 EHBDRO Cc1ccccc1[C@@H](O)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163185064 1025196037 /nfs/dbraw/zinc/19/60/37/1025196037.db2.gz ZWHLUTOXWQKDPT-ICSRJNTNSA-N 1 0 340.423 3.548 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)cnn1C ZINC000294588082 1025246300 /nfs/dbraw/zinc/24/63/00/1025246300.db2.gz MXFRNCIMSWODPC-VIFPVBQESA-N 1 0 342.321 3.506 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000602948732 1033273905 /nfs/dbraw/zinc/27/39/05/1033273905.db2.gz DSCYRPSKFUFPLL-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO Nc1ccc2c(c1)CC[C@@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000574532186 1033274233 /nfs/dbraw/zinc/27/42/33/1033274233.db2.gz LAZPGTGMQULDRP-HNNXBMFYSA-N 1 0 349.337 3.556 20 5 EHBDRO CC[NH+]1CCC(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000321095006 1025386805 /nfs/dbraw/zinc/38/68/05/1025386805.db2.gz GXNZZVHPVVFZSB-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@@H](NC(=O)OC(C)(C)C)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000381380983 1025421669 /nfs/dbraw/zinc/42/16/69/1025421669.db2.gz PFMKMBNXAQZATA-UPJWGTAASA-N 1 0 337.420 3.547 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467874 1025467158 /nfs/dbraw/zinc/46/71/58/1025467158.db2.gz OHVOOXVKXRUJFQ-VXGBXAGGSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@@H]3CCC[C@@H]32)o1 ZINC000934338649 1025527372 /nfs/dbraw/zinc/52/73/72/1025527372.db2.gz DRCQEDKJOUAMPP-GWCFXTLKSA-N 1 0 348.790 3.673 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2C)o1 ZINC000185678364 1025587308 /nfs/dbraw/zinc/58/73/08/1025587308.db2.gz XRULGWYPFCLTJP-QGZVFWFLSA-N 1 0 330.384 3.980 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347165157 1025602730 /nfs/dbraw/zinc/60/27/30/1025602730.db2.gz JQSUSPBSFVPMPX-YIONKMFJSA-N 1 0 341.411 3.570 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)ccc1F ZINC000451160013 1025620603 /nfs/dbraw/zinc/62/06/03/1025620603.db2.gz DCGGSTSTFDNFSR-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](c1ccccc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000248647448 1025775377 /nfs/dbraw/zinc/77/53/77/1025775377.db2.gz SZBXIRMHOUOCJR-YZVOILCLSA-N 1 0 327.428 3.937 20 5 EHBDRO Cc1cccc([C@H]2CCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)c1C ZINC000472220185 1025915352 /nfs/dbraw/zinc/91/53/52/1025915352.db2.gz BNULGDLOLJITSW-GOSISDBHSA-N 1 0 328.416 3.635 20 5 EHBDRO CCc1nc(C)c(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000451543465 1026090662 /nfs/dbraw/zinc/09/06/62/1026090662.db2.gz BWBWRMHGOSQJMI-OAHLLOKOSA-N 1 0 329.400 3.833 20 5 EHBDRO CC(C)c1ccc(C[N@H+](CCn2ccc([N+](=O)[O-])n2)C2CC2)cc1 ZINC000478430602 1026116086 /nfs/dbraw/zinc/11/60/86/1026116086.db2.gz GZBHKSIWFOPJCM-UHFFFAOYSA-N 1 0 328.416 3.579 20 5 EHBDRO COCCOc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478492542 1026125964 /nfs/dbraw/zinc/12/59/64/1026125964.db2.gz NZVFPWOJHFVHDN-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCSC4(CCC4)C3)nc2c1 ZINC000896951495 1026150229 /nfs/dbraw/zinc/15/02/29/1026150229.db2.gz PJNPHFFJKNAOHE-NSHDSACASA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCCC[C@@H]1C ZINC000530855958 1026355513 /nfs/dbraw/zinc/35/55/13/1026355513.db2.gz XNTOVWNKPHESMM-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccccc3[N+](=O)[O-])c2C1 ZINC000158357162 1026359361 /nfs/dbraw/zinc/35/93/61/1026359361.db2.gz XVCSHNIMVVXLHS-UHFFFAOYSA-N 1 0 339.395 3.819 20 5 EHBDRO CCC[C@H](NC1CC[NH+](CCCOC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000159143003 1026498806 /nfs/dbraw/zinc/49/88/06/1026498806.db2.gz NVXCAUHQZPHVGQ-IBGZPJMESA-N 1 0 349.475 3.527 20 5 EHBDRO COc1cccc(N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354947 1026510080 /nfs/dbraw/zinc/51/00/80/1026510080.db2.gz SYEYGSMTLNSUBY-ZBFHGGJFSA-N 1 0 341.411 3.851 20 5 EHBDRO CCC(=O)c1ccc(NCC(C)(C)C[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479289646 1026582034 /nfs/dbraw/zinc/58/20/34/1026582034.db2.gz QLPLUPDAEHZFJG-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO CC[NH+](CC)Cc1ccc(-c2nc(-c3ccc([N+](=O)[O-])s3)no2)o1 ZINC000618410747 1026631420 /nfs/dbraw/zinc/63/14/20/1026631420.db2.gz CQHXZYAXNMUOKK-UHFFFAOYSA-N 1 0 348.384 3.808 20 5 EHBDRO COc1ncccc1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000562090687 1026653053 /nfs/dbraw/zinc/65/30/53/1026653053.db2.gz BYPNNXNDRQSFDC-KRWDZBQOSA-N 1 0 341.411 3.553 20 5 EHBDRO COc1cccc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000475455170 1027051673 /nfs/dbraw/zinc/05/16/73/1027051673.db2.gz XJUNYQYFIUETJM-KRWDZBQOSA-N 1 0 341.411 3.852 20 5 EHBDRO COc1ccc(C[NH2+]C(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000061002591 1027195511 /nfs/dbraw/zinc/19/55/11/1027195511.db2.gz IQXVHJUGWXEMIT-UHFFFAOYSA-N 1 0 330.384 3.680 20 5 EHBDRO COc1ccccc1O[C@@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000178659931 1027620155 /nfs/dbraw/zinc/62/01/55/1027620155.db2.gz MSNKTSJDGQUXLL-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501899951 1027628648 /nfs/dbraw/zinc/62/86/48/1027628648.db2.gz PJZDRZUPGAQQQB-AWEZNQCLSA-N 1 0 333.432 3.682 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000513790220 1027840176 /nfs/dbraw/zinc/84/01/76/1027840176.db2.gz UIZNZUCXDAKBPF-VQIMIIECSA-N 1 0 340.423 3.844 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174537 1027911874 /nfs/dbraw/zinc/91/18/74/1027911874.db2.gz FTRCTTWJOZAUOI-ACJLOTCBSA-N 1 0 330.359 3.948 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CO)c2ccccc2C)cc1[N+](=O)[O-] ZINC000536626013 1028014658 /nfs/dbraw/zinc/01/46/58/1028014658.db2.gz VKRQGEBONFBZQA-WMLDXEAASA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCCC23CCOCC3)cc1 ZINC000502266836 1028018341 /nfs/dbraw/zinc/01/83/41/1028018341.db2.gz GFIWAFKDCYBYLI-GOSISDBHSA-N 1 0 332.444 3.856 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC(C)(C)C1 ZINC000612404320 1028071277 /nfs/dbraw/zinc/07/12/77/1028071277.db2.gz DOKKAPMHWBHEAB-AWEZNQCLSA-N 1 0 342.443 3.863 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1C(=O)NCCCCCCC[NH+]1CCCC1 ZINC000277953187 1028102342 /nfs/dbraw/zinc/10/23/42/1028102342.db2.gz HIGHRZLDDBJFOH-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](C)Cn1ccnc1C)c1cccc([N+](=O)[O-])c1 ZINC000178702030 1028120777 /nfs/dbraw/zinc/12/07/77/1028120777.db2.gz JZHKCVMIRSYDRO-KDOFPFPSSA-N 1 0 330.432 3.867 20 5 EHBDRO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc([C@@H](C)[NH3+])cc1 ZINC000423076839 1028166569 /nfs/dbraw/zinc/16/65/69/1028166569.db2.gz ZXNKAHQVEYGBPN-CQSZACIVSA-N 1 0 341.411 3.665 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000503862667 1028173919 /nfs/dbraw/zinc/17/39/19/1028173919.db2.gz YLHMRTLSDUGYMZ-ZKYQVNSYSA-N 1 0 344.358 3.804 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[C@@H]1CCCOC1 ZINC000503926252 1028218331 /nfs/dbraw/zinc/21/83/31/1028218331.db2.gz IZSNRIGTQFFNOT-DZGCQCFKSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CC12CCSCC2 ZINC000421354187 1028298727 /nfs/dbraw/zinc/29/87/27/1028298727.db2.gz QZLVBIMWZIJZFT-AWEZNQCLSA-N 1 0 336.457 3.616 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@H](CCO)CC3)o2)c1 ZINC000421392489 1028366375 /nfs/dbraw/zinc/36/63/75/1028366375.db2.gz BYTZVBVWPFDEAJ-OAHLLOKOSA-N 1 0 344.411 3.839 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc(C4CC4)c3)CC2)n1 ZINC000421399833 1028378754 /nfs/dbraw/zinc/37/87/54/1028378754.db2.gz UVEOVAZKOQIHIN-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697751 1028382662 /nfs/dbraw/zinc/38/26/62/1028382662.db2.gz SIPRZQUQFUHMJU-ZFWWWQNUSA-N 1 0 329.400 3.913 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1NCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437951 1028446373 /nfs/dbraw/zinc/44/63/73/1028446373.db2.gz URCVDPDIFXEXQY-MOPGFXCFSA-N 1 0 325.412 3.523 20 5 EHBDRO CCc1ccccc1[C@H](N)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498599 1028464179 /nfs/dbraw/zinc/46/41/79/1028464179.db2.gz IHTHBDVDRFCBNK-KBXCAEBGSA-N 1 0 327.428 3.816 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)cc1 ZINC000178734106 1028475099 /nfs/dbraw/zinc/47/50/99/1028475099.db2.gz KXLFPEKOHXLQSV-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000162343739 1028624850 /nfs/dbraw/zinc/62/48/50/1028624850.db2.gz JKENJBHNNHVYSI-CJNGLKHVSA-N 1 0 329.400 3.961 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000074994027 1028777535 /nfs/dbraw/zinc/77/75/35/1028777535.db2.gz KOFXMAHYUWMVHJ-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@@H](NC(=O)CC[C@@H]([NH3+])CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000424103367 1028785923 /nfs/dbraw/zinc/78/59/23/1028785923.db2.gz SHRLHILEYVPKSH-RHSMWYFYSA-N 1 0 347.459 3.850 20 5 EHBDRO Cc1cc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)ccc1C[NH+](C)C ZINC000421886561 1028892524 /nfs/dbraw/zinc/89/25/24/1028892524.db2.gz HIXBHCCVHRKNGT-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO [NH3+]C1(c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)CCCCC1 ZINC000424336028 1028983794 /nfs/dbraw/zinc/98/37/94/1028983794.db2.gz ICMFXTQROIZWGE-UHFFFAOYSA-N 1 0 344.396 3.978 20 5 EHBDRO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424338516 1029014389 /nfs/dbraw/zinc/01/43/89/1029014389.db2.gz AKHNPUHADCOBNS-LLVKDONJSA-N 1 0 348.428 3.949 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(O)CCCCC1 ZINC000504918788 1029060908 /nfs/dbraw/zinc/06/09/08/1029060908.db2.gz IWJUAGHAECMPPX-CQSZACIVSA-N 1 0 338.473 3.750 20 5 EHBDRO Cc1ccc(C(=O)CC[N@@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000583191915 1029178473 /nfs/dbraw/zinc/17/84/73/1029178473.db2.gz NKBMFJHRLYUCIX-UHFFFAOYSA-N 1 0 326.396 3.651 20 5 EHBDRO Cc1cccc(N2CC[C@@H]([N@H+](C)Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000614977219 1029180612 /nfs/dbraw/zinc/18/06/12/1029180612.db2.gz GFYDJQFAYYLAJK-QGZVFWFLSA-N 1 0 325.412 3.614 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CCc1nnc2n1CCC2 ZINC000067698520 1029198924 /nfs/dbraw/zinc/19/89/24/1029198924.db2.gz BYNCOSKURBNULQ-UHFFFAOYSA-N 1 0 342.446 3.863 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC1(CCO)CCCC1 ZINC000513822898 1029523448 /nfs/dbraw/zinc/52/34/48/1029523448.db2.gz KRUMLNXIGNYPRP-WMZOPIPTSA-N 1 0 346.471 3.838 20 5 EHBDRO CC(C)[C@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533247935 1029524521 /nfs/dbraw/zinc/52/45/21/1029524521.db2.gz WZPCOCSTAQVODS-MRXNPFEDSA-N 1 0 329.400 3.913 20 5 EHBDRO CCCC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000544414307 1029690864 /nfs/dbraw/zinc/69/08/64/1029690864.db2.gz BHCFKOUDUZSWQC-ZFWWWQNUSA-N 1 0 333.432 3.870 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000162953111 1029737055 /nfs/dbraw/zinc/73/70/55/1029737055.db2.gz PKXXTRZGILAMGH-FQTNTNHHSA-N 1 0 338.473 3.715 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)C[N@@H+](CCCOCCc1ccccc1)CC2 ZINC000446736513 1029784087 /nfs/dbraw/zinc/78/40/87/1029784087.db2.gz VEFPPHMWYAJUER-UHFFFAOYSA-N 1 0 340.423 3.602 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248212 1029883543 /nfs/dbraw/zinc/88/35/43/1029883543.db2.gz IVWJELPYHMRMLP-MLGOLLRUSA-N 1 0 345.399 3.932 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248211 1029883874 /nfs/dbraw/zinc/88/38/74/1029883874.db2.gz IVWJELPYHMRMLP-LRDDRELGSA-N 1 0 345.399 3.932 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453247612 1029974159 /nfs/dbraw/zinc/97/41/59/1029974159.db2.gz NZZISIABLYCWSY-NUEKZKHPSA-N 1 0 328.416 3.705 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000453330950 1030067004 /nfs/dbraw/zinc/06/70/04/1030067004.db2.gz BSSLTFDLXSTDGA-UCLAIMLFSA-N 1 0 341.411 3.869 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000531937729 1030100125 /nfs/dbraw/zinc/10/01/25/1030100125.db2.gz HZVPEOJFULLREX-CYBMUJFWSA-N 1 0 327.384 3.794 20 5 EHBDRO C[NH+](C)C[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574592 1030168855 /nfs/dbraw/zinc/16/88/55/1030168855.db2.gz DPBUGARPYHYUIA-ZWKOTPCHSA-N 1 0 343.402 3.614 20 5 EHBDRO C[C@@H]1CC[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)O1 ZINC000453408794 1030221415 /nfs/dbraw/zinc/22/14/15/1030221415.db2.gz NRHMTGORQABIAK-MDASCCDHSA-N 1 0 326.396 3.841 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447563188 1030308150 /nfs/dbraw/zinc/30/81/50/1030308150.db2.gz OUDBPZCWIVUAPM-YLJYHZDGSA-N 1 0 340.423 3.820 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000447563166 1030309272 /nfs/dbraw/zinc/30/92/72/1030309272.db2.gz OPFFXSYXSUOKDT-XYPHTWIQSA-N 1 0 346.406 3.807 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](Nc3ccc([N+](=O)[O-])cn3)C2)cc1Cl ZINC000447732153 1030441520 /nfs/dbraw/zinc/44/15/20/1030441520.db2.gz VOBVSSXUHPARCY-CQSZACIVSA-N 1 0 346.818 3.638 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCO[C@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409857 1030741093 /nfs/dbraw/zinc/74/10/93/1030741093.db2.gz SVSCQPVYFFNTKP-MJGOQNOKSA-N 1 0 341.411 3.733 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCc3ccccc3[C@H]2C)c([N+](=O)[O-])c1 ZINC000482846942 1030749236 /nfs/dbraw/zinc/74/92/36/1030749236.db2.gz VIUMTGNZROYDAR-CQSZACIVSA-N 1 0 342.395 3.602 20 5 EHBDRO CCC(CC)[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC(C)C ZINC000482858551 1030766907 /nfs/dbraw/zinc/76/69/07/1030766907.db2.gz PMOYZFUHQQGVPY-UHFFFAOYSA-N 1 0 335.448 3.704 20 5 EHBDRO COC(=O)CCC1CC[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000527304330 1030768402 /nfs/dbraw/zinc/76/84/02/1030768402.db2.gz ZIUNKXYLFYMBNT-NTCAYCPXSA-N 1 0 346.427 3.663 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406810 1030826228 /nfs/dbraw/zinc/82/62/28/1030826228.db2.gz LUEIYBIKKWIFHM-KGLIPLIRSA-N 1 0 344.411 3.898 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)NC(C)(C)CC[NH+]1CCCCCC1 ZINC000476793802 1030961311 /nfs/dbraw/zinc/96/13/11/1030961311.db2.gz FIRJTLLRLLMBBX-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCCc2nc(C(C)C)no2)cccc1[N+](=O)[O-] ZINC000160795592 1031024727 /nfs/dbraw/zinc/02/47/27/1031024727.db2.gz GWLHHUZLJHLAQA-ZDUSSCGKSA-N 1 0 332.404 3.693 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916526 1031274994 /nfs/dbraw/zinc/27/49/94/1031274994.db2.gz QDUBSAUDZWPPOT-COPLHBTASA-N 1 0 332.322 3.745 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000483739072 1031312318 /nfs/dbraw/zinc/31/23/18/1031312318.db2.gz FGCCXXRUUMGCOI-UONOGXRCSA-N 1 0 333.432 3.870 20 5 EHBDRO C[C@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@@H+]1C ZINC000161119011 1031336382 /nfs/dbraw/zinc/33/63/82/1031336382.db2.gz OYIGLBRRJYIXCG-JQWIXIFHSA-N 1 0 331.338 3.533 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+]([C@H](C)c2ccccc2)C1 ZINC000536183622 1031350751 /nfs/dbraw/zinc/35/07/51/1031350751.db2.gz SQSBDIFZYDRUFS-GDBMZVCRSA-N 1 0 326.400 3.546 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161142168 1031358891 /nfs/dbraw/zinc/35/88/91/1031358891.db2.gz KDGYYZQTPVQUGZ-LBPRGKRZSA-N 1 0 345.365 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC3(O)CCC3)s2)cc1 ZINC000551581296 1031482748 /nfs/dbraw/zinc/48/27/48/1031482748.db2.gz AHRRXYCGOSAGLP-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO CC(C)(CCc1ccccc1)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000551741789 1031605501 /nfs/dbraw/zinc/60/55/01/1031605501.db2.gz LLNVCFPHUCTDKK-UHFFFAOYSA-N 1 0 328.412 3.975 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@H]1c1ccsc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000052803848 1031700198 /nfs/dbraw/zinc/70/01/98/1031700198.db2.gz VQNLZJHPJKCVAH-MRXNPFEDSA-N 1 0 345.424 3.822 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H](C)C1 ZINC000248577248 1032000365 /nfs/dbraw/zinc/00/03/65/1032000365.db2.gz UHBSGQKSPGHLDT-UHIISALHSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898067668 1033311283 /nfs/dbraw/zinc/31/12/83/1033311283.db2.gz HGHGPALUTAZFCT-CQSZACIVSA-N 1 0 331.441 3.733 20 5 EHBDRO C[C@H]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CS1 ZINC000594499438 1033401184 /nfs/dbraw/zinc/40/11/84/1033401184.db2.gz GWVUUBJEIMOQAA-JOYOIKCWSA-N 1 0 334.363 3.987 20 5 EHBDRO COc1cccc(C[C@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594503620 1033404542 /nfs/dbraw/zinc/40/45/42/1033404542.db2.gz ZZMHXTOUZJNEDE-UGSOOPFHSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ncccc12 ZINC000594596673 1033443974 /nfs/dbraw/zinc/44/39/74/1033443974.db2.gz BAYAFLHWZJROQO-YOEHRIQHSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(N)ccc21 ZINC000594738162 1033510998 /nfs/dbraw/zinc/51/09/98/1033510998.db2.gz BCDHIPREQBYIIF-UGSOOPFHSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(F)c2OC(F)F)cc1 ZINC000594918934 1033544712 /nfs/dbraw/zinc/54/47/12/1033544712.db2.gz CPNQNXVORAVKKS-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000059372105 1033588950 /nfs/dbraw/zinc/58/89/50/1033588950.db2.gz PVBGRNJSXJXQEA-QGZVFWFLSA-N 1 0 342.395 3.819 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000598989758 1033616282 /nfs/dbraw/zinc/61/62/82/1033616282.db2.gz SWCSBNUIWIWZCX-ULXKQSRTSA-N 1 0 338.407 3.729 20 5 EHBDRO CCSC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000594987126 1033621396 /nfs/dbraw/zinc/62/13/96/1033621396.db2.gz SLACPYPYTHAGJQ-UHFFFAOYSA-N 1 0 332.372 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)c(Cl)c1 ZINC000594996625 1033624186 /nfs/dbraw/zinc/62/41/86/1033624186.db2.gz UIAFHETXJPGVEM-USXIJHARSA-N 1 0 332.762 3.815 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[NH2+][C@H]2C[C@H](O)C2)cc1 ZINC000594999172 1033626366 /nfs/dbraw/zinc/62/63/66/1033626366.db2.gz PCFDCMHSAQOPBN-HDJSIYSDSA-N 1 0 348.786 3.653 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCCOC2)o1 ZINC000598985527 1033633070 /nfs/dbraw/zinc/63/30/70/1033633070.db2.gz RGPIKECRIDNJBL-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO Cc1[nH]c2ccc(F)cc2c1CC[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000599004274 1033639603 /nfs/dbraw/zinc/63/96/03/1033639603.db2.gz SAOGUWQPMZSIBU-UHFFFAOYSA-N 1 0 333.388 3.917 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2cnccc2C)cc1[N+](=O)[O-] ZINC000595072650 1033647337 /nfs/dbraw/zinc/64/73/37/1033647337.db2.gz JHDUDZSVURZNHF-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCO[C@H](CC(C)C)C1 ZINC000595027087 1033648965 /nfs/dbraw/zinc/64/89/65/1033648965.db2.gz MJGPWYFPHIQCCX-OFQRWUPVSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCc1cccc(C)n1 ZINC000595042423 1033660445 /nfs/dbraw/zinc/66/04/45/1033660445.db2.gz GAELUDXHHAKGMZ-CQSZACIVSA-N 1 0 329.400 3.590 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CO1 ZINC000595050150 1033668068 /nfs/dbraw/zinc/66/80/68/1033668068.db2.gz QIJFDDZLWDWEGL-SJLPKXTDSA-N 1 0 326.396 3.841 20 5 EHBDRO O=[N+]([O-])c1c2ccncc2ccc1N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000599047095 1033678200 /nfs/dbraw/zinc/67/82/00/1033678200.db2.gz OYEUSXBDXHZNEA-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@@H](O)[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000595104748 1033692299 /nfs/dbraw/zinc/69/22/99/1033692299.db2.gz TXJDBQJMSZTFPB-CLCXKQKWSA-N 1 0 328.412 3.628 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595109148 1033693126 /nfs/dbraw/zinc/69/31/26/1033693126.db2.gz UQKOCTCUHKMDDT-UAGQMJEPSA-N 1 0 332.444 3.711 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000595078364 1033696424 /nfs/dbraw/zinc/69/64/24/1033696424.db2.gz VGEFLYVEXCQPBH-QGZVFWFLSA-N 1 0 328.416 3.837 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](n2cccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000599058420 1033697085 /nfs/dbraw/zinc/69/70/85/1033697085.db2.gz UKRDONKAWZSWKS-SMDDNHRTSA-N 1 0 342.321 3.554 20 5 EHBDRO COCc1csc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000595077838 1033697089 /nfs/dbraw/zinc/69/70/89/1033697089.db2.gz QKXDBOMZCFMKNU-KRWDZBQOSA-N 1 0 346.452 3.914 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081033 1033697159 /nfs/dbraw/zinc/69/71/59/1033697159.db2.gz PIOLWKHWNACIJD-KSSFIOAISA-N 1 0 329.444 3.579 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3CO2)cc1[N+](=O)[O-] ZINC000599062505 1033701303 /nfs/dbraw/zinc/70/13/03/1033701303.db2.gz XHDTTZHUYQJQDS-KDOFPFPSSA-N 1 0 326.396 3.695 20 5 EHBDRO CC(C)[C@H](O)[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000595094126 1033701550 /nfs/dbraw/zinc/70/15/50/1033701550.db2.gz DMXGPIYZBRUHFH-IHPCNDPISA-N 1 0 340.423 3.930 20 5 EHBDRO Cc1ncccc1C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599072281 1033713739 /nfs/dbraw/zinc/71/37/39/1033713739.db2.gz AJGSJUHLTVGAGS-CRAIPNDOSA-N 1 0 325.412 3.799 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000595330989 1033728220 /nfs/dbraw/zinc/72/82/20/1033728220.db2.gz GXUWIPXFDQODRF-HOCLYGCPSA-N 1 0 329.400 3.907 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095556 1033731731 /nfs/dbraw/zinc/73/17/31/1033731731.db2.gz GXGZCFZBSHKVNZ-VQIMIIECSA-N 1 0 339.395 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCC2)c2ccncc21 ZINC000599164779 1033780004 /nfs/dbraw/zinc/78/00/04/1033780004.db2.gz MJYXGYLMZZXPDS-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599163639 1033780198 /nfs/dbraw/zinc/78/01/98/1033780198.db2.gz GEZCCEDGVMLISK-CYBMUJFWSA-N 1 0 325.359 3.961 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000595419953 1033793216 /nfs/dbraw/zinc/79/32/16/1033793216.db2.gz BGYPHHUKHVUSMR-LSDHHAIUSA-N 1 0 347.459 3.530 20 5 EHBDRO Cc1noc(C[NH2+][C@@H]2CCCC[C@H]2Oc2cccc(C)c2)c1[N+](=O)[O-] ZINC000595447682 1033813405 /nfs/dbraw/zinc/81/34/05/1033813405.db2.gz IFYVLKMQTXKTNY-HZPDHXFCSA-N 1 0 345.399 3.679 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccccc2C)c1 ZINC000593021844 1033837174 /nfs/dbraw/zinc/83/71/74/1033837174.db2.gz YJUJYOAORILNTL-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@@H]1CCO ZINC000595696274 1033950476 /nfs/dbraw/zinc/95/04/76/1033950476.db2.gz KAVRNQYCQWUPBP-XHDPSFHLSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1CN1CC[C@@]2(CC2(F)F)C1 ZINC000593119214 1033969357 /nfs/dbraw/zinc/96/93/57/1033969357.db2.gz VRWBSPDNSRLEHE-GFCCVEGCSA-N 1 0 347.159 3.588 20 5 EHBDRO CC1CC[NH+](Cc2ccc(CNc3cccnc3[N+](=O)[O-])cc2)CC1 ZINC000603847278 1033972007 /nfs/dbraw/zinc/97/20/07/1033972007.db2.gz NFFPGOPPGQPJQD-UHFFFAOYSA-N 1 0 340.427 3.834 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNc1cccnc1[N+](=O)[O-] ZINC000603859490 1033982967 /nfs/dbraw/zinc/98/29/67/1033982967.db2.gz CILHSLDGXYRRLB-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@@H](C4CCC4)C3)n2)c1 ZINC000595832137 1034016904 /nfs/dbraw/zinc/01/69/04/1034016904.db2.gz IRDHUXBRTKASBD-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000599590224 1034029791 /nfs/dbraw/zinc/02/97/91/1034029791.db2.gz VWYRBWFEUOOVTH-XJKSGUPXSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594358 1034035201 /nfs/dbraw/zinc/03/52/01/1034035201.db2.gz GGPISTBYGQZJIB-KEYYUXOJSA-N 1 0 348.443 3.956 20 5 EHBDRO C[C@H]([NH2+]Cc1cnccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000596117809 1034081405 /nfs/dbraw/zinc/08/14/05/1034081405.db2.gz JPBVPFUNFZVVPB-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cc(OC)c([N+](=O)[O-])cc1F ZINC000119076125 1034081921 /nfs/dbraw/zinc/08/19/21/1034081921.db2.gz GBBMRJGQUIGZSC-LBPRGKRZSA-N 1 0 327.400 3.665 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690701 1034095930 /nfs/dbraw/zinc/09/59/30/1034095930.db2.gz PGUAFRYWOSCHOY-SFAKSCPVSA-N 1 0 342.399 3.823 20 5 EHBDRO CC(C)[N@H+](Cc1cnn(C(C)(C)C)c1)Cc1ccc([N+](=O)[O-])cc1 ZINC000179320687 1034108757 /nfs/dbraw/zinc/10/87/57/1034108757.db2.gz DTRFERPFTCWAOV-UHFFFAOYSA-N 1 0 330.432 3.957 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@@H]21 ZINC000596168106 1034115416 /nfs/dbraw/zinc/11/54/16/1034115416.db2.gz KREUFOZHKROQKL-FZMZJTMJSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc2c(ccnc2N2CCC[C@H]([NH+]3CCCC3)CC2)c1 ZINC000450342893 1034150550 /nfs/dbraw/zinc/15/05/50/1034150550.db2.gz BOMFPYYPLINJIL-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO C[NH+](C)C1CCC2(CC1)CCN(c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000596254794 1034150940 /nfs/dbraw/zinc/15/09/40/1034150940.db2.gz GXRPBFPLUMOMDH-UHFFFAOYSA-N 1 0 335.423 3.825 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Nc2ccccn2)CC1 ZINC000534127727 1034167526 /nfs/dbraw/zinc/16/75/26/1034167526.db2.gz BIGVYBXDYUPMAI-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)CC[C@H]2[NH+](C)C ZINC000456262573 1034261238 /nfs/dbraw/zinc/26/12/38/1034261238.db2.gz GIYGUPZWPBJTNJ-GOSISDBHSA-N 1 0 339.395 3.704 20 5 EHBDRO CCOc1cc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)ccc1[N+](=O)[O-] ZINC000596570733 1034294486 /nfs/dbraw/zinc/29/44/86/1034294486.db2.gz NEFSGXSKHWQAEY-HNNXBMFYSA-N 1 0 333.432 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@@H]3CCC(F)(F)C3)CC2)cc1 ZINC000450461725 1034342384 /nfs/dbraw/zinc/34/23/84/1034342384.db2.gz XCAJRWWKCOWJRV-CYBMUJFWSA-N 1 0 340.370 3.873 20 5 EHBDRO C[C@@H]1C[N@@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H](C)[C@H]1O ZINC000597206461 1034591186 /nfs/dbraw/zinc/59/11/86/1034591186.db2.gz RZQCLBRYFWZIPB-MCBXIFIFSA-N 1 0 346.452 3.772 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CNc2ccccc2C1 ZINC000593314350 1034627135 /nfs/dbraw/zinc/62/71/35/1034627135.db2.gz DFYSZVQOQMDPCQ-PBHICJAKSA-N 1 0 325.412 3.542 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000597257608 1034630376 /nfs/dbraw/zinc/63/03/76/1034630376.db2.gz HDWQWBINSMRLQQ-VGOFMYFVSA-N 1 0 340.427 3.806 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1CNc2ccccc2C1)C1CC1 ZINC000593319683 1034656531 /nfs/dbraw/zinc/65/65/31/1034656531.db2.gz OLJIRYDTIMSCIM-HKUYNNGSSA-N 1 0 337.423 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Cc3ccncc3)C2)c(Cl)c1 ZINC000612402215 1034893157 /nfs/dbraw/zinc/89/31/57/1034893157.db2.gz VNGCYPZIWRSNMD-CQSZACIVSA-N 1 0 331.803 3.708 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000612465510 1034962983 /nfs/dbraw/zinc/96/29/83/1034962983.db2.gz MNTSUPUHBSTKBR-MRXNPFEDSA-N 1 0 337.379 3.847 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC000612578796 1035074776 /nfs/dbraw/zinc/07/47/76/1035074776.db2.gz JVLZQHKOGIZSFI-FQEVSTJZSA-N 1 0 339.439 3.610 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@@H]2/C=C\c2cccs2)n1 ZINC000542131643 1035075909 /nfs/dbraw/zinc/07/59/09/1035075909.db2.gz NKZDUSHJMZKCTR-ZPIQOJFGSA-N 1 0 346.456 3.811 20 5 EHBDRO CCc1ccc(-c2nc(C3C[C@H]4CC[C@@H](C3)[N@H+]4C)no2)cc1[N+](=O)[O-] ZINC000612954108 1035322914 /nfs/dbraw/zinc/32/29/14/1035322914.db2.gz BQQPBRJMZGQIJN-GOOCMWNKSA-N 1 0 342.399 3.547 20 5 EHBDRO COc1ncc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000579918346 1035373457 /nfs/dbraw/zinc/37/34/57/1035373457.db2.gz IUJNPGGEGTZXTH-LLVKDONJSA-N 1 0 335.791 3.811 20 5 EHBDRO COc1ncc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1Cl ZINC000579918347 1035373850 /nfs/dbraw/zinc/37/38/50/1035373850.db2.gz IUJNPGGEGTZXTH-NSHDSACASA-N 1 0 335.791 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(-n3ccnc3)cc2)c2ccncc21 ZINC000066372365 1035419061 /nfs/dbraw/zinc/41/90/61/1035419061.db2.gz CFHFLSXGRJHNGI-UHFFFAOYSA-N 1 0 345.362 3.941 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCCOCC(F)(F)F)c2cc([N+](=O)[O-])ccc21 ZINC000580395015 1035435141 /nfs/dbraw/zinc/43/51/41/1035435141.db2.gz XHFMHBZVZOUGFK-AWEZNQCLSA-N 1 0 346.349 3.876 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)c1 ZINC000580944718 1035464037 /nfs/dbraw/zinc/46/40/37/1035464037.db2.gz DWIGLJMNQOHVLU-UHFFFAOYSA-N 1 0 332.350 3.951 20 5 EHBDRO Cc1cc(NC[C@H]2CCC[N@@H+](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000580866991 1035465358 /nfs/dbraw/zinc/46/53/58/1035465358.db2.gz DALRKDSHCADPIF-LLVKDONJSA-N 1 0 331.338 3.676 20 5 EHBDRO CC(C)[C@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CS1 ZINC000581039236 1035466100 /nfs/dbraw/zinc/46/61/00/1035466100.db2.gz QMUNJOTYZUOLMT-SUMWQHHRSA-N 1 0 333.457 3.738 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1OC ZINC000581262523 1035482135 /nfs/dbraw/zinc/48/21/35/1035482135.db2.gz XZXCIIVJAYVSOX-MRXNPFEDSA-N 1 0 342.395 3.779 20 5 EHBDRO C[NH+]1CCC(CCN[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000581255615 1035482430 /nfs/dbraw/zinc/48/24/30/1035482430.db2.gz KOQGFXHNXIEZEF-HNNXBMFYSA-N 1 0 345.365 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000152026673 1035535646 /nfs/dbraw/zinc/53/56/46/1035535646.db2.gz CWDRZUGPMYBRTQ-MRXNPFEDSA-N 1 0 349.818 3.768 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936041 1035673069 /nfs/dbraw/zinc/67/30/69/1035673069.db2.gz VDSZQKCASXEWDV-NVXWUHKLSA-N 1 0 326.396 3.852 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000414153274 1035802959 /nfs/dbraw/zinc/80/29/59/1035802959.db2.gz ZBLQSUIHUACVBM-UHOSZYNNSA-N 1 0 326.396 3.841 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]3CCCC[C@@H]32)c2c(c1)COCO2 ZINC000016397222 1035953702 /nfs/dbraw/zinc/95/37/02/1035953702.db2.gz BWXRUFHEZFRAFT-GUYCJALGSA-N 1 0 332.400 3.616 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000582577708 1035987743 /nfs/dbraw/zinc/98/77/43/1035987743.db2.gz WMUWAKFQLPQYBY-LESCRADOSA-N 1 0 334.460 3.693 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000414193268 1035990445 /nfs/dbraw/zinc/99/04/45/1035990445.db2.gz SVXLLASZUISAHV-XJKSGUPXSA-N 1 0 326.396 3.730 20 5 EHBDRO COC(=O)CCC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000540907924 1036038632 /nfs/dbraw/zinc/03/86/32/1036038632.db2.gz IPJXYMNAQUDHDX-CQSZACIVSA-N 1 0 334.416 3.629 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589111659 1036257556 /nfs/dbraw/zinc/25/75/56/1036257556.db2.gz MYGIDEIQNNQWEM-GFCCVEGCSA-N 1 0 345.365 3.782 20 5 EHBDRO Cc1nn(-c2ccccc2)cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000180228359 1036308134 /nfs/dbraw/zinc/30/81/34/1036308134.db2.gz YPQKIXISUGBLIH-CQSZACIVSA-N 1 0 336.395 3.940 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H](C)C[C@H](C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541543610 1036421894 /nfs/dbraw/zinc/42/18/94/1036421894.db2.gz QILJPNDCGIBZQH-BIENJYKASA-N 1 0 346.427 3.836 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@@H]1Oc2ccccc2[C@H]1C ZINC000541688171 1036560015 /nfs/dbraw/zinc/56/00/15/1036560015.db2.gz TYVXZHQKDIUGHO-BIENJYKASA-N 1 0 342.395 3.516 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCO[C@@H](CCc2ccccc2)C1 ZINC000541700134 1036576743 /nfs/dbraw/zinc/57/67/43/1036576743.db2.gz HXHWYXCCUWNHML-AEFFLSMTSA-N 1 0 340.423 3.989 20 5 EHBDRO C[NH+](C)C1CCN(c2ccc(Nc3ccccc3[N+](=O)[O-])cc2)CC1 ZINC000089266926 1036587233 /nfs/dbraw/zinc/58/72/33/1036587233.db2.gz KURJEZQPWPQYBO-UHFFFAOYSA-N 1 0 340.427 3.869 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCO[C@H]2C2CC2)s1 ZINC000535541161 1036618733 /nfs/dbraw/zinc/61/87/33/1036618733.db2.gz CFRYFTVMGSDDKX-YJBOKZPZSA-N 1 0 344.436 3.980 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152809815 1036789491 /nfs/dbraw/zinc/78/94/91/1036789491.db2.gz MJKMCMKXFOUPAU-GJZGRUSLSA-N 1 0 343.402 3.911 20 5 EHBDRO Cc1cccc(Cl)c1NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180434128 1036824127 /nfs/dbraw/zinc/82/41/27/1036824127.db2.gz QNQIYNVUNUAWNY-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO [NH3+]Cc1nn(-c2cc3cccnc3c3ncccc23)c2ccccc12 ZINC001167698087 1036886558 /nfs/dbraw/zinc/88/65/58/1036886558.db2.gz MBLRMILKIZUCQY-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169681 1036918508 /nfs/dbraw/zinc/91/85/08/1036918508.db2.gz VLZICBROBABZKZ-FZKQIMNGSA-N 1 0 349.406 3.575 20 5 EHBDRO Cc1nn(C[N@H+]2C[C@@H](c3ccccc3C)C[C@H]2C)c(C)c1[N+](=O)[O-] ZINC000151537385 1037042857 /nfs/dbraw/zinc/04/28/57/1037042857.db2.gz IDKLLCCPWLDPFB-CJNGLKHVSA-N 1 0 328.416 3.552 20 5 EHBDRO O=C(C[NH2+][C@H]1CCCC12CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000590778045 1037044305 /nfs/dbraw/zinc/04/43/05/1037044305.db2.gz XVJRKSPZVFAHIU-INIZCTEOSA-N 1 0 331.416 3.626 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccccc1F ZINC000761526610 1037100521 /nfs/dbraw/zinc/10/05/21/1037100521.db2.gz PCCWADCHRHTIQH-NSHDSACASA-N 1 0 338.766 3.944 20 5 EHBDRO CC[C@H](O)C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850727 1037281206 /nfs/dbraw/zinc/28/12/06/1037281206.db2.gz OVBWTWHPUMFJCJ-ICEKFOEVSA-N 1 0 340.423 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@H]4COCC[C@@H]43)o2)cc1 ZINC000539891306 1037316353 /nfs/dbraw/zinc/31/63/53/1037316353.db2.gz RUDYXGBYVIUFIZ-YJBOKZPZSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1csc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000591347905 1037368928 /nfs/dbraw/zinc/36/89/28/1037368928.db2.gz YBZAMVKPGSIUPH-MRXNPFEDSA-N 1 0 331.441 3.960 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@@H](OCC)C12CCCC2 ZINC000462756707 1037371666 /nfs/dbraw/zinc/37/16/66/1037371666.db2.gz OXUOOZRISIISOS-QZTJIDSGSA-N 1 0 348.443 3.821 20 5 EHBDRO CC[N@@H+]1CCC[C@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423957 1037451618 /nfs/dbraw/zinc/45/16/18/1037451618.db2.gz QGJNIIPLHOMHMM-PMACEKPBSA-N 1 0 339.439 3.758 20 5 EHBDRO C[C@H](NCC[NH2+]C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591577316 1037515699 /nfs/dbraw/zinc/51/56/99/1037515699.db2.gz OWJJXHWKDXMDEU-LBPRGKRZSA-N 1 0 331.441 3.726 20 5 EHBDRO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789395 1037531280 /nfs/dbraw/zinc/53/12/80/1037531280.db2.gz MCQOUCOXQPPUKP-QWQRMKEZSA-N 1 0 344.411 3.836 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000290423578 1037600980 /nfs/dbraw/zinc/60/09/80/1037600980.db2.gz KWRKYSCHXFUODI-UHFFFAOYSA-N 1 0 330.432 3.574 20 5 EHBDRO CCC[C@@H](C)[C@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573615421 1037629865 /nfs/dbraw/zinc/62/98/65/1037629865.db2.gz WTRXJQKKOCNUNP-YGRLFVJLSA-N 1 0 334.338 3.500 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)N[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000415919950 1037655353 /nfs/dbraw/zinc/65/53/53/1037655353.db2.gz NVLNAZYMNRBCMV-CYBMUJFWSA-N 1 0 342.399 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCc3c2c(F)ccc3F)cc1 ZINC000540183208 1037666774 /nfs/dbraw/zinc/66/67/74/1037666774.db2.gz YTURRHSWQGGEBX-INIZCTEOSA-N 1 0 334.322 3.529 20 5 EHBDRO CC[C@H](O)CCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004001 1037768376 /nfs/dbraw/zinc/76/83/76/1037768376.db2.gz NJAOAEYCPAZWEV-RBUKOAKNSA-N 1 0 328.412 3.825 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328652 1037828031 /nfs/dbraw/zinc/82/80/31/1037828031.db2.gz OWBCTZQYDFUUMM-CZUORRHYSA-N 1 0 347.440 3.623 20 5 EHBDRO CC(C)(C)OC(=O)C1(C)CC[NH+](Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000592157722 1037899996 /nfs/dbraw/zinc/89/99/96/1037899996.db2.gz JXVTUHCDHQEAEP-UHFFFAOYSA-N 1 0 334.416 3.539 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000324800637 1037902196 /nfs/dbraw/zinc/90/21/96/1037902196.db2.gz QIZRXPVTUXKTEM-IBGZPJMESA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@@H](O)[C@@H]2CCc2ccccc2)cs1 ZINC000592165647 1037908802 /nfs/dbraw/zinc/90/88/02/1037908802.db2.gz DIOPGRXXXQOAPK-DLBZAZTESA-N 1 0 346.452 3.614 20 5 EHBDRO Cc1ccc(C2([NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)CCC2)cc1 ZINC000592190092 1037927304 /nfs/dbraw/zinc/92/73/04/1037927304.db2.gz ZEAYZXSZWKWPEY-UHFFFAOYSA-N 1 0 336.395 3.949 20 5 EHBDRO O=C(CC[N@@H+]1CCCC[C@H]1C1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000592199118 1037944376 /nfs/dbraw/zinc/94/43/76/1037944376.db2.gz XABHQHLEECZCAS-INIZCTEOSA-N 1 0 331.416 3.578 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCc2ccccc2C1 ZINC000110243888 1038102956 /nfs/dbraw/zinc/10/29/56/1038102956.db2.gz JYJYKBGRXFLRLW-QGZVFWFLSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH+]2CCCCC2)c(Br)c1 ZINC000461462317 1038444092 /nfs/dbraw/zinc/44/40/92/1038444092.db2.gz IZMKHISKQZZPRZ-UHFFFAOYSA-N 1 0 342.237 3.645 20 5 EHBDRO COc1ccc(C[NH2+][C@@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000538707803 1038483511 /nfs/dbraw/zinc/48/35/11/1038483511.db2.gz ZHBCCTQTSQUUEQ-IBGZPJMESA-N 1 0 326.396 3.945 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000470174382 1038493155 /nfs/dbraw/zinc/49/31/55/1038493155.db2.gz KJCUVTKLXJHNGV-FLXZHSAZSA-N 1 0 343.471 3.948 20 5 EHBDRO Cc1ccc(C[N@H+](CCCO)Cc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000538798250 1038533286 /nfs/dbraw/zinc/53/32/86/1038533286.db2.gz VKFVBDQOVVVAHC-UHFFFAOYSA-N 1 0 348.830 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000182356054 1038587657 /nfs/dbraw/zinc/58/76/57/1038587657.db2.gz OOZQBERVYYPXTJ-RDTXWAMCSA-N 1 0 349.862 3.697 20 5 EHBDRO CC(C)c1noc(CCC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000192809658 1038728405 /nfs/dbraw/zinc/72/84/05/1038728405.db2.gz ZXKLEFHVQPRUMY-MRXNPFEDSA-N 1 0 344.415 3.701 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893255216 1038737986 /nfs/dbraw/zinc/73/79/86/1038737986.db2.gz HHUKGPZNYMDYDI-ZFWWWQNUSA-N 1 0 326.824 3.932 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000236839444 1038875512 /nfs/dbraw/zinc/87/55/12/1038875512.db2.gz BYGGQXXMFWMQOL-HKMNZKMDSA-N 1 0 343.427 3.874 20 5 EHBDRO Cc1[nH]c2ccccc2c1CC[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000479977128 1038950419 /nfs/dbraw/zinc/95/04/19/1038950419.db2.gz GZWREOSMRBUZMH-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000905852326 1039156703 /nfs/dbraw/zinc/15/67/03/1039156703.db2.gz IDRXKWXRBADGGO-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2SCCc3ccccc32)c(F)c1 ZINC000478246056 1039319358 /nfs/dbraw/zinc/31/93/58/1039319358.db2.gz BCWSLXDAGHUURG-QGZVFWFLSA-N 1 0 332.400 3.854 20 5 EHBDRO Cc1ccc(CC(C)(C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000842165949 1039500403 /nfs/dbraw/zinc/50/04/03/1039500403.db2.gz IZWKVMRWXVPTRX-SFHVURJKSA-N 1 0 328.412 3.548 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2(CCO)CCCC2)o1 ZINC000512497106 1039516495 /nfs/dbraw/zinc/51/64/95/1039516495.db2.gz QJJWVLRNTLUBRB-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CCC(CC)[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[NH+](C)C ZINC000480434941 1039545529 /nfs/dbraw/zinc/54/55/29/1039545529.db2.gz SRTGDWFUEMEQBC-KRWDZBQOSA-N 1 0 330.432 3.921 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(OCC3CC3)cc2)cccc1[N+](=O)[O-] ZINC000480483655 1039588233 /nfs/dbraw/zinc/58/82/33/1039588233.db2.gz WRPCAONKEWAXHJ-UHFFFAOYSA-N 1 0 326.396 3.982 20 5 EHBDRO CC(C)[NH+]1CCC(N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316983 1039657643 /nfs/dbraw/zinc/65/76/43/1039657643.db2.gz VMFYWFSWELJXCT-LJQANCHMSA-N 1 0 331.460 3.825 20 5 EHBDRO CN(C)c1ccc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417309898 1039664125 /nfs/dbraw/zinc/66/41/25/1039664125.db2.gz GMMTXTPSLHTSBR-GOSISDBHSA-N 1 0 340.427 3.613 20 5 EHBDRO CO[C@H](CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000417325130 1039681723 /nfs/dbraw/zinc/68/17/23/1039681723.db2.gz DLODJEFIVCEJCP-HUUCEWRRSA-N 1 0 346.349 3.919 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCO[C@H](C(F)(F)F)C2)cc1 ZINC000584856298 1040114051 /nfs/dbraw/zinc/11/40/51/1040114051.db2.gz OMKYXWTUZQPQKI-HIFRSBDPSA-N 1 0 346.349 3.617 20 5 EHBDRO CCOC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000573510351 1040137342 /nfs/dbraw/zinc/13/73/42/1040137342.db2.gz AIGKWDPAABRPKX-KRWDZBQOSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000481111348 1040354944 /nfs/dbraw/zinc/35/49/44/1040354944.db2.gz OUIJSUANTCOZSD-SWLSCSKDSA-N 1 0 344.415 3.949 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000481104888 1040369865 /nfs/dbraw/zinc/36/98/65/1040369865.db2.gz JKNZKPKHIYCSBM-UKRRQHHQSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000481167269 1040422289 /nfs/dbraw/zinc/42/22/89/1040422289.db2.gz GHAAAJNZKIYTBJ-UMVBOHGHSA-N 1 0 333.432 3.646 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069277 1040431237 /nfs/dbraw/zinc/43/12/37/1040431237.db2.gz GNHRALPPEIRXMF-GDBMZVCRSA-N 1 0 333.432 3.824 20 5 EHBDRO CC1(C)CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000512667528 1040461527 /nfs/dbraw/zinc/46/15/27/1040461527.db2.gz DGXMZDYURIMLDH-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481195216 1040471339 /nfs/dbraw/zinc/47/13/39/1040471339.db2.gz XHNHGADCQNLUDO-GDBMZVCRSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@H]1C ZINC000249525165 1040720203 /nfs/dbraw/zinc/72/02/03/1040720203.db2.gz SBMNUXNMSWTDAZ-UHIISALHSA-N 1 0 339.823 3.601 20 5 EHBDRO [NH3+]C1(C(=O)Nc2cccc(Oc3ccc([N+](=O)[O-])cc3)c2)CCCC1 ZINC000490797711 1040745682 /nfs/dbraw/zinc/74/56/82/1040745682.db2.gz PYCKAPRJGISPOT-UHFFFAOYSA-N 1 0 341.367 3.597 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000433154023 1040921804 /nfs/dbraw/zinc/92/18/04/1040921804.db2.gz YGIUYBGAWFPMRI-CEXWTWQISA-N 1 0 338.407 3.565 20 5 EHBDRO CCOc1c(Cl)cccc1C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000487569468 1040968727 /nfs/dbraw/zinc/96/87/27/1040968727.db2.gz GGIYZQVDAWECBK-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000433189502 1041026135 /nfs/dbraw/zinc/02/61/35/1041026135.db2.gz FPCKIIVXEYHSHG-SFHVURJKSA-N 1 0 339.439 3.909 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2[nH]c(=O)oc2c1 ZINC000586791499 1041026655 /nfs/dbraw/zinc/02/66/55/1041026655.db2.gz PKAVCJAOUKCECH-MNOVXSKESA-N 1 0 327.340 3.853 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCc3ccc([N+](=O)[O-])cc3)cccc21 ZINC000433203556 1041056447 /nfs/dbraw/zinc/05/64/47/1041056447.db2.gz CIEQVQKKKLUNLG-KRWDZBQOSA-N 1 0 327.384 3.592 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cccc(Br)c2Cl)C1 ZINC001168990265 1132634441 /nfs/dbraw/zinc/63/44/41/1132634441.db2.gz ZKECFOVVINFFAC-GXSJLCMTSA-N 1 0 347.640 3.638 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433280616 1041191401 /nfs/dbraw/zinc/19/14/01/1041191401.db2.gz CYWKJKAEVKYTSO-KXBFYZLASA-N 1 0 340.423 3.683 20 5 EHBDRO CC(C)C[C@H](CCO)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433284378 1041233848 /nfs/dbraw/zinc/23/38/48/1041233848.db2.gz DZSWYMVCPGCLHK-KBXCAEBGSA-N 1 0 334.460 3.952 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000433295134 1041248543 /nfs/dbraw/zinc/24/85/43/1041248543.db2.gz OLGKNYIOVYBMPK-FHSNZYRGSA-N 1 0 329.444 3.532 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCCOC1 ZINC000571448075 1041295729 /nfs/dbraw/zinc/29/57/29/1041295729.db2.gz QHPWVFHGWZYTHI-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000432118977 1041615050 /nfs/dbraw/zinc/61/50/50/1041615050.db2.gz ZHFRTPGDZNOINU-LBPRGKRZSA-N 1 0 327.400 3.665 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@H](C(=O)NC(C)C)C1 ZINC000124774816 1041736169 /nfs/dbraw/zinc/73/61/69/1041736169.db2.gz QKLBSMLQPMEVSY-JYJNAYRXSA-N 1 0 347.459 3.637 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c([N+](=O)[O-])cc1O ZINC000093116143 1041889511 /nfs/dbraw/zinc/88/95/11/1041889511.db2.gz GFLTVRCUXUCJOU-HNNXBMFYSA-N 1 0 346.358 3.615 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112077768 1042332444 /nfs/dbraw/zinc/33/24/44/1042332444.db2.gz HJGAIVBZNOQZSU-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO CC1(C)CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000112702139 1042420989 /nfs/dbraw/zinc/42/09/89/1042420989.db2.gz NZUIMFKHEJDXLH-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000278918706 1042944989 /nfs/dbraw/zinc/94/49/89/1042944989.db2.gz WNJLOHKCQXIRIN-GFCCVEGCSA-N 1 0 332.322 3.768 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000585765588 1043029310 /nfs/dbraw/zinc/02/93/10/1043029310.db2.gz XKIDBMLUNRPZKI-AWEZNQCLSA-N 1 0 338.411 3.625 20 5 EHBDRO Cc1nccn1CCC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278976859 1043115357 /nfs/dbraw/zinc/11/53/57/1043115357.db2.gz COWMMUBKPKWPAH-KRWDZBQOSA-N 1 0 328.416 3.502 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC2CC(O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000432416583 1043134763 /nfs/dbraw/zinc/13/47/63/1043134763.db2.gz HGGHHDDKPVFKRJ-ZVYVSMAVSA-N 1 0 344.411 3.590 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCO[C@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279094765 1043337752 /nfs/dbraw/zinc/33/77/52/1043337752.db2.gz NUQWYJCGCKHNAG-BVGQSLNGSA-N 1 0 330.428 3.864 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512210000 1044160846 /nfs/dbraw/zinc/16/08/46/1044160846.db2.gz BQBYPBXYTWTOGL-SJLPKXTDSA-N 1 0 331.460 3.681 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1sc(C)nc1C ZINC000344832304 1044499194 /nfs/dbraw/zinc/49/91/94/1044499194.db2.gz SIXFCYIWSWRUDL-XFXZXTDPSA-N 1 0 331.441 3.904 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1CCCn2cc(C)nc21 ZINC000344857158 1044528072 /nfs/dbraw/zinc/52/80/72/1044528072.db2.gz LQMJXTKGTXCPDI-DZXKJOIRSA-N 1 0 340.427 3.670 20 5 EHBDRO Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1C ZINC001659390739 1126263425 /nfs/dbraw/zinc/26/34/25/1126263425.db2.gz YBSJGZPOYSEERG-INIZCTEOSA-N 1 0 348.830 3.558 20 5 EHBDRO CCCC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCC1 ZINC000184907577 1126710524 /nfs/dbraw/zinc/71/05/24/1126710524.db2.gz VKGMAAOQKLLEMF-KRWDZBQOSA-N 1 0 333.432 3.506 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2csc([N+](=O)[O-])c2)C1 ZINC000072965823 1126953488 /nfs/dbraw/zinc/95/34/88/1126953488.db2.gz YSPVVGMTBGPNRQ-HUUCEWRRSA-N 1 0 337.489 3.743 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)o1 ZINC000131207434 1126969190 /nfs/dbraw/zinc/96/91/90/1126969190.db2.gz SJZNSVZRHQAOCW-QGZVFWFLSA-N 1 0 346.383 3.550 20 5 EHBDRO C[C@H]1CCC[N@H+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000301280861 1127729370 /nfs/dbraw/zinc/72/93/70/1127729370.db2.gz ODWABDAHJNTDDM-LBPRGKRZSA-N 1 0 326.828 3.567 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302455 1127735703 /nfs/dbraw/zinc/73/57/03/1127735703.db2.gz VWTSCTYGMWVORQ-HUUCEWRRSA-N 1 0 335.423 3.825 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488451 1127758380 /nfs/dbraw/zinc/75/83/80/1127758380.db2.gz BUHOVWSTAQUONE-NSHDSACASA-N 1 0 344.358 3.683 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ncccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000301443288 1127936083 /nfs/dbraw/zinc/93/60/83/1127936083.db2.gz VAJAUWOWVMEJHE-IUODEOHRSA-N 1 0 332.429 3.546 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000273018399 1128432606 /nfs/dbraw/zinc/43/26/06/1128432606.db2.gz CESZKXDDZOUSLP-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000903280814 1128465446 /nfs/dbraw/zinc/46/54/46/1128465446.db2.gz DHOKAAJUBWHWLV-SMDDNHRTSA-N 1 0 326.437 3.929 20 5 EHBDRO C[C@H]1C[NH+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000301580726 1128499762 /nfs/dbraw/zinc/49/97/62/1128499762.db2.gz SHSZWXCDCQVXLW-STQMWFEESA-N 1 0 341.839 3.550 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000542725233 1128563231 /nfs/dbraw/zinc/56/32/31/1128563231.db2.gz ZOPHUXMGXXLCBB-UGSOOPFHSA-N 1 0 332.375 3.908 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1CCO[C@H](c2ccc(F)cc2)C1 ZINC000273502859 1128569887 /nfs/dbraw/zinc/56/98/87/1128569887.db2.gz POQQCRMTQAPXLJ-AEFFLSMTSA-N 1 0 330.359 3.744 20 5 EHBDRO COc1cc(C[N@@H+]2CCC3(CCC3)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000123121387 1128611033 /nfs/dbraw/zinc/61/10/33/1128611033.db2.gz XJNCLSXLHVYEER-UHFFFAOYSA-N 1 0 342.342 3.581 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@]1(O)CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000765881476 1128637329 /nfs/dbraw/zinc/63/73/29/1128637329.db2.gz RPKZJYZFVGOLPK-UXHICEINSA-N 1 0 340.423 3.860 20 5 EHBDRO CC[N@H+](CC(C)C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000153737822 1128661315 /nfs/dbraw/zinc/66/13/15/1128661315.db2.gz JAKKLFPIYPWRSH-LLVKDONJSA-N 1 0 327.812 3.553 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(C(F)(F)F)s2)cc1[N+](=O)[O-] ZINC000428842740 1128776345 /nfs/dbraw/zinc/77/63/45/1128776345.db2.gz GKVJEOIFCGEPOQ-UHFFFAOYSA-N 1 0 346.330 3.974 20 5 EHBDRO CCc1ccc([C@H](NC2CC[NH+](C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542478110 1120415557 /nfs/dbraw/zinc/41/55/57/1120415557.db2.gz PMWQDXNJPJFQEG-LJQANCHMSA-N 1 0 343.427 3.523 20 5 EHBDRO CCCCCC[N@H+](C)Cc1nc(-c2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000761637952 1120659892 /nfs/dbraw/zinc/65/98/92/1120659892.db2.gz HDLQAXWPZWSZIC-UHFFFAOYSA-N 1 0 332.404 3.965 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc(C)cc2)cc1[N+](=O)[O-] ZINC000153114313 1120691311 /nfs/dbraw/zinc/69/13/11/1120691311.db2.gz MDSPIIGBWVPNLZ-RDTXWAMCSA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCOC(F)F)o1 ZINC000193662149 1120789941 /nfs/dbraw/zinc/78/99/41/1120789941.db2.gz IAXRBHNSWMXTNI-UHFFFAOYSA-N 1 0 326.299 3.574 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H](O)c2ccc(F)c(F)c2)C2CC2)c1 ZINC000153260002 1120928589 /nfs/dbraw/zinc/92/85/89/1120928589.db2.gz PLKDHQPJVLEGND-GOSISDBHSA-N 1 0 348.349 3.571 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@@H](O)c2c(F)cccc2F)C2CC2)c1 ZINC000153273346 1120933513 /nfs/dbraw/zinc/93/35/13/1120933513.db2.gz NUNMYXXLCUQYKX-QGZVFWFLSA-N 1 0 348.349 3.571 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@H]12 ZINC000915210189 1121255084 /nfs/dbraw/zinc/25/50/84/1121255084.db2.gz WUHGRNYEGJIRFI-QBIMZIAESA-N 1 0 328.416 3.803 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000487955958 1121360247 /nfs/dbraw/zinc/36/02/47/1121360247.db2.gz VGZAPVCEQUTVRV-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO CC(C)COCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113315636 1129000306 /nfs/dbraw/zinc/00/03/06/1129000306.db2.gz PEJRHTMJQUOYTO-UHFFFAOYSA-N 1 0 349.456 3.871 20 5 EHBDRO CCCCOCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113330373 1129001631 /nfs/dbraw/zinc/00/16/31/1129001631.db2.gz GAIGOSSYGLZORQ-UHFFFAOYSA-N 1 0 335.429 3.625 20 5 EHBDRO CCCC[NH+]1CCC(N[C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153345694 1121745527 /nfs/dbraw/zinc/74/55/27/1121745527.db2.gz VRMGAJLMWCFHSE-OAHLLOKOSA-N 1 0 349.475 3.909 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCCC[C@@H]23)cc1C(F)(F)F ZINC000301117822 1121954382 /nfs/dbraw/zinc/95/43/82/1121954382.db2.gz WIJNNLUEHXPMQI-OCCSQVGLSA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763395788 1122229218 /nfs/dbraw/zinc/22/92/18/1122229218.db2.gz OTSQBDAHUKZULM-DLBZAZTESA-N 1 0 332.787 3.559 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCC[C@H]1O ZINC000497144531 1122351321 /nfs/dbraw/zinc/35/13/21/1122351321.db2.gz KMWNSQBAZLRDGV-MAUKXSAKSA-N 1 0 344.411 3.838 20 5 EHBDRO CC(C)[C@@H](c1ccccc1)[N@H+](C)CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000497445804 1122554647 /nfs/dbraw/zinc/55/46/47/1122554647.db2.gz UCYFIAUODXDTLA-IBGZPJMESA-N 1 0 341.411 3.862 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000497464081 1122561731 /nfs/dbraw/zinc/56/17/31/1122561731.db2.gz MWVZMVZEJHGPDP-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CC1CCC([N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C2CC2)CC1 ZINC000917437305 1122602380 /nfs/dbraw/zinc/60/23/80/1122602380.db2.gz JYKVKSUIQAHKJV-UHFFFAOYSA-N 1 0 328.416 3.945 20 5 EHBDRO O=c1oc2ccc([N+](=O)[O-])cc2n1C[N@@H+]1CCC[C@@H]1C1CCCCC1 ZINC000917481008 1122614284 /nfs/dbraw/zinc/61/42/84/1122614284.db2.gz WLPYGSVJCCMEEX-OAHLLOKOSA-N 1 0 345.399 3.505 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](c1ccccc1)C1CC1 ZINC000194552460 1122739795 /nfs/dbraw/zinc/73/97/95/1122739795.db2.gz PZYVCUKEUVWPNK-LJQANCHMSA-N 1 0 339.395 3.583 20 5 EHBDRO Cc1ccc(NC(=O)/C=C/c2ccc([N+](=O)[O-])cc2)c(C[NH+](C)C)c1 ZINC000113911590 1129090053 /nfs/dbraw/zinc/09/00/53/1129090053.db2.gz AZLMYLIZWKASSB-YRNVUSSQSA-N 1 0 339.395 3.617 20 5 EHBDRO CC(C)C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccs1 ZINC000155112548 1123189794 /nfs/dbraw/zinc/18/97/94/1123189794.db2.gz VUBXMDMGPPBSPE-CQSZACIVSA-N 1 0 347.440 3.972 20 5 EHBDRO COc1ccc(C[N@H+](CCc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000609744680 1123654857 /nfs/dbraw/zinc/65/48/57/1123654857.db2.gz SDXZOLFXZNMZGS-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000064641007 1123693483 /nfs/dbraw/zinc/69/34/83/1123693483.db2.gz MGMNOTLBAWHEJC-FQEVSTJZSA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(-n3cccn3)cc2)C2CC2)cc1 ZINC000195677476 1123734099 /nfs/dbraw/zinc/73/40/99/1123734099.db2.gz JMJKGSGGPJHSBF-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000615837655 1123884679 /nfs/dbraw/zinc/88/46/79/1123884679.db2.gz SNGNOTOVPMBHPH-SKTWIKFTSA-N 1 0 337.423 3.958 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000237884749 1123898578 /nfs/dbraw/zinc/89/85/78/1123898578.db2.gz CCDRABYAWPKYKM-GOSISDBHSA-N 1 0 343.427 3.731 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCCCO3)s2)cc1 ZINC000237989548 1123940423 /nfs/dbraw/zinc/94/04/23/1123940423.db2.gz VMRRVUYPSWWDQQ-OAHLLOKOSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@H]1CCC[C@](CNc2ncnc3sc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000326557575 1124646188 /nfs/dbraw/zinc/64/61/88/1124646188.db2.gz VEQFMJFXIXHAJT-ZBEGNZNMSA-N 1 0 349.460 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3cc(O)ccc3C2)c(Cl)c1 ZINC000618197838 1125017417 /nfs/dbraw/zinc/01/74/17/1125017417.db2.gz GIXAKVKEHIWBRA-CQSZACIVSA-N 1 0 332.787 3.601 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCOCC1 ZINC000618798283 1125205130 /nfs/dbraw/zinc/20/51/30/1125205130.db2.gz LTRWAOJRPOHBMC-OAHLLOKOSA-N 1 0 346.349 3.908 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000446843444 1125334965 /nfs/dbraw/zinc/33/49/65/1125334965.db2.gz NNLUWKOSCRDPHK-HKBKRHGFSA-N 1 0 340.427 3.611 20 5 EHBDRO O=C(CC[NH2+]CCCCc1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000619705741 1125390565 /nfs/dbraw/zinc/39/05/65/1125390565.db2.gz UPMGEXGHZCICSN-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000182990663 1125417813 /nfs/dbraw/zinc/41/78/13/1125417813.db2.gz MTLLQKAZOCYHHM-LBPRGKRZSA-N 1 0 347.440 3.953 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989280 1129220480 /nfs/dbraw/zinc/22/04/80/1129220480.db2.gz CNCWZPNQNDTMET-OLZOCXBDSA-N 1 0 328.368 3.778 20 5 EHBDRO C[C@H]([NH2+]Cc1cnn(Cc2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000079724006 1129289884 /nfs/dbraw/zinc/28/98/84/1129289884.db2.gz XDTOYDNLXYPBNS-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000116279746 1129348846 /nfs/dbraw/zinc/34/88/46/1129348846.db2.gz POIIXXCYWUQDCM-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000116280542 1129348890 /nfs/dbraw/zinc/34/88/90/1129348890.db2.gz LJMZDFLYAHHEHG-QGZVFWFLSA-N 1 0 346.814 3.730 20 5 EHBDRO C[NH+](C)CCc1ccc(Nc2ccc([N+](=O)[O-])c3cccnc23)cc1 ZINC000301958290 1129416290 /nfs/dbraw/zinc/41/62/90/1129416290.db2.gz OICHCPGNDDRLJX-UHFFFAOYSA-N 1 0 336.395 3.991 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000117345600 1129434945 /nfs/dbraw/zinc/43/49/45/1129434945.db2.gz NDZJMPULANTXPX-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000466474451 1129477519 /nfs/dbraw/zinc/47/75/19/1129477519.db2.gz NYDMXKXUPSXYKC-WBMJQRKESA-N 1 0 326.824 3.789 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(CCOC)CCC2)cc1[N+](=O)[O-] ZINC000154249174 1129542213 /nfs/dbraw/zinc/54/22/13/1129542213.db2.gz RYZFUOLODPNUMA-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482610 1129590406 /nfs/dbraw/zinc/59/04/06/1129590406.db2.gz IJKAJLKDYVRGLE-KGLIPLIRSA-N 1 0 330.384 3.590 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390545294 1129622616 /nfs/dbraw/zinc/62/26/16/1129622616.db2.gz UCPWKIGVAKWULJ-JXFKEZNVSA-N 1 0 339.439 3.910 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H](C(=O)NC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000124831961 1129637257 /nfs/dbraw/zinc/63/72/57/1129637257.db2.gz OMVNQVAIQKBOSP-BQFCYCMXSA-N 1 0 347.459 3.719 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nc2c(s1)CCC2 ZINC000922714094 1129637955 /nfs/dbraw/zinc/63/79/55/1129637955.db2.gz DPQQWOURZBRXMC-RAXLEYEMSA-N 1 0 343.452 3.776 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3Cc4ccccc4C3)o2)c1 ZINC000155461871 1129640158 /nfs/dbraw/zinc/64/01/58/1129640158.db2.gz YVYAZUBPHIJQOX-UHFFFAOYSA-N 1 0 335.363 3.808 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000124853009 1129640514 /nfs/dbraw/zinc/64/05/14/1129640514.db2.gz IKGCIRFRFDBAEG-ACJLOTCBSA-N 1 0 331.391 3.687 20 5 EHBDRO Cc1cnn(CC2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)c1 ZINC000330735044 1129644177 /nfs/dbraw/zinc/64/41/77/1129644177.db2.gz VQVWIDRIQJDMRZ-INIZCTEOSA-N 1 0 342.443 3.881 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235622 1129672478 /nfs/dbraw/zinc/67/24/78/1129672478.db2.gz QCRDQFUORISOLM-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000922844763 1129691112 /nfs/dbraw/zinc/69/11/12/1129691112.db2.gz ZESQCZXUIVSJSO-ONGXEEELSA-N 1 0 332.372 3.570 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513985 1129699493 /nfs/dbraw/zinc/69/94/93/1129699493.db2.gz FSZHYAAOAMYHLE-GFCCVEGCSA-N 1 0 341.367 3.505 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+]([C@@H]2C[C@H]2C)C[C@@H](C)C1 ZINC000429033018 1129714358 /nfs/dbraw/zinc/71/43/58/1129714358.db2.gz YZWPIRXXCCQZSJ-NQUFMGSDSA-N 1 0 331.460 3.626 20 5 EHBDRO C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302045565 1129764605 /nfs/dbraw/zinc/76/46/05/1129764605.db2.gz KILYNVKOMMVPCN-RYUDHWBXSA-N 1 0 338.839 3.708 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](c3ccccc3)C2)cc1 ZINC000302974459 1129803826 /nfs/dbraw/zinc/80/38/26/1129803826.db2.gz JCLQEEJFKIHNNI-KRWDZBQOSA-N 1 0 326.396 3.853 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196576 1129805733 /nfs/dbraw/zinc/80/57/33/1129805733.db2.gz TUFCMTDDOWAITG-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196866 1129805835 /nfs/dbraw/zinc/80/58/35/1129805835.db2.gz FCTRYDTZNDVFSN-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC001168741709 1129836222 /nfs/dbraw/zinc/83/62/22/1129836222.db2.gz PEUVPRFNMWUCGM-NIKGAXFTSA-N 1 0 328.412 3.800 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509142645 1129841948 /nfs/dbraw/zinc/84/19/48/1129841948.db2.gz UNFBVSMUCLIZEF-HOTGVXAUSA-N 1 0 328.359 3.556 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303655731 1129861921 /nfs/dbraw/zinc/86/19/21/1129861921.db2.gz UZPSIHLCSQCQIK-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000163648359 1129943376 /nfs/dbraw/zinc/94/33/76/1129943376.db2.gz LTJSCGPAHLKCBG-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO COc1ccc(C[N@H+](CCOc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000058562986 1129948557 /nfs/dbraw/zinc/94/85/57/1129948557.db2.gz IDOPBMIYCMRFKC-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132137 1129981382 /nfs/dbraw/zinc/98/13/82/1129981382.db2.gz YOPFZZMUHCVHHI-HNNXBMFYSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000134132361 1129981557 /nfs/dbraw/zinc/98/15/57/1129981557.db2.gz YOPFZZMUHCVHHI-OAHLLOKOSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)COC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000172019485 1130100362 /nfs/dbraw/zinc/10/03/62/1130100362.db2.gz SFNQOLHNBCFKCJ-UHFFFAOYSA-N 1 0 326.824 3.885 20 5 EHBDRO C[C@@H]1[C@@H](C)CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000172864394 1130165240 /nfs/dbraw/zinc/16/52/40/1130165240.db2.gz QAQHGOUQEAQKCA-UONOGXRCSA-N 1 0 329.400 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@H](c4ccccc4F)C3)c2c1 ZINC000730455256 1130712730 /nfs/dbraw/zinc/71/27/30/1130712730.db2.gz RPIUAEUZGJZKGY-AWEZNQCLSA-N 1 0 340.358 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H](CCO)C3CC3)s2)cc1 ZINC000741258529 1131590155 /nfs/dbraw/zinc/59/01/55/1131590155.db2.gz NIYQZWRLTBCLBT-INIZCTEOSA-N 1 0 332.425 3.574 20 5 EHBDRO Cc1ccnc([C@@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172897607 1131881365 /nfs/dbraw/zinc/88/13/65/1131881365.db2.gz BCSMAHBHAXMJBV-PBHICJAKSA-N 1 0 325.412 3.896 20 5 EHBDRO [NH2+]=C(N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1Cl ZINC001172903751 1131886387 /nfs/dbraw/zinc/88/63/87/1131886387.db2.gz SZFUSSDMHDHDKV-ZDUSSCGKSA-N 1 0 344.802 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H](c1cccnc1)C1CC1)CC2 ZINC001172903236 1131886560 /nfs/dbraw/zinc/88/65/60/1131886560.db2.gz POXDQXFTCGMXHT-UYAOXDASSA-N 1 0 337.423 3.978 20 5 EHBDRO [NH2+]=C(N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1Cl ZINC001172903750 1131886981 /nfs/dbraw/zinc/88/69/81/1131886981.db2.gz SZFUSSDMHDHDKV-CYBMUJFWSA-N 1 0 344.802 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCCc3ccncc31)CC2 ZINC001172908189 1131888401 /nfs/dbraw/zinc/88/84/01/1131888401.db2.gz KZQZIBNJZVRDQT-XLIONFOSSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1CCc3cc(O)ccc3C1)CC2 ZINC001172906196 1131888506 /nfs/dbraw/zinc/88/85/06/1131888506.db2.gz WOFJQQVFJAJCLT-GOSISDBHSA-N 1 0 338.407 3.606 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)c1F ZINC001173179272 1131992576 /nfs/dbraw/zinc/99/25/76/1131992576.db2.gz OPKKVJXXZSMCEE-STQMWFEESA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1F ZINC001173177589 1131992591 /nfs/dbraw/zinc/99/25/91/1131992591.db2.gz VRJLECJOKBHYQW-MNOVXSKESA-N 1 0 346.349 3.699 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2C[C@H]3CCCC[C@@H]3C2)c1F ZINC001173183475 1131994413 /nfs/dbraw/zinc/99/44/13/1131994413.db2.gz YTRTVRFUIPNBQQ-BFHYXJOUSA-N 1 0 336.407 3.796 20 5 EHBDRO CCOc1cccc(CC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214856 1132001161 /nfs/dbraw/zinc/00/11/61/1132001161.db2.gz QWZUHMCXYOFIHJ-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC001173215665 1132002402 /nfs/dbraw/zinc/00/24/02/1132002402.db2.gz YEPMTIHBEOPFSG-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1cccc2c(C[NH3+])cn([C@H](C)Cc3ccc([N+](=O)[O-])cc3)c21 ZINC001173222077 1132004261 /nfs/dbraw/zinc/00/42/61/1132004261.db2.gz SVZDEWFPUJYKCG-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCO)c1cccc(Cl)c1 ZINC001173220893 1132004573 /nfs/dbraw/zinc/00/45/73/1132004573.db2.gz HTQAOEORQKRUSR-ACJLOTCBSA-N 1 0 348.830 3.893 20 5 EHBDRO Cc1cnccc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223355 1132005821 /nfs/dbraw/zinc/00/58/21/1132005821.db2.gz IDMLJGXGJJFAJA-LIRRHRJNSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-c2ncccn2)cc1 ZINC001173224969 1132005846 /nfs/dbraw/zinc/00/58/46/1132005846.db2.gz PYKSKTRXBSTCQE-OAHLLOKOSA-N 1 0 348.406 3.773 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001173231062 1132009248 /nfs/dbraw/zinc/00/92/48/1132009248.db2.gz JGKGABKPWVFJSP-DNVCBOLYSA-N 1 0 332.444 3.807 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(-c2ccccc2)no1 ZINC001173212998 1132014315 /nfs/dbraw/zinc/01/43/15/1132014315.db2.gz FEPCYIYXYDPVPQ-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CCOCC1 ZINC001173213920 1132015610 /nfs/dbraw/zinc/01/56/10/1132015610.db2.gz MBHFGKUFHWPFDG-INIZCTEOSA-N 1 0 340.423 3.821 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](CCc1ccccc1)C1CC1 ZINC000746114881 1132376753 /nfs/dbraw/zinc/37/67/53/1132376753.db2.gz YWNJYBHUWYKVFX-UHFFFAOYSA-N 1 0 326.396 3.681 20 5 EHBDRO C[C@H]([NH2+]Cc1c2ccccc2cc2ccccc21)[C@@H]1CN(C)CCO1 ZINC000773403259 1132460498 /nfs/dbraw/zinc/46/04/98/1132460498.db2.gz DBMJKWGTOMSDND-AOMKIAJQSA-N 1 0 334.463 3.802 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168978349 1132618528 /nfs/dbraw/zinc/61/85/28/1132618528.db2.gz RGFSIMHQTFYVMG-GYSYKLTISA-N 1 0 327.222 3.545 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168996538 1132626118 /nfs/dbraw/zinc/62/61/18/1132626118.db2.gz VQQPYZZNIBOFRD-DFBGVHRSSA-N 1 0 341.249 3.935 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ccnc(C(F)(F)F)c2)C2CC2)C1 ZINC001168997033 1132627667 /nfs/dbraw/zinc/62/76/67/1132627667.db2.gz BCEWAKORJOXNGL-DGFSRKRXSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2cccnc2C(F)(F)F)C2CC2)C1 ZINC001169009759 1132631419 /nfs/dbraw/zinc/63/14/19/1132631419.db2.gz XYEDGPZWIFABBB-OSMZGAPFSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2c3ccc(Cl)cc3c3c2CC[NH2+]C3)C1 ZINC001169030324 1132635997 /nfs/dbraw/zinc/63/59/97/1132635997.db2.gz YSPCZSDYTBSNSB-DGCLKSJQSA-N 1 0 333.819 3.558 20 5 EHBDRO Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@H]2CC[C@H](C[N+](=O)[O-])C2)CC1 ZINC001169024904 1132640912 /nfs/dbraw/zinc/64/09/12/1132640912.db2.gz SHPVFCHEDHPRNL-WMZOPIPTSA-N 1 0 328.456 3.720 20 5 EHBDRO CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169045718 1132641693 /nfs/dbraw/zinc/64/16/93/1132641693.db2.gz JTISPAKFDIDFTR-ZFWWWQNUSA-N 1 0 330.350 3.973 20 5 EHBDRO CC1(C)C[C@H](Nc2cc(F)cc(F)c2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169141600 1132674263 /nfs/dbraw/zinc/67/42/63/1132674263.db2.gz CLIOPDFPTZWSAT-ZBEGNZNMSA-N 1 0 327.375 3.829 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@H]1CCc2ccccc2[C@@H]1O ZINC001169619504 1132807944 /nfs/dbraw/zinc/80/79/44/1132807944.db2.gz ISTZFBUCEKRVAL-SFTDATJTSA-N 1 0 325.476 3.743 20 5 EHBDRO COc1c(F)cc(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)cc1[N+](=O)[O-] ZINC001169697656 1132823075 /nfs/dbraw/zinc/82/30/75/1132823075.db2.gz OKKNJYHQMUKBFT-OAHLLOKOSA-N 1 0 345.374 3.983 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCOC12CCCC2 ZINC001176823943 1133003219 /nfs/dbraw/zinc/00/32/19/1133003219.db2.gz ZTTUPVDOGPOQHA-QGZVFWFLSA-N 1 0 334.416 3.573 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762595 1133048244 /nfs/dbraw/zinc/04/82/44/1133048244.db2.gz IZLCKWBJZUCAEW-LRDDRELGSA-N 1 0 331.420 3.506 20 5 EHBDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765819 1133049823 /nfs/dbraw/zinc/04/98/23/1133049823.db2.gz PNXDKXPOYAXMQC-INIZCTEOSA-N 1 0 343.431 3.711 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC001177976268 1133126283 /nfs/dbraw/zinc/12/62/83/1133126283.db2.gz DBSWYRQDMUCQFQ-UHFFFAOYSA-N 1 0 349.818 3.935 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C/C=C/c1ccc(F)cc1F ZINC001178295271 1133153861 /nfs/dbraw/zinc/15/38/61/1133153861.db2.gz OBBZSTIDQJDKQR-NSCUHMNNSA-N 1 0 334.322 3.685 20 5 EHBDRO CCO[C@@H]1CCC[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001178326688 1133160258 /nfs/dbraw/zinc/16/02/58/1133160258.db2.gz OVZHWJVVZWEDRV-LSDHHAIUSA-N 1 0 326.824 3.728 20 5 EHBDRO C[C@@H]1CCC[C@@H]1C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178558033 1133181040 /nfs/dbraw/zinc/18/10/40/1133181040.db2.gz WZZVXNVXEDJJGQ-GHMZBOCLSA-N 1 0 327.222 3.883 20 5 EHBDRO Cc1cc(C[NH2+]CCc2ccccc2[N+](=O)[O-])ccc1Br ZINC001178606032 1133185577 /nfs/dbraw/zinc/18/55/77/1133185577.db2.gz SHGMRXNJJGRGBG-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]CCC(C)(C)OC)o2)c([N+](=O)[O-])c1 ZINC001179391806 1133250204 /nfs/dbraw/zinc/25/02/04/1133250204.db2.gz ZDBLJPYUJFTTCY-UHFFFAOYSA-N 1 0 348.399 3.768 20 5 EHBDRO Cc1noc(C)c1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774219598 1133641249 /nfs/dbraw/zinc/64/12/49/1133641249.db2.gz TTZABBWCQXFCJF-SFHVURJKSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CC[C@H]1COc2ccccc2O1 ZINC001182432610 1133656015 /nfs/dbraw/zinc/65/60/15/1133656015.db2.gz AYMODBJHDIUVST-AWEZNQCLSA-N 1 0 348.786 3.568 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CC[C@@H]1COc2ccccc2O1 ZINC001182432611 1133656112 /nfs/dbraw/zinc/65/61/12/1133656112.db2.gz AYMODBJHDIUVST-CQSZACIVSA-N 1 0 348.786 3.568 20 5 EHBDRO Cc1nn(C[NH+](CC(C)(C)C)CC(C)(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000774639389 1133814115 /nfs/dbraw/zinc/81/41/15/1133814115.db2.gz JRRHTWLXJGIBME-UHFFFAOYSA-N 1 0 347.463 4.000 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000746666404 1133985153 /nfs/dbraw/zinc/98/51/53/1133985153.db2.gz MJIWEYIVLOHJBT-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998596 1134018117 /nfs/dbraw/zinc/01/81/17/1134018117.db2.gz FIDYFXUKQMUMRD-ZNMIVQPWSA-N 1 0 342.443 3.921 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000788580007 1134146879 /nfs/dbraw/zinc/14/68/79/1134146879.db2.gz JXUHDLQPDZAWPL-QZTJIDSGSA-N 1 0 344.386 3.780 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000788574830 1134147369 /nfs/dbraw/zinc/14/73/69/1134147369.db2.gz BDJCYRWQLJCUBT-ZWKOTPCHSA-N 1 0 344.386 3.780 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788693995 1134157686 /nfs/dbraw/zinc/15/76/86/1134157686.db2.gz SVWFQPVWEVPMKG-PZROIBLQSA-N 1 0 347.390 3.743 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3[N+](=O)[O-])C2)cc1 ZINC000775061524 1134274043 /nfs/dbraw/zinc/27/40/43/1134274043.db2.gz WQWWSMKJFDFJSZ-OAHLLOKOSA-N 1 0 341.367 3.801 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](Cc3cccc(C)c3)C2)c([N+](=O)[O-])s1 ZINC001187190977 1134307969 /nfs/dbraw/zinc/30/79/69/1134307969.db2.gz WWCKNDGWGXYITH-HNNXBMFYSA-N 1 0 331.441 3.960 20 5 EHBDRO CC(C)C[C@@H]1C[N@H+](C)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001187708183 1134371856 /nfs/dbraw/zinc/37/18/56/1134371856.db2.gz DIRXBOYUESFMGK-CYBMUJFWSA-N 1 0 345.365 3.780 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170297197 1134737387 /nfs/dbraw/zinc/73/73/87/1134737387.db2.gz LVSLTJLJJGAMNS-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2cc(C)ccn2)c([N+](=O)[O-])c1 ZINC001170297509 1134737572 /nfs/dbraw/zinc/73/75/72/1134737572.db2.gz OHDXZZVYLBPCSM-UONOGXRCSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170298579 1134738028 /nfs/dbraw/zinc/73/80/28/1134738028.db2.gz MPIICRFTVBNPTF-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170299561 1134738218 /nfs/dbraw/zinc/73/82/18/1134738218.db2.gz UYIJCJWTYHVEJM-NWDGAFQWSA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170304463 1134739079 /nfs/dbraw/zinc/73/90/79/1134739079.db2.gz CAXIIDCAKMWZAG-YPMHNXCESA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170304253 1134739210 /nfs/dbraw/zinc/73/92/10/1134739210.db2.gz ALHFHCZLPDLGJO-ZIAGYGMSSA-N 1 0 344.411 3.633 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C(C)(C)Cc2cccnc2)c([N+](=O)[O-])c1 ZINC001170325886 1134748240 /nfs/dbraw/zinc/74/82/40/1134748240.db2.gz BNEMCXRUBFNXNJ-AWEZNQCLSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3ccc(C)cc3C2)c([N+](=O)[O-])c1 ZINC001170327191 1134748323 /nfs/dbraw/zinc/74/83/23/1134748323.db2.gz FMLUCGAMKMCSCZ-OAHLLOKOSA-N 1 0 340.423 3.901 20 5 EHBDRO CC(C)[C@@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001191201920 1134814323 /nfs/dbraw/zinc/81/43/23/1134814323.db2.gz CGIGKFCTQOBPFV-ZDUSSCGKSA-N 1 0 327.222 3.978 20 5 EHBDRO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204363 1134814888 /nfs/dbraw/zinc/81/48/88/1134814888.db2.gz SQTXHELUKBAAOM-GDBMZVCRSA-N 1 0 326.824 3.884 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCS[C@H]3CCCC[C@H]32)cc1 ZINC001191368241 1134858508 /nfs/dbraw/zinc/85/85/08/1134858508.db2.gz YYKXFLVXSSLJKS-SJORKVTESA-N 1 0 336.457 3.724 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccccc1CC(=O)OC)c1cccc([N+](=O)[O-])c1 ZINC000775537561 1135034286 /nfs/dbraw/zinc/03/42/86/1135034286.db2.gz AJIYMRBJLJFLKX-SFHVURJKSA-N 1 0 342.395 3.551 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001193325019 1135125484 /nfs/dbraw/zinc/12/54/84/1135125484.db2.gz XWUXQFHVHMVVFK-KRWDZBQOSA-N 1 0 326.396 3.772 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1nsc2ccccc21 ZINC001194260526 1135251308 /nfs/dbraw/zinc/25/13/08/1135251308.db2.gz DKVMSTCFOQOWNC-UHFFFAOYSA-N 1 0 327.409 3.879 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2ccc(Cl)c(F)c2)c(F)c1 ZINC001205804050 1135683107 /nfs/dbraw/zinc/68/31/07/1135683107.db2.gz XTHJARDKYWCICY-UHFFFAOYSA-N 1 0 342.729 3.695 20 5 EHBDRO CC(C)[N@H+](CC[C@H](O)c1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000808711909 1135719130 /nfs/dbraw/zinc/71/91/30/1135719130.db2.gz WARZSMLYAYRFFG-IBGZPJMESA-N 1 0 328.412 3.929 20 5 EHBDRO C[C@@]1(Cc2cccs2)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301958 1135796590 /nfs/dbraw/zinc/79/65/90/1135796590.db2.gz ZCKWGIQDQIPLQM-MSOLQXFVSA-N 1 0 346.452 3.787 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001198707212 1135851584 /nfs/dbraw/zinc/85/15/84/1135851584.db2.gz SRNCGIFDTBMSOU-GDBMZVCRSA-N 1 0 345.443 3.824 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCCC[C@@H]3C2)c([N+](=O)[O-])cc1O ZINC001199053504 1135876249 /nfs/dbraw/zinc/87/62/49/1135876249.db2.gz ZZWVRQRXCPJPNJ-GZBFAFLISA-N 1 0 334.416 3.758 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCN1CCCc2ccccc21 ZINC001199800568 1135930608 /nfs/dbraw/zinc/93/06/08/1135930608.db2.gz GYXLJUJATHPXOA-UHFFFAOYSA-N 1 0 339.439 3.754 20 5 EHBDRO C[C@@H](C[C@H]1CCOC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001201380832 1136014083 /nfs/dbraw/zinc/01/40/83/1136014083.db2.gz VZGGCVUVFCZDMO-UONOGXRCSA-N 1 0 330.384 3.760 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@H](C2CCOCC2)C1 ZINC001201635029 1136045128 /nfs/dbraw/zinc/04/51/28/1136045128.db2.gz XZUDRUDMSJRXDG-DOTOQJQBSA-N 1 0 348.443 3.678 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC001201788359 1136066765 /nfs/dbraw/zinc/06/67/65/1136066765.db2.gz YLRVVLMOBXXPTP-ORAYPTAESA-N 1 0 346.402 3.953 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(CO)CCCCC1 ZINC000811484265 1136092082 /nfs/dbraw/zinc/09/20/82/1136092082.db2.gz XWCQONWENLEONO-UHFFFAOYSA-N 1 0 347.242 3.934 20 5 EHBDRO Cc1ncc(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])s1 ZINC000811484597 1136092426 /nfs/dbraw/zinc/09/24/26/1136092426.db2.gz CVEFBFUUSNSLGZ-UHFFFAOYSA-N 1 0 346.239 3.999 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])O1 ZINC000811492492 1136093650 /nfs/dbraw/zinc/09/36/50/1136093650.db2.gz SZHGAYADCMDOBT-LLVKDONJSA-N 1 0 333.215 3.949 20 5 EHBDRO COCc1csc(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])c1 ZINC000850377513 1136245320 /nfs/dbraw/zinc/24/53/20/1136245320.db2.gz JHIIYIKBYYPKOZ-UHFFFAOYSA-N 1 0 326.805 3.746 20 5 EHBDRO CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812853112 1136262801 /nfs/dbraw/zinc/26/28/01/1136262801.db2.gz AOSLJJQSAGCMBL-HNAYVOBHSA-N 1 0 328.412 3.581 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@](C)(O)c1ccccc1 ZINC000850462396 1136264043 /nfs/dbraw/zinc/26/40/43/1136264043.db2.gz NYKQYMIBXZROPK-KUHUBIRLSA-N 1 0 344.411 3.552 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470241 1136265312 /nfs/dbraw/zinc/26/53/12/1136265312.db2.gz ZVKFZCPSWDFQDQ-ACJLOTCBSA-N 1 0 344.411 3.550 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@]1(C)C[C@@]1(F)Cl ZINC000850476936 1136266860 /nfs/dbraw/zinc/26/68/60/1136266860.db2.gz OZFINOVOVYHIGZ-LKTVYLICSA-N 1 0 330.787 3.959 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1C[C@@H](O)c2ccccc21)C1CC1 ZINC000850529606 1136278989 /nfs/dbraw/zinc/27/89/89/1136278989.db2.gz SKJJBFZAERGAPY-NLWGTHIKSA-N 1 0 338.407 3.684 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(CO)CCC1 ZINC000814170736 1136414953 /nfs/dbraw/zinc/41/49/53/1136414953.db2.gz CRLXGIMEMSCOGY-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000776593710 1136453950 /nfs/dbraw/zinc/45/39/50/1136453950.db2.gz WPQSEXMAZMXUNJ-RBUKOAKNSA-N 1 0 344.386 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NC[C@@H]3CCC[N@H+](CC4CC4)C3)sc2c1 ZINC000853999655 1136579204 /nfs/dbraw/zinc/57/92/04/1136579204.db2.gz NPXBWHOOSIQRKT-ZDUSSCGKSA-N 1 0 346.456 3.738 20 5 EHBDRO Cc1cc(Cl)c(C(=O)OCC[C@@H]2CCCC[N@H+]2C)cc1[N+](=O)[O-] ZINC000815405708 1136592812 /nfs/dbraw/zinc/59/28/12/1136592812.db2.gz GLUSLVZYABPPFM-LBPRGKRZSA-N 1 0 340.807 3.588 20 5 EHBDRO C[C@@H]([NH2+]CCCO[C@@H](C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554507 1136609853 /nfs/dbraw/zinc/60/98/53/1136609853.db2.gz AXNXQLBBGFINOV-CABCVRRESA-N 1 0 343.427 3.996 20 5 EHBDRO CC(C)Oc1ccc(CC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556603 1136610155 /nfs/dbraw/zinc/61/01/55/1136610155.db2.gz ZDVADKZQHNLYAO-CQSZACIVSA-N 1 0 343.427 3.858 20 5 EHBDRO CC(C)Oc1cccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815561730 1136611291 /nfs/dbraw/zinc/61/12/91/1136611291.db2.gz OMZLELRTNHDHOR-ZDUSSCGKSA-N 1 0 329.400 3.815 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741652 1136617806 /nfs/dbraw/zinc/61/78/06/1136617806.db2.gz WKBSWZTXHPAWDV-WMLDXEAASA-N 1 0 334.416 3.711 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2cccc([N+](=O)[O-])c2Cl)c1 ZINC000816955704 1136766669 /nfs/dbraw/zinc/76/66/69/1136766669.db2.gz LDWAEYXQIYFQPA-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414680 1136806716 /nfs/dbraw/zinc/80/67/16/1136806716.db2.gz ICZMXEJNNGWRTH-NWDGAFQWSA-N 1 0 333.215 3.949 20 5 EHBDRO C[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000339000367 1136825180 /nfs/dbraw/zinc/82/51/80/1136825180.db2.gz LRNAODBBBOLARG-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3C[C@H]3C3CCC3)CC2)cc1 ZINC000818346591 1136869916 /nfs/dbraw/zinc/86/99/16/1136869916.db2.gz UJOIQNVYHASMOY-KXBFYZLASA-N 1 0 329.444 3.589 20 5 EHBDRO [NH3+][C@H](CCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCCCC1 ZINC000818380596 1136877076 /nfs/dbraw/zinc/87/70/76/1136877076.db2.gz JDHPDMZVALFPNF-OAHLLOKOSA-N 1 0 344.415 3.875 20 5 EHBDRO [NH3+]CCCCCCCOc1c(Br)cccc1[N+](=O)[O-] ZINC000818619872 1136886926 /nfs/dbraw/zinc/88/69/26/1136886926.db2.gz MFTFSZZAQBNTGX-UHFFFAOYSA-N 1 0 331.210 3.645 20 5 EHBDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819079424 1136911989 /nfs/dbraw/zinc/91/19/89/1136911989.db2.gz ACCGJGDJUBLPNO-AEFFLSMTSA-N 1 0 348.830 3.893 20 5 EHBDRO CC[C@H](CSc1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819187130 1136921272 /nfs/dbraw/zinc/92/12/72/1136921272.db2.gz BIBJOGSTFWVAHE-QAPCUYQASA-N 1 0 346.452 3.789 20 5 EHBDRO C[C@@H]([NH2+]CC1(C(F)(F)F)CCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858568557 1136979146 /nfs/dbraw/zinc/97/91/46/1136979146.db2.gz OIACACQLURGUHB-SNVBAGLBSA-N 1 0 331.338 3.950 20 5 EHBDRO COc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1F ZINC000859645280 1137024263 /nfs/dbraw/zinc/02/42/63/1137024263.db2.gz WPRULGTXTRTSIV-UHFFFAOYSA-N 1 0 336.338 3.907 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C[NH+](C)C)cc1F ZINC000823576709 1137104805 /nfs/dbraw/zinc/10/48/05/1137104805.db2.gz JPJYYBIZEHZQAE-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@H]1CCc2ccc(O)cc2C1 ZINC001171031482 1137113596 /nfs/dbraw/zinc/11/35/96/1137113596.db2.gz FAEXPHJRNBFDLV-IBGZPJMESA-O 1 0 325.476 3.958 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CCC(O)CC3)CC2)cc1Cl ZINC000824520835 1137141112 /nfs/dbraw/zinc/14/11/12/1137141112.db2.gz AZKKDHHTRRFIOT-UHFFFAOYSA-N 1 0 338.835 3.765 20 5 EHBDRO C[C@@H]([NH3+])CN(C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000863651168 1137196700 /nfs/dbraw/zinc/19/67/00/1137196700.db2.gz CEFZMNZDKDMCKG-GFCCVEGCSA-N 1 0 349.818 3.820 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](O)c1ccccc1 ZINC000794615710 1137221078 /nfs/dbraw/zinc/22/10/78/1137221078.db2.gz YKNDHJGUHULSKO-MSOLQXFVSA-N 1 0 332.375 3.582 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000120481448 1137275980 /nfs/dbraw/zinc/27/59/80/1137275980.db2.gz PDQDPJRXHWBGLF-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ccc4nc[nH]c4c3[N+](=O)[O-])c2c1 ZINC001171167540 1137278380 /nfs/dbraw/zinc/27/83/80/1137278380.db2.gz HNVZERKCNDKZDX-LBPRGKRZSA-N 1 0 349.394 3.613 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567505 1137295653 /nfs/dbraw/zinc/29/56/53/1137295653.db2.gz NQOKNPGEKNXXKI-GFCCVEGCSA-N 1 0 327.375 3.701 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000866020420 1137324877 /nfs/dbraw/zinc/32/48/77/1137324877.db2.gz LHTIKBSXINLOAZ-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@](C)(O)c1ccccc1 ZINC000846038771 1137328932 /nfs/dbraw/zinc/32/89/32/1137328932.db2.gz QEZUOPLPEDQWPQ-SJCJKPOMSA-N 1 0 334.803 3.634 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](c1cccnc1)C1CC1 ZINC000866312634 1137344894 /nfs/dbraw/zinc/34/48/94/1137344894.db2.gz PHJZMFOJXLNVKV-XIKOKIGWSA-N 1 0 329.375 3.801 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866538596 1137362830 /nfs/dbraw/zinc/36/28/30/1137362830.db2.gz CPYRACVLQGETCZ-OAHLLOKOSA-N 1 0 341.411 3.719 20 5 EHBDRO CC[C@H](C[C@H](C)O)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000866635270 1137371579 /nfs/dbraw/zinc/37/15/79/1137371579.db2.gz OJXSGBHXYIOVLJ-YJLNNSPDSA-N 1 0 328.412 3.823 20 5 EHBDRO Cc1ccnc([C@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)C2)c1 ZINC000846979774 1137381964 /nfs/dbraw/zinc/38/19/64/1137381964.db2.gz QQXVZXLDBLFXKX-ZDUSSCGKSA-N 1 0 331.803 3.941 20 5 EHBDRO CC(C)CC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000773037333 1137460847 /nfs/dbraw/zinc/46/08/47/1137460847.db2.gz TXNLPURGJXLWQU-UHFFFAOYSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@](C)(O)c1ccc(F)cc1 ZINC000773120149 1137466925 /nfs/dbraw/zinc/46/69/25/1137466925.db2.gz RBNLHBDNJBBYQM-ACJLOTCBSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000715136647 1137476314 /nfs/dbraw/zinc/47/63/14/1137476314.db2.gz MEPOUFSSBFWQQP-UMVBOHGHSA-N 1 0 349.431 3.549 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC001649160325 1137479532 /nfs/dbraw/zinc/47/95/32/1137479532.db2.gz XEZRRVDWFPADKS-QGZVFWFLSA-N 1 0 348.406 3.829 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001171619741 1137500946 /nfs/dbraw/zinc/50/09/46/1137500946.db2.gz DFFWBIWYEWMNJC-SJKOYZFVSA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCCC2)CC1 ZINC001171911649 1137518100 /nfs/dbraw/zinc/51/81/00/1137518100.db2.gz TWRAJFFSTYZJCP-OAHLLOKOSA-N 1 0 345.443 3.968 20 5 EHBDRO C[C@@H](NCc1ccc(F)c(C[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033037 1137566721 /nfs/dbraw/zinc/56/67/21/1137566721.db2.gz AYNNCZPWEFRYRL-GFCCVEGCSA-N 1 0 349.381 3.785 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1ccsc1 ZINC000872037788 1137566923 /nfs/dbraw/zinc/56/69/23/1137566923.db2.gz IEJCXHAIDRVGMU-QMTHXVAHSA-N 1 0 338.454 3.762 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1ccsc1 ZINC000872037786 1137566936 /nfs/dbraw/zinc/56/69/36/1137566936.db2.gz IEJCXHAIDRVGMU-HZMBPMFUSA-N 1 0 338.454 3.762 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872047157 1137567589 /nfs/dbraw/zinc/56/75/89/1137567589.db2.gz BUGFPBIJGPNMFO-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872047158 1137567649 /nfs/dbraw/zinc/56/76/49/1137567649.db2.gz BUGFPBIJGPNMFO-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+]CCSCC(F)(F)F)c1c(F)cccc1[N+](=O)[O-] ZINC000872054512 1137568306 /nfs/dbraw/zinc/56/83/06/1137568306.db2.gz XLBGWXYLVQUSMH-MRVPVSSYSA-N 1 0 326.315 3.680 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cccc(C)n1 ZINC000872066917 1137569296 /nfs/dbraw/zinc/56/92/96/1137569296.db2.gz MDLSESNJRLZYAE-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC([NH+]2CCCCC2)C1 ZINC000872069473 1137569394 /nfs/dbraw/zinc/56/93/94/1137569394.db2.gz QADFZBFWZUHFSL-HLIUYOAVSA-N 1 0 349.500 3.984 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ncc(Cl)s1 ZINC000872112659 1137571859 /nfs/dbraw/zinc/57/18/59/1137571859.db2.gz KJYOGEKAMYWJBF-QMMMGPOBSA-N 1 0 329.784 3.565 20 5 EHBDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873060850 1137589239 /nfs/dbraw/zinc/58/92/39/1137589239.db2.gz CXKHFIJARAFIEO-KRWDZBQOSA-N 1 0 342.395 3.834 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000873131389 1137590930 /nfs/dbraw/zinc/59/09/30/1137590930.db2.gz OZTZCKPWFBRXCU-APWZRJJASA-N 1 0 341.411 3.617 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H](CC3CC3)c3ccccc3)C2)c1 ZINC000877044330 1137668583 /nfs/dbraw/zinc/66/85/83/1137668583.db2.gz YRXJYXKWXBYOSQ-LEOMRAHMSA-N 1 0 326.400 3.626 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877077454 1137669753 /nfs/dbraw/zinc/66/97/53/1137669753.db2.gz IQSFYMHCWGBETM-IRTXOTEKSA-N 1 0 344.390 3.547 20 5 EHBDRO CC[C@@H](CSc1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877111550 1137670405 /nfs/dbraw/zinc/67/04/05/1137670405.db2.gz JYKFJBREILJERC-NFOMZHRRSA-N 1 0 346.456 3.655 20 5 EHBDRO CC[C@H](CSc1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877111551 1137670476 /nfs/dbraw/zinc/67/04/76/1137670476.db2.gz JYKFJBREILJERC-WLYUNCDWSA-N 1 0 346.456 3.655 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3C[C@H](c4cccc(Cl)c4)C3)C2)c1 ZINC000877496274 1137678501 /nfs/dbraw/zinc/67/85/01/1137678501.db2.gz PKECVNULVKJCDG-YCVWASFZSA-N 1 0 346.818 3.684 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827758 1137692497 /nfs/dbraw/zinc/69/24/97/1137692497.db2.gz OQNCLXKJNSNZEU-UAGWRWDDSA-N 1 0 328.349 3.968 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878114435 1137702867 /nfs/dbraw/zinc/70/28/67/1137702867.db2.gz XHQVBZPJCIPHBR-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC3(CCC3)C2)o1 ZINC000878187512 1137706324 /nfs/dbraw/zinc/70/63/24/1137706324.db2.gz BSYPDKFBFVTCQC-UHFFFAOYSA-N 1 0 348.790 3.674 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878446552 1137716388 /nfs/dbraw/zinc/71/63/88/1137716388.db2.gz GNYSIRQZZLGKCH-YRGRVCCFSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879690530 1137755409 /nfs/dbraw/zinc/75/54/09/1137755409.db2.gz XVTKUSFISZLCQM-ZBFHGGJFSA-N 1 0 338.411 3.535 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CCCn2nccc21 ZINC000879788091 1137758764 /nfs/dbraw/zinc/75/87/64/1137758764.db2.gz QRKCLXQHLOPPNV-LBPRGKRZSA-N 1 0 341.198 3.723 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2ncc(C)cc2[N+](=O)[O-])CC1 ZINC000882817316 1137834962 /nfs/dbraw/zinc/83/49/62/1137834962.db2.gz YBASZOCOCWOSQP-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cccc2c1CCOC2 ZINC000883084236 1137844095 /nfs/dbraw/zinc/84/40/95/1137844095.db2.gz LNRMWOJERXJDQP-UHFFFAOYSA-N 1 0 346.814 3.653 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCc1ccns1 ZINC000883247948 1137850418 /nfs/dbraw/zinc/85/04/18/1137850418.db2.gz CFSGKFRWJPNAGA-CJNGLKHVSA-N 1 0 331.441 3.595 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCC[C@]23CCCO3)cc1[N+](=O)[O-] ZINC000883368020 1137857775 /nfs/dbraw/zinc/85/77/75/1137857775.db2.gz DUGHGBFCYBBMEI-XWIAVFTESA-N 1 0 334.416 3.746 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CCC3(COC3)CC2)o1 ZINC000883390510 1137859159 /nfs/dbraw/zinc/85/91/59/1137859159.db2.gz NOTCSAQYADWCEP-UHFFFAOYSA-N 1 0 342.395 3.904 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000348306218 1137924737 /nfs/dbraw/zinc/92/47/37/1137924737.db2.gz CPLYIJYKNYXWSY-LLVKDONJSA-N 1 0 333.413 3.508 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128109 1137932625 /nfs/dbraw/zinc/93/26/25/1137932625.db2.gz MYNZGYISBVNNQF-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)[C@H]1CCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332338775 1137940646 /nfs/dbraw/zinc/94/06/46/1137940646.db2.gz LFQLNANNOBJTQF-IAGOWNOFSA-N 1 0 334.416 3.766 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(F)c(C[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC000120910887 1137953518 /nfs/dbraw/zinc/95/35/18/1137953518.db2.gz HLIHLVNFQSVONP-CQSZACIVSA-N 1 0 345.418 3.955 20 5 EHBDRO Cc1[nH]c(C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)[nH+]c1C ZINC000884707891 1137969490 /nfs/dbraw/zinc/96/94/90/1137969490.db2.gz CQYCQDSVHJRVCD-UHFFFAOYSA-N 1 0 336.342 3.597 20 5 EHBDRO C[C@H]1SCCN(Cc2cccnc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000886014441 1138032152 /nfs/dbraw/zinc/03/21/52/1138032152.db2.gz HQRKTEWTVFTWIH-CZUORRHYSA-N 1 0 329.425 3.668 20 5 EHBDRO CO[C@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886116917 1138048457 /nfs/dbraw/zinc/04/84/57/1138048457.db2.gz VLEWLHJSIRRXRH-NHYWBVRUSA-N 1 0 335.791 3.509 20 5 EHBDRO Cc1nc(C2CC[NH+]([C@H](C)c3ccccc3[N+](=O)[O-])CC2)[nH]c1C ZINC000886665542 1138111571 /nfs/dbraw/zinc/11/15/71/1138111571.db2.gz AOTVICFYYZIKLV-CQSZACIVSA-N 1 0 328.416 3.875 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000075998851 1138129599 /nfs/dbraw/zinc/12/95/99/1138129599.db2.gz XJQFUVYSWRDGGI-KRWDZBQOSA-N 1 0 330.388 3.657 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000075998850 1138129717 /nfs/dbraw/zinc/12/97/17/1138129717.db2.gz XJQFUVYSWRDGGI-QGZVFWFLSA-N 1 0 330.388 3.657 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000089513289 1138200481 /nfs/dbraw/zinc/20/04/81/1138200481.db2.gz HEJREICNQOFVOL-LBPRGKRZSA-N 1 0 345.355 3.753 20 5 EHBDRO CC[C@H](CSC)[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000091099426 1138215918 /nfs/dbraw/zinc/21/59/18/1138215918.db2.gz INYPQYYTFFJMNE-CQSZACIVSA-N 1 0 349.456 3.866 20 5 EHBDRO COCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000125265569 1138304789 /nfs/dbraw/zinc/30/47/89/1138304789.db2.gz AZKGXGMHJBXANZ-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@H](c1ccc(F)cc1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336973206 1138438555 /nfs/dbraw/zinc/43/85/55/1138438555.db2.gz RRNYTIZUPFYTIA-CYBMUJFWSA-N 1 0 345.374 3.756 20 5 EHBDRO CCN(CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000301643158 1138611781 /nfs/dbraw/zinc/61/17/81/1138611781.db2.gz NJTPRPBDWPOEPA-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO CC[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092482 1138711186 /nfs/dbraw/zinc/71/11/86/1138711186.db2.gz FEKLVSBBTSXTAX-TZMCWYRMSA-N 1 0 337.420 3.549 20 5 EHBDRO COc1cc(C[N@@H+]2CCC(C)=C(c3ccco3)C2)ccc1[N+](=O)[O-] ZINC000338360062 1138854854 /nfs/dbraw/zinc/85/48/54/1138854854.db2.gz WETBWNIDPVCEBI-UHFFFAOYSA-N 1 0 328.368 3.876 20 5 EHBDRO O[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)C1CCOCC1 ZINC000265509143 1138935275 /nfs/dbraw/zinc/93/52/75/1138935275.db2.gz FOSRFWLKBKRIPF-JOCHJYFZSA-N 1 0 335.447 3.870 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152567617 1139098513 /nfs/dbraw/zinc/09/85/13/1139098513.db2.gz DLFSYRJRHSKTGE-JKSUJKDBSA-N 1 0 325.412 3.772 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000177582554 1139627828 /nfs/dbraw/zinc/62/78/28/1139627828.db2.gz SVKHYEUOFASZQW-KBPBESRZSA-N 1 0 342.395 3.743 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCc2ccccn2)cc1[N+](=O)[O-] ZINC000181489965 1139910153 /nfs/dbraw/zinc/91/01/53/1139910153.db2.gz PGMVJHTVVZDCMT-CQSZACIVSA-N 1 0 329.400 3.672 20 5 EHBDRO Cc1ccccc1NC(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181812832 1139932737 /nfs/dbraw/zinc/93/27/37/1139932737.db2.gz NYMYRYHMRAQXAE-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000181814099 1139933550 /nfs/dbraw/zinc/93/35/50/1139933550.db2.gz ZDVJKFSSXJUOQA-LBPRGKRZSA-N 1 0 346.358 3.680 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1)c1nccs1 ZINC000183969239 1140070310 /nfs/dbraw/zinc/07/03/10/1140070310.db2.gz MTEKMBKLVLBYKU-SNVBAGLBSA-N 1 0 325.821 3.940 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000183986419 1140071389 /nfs/dbraw/zinc/07/13/89/1140071389.db2.gz PZYVTLZSIALICJ-GDBMZVCRSA-N 1 0 336.432 3.993 20 5 EHBDRO COCCC(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000185285663 1140143247 /nfs/dbraw/zinc/14/32/47/1140143247.db2.gz CFPSDJCMWSKUIP-UHFFFAOYSA-N 1 0 349.456 3.871 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000190794302 1140418145 /nfs/dbraw/zinc/41/81/45/1140418145.db2.gz VCNIEWSUOBJLCL-AWEZNQCLSA-N 1 0 328.416 3.685 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCO[C@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120645 1140504332 /nfs/dbraw/zinc/50/43/32/1140504332.db2.gz GCZYCLLWXAZZHM-WMZOPIPTSA-N 1 0 348.349 3.801 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193049964 1140562231 /nfs/dbraw/zinc/56/22/31/1140562231.db2.gz SBXFUNHJZHNDEA-GOSISDBHSA-N 1 0 342.443 3.620 20 5 EHBDRO Cc1cc(NCc2ccc(C[NH+]3CCCC3)cc2)ncc1[N+](=O)[O-] ZINC000266846675 1140729252 /nfs/dbraw/zinc/72/92/52/1140729252.db2.gz PCJBENJXTDYFDQ-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2F)cc1[N+](=O)[O-] ZINC000268776817 1140989018 /nfs/dbraw/zinc/98/90/18/1140989018.db2.gz WBSPZSVYHIVADF-DIFFPNOSSA-N 1 0 336.338 3.566 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000268872551 1141015332 /nfs/dbraw/zinc/01/53/32/1141015332.db2.gz GMEOEYBRQKQORE-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO C[C@@H](CCO)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268950009 1141033185 /nfs/dbraw/zinc/03/31/85/1141033185.db2.gz RUWBQRJGTLUGKD-STQMWFEESA-N 1 0 334.441 3.992 20 5 EHBDRO CO[C@@H](C)c1nc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000269125279 1141069225 /nfs/dbraw/zinc/06/92/25/1141069225.db2.gz YINIHRZEEZQEFJ-STQMWFEESA-N 1 0 349.456 3.870 20 5 EHBDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636323 1141130136 /nfs/dbraw/zinc/13/01/36/1141130136.db2.gz AOPCBQVRUAMYFF-DIFFPNOSSA-N 1 0 336.338 3.599 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000269640035 1141131032 /nfs/dbraw/zinc/13/10/32/1141131032.db2.gz BXKFPZSCBVPUQJ-MOPGFXCFSA-N 1 0 344.411 3.624 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cccnc1 ZINC000271154644 1141314787 /nfs/dbraw/zinc/31/47/87/1141314787.db2.gz QYTHUTOFLBFTRS-HNNXBMFYSA-N 1 0 331.441 3.693 20 5 EHBDRO CC(C)(CCCO)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000271444580 1141369035 /nfs/dbraw/zinc/36/90/35/1141369035.db2.gz CXFLHJBNWUJPNU-UHFFFAOYSA-N 1 0 332.400 3.743 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2ccnc(OC)c2)cc1[N+](=O)[O-] ZINC000348677037 1141565886 /nfs/dbraw/zinc/56/58/86/1141565886.db2.gz DXPHLDMAWUZCQV-CHWSQXEVSA-N 1 0 345.399 3.809 20 5 EHBDRO COCc1ccc([C@@H]2CCCN2Cc2ccc([N+](=O)[O-])c(F)c2)o1 ZINC000283170115 1141566399 /nfs/dbraw/zinc/56/63/99/1141566399.db2.gz PMDGEEWCJOCMFC-INIZCTEOSA-N 1 0 334.347 3.810 20 5 EHBDRO Cc1oc2ccccc2c1CN(CC[NH3+])c1ccccc1[N+](=O)[O-] ZINC000348890865 1141604929 /nfs/dbraw/zinc/60/49/29/1141604929.db2.gz FROJWSCSLUMDEB-UHFFFAOYSA-N 1 0 325.368 3.615 20 5 EHBDRO [NH3+]CCN(Cc1ccc(C(F)(F)F)s1)c1ccccc1[N+](=O)[O-] ZINC000348894223 1141605436 /nfs/dbraw/zinc/60/54/36/1141605436.db2.gz NWTRYYANWYENFK-UHFFFAOYSA-N 1 0 345.346 3.640 20 5 EHBDRO COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1cccnc1 ZINC000349005712 1141620897 /nfs/dbraw/zinc/62/08/97/1141620897.db2.gz LAIDCCRBEXSYQB-LFIBNONCSA-N 1 0 341.411 3.542 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(OCc2ccccc2)CC1 ZINC000073106562 216350612 /nfs/dbraw/zinc/35/06/12/216350612.db2.gz VFCQWSNYLMHUBW-UHFFFAOYSA-N 1 0 326.396 3.776 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449061040 1032103821 /nfs/dbraw/zinc/10/38/21/1032103821.db2.gz HISJTNMNDPEJCA-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000430197055 1014830217 /nfs/dbraw/zinc/83/02/17/1014830217.db2.gz TZHMJCWARIIYSC-HNNXBMFYSA-N 1 0 342.395 3.504 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(OCC2CCCC2)CC1 ZINC000430199665 1014845115 /nfs/dbraw/zinc/84/51/15/1014845115.db2.gz DDAQRVMNOCDXLR-UHFFFAOYSA-N 1 0 348.443 3.775 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN1CCSC[C@H]1c1ccccc1 ZINC000430201939 1014886470 /nfs/dbraw/zinc/88/64/70/1014886470.db2.gz BTJQNJKVXDIRMB-KRWDZBQOSA-N 1 0 344.436 3.894 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153737 1016507250 /nfs/dbraw/zinc/50/72/50/1016507250.db2.gz BKZUJMQUUZUVBB-KSSFIOAISA-N 1 0 341.411 3.971 20 5 EHBDRO CC(C)C(C)(C)C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000189471629 1016520717 /nfs/dbraw/zinc/52/07/17/1016520717.db2.gz JZCBNDLRVJHEAZ-UHFFFAOYSA-N 1 0 330.432 3.767 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc([C@H]3CCC[N@@H+]3C3CCCC3)n2)c1 ZINC000275420256 1016733501 /nfs/dbraw/zinc/73/35/01/1016733501.db2.gz HHCPFBBMBUCEME-OAHLLOKOSA-N 1 0 328.372 3.724 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000175716534 1016898883 /nfs/dbraw/zinc/89/88/83/1016898883.db2.gz MRCVOGZYVBWHRL-HNNXBMFYSA-N 1 0 345.443 3.805 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1F ZINC000181374513 1016916080 /nfs/dbraw/zinc/91/60/80/1016916080.db2.gz ISLQNIUDDYARQA-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)O1 ZINC000414512830 1016946775 /nfs/dbraw/zinc/94/67/75/1016946775.db2.gz JCPYWWNMTZYQRM-IPYPFGDCSA-N 1 0 330.384 3.758 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449074463 1032160105 /nfs/dbraw/zinc/16/01/05/1032160105.db2.gz CGHNINNCHZHFIV-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@@H]1CCCO1 ZINC000536829274 1032308844 /nfs/dbraw/zinc/30/88/44/1032308844.db2.gz XFFYDYISCIDNHO-XZKMEQPCSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]C2CCC(OC3CCCC3)CC2)c1 ZINC000449213910 1032319977 /nfs/dbraw/zinc/31/99/77/1032319977.db2.gz XDFQKTLYLRGDAJ-UHFFFAOYSA-N 1 0 332.444 3.997 20 5 EHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622519 1032335063 /nfs/dbraw/zinc/33/50/63/1032335063.db2.gz YKHNGMOLPDLXTB-SJCJKPOMSA-N 1 0 330.388 3.703 20 5 EHBDRO Cn1cc([C@@H]([NH2+]C/C=C\c2ccccc2[N+](=O)[O-])C(C)(C)C)cn1 ZINC000538430307 1032358911 /nfs/dbraw/zinc/35/89/11/1032358911.db2.gz VALJVPTZZLATLY-NBEHIINDSA-N 1 0 328.416 3.719 20 5 EHBDRO COC1CCC([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000459666800 1032394309 /nfs/dbraw/zinc/39/43/09/1032394309.db2.gz ADEGHHHVKOCOLN-UHFFFAOYSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449341602 1032455555 /nfs/dbraw/zinc/45/55/55/1032455555.db2.gz ZRSISXPDCGFXRV-OAHLLOKOSA-N 1 0 327.428 3.797 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc2ccccc2s1 ZINC000449320982 1032453782 /nfs/dbraw/zinc/45/37/82/1032453782.db2.gz QJOYKWHKCBYUAQ-ZDUSSCGKSA-N 1 0 341.436 3.968 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1O ZINC000449346683 1032462023 /nfs/dbraw/zinc/46/20/23/1032462023.db2.gz BZCAOJTXJWPLBI-KGLIPLIRSA-N 1 0 344.411 3.981 20 5 EHBDRO C[C@@H](O)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000278763745 1032472605 /nfs/dbraw/zinc/47/26/05/1032472605.db2.gz XMLJWFNQEKIRKG-LLVKDONJSA-N 1 0 338.791 3.759 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](c1ccccc1)C(C)C ZINC000008002822 1017318021 /nfs/dbraw/zinc/31/80/21/1017318021.db2.gz HXKAKZIYJYBJCK-GOSISDBHSA-N 1 0 341.411 3.829 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000449453420 1032569782 /nfs/dbraw/zinc/56/97/82/1032569782.db2.gz MVZABNRCWVNIBJ-WZYPUGOLSA-N 1 0 330.428 3.624 20 5 EHBDRO COCc1nc(CN2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501945 1032677670 /nfs/dbraw/zinc/67/76/70/1032677670.db2.gz QNPANMIQKOLNCY-CQSZACIVSA-N 1 0 347.440 3.577 20 5 EHBDRO C[NH2+]C[C@@H]1CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414662067 1017112105 /nfs/dbraw/zinc/11/21/05/1017112105.db2.gz PUPSBKMJTJXKCM-ZDUSSCGKSA-N 1 0 349.818 3.692 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)N[C@H](CCC[NH3+])c1ccccc1 ZINC000414667949 1017117262 /nfs/dbraw/zinc/11/72/62/1017117262.db2.gz YEFOXUNLDUGHIO-MRXNPFEDSA-N 1 0 342.399 3.505 20 5 EHBDRO COCc1ccc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)o1 ZINC000449502976 1032684107 /nfs/dbraw/zinc/68/41/07/1032684107.db2.gz SKXOIUCLSDJHTH-OAHLLOKOSA-N 1 0 330.384 3.714 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449503710 1032686745 /nfs/dbraw/zinc/68/67/45/1032686745.db2.gz POYAAWOOLDDRTH-SUMWQHHRSA-N 1 0 330.384 3.712 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892730068 1017240454 /nfs/dbraw/zinc/24/04/54/1017240454.db2.gz DLCPEHQSPLDYCW-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO C[C@H]1C[C@@H](NCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[NH2+]1 ZINC000414944941 1017345014 /nfs/dbraw/zinc/34/50/14/1017345014.db2.gz HRKYYBAYAJVPBA-RYUDHWBXSA-N 1 0 349.818 3.738 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000177359870 1017643210 /nfs/dbraw/zinc/64/32/10/1017643210.db2.gz RRUBYOYMKNNUEY-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)N(CCC[NH3+])CC1CCCC1 ZINC000415302998 1017849699 /nfs/dbraw/zinc/84/96/99/1017849699.db2.gz ULWUSWAESHJZEK-UHFFFAOYSA-N 1 0 348.447 3.585 20 5 EHBDRO CC(C)c1ccc([C@H]([NH3+])CNC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000415492447 1018102328 /nfs/dbraw/zinc/10/23/28/1018102328.db2.gz CADBYWPEMBINAC-QGZVFWFLSA-N 1 0 342.399 3.540 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000592404877 1032776789 /nfs/dbraw/zinc/77/67/89/1032776789.db2.gz YNVOLFMRSDTOPY-AEGPPILISA-N 1 0 334.416 3.756 20 5 EHBDRO CC[C@H]([NH2+][C@H](CCO)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000592402540 1032797374 /nfs/dbraw/zinc/79/73/74/1032797374.db2.gz IRKFUDHFAMXJIB-ZWKOTPCHSA-N 1 0 332.375 3.898 20 5 EHBDRO C[C@@H]1C[C@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637261 1019011263 /nfs/dbraw/zinc/01/12/63/1019011263.db2.gz SHBRLPZFBRZXLD-VQIMIIECSA-N 1 0 339.439 3.738 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@H]1C ZINC000419379863 1019012221 /nfs/dbraw/zinc/01/22/21/1019012221.db2.gz XEZWWNMHLYQYCG-RDBSUJKOSA-N 1 0 329.400 3.769 20 5 EHBDRO C[C@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610422093 1019030377 /nfs/dbraw/zinc/03/03/77/1019030377.db2.gz YRUHTUPVMLEHFU-HNAYVOBHSA-N 1 0 336.395 3.883 20 5 EHBDRO CC(C)c1ccc(CN2CCC[C@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425502 1032812624 /nfs/dbraw/zinc/81/26/24/1032812624.db2.gz HBDGRRYFCBHDGL-FUHWJXTLSA-N 1 0 331.460 3.682 20 5 EHBDRO COc1cccc(C[C@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000513363800 1019572462 /nfs/dbraw/zinc/57/24/62/1019572462.db2.gz DYHUKQARIINVAA-IBGZPJMESA-N 1 0 340.423 3.757 20 5 EHBDRO Cc1ccc2c(c1)CC[C@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000548829449 1032866722 /nfs/dbraw/zinc/86/67/22/1032866722.db2.gz JWYUDTRMQPOQPQ-MRXNPFEDSA-N 1 0 339.395 3.509 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nccnc2c1 ZINC000602438603 1032889667 /nfs/dbraw/zinc/88/96/67/1032889667.db2.gz GIAJZBMHPDHUOC-UHFFFAOYSA-N 1 0 336.395 3.949 20 5 EHBDRO C[C@@H](N[C@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186686 1020542332 /nfs/dbraw/zinc/54/23/32/1020542332.db2.gz BPFDIQXJBPXMOY-BFYDXBDKSA-N 1 0 331.460 3.898 20 5 EHBDRO C[C@H](CCc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602504461 1032938057 /nfs/dbraw/zinc/93/80/57/1032938057.db2.gz QMZHDYZZYFHZFX-CYBMUJFWSA-N 1 0 325.368 3.847 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+](CCC(F)(F)F)CC2CC2)c1 ZINC000084137793 1021005919 /nfs/dbraw/zinc/00/59/19/1021005919.db2.gz KDVQNXBEHYIRIR-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO CCOc1ccccc1[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537966560 1021026385 /nfs/dbraw/zinc/02/63/85/1021026385.db2.gz ROOGKMMOOOFYCS-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000581562245 1021091542 /nfs/dbraw/zinc/09/15/42/1021091542.db2.gz DYRWXNATBCUCIS-RYGJVYDSSA-N 1 0 339.439 3.999 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](CO)CC3)s2)cc1 ZINC000581599302 1021132530 /nfs/dbraw/zinc/13/25/30/1021132530.db2.gz ZUTQKCNKURPPEE-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO CC(C)(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549541 1032959903 /nfs/dbraw/zinc/95/99/03/1032959903.db2.gz DKFQMDQCTKHNJU-SJCJKPOMSA-N 1 0 347.415 3.667 20 5 EHBDRO CO[C@H]([C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633669 1032965156 /nfs/dbraw/zinc/96/51/56/1032965156.db2.gz UQPIZIORFVPSQV-KZULUSFZSA-N 1 0 330.384 3.758 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1ccncc1 ZINC000602561174 1032972492 /nfs/dbraw/zinc/97/24/92/1032972492.db2.gz DJICJUUYNGPHAP-NSHDSACASA-N 1 0 339.317 3.902 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000337321995 1021375426 /nfs/dbraw/zinc/37/54/26/1021375426.db2.gz ZRBRWGUDXPGIQE-FUHWJXTLSA-N 1 0 325.412 3.848 20 5 EHBDRO CC[N@H+](CCC1CC1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000546230112 1021379295 /nfs/dbraw/zinc/37/92/95/1021379295.db2.gz SSKWKZUPDRIBKM-LLVKDONJSA-N 1 0 339.823 3.697 20 5 EHBDRO CC[C@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602550980 1032986797 /nfs/dbraw/zinc/98/67/97/1032986797.db2.gz GMZAWBPYODDWMK-HOCLYGCPSA-N 1 0 332.448 3.517 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909882 1021689468 /nfs/dbraw/zinc/68/94/68/1021689468.db2.gz SFENHCSGPJICOC-GJZGRUSLSA-N 1 0 328.412 3.928 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)N(C)Cc1cccc(Cl)c1 ZINC000016632095 1033031172 /nfs/dbraw/zinc/03/11/72/1033031172.db2.gz RFTYQXBHGGCFGC-LBPRGKRZSA-N 1 0 347.802 3.707 20 5 EHBDRO C[C@H]1CCCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000187517788 1022277631 /nfs/dbraw/zinc/27/76/31/1022277631.db2.gz ILFORVQHCLXOQP-AWEZNQCLSA-N 1 0 328.416 3.617 20 5 EHBDRO CCSCCC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602650677 1033040139 /nfs/dbraw/zinc/04/01/39/1033040139.db2.gz GDRFMDHNAMZLRB-UHFFFAOYSA-N 1 0 339.280 3.652 20 5 EHBDRO CC1CC[NH+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)CC1 ZINC000341555910 1022308408 /nfs/dbraw/zinc/30/84/08/1022308408.db2.gz ZAFXFUOMEZWIPV-UHFFFAOYSA-N 1 0 349.460 3.524 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CCO2 ZINC000341562559 1022343890 /nfs/dbraw/zinc/34/38/90/1022343890.db2.gz JFBNDHPBQCUNET-MRXNPFEDSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@@H](CCCC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602634744 1033047466 /nfs/dbraw/zinc/04/74/66/1033047466.db2.gz PDRSSHWEOVTTFR-VIFPVBQESA-N 1 0 331.294 3.947 20 5 EHBDRO CC[C@H]1CC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602671635 1033049075 /nfs/dbraw/zinc/04/90/75/1033049075.db2.gz WBAPSMYSPRUISB-SHTZXODSSA-N 1 0 332.448 3.517 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468225 1033054385 /nfs/dbraw/zinc/05/43/85/1033054385.db2.gz UUHSYJINJVXCEZ-WCQYABFASA-N 1 0 339.823 3.697 20 5 EHBDRO COC1(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000602675013 1033051685 /nfs/dbraw/zinc/05/16/85/1033051685.db2.gz IELXMEAGWDZUFZ-UHFFFAOYSA-N 1 0 332.322 3.662 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccccc1[N+](=O)[O-] ZINC000303804917 1022511485 /nfs/dbraw/zinc/51/14/85/1022511485.db2.gz HKEQZMYNLDXXGI-MRXNPFEDSA-N 1 0 325.412 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@H+](C[C@H]2CCCO2)C2CCCC2)cc1 ZINC000441433476 1022587336 /nfs/dbraw/zinc/58/73/36/1022587336.db2.gz GPAOPVDDPSRWHO-LJQANCHMSA-N 1 0 348.443 3.787 20 5 EHBDRO CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@H](C)c1cccnc1 ZINC000602668896 1033067664 /nfs/dbraw/zinc/06/76/64/1033067664.db2.gz VHLGIAWDNMKPOQ-GFCCVEGCSA-N 1 0 326.356 3.714 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(OCC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000480461844 1033070374 /nfs/dbraw/zinc/07/03/74/1033070374.db2.gz BBSYTMGPDGZGHM-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1)CC(F)F ZINC000602700899 1033090312 /nfs/dbraw/zinc/09/03/12/1033090312.db2.gz OXUKBENUKJSELW-ZCFIWIBFSA-N 1 0 343.193 3.800 20 5 EHBDRO CN(C)[C@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccccc1 ZINC000060774003 1022913342 /nfs/dbraw/zinc/91/33/42/1022913342.db2.gz AEIJURWKNADNGA-QGZVFWFLSA-N 1 0 333.819 3.641 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCO[C@H]1CCCC[C@@H]1C ZINC000509585640 1023092796 /nfs/dbraw/zinc/09/27/96/1023092796.db2.gz KLDMDWKBFHKNNP-YOEHRIQHSA-N 1 0 336.432 3.678 20 5 EHBDRO O=C(C[C@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002494 1023098172 /nfs/dbraw/zinc/09/81/72/1023098172.db2.gz ZFKSRTKKPUJPJE-MRXNPFEDSA-N 1 0 344.436 3.936 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310201109 1023103882 /nfs/dbraw/zinc/10/38/82/1023103882.db2.gz SIMCCXTVQDBFQW-CYBMUJFWSA-N 1 0 333.338 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(Cc3ccccc3)CCOCC2)c(F)c1 ZINC000449722961 1033108616 /nfs/dbraw/zinc/10/86/16/1033108616.db2.gz WJGNGGSNMSXJFG-UHFFFAOYSA-N 1 0 344.386 3.615 20 5 EHBDRO CC1(C)CC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC(C)(C)[NH2+]1 ZINC000484971353 1023240421 /nfs/dbraw/zinc/24/04/21/1023240421.db2.gz TUNOFSBPDMJDPT-UHFFFAOYSA-N 1 0 328.416 3.864 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](O)C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729738 1033117346 /nfs/dbraw/zinc/11/73/46/1033117346.db2.gz CAHQMEWWSUYBLG-MJGOQNOKSA-N 1 0 326.396 3.601 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@@H](CCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276872536 1023270982 /nfs/dbraw/zinc/27/09/82/1023270982.db2.gz HRCDZQIRSLRSLG-KRWDZBQOSA-N 1 0 344.411 3.549 20 5 EHBDRO Cc1oc2ccccc2c1C[NH2+][C@@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602731501 1033120801 /nfs/dbraw/zinc/12/08/01/1033120801.db2.gz KYIIVWWXPNDUIR-IBGZPJMESA-N 1 0 340.379 3.647 20 5 EHBDRO CCOc1cc(CN(C)Cc2nc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000276913121 1023343985 /nfs/dbraw/zinc/34/39/85/1023343985.db2.gz NRPNTXHEJRJKBU-UHFFFAOYSA-N 1 0 341.367 3.767 20 5 EHBDRO CCOc1cc(C[N@H+](C)C[C@H](C)c2nccs2)ccc1[N+](=O)[O-] ZINC000276938792 1023426488 /nfs/dbraw/zinc/42/64/88/1023426488.db2.gz RXPZCEVYVUWWIA-LBPRGKRZSA-N 1 0 335.429 3.686 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000510967795 1023540908 /nfs/dbraw/zinc/54/09/08/1023540908.db2.gz MAQYVKWTHCGQCF-CQSZACIVSA-N 1 0 348.443 3.957 20 5 EHBDRO C[C@@](O)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000588467871 1023561699 /nfs/dbraw/zinc/56/16/99/1023561699.db2.gz DRMSEMSATKPWHM-LZCIBIBXSA-N 1 0 346.814 3.759 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN2Cc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000610805599 1023685513 /nfs/dbraw/zinc/68/55/13/1023685513.db2.gz UOIVNHWUFYCZRC-OAHLLOKOSA-N 1 0 325.412 3.570 20 5 EHBDRO C[C@H]([NH2+]CCN1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000610805533 1023693716 /nfs/dbraw/zinc/69/37/16/1023693716.db2.gz UBQKXSDIRIFKBS-HNNXBMFYSA-N 1 0 325.412 3.698 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](Cc1ccc(F)cc1)C1CCOCC1 ZINC000277100781 1023763148 /nfs/dbraw/zinc/76/31/48/1023763148.db2.gz VELJVULTMBXKHZ-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000610831082 1023781479 /nfs/dbraw/zinc/78/14/79/1023781479.db2.gz WYWCGVFOHRYAFX-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cc(NC(=O)c2c(C)cccc2[N+](=O)[O-])ccc1C[NH+](C)C ZINC000458271104 1023843387 /nfs/dbraw/zinc/84/33/87/1023843387.db2.gz UKCZJKJEDKMCNV-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(-c3ncc[nH]3)ccc2C)c1 ZINC000477982570 1023848453 /nfs/dbraw/zinc/84/84/53/1023848453.db2.gz ABQSLJDNLYJDBL-UHFFFAOYSA-N 1 0 336.351 3.854 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000164539460 1023959966 /nfs/dbraw/zinc/95/99/66/1023959966.db2.gz JFAQQBAMECGJNX-HIFRSBDPSA-N 1 0 342.395 3.566 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000164539195 1023960378 /nfs/dbraw/zinc/96/03/78/1023960378.db2.gz JFAQQBAMECGJNX-UKRRQHHQSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)cc1 ZINC000449764585 1033177503 /nfs/dbraw/zinc/17/75/03/1033177503.db2.gz CGPHVRUUAKDWPI-MRXNPFEDSA-N 1 0 332.425 3.650 20 5 EHBDRO CO[C@@H](C[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1)c1ccc(Cl)cc1 ZINC000514078274 1024108579 /nfs/dbraw/zinc/10/85/79/1024108579.db2.gz IRMHRCOOWJIESN-SFHVURJKSA-N 1 0 346.814 3.994 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1cccs1 ZINC000075469830 1024199440 /nfs/dbraw/zinc/19/94/40/1024199440.db2.gz MFMPLLPGXQCCOR-HNNXBMFYSA-N 1 0 342.424 3.919 20 5 EHBDRO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1OC ZINC000611252208 1024322247 /nfs/dbraw/zinc/32/22/47/1024322247.db2.gz OLPXBTQRGJNIDE-SOFGYWHQSA-N 1 0 342.395 3.757 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000430112703 1024381477 /nfs/dbraw/zinc/38/14/77/1024381477.db2.gz DZMVXDRVKUWYJT-PMAWGNDNSA-N 1 0 343.471 3.660 20 5 EHBDRO O=[N+]([O-])c1cc2c(ncnc2NCCCCC[NH+]2CCCCC2)s1 ZINC000342218271 1024441948 /nfs/dbraw/zinc/44/19/48/1024441948.db2.gz HDBUELABUWCWBO-UHFFFAOYSA-N 1 0 349.460 3.668 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)c2cc(Cl)cc([N+](=O)[O-])c2)cc1 ZINC000346136269 1024464796 /nfs/dbraw/zinc/46/47/96/1024464796.db2.gz HBNTXDRLYAAOGR-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO COCC[N@H+](C)CC[C@@H](Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000505585141 1024548533 /nfs/dbraw/zinc/54/85/33/1024548533.db2.gz LJTSTDVQPSBZJL-LJQANCHMSA-N 1 0 343.427 3.716 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000342267986 1024631248 /nfs/dbraw/zinc/63/12/48/1024631248.db2.gz PTTAFEOXPBYDDC-GOSISDBHSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)cc2)c1C ZINC000895607338 1024653089 /nfs/dbraw/zinc/65/30/89/1024653089.db2.gz MTWRPQMYVGVMSP-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368574 1024882056 /nfs/dbraw/zinc/88/20/56/1024882056.db2.gz FDTPUMWNZKDBSX-SFHVURJKSA-N 1 0 330.428 3.684 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])C1 ZINC000071954823 1024884746 /nfs/dbraw/zinc/88/47/46/1024884746.db2.gz LAUVKELLUGVSFX-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO Nc1c(F)c(NC[C@@H]2CCC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435591228 1025022622 /nfs/dbraw/zinc/02/26/22/1025022622.db2.gz DABCVGSRMJOLCH-ZDUSSCGKSA-N 1 0 336.411 3.525 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039194 1025073437 /nfs/dbraw/zinc/07/34/37/1025073437.db2.gz CNZJESPUWZGWOK-HOCLYGCPSA-N 1 0 347.459 3.693 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCn2c(C)ncc2[N+](=O)[O-])C(C)C)cc1 ZINC000611573619 1025184421 /nfs/dbraw/zinc/18/44/21/1025184421.db2.gz KPSSLPHZQDPRMJ-GOSISDBHSA-N 1 0 330.432 3.649 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174814 1025248074 /nfs/dbraw/zinc/24/80/74/1025248074.db2.gz MXGLGVITLYKVHV-MRXNPFEDSA-N 1 0 333.476 3.893 20 5 EHBDRO CSC1CCC(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000896256772 1025287846 /nfs/dbraw/zinc/28/78/46/1025287846.db2.gz ZKOZVFIEEHFKLV-UHFFFAOYSA-N 1 0 335.429 3.747 20 5 EHBDRO CCC1([NH+](C)C)CCN(C(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000602951649 1033275777 /nfs/dbraw/zinc/27/57/77/1033275777.db2.gz XIMMKSOBSAIKGP-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000602950212 1033276864 /nfs/dbraw/zinc/27/68/64/1033276864.db2.gz LPCQFROYTVTRBN-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000896510121 1025491856 /nfs/dbraw/zinc/49/18/56/1025491856.db2.gz LCOLIIUWMBLGGM-UAGWRWDDSA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077298 1025497473 /nfs/dbraw/zinc/49/74/73/1025497473.db2.gz VKAZDDPBVQESRX-CXAGYDPISA-N 1 0 329.400 3.557 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000602966902 1033289801 /nfs/dbraw/zinc/28/98/01/1033289801.db2.gz VCDYNZNXDGYMNW-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)NCc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000442998374 1025639345 /nfs/dbraw/zinc/63/93/45/1025639345.db2.gz IZQFPNYHRGZZBV-AUUYWEPGSA-N 1 0 345.418 3.823 20 5 EHBDRO CN1C[C@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000436413281 1025692818 /nfs/dbraw/zinc/69/28/18/1025692818.db2.gz NPGYEZUDWMFCEY-HWYHOQROSA-N 1 0 337.423 3.506 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425557012 1025725337 /nfs/dbraw/zinc/72/53/37/1025725337.db2.gz VNOWHFQQZBIYKM-KDOFPFPSSA-N 1 0 330.428 3.937 20 5 EHBDRO [NH3+]CC[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000281950011 1025768875 /nfs/dbraw/zinc/76/88/75/1025768875.db2.gz LYTNMUKMQCPZSP-OAHLLOKOSA-N 1 0 333.435 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@H](COc3ccccc3)C2)c(F)c1 ZINC000505838244 1025806261 /nfs/dbraw/zinc/80/62/61/1025806261.db2.gz HOOFGXBYCIZNGD-AWEZNQCLSA-N 1 0 330.359 3.635 20 5 EHBDRO C/C=C/C[C@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000185825337 1025965715 /nfs/dbraw/zinc/96/57/15/1025965715.db2.gz VOELQGUETPTUJC-YWVDXFKGSA-N 1 0 332.425 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCO[C@@H]3CCCCO3)C2)cc1 ZINC000451550476 1026102523 /nfs/dbraw/zinc/10/25/23/1026102523.db2.gz RWDMXBSULQQXDV-IEBWSBKVSA-N 1 0 348.443 3.708 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840775539 1026148132 /nfs/dbraw/zinc/14/81/32/1026148132.db2.gz QGPSJWAUCZXWGE-KGLIPLIRSA-N 1 0 328.416 3.634 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])nc1 ZINC000339029422 1026355324 /nfs/dbraw/zinc/35/53/24/1026355324.db2.gz LDKPVVDMGKQMNK-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO COc1ccccc1OC[C@H](C)C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000478911445 1026366013 /nfs/dbraw/zinc/36/60/13/1026366013.db2.gz VPELEXMBERMGJM-HUUCEWRRSA-N 1 0 344.411 3.969 20 5 EHBDRO COC1CCC(C)(C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000475221082 1026400286 /nfs/dbraw/zinc/40/02/86/1026400286.db2.gz SVGGNNFZBQXKJE-UHFFFAOYSA-N 1 0 326.824 3.933 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000158414756 1026449926 /nfs/dbraw/zinc/44/99/26/1026449926.db2.gz BSTQTWPMVMMZKH-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000452096759 1026475186 /nfs/dbraw/zinc/47/51/86/1026475186.db2.gz XMIYLXIBGQRBKS-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C(C)C)C1CC(C)(C)C1 ZINC000452102636 1026496994 /nfs/dbraw/zinc/49/69/94/1026496994.db2.gz IORCYVBQAORZIL-UHFFFAOYSA-N 1 0 333.432 3.741 20 5 EHBDRO COc1cc([C@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c(F)cn1 ZINC000562077629 1026519797 /nfs/dbraw/zinc/51/97/97/1026519797.db2.gz HDJIBYGPKRLCGP-ZDUSSCGKSA-N 1 0 347.390 3.811 20 5 EHBDRO CC[N@H+](Cc1csc([N+](=O)[O-])c1)[C@H](COC)Cc1ccccc1 ZINC000531105060 1026572237 /nfs/dbraw/zinc/57/22/37/1026572237.db2.gz KUZVLGIOOKZOHT-INIZCTEOSA-N 1 0 334.441 3.736 20 5 EHBDRO COc1cc(C[NH2+]Cc2cccc(C(C)C)c2)c([N+](=O)[O-])cc1O ZINC000479405271 1026622513 /nfs/dbraw/zinc/62/25/13/1026622513.db2.gz GLDNLCITZUKYES-UHFFFAOYSA-N 1 0 330.384 3.722 20 5 EHBDRO Cn1cnc2cc(C[N@H+](Cc3cccc([N+](=O)[O-])c3)C3CC3)ccc21 ZINC000342679942 1026687535 /nfs/dbraw/zinc/68/75/35/1026687535.db2.gz HCRMBFVUZRSTSJ-UHFFFAOYSA-N 1 0 336.395 3.646 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccc(C)cc1 ZINC000340152022 1026873894 /nfs/dbraw/zinc/87/38/94/1026873894.db2.gz IXEATXZKRJCMPF-KBXCAEBGSA-N 1 0 341.411 3.971 20 5 EHBDRO CCC(C)(C)[N@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000548755529 1027015718 /nfs/dbraw/zinc/01/57/18/1027015718.db2.gz JQFSPDBZNQVCCP-UHFFFAOYSA-N 1 0 332.347 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C3CCCC3)CC2)c2cccnc21 ZINC000413151966 1027135730 /nfs/dbraw/zinc/13/57/30/1027135730.db2.gz HABJKBDFTLEBGS-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1c(NC(=O)NCCC[N@@H+](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000501584187 1027372309 /nfs/dbraw/zinc/37/23/09/1027372309.db2.gz XIWZXYZQZXJZRS-UHFFFAOYSA-N 1 0 348.447 3.679 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2nn(C)c3ccccc23)cc1[N+](=O)[O-] ZINC000186484643 1027376141 /nfs/dbraw/zinc/37/61/41/1027376141.db2.gz HCADGZHGBUQJAD-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO COc1cc(C[NH+]2CCCCCC2)c([N+](=O)[O-])cc1OCC(F)F ZINC000183295600 1027415523 /nfs/dbraw/zinc/41/55/23/1027415523.db2.gz XJURYVUZJUDCJL-UHFFFAOYSA-N 1 0 344.358 3.623 20 5 EHBDRO COCCC1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCC1 ZINC000475497740 1027421228 /nfs/dbraw/zinc/42/12/28/1027421228.db2.gz RKTPXDMMMYJBOQ-UHFFFAOYSA-N 1 0 347.440 3.767 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H](CO)CC3CCC3)s2)cc1 ZINC000475499955 1027478191 /nfs/dbraw/zinc/47/81/91/1027478191.db2.gz BSZFCSGOYWRTMB-HNNXBMFYSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1cccc([N+](=O)[O-])c1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000582756045 1027588472 /nfs/dbraw/zinc/58/84/72/1027588472.db2.gz PPAKVLCOQBJQTG-HNNXBMFYSA-N 1 0 345.399 3.836 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2cc(F)cc([N+](=O)[O-])c2n1 ZINC001167624716 1027915699 /nfs/dbraw/zinc/91/56/99/1027915699.db2.gz LWBIMBAMSODSFV-UHFFFAOYSA-N 1 0 346.406 3.767 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000237817257 1028069022 /nfs/dbraw/zinc/06/90/22/1028069022.db2.gz BLRKRXONHJRBAI-IBGZPJMESA-N 1 0 339.439 3.657 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@H]1CCCC[C@@H]1C ZINC000444676938 1028145468 /nfs/dbraw/zinc/14/54/68/1028145468.db2.gz OUDUGSSSDXMYDO-GUYCJALGSA-N 1 0 334.416 3.862 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1(CC)CC ZINC000444691012 1028163436 /nfs/dbraw/zinc/16/34/36/1028163436.db2.gz WRENWHMBJIWOAU-CVEARBPZSA-N 1 0 346.431 3.545 20 5 EHBDRO COC[C@@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000467118634 1028223872 /nfs/dbraw/zinc/22/38/72/1028223872.db2.gz PCYQZFXXZNOEFF-OAHLLOKOSA-N 1 0 336.432 3.631 20 5 EHBDRO CCC[C@@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764444 1028251261 /nfs/dbraw/zinc/25/12/61/1028251261.db2.gz BESVWZLVJPCVKH-SFHVURJKSA-N 1 0 336.432 3.509 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCOC1 ZINC000503953256 1028261112 /nfs/dbraw/zinc/26/11/12/1028261112.db2.gz RSRHIROHDRJAEM-KBPBESRZSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCCOC1 ZINC000503953257 1028262226 /nfs/dbraw/zinc/26/22/26/1028262226.db2.gz RSRHIROHDRJAEM-KGLIPLIRSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](C3CC3)CC2)cc1C(F)(F)F ZINC000444875408 1028364659 /nfs/dbraw/zinc/36/46/59/1028364659.db2.gz OEKMBHCCMWCLTG-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391339 1028367057 /nfs/dbraw/zinc/36/70/57/1028367057.db2.gz UAFNQWCTPWXDCW-XJKSGUPXSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@@]1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338930 1028372422 /nfs/dbraw/zinc/37/24/22/1028372422.db2.gz LFFWKPYINQUKJN-VQTJNVASSA-N 1 0 339.439 3.664 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000421394502 1028373591 /nfs/dbraw/zinc/37/35/91/1028373591.db2.gz XOQZVQDHXKYQLX-KBPBESRZSA-N 1 0 330.384 3.902 20 5 EHBDRO CCc1nc2c(s1)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000178729535 1028376574 /nfs/dbraw/zinc/37/65/74/1028376574.db2.gz HWOHEPQHQVERLZ-ZDUSSCGKSA-N 1 0 347.440 3.790 20 5 EHBDRO C[C@H]1CN(CC[NH2+]Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000729682826 1028447379 /nfs/dbraw/zinc/44/73/79/1028447379.db2.gz AYZRSMBRBMSEKA-KRWDZBQOSA-N 1 0 334.463 3.803 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000613179308 1028578146 /nfs/dbraw/zinc/57/81/46/1028578146.db2.gz SLKYQLLHTDNKSB-WBVHZDCISA-N 1 0 325.412 3.924 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000514761227 1028676762 /nfs/dbraw/zinc/67/67/62/1028676762.db2.gz IPJIXDIDVYTIPM-QSFXBCCZSA-N 1 0 340.423 3.720 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000454332713 1028785701 /nfs/dbraw/zinc/78/57/01/1028785701.db2.gz VVDJRFLVSQLUFR-KRWDZBQOSA-N 1 0 340.383 3.788 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@H+](C)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000532755659 1028798976 /nfs/dbraw/zinc/79/89/76/1028798976.db2.gz IWKMMVPETHRMAP-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO [NH3+][C@@H]1CCCC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000424374573 1029033871 /nfs/dbraw/zinc/03/38/71/1029033871.db2.gz ZKNPIVHBMVXREH-HUUCEWRRSA-N 1 0 331.441 3.683 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@](C)(O)[C@@H](C)CC ZINC000504911792 1029052966 /nfs/dbraw/zinc/05/29/66/1029052966.db2.gz LJLHYGMALQYNQY-VBQJREDUSA-N 1 0 340.489 3.852 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCOc1ccc(C(F)(F)F)cc1 ZINC000237844940 1029458360 /nfs/dbraw/zinc/45/83/60/1029458360.db2.gz DAZJOIRQPLVCSK-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO CN(C(=O)C[N@H+](CC1CC1)C1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000533276130 1029556336 /nfs/dbraw/zinc/55/63/36/1029556336.db2.gz MIOKWMBJUILOBS-UHFFFAOYSA-N 1 0 345.443 3.602 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288260 1029580600 /nfs/dbraw/zinc/58/06/00/1029580600.db2.gz WUFPQVPSYZPABD-JSGCOSHPSA-N 1 0 333.432 3.741 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)CCC[C@H]1C ZINC000533293610 1029587278 /nfs/dbraw/zinc/58/72/78/1029587278.db2.gz WASKHZUVYVWYTL-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(Nc3ccc(F)cc3)CC2)c1 ZINC000237853469 1029668869 /nfs/dbraw/zinc/66/88/69/1029668869.db2.gz TXGHTJGHGBAOMK-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000525121299 1029693073 /nfs/dbraw/zinc/69/30/73/1029693073.db2.gz FYBMBCMPMYTQHM-KRWDZBQOSA-N 1 0 326.396 3.538 20 5 EHBDRO CC(C)(C)[C@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000446831794 1029814875 /nfs/dbraw/zinc/81/48/75/1029814875.db2.gz IWZUIOPVJXUAGQ-INIZCTEOSA-N 1 0 334.441 3.820 20 5 EHBDRO CCO[C@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000446849533 1029818506 /nfs/dbraw/zinc/81/85/06/1029818506.db2.gz OEYPGYFRTITIQA-KEEQEYLASA-N 1 0 326.396 3.975 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCCC[C@H]1O ZINC000428456271 1029834315 /nfs/dbraw/zinc/83/43/15/1029834315.db2.gz IAHXXBYFHWJHKE-IAGOWNOFSA-N 1 0 330.384 3.590 20 5 EHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525410914 1029840443 /nfs/dbraw/zinc/84/04/43/1029840443.db2.gz PNTGINFIEMKSLV-KBAYOESNSA-N 1 0 348.443 3.629 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2CCCCC2(F)F)n1 ZINC000453241033 1029917618 /nfs/dbraw/zinc/91/76/18/1029917618.db2.gz CXVBGLDDQSXXIU-MELADBBJSA-N 1 0 342.390 3.690 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367733 1030183017 /nfs/dbraw/zinc/18/30/17/1030183017.db2.gz MKRZPQMBHNLCGY-ILZDJORESA-N 1 0 344.455 3.809 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cn1 ZINC000453392290 1030237869 /nfs/dbraw/zinc/23/78/69/1030237869.db2.gz YUHSVTUYBAVBNW-RLFYNMQTSA-N 1 0 342.443 3.873 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cn1 ZINC000453392287 1030239189 /nfs/dbraw/zinc/23/91/89/1030239189.db2.gz YUHSVTUYBAVBNW-DAYGRLMNSA-N 1 0 342.443 3.873 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447527166 1030250443 /nfs/dbraw/zinc/25/04/43/1030250443.db2.gz FLKSNHDFEDFNOS-DLBZAZTESA-N 1 0 342.443 3.842 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCSc2ccccc2)n1 ZINC000447514729 1030259493 /nfs/dbraw/zinc/25/94/93/1030259493.db2.gz HICCRBXSLAXGHK-HZPDHXFCSA-N 1 0 346.456 3.657 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000447535827 1030270842 /nfs/dbraw/zinc/27/08/42/1030270842.db2.gz IRTNWQOHTKQGDF-CVEARBPZSA-N 1 0 332.379 3.512 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)s2)n1 ZINC000447544705 1030278000 /nfs/dbraw/zinc/27/80/00/1030278000.db2.gz OXMQKYGMPLEIJT-NWDGAFQWSA-N 1 0 340.836 3.780 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000447546694 1030280074 /nfs/dbraw/zinc/28/00/74/1030280074.db2.gz YBEXPMUXMSEHIK-FGTMMUONSA-N 1 0 330.428 3.910 20 5 EHBDRO Cc1cccc(C)c1CC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447587233 1030324359 /nfs/dbraw/zinc/32/43/59/1030324359.db2.gz QNJSDEWREJIVPC-ROUUACIJSA-N 1 0 342.443 3.724 20 5 EHBDRO Cc1c(C[NH2+]CCCc2ccc3c(c2)CCO3)cccc1[N+](=O)[O-] ZINC000482443664 1030422296 /nfs/dbraw/zinc/42/22/96/1030422296.db2.gz ZCZSIYNSPSUXGJ-UHFFFAOYSA-N 1 0 326.396 3.561 20 5 EHBDRO C[C@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000161831748 1030489130 /nfs/dbraw/zinc/48/91/30/1030489130.db2.gz FVSCFGWOOWITQI-LRDDRELGSA-N 1 0 349.431 3.549 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2coc3ccccc23)n1 ZINC000340450685 1030492265 /nfs/dbraw/zinc/49/22/65/1030492265.db2.gz NUGGMMZBDIFHMI-JKSUJKDBSA-N 1 0 340.383 3.811 20 5 EHBDRO CCn1nc(C)c(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c1C ZINC000527038642 1030587123 /nfs/dbraw/zinc/58/71/23/1030587123.db2.gz RBOYTODWGFNRQX-UKTHLTGXSA-N 1 0 328.416 3.621 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)c1 ZINC000160190801 1030587506 /nfs/dbraw/zinc/58/75/06/1030587506.db2.gz YOEPJQQGDAYZKM-SFHVURJKSA-N 1 0 341.411 3.585 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]C1CCC2(CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000278403406 1030645336 /nfs/dbraw/zinc/64/53/36/1030645336.db2.gz OPFPLBUMEIVLQX-KRWDZBQOSA-N 1 0 340.427 3.730 20 5 EHBDRO Cc1cc(N[C@H]2CCO[C@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000160340382 1030684132 /nfs/dbraw/zinc/68/41/32/1030684132.db2.gz KLPAUVBDFSNNEM-UGSOOPFHSA-N 1 0 327.384 3.821 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000249197424 1030797092 /nfs/dbraw/zinc/79/70/92/1030797092.db2.gz RPMZEGXHOQCSJL-LNSITVRQSA-N 1 0 346.349 3.729 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)c(OC)c1 ZINC000022971560 1030906983 /nfs/dbraw/zinc/90/69/83/1030906983.db2.gz TWJLGKPUUVZCEQ-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO CCOc1ncccc1CN[C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192652234 1030954293 /nfs/dbraw/zinc/95/42/93/1030954293.db2.gz FVXDWUDBADRPCB-QGZVFWFLSA-N 1 0 327.384 3.556 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000483101749 1030956463 /nfs/dbraw/zinc/95/64/63/1030956463.db2.gz DFXZDIHAVQUJFQ-HNNXBMFYSA-N 1 0 330.359 3.602 20 5 EHBDRO C[N@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343458383 1030974566 /nfs/dbraw/zinc/97/45/66/1030974566.db2.gz CRRKQLGESBGNNC-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368402 1031017801 /nfs/dbraw/zinc/01/78/01/1031017801.db2.gz UUHUZWZUHKMIIL-CABCVRRESA-N 1 0 344.411 3.980 20 5 EHBDRO CC(C)Cc1ccc([C@@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C2CC2)cc1 ZINC000343559382 1031397544 /nfs/dbraw/zinc/39/75/44/1031397544.db2.gz CZPIFIWXBBMIEU-GOSISDBHSA-N 1 0 342.443 3.768 20 5 EHBDRO Cc1ncsc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000278629787 1031741378 /nfs/dbraw/zinc/74/13/78/1031741378.db2.gz FFVCTOLOYUJXNC-UHFFFAOYSA-N 1 0 331.319 3.668 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1C[C@H]1C(F)(F)F)C1CC1 ZINC000926950864 1031847414 /nfs/dbraw/zinc/84/74/14/1031847414.db2.gz VPPZDCZLRBIDNC-MJBXVCDLSA-N 1 0 328.334 3.704 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCO[C@H](C)C1 ZINC000537766081 1031898588 /nfs/dbraw/zinc/89/85/88/1031898588.db2.gz CFUMNMSTUPCZEF-QLFBSQMISA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cccnc1 ZINC000278674740 1031948343 /nfs/dbraw/zinc/94/83/43/1031948343.db2.gz HBASJLBTXWJGHY-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO C[C@@H](COCC(F)(F)F)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278699046 1032054212 /nfs/dbraw/zinc/05/42/12/1032054212.db2.gz KVQLHVRKUBJWIX-IINYFYTJSA-N 1 0 332.322 3.529 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CS1 ZINC000594499436 1033402280 /nfs/dbraw/zinc/40/22/80/1033402280.db2.gz GWVUUBJEIMOQAA-BXKDBHETSA-N 1 0 334.363 3.987 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000594514909 1033419778 /nfs/dbraw/zinc/41/97/78/1033419778.db2.gz MDILYZXCSPBCNZ-IFXJQAMLSA-N 1 0 325.412 3.978 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000063551553 1033447108 /nfs/dbraw/zinc/44/71/08/1033447108.db2.gz MEIGGUNSUAUMTD-SFHVURJKSA-N 1 0 345.443 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccc3c(c1)CCO3)CCC2 ZINC000574834630 1033556951 /nfs/dbraw/zinc/55/69/51/1033556951.db2.gz IVZPHPGRYJELJF-IBGZPJMESA-N 1 0 338.407 3.739 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cc1[N+](=O)[O-] ZINC000594940594 1033587925 /nfs/dbraw/zinc/58/79/25/1033587925.db2.gz OYBCROSKROGQRI-ZDUSSCGKSA-N 1 0 328.416 3.755 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C[C@H]1CCN(c2ccccc2Cl)C1 ZINC000594953818 1033595977 /nfs/dbraw/zinc/59/59/77/1033595977.db2.gz IBMXQMKAGYYIKU-CQSZACIVSA-N 1 0 345.830 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CCN(c3ccccc3Cl)C2)cc1 ZINC000594954393 1033596117 /nfs/dbraw/zinc/59/61/17/1033596117.db2.gz LACXGICJCVDBKE-OAHLLOKOSA-N 1 0 345.830 3.864 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccsc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000598965784 1033600956 /nfs/dbraw/zinc/60/09/56/1033600956.db2.gz ZTWKJHSWTMVTNW-UHFFFAOYSA-N 1 0 346.330 3.974 20 5 EHBDRO CC1(C)OC[C@H]2C[C@]21[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000598986596 1033612371 /nfs/dbraw/zinc/61/23/71/1033612371.db2.gz DFMBOEGIRWIPJH-ACJLOTCBSA-N 1 0 328.368 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCOc2ccccc21 ZINC000595021010 1033614779 /nfs/dbraw/zinc/61/47/79/1033614779.db2.gz WIGLJFOYVGJDML-UONOGXRCSA-N 1 0 342.395 3.820 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000599001916 1033638533 /nfs/dbraw/zinc/63/85/33/1033638533.db2.gz ZDEJGCRDDXCRHZ-UHFFFAOYSA-N 1 0 346.374 3.773 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccnc1N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000595064126 1033641845 /nfs/dbraw/zinc/64/18/45/1033641845.db2.gz CXDBXYPIAPMAPS-SFHVURJKSA-N 1 0 340.427 3.831 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595071399 1033646263 /nfs/dbraw/zinc/64/62/63/1033646263.db2.gz YNMBCONHSCLJDT-KDOFPFPSSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1cccc2[nH]ccc21 ZINC000595040762 1033660070 /nfs/dbraw/zinc/66/00/70/1033660070.db2.gz WSTIAGSAGAFIGS-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000173985906 1033664006 /nfs/dbraw/zinc/66/40/06/1033664006.db2.gz HECFSHWGWYJIHU-INIZCTEOSA-N 1 0 344.386 3.773 20 5 EHBDRO C[C@@H](Nc1ccc(C(F)(F)F)c([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000599044354 1033673059 /nfs/dbraw/zinc/67/30/59/1033673059.db2.gz PNPNSCJKDVKZDC-SNVBAGLBSA-N 1 0 331.338 3.756 20 5 EHBDRO CC(C)[C@H](O)[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000595094128 1033699964 /nfs/dbraw/zinc/69/99/64/1033699964.db2.gz DMXGPIYZBRUHFH-SXLOBPIMSA-N 1 0 340.423 3.930 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CCCC[N@@H+]2C2CC2)ccc2cnccc21 ZINC000599072320 1033713955 /nfs/dbraw/zinc/71/39/55/1033713955.db2.gz BVQCUCOPMPAYTG-HNNXBMFYSA-N 1 0 326.400 3.572 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000599077312 1033719464 /nfs/dbraw/zinc/71/94/64/1033719464.db2.gz BRISSAWCAWHISA-STQMWFEESA-N 1 0 344.406 3.936 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@H](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000595297391 1033722082 /nfs/dbraw/zinc/72/20/82/1033722082.db2.gz FCHMUUYWGIAZSB-MRXNPFEDSA-N 1 0 329.400 3.654 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCC2)c2ncccc12 ZINC000599164091 1033779732 /nfs/dbraw/zinc/77/97/32/1033779732.db2.gz JLABLQRTNPNSKM-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000595414486 1033789023 /nfs/dbraw/zinc/78/90/23/1033789023.db2.gz KMUKXPWYRUSWTF-OAHLLOKOSA-N 1 0 346.358 3.746 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H](C1CC1)C1CCOCC1)CCC2 ZINC000593714760 1033820847 /nfs/dbraw/zinc/82/08/47/1033820847.db2.gz AMVMKYOULKIRQO-OALUTQOASA-N 1 0 330.428 3.767 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1 ZINC000593022261 1033839656 /nfs/dbraw/zinc/83/96/56/1033839656.db2.gz XNVIZUQKTDMJFO-KBPBESRZSA-N 1 0 342.395 3.663 20 5 EHBDRO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599349374 1033883995 /nfs/dbraw/zinc/88/39/95/1033883995.db2.gz HDVBICMBTDHUSF-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)C1 ZINC000046934148 1033893680 /nfs/dbraw/zinc/89/36/80/1033893680.db2.gz YTTKYRGZUUVAED-ZDUSSCGKSA-N 1 0 343.383 3.672 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H](C)C3CC3)o2)c([N+](=O)[O-])c1 ZINC000608836360 1033907535 /nfs/dbraw/zinc/90/75/35/1033907535.db2.gz AQOBMAVESPUFFX-GFCCVEGCSA-N 1 0 330.384 3.999 20 5 EHBDRO CCC(C)(C)[C@H](C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000595638915 1033913060 /nfs/dbraw/zinc/91/30/60/1033913060.db2.gz OLDKOGIRFBCNNK-JTQLQIEISA-N 1 0 327.812 3.601 20 5 EHBDRO COc1ccc(C[N@H+](Cc2ccc(F)cc2)C2CC2)cc1[N+](=O)[O-] ZINC000603836727 1033961293 /nfs/dbraw/zinc/96/12/93/1033961293.db2.gz OEIAEDDIYKNPTI-UHFFFAOYSA-N 1 0 330.359 3.907 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])C1 ZINC000603859506 1033986026 /nfs/dbraw/zinc/98/60/26/1033986026.db2.gz FVDLNYXLOGYQFE-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000603867319 1033993115 /nfs/dbraw/zinc/99/31/15/1033993115.db2.gz KTTHHODWFGWYMR-IBGZPJMESA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCC(F)CC1 ZINC000595819084 1033994121 /nfs/dbraw/zinc/99/41/21/1033994121.db2.gz MEHNICQQNSHIMS-DCBWTQNWSA-N 1 0 348.378 3.651 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000603905618 1034025236 /nfs/dbraw/zinc/02/52/36/1034025236.db2.gz JRYAVEBKPNFMDJ-NXHRZFHOSA-N 1 0 337.423 3.724 20 5 EHBDRO COc1cc(NC[C@H](c2ccco2)[NH+](C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596055107 1034056177 /nfs/dbraw/zinc/05/61/77/1034056177.db2.gz SDBBMZPIDFKMOK-CYBMUJFWSA-N 1 0 339.779 3.565 20 5 EHBDRO O=[N+]([O-])c1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1C(F)(F)F ZINC000596082050 1034074389 /nfs/dbraw/zinc/07/43/89/1034074389.db2.gz FIWGYAYUNMGDTK-RYUDHWBXSA-N 1 0 329.322 3.652 20 5 EHBDRO Cc1ccc([C@@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093693 1034078865 /nfs/dbraw/zinc/07/88/65/1034078865.db2.gz DPIRGJCUGCTNFT-NVXWUHKLSA-N 1 0 331.460 3.676 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000599690699 1034096267 /nfs/dbraw/zinc/09/62/67/1034096267.db2.gz PGUAFRYWOSCHOY-HSWBROFVSA-N 1 0 342.399 3.823 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691150 1034096326 /nfs/dbraw/zinc/09/63/26/1034096326.db2.gz QSLZBPZLRWGHBB-SFAKSCPVSA-N 1 0 342.399 3.823 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)cn1 ZINC000599697916 1034100472 /nfs/dbraw/zinc/10/04/72/1034100472.db2.gz INWDMRDWFMVBPE-GOSISDBHSA-N 1 0 327.384 3.548 20 5 EHBDRO COc1cc(NC2CC([NH+]3CCCCC3)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596217338 1034122601 /nfs/dbraw/zinc/12/26/01/1034122601.db2.gz JQIJUSVZJGNIEW-UHFFFAOYSA-N 1 0 339.823 3.686 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCc2ccccc21 ZINC000604012565 1034135524 /nfs/dbraw/zinc/13/55/24/1034135524.db2.gz QDMNZCXPSCWWHS-IBGZPJMESA-N 1 0 326.396 3.983 20 5 EHBDRO CO[C@]1(C(F)(F)F)CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000615141114 1034145502 /nfs/dbraw/zinc/14/55/02/1034145502.db2.gz BKZIGRNOIQSMRG-NFBGWVBBSA-N 1 0 344.333 3.651 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000596308793 1034162019 /nfs/dbraw/zinc/16/20/19/1034162019.db2.gz VGYMOKPSNZQJMT-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000596307368 1034162831 /nfs/dbraw/zinc/16/28/31/1034162831.db2.gz LHXKNXWFJWTTEU-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620059 1034196992 /nfs/dbraw/zinc/19/69/92/1034196992.db2.gz OTKPILRHYDIZJA-HNNXBMFYSA-N 1 0 328.412 3.914 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(N)c1 ZINC000596650615 1034348040 /nfs/dbraw/zinc/34/80/40/1034348040.db2.gz LXPPIZGRJLVZAM-OAHLLOKOSA-N 1 0 331.441 3.838 20 5 EHBDRO COCc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000179520729 1034467527 /nfs/dbraw/zinc/46/75/27/1034467527.db2.gz SXQKLUBFSBILGN-UHFFFAOYSA-N 1 0 326.396 3.906 20 5 EHBDRO COCCC1C[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000597183565 1034586889 /nfs/dbraw/zinc/58/68/89/1034586889.db2.gz LHPFKOJVQKWTRW-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]3COC[C@@H]3C2)s1 ZINC000597231199 1034613615 /nfs/dbraw/zinc/61/36/15/1034613615.db2.gz OHBOIKSYPMEDCS-KBPBESRZSA-N 1 0 344.436 3.792 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](Cc1ccccc1)N(C)C ZINC000534529342 1034647582 /nfs/dbraw/zinc/64/75/82/1034647582.db2.gz FJLRGMSKRCAPEL-APWZRJJASA-N 1 0 341.455 3.727 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000172180083 1034857352 /nfs/dbraw/zinc/85/73/52/1034857352.db2.gz LVXJOTVKGIFXIM-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000450855968 1034898769 /nfs/dbraw/zinc/89/87/69/1034898769.db2.gz HVIKTAVNEREGBC-IMJJTQAJSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2 ZINC000450855932 1034898810 /nfs/dbraw/zinc/89/88/10/1034898810.db2.gz HRVJMHHUWWDRGR-IUIKQTSFSA-N 1 0 336.819 3.686 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000167458647 1034903075 /nfs/dbraw/zinc/90/30/75/1034903075.db2.gz YBJDYWWERUDXLV-JSGCOSHPSA-N 1 0 347.365 3.803 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](CC/C=C/c3ccccc3)CC2)n1 ZINC000450887580 1034917913 /nfs/dbraw/zinc/91/79/13/1034917913.db2.gz YJJVXEYQENKDAP-XBXARRHUSA-N 1 0 326.400 3.532 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)C1=CC[N@H+](C)CC1 ZINC000511367841 1035181885 /nfs/dbraw/zinc/18/18/85/1035181885.db2.gz ADKQOYVNDUFAFY-SNVBAGLBSA-N 1 0 329.322 3.676 20 5 EHBDRO COCc1ccccc1/C=C(\C)C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000511367116 1035183623 /nfs/dbraw/zinc/18/36/23/1035183623.db2.gz MMXOEJCEAITZJC-DTQAZKPQSA-N 1 0 340.423 3.977 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN[C@@H](C[NH+](C)C)c1ccc(Cl)cc1 ZINC000548991602 1035405175 /nfs/dbraw/zinc/40/51/75/1035405175.db2.gz KFOLMEAFDBFBQY-SFHVURJKSA-N 1 0 347.846 3.949 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cn1 ZINC000414095013 1035485310 /nfs/dbraw/zinc/48/53/10/1035485310.db2.gz PGMGHFSLBKJRPV-OAHLLOKOSA-N 1 0 343.427 3.542 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000581503389 1035513667 /nfs/dbraw/zinc/51/36/67/1035513667.db2.gz HEBXGJWCJOXEKA-KPKJPENVSA-N 1 0 349.337 3.784 20 5 EHBDRO CC[C@@H](C)[N@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000595592926 1035650000 /nfs/dbraw/zinc/65/00/00/1035650000.db2.gz KXJKTUIYUOBWSH-SNVBAGLBSA-N 1 0 332.347 3.825 20 5 EHBDRO CCOc1cc(CN(C)Cc2ccc(F)c(F)c2)ccc1[N+](=O)[O-] ZINC000492355483 1035691870 /nfs/dbraw/zinc/69/18/70/1035691870.db2.gz HITLMSQBCGFKIB-UHFFFAOYSA-N 1 0 336.338 3.904 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@H](CO)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000588231254 1035828874 /nfs/dbraw/zinc/82/88/74/1035828874.db2.gz ZBKXUDLTYYHPFY-BEFAXECRSA-N 1 0 346.427 3.694 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000588232659 1035832563 /nfs/dbraw/zinc/83/25/63/1035832563.db2.gz VBGFLRNHXHGODM-UKRRQHHQSA-N 1 0 348.830 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCCOc3cc(F)ccc32)cc1 ZINC000540990517 1035886332 /nfs/dbraw/zinc/88/63/32/1035886332.db2.gz RHRWNOMWNZXUBH-KRWDZBQOSA-N 1 0 346.358 3.616 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1Cc2cccc(OC)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000414191923 1035976397 /nfs/dbraw/zinc/97/63/97/1035976397.db2.gz SDVDIRBGXOGOJK-MAUKXSAKSA-N 1 0 326.396 3.812 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1N[C@H](C)[C@H](c1ccccc1C)[NH+](C)C ZINC000340918893 1035995531 /nfs/dbraw/zinc/99/55/31/1035995531.db2.gz OXJKDMBPJNLDIN-CZUORRHYSA-N 1 0 345.447 3.531 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000463967295 1036014509 /nfs/dbraw/zinc/01/45/09/1036014509.db2.gz WJAGQGAEVONHBZ-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1cc(C[NH3+])cc(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)c1 ZINC000457388219 1036050817 /nfs/dbraw/zinc/05/08/17/1036050817.db2.gz YZMKQZUCOSVHBN-UHFFFAOYSA-N 1 0 327.384 3.539 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056197236 1036139140 /nfs/dbraw/zinc/13/91/40/1036139140.db2.gz AXLNYAHKWDMCJO-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@](C)(OC)C2CC2)cc1[N+](=O)[O-] ZINC000414226279 1036149335 /nfs/dbraw/zinc/14/93/35/1036149335.db2.gz BUMXOKKBSBOSII-LXIYXOSZSA-N 1 0 336.432 3.848 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1ccco1)N1CCCC1 ZINC000152277132 1036270609 /nfs/dbraw/zinc/27/06/09/1036270609.db2.gz JVJQZGIPLOGXEY-CRAIPNDOSA-N 1 0 343.427 3.984 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000589200170 1036306909 /nfs/dbraw/zinc/30/69/09/1036306909.db2.gz VQUVAWFZZFZSGV-GGVHLCNSSA-N 1 0 330.428 3.747 20 5 EHBDRO CSc1ccc(CN2CCN(c3cccc([N+](=O)[O-])c3)CC2)s1 ZINC000589495901 1036437723 /nfs/dbraw/zinc/43/77/23/1036437723.db2.gz JJEDFCHSUNLBJW-UHFFFAOYSA-N 1 0 349.481 3.700 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@H]1c1cccs1)Nc1ccccc1[N+](=O)[O-] ZINC000026231490 1036443184 /nfs/dbraw/zinc/44/31/84/1036443184.db2.gz SGDPODCFBIMYLW-HNNXBMFYSA-N 1 0 345.424 3.822 20 5 EHBDRO C[C@@H]([C@H](C)[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000541601537 1036482249 /nfs/dbraw/zinc/48/22/49/1036482249.db2.gz GXIXZHYCGXMERE-GJZGRUSLSA-N 1 0 347.459 3.752 20 5 EHBDRO CC[C@H](C)[C@H](C)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000249741153 1036521890 /nfs/dbraw/zinc/52/18/90/1036521890.db2.gz IOVFAOAXMJXBQQ-GARJFASQSA-N 1 0 327.812 3.599 20 5 EHBDRO COCC1CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000414307612 1036578709 /nfs/dbraw/zinc/57/87/09/1036578709.db2.gz HIYGDNQWNPGYDF-UYJHFMRCSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC(CCC[NH+]2CCCC2)CC1 ZINC000443601361 1036656405 /nfs/dbraw/zinc/65/64/05/1036656405.db2.gz NWIVXAZBONXTBE-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@@H]1c1ccc(Cl)cc1 ZINC000089808619 1036659601 /nfs/dbraw/zinc/65/96/01/1036659601.db2.gz CBNAYZFDAQSXLQ-MSOLQXFVSA-N 1 0 345.830 3.783 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000557522251 1036677714 /nfs/dbraw/zinc/67/77/14/1036677714.db2.gz SFHCMVZBNGOKTR-SECBINFHSA-N 1 0 330.215 3.798 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CC[C@@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939099 1036687663 /nfs/dbraw/zinc/68/76/63/1036687663.db2.gz OYGPWPWDVJOFMA-WFASDCNBSA-N 1 0 346.349 3.654 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)NCc1csc([N+](=O)[O-])c1)[NH+](C)C ZINC000443012252 1036794337 /nfs/dbraw/zinc/79/43/37/1036794337.db2.gz IQYHPLFWDOGUSL-GUYCJALGSA-N 1 0 333.457 3.746 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](c2ccccc2)CO1 ZINC000464838373 1036853853 /nfs/dbraw/zinc/85/38/53/1036853853.db2.gz VLLSUFCBEVSJAC-KXBFYZLASA-N 1 0 326.396 3.599 20 5 EHBDRO CC[NH+]1CCC(N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000491328683 1036854375 /nfs/dbraw/zinc/85/43/75/1036854375.db2.gz JBAKONBNWYHJKL-FQEVSTJZSA-N 1 0 339.439 3.758 20 5 EHBDRO CCC[C@@]1(C)CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000464842665 1036878409 /nfs/dbraw/zinc/87/84/09/1036878409.db2.gz KGIZDQKFFCSGJJ-SFHVURJKSA-N 1 0 333.432 3.826 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@H](C)C[C@@H](C)C1 ZINC000443663763 1036975995 /nfs/dbraw/zinc/97/59/95/1036975995.db2.gz YVLVVXCRERNYMZ-UONOGXRCSA-N 1 0 333.432 3.600 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000158942711 1037051043 /nfs/dbraw/zinc/05/10/43/1037051043.db2.gz NKKBWZBLPCXRJP-IBGZPJMESA-N 1 0 340.423 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(-n3cccn3)cc2)cc1Cl ZINC000761522404 1037091033 /nfs/dbraw/zinc/09/10/33/1037091033.db2.gz OZEODFRJWYWBAG-UHFFFAOYSA-N 1 0 342.786 3.724 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CO1 ZINC000595050149 1037219277 /nfs/dbraw/zinc/21/92/77/1037219277.db2.gz QIJFDDZLWDWEGL-FUHWJXTLSA-N 1 0 326.396 3.841 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CO1 ZINC000595050147 1037219705 /nfs/dbraw/zinc/21/97/05/1037219705.db2.gz QIJFDDZLWDWEGL-AEFFLSMTSA-N 1 0 326.396 3.841 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@@H]1C1CC1 ZINC000542316381 1037282747 /nfs/dbraw/zinc/28/27/47/1037282747.db2.gz UHBSMFFDGTYYBX-MOPGFXCFSA-N 1 0 342.395 3.902 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCCN(CC(C)(C)C)C2=O)cc1[N+](=O)[O-] ZINC000460674031 1037361215 /nfs/dbraw/zinc/36/12/15/1037361215.db2.gz RJZMWUJXIRWDQV-HOCLYGCPSA-N 1 0 347.459 3.591 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000532461474 1037364922 /nfs/dbraw/zinc/36/49/22/1037364922.db2.gz RRGNFUPLTQWUDM-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO COc1ccc(-c2ccc(C[N@H+](C)CC(C)(C)OC)o2)c([N+](=O)[O-])c1 ZINC000539927306 1037366468 /nfs/dbraw/zinc/36/64/68/1037366468.db2.gz MSYMWGYNPAVUEP-UHFFFAOYSA-N 1 0 348.399 3.720 20 5 EHBDRO CC(C)[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCCC1 ZINC000539992845 1037429885 /nfs/dbraw/zinc/42/98/85/1037429885.db2.gz IGWAQOCNNVXTNF-AWEZNQCLSA-N 1 0 343.374 3.729 20 5 EHBDRO Cc1cccc([C@H](C)C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000472616573 1037476513 /nfs/dbraw/zinc/47/65/13/1037476513.db2.gz MLBSWYRPSOKZGF-NXHRZFHOSA-N 1 0 342.443 3.977 20 5 EHBDRO Cc1cccc([C@H](C)C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000472616571 1037477094 /nfs/dbraw/zinc/47/70/94/1037477094.db2.gz MLBSWYRPSOKZGF-NJAFHUGGSA-N 1 0 342.443 3.977 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@@H](C)C1 ZINC000462862128 1037487495 /nfs/dbraw/zinc/48/74/95/1037487495.db2.gz LMAQECXBLITDOQ-AAEUAGOBSA-N 1 0 345.365 3.780 20 5 EHBDRO COCCc1nc(C)c([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271859626 1037510513 /nfs/dbraw/zinc/51/05/13/1037510513.db2.gz ZFADGJPYQDCYKB-NWDGAFQWSA-N 1 0 349.456 3.960 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCC[C@@H](C(=O)NC(C)C)C1 ZINC000532501265 1037527730 /nfs/dbraw/zinc/52/77/30/1037527730.db2.gz QKLBSMLQPMEVSY-XHSDSOJGSA-N 1 0 347.459 3.637 20 5 EHBDRO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790587 1037538540 /nfs/dbraw/zinc/53/85/40/1037538540.db2.gz PFZNVOGXPLJXBL-GLJUWKHASA-N 1 0 344.411 3.836 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCN(c2ccccc2F)C1 ZINC000462915544 1037544889 /nfs/dbraw/zinc/54/48/89/1037544889.db2.gz VVPWGRBIIHRWSM-OAHLLOKOSA-N 1 0 343.402 3.658 20 5 EHBDRO CC(C)(C)C[C@H](CO)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540148121 1037602628 /nfs/dbraw/zinc/60/26/28/1037602628.db2.gz HGEWAIGDILBKCE-USXIJHARSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2ncccc12 ZINC000540146949 1037602798 /nfs/dbraw/zinc/60/27/98/1037602798.db2.gz FWYKNOAGVVGRMA-CQSZACIVSA-N 1 0 338.411 3.625 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000463009651 1037643071 /nfs/dbraw/zinc/64/30/71/1037643071.db2.gz LUUMUOXDEQYGGJ-OAHLLOKOSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]CCc3ccc(F)cc3Cl)nc2c1 ZINC000573650435 1037670989 /nfs/dbraw/zinc/67/09/89/1037670989.db2.gz DYBSOHFBHMPROU-UHFFFAOYSA-N 1 0 348.765 3.596 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000341213645 1037766053 /nfs/dbraw/zinc/76/60/53/1037766053.db2.gz RHRWLRXKWQFWHK-KRWDZBQOSA-N 1 0 341.411 3.973 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000540375880 1037860060 /nfs/dbraw/zinc/86/00/60/1037860060.db2.gz INEYAFGZSMUSTK-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@]3(C)CCCO3)o2)c([N+](=O)[O-])c1 ZINC000152936972 1037864697 /nfs/dbraw/zinc/86/46/97/1037864697.db2.gz OMJXIYYRNOIAGB-SFHVURJKSA-N 1 0 346.383 3.522 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccc1)C1(CO)CC=CC1 ZINC000592174895 1037915100 /nfs/dbraw/zinc/91/51/00/1037915100.db2.gz MWPOHOHDHYUFES-LJQANCHMSA-N 1 0 338.407 3.754 20 5 EHBDRO CCCC[C@@](C)(CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375405 1037923767 /nfs/dbraw/zinc/92/37/67/1037923767.db2.gz RQKMYVAHMNLFJA-KRWDZBQOSA-N 1 0 349.456 3.749 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117026 1038153951 /nfs/dbraw/zinc/15/39/51/1038153951.db2.gz QFPHWJQJMOTNLO-DOMZBBRYSA-N 1 0 344.415 3.949 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000104151674 1038267625 /nfs/dbraw/zinc/26/76/25/1038267625.db2.gz IESVBPLDOHXXSO-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC(CCCO)CC3)o2)cc1 ZINC000541242573 1038371713 /nfs/dbraw/zinc/37/17/13/1038371713.db2.gz VUOQJEGYXGEQOG-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO C[C@H]1C[C@H](C)C[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661366 1038440823 /nfs/dbraw/zinc/44/08/23/1038440823.db2.gz SMXRCLODSAKXLU-KBPBESRZSA-N 1 0 329.400 3.770 20 5 EHBDRO COc1cc(CN2CC[C@@](F)(c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000549415743 1038454459 /nfs/dbraw/zinc/45/44/59/1038454459.db2.gz PKKLOWZBIVQXQN-SFHVURJKSA-N 1 0 348.349 3.813 20 5 EHBDRO C[C@@H]1C[N@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730126 1038497152 /nfs/dbraw/zinc/49/71/52/1038497152.db2.gz IGCPDLKCHAJVQI-GFCCVEGCSA-N 1 0 349.818 3.644 20 5 EHBDRO C/C(=C\c1ccccc1)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737320 1038500758 /nfs/dbraw/zinc/50/07/58/1038500758.db2.gz VVQCPKXQVUSWFV-JMPLCFMRSA-N 1 0 338.411 3.580 20 5 EHBDRO Cc1cc(N2CCC([NH2+]C(C)C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461770500 1038602315 /nfs/dbraw/zinc/60/23/15/1038602315.db2.gz WIQSBWATBKQQML-UHFFFAOYSA-N 1 0 345.365 3.889 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C3CC3)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461777580 1038603629 /nfs/dbraw/zinc/60/36/29/1038603629.db2.gz GAZOAXQHFAARTN-JTQLQIEISA-N 1 0 329.322 3.571 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2c(c(Cl)c1)OCO2 ZINC000552142444 1039021026 /nfs/dbraw/zinc/02/10/26/1039021026.db2.gz FOKNMMYHHIHIHX-UHFFFAOYSA-N 1 0 348.786 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CC3CC3)CC2)cc1C(F)(F)F ZINC000175026620 1039032263 /nfs/dbraw/zinc/03/22/63/1039032263.db2.gz YNBAQUQQAIKNQW-UHFFFAOYSA-N 1 0 343.349 3.900 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000236848826 1039046486 /nfs/dbraw/zinc/04/64/86/1039046486.db2.gz MLOKIEYPTBOQRI-IBGZPJMESA-N 1 0 327.428 3.768 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@H+](Cc2ccccc2F)C2CCCCC2)n1 ZINC000478012754 1039117796 /nfs/dbraw/zinc/11/77/96/1039117796.db2.gz BUIPEOWQQPTXDH-UHFFFAOYSA-N 1 0 346.406 3.765 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H](O)Cc1ccccc1 ZINC000552293347 1039164106 /nfs/dbraw/zinc/16/41/06/1039164106.db2.gz YZTYMNPUWAZWHW-TUOAVLBBSA-N 1 0 340.423 3.534 20 5 EHBDRO CC(C)(CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)C[NH+]1CCCC1 ZINC000478047191 1039166339 /nfs/dbraw/zinc/16/63/39/1039166339.db2.gz OXUFYKNNMKQUNY-UHFFFAOYSA-N 1 0 343.374 3.730 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000480505404 1039616130 /nfs/dbraw/zinc/61/61/30/1039616130.db2.gz MHUQWBVZLKEVKS-QGZVFWFLSA-N 1 0 340.427 3.541 20 5 EHBDRO Cc1cc(NC[C@@H](C2CC2)[N@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000480500570 1039625837 /nfs/dbraw/zinc/62/58/37/1039625837.db2.gz LEZCPHOJSCMCQO-SFHVURJKSA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](CO)c1ccccc1)CCCC2 ZINC000417307858 1039661132 /nfs/dbraw/zinc/66/11/32/1039661132.db2.gz HNIKBWJAQFBYBC-YLJYHZDGSA-N 1 0 340.423 3.728 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(CF)CCOCC1)CCCC2 ZINC000417353618 1039710976 /nfs/dbraw/zinc/71/09/76/1039710976.db2.gz XQPOLNGFGJKLKD-KRWDZBQOSA-N 1 0 336.407 3.718 20 5 EHBDRO CCC(CC)(CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236909540 1040115829 /nfs/dbraw/zinc/11/58/29/1040115829.db2.gz KRVWAFMIHYOAKS-UHFFFAOYSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](Cc2ccccc2)CN(C)C)cccc1[N+](=O)[O-] ZINC000480884736 1040131628 /nfs/dbraw/zinc/13/16/28/1040131628.db2.gz UUZLWSGVTWUBHR-WMZOPIPTSA-N 1 0 341.455 3.727 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C3(CCO)CCCC3)o2)c1 ZINC000512562656 1040133921 /nfs/dbraw/zinc/13/39/21/1040133921.db2.gz ZPZKCIAIBDZCKD-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CC(C)[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000029113011 1040139481 /nfs/dbraw/zinc/13/94/81/1040139481.db2.gz ROHJRKNRRDYQNL-IBGZPJMESA-N 1 0 341.411 3.545 20 5 EHBDRO COc1cccc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192953282 1040159458 /nfs/dbraw/zinc/15/94/58/1040159458.db2.gz GVZBZLREKJGBJR-INIZCTEOSA-N 1 0 341.411 3.537 20 5 EHBDRO CCC(=O)c1ccc(NCC[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000479362948 1040183552 /nfs/dbraw/zinc/18/35/52/1040183552.db2.gz FMDFIRONJLCVAO-UHFFFAOYSA-N 1 0 341.411 3.731 20 5 EHBDRO C[NH+](C)Cc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000573724821 1040200615 /nfs/dbraw/zinc/20/06/15/1040200615.db2.gz PPKUIISMSCANSX-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO COc1cc(C[NH2+][C@@H](c2ncccc2C)C(C)C)ccc1[N+](=O)[O-] ZINC000489981538 1040288015 /nfs/dbraw/zinc/28/80/15/1040288015.db2.gz WBJIBEAGEVOSAJ-QGZVFWFLSA-N 1 0 329.400 3.794 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CO)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000479528424 1040324990 /nfs/dbraw/zinc/32/49/90/1040324990.db2.gz QRGOWKLVFZUNFO-ZFWWWQNUSA-N 1 0 338.448 3.831 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@H](C)c1cccc(O)c1 ZINC000490065042 1040331395 /nfs/dbraw/zinc/33/13/95/1040331395.db2.gz DGKNWTAUYQUIJC-CYBMUJFWSA-N 1 0 330.384 3.892 20 5 EHBDRO C[C@H]1C[C@@H](CCNc2ccc([N+](=O)[O-])nc2)C[N@@H+]1Cc1ccccc1 ZINC000511649211 1040399658 /nfs/dbraw/zinc/39/96/58/1040399658.db2.gz WCRKZIVYPNTJCS-DOTOQJQBSA-N 1 0 340.427 3.702 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000481163576 1040414094 /nfs/dbraw/zinc/41/40/94/1040414094.db2.gz AFHIHBQLYDFIMG-FXAWDEMLSA-N 1 0 342.439 3.877 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCN(C(=O)C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000192839834 1040437528 /nfs/dbraw/zinc/43/75/28/1040437528.db2.gz VAJCUFGDFJLEDZ-GOSISDBHSA-N 1 0 347.459 3.673 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000092626527 1040457957 /nfs/dbraw/zinc/45/79/57/1040457957.db2.gz RHJIZPGORRXMRC-LBPRGKRZSA-N 1 0 343.374 3.729 20 5 EHBDRO CCOC(=O)CC(C)(C)CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000553876181 1040553990 /nfs/dbraw/zinc/55/39/90/1040553990.db2.gz VJLRSRBVNBFGEA-CQSZACIVSA-N 1 0 336.432 3.923 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc(C4CC4)o3)C2)cc1 ZINC000600170021 1040756271 /nfs/dbraw/zinc/75/62/71/1040756271.db2.gz VIGNWJSKSUVHCU-HNNXBMFYSA-N 1 0 327.384 3.840 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000555563087 1040836329 /nfs/dbraw/zinc/83/63/29/1040836329.db2.gz SSQTXFLWVNKWBK-DOTOQJQBSA-N 1 0 348.443 3.629 20 5 EHBDRO CC(=O)c1cc(N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344413 1041214959 /nfs/dbraw/zinc/21/49/59/1041214959.db2.gz GSORBMUCFBLZHM-CPUCHLNUSA-N 1 0 345.443 3.639 20 5 EHBDRO COc1cc2c(NCc3ccc([N+](=O)[O-])cc3)cc[nH+]c2cc1F ZINC000509729122 1041326464 /nfs/dbraw/zinc/32/64/64/1041326464.db2.gz JHDZOZOCXYADCC-UHFFFAOYSA-N 1 0 327.315 3.903 20 5 EHBDRO CC[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837881 1041685111 /nfs/dbraw/zinc/68/51/11/1041685111.db2.gz JZMPEAWVCHWUJS-BBRMVZONSA-N 1 0 330.384 3.854 20 5 EHBDRO CC[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837883 1041685166 /nfs/dbraw/zinc/68/51/66/1041685166.db2.gz JZMPEAWVCHWUJS-CZUORRHYSA-N 1 0 330.384 3.854 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000236871537 1042108578 /nfs/dbraw/zinc/10/85/78/1042108578.db2.gz IAFYEEBEPXGKEN-CQSZACIVSA-N 1 0 331.416 3.675 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000544609790 1042478670 /nfs/dbraw/zinc/47/86/70/1042478670.db2.gz POLFFBDLRDNAOX-FZKQIMNGSA-N 1 0 332.375 3.908 20 5 EHBDRO COc1c(O)ccc(C[NH2+]Cc2ccc(Cl)c(C)c2)c1[N+](=O)[O-] ZINC000893570225 1042696038 /nfs/dbraw/zinc/69/60/38/1042696038.db2.gz XCYXJVVMFHNCQF-UHFFFAOYSA-N 1 0 336.775 3.561 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccccc2OCC(C)C)cc1[N+](=O)[O-] ZINC000106467955 1042985937 /nfs/dbraw/zinc/98/59/37/1042985937.db2.gz SGQKOTNHPHCVDD-UHFFFAOYSA-N 1 0 344.411 3.928 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000106468704 1042986125 /nfs/dbraw/zinc/98/61/25/1042986125.db2.gz YQPREFKMPDEKLL-UHFFFAOYSA-N 1 0 343.358 3.556 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cscc2Br)c1 ZINC000512050344 1043041167 /nfs/dbraw/zinc/04/11/67/1043041167.db2.gz BOLUGRMVJWZSIT-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000166932215 1043119876 /nfs/dbraw/zinc/11/98/76/1043119876.db2.gz HMTUBGDIXNZJQV-QGZVFWFLSA-N 1 0 343.427 3.819 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@@H]1CC=CCC1 ZINC000344030524 1043124993 /nfs/dbraw/zinc/12/49/93/1043124993.db2.gz BUJRFLLTAWBUPM-ZIAGYGMSSA-N 1 0 342.399 3.994 20 5 EHBDRO COc1ccc(C[NH2+]C/C=C\c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000512087391 1043174426 /nfs/dbraw/zinc/17/44/26/1043174426.db2.gz JJTRDOYWJXQJNI-IHWYPQMZSA-N 1 0 334.322 3.685 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1C ZINC000183720566 1125742674 /nfs/dbraw/zinc/74/26/74/1125742674.db2.gz FJBVPPFXFNFFMM-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H]1C ZINC000764434256 1127493728 /nfs/dbraw/zinc/49/37/28/1127493728.db2.gz VSZQTDUYNXQJDG-VCBZYWHSSA-N 1 0 331.460 3.978 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C[C@@H]1C ZINC000552066370 1127555369 /nfs/dbraw/zinc/55/53/69/1127555369.db2.gz HLFFBLRRIVSLCI-OAOQPFQOSA-N 1 0 342.443 3.832 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H](Cn2ccnc2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251226 1127588481 /nfs/dbraw/zinc/58/84/81/1127588481.db2.gz MXILNQPPUJXVMP-RHSMWYFYSA-N 1 0 330.432 3.865 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2nccc(C)c2[N+](=O)[O-])CC1 ZINC000301302134 1127735344 /nfs/dbraw/zinc/73/53/44/1127735344.db2.gz RQDLBPHBDWAHEG-UHFFFAOYSA-N 1 0 340.427 3.683 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCC[C@H](C)C1 ZINC000301382742 1127741169 /nfs/dbraw/zinc/74/11/69/1127741169.db2.gz VGTHVIIEVNFOKO-RYUDHWBXSA-N 1 0 343.374 3.729 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cc(C)no1 ZINC000552340171 1127750170 /nfs/dbraw/zinc/75/01/70/1127750170.db2.gz MGZKNWHTZNMMRS-ZDUSSCGKSA-N 1 0 335.429 3.594 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(c2nccs2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000272942298 1127890396 /nfs/dbraw/zinc/89/03/96/1127890396.db2.gz UHPOGEPOMNHETI-MRXNPFEDSA-N 1 0 346.456 3.761 20 5 EHBDRO CC[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1C ZINC001307703131 1128455402 /nfs/dbraw/zinc/45/54/02/1128455402.db2.gz OMQOOHXQGCZZCN-GHMZBOCLSA-N 1 0 327.222 3.978 20 5 EHBDRO COc1cc(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301464535 1128457530 /nfs/dbraw/zinc/45/75/30/1128457530.db2.gz GRCKRABRBRMXNI-INIZCTEOSA-N 1 0 349.818 3.972 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2sc(C)nc2C)cc1[N+](=O)[O-] ZINC000153696125 1128616026 /nfs/dbraw/zinc/61/60/26/1128616026.db2.gz DBPXUVZAXQVLQP-LLVKDONJSA-N 1 0 349.456 3.960 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000338711794 1128733464 /nfs/dbraw/zinc/73/34/64/1128733464.db2.gz BOKOGGWIWFWHEU-WEVVVXLNSA-N 1 0 348.406 3.643 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000542497322 1120785354 /nfs/dbraw/zinc/78/53/54/1120785354.db2.gz AICKVBSQJVWZAY-HUUCEWRRSA-N 1 0 332.400 3.795 20 5 EHBDRO C[C@H](C1CC[NH+](C)CC1)N(C)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000542506308 1120837181 /nfs/dbraw/zinc/83/71/81/1120837181.db2.gz ODJXPTYVWTZMOC-LLVKDONJSA-N 1 0 345.365 3.780 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)CCc1ccccc1 ZINC000542519350 1120885265 /nfs/dbraw/zinc/88/52/65/1120885265.db2.gz ROPJHBHQIWMFHB-HXUWFJFHSA-N 1 0 342.439 3.799 20 5 EHBDRO Cc1nn(C[N@@H+](CC(C)C)CC(C)(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000761830875 1120975399 /nfs/dbraw/zinc/97/53/99/1120975399.db2.gz KJFFFEAIFCBIOB-UHFFFAOYSA-N 1 0 333.436 3.610 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000054513368 1120985309 /nfs/dbraw/zinc/98/53/09/1120985309.db2.gz LHMOCVPNBRSEAX-UHFFFAOYSA-N 1 0 343.358 3.582 20 5 EHBDRO COc1ccc(C[N@@H+](Cc2cccc(O)c2)CC2CC2)cc1[N+](=O)[O-] ZINC000112978556 1128963673 /nfs/dbraw/zinc/96/36/73/1128963673.db2.gz BYBZLDGDOSISDW-UHFFFAOYSA-N 1 0 342.395 3.721 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccc(F)cc3)CC2)c(F)c1 ZINC000301060018 1121210630 /nfs/dbraw/zinc/21/06/30/1121210630.db2.gz BIUNIWBBCXPEHE-UHFFFAOYSA-N 1 0 347.365 3.585 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cc(N)ccc2[N+](=O)[O-])CC1 ZINC000193438380 1121285848 /nfs/dbraw/zinc/28/58/48/1121285848.db2.gz QHJRGOMKTWOFNT-AWEZNQCLSA-N 1 0 340.427 3.815 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000193503606 1121358290 /nfs/dbraw/zinc/35/82/90/1121358290.db2.gz KAHJRMGLJQUYKZ-IUODEOHRSA-N 1 0 345.365 3.520 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCC[C@@H](C)C1 ZINC000301075502 1121359425 /nfs/dbraw/zinc/35/94/25/1121359425.db2.gz FCUUQZBLNYAFTN-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000090540459 1121386440 /nfs/dbraw/zinc/38/64/40/1121386440.db2.gz YQRFHTLOLITXKL-YSVLISHTSA-N 1 0 336.457 3.609 20 5 EHBDRO C[C@H]([NH2+]CCc1nnc(-c2ccccc2)o1)c1cccc([N+](=O)[O-])c1 ZINC000090658783 1121669683 /nfs/dbraw/zinc/66/96/83/1121669683.db2.gz PXGIXCZYQNEQAQ-ZDUSSCGKSA-N 1 0 338.367 3.538 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccc(C)cc1 ZINC000194014194 1121752661 /nfs/dbraw/zinc/75/26/61/1121752661.db2.gz LNMFOWWXAFEGCZ-KRWDZBQOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(=O)c1c(NC[C@@H](c2ccc(F)cc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763203087 1121869278 /nfs/dbraw/zinc/86/92/78/1121869278.db2.gz KFXXITCTJYPIID-KRWDZBQOSA-N 1 0 345.374 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)c(F)c1 ZINC000301112626 1121973696 /nfs/dbraw/zinc/97/36/96/1121973696.db2.gz ZCMSAHNIOPNVBZ-INIZCTEOSA-N 1 0 333.363 3.966 20 5 EHBDRO CC(=O)c1ccc(NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301111358 1121974093 /nfs/dbraw/zinc/97/40/93/1121974093.db2.gz RMMYBHUUNGWJCV-ZIAGYGMSSA-N 1 0 333.432 3.577 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763395797 1122229152 /nfs/dbraw/zinc/22/91/52/1122229152.db2.gz OTSQBDAHUKZULM-SJORKVTESA-N 1 0 332.787 3.559 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000125824890 1122345319 /nfs/dbraw/zinc/34/53/19/1122345319.db2.gz STPKWTUTKSXRTQ-UKRRQHHQSA-N 1 0 345.365 3.662 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](CCSc3ccccc3)CC2)cc1 ZINC000917081167 1122483929 /nfs/dbraw/zinc/48/39/29/1122483929.db2.gz SSELLTXSLVUFGE-UHFFFAOYSA-N 1 0 343.452 3.509 20 5 EHBDRO Cc1ccc(N2CCC[N@H+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000917088570 1122486464 /nfs/dbraw/zinc/48/64/64/1122486464.db2.gz MLZZWMVMMTVTQC-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2ccc([N+](=O)[O-])cn2)c2ccccc2)CC1 ZINC000497647015 1122620240 /nfs/dbraw/zinc/62/02/40/1122620240.db2.gz DVJCWNJXWFONLY-GOSISDBHSA-N 1 0 340.427 3.875 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H](c2ccccc2)C2CCC2)c1 ZINC000154523251 1122684333 /nfs/dbraw/zinc/68/43/33/1122684333.db2.gz VRTMSMSSAABKJP-RTBURBONSA-N 1 0 326.396 3.759 20 5 EHBDRO CC1(C)CC2(CC([NH2+]CCCCc3ccc([N+](=O)[O-])cc3)C2)CO1 ZINC000925467187 1123072709 /nfs/dbraw/zinc/07/27/09/1123072709.db2.gz QGYFZROEWYSHME-UHFFFAOYSA-N 1 0 332.444 3.855 20 5 EHBDRO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000556896395 1123173335 /nfs/dbraw/zinc/17/33/35/1123173335.db2.gz VWVFKWYFGVRFAG-NXHRZFHOSA-N 1 0 332.444 3.929 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000609354282 1123553551 /nfs/dbraw/zinc/55/35/51/1123553551.db2.gz NLXOCADLNIOGCH-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])c(C)c2)C1 ZINC000609489645 1123591275 /nfs/dbraw/zinc/59/12/75/1123591275.db2.gz XLDAFUBPWGBZHZ-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000609560436 1123609063 /nfs/dbraw/zinc/60/90/63/1123609063.db2.gz VLMOCUMZOCFUMD-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@H]21 ZINC000609631773 1123634740 /nfs/dbraw/zinc/63/47/40/1123634740.db2.gz WFDQFRPVCDOBBW-NUEKZKHPSA-N 1 0 345.443 3.742 20 5 EHBDRO CCOC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1Br)C(C)C ZINC000233736034 1123708088 /nfs/dbraw/zinc/70/80/88/1123708088.db2.gz GYCJAYOXFPEVBU-GFCCVEGCSA-N 1 0 345.237 3.508 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@H]1c1ccccc1 ZINC000301823522 1129141033 /nfs/dbraw/zinc/14/10/33/1129141033.db2.gz CMIYZSKDHAOAIF-LSDHHAIUSA-N 1 0 332.791 3.501 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CNc1cnn(-c2cc[nH+]cc2)c1 ZINC000615720748 1123863610 /nfs/dbraw/zinc/86/36/10/1123863610.db2.gz WHSXCRCBAJZNSS-NTEUORMPSA-N 1 0 335.367 3.691 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000255641247 1129169060 /nfs/dbraw/zinc/16/90/60/1129169060.db2.gz WKYNLOMPHWPJDJ-BHSKVQTESA-N 1 0 341.455 3.557 20 5 EHBDRO C[C@@H]1CCC[C@@](CNc2ncnc3sc([N+](=O)[O-])cc32)([NH+](C)C)C1 ZINC000326557571 1124646139 /nfs/dbraw/zinc/64/61/39/1124646139.db2.gz VEQFMJFXIXHAJT-BDJLRTHQSA-N 1 0 349.460 3.522 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@H](C)[C@@H]1OC ZINC000617549835 1124648601 /nfs/dbraw/zinc/64/86/01/1124648601.db2.gz NKVAACKMBDSRIP-JECHBYEQSA-N 1 0 347.415 3.665 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569538 1125363945 /nfs/dbraw/zinc/36/39/45/1125363945.db2.gz GGUGPPOWGDJJQL-JZGRTCEGSA-N 1 0 332.444 3.746 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000078989274 1129220644 /nfs/dbraw/zinc/22/06/44/1129220644.db2.gz CNCWZPNQNDTMET-STQMWFEESA-N 1 0 328.368 3.778 20 5 EHBDRO CC(C)N(Cc1nnc(-c2ccco2)o1)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458544 1129276071 /nfs/dbraw/zinc/27/60/71/1129276071.db2.gz SKJLAGGTIJMUMN-UHFFFAOYSA-N 1 0 342.355 3.648 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920390 1129367941 /nfs/dbraw/zinc/36/79/41/1129367941.db2.gz DUNUAIVXJGJKQZ-VXGBXAGGSA-N 1 0 343.374 3.729 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000131034581 1129406537 /nfs/dbraw/zinc/40/65/37/1129406537.db2.gz DWCAJJLIZWRJNF-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1cc(NCc2cccc3cc[nH]c32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000466368201 1129407069 /nfs/dbraw/zinc/40/70/69/1129407069.db2.gz HCYPLRQMJAKCOU-UHFFFAOYSA-N 1 0 332.363 3.967 20 5 EHBDRO C[C@@H]([NH2+][C@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674630 1129451526 /nfs/dbraw/zinc/45/15/26/1129451526.db2.gz PCHGDBFDYKENHJ-FZKQIMNGSA-N 1 0 339.395 3.663 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@]2(C)CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543400010 1129460700 /nfs/dbraw/zinc/46/07/00/1129460700.db2.gz SPSZYAYTNANOBL-OALUTQOASA-N 1 0 344.411 3.998 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](O)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000543416599 1129476419 /nfs/dbraw/zinc/47/64/19/1129476419.db2.gz PORGCHPBPDBBLC-WBVHZDCISA-N 1 0 328.412 3.548 20 5 EHBDRO CCC[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494519 1129492525 /nfs/dbraw/zinc/49/25/25/1129492525.db2.gz DFTCOBWYXOJIAK-HUUCEWRRSA-N 1 0 333.432 3.742 20 5 EHBDRO CCN(CC)c1ccc(Nc2ncnc3cccc([N+](=O)[O-])c32)cn1 ZINC000543450879 1129493664 /nfs/dbraw/zinc/49/36/64/1129493664.db2.gz DGLJYZKDDMHFHG-UHFFFAOYSA-N 1 0 338.371 3.523 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301993134 1129509398 /nfs/dbraw/zinc/50/93/98/1129509398.db2.gz GRVFUSKWVFTLFV-LBPRGKRZSA-N 1 0 334.807 3.576 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000123730858 1129548454 /nfs/dbraw/zinc/54/84/54/1129548454.db2.gz ORIHQNHBSFYTSA-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1Nc1ncc([N+](=O)[O-])cc1Cl ZINC000389802847 1129590741 /nfs/dbraw/zinc/59/07/41/1129590741.db2.gz YFWXURGDCNIZEK-LRDDRELGSA-N 1 0 346.818 3.576 20 5 EHBDRO C[C@H]([NH2+][C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000389865026 1129592602 /nfs/dbraw/zinc/59/26/02/1129592602.db2.gz KMRRIXCTNHMWSU-FTRWYGJKSA-N 1 0 339.439 3.766 20 5 EHBDRO Cc1c(C[NH2+]C(C)(C)COCc2ccccc2)cccc1[N+](=O)[O-] ZINC000390040986 1129601421 /nfs/dbraw/zinc/60/14/21/1129601421.db2.gz AJOBCCYOMMVCMQ-UHFFFAOYSA-N 1 0 328.412 3.988 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964368 1129601904 /nfs/dbraw/zinc/60/19/04/1129601904.db2.gz WOADWVKXAQVIIQ-PBHICJAKSA-N 1 0 329.400 3.676 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)N(C)C)c1 ZINC000154971628 1129602428 /nfs/dbraw/zinc/60/24/28/1129602428.db2.gz SXKUKTHZPGPJSM-AUUYWEPGSA-N 1 0 343.427 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@@]4(CCOC4)C3)s2)cc1 ZINC000093820049 1129604911 /nfs/dbraw/zinc/60/49/11/1129604911.db2.gz FJYDYGYNCSNHLK-GOSISDBHSA-N 1 0 344.436 3.936 20 5 EHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(OC)c(OC)cc1[N+](=O)[O-] ZINC000093870958 1129606621 /nfs/dbraw/zinc/60/66/21/1129606621.db2.gz IVSKNOBZTSCLSP-GFCCVEGCSA-N 1 0 342.461 3.576 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000331075868 1129652532 /nfs/dbraw/zinc/65/25/32/1129652532.db2.gz WDVWGTMYWVFDSU-GJZGRUSLSA-N 1 0 348.447 3.548 20 5 EHBDRO CCC[N@H+](CCc1cccs1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000766027345 1129828310 /nfs/dbraw/zinc/82/83/10/1129828310.db2.gz GKDUOVRAZWLABT-UHFFFAOYSA-N 1 0 344.440 3.918 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C[C@H](C)O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305148322 1129912937 /nfs/dbraw/zinc/91/29/37/1129912937.db2.gz OACHXSSPPBXHFS-DAYGRLMNSA-N 1 0 328.412 3.800 20 5 EHBDRO CC(C)([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000057846522 1129917343 /nfs/dbraw/zinc/91/73/43/1129917343.db2.gz CFNXNNVWGUIDRK-UHFFFAOYSA-N 1 0 347.802 3.712 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000282494873 1129946981 /nfs/dbraw/zinc/94/69/81/1129946981.db2.gz HWOHIMOPSQPMGF-KBXCAEBGSA-N 1 0 348.443 3.993 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@@H](C)[C@H]1c1ccccc1 ZINC000245443389 1130208248 /nfs/dbraw/zinc/20/82/48/1130208248.db2.gz XCOIRLPZFSWKNE-KUHUBIRLSA-N 1 0 339.395 3.535 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419174 1130228576 /nfs/dbraw/zinc/22/85/76/1130228576.db2.gz SLTHKKUGMNNEBO-SJKOYZFVSA-N 1 0 349.381 3.827 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)N1C[C@@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000245831743 1130323434 /nfs/dbraw/zinc/32/34/34/1130323434.db2.gz ACOMFFROJININW-AFIMGQEJSA-N 1 0 347.459 3.529 20 5 EHBDRO C[C@H](O)C[C@H](C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246055806 1130338898 /nfs/dbraw/zinc/33/88/98/1130338898.db2.gz YRPNWGWIWNQGAB-YZVOILCLSA-N 1 0 328.412 3.681 20 5 EHBDRO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987150 1130394720 /nfs/dbraw/zinc/39/47/20/1130394720.db2.gz ILYCMPHIXDWONU-KUHUBIRLSA-N 1 0 339.395 3.616 20 5 EHBDRO CC(C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+]1CCCC1 ZINC000731208334 1130779118 /nfs/dbraw/zinc/77/91/18/1130779118.db2.gz BGTQXTBUQMCNFE-AWEZNQCLSA-N 1 0 334.445 3.737 20 5 EHBDRO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCCC[C@@H]1C ZINC000731206205 1130779167 /nfs/dbraw/zinc/77/91/67/1130779167.db2.gz BHKMWMZJYNVBEX-RYUDHWBXSA-N 1 0 334.445 3.879 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794892 1131082739 /nfs/dbraw/zinc/08/27/39/1131082739.db2.gz HITFVLDUVBCBSW-HOTGVXAUSA-N 1 0 349.450 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@]4(CC=CCC4)C3)c2c1 ZINC000733991508 1131180063 /nfs/dbraw/zinc/18/00/63/1131180063.db2.gz FYUQSLQCDUYBOQ-SFHVURJKSA-N 1 0 326.400 3.724 20 5 EHBDRO CC[C@@H](C)[C@H]1CCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059328 1131462046 /nfs/dbraw/zinc/46/20/46/1131462046.db2.gz XKSQBTZGXBOLFE-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[NH+]3CCc4ccccc4CC3)c2)cc1 ZINC000738227643 1131464051 /nfs/dbraw/zinc/46/40/51/1131464051.db2.gz XJBLXKBEUJGQDU-UHFFFAOYSA-N 1 0 348.406 3.517 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901029 1131883316 /nfs/dbraw/zinc/88/33/16/1131883316.db2.gz FSVBYCSVYQUSPE-KDOFPFPSSA-N 1 0 340.423 3.769 20 5 EHBDRO Cc1cccc(OCC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172901207 1131883988 /nfs/dbraw/zinc/88/39/88/1131883988.db2.gz LBYPIKXGKPRYCB-SFHVURJKSA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1CCC3(COC3)CC1)CC2 ZINC001172899868 1131884138 /nfs/dbraw/zinc/88/41/38/1131884138.db2.gz FDNFQDLEVNOVQE-GOSISDBHSA-N 1 0 344.455 3.639 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172901576 1131884571 /nfs/dbraw/zinc/88/45/71/1131884571.db2.gz NUHZTLSCWHORRW-MJGOQNOKSA-N 1 0 325.412 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCC(F)(F)[C@@H](F)C1)CC2 ZINC001172902668 1131885180 /nfs/dbraw/zinc/88/51/80/1131885180.db2.gz BNIHHPWTUTVLRW-ZFWWWQNUSA-N 1 0 328.334 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1noc3ccccc13)CC2 ZINC001172903246 1131886243 /nfs/dbraw/zinc/88/62/43/1131886243.db2.gz PUQLVUGEVLNJOI-OAHLLOKOSA-N 1 0 337.379 3.773 20 5 EHBDRO O=C1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@@H]2CCCC[C@@H]12 ZINC001172908395 1131887364 /nfs/dbraw/zinc/88/73/64/1131887364.db2.gz MDOITLZGSHBJDY-BHIYHBOVSA-N 1 0 342.439 3.676 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](C(F)(F)F)C1)CC2 ZINC001172914273 1131903019 /nfs/dbraw/zinc/90/30/19/1131903019.db2.gz GFDYQZACDTXDLG-KGLIPLIRSA-N 1 0 328.334 3.726 20 5 EHBDRO CC(C)[N@H+](C1CCN(C)CC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911753 1131917773 /nfs/dbraw/zinc/91/77/73/1131917773.db2.gz FRFPFYKIEAZMRD-GOSISDBHSA-N 1 0 345.487 3.647 20 5 EHBDRO Cc1cc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cnc1Cl ZINC001172912718 1131917894 /nfs/dbraw/zinc/91/78/94/1131917894.db2.gz OQFDQFCBERUARQ-MRXNPFEDSA-N 1 0 345.830 3.989 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2CCC(F)CC2)c1F ZINC001173174912 1131990845 /nfs/dbraw/zinc/99/08/45/1131990845.db2.gz FZQQPFFDMNGIJP-VOMCLLRMSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2ccc(C)cc2)c1F ZINC001173175668 1131991608 /nfs/dbraw/zinc/99/16/08/1131991608.db2.gz QNQGKPFPWQIOFZ-AWEZNQCLSA-N 1 0 346.402 3.814 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CCc3ccccc32)c1F ZINC001173179822 1131992088 /nfs/dbraw/zinc/99/20/88/1131992088.db2.gz QBMMMXOQZZLWAF-WBMJQRKESA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2cc(C)ccn2)c1F ZINC001173179269 1131992400 /nfs/dbraw/zinc/99/24/00/1131992400.db2.gz OPKKVJXXZSMCEE-QWHCGFSZSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1F ZINC001173183477 1131993613 /nfs/dbraw/zinc/99/36/13/1131993613.db2.gz YTRTVRFUIPNBQQ-MCIONIFRSA-N 1 0 336.407 3.796 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC[C@H](C(F)F)C2)c1F ZINC001173189248 1131995462 /nfs/dbraw/zinc/99/54/62/1131995462.db2.gz JXACYPBALGSAIC-MNOVXSKESA-N 1 0 346.349 3.651 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC001173220380 1132004737 /nfs/dbraw/zinc/00/47/37/1132004737.db2.gz ZMCYLABZFVQHGD-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO Cc1cccc(N2CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173224692 1132005637 /nfs/dbraw/zinc/00/56/37/1132005637.db2.gz GLAMPWFWQZLWPB-KRWDZBQOSA-N 1 0 339.439 3.656 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1Cc2ccc(Cl)cc2C1 ZINC001173225353 1132006395 /nfs/dbraw/zinc/00/63/95/1132006395.db2.gz JMPZREPYBLQDKL-SJCJKPOMSA-N 1 0 330.815 3.936 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](OCc2ccccc2)C1 ZINC001173225455 1132007151 /nfs/dbraw/zinc/00/71/51/1132007151.db2.gz CGAYBEKHFCWWEH-OXJNMPFZSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001173228222 1132007884 /nfs/dbraw/zinc/00/78/84/1132007884.db2.gz UQFRABYZHQUGCF-GDBMZVCRSA-N 1 0 348.443 3.580 20 5 EHBDRO COc1cc2c(cc1C)C[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173234331 1132009865 /nfs/dbraw/zinc/00/98/65/1132009865.db2.gz OEPDJNZOCKTGJP-KDOFPFPSSA-N 1 0 340.423 3.600 20 5 EHBDRO CCOC(=O)CCCCCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173214520 1132014804 /nfs/dbraw/zinc/01/48/04/1132014804.db2.gz OLFYQLGMWGQIMJ-HNNXBMFYSA-N 1 0 336.432 3.629 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC[C@H](c2ccc(F)cc2)C1(C)C ZINC001175231031 1132602666 /nfs/dbraw/zinc/60/26/66/1132602666.db2.gz ZQKVSDZEWUUWLZ-MRXNPFEDSA-N 1 0 346.406 3.507 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC001168977449 1132616768 /nfs/dbraw/zinc/61/67/68/1132616768.db2.gz JXKSUMCIPSFVQT-PKOBYXMFSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H]2CCc3c2cccc3OC(F)(F)F)C1 ZINC001168978236 1132618436 /nfs/dbraw/zinc/61/84/36/1132618436.db2.gz QCYBTWKFCAAHMJ-UHIISALHSA-N 1 0 344.333 3.608 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)c(Br)c1 ZINC001168997439 1132627915 /nfs/dbraw/zinc/62/79/15/1132627915.db2.gz ZKGPBSRLMXIFKW-NHCYSSNCSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009408 1132631713 /nfs/dbraw/zinc/63/17/13/1132631713.db2.gz WCMXKLXGHJCEBU-MJGOQNOKSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030291 1132635988 /nfs/dbraw/zinc/63/59/88/1132635988.db2.gz YCUIASDNTPVIHF-HKUYNNGSSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2c3ccc(Cl)cc3c3c2CC[NH2+]C3)C1 ZINC001169030323 1132636142 /nfs/dbraw/zinc/63/61/42/1132636142.db2.gz YSPCZSDYTBSNSB-AAEUAGOBSA-N 1 0 333.819 3.558 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038401 1132636972 /nfs/dbraw/zinc/63/69/72/1132636972.db2.gz YLFGDRTXIUVSHS-IVMMDQJWSA-N 1 0 342.361 3.940 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041701 1132638162 /nfs/dbraw/zinc/63/81/62/1132638162.db2.gz CBNJSOPBCHCETQ-WMZOPIPTSA-N 1 0 334.485 3.830 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048730 1132641415 /nfs/dbraw/zinc/64/14/15/1132641415.db2.gz BCEVZSGTKCSIOT-MFKMUULPSA-N 1 0 329.227 3.797 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@]3(CCc4c3cccc4F)C2)C1 ZINC001169051289 1132643049 /nfs/dbraw/zinc/64/30/49/1132643049.db2.gz CTWPQZDOQGJCSE-CLCXKQKWSA-N 1 0 332.419 3.551 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H](CO)C1CCCCC1 ZINC000809974244 1132660290 /nfs/dbraw/zinc/66/02/90/1132660290.db2.gz QGDZZNBAFVTBQZ-AWEZNQCLSA-N 1 0 347.242 3.932 20 5 EHBDRO COc1c(F)cc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169148261 1132678021 /nfs/dbraw/zinc/67/80/21/1132678021.db2.gz VLRZUWIXTAWMHD-SJCJKPOMSA-N 1 0 339.411 3.698 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714360 1132741325 /nfs/dbraw/zinc/74/13/25/1132741325.db2.gz HAEDTJJUXFPHAU-OAHLLOKOSA-N 1 0 329.400 3.968 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3cc([N+](=O)[O-])ccc3F)cc2)CC1 ZINC001175736987 1132749516 /nfs/dbraw/zinc/74/95/16/1132749516.db2.gz QFHDBHDKHMVIIA-UHFFFAOYSA-N 1 0 344.390 3.619 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@H+]1CCCC[C@@H]1C ZINC000804352038 1132979207 /nfs/dbraw/zinc/97/92/07/1132979207.db2.gz NEQQGUYATWCMCX-AWEZNQCLSA-N 1 0 333.432 3.864 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001177483360 1133068363 /nfs/dbraw/zinc/06/83/63/1133068363.db2.gz ONTXXKCKZVKPKE-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCC[C@@H]1C ZINC000768103670 1133094650 /nfs/dbraw/zinc/09/46/50/1133094650.db2.gz VEIGEJQBHMNAKX-GJZGRUSLSA-N 1 0 337.489 3.539 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@@H]2CCCCO2)o1 ZINC001178295482 1133153721 /nfs/dbraw/zinc/15/37/21/1133153721.db2.gz RDMNVTMMZVNLHJ-AWEZNQCLSA-N 1 0 330.384 3.904 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C/C=C\c1ccc(F)cc1F ZINC001178295270 1133154061 /nfs/dbraw/zinc/15/40/61/1133154061.db2.gz OBBZSTIDQJDKQR-IHWYPQMZSA-N 1 0 334.322 3.685 20 5 EHBDRO Cc1c(C[NH2+]Cc2cc3cc(Cl)cnc3o2)cccc1[N+](=O)[O-] ZINC001178477355 1133172578 /nfs/dbraw/zinc/17/25/78/1133172578.db2.gz FUGHJDHDDYEIBZ-UHFFFAOYSA-N 1 0 331.759 3.988 20 5 EHBDRO Cc1c(C[NH2+]C[C@@](C)(Cc2ccccc2)[C@@H](C)O)cccc1[N+](=O)[O-] ZINC001178648215 1133187840 /nfs/dbraw/zinc/18/78/40/1133187840.db2.gz VDEOJRCWOKKVHA-OXQOHEQNSA-N 1 0 342.439 3.623 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)COc2c(F)cccc2F)cc1[N+](=O)[O-] ZINC001179123614 1133230008 /nfs/dbraw/zinc/23/00/08/1133230008.db2.gz VZLVHPUCGADJFB-LBPRGKRZSA-N 1 0 336.338 3.739 20 5 EHBDRO CC(C)CC[C@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179154648 1133232413 /nfs/dbraw/zinc/23/24/13/1133232413.db2.gz ZTDZYDJUPUQYAD-CQSZACIVSA-N 1 0 332.400 3.742 20 5 EHBDRO O=C1CC[C@H]2C[N@H+](Cc3c4ccccc4cc4ccccc43)CCN12 ZINC000769204913 1133244458 /nfs/dbraw/zinc/24/44/58/1133244458.db2.gz BGTUFCXCKIOOAP-SFHVURJKSA-N 1 0 330.431 3.800 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@H]2[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246255 1133250641 /nfs/dbraw/zinc/25/06/41/1133250641.db2.gz YOWMXNWIGUYFLE-ICSRJNTNSA-N 1 0 340.423 3.991 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CN(C)Cc1ccccc1[N+](=O)[O-] ZINC001180011670 1133316257 /nfs/dbraw/zinc/31/62/57/1133316257.db2.gz SHFUZFZLIVODMQ-UHFFFAOYSA-N 1 0 329.356 3.752 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000772024787 1133635200 /nfs/dbraw/zinc/63/52/00/1133635200.db2.gz VLEHXXANXUAARZ-SNVBAGLBSA-N 1 0 332.231 3.868 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000786583044 1133871243 /nfs/dbraw/zinc/87/12/43/1133871243.db2.gz LIIWHQOUSOIGRA-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000786810829 1133909500 /nfs/dbraw/zinc/90/95/00/1133909500.db2.gz BFNJSSBJNYOEKH-FUNAXGEOSA-N 1 0 346.814 3.975 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1cc(C)oc1C ZINC000786812130 1133910399 /nfs/dbraw/zinc/91/03/99/1133910399.db2.gz GTKCNORSQXJEQB-CWRQFWGNSA-N 1 0 344.411 3.705 20 5 EHBDRO Cc1cc(F)ccc1[C@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000746663145 1133974130 /nfs/dbraw/zinc/97/41/30/1133974130.db2.gz OHWXUJJTGLIRPD-LJQANCHMSA-N 1 0 346.402 3.986 20 5 EHBDRO Cc1cccc([C@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000788592942 1134149035 /nfs/dbraw/zinc/14/90/35/1134149035.db2.gz PLLFGWCJNRSEQY-RBUKOAKNSA-N 1 0 340.423 3.949 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670165 1134159907 /nfs/dbraw/zinc/15/99/07/1134159907.db2.gz SQFUMQBDUUGQIR-PIGZYNQJSA-N 1 0 349.818 3.869 20 5 EHBDRO Cc1cc(Br)cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])c1 ZINC000774978843 1134175495 /nfs/dbraw/zinc/17/54/95/1134175495.db2.gz OBRAIAZYONQPKS-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(F)(c3ccccc3)CC2)c1 ZINC000789308827 1134251954 /nfs/dbraw/zinc/25/19/54/1134251954.db2.gz HCGHOKCMMLEIFI-GOSISDBHSA-N 1 0 344.386 3.589 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000790697242 1134454584 /nfs/dbraw/zinc/45/45/84/1134454584.db2.gz WOFVJIHQCSZZHM-CYBMUJFWSA-N 1 0 343.383 3.922 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C(C)C ZINC000775376254 1134686310 /nfs/dbraw/zinc/68/63/10/1134686310.db2.gz ZMMKTBVURIZBDA-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCCC12CCOCC2 ZINC001170195303 1134711082 /nfs/dbraw/zinc/71/10/82/1134711082.db2.gz TXBBJNSUTTUKOQ-KRWDZBQOSA-N 1 0 332.444 3.666 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2c(F)cccc2F)c([N+](=O)[O-])c1 ZINC001170298302 1134738385 /nfs/dbraw/zinc/73/83/85/1134738385.db2.gz IPCYCVIPLWWGCD-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297960 1134738441 /nfs/dbraw/zinc/73/84/41/1134738441.db2.gz WVCQDKLENOLGFN-ACJLOTCBSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170321852 1134747721 /nfs/dbraw/zinc/74/77/21/1134747721.db2.gz CPKZKUAMMCAXIJ-STQMWFEESA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CCC3(CC(F)C3)CC2)c([N+](=O)[O-])c1 ZINC001170335494 1134752008 /nfs/dbraw/zinc/75/20/08/1134752008.db2.gz OQYUOEFRWZWNQS-CYBMUJFWSA-N 1 0 336.407 3.749 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335493 1134752014 /nfs/dbraw/zinc/75/20/14/1134752014.db2.gz OOKZWXWHLAQASX-LBPRGKRZSA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350559 1134760746 /nfs/dbraw/zinc/76/07/46/1134760746.db2.gz BCKOBKZPJAPXAH-RDTXWAMCSA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@@H](C)[C@@H]1c1ccc(C)cc1 ZINC001191184186 1134821687 /nfs/dbraw/zinc/82/16/87/1134821687.db2.gz VEFYAGDIAVMLPU-DNVCBOLYSA-N 1 0 342.443 3.881 20 5 EHBDRO CC(C)Oc1cccc(C[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001192954795 1135076086 /nfs/dbraw/zinc/07/60/86/1135076086.db2.gz BTJKCCTVHRGMCK-UHFFFAOYSA-N 1 0 344.411 3.893 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])cc1C(F)(F)F)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000804814595 1135202039 /nfs/dbraw/zinc/20/20/39/1135202039.db2.gz FBTCCCGIHPUUGE-QYJAPNMZSA-N 1 0 343.349 3.675 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194162531 1135236122 /nfs/dbraw/zinc/23/61/22/1135236122.db2.gz FGGHRSRLSHPTES-QWRGUYRKSA-N 1 0 339.823 3.601 20 5 EHBDRO C[C@H](Cc1cccc(F)c1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195015076 1135349656 /nfs/dbraw/zinc/34/96/56/1135349656.db2.gz RSCJUZDDHUGWIJ-CQSZACIVSA-N 1 0 332.375 3.676 20 5 EHBDRO Cc1ccc([C@H](O)[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701713 1135874138 /nfs/dbraw/zinc/87/41/38/1135874138.db2.gz JCOUALUGGMOFFB-YVEFUNNKSA-N 1 0 334.803 3.768 20 5 EHBDRO CCCC[N@H+](CCCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809972153 1135906887 /nfs/dbraw/zinc/90/68/87/1135906887.db2.gz CXZZEJKRAGKOEL-UHFFFAOYSA-N 1 0 335.231 3.886 20 5 EHBDRO CCC(CC)(CCO)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000810004132 1135912707 /nfs/dbraw/zinc/91/27/07/1135912707.db2.gz JITYGDGUVLVHJN-UHFFFAOYSA-N 1 0 335.231 3.932 20 5 EHBDRO O=[N+]([O-])c1cc(O)cc(Nc2ccc(CC[NH+]3CCCC3)cc2)c1 ZINC001201223177 1135999582 /nfs/dbraw/zinc/99/95/82/1135999582.db2.gz VXPIMGBJWZYKPA-UHFFFAOYSA-N 1 0 327.384 3.682 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc2oc(=O)oc2c1)c1cccc([N+](=O)[O-])c1 ZINC001201769496 1136061255 /nfs/dbraw/zinc/06/12/55/1136061255.db2.gz HSHZRXQZDREXAB-AWEZNQCLSA-N 1 0 328.324 3.535 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CCC[C@@H](O)C1 ZINC000811481531 1136091519 /nfs/dbraw/zinc/09/15/19/1136091519.db2.gz FDWSICKOMNCOQE-BXKDBHETSA-N 1 0 333.215 3.542 20 5 EHBDRO CC[NH+](CC)CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811486520 1136093039 /nfs/dbraw/zinc/09/30/39/1136093039.db2.gz KCXKDVKBZONMGZ-UHFFFAOYSA-N 1 0 334.247 3.723 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473615 1136095760 /nfs/dbraw/zinc/09/57/60/1136095760.db2.gz FMLBPMLWTSDUBB-NSHDSACASA-N 1 0 346.258 3.866 20 5 EHBDRO C[C@@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000811474815 1136096400 /nfs/dbraw/zinc/09/64/00/1136096400.db2.gz BVUZLGBVOKIRRS-NSHDSACASA-N 1 0 346.258 3.866 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476108 1136096482 /nfs/dbraw/zinc/09/64/82/1136096482.db2.gz FLYYLAUNFFWELN-NSHDSACASA-N 1 0 346.258 3.723 20 5 EHBDRO CCOc1ccc(Cl)cc1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC001202228659 1136108099 /nfs/dbraw/zinc/10/80/99/1136108099.db2.gz VONGHKHOXSFSSP-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000776277103 1136126534 /nfs/dbraw/zinc/12/65/34/1136126534.db2.gz PEUDBWMDOMLULX-QZTJIDSGSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@H](c1cc(F)ccc1F)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276597 1136130858 /nfs/dbraw/zinc/13/08/58/1136130858.db2.gz KUIQHEYPXLVLRI-DIFFPNOSSA-N 1 0 336.338 3.599 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)C[C@@H](O)c1ccccc1 ZINC000850442020 1136259184 /nfs/dbraw/zinc/25/91/84/1136259184.db2.gz JRAKJLXVSXCYGZ-SUNYJGFJSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)[C@H](O)c1ccccc1 ZINC000812853797 1136261942 /nfs/dbraw/zinc/26/19/42/1136261942.db2.gz KGVWDAXGXDUWDJ-KUHUBIRLSA-N 1 0 344.411 3.547 20 5 EHBDRO C[C@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000850549028 1136283208 /nfs/dbraw/zinc/28/32/08/1136283208.db2.gz CNWZYIAFKIALTD-VLRKGOCCSA-N 1 0 325.359 3.796 20 5 EHBDRO CC(C)(C)C(F)(F)C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000850572701 1136289748 /nfs/dbraw/zinc/28/97/48/1136289748.db2.gz NZTHYSVIKKTBOS-UHFFFAOYSA-N 1 0 341.402 3.835 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCCC[C@@H]2c2ccccc2)c1 ZINC000776487378 1136304094 /nfs/dbraw/zinc/30/40/94/1136304094.db2.gz ZBYQSOBGOVGDIQ-HSALFYBXSA-N 1 0 340.423 3.944 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000776580720 1136445406 /nfs/dbraw/zinc/44/54/06/1136445406.db2.gz ZGNAYPLDXVBUNY-FZKQIMNGSA-N 1 0 332.375 3.850 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccsc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000852312004 1136447776 /nfs/dbraw/zinc/44/77/76/1136447776.db2.gz RQGRNQVDTLDTAK-MRXNPFEDSA-N 1 0 334.441 3.990 20 5 EHBDRO CC[C@H](Cc1ccc(C)cc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588699 1136453014 /nfs/dbraw/zinc/45/30/14/1136453014.db2.gz NXTNMRJAGUIMAG-UYAOXDASSA-N 1 0 342.439 3.890 20 5 EHBDRO Cc1cccc(C2([NH2+]C[C@H](O)c3ccc([N+](=O)[O-])cc3)CCCC2)c1 ZINC000776593949 1136454284 /nfs/dbraw/zinc/45/42/84/1136454284.db2.gz YCCQKDPFGFAYTB-IBGZPJMESA-N 1 0 340.423 3.996 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)OCc2ccccc2)cc1[N+](=O)[O-] ZINC000776606176 1136471340 /nfs/dbraw/zinc/47/13/40/1136471340.db2.gz SVOCKDCWUVLEQO-HNNXBMFYSA-N 1 0 342.395 3.687 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC([C@@H]2CCC[NH2+]C2)CC1 ZINC000853016091 1136498763 /nfs/dbraw/zinc/49/87/63/1136498763.db2.gz NOQYCAXPTCZOLE-CQSZACIVSA-N 1 0 339.386 3.748 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000853362803 1136528485 /nfs/dbraw/zinc/52/84/85/1136528485.db2.gz YWTNZSWWGIOLCX-CQSZACIVSA-N 1 0 339.386 3.987 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000815124452 1136553727 /nfs/dbraw/zinc/55/37/27/1136553727.db2.gz YUFYJKYFCFLGTF-LJQANCHMSA-N 1 0 326.396 3.686 20 5 EHBDRO Cc1ccc2c(c1)C[N@@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)C2 ZINC000815186724 1136563686 /nfs/dbraw/zinc/56/36/86/1136563686.db2.gz XBGJVTQPLYRKSI-LJQANCHMSA-N 1 0 340.423 3.774 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000815253542 1136573815 /nfs/dbraw/zinc/57/38/15/1136573815.db2.gz GGIGXMPJKZUALZ-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO Cc1ccc(O[C@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815583518 1136614795 /nfs/dbraw/zinc/61/47/95/1136614795.db2.gz HWEAKEUAUDPGPF-ZIAGYGMSSA-N 1 0 329.400 3.604 20 5 EHBDRO COc1ccc(C[C@@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815598756 1136617030 /nfs/dbraw/zinc/61/70/30/1136617030.db2.gz BMYHVWQQVAVYMH-KGLIPLIRSA-N 1 0 343.427 3.715 20 5 EHBDRO COc1cc(CC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)ccc1Cl ZINC000815658042 1136622988 /nfs/dbraw/zinc/62/29/88/1136622988.db2.gz QUMUBADNRALHFI-LLVKDONJSA-N 1 0 349.818 3.732 20 5 EHBDRO CCCOc1ccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000819257244 1136929263 /nfs/dbraw/zinc/92/92/63/1136929263.db2.gz BLZIALCLFWIKGH-IBGZPJMESA-N 1 0 344.411 3.515 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000819262742 1136929879 /nfs/dbraw/zinc/92/98/79/1136929879.db2.gz OBZLSYDBNXJGFB-YVWKXTFCSA-N 1 0 340.423 3.944 20 5 EHBDRO O=[N+]([O-])c1ccccc1Nc1ccc(Br)c2c1C[NH2+]CC2 ZINC001159942157 1137036658 /nfs/dbraw/zinc/03/66/58/1137036658.db2.gz VGGIDQKAFOACFF-UHFFFAOYSA-N 1 0 348.200 3.747 20 5 EHBDRO Cc1cc(CNC(=O)CCc2c(Cl)cccc2[N+](=O)[O-])cc(C)n1 ZINC000823058111 1137084271 /nfs/dbraw/zinc/08/42/71/1137084271.db2.gz YOYGTHQFYOBHQU-UHFFFAOYSA-N 1 0 347.802 3.509 20 5 EHBDRO Cc1cc(C)[nH+]c(NC2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000777256857 1137142419 /nfs/dbraw/zinc/14/24/19/1137142419.db2.gz UDXZKSYSCFZNIA-UHFFFAOYSA-N 1 0 326.400 3.688 20 5 EHBDRO C[N@H+](CCc1nccs1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339051814 1137170699 /nfs/dbraw/zinc/17/06/99/1137170699.db2.gz WENGOPWLUGEMTE-UHFFFAOYSA-N 1 0 345.346 3.745 20 5 EHBDRO Cc1c(CN2C[C@@H]3CCC[N@@H+]3Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000864005479 1137211281 /nfs/dbraw/zinc/21/12/81/1137211281.db2.gz YEDZRNRXCBIXPA-SFHVURJKSA-N 1 0 337.423 3.888 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)C1 ZINC000794703078 1137236269 /nfs/dbraw/zinc/23/62/69/1137236269.db2.gz HUULDCARRMMYHY-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@H]3CCSC3)cs2)c1 ZINC000865654740 1137302251 /nfs/dbraw/zinc/30/22/51/1137302251.db2.gz UHTGBNQOPOAPKW-LBPRGKRZSA-N 1 0 349.481 3.951 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1nc(C2CC2)cs1 ZINC000866306826 1137343958 /nfs/dbraw/zinc/34/39/58/1137343958.db2.gz WDMLBFZCVRAYBO-SNVBAGLBSA-N 1 0 335.404 3.789 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccn(C2CCCC2)n1 ZINC000866308198 1137344207 /nfs/dbraw/zinc/34/42/07/1137344207.db2.gz RZGVZDWSXMREDW-CYBMUJFWSA-N 1 0 346.406 3.766 20 5 EHBDRO COCC[C@@H]([NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccco1 ZINC000866338159 1137347022 /nfs/dbraw/zinc/34/70/22/1137347022.db2.gz YBJGDFPWWZXRJV-IUODEOHRSA-N 1 0 336.363 3.625 20 5 EHBDRO CC(C)(C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)C(C)(F)F ZINC000866541847 1137363368 /nfs/dbraw/zinc/36/33/68/1137363368.db2.gz COPSDYRGIFRVAX-UHFFFAOYSA-N 1 0 341.402 3.835 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H](O)c1cccc(F)c1 ZINC000773044543 1137461655 /nfs/dbraw/zinc/46/16/55/1137461655.db2.gz WKBAXMNDAJPAOD-PJIJBLCYSA-N 1 0 346.402 3.767 20 5 EHBDRO CCC[C@@H](CCO)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041142 1137567017 /nfs/dbraw/zinc/56/70/17/1137567017.db2.gz QCKBXVNUMWQVRY-STQMWFEESA-N 1 0 326.462 3.766 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1c2ccccc2C[C@H]1O ZINC000872043011 1137567208 /nfs/dbraw/zinc/56/72/08/1137567208.db2.gz VBRLAHITHNETHM-LIXBPZJASA-N 1 0 344.436 3.626 20 5 EHBDRO C[C@H](Nc1cccc(OCC[NH+](C)C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872059933 1137568727 /nfs/dbraw/zinc/56/87/27/1137568727.db2.gz LRRYGYZQFUTSSI-ZDUSSCGKSA-N 1 0 347.390 3.847 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc(C)cn1 ZINC000872077437 1137569998 /nfs/dbraw/zinc/56/99/98/1137569998.db2.gz IHWIPTYCDCGRCR-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO CC[N@@H+](c1ccc(NC2CC(n3cc([N+](=O)[O-])cn3)C2)cc1)C(C)C ZINC000876820577 1137662718 /nfs/dbraw/zinc/66/27/18/1137662718.db2.gz QGWOZTCJIFGRMS-UHFFFAOYSA-N 1 0 343.431 3.842 20 5 EHBDRO CC(C)(C)c1ccc(CC[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876929229 1137665426 /nfs/dbraw/zinc/66/54/26/1137665426.db2.gz BWBDWPXIPXDMPQ-UHFFFAOYSA-N 1 0 342.443 3.625 20 5 EHBDRO CCOc1ccccc1[C@H](CC)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876994442 1137667257 /nfs/dbraw/zinc/66/72/57/1137667257.db2.gz IVBRPLAKCKWVCY-KVULBXGLSA-N 1 0 344.415 3.634 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@H]3CCC[C@@H]3c3ccccc3)C2)c1 ZINC000877559306 1137681211 /nfs/dbraw/zinc/68/12/11/1137681211.db2.gz USAXMGAUYQXHCH-RMFNQSEZSA-N 1 0 340.427 3.668 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674380 1137685314 /nfs/dbraw/zinc/68/53/14/1137685314.db2.gz UZEFZZFBFXQWCS-PKOBYXMFSA-N 1 0 326.396 3.601 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674377 1137685339 /nfs/dbraw/zinc/68/53/39/1137685339.db2.gz UZEFZZFBFXQWCS-IEBWSBKVSA-N 1 0 326.396 3.601 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877936028 1137696262 /nfs/dbraw/zinc/69/62/62/1137696262.db2.gz QLYJIGUVYYNEDL-JTQLQIEISA-N 1 0 336.779 3.673 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128346 1137703589 /nfs/dbraw/zinc/70/35/89/1137703589.db2.gz CNZLIJAJKLBCMY-STQMWFEESA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cc1[N+](=O)[O-] ZINC000878904334 1137731595 /nfs/dbraw/zinc/73/15/95/1137731595.db2.gz LJALWGDTVZAHQZ-KRWDZBQOSA-N 1 0 348.406 3.836 20 5 EHBDRO CC(C)[N@H+](C)Cc1ccccc1CNc1ccnc(F)c1[N+](=O)[O-] ZINC000881810155 1137815735 /nfs/dbraw/zinc/81/57/35/1137815735.db2.gz CQKQXFIGIQOXCH-UHFFFAOYSA-N 1 0 332.379 3.581 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000882817303 1137835034 /nfs/dbraw/zinc/83/50/34/1137835034.db2.gz XEQXRNHYBIPKFV-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO C[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CCN1c1cc[nH+]cc1 ZINC000882820810 1137835199 /nfs/dbraw/zinc/83/51/99/1137835199.db2.gz BAJOTYQJYXMZQE-GFCCVEGCSA-N 1 0 348.353 3.643 20 5 EHBDRO COc1cc(C[NH2+]CC[C@@H]2CCCC2(F)F)c([N+](=O)[O-])cc1OC ZINC000883267138 1137851666 /nfs/dbraw/zinc/85/16/66/1137851666.db2.gz UPKLISHUPAMNLM-LBPRGKRZSA-N 1 0 344.358 3.527 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@H]2C[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000883272054 1137851748 /nfs/dbraw/zinc/85/17/48/1137851748.db2.gz CEMMSDQRMNFUDB-IXDGSTSKSA-N 1 0 344.411 3.854 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000118959760 1137936778 /nfs/dbraw/zinc/93/67/78/1137936778.db2.gz XCDFUQPWPNFXSI-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](c2ccnn2C)C1 ZINC000332323335 1137939910 /nfs/dbraw/zinc/93/99/10/1137939910.db2.gz NYZKVZSQMMVONP-CABCVRRESA-N 1 0 328.416 3.577 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000884717981 1137970874 /nfs/dbraw/zinc/97/08/74/1137970874.db2.gz RTAWUDISERLCSS-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CCCOc1ccc(C(C)(C)[NH2+]Cc2cccnc2[N+](=O)[O-])cc1 ZINC000886183510 1138056767 /nfs/dbraw/zinc/05/67/67/1138056767.db2.gz GVZJWXCWPZOVFQ-UHFFFAOYSA-N 1 0 329.400 3.804 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](C)CC1 ZINC000063308695 1138069889 /nfs/dbraw/zinc/06/98/89/1138069889.db2.gz RXSDBQYYTWVLNO-STQMWFEESA-N 1 0 330.388 3.828 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1cc(C2CC2)no1 ZINC000886684279 1138114572 /nfs/dbraw/zinc/11/45/72/1138114572.db2.gz IUXZWCPFLNOGOW-YOEHRIQHSA-N 1 0 341.411 3.961 20 5 EHBDRO CS[C@@H]1CCCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089924791 1138207848 /nfs/dbraw/zinc/20/78/48/1138207848.db2.gz YCTOIVGIYGJQBY-MRXNPFEDSA-N 1 0 347.440 3.967 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@](C)(O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000090890991 1138214196 /nfs/dbraw/zinc/21/41/96/1138214196.db2.gz LMDOECBMQZHYIC-FZKQIMNGSA-N 1 0 332.375 3.601 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(OCC3CC3)nc2)cccc1[N+](=O)[O-] ZINC000131339482 1138511270 /nfs/dbraw/zinc/51/12/70/1138511270.db2.gz HUXAUJUSPMYTEP-CQSZACIVSA-N 1 0 341.411 3.938 20 5 EHBDRO CN(C)Cc1cc(NC(=O)c2cccc([N+](=O)[O-])c2)ccc1Cl ZINC000337264337 1138513173 /nfs/dbraw/zinc/51/31/73/1138513173.db2.gz ZQMIMAGBRDDKMV-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(-c3cnn(C)c3)s2)cccc1[N+](=O)[O-] ZINC000337841860 1138680418 /nfs/dbraw/zinc/68/04/18/1138680418.db2.gz ZUTDSMZTXVQSJS-UHFFFAOYSA-N 1 0 342.424 3.655 20 5 EHBDRO CC(=O)c1ccc(NCc2ccc(F)c(C[NH+](C)C)c2)c([N+](=O)[O-])c1 ZINC000265194129 1138761853 /nfs/dbraw/zinc/76/18/53/1138761853.db2.gz IBJUIANUYOGNCA-UHFFFAOYSA-N 1 0 345.374 3.610 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)c1 ZINC000175197995 1139472175 /nfs/dbraw/zinc/47/21/75/1139472175.db2.gz BZNQXNKTASDOFP-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178644830 1139709076 /nfs/dbraw/zinc/70/90/76/1139709076.db2.gz KPKGFVOQKLJCTH-CQSZACIVSA-N 1 0 339.395 3.572 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000179135711 1139738140 /nfs/dbraw/zinc/73/81/40/1139738140.db2.gz QUZGOGAMNAHGMZ-JOQOYGCGSA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1noc([C@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685667 1139986209 /nfs/dbraw/zinc/98/62/09/1139986209.db2.gz RLFWDKNBSQVDCM-OCCSQVGLSA-N 1 0 330.388 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185466107 1140151494 /nfs/dbraw/zinc/15/14/94/1140151494.db2.gz ZNODVLBQGPZHQX-INIZCTEOSA-N 1 0 340.423 3.948 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000189951298 1140373836 /nfs/dbraw/zinc/37/38/36/1140373836.db2.gz VUBOLPFYLSTQKL-HNNXBMFYSA-N 1 0 347.459 3.522 20 5 EHBDRO COCc1ccccc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192632664 1140541907 /nfs/dbraw/zinc/54/19/07/1140541907.db2.gz NSSSMMMSRWWAOY-IBGZPJMESA-N 1 0 326.396 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(-n3cccn3)cc1)CCC2 ZINC000192675980 1140543384 /nfs/dbraw/zinc/54/33/84/1140543384.db2.gz MODXAWYDCSWBQF-HXUWFJFHSA-N 1 0 348.406 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCCCO)o2)c(Cl)c1 ZINC000192905399 1140555313 /nfs/dbraw/zinc/55/53/13/1140555313.db2.gz BWZSZFLIFDYKMB-UHFFFAOYSA-N 1 0 338.791 3.760 20 5 EHBDRO CC[NH+](CC)Cc1cccc(CNc2cc(N)ccc2[N+](=O)[O-])c1 ZINC000193389023 1140574034 /nfs/dbraw/zinc/57/40/34/1140574034.db2.gz VJXGGNQTYMTYKI-UHFFFAOYSA-N 1 0 328.416 3.631 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781848 1140724257 /nfs/dbraw/zinc/72/42/57/1140724257.db2.gz NEASNZXHJZMKDP-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309594 1140918695 /nfs/dbraw/zinc/91/86/95/1140918695.db2.gz XAKOPLIAXABHPX-NVXWUHKLSA-N 1 0 330.384 3.584 20 5 EHBDRO CO[C@@H](C)c1nc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000269125252 1141068639 /nfs/dbraw/zinc/06/86/39/1141068639.db2.gz YINIHRZEEZQEFJ-OLZOCXBDSA-N 1 0 349.456 3.870 20 5 EHBDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636326 1141129656 /nfs/dbraw/zinc/12/96/56/1141129656.db2.gz AOPCBQVRUAMYFF-GTNSWQLSSA-N 1 0 336.338 3.599 20 5 EHBDRO CCOc1ccc([C@@H](C)NC2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025753 1141296562 /nfs/dbraw/zinc/29/65/62/1141296562.db2.gz BCQKHZXNUIZQRZ-CQSZACIVSA-N 1 0 347.459 3.661 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000271159272 1141316708 /nfs/dbraw/zinc/31/67/08/1141316708.db2.gz RTKCOQDRUMMRLA-ZDUSSCGKSA-N 1 0 330.384 3.592 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000271212723 1141327049 /nfs/dbraw/zinc/32/70/49/1141327049.db2.gz DMOIAQGYHMZFDE-CYBMUJFWSA-N 1 0 329.400 3.520 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258087 1141335058 /nfs/dbraw/zinc/33/50/58/1141335058.db2.gz ACNPFXXMGUQUQT-OLZOCXBDSA-N 1 0 347.440 3.623 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000271262810 1141336436 /nfs/dbraw/zinc/33/64/36/1141336436.db2.gz AVOJDITZKHEIDE-KGLIPLIRSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCc1nccs1)C1CC1 ZINC000271476370 1141376961 /nfs/dbraw/zinc/37/69/61/1141376961.db2.gz JPGBLDCVFKXKGO-OAHLLOKOSA-N 1 0 331.441 3.595 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)Cc1cc(C)n[nH]1 ZINC000271482963 1141378200 /nfs/dbraw/zinc/37/82/00/1141378200.db2.gz JFHSMLHENLXTFT-GXTWGEPZSA-N 1 0 348.472 3.718 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[C@@H](C)O ZINC000271496465 1141381523 /nfs/dbraw/zinc/38/15/23/1141381523.db2.gz MODNGYSCTPXXPR-ZIAGYGMSSA-N 1 0 340.489 3.852 20 5 EHBDRO COc1ccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000536672116 1032105629 /nfs/dbraw/zinc/10/56/29/1032105629.db2.gz ABRRICAXJBPNFX-WMLDXEAASA-N 1 0 326.396 3.981 20 5 EHBDRO COCCOc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000154079231 1014968616 /nfs/dbraw/zinc/96/86/16/1014968616.db2.gz LLYHVQFODBKKIK-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@@H+](Cc2ccc([N+](=O)[O-])cc2OC)C1 ZINC000430223784 1015100414 /nfs/dbraw/zinc/10/04/14/1015100414.db2.gz VTTHHIFAUUVUNQ-AWEZNQCLSA-N 1 0 342.395 3.602 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000120524047 1015404280 /nfs/dbraw/zinc/40/42/80/1015404280.db2.gz YCHZNQKXWBZIJV-ACJLOTCBSA-N 1 0 348.830 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000134796584 1015805900 /nfs/dbraw/zinc/80/59/00/1015805900.db2.gz VZFNFTRZJMLAMS-MOPGFXCFSA-N 1 0 344.386 3.822 20 5 EHBDRO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432095 1016240501 /nfs/dbraw/zinc/24/05/01/1016240501.db2.gz RDKJEEDLWGEHKI-CHWSQXEVSA-N 1 0 336.823 3.569 20 5 EHBDRO CC[C@@H](CSC)[N@H+](C)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000167416845 1034880626 /nfs/dbraw/zinc/88/06/26/1034880626.db2.gz LTIQHKJPUSWSSO-NSHDSACASA-N 1 0 347.278 3.931 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@@H]3CCO)s2)cc1 ZINC000189930298 1016780120 /nfs/dbraw/zinc/78/01/20/1016780120.db2.gz TYNAQHVGLPAPHP-DYVFJYSZSA-N 1 0 346.452 3.964 20 5 EHBDRO C[N@@H+]1CC[C@@H](NCc2ccccc2[N+](=O)[O-])C[C@@H]1c1ccccc1 ZINC000340283535 1016857528 /nfs/dbraw/zinc/85/75/28/1016857528.db2.gz YTWMDWGSDRCURK-IEBWSBKVSA-N 1 0 325.412 3.520 20 5 EHBDRO COC1(C[C@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCC1 ZINC000573194135 1032155975 /nfs/dbraw/zinc/15/59/75/1032155975.db2.gz HMKGLPAXTLTFAL-ZDUSSCGKSA-N 1 0 331.416 3.556 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000449077017 1032166450 /nfs/dbraw/zinc/16/64/50/1032166450.db2.gz QOYHBSOOYFERSA-IRXDYDNUSA-N 1 0 339.439 3.642 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@H]1OC ZINC000538194817 1032211495 /nfs/dbraw/zinc/21/14/95/1032211495.db2.gz MJEREIDZCSSXQV-IIAWOOMASA-N 1 0 338.473 3.870 20 5 EHBDRO COC(=O)c1cccc2c1CCN([C@@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540349 1032257919 /nfs/dbraw/zinc/25/79/19/1032257919.db2.gz DKUMPJNODICKMM-ZDUSSCGKSA-N 1 0 340.379 3.501 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000449191284 1032286934 /nfs/dbraw/zinc/28/69/34/1032286934.db2.gz XAQASNRNJSQBCB-CRAIPNDOSA-N 1 0 327.428 3.950 20 5 EHBDRO Cn1cc(C[NH+]2CC3(C2)CCCCC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000459601679 1032321197 /nfs/dbraw/zinc/32/11/97/1032321197.db2.gz YQBWFIYYZVQSMD-UHFFFAOYSA-N 1 0 340.427 3.761 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)NC[C@@H]1CCC[N@@H+](CC(C)C)C1 ZINC000536835053 1032331231 /nfs/dbraw/zinc/33/12/31/1032331231.db2.gz ZGSGKAUHUBYGMZ-IRXDYDNUSA-N 1 0 333.476 3.922 20 5 EHBDRO C[C@@H]1c2cc(F)cc(F)c2CCN1CCOc1cccc([N+](=O)[O-])c1 ZINC001168157750 1032336577 /nfs/dbraw/zinc/33/65/77/1032336577.db2.gz ZBYHMKAHFXCVDO-GFCCVEGCSA-N 1 0 348.349 3.871 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000459665809 1032392592 /nfs/dbraw/zinc/39/25/92/1032392592.db2.gz LKEWUUKLZQZMAS-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CCC[NH2+][C@@H](C)C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000449282244 1032401213 /nfs/dbraw/zinc/40/12/13/1032401213.db2.gz HAITYPBKFRDDSP-ZDUSSCGKSA-N 1 0 343.383 3.714 20 5 EHBDRO CCO[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449287712 1032404505 /nfs/dbraw/zinc/40/45/05/1032404505.db2.gz LCOHCPGAIHTMTO-HNAYVOBHSA-N 1 0 328.412 3.893 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCC(O)(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000536908451 1032421810 /nfs/dbraw/zinc/42/18/10/1032421810.db2.gz FPUDPGAMWTVEEH-ZOODHJKOSA-N 1 0 346.349 3.790 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc2ccccc2s1 ZINC000449320981 1032453953 /nfs/dbraw/zinc/45/39/53/1032453953.db2.gz QJOYKWHKCBYUAQ-CYBMUJFWSA-N 1 0 341.436 3.968 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000536987856 1032463786 /nfs/dbraw/zinc/46/37/86/1032463786.db2.gz NMYZJZFVXJBNRI-CQSZACIVSA-N 1 0 335.448 3.916 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000536987855 1032464113 /nfs/dbraw/zinc/46/41/13/1032464113.db2.gz NMYZJZFVXJBNRI-AWEZNQCLSA-N 1 0 335.448 3.916 20 5 EHBDRO C[C@H]([NH2+]CC(=O)NCCCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000537074362 1032507571 /nfs/dbraw/zinc/50/75/71/1032507571.db2.gz FLBACMRQNGENOP-HNNXBMFYSA-N 1 0 347.459 3.722 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000449487515 1032642591 /nfs/dbraw/zinc/64/25/91/1032642591.db2.gz YUCLCLRDWQKVAQ-SFHVURJKSA-N 1 0 342.443 3.978 20 5 EHBDRO CC(C)n1nccc1C[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449501593 1032682611 /nfs/dbraw/zinc/68/26/11/1032682611.db2.gz QCDRCNXWEFFFIL-MRXNPFEDSA-N 1 0 328.416 3.752 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000472649752 1017202460 /nfs/dbraw/zinc/20/24/60/1017202460.db2.gz VEJONHNFBAZHSC-CWRNSKLLSA-N 1 0 348.472 3.805 20 5 EHBDRO C[C@@H]([NH3+])c1ccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)cc1 ZINC000414803470 1017204078 /nfs/dbraw/zinc/20/40/78/1017204078.db2.gz JJYQALDWLQUJIO-SNVBAGLBSA-N 1 0 337.326 3.828 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C[C@@H]1C ZINC000449503709 1032686855 /nfs/dbraw/zinc/68/68/55/1032686855.db2.gz POYAAWOOLDDRTH-GUYCJALGSA-N 1 0 330.384 3.712 20 5 EHBDRO N[C@H](C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842979 1017232264 /nfs/dbraw/zinc/23/22/64/1017232264.db2.gz ZXVIWHXCRVTCEP-BHIYHBOVSA-N 1 0 339.439 3.596 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000190052615 1017263310 /nfs/dbraw/zinc/26/33/10/1017263310.db2.gz KEKKBGWERSCMSZ-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000414958944 1017344716 /nfs/dbraw/zinc/34/47/16/1017344716.db2.gz DZSOJMHRHVKCCZ-VQIMIIECSA-N 1 0 339.439 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCCC[NH2+]C3CC3)o2)c(Cl)c1 ZINC000415070579 1017512633 /nfs/dbraw/zinc/51/26/33/1017512633.db2.gz RCDSVWZUMMPMGD-UHFFFAOYSA-N 1 0 349.818 3.740 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2coc3ccccc23)n1 ZINC000340450651 1017875438 /nfs/dbraw/zinc/87/54/38/1017875438.db2.gz NUGGMMZBDIFHMI-CVEARBPZSA-N 1 0 340.383 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NC1CC[NH+](C2CCCC2)CC1 ZINC000593467170 1032734248 /nfs/dbraw/zinc/73/42/48/1032734248.db2.gz HFRYOKZHWJMSCD-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000388351919 1017971718 /nfs/dbraw/zinc/97/17/18/1017971718.db2.gz ADDQDXSPZZGJQF-JSGCOSHPSA-N 1 0 326.824 3.764 20 5 EHBDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064327 1017973353 /nfs/dbraw/zinc/97/33/53/1017973353.db2.gz NANVFCRWJOEMKS-SWLSCSKDSA-N 1 0 335.429 3.890 20 5 EHBDRO CCN(CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000517550817 1018301515 /nfs/dbraw/zinc/30/15/15/1018301515.db2.gz NFGLJAFFIFWELE-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000592399341 1032756583 /nfs/dbraw/zinc/75/65/83/1032756583.db2.gz XKKGQWZYBAVSAS-MZMPZRCHSA-N 1 0 327.384 3.561 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]Cc3cccnc3)o2)c([N+](=O)[O-])c1 ZINC000102419131 1018527272 /nfs/dbraw/zinc/52/72/72/1018527272.db2.gz WGQZZKPABWGDJD-UHFFFAOYSA-N 1 0 339.351 3.548 20 5 EHBDRO C[C@@H]1C[C@@H](NCc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000379637250 1019011788 /nfs/dbraw/zinc/01/17/88/1019011788.db2.gz SHBRLPZFBRZXLD-APWZRJJASA-N 1 0 339.439 3.738 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182329614 1019065659 /nfs/dbraw/zinc/06/56/59/1019065659.db2.gz FIXOLYODEIKMGI-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@H]1[C@H]([NH+](C)C)CCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000647832264 1019718917 /nfs/dbraw/zinc/71/89/17/1019718917.db2.gz XFTNLRUJKCEODC-IFXJQAMLSA-N 1 0 333.435 3.553 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCO[C@@H](C)C1 ZINC000537766092 1020087870 /nfs/dbraw/zinc/08/78/70/1020087870.db2.gz CFUMNMSTUPCZEF-RRFJBIMHSA-N 1 0 338.473 3.870 20 5 EHBDRO CCC[C@H]([NH2+]Cc1cccc(C(=O)NC)c1)c1cccc([N+](=O)[O-])c1 ZINC000155879875 1020122001 /nfs/dbraw/zinc/12/20/01/1020122001.db2.gz FWOUGINPQJCPBO-SFHVURJKSA-N 1 0 341.411 3.585 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(F)ccc1[N+](=O)[O-])c1ccccc1-n1cccn1 ZINC000183144681 1020392251 /nfs/dbraw/zinc/39/22/51/1020392251.db2.gz DFUOOEFZZULESL-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169796 1020498955 /nfs/dbraw/zinc/49/89/55/1020498955.db2.gz MGICBUAQHOGBFX-SUMWQHHRSA-N 1 0 328.416 3.515 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]2COCC[C@@H]21 ZINC000602485463 1032914767 /nfs/dbraw/zinc/91/47/67/1032914767.db2.gz QRDDEVWPNMBQBA-OCCSQVGLSA-N 1 0 344.333 3.615 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000177965142 1020648505 /nfs/dbraw/zinc/64/85/05/1020648505.db2.gz IXCQRQJIOAEEMN-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO CO[C@H]([C@@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000449629109 1032929357 /nfs/dbraw/zinc/92/93/57/1032929357.db2.gz KBUXFAKJJGHEIC-BDJLRTHQSA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000426296736 1021200811 /nfs/dbraw/zinc/20/08/11/1021200811.db2.gz SXDUSVQPEIWOBX-ZFWWWQNUSA-N 1 0 329.375 3.663 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)COC ZINC000426336016 1021316069 /nfs/dbraw/zinc/31/60/69/1021316069.db2.gz RTVXXSQQALFYNL-ZDUSSCGKSA-N 1 0 326.462 3.728 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000894847623 1021356035 /nfs/dbraw/zinc/35/60/35/1021356035.db2.gz DIRZNMYCJKGUHC-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC2(CCOCC2)CC1 ZINC000344620906 1021498493 /nfs/dbraw/zinc/49/84/93/1021498493.db2.gz ZCJKSWBOQOVBSS-UHFFFAOYSA-N 1 0 348.443 3.823 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449655595 1032985400 /nfs/dbraw/zinc/98/54/00/1032985400.db2.gz ZMGANZQYYILTON-KRWDZBQOSA-N 1 0 325.412 3.964 20 5 EHBDRO CCC[NH+]1CCC(NCc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602586683 1032986809 /nfs/dbraw/zinc/98/68/09/1032986809.db2.gz MNEYZQCZIYGJHM-UHFFFAOYSA-N 1 0 345.365 3.578 20 5 EHBDRO CCC(CC)[C@@H]1C[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590252 1032988361 /nfs/dbraw/zinc/98/83/61/1032988361.db2.gz YGCNKDOCWISTEA-DYVFJYSZSA-N 1 0 347.415 3.809 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@H](C)C1 ZINC000127275141 1021670312 /nfs/dbraw/zinc/67/03/12/1021670312.db2.gz SUSAXAMKTUKPHK-QWHCGFSZSA-N 1 0 330.388 3.513 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C34CC5CC(CC(C5)C3)C4)nc2c1 ZINC000602584722 1033006106 /nfs/dbraw/zinc/00/61/06/1033006106.db2.gz JXFNXDXGPHFEME-UHFFFAOYSA-N 1 0 327.384 3.794 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]3CCC[C@@H]32)cc1[N+](=O)[O-] ZINC000519076395 1021818470 /nfs/dbraw/zinc/81/84/70/1021818470.db2.gz WYWARRUBFIQXSP-SJORKVTESA-N 1 0 330.428 3.684 20 5 EHBDRO C[C@@H]1C[C@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602607311 1033024265 /nfs/dbraw/zinc/02/42/65/1033024265.db2.gz HWYOLZIMPMJWMH-VXGBXAGGSA-N 1 0 346.349 3.908 20 5 EHBDRO CCCCN(CCCC)C(=O)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000060657846 1022087333 /nfs/dbraw/zinc/08/73/33/1022087333.db2.gz WQKPLSRHACBYSK-UHFFFAOYSA-N 1 0 344.415 3.823 20 5 EHBDRO O=c1[nH]c2cccc(CN(Cc3ccccc3[N+](=O)[O-])C3CC3)c2o1 ZINC000891622777 1022133832 /nfs/dbraw/zinc/13/38/32/1022133832.db2.gz JTPRCTHWFVRUCH-UHFFFAOYSA-N 1 0 339.351 3.606 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000178204892 1022141270 /nfs/dbraw/zinc/14/12/70/1022141270.db2.gz OBMIJYQMLTXVIW-CQSZACIVSA-N 1 0 342.395 3.568 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000517287581 1022213606 /nfs/dbraw/zinc/21/36/06/1022213606.db2.gz MSYJNNALQMBIPL-HZPDHXFCSA-N 1 0 345.399 3.563 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@@H](OC)C3)o2)c([N+](=O)[O-])c1 ZINC000471819817 1022400768 /nfs/dbraw/zinc/40/07/68/1022400768.db2.gz DOLXHLMIUARDPE-QWHCGFSZSA-N 1 0 346.383 3.521 20 5 EHBDRO CC(=O)c1cc(NC[C@@H](c2ccc(C)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000550386438 1022418820 /nfs/dbraw/zinc/41/88/20/1022418820.db2.gz GXCXETBOYKLLRX-IBGZPJMESA-N 1 0 341.411 3.821 20 5 EHBDRO Cc1cccnc1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602686571 1033066576 /nfs/dbraw/zinc/06/65/76/1033066576.db2.gz XMCXKPAKYMTTGH-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO CC(C)c1ccc(CC[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000426005720 1022653422 /nfs/dbraw/zinc/65/34/22/1022653422.db2.gz YIXPXLXQZHVPKB-UHFFFAOYSA-N 1 0 342.443 3.794 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602697133 1033075907 /nfs/dbraw/zinc/07/59/07/1033075907.db2.gz IARDJUUJYNZTCL-CHWSQXEVSA-N 1 0 332.322 3.661 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000550211582 1022763372 /nfs/dbraw/zinc/76/33/72/1022763372.db2.gz HJBRODFURDXPMS-DOTOQJQBSA-N 1 0 348.443 3.895 20 5 EHBDRO COc1cccc2c1CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000426060248 1022787810 /nfs/dbraw/zinc/78/78/10/1022787810.db2.gz RBOJGKYKBHFVJF-MRXNPFEDSA-N 1 0 326.396 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CO)CCCCC3)o2)cc1 ZINC000610583432 1022809133 /nfs/dbraw/zinc/80/91/33/1022809133.db2.gz FPYDXKYKMJRVBO-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C3(Cc4ccc(F)cc4)CC3)nc2c1 ZINC000602682679 1033082927 /nfs/dbraw/zinc/08/29/27/1033082927.db2.gz OLVAQTFKRAOKLB-UHFFFAOYSA-N 1 0 341.342 3.740 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@]2(CC2(F)F)C1 ZINC000602704177 1033093257 /nfs/dbraw/zinc/09/32/57/1033093257.db2.gz GFYWRZHYQZIAOA-GFCCVEGCSA-N 1 0 336.260 3.845 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NCc1cccc(C[NH+]2CCCC2)c1 ZINC000341746102 1023246919 /nfs/dbraw/zinc/24/69/19/1023246919.db2.gz WPSVFWMEXOJDJQ-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO CCOc1cc(C[NH2+]C2(c3cccc(OC)c3)CC2)ccc1[N+](=O)[O-] ZINC000276864704 1023258182 /nfs/dbraw/zinc/25/81/82/1023258182.db2.gz GWCGYQAJQJRIQP-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)[C@@H]1CCCCO1 ZINC000610717406 1023336837 /nfs/dbraw/zinc/33/68/37/1023336837.db2.gz FUYBKVCAOJSUTC-KRWDZBQOSA-N 1 0 336.432 3.678 20 5 EHBDRO CC1(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])CCC2(CC1)OCCO2 ZINC000897720558 1033134776 /nfs/dbraw/zinc/13/47/76/1033134776.db2.gz VNWHPWBXKSPEDQ-GQCTYLIASA-N 1 0 346.427 3.521 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000610798229 1023656356 /nfs/dbraw/zinc/65/63/56/1023656356.db2.gz GPGFPNBGJXNVLR-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000065202263 1023892153 /nfs/dbraw/zinc/89/21/53/1023892153.db2.gz QRHLCXDCNNNIIC-KRWDZBQOSA-N 1 0 325.412 3.919 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000610996947 1023992639 /nfs/dbraw/zinc/99/26/39/1023992639.db2.gz OLHBDIGMWGEXPY-AWEZNQCLSA-N 1 0 334.416 3.711 20 5 EHBDRO Cn1cc(C[NH2+][C@H](c2ccc(Cl)cc2)C2CCC2)c([N+](=O)[O-])n1 ZINC000602808811 1033183024 /nfs/dbraw/zinc/18/30/24/1033183024.db2.gz ZRFZPQFSQQGBNY-HNNXBMFYSA-N 1 0 334.807 3.613 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000126836673 1024213920 /nfs/dbraw/zinc/21/39/20/1024213920.db2.gz UEBOOGROKYCWQC-OAHLLOKOSA-N 1 0 342.443 3.995 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000443643643 1024306242 /nfs/dbraw/zinc/30/62/42/1024306242.db2.gz SEOLYIDDGLRGJV-ZIAGYGMSSA-N 1 0 333.432 3.600 20 5 EHBDRO CC(C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC(C)(C)C1 ZINC000449780548 1033207596 /nfs/dbraw/zinc/20/75/96/1033207596.db2.gz GKCHVDYTVLZQSO-UHFFFAOYSA-N 1 0 334.416 3.860 20 5 EHBDRO Cn1cc(C[NH2+]C2CCC3(CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434777396 1024416695 /nfs/dbraw/zinc/41/66/95/1024416695.db2.gz PTWSZQWXGZTVBR-UHFFFAOYSA-N 1 0 340.427 3.808 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)c1ncc(Cl)cc1[N+](=O)[O-] ZINC000434953337 1024523422 /nfs/dbraw/zinc/52/34/22/1024523422.db2.gz AZVZNQKEXFAXMK-UHFFFAOYSA-N 1 0 348.834 3.731 20 5 EHBDRO CCn1nc(CNCc2ccc([N+](=O)[O-])cc2Cl)c2ccccc21 ZINC000472060478 1024531495 /nfs/dbraw/zinc/53/14/95/1024531495.db2.gz UXLGQYKOXXQMGC-UHFFFAOYSA-N 1 0 344.802 3.908 20 5 EHBDRO Cn1cc(C[NH2+][C@H]2CCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000346220805 1024533814 /nfs/dbraw/zinc/53/38/14/1024533814.db2.gz KIJXENRPVOTZHV-HNNXBMFYSA-N 1 0 328.416 3.664 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000514593753 1024594389 /nfs/dbraw/zinc/59/43/89/1024594389.db2.gz WZFRMRCDGNZVRG-SFHVURJKSA-N 1 0 344.411 3.742 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])cc1F)[N@@H+]1CCc2ccccc2C1 ZINC000520748292 1024608299 /nfs/dbraw/zinc/60/82/99/1024608299.db2.gz KBAWLNSBGNDMRQ-CYBMUJFWSA-N 1 0 329.375 3.593 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](CCCO)C2)s1 ZINC000449793070 1033237141 /nfs/dbraw/zinc/23/71/41/1033237141.db2.gz VPWVPXFNZVQOJH-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000514892762 1024838765 /nfs/dbraw/zinc/83/87/65/1024838765.db2.gz BAPUVPWRCTZNCY-ZIAGYGMSSA-N 1 0 348.447 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CO)CCCC3)s2)cc1 ZINC000472130161 1024994229 /nfs/dbraw/zinc/99/42/29/1024994229.db2.gz KQSVQKVMVQLXFL-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO Nc1c(F)c(NC[C@H]2CCC[N@@H+]2C2CCCCC2)ccc1[N+](=O)[O-] ZINC000435591227 1025022998 /nfs/dbraw/zinc/02/29/98/1025022998.db2.gz DABCVGSRMJOLCH-CYBMUJFWSA-N 1 0 336.411 3.525 20 5 EHBDRO C[N@H+](CCCOCCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000051383368 1025034005 /nfs/dbraw/zinc/03/40/05/1025034005.db2.gz QHZVSYBMKPBAEI-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc(OC)c1 ZINC000346785776 1025097661 /nfs/dbraw/zinc/09/76/61/1025097661.db2.gz AFDHQZLZYVFYKW-QGZVFWFLSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](c3cc(F)cc(F)c3)C2)cc1[N+](=O)[O-] ZINC000435748882 1025110254 /nfs/dbraw/zinc/11/02/54/1025110254.db2.gz QHUSXDNLVOYNGR-SAZUREKKSA-N 1 0 348.349 3.917 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccco2)[NH+]2CCCCC2)n1 ZINC000119809885 1025245933 /nfs/dbraw/zinc/24/59/33/1025245933.db2.gz XOOBFPGJZKPKNM-HNNXBMFYSA-N 1 0 330.388 3.530 20 5 EHBDRO CCCCN(C)C(=O)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000053241433 1025292272 /nfs/dbraw/zinc/29/22/72/1025292272.db2.gz VUWHTVOYBQEUFM-OAHLLOKOSA-N 1 0 347.459 3.626 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1cccc([N+](=O)[O-])c1 ZINC000119915935 1025423293 /nfs/dbraw/zinc/42/32/93/1025423293.db2.gz WBKHTYLKQJVHKU-OCCSQVGLSA-N 1 0 346.818 3.573 20 5 EHBDRO O=[N+]([O-])c1cnc(C(F)(F)F)cc1NCCC[NH2+]C1CCCCC1 ZINC000436309954 1025592069 /nfs/dbraw/zinc/59/20/69/1025592069.db2.gz TZFFNFURDNZJFT-UHFFFAOYSA-N 1 0 346.353 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CC[C@@H](O)[C@H]2c2ccc(Cl)cc2)cc1 ZINC000425549725 1025712269 /nfs/dbraw/zinc/71/22/69/1025712269.db2.gz LRHSEYNYDLUOEN-QZTJIDSGSA-N 1 0 346.814 3.599 20 5 EHBDRO Cn1cc(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2)c2ccc(F)cc21 ZINC000185745143 1025743972 /nfs/dbraw/zinc/74/39/72/1025743972.db2.gz LKZUMZPHFRHNEE-UHFFFAOYSA-N 1 0 327.359 3.558 20 5 EHBDRO C[C@H](CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C[NH+]1CCCC1 ZINC000516073907 1025951247 /nfs/dbraw/zinc/95/12/47/1025951247.db2.gz FLROKKYAUOMTCZ-IUODEOHRSA-N 1 0 345.365 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](CCO)c2ccc(Cl)c(F)c2)cc1 ZINC000601136741 1025958037 /nfs/dbraw/zinc/95/80/37/1025958037.db2.gz KGSMUROHACJWEB-MRXNPFEDSA-N 1 0 338.766 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCO[C@H]3CCCCO3)C2)cc1 ZINC000451550475 1026101885 /nfs/dbraw/zinc/10/18/85/1026101885.db2.gz RWDMXBSULQQXDV-HKUYNNGSSA-N 1 0 348.443 3.708 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2c2ccc(Cl)cc2)c1 ZINC000451732156 1026240050 /nfs/dbraw/zinc/24/00/50/1026240050.db2.gz GDPWLDRZJWEAPV-MRXNPFEDSA-N 1 0 334.807 3.672 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](CO)c1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000562045735 1026265635 /nfs/dbraw/zinc/26/56/35/1026265635.db2.gz NVSJQSHUNTWGLG-TZMCWYRMSA-N 1 0 334.803 3.675 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000127107300 1026274111 /nfs/dbraw/zinc/27/41/11/1026274111.db2.gz ZLRRFOYRXVMOSR-OAHLLOKOSA-N 1 0 343.427 3.812 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])nc3)cc2)C1 ZINC000339002123 1026334660 /nfs/dbraw/zinc/33/46/60/1026334660.db2.gz HVWVESQJPOBOEC-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO Cc1cccc(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000475284238 1026440820 /nfs/dbraw/zinc/44/08/20/1026440820.db2.gz WEKCWWGMHXPTLX-VQIMIIECSA-N 1 0 339.439 3.842 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@@H](c1ccccc1)N(C)C ZINC000186327696 1026502040 /nfs/dbraw/zinc/50/20/40/1026502040.db2.gz SZBXIRMHOUOCJR-KHYOSLBOSA-N 1 0 327.428 3.937 20 5 EHBDRO COc1cc(C[NH+]2CCCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000127931898 1026641840 /nfs/dbraw/zinc/64/18/40/1026641840.db2.gz FWYBXYZVTUGNLL-UHFFFAOYSA-N 1 0 342.395 3.778 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000186435594 1026889234 /nfs/dbraw/zinc/88/92/34/1026889234.db2.gz HUIPULZLAVBCSN-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@]3(C2)OCc2ccccc23)c1 ZINC000186438456 1026902304 /nfs/dbraw/zinc/90/23/04/1026902304.db2.gz JTYPHWYMYWUGND-GOSISDBHSA-N 1 0 344.798 3.880 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000531587149 1027076476 /nfs/dbraw/zinc/07/64/76/1027076476.db2.gz PLWMDMAKACANPA-AWEZNQCLSA-N 1 0 334.416 3.719 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@H](O)C(F)(F)F)C1 ZINC000277845596 1027250487 /nfs/dbraw/zinc/25/04/87/1027250487.db2.gz SMMASRNHWLXDDK-HUBLWGQQSA-N 1 0 346.349 3.599 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC([NH2+]CC2CC2)CC1 ZINC000420195055 1027394479 /nfs/dbraw/zinc/39/44/79/1027394479.db2.gz GOUNIPBXFWEUPO-UHFFFAOYSA-N 1 0 344.242 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCN2CC=CCC2)s1 ZINC000475514630 1027525366 /nfs/dbraw/zinc/52/53/66/1027525366.db2.gz YBGFWMCZEUGWIG-UHFFFAOYSA-N 1 0 343.452 3.675 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](Cc1ccccc1)CC1(CO)CC1 ZINC000342839576 1027575225 /nfs/dbraw/zinc/57/52/25/1027575225.db2.gz IOGOJTKUYKUXBX-UHFFFAOYSA-N 1 0 340.423 3.678 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000420631341 1027655862 /nfs/dbraw/zinc/65/58/62/1027655862.db2.gz VDCXNLXYHRKSCH-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293761147 1027662676 /nfs/dbraw/zinc/66/26/76/1027662676.db2.gz OXEUHSIFRNSDDK-NEPJUHHUSA-N 1 0 342.399 3.547 20 5 EHBDRO CC(C)(C)[C@H](Cn1ccnc1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783598630 1027714915 /nfs/dbraw/zinc/71/49/15/1027714915.db2.gz MMXLLPNWDGNMOP-HNNXBMFYSA-N 1 0 336.823 3.649 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000366690874 1027742162 /nfs/dbraw/zinc/74/21/62/1027742162.db2.gz BDGZKTYHLCPECG-KDOFPFPSSA-N 1 0 325.412 3.741 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(Cl)c1 ZINC000300241791 1027784294 /nfs/dbraw/zinc/78/42/94/1027784294.db2.gz RPZZFRIKFQXCSR-ZJUUUORDSA-N 1 0 330.215 3.940 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000178682040 1027872363 /nfs/dbraw/zinc/87/23/63/1027872363.db2.gz UKFYRGGLGSHUPF-JIDKMEAJSA-N 1 0 347.459 3.637 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H](CC(F)(F)F)C1 ZINC000420944261 1027902295 /nfs/dbraw/zinc/90/22/95/1027902295.db2.gz JGUSDVNDJBDTGX-GFCCVEGCSA-N 1 0 332.322 3.638 20 5 EHBDRO C[NH2+]Cc1ccccc1NC(=O)c1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000422739759 1027904311 /nfs/dbraw/zinc/90/43/11/1027904311.db2.gz MDFCRPFJHSJIQU-UHFFFAOYSA-N 1 0 327.384 3.690 20 5 EHBDRO CC[C@@](O)(CCC(F)(F)F)C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000897522293 1028221796 /nfs/dbraw/zinc/22/17/96/1028221796.db2.gz LGVUPMFRAJGOJA-ZQMJAJRESA-N 1 0 346.349 3.681 20 5 EHBDRO C[NH2+]C[C@@H](C)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285345 1028322416 /nfs/dbraw/zinc/32/24/16/1028322416.db2.gz ZJWABFRPJBNPGT-OLZOCXBDSA-N 1 0 333.457 3.829 20 5 EHBDRO C[C@@H](NC1CC[NH+](Cc2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000268738974 1028332134 /nfs/dbraw/zinc/33/21/34/1028332134.db2.gz OXPIEQQLWAEQGB-MRXNPFEDSA-N 1 0 339.439 3.910 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000421388720 1028362048 /nfs/dbraw/zinc/36/20/48/1028362048.db2.gz QIYPNNHPEJKNDD-GOEBONIOSA-N 1 0 330.384 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@]23CCOC3)s1 ZINC000421393517 1028368788 /nfs/dbraw/zinc/36/87/88/1028368788.db2.gz DZJXNUKYUKJEPB-QGZVFWFLSA-N 1 0 330.409 3.688 20 5 EHBDRO CC[NH2+][C@H](C)CN[C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423390897 1028404978 /nfs/dbraw/zinc/40/49/78/1028404978.db2.gz WLOQRHHONNYCPT-CHWSQXEVSA-N 1 0 333.457 3.972 20 5 EHBDRO COc1cc(F)c([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178734347 1028475756 /nfs/dbraw/zinc/47/57/56/1028475756.db2.gz QRHKWQNMPCUJRR-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO Cc1nc(C(C)(C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)sc1C ZINC000072865847 1028525182 /nfs/dbraw/zinc/52/51/82/1028525182.db2.gz OOFCSPAHPBIDBA-UHFFFAOYSA-N 1 0 335.429 3.572 20 5 EHBDRO Cc1ccccc1OCCC[N@@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000523701380 1028554823 /nfs/dbraw/zinc/55/48/23/1028554823.db2.gz PUOJXJOUFNKUQV-UHFFFAOYSA-N 1 0 328.412 3.847 20 5 EHBDRO C/C(=C\c1nc(C2([NH3+])CCCCC2)no1)c1ccc([N+](=O)[O-])cc1 ZINC000424340376 1029016410 /nfs/dbraw/zinc/01/64/10/1029016410.db2.gz GQEHSUYZIGTGLE-VAWYXSNFSA-N 1 0 328.372 3.656 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCN2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504930041 1029077390 /nfs/dbraw/zinc/07/73/90/1029077390.db2.gz MYVRYQPXFWRVRA-CABCVRRESA-N 1 0 335.448 3.519 20 5 EHBDRO O=C(CC[N@@H+]1CCCC2(CCCC2)C1)Nc1ccc([N+](=O)[O-])cc1 ZINC000445840602 1029181467 /nfs/dbraw/zinc/18/14/67/1029181467.db2.gz JJDQJHHBQDOZFS-UHFFFAOYSA-N 1 0 331.416 3.580 20 5 EHBDRO CO[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000249023606 1029284483 /nfs/dbraw/zinc/28/44/83/1029284483.db2.gz KOSXVWGRUAYTFQ-BHIYHBOVSA-N 1 0 326.396 3.841 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCCCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000446067689 1029383410 /nfs/dbraw/zinc/38/34/10/1029383410.db2.gz PCBOXIJITNBZCS-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO CC1(C)Cc2cccc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)c2O1 ZINC000324918841 1029390788 /nfs/dbraw/zinc/39/07/88/1029390788.db2.gz LCRVEQCQXJELJV-UHFFFAOYSA-N 1 0 326.396 3.641 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000533263477 1029564481 /nfs/dbraw/zinc/56/44/81/1029564481.db2.gz HVAQPCMSVJZZHV-LSDHHAIUSA-N 1 0 341.411 3.657 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cnn(C)c1 ZINC000525183402 1029732702 /nfs/dbraw/zinc/73/27/02/1029732702.db2.gz IQFGEVVGWBAJGD-GFCCVEGCSA-N 1 0 342.424 3.908 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H]2CCC[C@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000154141106 1029732828 /nfs/dbraw/zinc/73/28/28/1029732828.db2.gz SMTSRYDHQNRPOY-IMJJTQAJSA-N 1 0 335.448 3.517 20 5 EHBDRO CCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525410915 1029840068 /nfs/dbraw/zinc/84/00/68/1029840068.db2.gz PNTGINFIEMKSLV-NXHRZFHOSA-N 1 0 348.443 3.629 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508579741 1029872913 /nfs/dbraw/zinc/87/29/13/1029872913.db2.gz PWQOCJQOUNYMAE-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO Cc1cnccc1OC1CC[NH+](Cc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000447074758 1029922277 /nfs/dbraw/zinc/92/22/77/1029922277.db2.gz CNWPIXYDUCTNKQ-UHFFFAOYSA-N 1 0 341.411 3.650 20 5 EHBDRO Cc1c(-c2noc([C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000453246156 1029972242 /nfs/dbraw/zinc/97/22/42/1029972242.db2.gz CRVLYZWHKXJQBY-GVXVVHGQSA-N 1 0 330.388 3.887 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000192911171 1030037146 /nfs/dbraw/zinc/03/71/46/1030037146.db2.gz NOKQVKPYKYYNQA-QGZVFWFLSA-N 1 0 342.395 3.997 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCCOC2)s1 ZINC000237956296 1030139852 /nfs/dbraw/zinc/13/98/52/1030139852.db2.gz HOFSWNBSDVTAMT-ZDUSSCGKSA-N 1 0 332.425 3.840 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447393665 1030161218 /nfs/dbraw/zinc/16/12/18/1030161218.db2.gz KHKKFINUKZPARO-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCCc2cccc(F)c2)n1 ZINC000447530820 1030253607 /nfs/dbraw/zinc/25/36/07/1030253607.db2.gz PCEDBCZDZICGNQ-DLBZAZTESA-N 1 0 346.406 3.637 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccncc2)C1 ZINC000583603049 1030258703 /nfs/dbraw/zinc/25/87/03/1030258703.db2.gz HYBPHRIOTILXHN-INIZCTEOSA-N 1 0 341.411 3.767 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCSc2ccccc2)n1 ZINC000447514727 1030258985 /nfs/dbraw/zinc/25/89/85/1030258985.db2.gz HICCRBXSLAXGHK-CVEARBPZSA-N 1 0 346.456 3.657 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2ccnn2)cc1 ZINC000159865237 1030396295 /nfs/dbraw/zinc/39/62/95/1030396295.db2.gz LXZZZZREEDBHIW-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857408 1030398693 /nfs/dbraw/zinc/39/86/93/1030398693.db2.gz FTMJYEYWXIIASL-IBGZPJMESA-N 1 0 341.411 3.904 20 5 EHBDRO CC[C@H]([NH2+]CCc1cccc(OC)c1OC)c1cccc([N+](=O)[O-])c1 ZINC000532212138 1030481430 /nfs/dbraw/zinc/48/14/30/1030481430.db2.gz VUCLGLMWXRQNDY-KRWDZBQOSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(C(=O)CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000163429300 1030557492 /nfs/dbraw/zinc/55/74/92/1030557492.db2.gz CFEMBSNGHHIJSS-HNNXBMFYSA-N 1 0 347.459 3.591 20 5 EHBDRO COC(=O)C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000544420834 1030806356 /nfs/dbraw/zinc/80/63/56/1030806356.db2.gz DQNVEPWUFAOKCQ-INIZCTEOSA-N 1 0 334.416 3.505 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCSC(F)(F)F)cc1[N+](=O)[O-] ZINC000179404330 1030808101 /nfs/dbraw/zinc/80/81/01/1030808101.db2.gz PMRLRTWXFNYXDG-VIFPVBQESA-N 1 0 338.351 3.897 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCCc2nc(C(C)C)no2)cccc1[N+](=O)[O-] ZINC000160795447 1031025219 /nfs/dbraw/zinc/02/52/19/1031025219.db2.gz GWLHHUZLJHLAQA-CYBMUJFWSA-N 1 0 332.404 3.693 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCN(C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177392 1031076872 /nfs/dbraw/zinc/07/68/72/1031076872.db2.gz YKLAVQXVDLWFLU-ICSRJNTNSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc(C[N@@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)o1 ZINC000160843090 1031087845 /nfs/dbraw/zinc/08/78/45/1031087845.db2.gz FSBOXMHINJUUII-UHFFFAOYSA-N 1 0 340.383 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](CO)C1CCCCC1)CCC2 ZINC000551271965 1031183104 /nfs/dbraw/zinc/18/31/04/1031183104.db2.gz HIFPNVMUXLIUGC-APWZRJJASA-N 1 0 332.444 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@H](C[NH+]3CCCC3)C2)cc1C(F)(F)F ZINC000161100414 1031319774 /nfs/dbraw/zinc/31/97/74/1031319774.db2.gz NJMBGDJYMLOYDE-LBPRGKRZSA-N 1 0 343.349 3.536 20 5 EHBDRO CCOc1cc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)ccc1O ZINC000459294613 1031356462 /nfs/dbraw/zinc/35/64/62/1031356462.db2.gz HDPCBNDPGYUQMU-UHFFFAOYSA-N 1 0 342.395 3.864 20 5 EHBDRO CC1(C)C[N@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@@H]1C(F)(F)F ZINC000484359208 1031544450 /nfs/dbraw/zinc/54/44/50/1031544450.db2.gz WACYWFRJKSSSNJ-AWEZNQCLSA-N 1 0 346.349 3.884 20 5 EHBDRO CCC1(C)CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000782482302 1031928306 /nfs/dbraw/zinc/92/83/06/1031928306.db2.gz GJSBLHQFNWMISO-UHFFFAOYSA-N 1 0 337.395 3.575 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@]23C[C@H]2COC32CCC2)cc1[N+](=O)[O-] ZINC000898066179 1033310073 /nfs/dbraw/zinc/31/00/73/1033310073.db2.gz WYKCNTGWUASUOU-MAUKXSAKSA-N 1 0 330.428 3.767 20 5 EHBDRO CCOc1cncc(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000598677858 1033376999 /nfs/dbraw/zinc/37/69/99/1033376999.db2.gz BYJVGVVKCSKZGE-UHFFFAOYSA-N 1 0 327.384 3.553 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](CCCO)c1ccccc1 ZINC000594495266 1033397779 /nfs/dbraw/zinc/39/77/79/1033397779.db2.gz PGAZEJVJZSRJQS-ZWKOTPCHSA-N 1 0 326.396 3.686 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594502848 1033404995 /nfs/dbraw/zinc/40/49/95/1033404995.db2.gz QVDDHXUBJLVJEW-CVEARBPZSA-N 1 0 340.379 3.704 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC(C)(C)[NH3+] ZINC000594735309 1033507760 /nfs/dbraw/zinc/50/77/60/1033507760.db2.gz KWXONSACAHTOFS-UHFFFAOYSA-N 1 0 337.807 3.677 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000594925208 1033547253 /nfs/dbraw/zinc/54/72/53/1033547253.db2.gz MQHKISIOULAGEG-LSDHHAIUSA-N 1 0 344.411 3.859 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761293216 1033575363 /nfs/dbraw/zinc/57/53/63/1033575363.db2.gz TUIYLQZGPKCQBV-DZGCQCFKSA-N 1 0 348.472 3.816 20 5 EHBDRO COCc1csc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000594945295 1033590677 /nfs/dbraw/zinc/59/06/77/1033590677.db2.gz YBYBUQJTROBZMY-UHFFFAOYSA-N 1 0 340.832 3.788 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(C)CCCC[NH+]1CCCCC1 ZINC000603411277 1033591148 /nfs/dbraw/zinc/59/11/48/1033591148.db2.gz YRWKPCAJHRGFEE-UHFFFAOYSA-N 1 0 347.459 3.550 20 5 EHBDRO COCc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595010163 1033605787 /nfs/dbraw/zinc/60/57/87/1033605787.db2.gz HWKMBQJQPYUFAH-ZDUSSCGKSA-N 1 0 330.384 3.601 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc(C(F)(F)F)c1 ZINC000598955611 1033609406 /nfs/dbraw/zinc/60/94/06/1033609406.db2.gz RSDVEQWWKPYKSU-UHFFFAOYSA-N 1 0 340.301 3.912 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)[C@@H](C)c1ccccc1 ZINC000594999584 1033626357 /nfs/dbraw/zinc/62/63/57/1033626357.db2.gz CAPRUGYZUJASPS-SKBXDANDSA-N 1 0 340.423 3.752 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1CCN1C1CCCCC1 ZINC000598992026 1033644903 /nfs/dbraw/zinc/64/49/03/1033644903.db2.gz JQPCZTQHQCRJDA-JHTBKMLMSA-N 1 0 329.444 3.605 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595070514 1033646078 /nfs/dbraw/zinc/64/60/78/1033646078.db2.gz VKQLYUDVQKKESE-SCLBCKFNSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1ccc(C[NH2+][C@H](c2ccccn2)C2CCC2)cc1[N+](=O)[O-] ZINC000598993033 1033647117 /nfs/dbraw/zinc/64/71/17/1033647117.db2.gz IINVMCVBJXRBSV-SFHVURJKSA-N 1 0 327.384 3.629 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000595102100 1033691825 /nfs/dbraw/zinc/69/18/25/1033691825.db2.gz JOBJYIRXROGIAE-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](n2cccn2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000599054979 1033691903 /nfs/dbraw/zinc/69/19/03/1033691903.db2.gz DWKBXCUQCFGNHK-BXUZGUMPSA-N 1 0 342.321 3.554 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000595092838 1033700167 /nfs/dbraw/zinc/70/01/67/1033700167.db2.gz XJRDASLKEUTIPF-UGSOOPFHSA-N 1 0 326.396 3.899 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)OC)c1 ZINC000599061198 1033701266 /nfs/dbraw/zinc/70/12/66/1033701266.db2.gz LDFZZNHRJRCCIY-FZKQIMNGSA-N 1 0 330.384 3.642 20 5 EHBDRO Cc1c(NC(=O)c2ccc3c(c2)[C@@H](C[NH3+])CCC3)cccc1[N+](=O)[O-] ZINC000595252961 1033713917 /nfs/dbraw/zinc/71/39/17/1033713917.db2.gz KJBYOLRYXRULNY-OAHLLOKOSA-N 1 0 339.395 3.534 20 5 EHBDRO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])[C@H]1CCc2ccccc2C1 ZINC000595295167 1033721420 /nfs/dbraw/zinc/72/14/20/1033721420.db2.gz HJPDJXFRESIAMN-INIZCTEOSA-N 1 0 329.400 3.661 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC3(CC3(F)F)CC2)c1 ZINC000593673927 1033721645 /nfs/dbraw/zinc/72/16/45/1033721645.db2.gz MUTPLCRCWRQSLZ-UHFFFAOYSA-N 1 0 348.296 3.817 20 5 EHBDRO CO[C@H]1C[C@@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599090590 1033728463 /nfs/dbraw/zinc/72/84/63/1033728463.db2.gz FMTYHWCHZUYXLP-MDASCCDHSA-N 1 0 326.396 3.699 20 5 EHBDRO COCc1ccnc(N[C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000593698551 1033798875 /nfs/dbraw/zinc/79/88/75/1033798875.db2.gz SWDCGYPFAIFENM-NVXWUHKLSA-N 1 0 341.411 3.960 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC3(CO)CCC3)s2)cc1 ZINC000593694076 1033802269 /nfs/dbraw/zinc/80/22/69/1033802269.db2.gz UWQPTXZLMFUWAX-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000593724144 1033863869 /nfs/dbraw/zinc/86/38/69/1033863869.db2.gz XDWNEPZUUGPPOV-UWWQBHOKSA-N 1 0 332.444 3.711 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])c1 ZINC000059733267 1033909252 /nfs/dbraw/zinc/90/92/52/1033909252.db2.gz NCRGJNOSQADLSQ-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO O=[N+]([O-])c1ncccc1NC[C@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000603838592 1033950904 /nfs/dbraw/zinc/95/09/04/1033950904.db2.gz VLWKTEMURFKHOM-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603843267 1033966211 /nfs/dbraw/zinc/96/62/11/1033966211.db2.gz LOIBNZDOXFXGMA-KRWDZBQOSA-N 1 0 342.395 3.819 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787962 1033998177 /nfs/dbraw/zinc/99/81/77/1033998177.db2.gz LAZXWPQISLFDEP-SJLPKXTDSA-N 1 0 348.443 3.775 20 5 EHBDRO CC[C@@H](c1ccccc1)[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)C(C)C ZINC000595849669 1034007155 /nfs/dbraw/zinc/00/71/55/1034007155.db2.gz CLLCSKGGWFQMLY-SFHVURJKSA-N 1 0 343.427 3.618 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]Cc1cnccc1C(F)(F)F ZINC000596061733 1034066061 /nfs/dbraw/zinc/06/60/61/1034066061.db2.gz JBNHQWLCIZZPIX-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000599661302 1034091114 /nfs/dbraw/zinc/09/11/14/1034091114.db2.gz SPBGNWAFCVRGIV-UHFFFAOYSA-N 1 0 345.418 3.818 20 5 EHBDRO Cc1cc(NCC2CCN(c3cc[nH+]cc3)CC2)c([N+](=O)[O-])s1 ZINC000596184568 1034102558 /nfs/dbraw/zinc/10/25/58/1034102558.db2.gz MJUUDIUDYOGPDK-UHFFFAOYSA-N 1 0 332.429 3.688 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000596244815 1034133076 /nfs/dbraw/zinc/13/30/76/1034133076.db2.gz UNSZKSFSQIUMPK-OAHLLOKOSA-N 1 0 343.349 3.536 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604016833 1034142406 /nfs/dbraw/zinc/14/24/06/1034142406.db2.gz GKVBZQAMYNJEND-KRWDZBQOSA-N 1 0 344.386 3.950 20 5 EHBDRO CN(Cc1cc([N+](=O)[O-])ccc1Cl)C[C@@](C)(O)c1ccccc1 ZINC000179374577 1034260459 /nfs/dbraw/zinc/26/04/59/1034260459.db2.gz JRGZWXDYJYFBNC-QGZVFWFLSA-N 1 0 334.803 3.588 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)c1 ZINC000456269160 1034269477 /nfs/dbraw/zinc/26/94/77/1034269477.db2.gz JPSCYRIUUGVXOZ-QGZVFWFLSA-N 1 0 339.395 3.704 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(C)cc1 ZINC000892438686 1034295056 /nfs/dbraw/zinc/29/50/56/1034295056.db2.gz LYDBGYYOQRPFNE-HNNXBMFYSA-N 1 0 330.384 3.858 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)NC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000179455477 1034309706 /nfs/dbraw/zinc/30/97/06/1034309706.db2.gz MHFRTAIIKKYCBX-OAHLLOKOSA-N 1 0 349.475 3.760 20 5 EHBDRO C[C@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000596650809 1034348775 /nfs/dbraw/zinc/34/87/75/1034348775.db2.gz REFBMCBTCUATPN-MJXNMMHHSA-N 1 0 343.402 3.530 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000596706365 1034362335 /nfs/dbraw/zinc/36/23/35/1034362335.db2.gz FRKXNRXZYQBGOZ-UHFFFAOYSA-N 1 0 347.459 3.559 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](COC)C(C)C ZINC000534329518 1034404055 /nfs/dbraw/zinc/40/40/55/1034404055.db2.gz AZRZRRZRFZCPRM-UONOGXRCSA-N 1 0 326.462 3.726 20 5 EHBDRO CC[C@@H](c1ccccc1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000604508739 1034407304 /nfs/dbraw/zinc/40/73/04/1034407304.db2.gz RHDBXTSNFPZBNI-IBGZPJMESA-N 1 0 325.412 3.868 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000601519771 1034566788 /nfs/dbraw/zinc/56/67/88/1034566788.db2.gz IOFWQBMTIZPBLA-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO CCOc1ccccc1[C@@H](CC)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742857 1034599216 /nfs/dbraw/zinc/59/92/16/1034599216.db2.gz GZICGVKRLXCMSS-MSOLQXFVSA-N 1 0 344.411 3.768 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1=CCSC1 ZINC000597241928 1034621348 /nfs/dbraw/zinc/62/13/48/1034621348.db2.gz ASZKMNJWYLRPOT-UHFFFAOYSA-N 1 0 330.409 3.960 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000597225035 1034625394 /nfs/dbraw/zinc/62/53/94/1034625394.db2.gz LXIGQLRSVOSRPP-KUZNAAJDSA-N 1 0 330.428 3.889 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](c1ccccc1)[C@@H](C)O ZINC000597249327 1034641750 /nfs/dbraw/zinc/64/17/50/1034641750.db2.gz QAVZZQKVXUXAJO-NDVVBYJMSA-N 1 0 326.396 3.710 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC([C@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000612402090 1034893507 /nfs/dbraw/zinc/89/35/07/1034893507.db2.gz HQIRUXLSTNPBFL-KRWDZBQOSA-N 1 0 332.444 3.967 20 5 EHBDRO COCC[N@H+](CCCc1ccccc1)Cc1ccccc1[N+](=O)[O-] ZINC000065959210 1035029100 /nfs/dbraw/zinc/02/91/00/1035029100.db2.gz PSQGPQLEVOIYPF-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cccc4ccccc43)CC2)n1 ZINC000376035085 1035157404 /nfs/dbraw/zinc/15/74/04/1035157404.db2.gz PWDXCJHBKJILPH-UHFFFAOYSA-N 1 0 336.395 3.782 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC000467174768 1035344054 /nfs/dbraw/zinc/34/40/54/1035344054.db2.gz WHTHMYRBSWWSAI-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCCCCCC1 ZINC000003538921 1035397412 /nfs/dbraw/zinc/39/74/12/1035397412.db2.gz SOLMLAAQCPSESB-LBPRGKRZSA-N 1 0 339.823 3.841 20 5 EHBDRO C[C@H](c1ccccc1)[NH+]1CCC(Nc2ccc(N)cc2[N+](=O)[O-])CC1 ZINC000376204401 1035412313 /nfs/dbraw/zinc/41/23/13/1035412313.db2.gz ARXULKUGYQVIFM-CQSZACIVSA-N 1 0 340.427 3.815 20 5 EHBDRO CC1(C)C[C@H](N[C@@H]2CC[N@@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390419 1035434509 /nfs/dbraw/zinc/43/45/09/1035434509.db2.gz XJCHAXOGYFCURI-FGTMMUONSA-N 1 0 329.444 3.534 20 5 EHBDRO Cc1ccccc1C[N@@H+](C)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026197600 1035501527 /nfs/dbraw/zinc/50/15/27/1035501527.db2.gz NWHRDPYCMLXDLU-OAHLLOKOSA-N 1 0 341.411 3.671 20 5 EHBDRO Cc1cc(N2CCC[N@@H+](C(C)(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000540649745 1035539014 /nfs/dbraw/zinc/53/90/14/1035539014.db2.gz CBLFBPQLXSLNRB-UHFFFAOYSA-N 1 0 342.443 3.762 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000045004339 1035599703 /nfs/dbraw/zinc/59/97/03/1035599703.db2.gz BTFLIHAKJSPYJL-INIZCTEOSA-N 1 0 342.395 3.949 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C2(c3ccc4c(c3)OCO4)CC2)cccc1[N+](=O)[O-] ZINC000540749310 1035659310 /nfs/dbraw/zinc/65/93/10/1035659310.db2.gz APOUALDXIISPGG-CYBMUJFWSA-N 1 0 340.379 3.972 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000594610779 1035830336 /nfs/dbraw/zinc/83/03/36/1035830336.db2.gz CNKNFUKAOUGTHA-SSZFMOIBSA-N 1 0 331.460 3.804 20 5 EHBDRO C[NH2+][C@H]1CC[C@H](Oc2cc([N+](=O)[O-])c(C)cc2Br)CC1 ZINC001218190133 1036210093 /nfs/dbraw/zinc/21/00/93/1036210093.db2.gz WWLRXQRKZZLDGP-XYPYZODXSA-N 1 0 343.221 3.575 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CCC(CO)CC1 ZINC000589206132 1036312484 /nfs/dbraw/zinc/31/24/84/1036312484.db2.gz JNRFGSIMRFLBGF-UHFFFAOYSA-N 1 0 344.411 3.838 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000589243731 1036318338 /nfs/dbraw/zinc/31/83/38/1036318338.db2.gz MVRSUYJEAUBLRF-LBPRGKRZSA-N 1 0 340.383 3.721 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000026224403 1036394676 /nfs/dbraw/zinc/39/46/76/1036394676.db2.gz KBCSZDPSVIQEQG-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CCOc1cccc(NC[C@H](c2ccc(F)cc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000541551913 1036445356 /nfs/dbraw/zinc/44/53/56/1036445356.db2.gz SDGVRCIOSWGKPM-MRXNPFEDSA-N 1 0 347.390 3.847 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCO[C@H](CCc2ccccc2)C1 ZINC000541700135 1036574895 /nfs/dbraw/zinc/57/48/95/1036574895.db2.gz HXHWYXCCUWNHML-FUHWJXTLSA-N 1 0 340.423 3.989 20 5 EHBDRO O=C(C[C@@H]1CCCN1Cc1csc([N+](=O)[O-])c1)c1ccccc1 ZINC000122461468 1036595801 /nfs/dbraw/zinc/59/58/01/1036595801.db2.gz URZBMADEAQWMSS-HNNXBMFYSA-N 1 0 330.409 3.894 20 5 EHBDRO CC[C@@]1(C)CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777049 1036770221 /nfs/dbraw/zinc/77/02/21/1036770221.db2.gz OMTNRTNBKAGCSV-KSSFIOAISA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@](O)(C3CC3)C2)o1 ZINC000597206034 1036854202 /nfs/dbraw/zinc/85/42/02/1036854202.db2.gz POFZWIVDHVHUIF-LJQANCHMSA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@@H]([NH2+]CC[C@H](C)NC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000180521955 1036911735 /nfs/dbraw/zinc/91/17/35/1036911735.db2.gz ZLSRJRNNPLPAAU-QWHCGFSZSA-N 1 0 337.420 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2cccs2)C2(CO)CCC2)cc1 ZINC000452060799 1036953750 /nfs/dbraw/zinc/95/37/50/1036953750.db2.gz NGZQBVGYJFYZHX-QGZVFWFLSA-N 1 0 346.452 3.692 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000271705489 1036958154 /nfs/dbraw/zinc/95/81/54/1036958154.db2.gz IFYPVMKCMYTHNT-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@H](CC)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000152851822 1036996888 /nfs/dbraw/zinc/99/68/88/1036996888.db2.gz BNFYZLXCVRCXAT-HOCLYGCPSA-N 1 0 335.448 3.519 20 5 EHBDRO CCOC(CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)OCC ZINC000276264789 1037006548 /nfs/dbraw/zinc/00/65/48/1037006548.db2.gz UTKMZIZFMJFLFR-UHFFFAOYSA-N 1 0 348.399 3.734 20 5 EHBDRO c1ccc2c(c1)nc(NCC1([NH+]3CCCC3)COC1)c1ccccc21 ZINC001168450378 1037031256 /nfs/dbraw/zinc/03/12/56/1037031256.db2.gz NVCRMGLNRVSEDS-UHFFFAOYSA-N 1 0 333.435 3.665 20 5 EHBDRO C[N@H+](CCOCc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761514477 1037092400 /nfs/dbraw/zinc/09/24/00/1037092400.db2.gz JWZICLWROATROF-UHFFFAOYSA-N 1 0 334.803 3.897 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCCCC1 ZINC000761515450 1037093467 /nfs/dbraw/zinc/09/34/67/1037093467.db2.gz LQTSYSKSNVASMU-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(n1)CCC2 ZINC000590951367 1037138383 /nfs/dbraw/zinc/13/83/83/1037138383.db2.gz BTULYIXEUSXSBV-UHFFFAOYSA-N 1 0 325.412 3.889 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@H]1C1CC1 ZINC000542316383 1037282790 /nfs/dbraw/zinc/28/27/90/1037282790.db2.gz UHBSMFFDGTYYBX-RBUKOAKNSA-N 1 0 342.395 3.902 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000542322047 1037298071 /nfs/dbraw/zinc/29/80/71/1037298071.db2.gz GWIVBKXPPZLICK-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)Oc1cccc(C)c1 ZINC000462730035 1037329133 /nfs/dbraw/zinc/32/91/33/1037329133.db2.gz FHFIESQXZSBNJT-OAHLLOKOSA-N 1 0 344.411 3.859 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC1([C@@H](C)CCO)CCC1 ZINC000271813984 1037363133 /nfs/dbraw/zinc/36/31/33/1037363133.db2.gz BFTJINSZGKWZBU-JKSUJKDBSA-N 1 0 334.460 3.694 20 5 EHBDRO CC[N@@H+]1CCC[C@@H]1CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423958 1037451003 /nfs/dbraw/zinc/45/10/03/1037451003.db2.gz QGJNIIPLHOMHMM-UXHICEINSA-N 1 0 339.439 3.758 20 5 EHBDRO CC1(C)CCC[C@@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000549859689 1037459606 /nfs/dbraw/zinc/45/96/06/1037459606.db2.gz ZIZPAPHMBZUULJ-LJQANCHMSA-N 1 0 344.411 3.886 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1OC ZINC000532476525 1037515501 /nfs/dbraw/zinc/51/55/01/1037515501.db2.gz MWTITXXTIRGZNG-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1F ZINC000532483136 1037521013 /nfs/dbraw/zinc/52/10/13/1037521013.db2.gz PLOFHSDKLHZVOU-CYBMUJFWSA-N 1 0 332.375 3.944 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000532522758 1037549215 /nfs/dbraw/zinc/54/92/15/1037549215.db2.gz HVMOGMGFPYNLCF-JYYAWHABSA-N 1 0 345.443 3.870 20 5 EHBDRO COc1cc(NC[C@@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000462922747 1037550704 /nfs/dbraw/zinc/55/07/04/1037550704.db2.gz DJWUEOBPVOKHGO-INIZCTEOSA-N 1 0 349.818 3.972 20 5 EHBDRO CC[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC(C)(C)C1 ZINC000412036487 1037564486 /nfs/dbraw/zinc/56/44/86/1037564486.db2.gz MJDIAHLUTVFOEJ-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1ccccc1C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000540118279 1037582079 /nfs/dbraw/zinc/58/20/79/1037582079.db2.gz SVXLCYWLTKIVJE-QGZVFWFLSA-N 1 0 328.412 3.960 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000573576704 1037619903 /nfs/dbraw/zinc/61/99/03/1037619903.db2.gz MNTBXMBAMVWNGJ-CVEARBPZSA-N 1 0 328.343 3.835 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCN(C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000540154105 1037626187 /nfs/dbraw/zinc/62/61/87/1037626187.db2.gz VYHSENHDAXVHBO-QKYXUNIQSA-N 1 0 339.439 3.999 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000540173947 1037642058 /nfs/dbraw/zinc/64/20/58/1037642058.db2.gz NLMBMVKLTCKRAJ-BBATYDOGSA-N 1 0 330.359 3.766 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)N[C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000415937551 1037680787 /nfs/dbraw/zinc/68/07/87/1037680787.db2.gz XBPIGSAHDVBQKC-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO Cc1cccc(C(C)(C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000179590061 1037853055 /nfs/dbraw/zinc/85/30/55/1037853055.db2.gz IVJIMBZEGYTLAP-UHFFFAOYSA-N 1 0 341.411 3.675 20 5 EHBDRO CCCn1nc(C)c(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000897463918 1037869764 /nfs/dbraw/zinc/86/97/64/1037869764.db2.gz COCTWVHRAQOINJ-ZDUSSCGKSA-N 1 0 330.432 3.711 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475097 1037890129 /nfs/dbraw/zinc/89/01/29/1037890129.db2.gz PVAGFZCISSCSPP-KBXCAEBGSA-N 1 0 332.400 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C1CC1)C1CCCC1 ZINC000103466258 1037900475 /nfs/dbraw/zinc/90/04/75/1037900475.db2.gz WGRSXBZURFZOEJ-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000592393136 1037934094 /nfs/dbraw/zinc/93/40/94/1037934094.db2.gz FKBQORGHIHZAQX-ZJPYXAASSA-N 1 0 340.427 3.668 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(CO)cc1 ZINC000592393171 1037934259 /nfs/dbraw/zinc/93/42/59/1037934259.db2.gz QPHYKMXENMQCQH-INIZCTEOSA-N 1 0 346.452 3.748 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@@H]3C3CCC3)n2)cc1 ZINC000592198941 1037945276 /nfs/dbraw/zinc/94/52/76/1037945276.db2.gz MTWLXNQUWKXYPE-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](CC(C)C)c1ccncc1 ZINC000592387603 1037954774 /nfs/dbraw/zinc/95/47/74/1037954774.db2.gz WSRSHDBRNCYZMX-QGZVFWFLSA-N 1 0 329.400 3.875 20 5 EHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cc2n(n1)CCCC2 ZINC000592387710 1037954949 /nfs/dbraw/zinc/95/49/49/1037954949.db2.gz IMNGOBOOODONND-HNNXBMFYSA-N 1 0 342.443 3.801 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](c1cccs1)C1CC1 ZINC000540463544 1037964007 /nfs/dbraw/zinc/96/40/07/1037964007.db2.gz CQBDKJJVPVFHFI-KRWDZBQOSA-N 1 0 345.424 3.644 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000326034515 1038039311 /nfs/dbraw/zinc/03/93/11/1038039311.db2.gz ASRUPILRKGTVOT-QGZVFWFLSA-N 1 0 326.396 3.559 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000123655322 1038052539 /nfs/dbraw/zinc/05/25/39/1038052539.db2.gz ZRTHQOKLWVRXEZ-INIZCTEOSA-N 1 0 342.395 3.949 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(C(=O)C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000122878867 1038121993 /nfs/dbraw/zinc/12/19/93/1038121993.db2.gz CKPMEYMVISVCKO-AWEZNQCLSA-N 1 0 347.459 3.591 20 5 EHBDRO C[C@H]1CC[C@H]([N@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123757 1038359454 /nfs/dbraw/zinc/35/94/54/1038359454.db2.gz JOZUNRCOLRYLMO-AAEUAGOBSA-N 1 0 346.349 3.597 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC[C@H](C(C)C)[NH+]1CCCC1 ZINC000468655429 1038392845 /nfs/dbraw/zinc/39/28/45/1038392845.db2.gz KVQDFDQMULCRFC-KZIRBZLESA-N 1 0 331.460 3.708 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000470172233 1038449225 /nfs/dbraw/zinc/44/92/25/1038449225.db2.gz UCIFHHKMJDBRRU-WOVXLNPSSA-N 1 0 330.428 3.747 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)c1c(C)cc(C)c([N+](=O)[O-])c1C ZINC000538743505 1038509405 /nfs/dbraw/zinc/50/94/05/1038509405.db2.gz JTMVTNWGNFBDQZ-MRXNPFEDSA-N 1 0 347.459 3.514 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000538751732 1038515591 /nfs/dbraw/zinc/51/55/91/1038515591.db2.gz KKLZMCYQVAEUES-SFHVURJKSA-N 1 0 325.412 3.980 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000539040664 1038649175 /nfs/dbraw/zinc/64/91/75/1038649175.db2.gz XEZWHGKOZIKPCR-ZDUSSCGKSA-N 1 0 330.432 3.612 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967824 1038769383 /nfs/dbraw/zinc/76/93/83/1038769383.db2.gz FHEJZPQPHJFNCB-OLZOCXBDSA-N 1 0 334.416 3.860 20 5 EHBDRO CCSc1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000905409066 1038864577 /nfs/dbraw/zinc/86/45/77/1038864577.db2.gz FMXOQTOUHHZNRR-KRWDZBQOSA-N 1 0 332.425 3.530 20 5 EHBDRO CCSc1ccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000905410330 1038868488 /nfs/dbraw/zinc/86/84/88/1038868488.db2.gz SFUBQLMFPIOGEN-KRWDZBQOSA-N 1 0 332.425 3.530 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C2CC(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000554140921 1038961054 /nfs/dbraw/zinc/96/10/54/1038961054.db2.gz QBLBXKSHHLMHJS-GCVQQVDUSA-N 1 0 332.322 3.985 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCCC1 ZINC000477855861 1038964713 /nfs/dbraw/zinc/96/47/13/1038964713.db2.gz IZLXCYKKLQCUTI-UYAOXDASSA-N 1 0 346.471 3.837 20 5 EHBDRO C[C@@H]1COCC[C@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552099324 1038987119 /nfs/dbraw/zinc/98/71/19/1038987119.db2.gz FNOIBEHYGLKEQD-BPAFIMBUSA-N 1 0 340.423 3.946 20 5 EHBDRO C[C@H](C[NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000905644505 1039025103 /nfs/dbraw/zinc/02/51/03/1039025103.db2.gz RFKLEUVGHBJOOC-PXAZEXFGSA-N 1 0 334.803 3.675 20 5 EHBDRO CCOc1ccc([C@H](C)NCC(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000477926282 1039034270 /nfs/dbraw/zinc/03/42/70/1039034270.db2.gz GXDIQUBSRSUABF-HNNXBMFYSA-N 1 0 349.475 3.766 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1C ZINC000893280645 1039176842 /nfs/dbraw/zinc/17/68/42/1039176842.db2.gz ZAPOFBJWBNLBAU-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cc(F)cc(F)c1)C1CC1 ZINC000480278248 1039387534 /nfs/dbraw/zinc/38/75/34/1039387534.db2.gz ZXNRPEARIFXBSG-QGZVFWFLSA-N 1 0 332.350 3.984 20 5 EHBDRO Cc1ccc(NC(=O)CN(C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000485796179 1039548879 /nfs/dbraw/zinc/54/88/79/1039548879.db2.gz VDYIOQUVDBNDJQ-HNNXBMFYSA-N 1 0 341.411 3.843 20 5 EHBDRO CC(C)(C[NH2+]Cc1cccc([N+](=O)[O-])c1)Oc1cc(F)cc(F)c1 ZINC000512516472 1039548940 /nfs/dbraw/zinc/54/89/40/1039548940.db2.gz GWMBOOIWFWESNE-UHFFFAOYSA-N 1 0 336.338 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccccc2C[NH+]2CCCC2)c(F)c1 ZINC000042096955 1039590204 /nfs/dbraw/zinc/59/02/04/1039590204.db2.gz RDDDDXCWVDDDPE-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO C[C@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1cscn1 ZINC000697869597 1039620164 /nfs/dbraw/zinc/62/01/64/1039620164.db2.gz AJZGVUZBDYZDDM-QMMMGPOBSA-N 1 0 342.218 3.665 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)c1ccco1 ZINC000436312021 1039680236 /nfs/dbraw/zinc/68/02/36/1039680236.db2.gz LTJSGTPKAABLIG-MRXNPFEDSA-N 1 0 344.415 3.651 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](Cc2ccccc2)CN(C)C)cc1[N+](=O)[O-] ZINC000480877127 1040124140 /nfs/dbraw/zinc/12/41/40/1040124140.db2.gz KMWMXUFDXYZVLE-VQIMIIECSA-N 1 0 341.455 3.727 20 5 EHBDRO CC(C)CC[NH+](CCC(C)C)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000027272083 1040131566 /nfs/dbraw/zinc/13/15/66/1040131566.db2.gz JUVXEQSFVJIZSD-UHFFFAOYSA-N 1 0 335.448 3.588 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3Cl)C2)c1 ZINC000573622003 1040162492 /nfs/dbraw/zinc/16/24/92/1040162492.db2.gz UETUWASBXGRFAA-CQSZACIVSA-N 1 0 331.803 3.941 20 5 EHBDRO CSC1(CNc2c(C)cc([N+](=O)[O-])cc2Cl)CC[NH+](C)CC1 ZINC000555139155 1040225263 /nfs/dbraw/zinc/22/52/63/1040225263.db2.gz HBRCJTQNPLNTPS-UHFFFAOYSA-N 1 0 343.880 3.796 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC(C)(C)C[C@@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481094403 1040349935 /nfs/dbraw/zinc/34/99/35/1040349935.db2.gz WSIOAFZNFFOXQO-IHRRRGAJSA-N 1 0 333.432 3.726 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H]2CC[C@@H](C1)[N@@H+]2C(C)C ZINC000490090526 1040352891 /nfs/dbraw/zinc/35/28/91/1040352891.db2.gz QYWQOGNWXCKOIC-NUJGCVRESA-N 1 0 331.460 3.911 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H]2CC[C@@H](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000481167271 1040422494 /nfs/dbraw/zinc/42/24/94/1040422494.db2.gz GHAAAJNZKIYTBJ-VNHYZAJKSA-N 1 0 333.432 3.646 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000512710249 1040586182 /nfs/dbraw/zinc/58/61/82/1040586182.db2.gz PMDAPTNIVKIBRE-OAHLLOKOSA-N 1 0 332.425 3.872 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(C)c1 ZINC000453279894 1040591378 /nfs/dbraw/zinc/59/13/78/1040591378.db2.gz FLTINEBXTACFPR-HNNXBMFYSA-N 1 0 331.441 3.959 20 5 EHBDRO Cc1c(C[N@@H+](C[C@@H](C)c2ccccc2)[C@@H](C)CO)cccc1[N+](=O)[O-] ZINC000553952460 1040625728 /nfs/dbraw/zinc/62/57/28/1040625728.db2.gz UXDQJBYKQXXMMI-CVEARBPZSA-N 1 0 342.439 3.890 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CC2(CO)CC3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433091781 1040721682 /nfs/dbraw/zinc/72/16/82/1040721682.db2.gz PDCNVSSVRLSPNX-QGZVFWFLSA-N 1 0 344.455 3.850 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000487179774 1040769921 /nfs/dbraw/zinc/76/99/21/1040769921.db2.gz QKNFAJOJKCKGGH-HNNXBMFYSA-N 1 0 335.448 3.693 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000600197037 1040812681 /nfs/dbraw/zinc/81/26/81/1040812681.db2.gz QDSCQURWABUJNA-WMLDXEAASA-N 1 0 348.443 3.703 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C1 ZINC000555563088 1040835509 /nfs/dbraw/zinc/83/55/09/1040835509.db2.gz SSQTXFLWVNKWBK-NVXWUHKLSA-N 1 0 348.443 3.629 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1F ZINC000491087489 1040910607 /nfs/dbraw/zinc/91/06/07/1040910607.db2.gz JGZDQTNELPJMQD-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)OCCc2ccccc21 ZINC000570889050 1040963485 /nfs/dbraw/zinc/96/34/85/1040963485.db2.gz RIIGYUQWIULQAP-FQEVSTJZSA-N 1 0 340.423 3.871 20 5 EHBDRO CC1(C)C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCC[C@H]21 ZINC000555721463 1041059847 /nfs/dbraw/zinc/05/98/47/1041059847.db2.gz REJPPJATMIELLI-CABCVRRESA-N 1 0 342.399 3.655 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000150741054 1041221958 /nfs/dbraw/zinc/22/19/58/1041221958.db2.gz DBOBNVLMFCWITE-AWEZNQCLSA-N 1 0 349.431 3.587 20 5 EHBDRO Cc1cnccc1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433304641 1041243709 /nfs/dbraw/zinc/24/37/09/1041243709.db2.gz NYOFOJWWMQAITE-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC[C@H]3CCCC[N@@H+]3C3CC3)ccnc21 ZINC000432152550 1041654247 /nfs/dbraw/zinc/65/42/47/1041654247.db2.gz KBPCWMDEGNUOFR-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(F)cc2C)c(C[NH+](C)C)c1 ZINC001126182179 1042443564 /nfs/dbraw/zinc/44/35/64/1042443564.db2.gz FLVIPETYARODIJ-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C/C=C\c1ccc(F)c(F)c1 ZINC000511942002 1042466143 /nfs/dbraw/zinc/46/61/43/1042466143.db2.gz KEDURZAHCHYIRL-IHWYPQMZSA-N 1 0 334.322 3.685 20 5 EHBDRO CC[C@@](C)([NH2+]CCOc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000072863310 1042633237 /nfs/dbraw/zinc/63/32/37/1042633237.db2.gz NGULZSAGRSNRQD-MRXNPFEDSA-N 1 0 335.429 3.654 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccc(F)c(F)c1)C1CC1 ZINC000481554705 1042760186 /nfs/dbraw/zinc/76/01/86/1042760186.db2.gz BINBOBLVWGHTLK-KRWDZBQOSA-N 1 0 332.350 3.984 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](N[C@H](CO)c1c(F)cccc1F)CCC2 ZINC000278877600 1042809387 /nfs/dbraw/zinc/80/93/87/1042809387.db2.gz XMRMGWIFYRBOLW-IAGOWNOFSA-N 1 0 348.349 3.574 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000585743448 1043018056 /nfs/dbraw/zinc/01/80/56/1043018056.db2.gz OEVJXOZZUKGPRO-NTEUORMPSA-N 1 0 336.395 3.707 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC2(CCOCC2)CC1 ZINC000585767939 1043030221 /nfs/dbraw/zinc/03/02/21/1043030221.db2.gz IQXKNKAYYVAZPX-DTQAZKPQSA-N 1 0 330.428 3.891 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1COc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000344017361 1043105438 /nfs/dbraw/zinc/10/54/38/1043105438.db2.gz FCFDHXCRKGXJIM-RDJZCZTQSA-N 1 0 330.359 3.778 20 5 EHBDRO CCC[C@@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421088 1043157867 /nfs/dbraw/zinc/15/78/67/1043157867.db2.gz FSRYGANXJJIWEW-QFBILLFUSA-N 1 0 349.475 3.527 20 5 EHBDRO COCCOc1cc(C)ccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000167617099 1043314098 /nfs/dbraw/zinc/31/40/98/1043314098.db2.gz RJRSUDZSCXWERX-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@H]1C[C@@H](N(C)c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC[N@@H+]1C ZINC000090095027 1043382140 /nfs/dbraw/zinc/38/21/40/1043382140.db2.gz WVBSFPKPIMBFMF-HOCLYGCPSA-N 1 0 340.427 3.576 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210859 1044162542 /nfs/dbraw/zinc/16/25/42/1044162542.db2.gz FWIQXLHOROAZRZ-SJORKVTESA-N 1 0 331.460 3.681 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000500460239 1044863830 /nfs/dbraw/zinc/86/38/30/1044863830.db2.gz XAGBOIFEOUOCBO-ZDUSSCGKSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1c(C[NH2+][C@](C)(CO)Cc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC001655736642 1126255969 /nfs/dbraw/zinc/25/59/69/1126255969.db2.gz QLVSNIWNRRTUCV-SFHVURJKSA-N 1 0 348.830 3.640 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774635 1127154403 /nfs/dbraw/zinc/15/44/03/1127154403.db2.gz XIPOTSPPRPLUJG-GJZGRUSLSA-N 1 0 333.432 3.598 20 5 EHBDRO C[C@@H](CCc1ccco1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000764609109 1127513961 /nfs/dbraw/zinc/51/39/61/1127513961.db2.gz SBDZVOYYPKKSQJ-HNNXBMFYSA-N 1 0 343.427 3.768 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@@H]3CCCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068980 1127569779 /nfs/dbraw/zinc/56/97/79/1127569779.db2.gz UUHLSDBARMJYBS-IAGOWNOFSA-N 1 0 346.456 3.570 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765417877 1127609011 /nfs/dbraw/zinc/60/90/11/1127609011.db2.gz WFRIVPFCHCISTR-HNNXBMFYSA-N 1 0 325.412 3.617 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCOC3CCCCC3)CC2)cc1 ZINC000765418960 1127610865 /nfs/dbraw/zinc/61/08/65/1127610865.db2.gz DVEVBDKRPHMCGK-UHFFFAOYSA-N 1 0 347.459 3.503 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000552250956 1127726699 /nfs/dbraw/zinc/72/66/99/1127726699.db2.gz HARGJSLVBGHGQN-RKVPGOIHSA-N 1 0 342.443 3.834 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)C1 ZINC000282220537 1128097581 /nfs/dbraw/zinc/09/75/81/1128097581.db2.gz HYNJQAUBNSDKQW-BBRMVZONSA-N 1 0 330.384 3.854 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477794 1131242233 /nfs/dbraw/zinc/24/22/33/1131242233.db2.gz UMDLYFQDCXRZKI-PBHICJAKSA-N 1 0 336.395 3.780 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc2cc(F)cc([N+](=O)[O-])c2n1 ZINC001168600815 1128278597 /nfs/dbraw/zinc/27/85/97/1128278597.db2.gz FBBPTRBVYROULZ-KBPBESRZSA-N 1 0 332.379 3.567 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1cc(C(F)(F)F)ccc1[N+](=O)[O-] ZINC001168601373 1128280304 /nfs/dbraw/zinc/28/03/04/1128280304.db2.gz NAUWKRUHRPIYAE-AAEUAGOBSA-N 1 0 331.338 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](CC3CCCC3)C2)c2ccncc21 ZINC000301465042 1128458616 /nfs/dbraw/zinc/45/86/16/1128458616.db2.gz LGLPTVZJCAMYPQ-HNNXBMFYSA-N 1 0 340.427 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CCC([NH+]3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000301522969 1128487491 /nfs/dbraw/zinc/48/74/91/1128487491.db2.gz GNPDPKWUJHBXIW-UHFFFAOYSA-N 1 0 348.403 3.712 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000153605112 1128508413 /nfs/dbraw/zinc/50/84/13/1128508413.db2.gz SEOLQIMBSBYRLM-UHFFFAOYSA-N 1 0 340.855 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCc3cc(Cl)ccc32)cc1 ZINC000765848653 1128559436 /nfs/dbraw/zinc/55/94/36/1128559436.db2.gz KNQCOIXCJWZVJC-IRXDYDNUSA-N 1 0 332.787 3.559 20 5 EHBDRO C[NH+](C)C1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000091670253 1128777355 /nfs/dbraw/zinc/77/73/55/1128777355.db2.gz GWOIXMPWIZYODZ-UHFFFAOYSA-N 1 0 345.468 3.849 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](Cc3ccccc3)CC2)c1 ZINC000225927317 1120235374 /nfs/dbraw/zinc/23/53/74/1120235374.db2.gz UUEKPEDPCICKCW-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO C[C@@H](CC1CCOCC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494523017 1120581270 /nfs/dbraw/zinc/58/12/70/1120581270.db2.gz IUIJZUFRHKJFSB-NSHDSACASA-N 1 0 346.349 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C/C=C/c3ccncc3)CC2)cc1 ZINC000494948281 1120909920 /nfs/dbraw/zinc/90/99/20/1120909920.db2.gz BTBPEFGYBBJPCR-OWOJBTEDSA-N 1 0 339.395 3.546 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000554957922 1128948957 /nfs/dbraw/zinc/94/89/57/1128948957.db2.gz GEXGWCMCZKGRGG-WMZOPIPTSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000542539535 1120965079 /nfs/dbraw/zinc/96/50/79/1120965079.db2.gz SLSMBTWPTDMUJB-HUUCEWRRSA-N 1 0 341.411 3.705 20 5 EHBDRO C[C@H](CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-])[NH+](C)C ZINC000914771011 1120981410 /nfs/dbraw/zinc/98/14/10/1120981410.db2.gz KVODNIOMCGMFGL-SSDOTTSWSA-N 1 0 325.718 3.629 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1 ZINC000311162900 1128984747 /nfs/dbraw/zinc/98/47/47/1128984747.db2.gz PZIWBSAGHGOIJV-INIZCTEOSA-N 1 0 341.411 3.537 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC[N@@H+]2CCc3ccccc3C2)c2ncccc12 ZINC000301091585 1121583347 /nfs/dbraw/zinc/58/33/47/1121583347.db2.gz WGTXSINTIJAYTQ-UHFFFAOYSA-N 1 0 348.406 3.613 20 5 EHBDRO O=C(CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)Nc1ccccc1 ZINC000153314545 1121665788 /nfs/dbraw/zinc/66/57/88/1121665788.db2.gz AHBXGHNEAPFHML-UHFFFAOYSA-N 1 0 339.395 3.588 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)[C@@H]1C ZINC000194035982 1121760623 /nfs/dbraw/zinc/76/06/23/1121760623.db2.gz SBMNUXNMSWTDAZ-JTNHKYCSSA-N 1 0 339.823 3.601 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143294 1121783817 /nfs/dbraw/zinc/78/38/17/1121783817.db2.gz OXLCSTUULHJZSO-WFASDCNBSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000194180158 1121797985 /nfs/dbraw/zinc/79/79/85/1121797985.db2.gz GNNJYBDKEINUEP-SWLSCSKDSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1C[NH+](CCCCNc2ccc(Cl)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000301737025 1129011007 /nfs/dbraw/zinc/01/10/07/1129011007.db2.gz VOPYQHSCVAQMPJ-STQMWFEESA-N 1 0 341.839 3.550 20 5 EHBDRO CCC[N@H+](CC)C[C@@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000461615810 1122128643 /nfs/dbraw/zinc/12/86/43/1122128643.db2.gz FZNUSTLGHAMEFM-GFCCVEGCSA-N 1 0 349.456 3.660 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCc3ccc(Cl)cc32)cc1 ZINC000763395793 1122229206 /nfs/dbraw/zinc/22/92/06/1122229206.db2.gz OTSQBDAHUKZULM-IRXDYDNUSA-N 1 0 332.787 3.559 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCC[C@H]1O ZINC000497264042 1122428468 /nfs/dbraw/zinc/42/84/68/1122428468.db2.gz VZSCOOCIXQXDGY-RDTXWAMCSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(C[NH+]3CCCCCC3)CC2)c(F)c1 ZINC000917064330 1122465731 /nfs/dbraw/zinc/46/57/31/1122465731.db2.gz PCFZDCHKSCAMML-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000917078715 1122482411 /nfs/dbraw/zinc/48/24/11/1122482411.db2.gz RNOLQFYPTFZNJP-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO CCCC[N@H+](Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H](C)CC ZINC000917436377 1122601582 /nfs/dbraw/zinc/60/15/82/1122601582.db2.gz BZTRFPQUHDPKOT-AWEZNQCLSA-N 1 0 331.420 3.711 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000154970275 1123054034 /nfs/dbraw/zinc/05/40/34/1123054034.db2.gz UEFSTCPBWYESPG-KBXCAEBGSA-N 1 0 343.427 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1cccs1)N(C)C ZINC000155070165 1123130120 /nfs/dbraw/zinc/13/01/20/1123130120.db2.gz KOZOUQVCKGFFEZ-XJKSGUPXSA-N 1 0 333.457 3.918 20 5 EHBDRO Cc1cc(C(=O)NCCCCCCC[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000920250963 1123343258 /nfs/dbraw/zinc/34/32/58/1123343258.db2.gz UNRYAOZHJVIZHP-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO CC[C@](C)(CO)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610088851 1123729094 /nfs/dbraw/zinc/72/90/94/1123729094.db2.gz GDXJAGYNOPZCJZ-LJQANCHMSA-N 1 0 343.427 3.613 20 5 EHBDRO CCOc1ccccc1[C@H](CC)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742844 1123845747 /nfs/dbraw/zinc/84/57/47/1123845747.db2.gz GZICGVKRLXCMSS-ROUUACIJSA-N 1 0 344.411 3.768 20 5 EHBDRO CN(Cc1cccc([N+](=O)[O-])c1)C1CC[NH+](Cc2ccccc2)CC1 ZINC000114481255 1129149570 /nfs/dbraw/zinc/14/95/70/1129149570.db2.gz KATFEKYZIGUCFL-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO Cc1nc2n(n1)C[C@H]([NH2+]Cc1c3ccccc3cc3ccccc31)CC2 ZINC000237795003 1123862819 /nfs/dbraw/zinc/86/28/19/1123862819.db2.gz CJBGNWKWPOIHIT-GOSISDBHSA-N 1 0 342.446 3.998 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2cc[nH]n2)C1 ZINC000615836026 1123884356 /nfs/dbraw/zinc/88/43/56/1123884356.db2.gz HCDDJXOIXIMFDU-HFQYIWAZSA-N 1 0 326.400 3.601 20 5 EHBDRO Cc1cc(NC[C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000181523119 1124908539 /nfs/dbraw/zinc/90/85/39/1124908539.db2.gz NHXJIQACTKVSQI-OAHLLOKOSA-N 1 0 337.379 3.639 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122854825 1124984342 /nfs/dbraw/zinc/98/43/42/1124984342.db2.gz OVEQIAMPOISCLV-LIRRHRJNSA-N 1 0 340.423 3.842 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCc3cc(O)ccc3C2)c(Cl)c1 ZINC000618197837 1125017233 /nfs/dbraw/zinc/01/72/33/1125017233.db2.gz GIXAKVKEHIWBRA-AWEZNQCLSA-N 1 0 332.787 3.601 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000069752211 1125037704 /nfs/dbraw/zinc/03/77/04/1125037704.db2.gz XZLKKCYSQYRWDF-QWHCGFSZSA-N 1 0 342.395 3.778 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCCCc2ccccc2)n1 ZINC000618562227 1125112614 /nfs/dbraw/zinc/11/26/14/1125112614.db2.gz SNWGVVJJTGOPKS-QZTJIDSGSA-N 1 0 342.443 3.888 20 5 EHBDRO CC(C)[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1F ZINC000182157310 1125191951 /nfs/dbraw/zinc/19/19/51/1125191951.db2.gz GCVRFDNRCYSMHV-HNNXBMFYSA-N 1 0 340.786 3.571 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000618988529 1125263120 /nfs/dbraw/zinc/26/31/20/1125263120.db2.gz XZFSMPBSIRLSND-LJQANCHMSA-N 1 0 340.423 3.642 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000182356142 1125267167 /nfs/dbraw/zinc/26/71/67/1125267167.db2.gz OOZQBERVYYPXTJ-KDOFPFPSSA-N 1 0 349.862 3.697 20 5 EHBDRO CO[C@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000619430963 1125348435 /nfs/dbraw/zinc/34/84/35/1125348435.db2.gz TXVZCWCRIAKLMP-OCCSQVGLSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891197 1129283840 /nfs/dbraw/zinc/28/38/40/1129283840.db2.gz UNHCMNHRBYCPRR-WMLDXEAASA-N 1 0 346.818 3.809 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000080347156 1129347951 /nfs/dbraw/zinc/34/79/51/1129347951.db2.gz RNQCWYHSDQECGM-UHFFFAOYSA-N 1 0 327.384 3.578 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CC[C@@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247737 1129371103 /nfs/dbraw/zinc/37/11/03/1129371103.db2.gz HYTRUVCPMJZSAN-ZIAGYGMSSA-N 1 0 333.432 3.598 20 5 EHBDRO C[C@H]1CCC[C@@](CNc2ncc([N+](=O)[O-])cc2Cl)([NH+](C)C)C1 ZINC000317839099 1129476027 /nfs/dbraw/zinc/47/60/27/1129476027.db2.gz QTULVHQYBCDBLD-XHDPSFHLSA-N 1 0 326.828 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2OCCc3sccc32)c(Cl)c1 ZINC000922438819 1129532787 /nfs/dbraw/zinc/53/27/87/1129532787.db2.gz UGKOFWVNAWZWHP-CQSZACIVSA-N 1 0 338.816 3.713 20 5 EHBDRO COc1cccc(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000389794509 1129590157 /nfs/dbraw/zinc/59/01/57/1129590157.db2.gz SGRBJJCNIXSKJF-WMLDXEAASA-N 1 0 341.411 3.536 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nc2c(s1)CCC2 ZINC000922714092 1129637971 /nfs/dbraw/zinc/63/79/71/1129637971.db2.gz DPQQWOURZBRXMC-JLHYYAGUSA-N 1 0 343.452 3.776 20 5 EHBDRO C[C@@H]([NH2+]CC1CCN(C(=O)C(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000331095468 1129652519 /nfs/dbraw/zinc/65/25/19/1129652519.db2.gz LILXSJLYLNIKCB-CQSZACIVSA-N 1 0 347.459 3.530 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000331316970 1129660671 /nfs/dbraw/zinc/66/06/71/1129660671.db2.gz APTDDDVUKPPNNC-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](Nc1c(F)cc([N+](=O)[O-])cc1F)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302040819 1129765296 /nfs/dbraw/zinc/76/52/96/1129765296.db2.gz HYTJPRWNDBIZAP-NWDGAFQWSA-N 1 0 339.386 3.938 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000302974460 1129803539 /nfs/dbraw/zinc/80/35/39/1129803539.db2.gz JCLQEEJFKIHNNI-QGZVFWFLSA-N 1 0 326.396 3.853 20 5 EHBDRO O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)c1csc([N+](=O)[O-])c1 ZINC000056331815 1129817313 /nfs/dbraw/zinc/81/73/13/1129817313.db2.gz UGJYWTSGOUAQKZ-UHFFFAOYSA-N 1 0 345.424 3.547 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC000303204375 1129828038 /nfs/dbraw/zinc/82/80/38/1129828038.db2.gz PETILWCCFVGLHX-UHFFFAOYSA-N 1 0 344.411 3.813 20 5 EHBDRO CC[C@H]1CN(Cc2ccc(Br)c([N+](=O)[O-])c2)CCS1 ZINC000162903507 1129911378 /nfs/dbraw/zinc/91/13/78/1129911378.db2.gz BQAMLHVGYWAITK-NSHDSACASA-N 1 0 345.262 3.685 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CC[C@H](O)CC2)c2ccccc2)c1 ZINC000305787574 1129926645 /nfs/dbraw/zinc/92/66/45/1129926645.db2.gz AGISXRQMLBWLBP-WDSOQIARSA-N 1 0 326.396 3.577 20 5 EHBDRO Cc1cccc(C(C)(C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1 ZINC000172474813 1130137870 /nfs/dbraw/zinc/13/78/70/1130137870.db2.gz WPJGRBGISXFJSZ-UHFFFAOYSA-N 1 0 342.395 3.795 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc(Cn2cccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173340992 1130211162 /nfs/dbraw/zinc/21/11/62/1130211162.db2.gz NFJFQLXKXROLEO-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3OCC[C@H]32)cc1[N+](=O)[O-] ZINC000245508315 1130224194 /nfs/dbraw/zinc/22/41/94/1130224194.db2.gz RSEYKXYFKWIAKM-FAYQHZLMSA-N 1 0 334.416 3.602 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000173458237 1130233802 /nfs/dbraw/zinc/23/38/02/1130233802.db2.gz HSVTXUHRHSXYSN-CQSZACIVSA-N 1 0 347.802 3.928 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000245553961 1130237666 /nfs/dbraw/zinc/23/76/66/1130237666.db2.gz QUZGOGAMNAHGMZ-YEWWUXTCSA-N 1 0 342.443 3.699 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)cs1 ZINC000173985009 1130327891 /nfs/dbraw/zinc/32/78/91/1130327891.db2.gz GDADBKFBDACWIW-OAHLLOKOSA-N 1 0 332.425 3.695 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000174146383 1130337191 /nfs/dbraw/zinc/33/71/91/1130337191.db2.gz BVEBATMNHSYBEI-KBPBESRZSA-N 1 0 333.432 3.789 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H](C(F)(F)F)C1 ZINC000175028098 1130397982 /nfs/dbraw/zinc/39/79/82/1130397982.db2.gz NAILGLOONFQVJL-LBPRGKRZSA-N 1 0 332.322 3.768 20 5 EHBDRO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCCC[C@H]1C ZINC000731206207 1130779090 /nfs/dbraw/zinc/77/90/90/1130779090.db2.gz BHKMWMZJYNVBEX-VXGBXAGGSA-N 1 0 334.445 3.879 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000766194722 1131161118 /nfs/dbraw/zinc/16/11/18/1131161118.db2.gz WBDPDQBIQDNFMX-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H](CCO)C3CC3)s2)cc1 ZINC000741258530 1131590175 /nfs/dbraw/zinc/59/01/75/1131590175.db2.gz NIYQZWRLTBCLBT-MRXNPFEDSA-N 1 0 332.425 3.574 20 5 EHBDRO C[C@H](CCCC(C)(C)O)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901571 1131883477 /nfs/dbraw/zinc/88/34/77/1131883477.db2.gz NUCLJUYMKDKFNH-RHSMWYFYSA-N 1 0 334.460 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905334 1131886793 /nfs/dbraw/zinc/88/67/93/1131886793.db2.gz RFKALELCSMBZLM-HOCLYGCPSA-N 1 0 342.361 3.911 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1Cc3ccc(F)cc3C1)CC2 ZINC001172906760 1131887524 /nfs/dbraw/zinc/88/75/24/1131887524.db2.gz ORHMFRPDMVUNQN-RTBURBONSA-N 1 0 340.398 3.738 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCc3c1cccc3O)CC2 ZINC001172907490 1131887891 /nfs/dbraw/zinc/88/78/91/1131887891.db2.gz FRWYKHXYFIFJCW-KXBFYZLASA-N 1 0 338.407 3.825 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895647 1131901287 /nfs/dbraw/zinc/90/12/87/1131901287.db2.gz GTVVHRXQBXDHFE-SFHVURJKSA-N 1 0 339.439 3.768 20 5 EHBDRO CC[N@H+](CCN1CCCCC1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922181 1131905244 /nfs/dbraw/zinc/90/52/44/1131905244.db2.gz WUDSERVDLIHRAG-IBGZPJMESA-N 1 0 345.487 3.650 20 5 EHBDRO CC[N@H+](CCN1CCCCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922182 1131905268 /nfs/dbraw/zinc/90/52/68/1131905268.db2.gz WUDSERVDLIHRAG-LJQANCHMSA-N 1 0 345.487 3.650 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(C)(C)C ZINC001173009781 1131935364 /nfs/dbraw/zinc/93/53/64/1131935364.db2.gz CAVNDGBACHRNQN-NSHDSACASA-N 1 0 341.402 3.866 20 5 EHBDRO CC1(C)CCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173009922 1131935950 /nfs/dbraw/zinc/93/59/50/1131935950.db2.gz JTIDTVCAGFXZBJ-UHFFFAOYSA-N 1 0 339.386 3.716 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000743856557 1131988901 /nfs/dbraw/zinc/98/89/01/1131988901.db2.gz KPQWMLZLCFOBON-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)N2Cc3cccc(C)c3C2)c1F ZINC001173179707 1131992127 /nfs/dbraw/zinc/99/21/27/1131992127.db2.gz GFYYGKHGJJQQPG-ZDUSSCGKSA-N 1 0 344.386 3.998 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173217809 1132001997 /nfs/dbraw/zinc/00/19/97/1132001997.db2.gz GGUMRZSONZWNJG-KDOFPFPSSA-N 1 0 326.396 3.948 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001173219584 1132002812 /nfs/dbraw/zinc/00/28/12/1132002812.db2.gz DOQUWDGPIXOBRQ-KDOFPFPSSA-N 1 0 348.443 3.627 20 5 EHBDRO CCOC(=O)c1csc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173219273 1132002977 /nfs/dbraw/zinc/00/29/77/1132002977.db2.gz AGAHLAORDUQAPP-LBPRGKRZSA-N 1 0 348.424 3.554 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1cncc(F)c1)C1CC1 ZINC001173224842 1132005406 /nfs/dbraw/zinc/00/54/06/1132005406.db2.gz PGIKUXPQWHFQPA-KZULUSFZSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1COc2ccc(Cl)cc21 ZINC001173226267 1132006541 /nfs/dbraw/zinc/00/65/41/1132006541.db2.gz WRXLIIRFLWUSLI-ZBEGNZNMSA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1Cc1ccccn1 ZINC001173228539 1132008598 /nfs/dbraw/zinc/00/85/98/1132008598.db2.gz XMSPKYVQYRCTLA-BEFAXECRSA-N 1 0 325.412 3.628 20 5 EHBDRO CC(C)CC1(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)CCOCC1 ZINC001173231494 1132009141 /nfs/dbraw/zinc/00/91/41/1132009141.db2.gz ZWUABYOZPRLGDD-MRXNPFEDSA-N 1 0 334.460 3.958 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CO)c1cccc(Cl)c1 ZINC001173235881 1132010066 /nfs/dbraw/zinc/01/00/66/1132010066.db2.gz VPVOLCZOKGKZGN-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO Cc1ccccc1OC[C@@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232748 1132010198 /nfs/dbraw/zinc/01/01/98/1132010198.db2.gz FUUTUUXRWMWPIU-JKSUJKDBSA-N 1 0 328.412 3.891 20 5 EHBDRO COc1ccc(CCC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173213820 1132015393 /nfs/dbraw/zinc/01/53/93/1132015393.db2.gz KYGBNLOBCXESEZ-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1cccc([C@H]([NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc2)c1 ZINC001168985316 1132619694 /nfs/dbraw/zinc/61/96/94/1132619694.db2.gz DGLXKHFOSGJOFO-XFQXTVEOSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccnc(C(F)(F)F)c2)C2CC2)C1 ZINC001168997036 1132627815 /nfs/dbraw/zinc/62/78/15/1132627815.db2.gz BCEWAKORJOXNGL-WDBKCZKBSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(c3noc4cc(F)ccc43)CC2)C1 ZINC001169010103 1132631627 /nfs/dbraw/zinc/63/16/27/1132631627.db2.gz AYGCUVYYDLBGPP-WFASDCNBSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3cc(F)ccc32)C1 ZINC001169042836 1132638194 /nfs/dbraw/zinc/63/81/94/1132638194.db2.gz GIZKSRKSXZLNRF-CJNGLKHVSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(Oc3ccccc3Cl)CC2)C1 ZINC001169024977 1132640254 /nfs/dbraw/zinc/64/02/54/1132640254.db2.gz IGCXZBCJMRNVJR-UONOGXRCSA-N 1 0 338.835 3.629 20 5 EHBDRO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046722 1132642032 /nfs/dbraw/zinc/64/20/32/1132642032.db2.gz MGIQHAOMOMFCIQ-ZFWWWQNUSA-N 1 0 330.350 3.973 20 5 EHBDRO Cn1cc(C[NH+]2CCC(C)(c3cccc(Cl)c3)CC2)c([N+](=O)[O-])n1 ZINC001169724222 1132835221 /nfs/dbraw/zinc/83/52/21/1132835221.db2.gz NCPDOHVJIOEWTP-UHFFFAOYSA-N 1 0 348.834 3.535 20 5 EHBDRO CCOc1ccc(CC[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC001176832786 1133004062 /nfs/dbraw/zinc/00/40/62/1133004062.db2.gz ILZOTJDEVCCQAB-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CC(C)[NH+]1CCC(CNc2nc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC001156496184 1133010714 /nfs/dbraw/zinc/01/07/14/1133010714.db2.gz XXMZSQHQWGGMCO-UHFFFAOYSA-N 1 0 347.246 3.829 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000767940064 1133073771 /nfs/dbraw/zinc/07/37/71/1133073771.db2.gz DHCLZEZKMKUSKX-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO CCc1cc(C[NH2+][C@H](CC)CSc2ccccc2[N+](=O)[O-])[nH]n1 ZINC000768104423 1133095466 /nfs/dbraw/zinc/09/54/66/1133095466.db2.gz KDAMLRKJGDGHEB-CYBMUJFWSA-N 1 0 334.445 3.541 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246254 1133250853 /nfs/dbraw/zinc/25/08/53/1133250853.db2.gz YOWMXNWIGUYFLE-AZUAARDMSA-N 1 0 340.423 3.991 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1nc(Cl)c(Cl)cc1[N+](=O)[O-] ZINC001156928400 1133557430 /nfs/dbraw/zinc/55/74/30/1133557430.db2.gz KGPCXNLFFPWDKG-SNVBAGLBSA-N 1 0 347.246 3.973 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1COc3ccccc3C1)CCC2 ZINC000774140145 1133613917 /nfs/dbraw/zinc/61/39/17/1133613917.db2.gz RRULJFDDOBJHAY-IFXJQAMLSA-N 1 0 338.407 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1COc3ccccc3C1)CCC2 ZINC000774140158 1133614149 /nfs/dbraw/zinc/61/41/49/1133614149.db2.gz RRULJFDDOBJHAY-LIRRHRJNSA-N 1 0 338.407 3.813 20 5 EHBDRO COc1cccc(NC2CCC([NH+]3CCCCC3)CC2)c1[N+](=O)[O-] ZINC000772103837 1133648397 /nfs/dbraw/zinc/64/83/97/1133648397.db2.gz CHXMOQKJVXXFNB-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2ccc([N+](=O)[O-])cc2C(C)=O)c1 ZINC000786583054 1133870708 /nfs/dbraw/zinc/87/07/08/1133870708.db2.gz LJLGPEJKIXSDIG-UHFFFAOYSA-N 1 0 341.411 3.861 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000786810179 1133909380 /nfs/dbraw/zinc/90/93/80/1133909380.db2.gz ROONUCCWTJBLDG-BAPRJRNISA-N 1 0 338.407 3.839 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1c(F)cccc1F ZINC000786815388 1133909884 /nfs/dbraw/zinc/90/98/84/1133909884.db2.gz SGBLQLASBDRRBI-FWVUHSSSSA-N 1 0 348.349 3.600 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1cccs1 ZINC000786813206 1133910670 /nfs/dbraw/zinc/91/06/70/1133910670.db2.gz LCEYAWZLYBTPRU-JZUUQJBKSA-N 1 0 332.425 3.557 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ncc([N+](=O)[O-])c3ccccc32)CC1 ZINC001184720056 1133980108 /nfs/dbraw/zinc/98/01/08/1133980108.db2.gz NHGOJCAXIYATLQ-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO CCC(CC)[C@@H](CNc1nccc2c1cccc2[N+](=O)[O-])[NH+](C)C ZINC001184740581 1133985946 /nfs/dbraw/zinc/98/59/46/1133985946.db2.gz REFLJVMQSBUXCL-QGZVFWFLSA-N 1 0 330.432 3.921 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000746671972 1133990459 /nfs/dbraw/zinc/99/04/59/1133990459.db2.gz CYRYNVPJZPODHK-DOMZBBRYSA-N 1 0 325.840 3.553 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001184972409 1134009392 /nfs/dbraw/zinc/00/93/92/1134009392.db2.gz FJNWTPWFFMWLMP-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001185098602 1134029252 /nfs/dbraw/zinc/02/92/52/1134029252.db2.gz OWCOKWMXTZUHNA-GFCCVEGCSA-N 1 0 331.338 3.580 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)CNc1c(Cl)cncc1[N+](=O)[O-])c1ccccc1 ZINC001185241015 1134056530 /nfs/dbraw/zinc/05/65/30/1134056530.db2.gz DBUVZLVWZSVHDA-GFCCVEGCSA-N 1 0 348.834 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])c1 ZINC000774879026 1134096519 /nfs/dbraw/zinc/09/65/19/1134096519.db2.gz GMVYUTLREGWSMK-CYBMUJFWSA-N 1 0 345.330 3.632 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476060 1134129691 /nfs/dbraw/zinc/12/96/91/1134129691.db2.gz MULKWSVVIPFKMT-INIZCTEOSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@H]([NH2+]CCCCOc1ccc(F)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788522250 1134136842 /nfs/dbraw/zinc/13/68/42/1134136842.db2.gz ZNEZXCTWQCNZBD-ZDUSSCGKSA-N 1 0 347.390 3.826 20 5 EHBDRO Cc1ccccc1[C@@H](O)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000788580143 1134147292 /nfs/dbraw/zinc/14/72/92/1134147292.db2.gz JMPUVVGEPQKPEW-OALUTQOASA-N 1 0 340.423 3.949 20 5 EHBDRO C[C@@H]([NH2+]CCc1cc2ccccc2o1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788665577 1134158829 /nfs/dbraw/zinc/15/88/29/1134158829.db2.gz OWKPNIUPRGXQBN-GFCCVEGCSA-N 1 0 325.368 3.817 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000788806970 1134171973 /nfs/dbraw/zinc/17/19/73/1134171973.db2.gz QVLQYCDUYRRGJU-SOVGHPHASA-N 1 0 343.427 3.730 20 5 EHBDRO C[NH+](C)[C@@H]1C[C@@H](Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])C12CCC2 ZINC001187025866 1134284276 /nfs/dbraw/zinc/28/42/76/1134284276.db2.gz UFUHEDJEEXWDJU-CHWSQXEVSA-N 1 0 343.349 3.898 20 5 EHBDRO C[NH+](C)[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C12CCC2 ZINC001187025456 1134284306 /nfs/dbraw/zinc/28/43/06/1134284306.db2.gz PVGAHOHRINWYND-ZIAGYGMSSA-N 1 0 325.359 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC=C(c3ccccc3)C2)c1 ZINC000789545244 1134294313 /nfs/dbraw/zinc/29/43/13/1134294313.db2.gz GBCQMIHWCJVPKV-UHFFFAOYSA-N 1 0 334.379 3.691 20 5 EHBDRO CC1(C)C[C@H](O)CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000825090940 1134308179 /nfs/dbraw/zinc/30/81/79/1134308179.db2.gz OFHLUDBFIXHELM-GFCCVEGCSA-N 1 0 347.242 3.885 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1NCc1ccccc1-c1cccnc1)C[NH2+]C2 ZINC001170114100 1134312391 /nfs/dbraw/zinc/31/23/91/1134312391.db2.gz AZEUWPWRTVUNFL-UHFFFAOYSA-N 1 0 346.390 3.872 20 5 EHBDRO O=C1C[C@@]2(CC[N@H+](Cc3c4ccccc4cc4ccccc43)C2)CN1 ZINC000789770453 1134329163 /nfs/dbraw/zinc/32/91/63/1134329163.db2.gz XTFYLNVWOJBEJT-QFIPXVFZSA-N 1 0 330.431 3.705 20 5 EHBDRO C[C@@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+]1C1CCCC1 ZINC001187624172 1134357878 /nfs/dbraw/zinc/35/78/78/1134357878.db2.gz ASYOSGKBFHFGSC-GFCCVEGCSA-N 1 0 346.456 3.658 20 5 EHBDRO Cn1nccc1[C@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000790494799 1134426038 /nfs/dbraw/zinc/42/60/38/1134426038.db2.gz HJECLEMEGDFZPL-JSGCOSHPSA-N 1 0 348.834 3.798 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170296614 1134737347 /nfs/dbraw/zinc/73/73/47/1134737347.db2.gz GSWSBGREVBRCPL-KGLIPLIRSA-N 1 0 346.402 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297602 1134737459 /nfs/dbraw/zinc/73/74/59/1134737459.db2.gz QPHNAKGPHUIHCJ-JQWIXIFHSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170298359 1134738042 /nfs/dbraw/zinc/73/80/42/1134738042.db2.gz JWILDUUQYKUEKD-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc(C[C@H](C)n2c(C[NH3+])cc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297873 1134738201 /nfs/dbraw/zinc/73/82/01/1134738201.db2.gz URXBSEGRAOFUDL-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C(C)=O)cc2)c([N+](=O)[O-])c1 ZINC001170314017 1134745589 /nfs/dbraw/zinc/74/55/89/1134745589.db2.gz UDXQOGAVEZAZSM-CYBMUJFWSA-N 1 0 342.395 3.527 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3cc(C)ncc32)c([N+](=O)[O-])c1 ZINC001170324114 1134747519 /nfs/dbraw/zinc/74/75/19/1134747519.db2.gz OGMMOBPZQXAKMV-FZKQIMNGSA-N 1 0 341.411 3.515 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H](Cc2ccccc2)C1 ZINC001190846195 1134759366 /nfs/dbraw/zinc/75/93/66/1134759366.db2.gz JLCWVZBAZGVQQF-SFHVURJKSA-N 1 0 340.423 3.928 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170351665 1134760627 /nfs/dbraw/zinc/76/06/27/1134760627.db2.gz HAZSDBYGYQNYIT-LLVKDONJSA-N 1 0 328.359 3.512 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000775437376 1134795786 /nfs/dbraw/zinc/79/57/86/1134795786.db2.gz APMZTOVWVGOFEI-IBGZPJMESA-N 1 0 344.386 3.991 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000793239056 1134885853 /nfs/dbraw/zinc/88/58/53/1134885853.db2.gz QJWPSNUTAPMPAD-QZTJIDSGSA-N 1 0 332.375 3.726 20 5 EHBDRO Cc1ccc([C@@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC001193325020 1135125195 /nfs/dbraw/zinc/12/51/95/1135125195.db2.gz XWUXQFHVHMVVFK-QGZVFWFLSA-N 1 0 326.396 3.772 20 5 EHBDRO C[C@@H](Cc1cccc(F)c1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC001195015075 1135349517 /nfs/dbraw/zinc/34/95/17/1135349517.db2.gz RSCJUZDDHUGWIJ-AWEZNQCLSA-N 1 0 332.375 3.676 20 5 EHBDRO C[NH+](C)C1CCN(c2ccc(Nc3sccc3[N+](=O)[O-])cc2)CC1 ZINC000775681470 1135504451 /nfs/dbraw/zinc/50/44/51/1135504451.db2.gz AEUBHJIKUCGGRK-UHFFFAOYSA-N 1 0 346.456 3.930 20 5 EHBDRO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000809738604 1135882915 /nfs/dbraw/zinc/88/29/15/1135882915.db2.gz BFGAMHREAGHFBI-UHFFFAOYSA-N 1 0 347.846 3.942 20 5 EHBDRO CCC(CC)[C@H](C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)N(C)C ZINC001199170655 1135884745 /nfs/dbraw/zinc/88/47/45/1135884745.db2.gz LZCHRVRIPWXFKP-HVEPWOEZSA-N 1 0 333.476 3.954 20 5 EHBDRO CC1CCN(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC001199268418 1135891803 /nfs/dbraw/zinc/89/18/03/1135891803.db2.gz XHCZTCGONMKJTF-UHFFFAOYSA-N 1 0 343.427 3.676 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809788537 1135892052 /nfs/dbraw/zinc/89/20/52/1135892052.db2.gz SSRSSALOBLOTQB-UHFFFAOYSA-N 1 0 333.819 3.946 20 5 EHBDRO COC(=O)CC[N@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000809946420 1135903467 /nfs/dbraw/zinc/90/34/67/1135903467.db2.gz VXXSEQMDDIVGIA-UHFFFAOYSA-N 1 0 349.214 3.675 20 5 EHBDRO CN(CCc1ccccn1)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809966385 1135904274 /nfs/dbraw/zinc/90/42/74/1135904274.db2.gz AIVVAYWWVNDRKT-UHFFFAOYSA-N 1 0 340.210 3.971 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1F ZINC000810047052 1135915233 /nfs/dbraw/zinc/91/52/33/1135915233.db2.gz IXOOPZZSBIUCPZ-IBGZPJMESA-N 1 0 342.370 3.704 20 5 EHBDRO Cc1cc([C@@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000776030894 1135936696 /nfs/dbraw/zinc/93/66/96/1135936696.db2.gz BXIQSNLLVFMYQQ-OALUTQOASA-N 1 0 344.386 3.817 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)O[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810847381 1136014647 /nfs/dbraw/zinc/01/46/47/1136014647.db2.gz OHCIFOMJJGDRAO-GJZGRUSLSA-N 1 0 346.427 3.676 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@@H](OC(C)C)C1(C)C ZINC001201887868 1136070371 /nfs/dbraw/zinc/07/03/71/1136070371.db2.gz DGUPGSHSGKUGAR-DLBZAZTESA-N 1 0 336.432 3.675 20 5 EHBDRO O=C(OCC[NH+]1CCCCC1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811375339 1136078589 /nfs/dbraw/zinc/07/85/89/1136078589.db2.gz XROXEIMWZMMUPH-UHFFFAOYSA-N 1 0 347.198 3.544 20 5 EHBDRO CC(C)[N@H+](C)CCCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473077 1136095804 /nfs/dbraw/zinc/09/58/04/1136095804.db2.gz OVCHFHQNYNIHDU-UHFFFAOYSA-N 1 0 334.247 3.722 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H](O)C1CCCCC1 ZINC000811477924 1136097146 /nfs/dbraw/zinc/09/71/46/1136097146.db2.gz ILJNTNNUKXKCAS-CQSZACIVSA-N 1 0 347.242 3.932 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@H]1c1ccccc1 ZINC000776254065 1136104702 /nfs/dbraw/zinc/10/47/02/1136104702.db2.gz QYEVCQLEMUGIGX-QZTJIDSGSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271956 1136124183 /nfs/dbraw/zinc/12/41/83/1136124183.db2.gz PIGGULWUPYBOBQ-YWZLYKJASA-N 1 0 340.423 3.929 20 5 EHBDRO CC(C)([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650854 1136162064 /nfs/dbraw/zinc/16/20/64/1136162064.db2.gz QGPDLTATISZBJF-SMDDNHRTSA-N 1 0 346.349 3.920 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812853795 1136262179 /nfs/dbraw/zinc/26/21/79/1136262179.db2.gz KGVWDAXGXDUWDJ-AUUYWEPGSA-N 1 0 344.411 3.547 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCC2SCCS2)cc1[N+](=O)[O-] ZINC000850570847 1136289170 /nfs/dbraw/zinc/28/91/70/1136289170.db2.gz MWIDDWOAEVMYKN-NSHDSACASA-N 1 0 342.486 3.840 20 5 EHBDRO CCOCOc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000813791376 1136362694 /nfs/dbraw/zinc/36/26/94/1136362694.db2.gz BFJJQGUKZSMVHI-UHFFFAOYSA-N 1 0 344.411 3.993 20 5 EHBDRO CO[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC001202483728 1136404013 /nfs/dbraw/zinc/40/40/13/1136404013.db2.gz PKWHMXKVLINNDV-GDBMZVCRSA-N 1 0 332.425 3.980 20 5 EHBDRO Cc1ccc(C[C@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583859 1136442471 /nfs/dbraw/zinc/44/24/71/1136442471.db2.gz GMKLKTWJRPXIIA-WOJBJXKFSA-N 1 0 340.423 3.644 20 5 EHBDRO CC[C@@H]1c2ccccc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582933 1136442539 /nfs/dbraw/zinc/44/25/39/1136442539.db2.gz DHHYJAJJTFQEHK-RTBURBONSA-N 1 0 326.396 3.638 20 5 EHBDRO COc1cc(NC2CC[NH+](C(C)(C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000853203507 1136517021 /nfs/dbraw/zinc/51/70/21/1136517021.db2.gz NQWSYYAUUMERNM-UHFFFAOYSA-N 1 0 341.839 3.932 20 5 EHBDRO C[NH+](C)C1CCC2(CC1)CCN(c1ccc([N+](=O)[O-])cc1F)CC2 ZINC000853650505 1136552737 /nfs/dbraw/zinc/55/27/37/1136552737.db2.gz SCFCVXIDWXTQAU-UHFFFAOYSA-N 1 0 335.423 3.825 20 5 EHBDRO Cc1cccc(OC[C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815563457 1136611295 /nfs/dbraw/zinc/61/12/95/1136611295.db2.gz CKFNSZVDMWPBMJ-ZIAGYGMSSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815587118 1136615140 /nfs/dbraw/zinc/61/51/40/1136615140.db2.gz ZYELPBYLRSSUGW-SGTLLEGYSA-N 1 0 343.452 3.858 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815575554 1136618090 /nfs/dbraw/zinc/61/80/90/1136618090.db2.gz UXRYTOVBRRQBDJ-OLZOCXBDSA-N 1 0 329.400 3.555 20 5 EHBDRO Cc1ccc(OC[C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815570712 1136618109 /nfs/dbraw/zinc/61/81/09/1136618109.db2.gz KSOVYIOUMWPGCC-KGLIPLIRSA-N 1 0 329.400 3.604 20 5 EHBDRO CC1(C)CCC[C@@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000815657593 1136622860 /nfs/dbraw/zinc/62/28/60/1136622860.db2.gz CLJUFMSCHLPRME-OAHLLOKOSA-N 1 0 331.460 3.980 20 5 EHBDRO CC(C)(C)C1CC([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000815642660 1136625339 /nfs/dbraw/zinc/62/53/39/1136625339.db2.gz JCXHZBDRFOKJIG-UHFFFAOYSA-N 1 0 331.460 3.978 20 5 EHBDRO CC1(C)CCC[C@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816641196 1136743377 /nfs/dbraw/zinc/74/33/77/1136743377.db2.gz LBPLEUHLBTZYJV-HNNXBMFYSA-N 1 0 347.242 3.932 20 5 EHBDRO CC(C)c1ccc([C@H](N)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951843 1136850898 /nfs/dbraw/zinc/85/08/98/1136850898.db2.gz BCKFXLQUZIRPPA-FZKQIMNGSA-N 1 0 342.443 3.651 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818961490 1136891630 /nfs/dbraw/zinc/89/16/30/1136891630.db2.gz QPELBPNAKDMCSX-IAGOWNOFSA-N 1 0 344.411 3.833 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@@H]1[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819138081 1136912445 /nfs/dbraw/zinc/91/24/45/1136912445.db2.gz LWIQJDGCGBENPN-QQGDVQBRSA-N 1 0 344.386 3.681 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000819177126 1136919747 /nfs/dbraw/zinc/91/97/47/1136919747.db2.gz APHVAWIGOBKMGI-QZTJIDSGSA-N 1 0 326.396 3.640 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)c1 ZINC000819333736 1136932181 /nfs/dbraw/zinc/93/21/81/1136932181.db2.gz REAOCOISQOVEML-MSOLQXFVSA-N 1 0 348.349 3.574 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]3COCC[C@H]32)c1 ZINC000339015681 1136995329 /nfs/dbraw/zinc/99/53/29/1136995329.db2.gz WPCFZVODFYIFHG-IAQYHMDHSA-N 1 0 344.333 3.615 20 5 EHBDRO CC[N@H+](CCNC(=O)OC(C)(C)C)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000859529387 1137018488 /nfs/dbraw/zinc/01/84/88/1137018488.db2.gz RIAIKFQGGKTHGC-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)cc1F ZINC000860102787 1137044500 /nfs/dbraw/zinc/04/45/00/1137044500.db2.gz HFUWPDBWGJLLCB-ZDUSSCGKSA-N 1 0 348.349 3.871 20 5 EHBDRO Cc1c(-c2noc([C@@H]3C[C@@H]4CCCC[C@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000823269649 1137092460 /nfs/dbraw/zinc/09/24/60/1137092460.db2.gz JSFHXQQXXAWJIX-YUTCNCBUSA-N 1 0 328.372 3.546 20 5 EHBDRO C[NH+](C)CCCC(C)(C)NC(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861903887 1137124441 /nfs/dbraw/zinc/12/44/41/1137124441.db2.gz RFVZSEGVFSGOQY-UHFFFAOYSA-N 1 0 343.427 3.598 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000824554436 1137142721 /nfs/dbraw/zinc/14/27/21/1137142721.db2.gz GFQROAPFVZSPSQ-SNVBAGLBSA-N 1 0 340.729 3.695 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccncc3)C2)cc1Cl ZINC000824952903 1137158928 /nfs/dbraw/zinc/15/89/28/1137158928.db2.gz FNDGMPKHZJDGOL-WMLDXEAASA-N 1 0 347.802 3.653 20 5 EHBDRO CCc1nc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])co1 ZINC000825057478 1137163883 /nfs/dbraw/zinc/16/38/83/1137163883.db2.gz PFEDLNFGUIUIQL-BBRMVZONSA-N 1 0 329.400 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2(c3ccccc3Cl)CCC2)cc1 ZINC000844350517 1137214226 /nfs/dbraw/zinc/21/42/26/1137214226.db2.gz HBTVHXVDICBIDH-QGZVFWFLSA-N 1 0 346.814 3.951 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]CCCO)cc2[N+](=O)[O-])cc1 ZINC000119947076 1137219861 /nfs/dbraw/zinc/21/98/61/1137219861.db2.gz ZHYDDJMOROEDML-UHFFFAOYSA-N 1 0 332.425 3.526 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](O)c1ccccc1 ZINC000794615713 1137221109 /nfs/dbraw/zinc/22/11/09/1137221109.db2.gz YKNDHJGUHULSKO-ZWKOTPCHSA-N 1 0 332.375 3.582 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(Cl)c1N1CCC([NH2+]C2CC2)CC1 ZINC000865625642 1137299942 /nfs/dbraw/zinc/29/99/42/1137299942.db2.gz SZYXDQKMFOLONR-UHFFFAOYSA-N 1 0 330.215 3.622 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000865778864 1137311055 /nfs/dbraw/zinc/31/10/55/1137311055.db2.gz ZKIBUCBPHUIEPO-GSPCDJLXSA-N 1 0 330.428 3.795 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1c(F)cncc1F ZINC000866356297 1137348963 /nfs/dbraw/zinc/34/89/63/1137348963.db2.gz CKFSMWCKXZILDQ-VHSXEESVSA-N 1 0 339.317 3.689 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1ccnc(F)c1 ZINC000866472741 1137357548 /nfs/dbraw/zinc/35/75/48/1137357548.db2.gz DTWFQHLXRFPGKR-GOEBONIOSA-N 1 0 329.375 3.630 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](C1CCC1)[C@@H]1CCOC1)CCC2 ZINC000866512002 1137360187 /nfs/dbraw/zinc/36/01/87/1137360187.db2.gz HFXUWMFOYRFYLJ-ATZDWAIDSA-N 1 0 330.428 3.767 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2cn(C)c3ncccc23)cc1[N+](=O)[O-] ZINC000866571112 1137365790 /nfs/dbraw/zinc/36/57/90/1137365790.db2.gz NMGFXJNJMKZQSK-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000772980605 1137405456 /nfs/dbraw/zinc/40/54/56/1137405456.db2.gz YBRKIDPMCCIXPL-ZDUSSCGKSA-N 1 0 345.355 3.541 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000339085545 1137431717 /nfs/dbraw/zinc/43/17/17/1137431717.db2.gz HDLJKLGXGVEXDQ-MNOVXSKESA-N 1 0 332.322 3.518 20 5 EHBDRO CCC(=O)c1ccc(N2CCC(C[NH+](CC)CC)CC2)c([N+](=O)[O-])c1 ZINC000795073821 1137448290 /nfs/dbraw/zinc/44/82/90/1137448290.db2.gz QNVDKGFUIIWKEW-UHFFFAOYSA-N 1 0 347.459 3.746 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1cccc(F)n1 ZINC000773092186 1137464619 /nfs/dbraw/zinc/46/46/19/1137464619.db2.gz ZMUOVSBHWZSAFF-BBRMVZONSA-N 1 0 329.375 3.630 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171805317 1137513321 /nfs/dbraw/zinc/51/33/21/1137513321.db2.gz RLTKFOMMLZUHES-MRXNPFEDSA-N 1 0 345.443 3.744 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041580 1137567085 /nfs/dbraw/zinc/56/70/85/1137567085.db2.gz UPUAGODCBQQEDP-RWMBFGLXSA-N 1 0 326.462 3.764 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872082844 1137570268 /nfs/dbraw/zinc/57/02/68/1137570268.db2.gz BZMZTVNTPDFLRM-ZJNRKIDTSA-N 1 0 332.375 3.681 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1 ZINC000872086902 1137570568 /nfs/dbraw/zinc/57/05/68/1137570568.db2.gz CASCTAWVXQNKIH-SJKOYZFVSA-N 1 0 348.374 3.781 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCn2nccc21 ZINC000872095220 1137571009 /nfs/dbraw/zinc/57/10/09/1137571009.db2.gz RTMHTBLUAJQTRQ-BXUZGUMPSA-N 1 0 332.429 3.699 20 5 EHBDRO CCc1noc(C2CCC([NH2+][C@H](C)c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000872129582 1137573182 /nfs/dbraw/zinc/57/31/82/1137573182.db2.gz NQZWSOLWVOBLEZ-IYXRBSQSSA-N 1 0 344.415 3.917 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)C[C@H](O)c1cccs1 ZINC000873097862 1137590167 /nfs/dbraw/zinc/59/01/67/1137590167.db2.gz XLCCLHSIMPFHOF-LRDDRELGSA-N 1 0 334.441 3.875 20 5 EHBDRO CC(C)C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876884519 1137664621 /nfs/dbraw/zinc/66/46/21/1137664621.db2.gz KQAARQFBVSYENR-LEOMRAHMSA-N 1 0 328.416 3.872 20 5 EHBDRO CC(C)Oc1cccc([C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c1 ZINC000876936644 1137665786 /nfs/dbraw/zinc/66/57/86/1137665786.db2.gz XFGYEPOXYIGNLH-JEYLPNPQSA-N 1 0 344.415 3.633 20 5 EHBDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877036499 1137668436 /nfs/dbraw/zinc/66/84/36/1137668436.db2.gz SQGOQJBNQUXHPF-QQFBHYJXSA-N 1 0 348.834 3.759 20 5 EHBDRO CCC[C@H](CCc1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877054202 1137668931 /nfs/dbraw/zinc/66/89/31/1137668931.db2.gz DLMYAJJJJJEQNU-WWDZGPRUSA-N 1 0 342.443 3.886 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000877472314 1137677455 /nfs/dbraw/zinc/67/74/55/1137677455.db2.gz PNEYRPNOQYOTEO-AMXDTQDGSA-N 1 0 328.349 3.716 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CC[C@H](c4ccc(F)cc4)C3)C2)c1 ZINC000877488233 1137678117 /nfs/dbraw/zinc/67/81/17/1137678117.db2.gz CTLYJBYPWZDEIF-OBTMHIKCSA-N 1 0 344.390 3.560 20 5 EHBDRO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCCC1 ZINC000877908669 1137695105 /nfs/dbraw/zinc/69/51/05/1137695105.db2.gz SWLJGVRTXNITLO-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO CC(C)[C@H](C)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877928033 1137695953 /nfs/dbraw/zinc/69/59/53/1137695953.db2.gz KVYOFSRPLBIKSI-JTQLQIEISA-N 1 0 338.795 3.775 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878020300 1137699879 /nfs/dbraw/zinc/69/98/79/1137699879.db2.gz NDCPKSFNIAWJOI-ZDUSSCGKSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878152396 1137704777 /nfs/dbraw/zinc/70/47/77/1137704777.db2.gz BBFVUDSLVTYKHE-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447453 1137716384 /nfs/dbraw/zinc/71/63/84/1137716384.db2.gz MUGSELXQRQAVPK-OCCSQVGLSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CC[C@H](C3CCCC3)C2)o1 ZINC000878720966 1137726200 /nfs/dbraw/zinc/72/62/00/1137726200.db2.gz RMORJGIZDKGSFJ-AWEZNQCLSA-N 1 0 342.399 3.657 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(CN2CCC23CCCC3)o1 ZINC000878801285 1137728582 /nfs/dbraw/zinc/72/85/82/1137728582.db2.gz IVNKFSGFMAFEQW-UHFFFAOYSA-N 1 0 348.790 3.817 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](C)C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000130503532 1137838907 /nfs/dbraw/zinc/83/89/07/1137838907.db2.gz SFHQECOOSAHQRF-DYVFJYSZSA-N 1 0 332.400 3.913 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCc1ccns1 ZINC000883247950 1137850445 /nfs/dbraw/zinc/85/04/45/1137850445.db2.gz CFSGKFRWJPNAGA-XJKSGUPXSA-N 1 0 331.441 3.595 20 5 EHBDRO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824706 1137922081 /nfs/dbraw/zinc/92/20/81/1137922081.db2.gz QAKPTFDMNZWLRR-SUMWQHHRSA-N 1 0 328.416 3.843 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000119244919 1137939577 /nfs/dbraw/zinc/93/95/77/1137939577.db2.gz GXQJTLBXQIGZSW-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000120892091 1137953351 /nfs/dbraw/zinc/95/33/51/1137953351.db2.gz USEULXKZIHDBAB-ZDUSSCGKSA-N 1 0 328.368 3.607 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000121060641 1137954716 /nfs/dbraw/zinc/95/47/16/1137954716.db2.gz SPULUNFNDVKWCE-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000068486886 1138085459 /nfs/dbraw/zinc/08/54/59/1138085459.db2.gz FZPFCKCKSRZDRT-INIZCTEOSA-N 1 0 333.435 3.554 20 5 EHBDRO CCc1ccccc1NC(=O)C[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000089509039 1138200072 /nfs/dbraw/zinc/20/00/72/1138200072.db2.gz SJIWILNWZCGQPL-QGZVFWFLSA-N 1 0 341.411 3.837 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)cccc1[N+](=O)[O-] ZINC000090666235 1138212770 /nfs/dbraw/zinc/21/27/70/1138212770.db2.gz UYDAIUPMRMVKTE-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000090728410 1138213047 /nfs/dbraw/zinc/21/30/47/1138213047.db2.gz QPMOKRNXXALDTQ-PXAZEXFGSA-N 1 0 343.427 3.914 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000094031720 1138243555 /nfs/dbraw/zinc/24/35/55/1138243555.db2.gz HQBLNMKFBFGZNJ-UHFFFAOYSA-N 1 0 347.459 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2[C@@H]3CC[C@H]2CC(O)C3)s1 ZINC000126656019 1138334914 /nfs/dbraw/zinc/33/49/14/1138334914.db2.gz GPYWGAWEDYONNI-PBWFPOADSA-N 1 0 344.436 3.811 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccnc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000131447657 1138518423 /nfs/dbraw/zinc/51/84/23/1138518423.db2.gz CPWCDIKZCJLAHW-SFHVURJKSA-N 1 0 340.427 3.831 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174478279 1139423169 /nfs/dbraw/zinc/42/31/69/1139423169.db2.gz MNUYJVADMNDZDL-INIZCTEOSA-N 1 0 347.462 3.802 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000177606016 1139628680 /nfs/dbraw/zinc/62/86/80/1139628680.db2.gz CAYWDCYTRFLJKZ-DNVCBOLYSA-N 1 0 348.443 3.706 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1ccc([N+](=O)[O-])cc1 ZINC000178660394 1139709833 /nfs/dbraw/zinc/70/98/33/1139709833.db2.gz HGHNYAOGHXQATO-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@H](c2nnc(C3CC3)[nH]2)C1 ZINC000179500569 1139760946 /nfs/dbraw/zinc/76/09/46/1139760946.db2.gz FGHSMVRJFPVCSV-WFASDCNBSA-N 1 0 341.415 3.531 20 5 EHBDRO O=C(Nc1cccc(CC[NH+]2CCCC2)c1)c1csc([N+](=O)[O-])c1 ZINC000179549958 1139763894 /nfs/dbraw/zinc/76/38/94/1139763894.db2.gz SOPJWNPXLXULFT-UHFFFAOYSA-N 1 0 345.424 3.547 20 5 EHBDRO CCOC1CC(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000189262781 1140331180 /nfs/dbraw/zinc/33/11/80/1140331180.db2.gz MOTGGWZREXHKES-IUPXNIOVSA-N 1 0 332.444 3.711 20 5 EHBDRO Nc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000193399575 1140575350 /nfs/dbraw/zinc/57/53/50/1140575350.db2.gz YRWBDWZASPMTBK-ZDUSSCGKSA-N 1 0 346.456 3.563 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899165 1140735871 /nfs/dbraw/zinc/73/58/71/1140735871.db2.gz TUAYBGRJDUQEGE-STQMWFEESA-N 1 0 339.395 3.526 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(N(C)C)nc1)c1cccc([N+](=O)[O-])c1 ZINC000268766366 1140986798 /nfs/dbraw/zinc/98/67/98/1140986798.db2.gz NVMBYBQDVVTINK-KRWDZBQOSA-N 1 0 328.416 3.687 20 5 EHBDRO CC(C)Oc1cccc([C@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268915305 1141025387 /nfs/dbraw/zinc/02/53/87/1141025387.db2.gz NQSVMYSIQZMYNX-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C[C@H](C)O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000268983094 1141039526 /nfs/dbraw/zinc/03/95/26/1141039526.db2.gz DDKSWCOQGHMCDN-DAYGRLMNSA-N 1 0 328.412 3.800 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](CCO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000268994922 1141042103 /nfs/dbraw/zinc/04/21/03/1141042103.db2.gz NGKHNYMUTFZBRD-RDJZCZTQSA-N 1 0 328.412 3.720 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[C@H](C)O ZINC000271496464 1141380942 /nfs/dbraw/zinc/38/09/42/1141380942.db2.gz MODNGYSCTPXXPR-UONOGXRCSA-N 1 0 340.489 3.852 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000271570758 1141399594 /nfs/dbraw/zinc/39/95/94/1141399594.db2.gz PPVIKYURCIGDQZ-SCTDSRPQSA-N 1 0 332.444 3.709 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl ZINC000271844831 1141420574 /nfs/dbraw/zinc/42/05/74/1141420574.db2.gz WQJSHGWMRMFBFI-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1cc2[nH]c(CN(CC[NH3+])c3ccccc3[N+](=O)[O-])cc2c(C)c1 ZINC000348924079 1141609918 /nfs/dbraw/zinc/60/99/18/1141609918.db2.gz UUOZJFNZXYHPED-UHFFFAOYSA-N 1 0 338.411 3.658 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000078625285 217089995 /nfs/dbraw/zinc/08/99/95/217089995.db2.gz YUMXOCPYYNLACX-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO [NH3+]C1(CNCc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)CC1 ZINC000904451092 1032059046 /nfs/dbraw/zinc/05/90/46/1032059046.db2.gz VPPPLSRZRDNUFR-UHFFFAOYSA-N 1 0 347.802 3.621 20 5 EHBDRO Cc1ccnc(NC[C@@H](c2cccs2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000301269218 1125459876 /nfs/dbraw/zinc/45/98/76/1125459876.db2.gz HHHAKUJSMOBIPK-ZDUSSCGKSA-N 1 0 332.429 3.609 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000034993934 1014235857 /nfs/dbraw/zinc/23/58/57/1014235857.db2.gz NVKXOPHKBYJNPH-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)c(F)c1 ZINC000339428594 1014410102 /nfs/dbraw/zinc/41/01/02/1014410102.db2.gz MHFTWPMYVFYZPR-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO CC[NH+](CC)CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000023380616 1014471960 /nfs/dbraw/zinc/47/19/60/1014471960.db2.gz PZHVYAXCNSMGHB-UHFFFAOYSA-N 1 0 341.411 3.580 20 5 EHBDRO COc1ccc([C@H](CNc2ccc([N+](=O)[O-])s2)[NH+]2CCCC2)cc1 ZINC000064029164 1014759051 /nfs/dbraw/zinc/75/90/51/1014759051.db2.gz YJGYYLGODOFUDH-HNNXBMFYSA-N 1 0 347.440 3.914 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449061041 1032103861 /nfs/dbraw/zinc/10/38/61/1032103861.db2.gz HISJTNMNDPEJCA-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC000175730120 1014819673 /nfs/dbraw/zinc/81/96/73/1014819673.db2.gz IDVQAQFYSCPIGR-QGZVFWFLSA-N 1 0 345.374 3.756 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000430215458 1015027784 /nfs/dbraw/zinc/02/77/84/1015027784.db2.gz DWVQLAUPBNOLGM-UHFFFAOYSA-N 1 0 342.395 3.689 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN3CC[C@H]([NH+]4CCCC4)C3)o2)c1 ZINC000127055018 1015210072 /nfs/dbraw/zinc/21/00/72/1015210072.db2.gz TVLFWVKSGPARQL-KRWDZBQOSA-N 1 0 341.411 3.525 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2nc(C)c(C)s2)cc1[N+](=O)[O-] ZINC000154273599 1015332211 /nfs/dbraw/zinc/33/22/11/1015332211.db2.gz OEPWESVEXVTANA-GFCCVEGCSA-N 1 0 349.456 3.960 20 5 EHBDRO CC[C@H](C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680285 1032122534 /nfs/dbraw/zinc/12/25/34/1032122534.db2.gz LMBDJUNXJWBDFN-WBVHZDCISA-N 1 0 340.427 3.670 20 5 EHBDRO CCC(CC)(CC)[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000471222800 1015801327 /nfs/dbraw/zinc/80/13/27/1015801327.db2.gz MGRIJVXVDWLOGJ-UHFFFAOYSA-N 1 0 327.812 3.745 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000449057031 1032135831 /nfs/dbraw/zinc/13/58/31/1032135831.db2.gz AIRJTPNJAAEKDO-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000175432138 1016241055 /nfs/dbraw/zinc/24/10/55/1016241055.db2.gz RDKJEEDLWGEHKI-OLZOCXBDSA-N 1 0 336.823 3.569 20 5 EHBDRO Cc1nc(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)c(C)o1 ZINC000340194043 1016665489 /nfs/dbraw/zinc/66/54/89/1016665489.db2.gz HHLRCUALIQTQEB-UHFFFAOYSA-N 1 0 341.367 3.792 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1[N+](=O)[O-] ZINC000892713357 1017032826 /nfs/dbraw/zinc/03/28/26/1017032826.db2.gz HBRZUBDEOSXXLQ-UHFFFAOYSA-N 1 0 340.301 3.970 20 5 EHBDRO COc1ccc(CNC[C@H]([NH3+])c2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000414844370 1017236673 /nfs/dbraw/zinc/23/66/73/1017236673.db2.gz KTGVGBROVQZQFC-KRWDZBQOSA-N 1 0 343.427 3.516 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+]C(C)(C)c1cccc(F)c1 ZINC000538214864 1032218962 /nfs/dbraw/zinc/21/89/62/1032218962.db2.gz IUJAERQGKNGQAB-UHFFFAOYSA-N 1 0 345.374 3.506 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000461090167 1032246424 /nfs/dbraw/zinc/24/64/24/1032246424.db2.gz RZTUJVKREQTYDO-GJZGRUSLSA-N 1 0 343.402 3.911 20 5 EHBDRO CCc1ccc(C(C)(C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000538258812 1032254331 /nfs/dbraw/zinc/25/43/31/1032254331.db2.gz JYSGXMFQERZXTI-UHFFFAOYSA-N 1 0 341.411 3.621 20 5 EHBDRO C[C@@H](COCc1ccccc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449176130 1032269329 /nfs/dbraw/zinc/26/93/29/1032269329.db2.gz SCVSYEHTKFDIQX-HOTGVXAUSA-N 1 0 328.412 3.721 20 5 EHBDRO CC[N@H+](Cc1ccccc1C)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000485143985 1032332701 /nfs/dbraw/zinc/33/27/01/1032332701.db2.gz JZTLDMVVWJAZMX-OAHLLOKOSA-N 1 0 341.411 3.752 20 5 EHBDRO CC[N@H+](C[C@@H]1COc2ccccc2O1)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189006 1032369009 /nfs/dbraw/zinc/36/90/09/1032369009.db2.gz FKGWQLJOKCEKOP-HUUCEWRRSA-N 1 0 342.395 3.818 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000449283006 1032403357 /nfs/dbraw/zinc/40/33/57/1032403357.db2.gz JRANISLQJHVCCD-CQSZACIVSA-N 1 0 325.412 3.589 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000459693040 1032418118 /nfs/dbraw/zinc/41/81/18/1032418118.db2.gz HFPIKBIHEJWGSF-CYBMUJFWSA-N 1 0 332.787 3.514 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CN(C)C)c1ccc(F)cc1 ZINC000449329705 1032441935 /nfs/dbraw/zinc/44/19/35/1032441935.db2.gz IYTCLTOXUYBEGL-KSSFIOAISA-N 1 0 345.418 3.557 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449341601 1032455054 /nfs/dbraw/zinc/45/50/54/1032455054.db2.gz ZRSISXPDCGFXRV-HNNXBMFYSA-N 1 0 327.428 3.797 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1O ZINC000449346674 1032462428 /nfs/dbraw/zinc/46/24/28/1032462428.db2.gz BZCAOJTXJWPLBI-KBPBESRZSA-N 1 0 344.411 3.981 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000449369143 1032484704 /nfs/dbraw/zinc/48/47/04/1032484704.db2.gz QVWMNXNOOIKGFQ-UHFFFAOYSA-N 1 0 348.443 3.511 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1 ZINC000537029594 1032492621 /nfs/dbraw/zinc/49/26/21/1032492621.db2.gz DATXXZJJSLYHNA-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115609 1032527683 /nfs/dbraw/zinc/52/76/83/1032527683.db2.gz JJLYBMYQDDQGJM-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCc2noc3ccccc32)C2CC2)c1 ZINC000593963692 1032644501 /nfs/dbraw/zinc/64/45/01/1032644501.db2.gz SOSHIEOWQDOCSA-UHFFFAOYSA-N 1 0 337.379 3.943 20 5 EHBDRO COc1cc(C)nc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504368 1032687565 /nfs/dbraw/zinc/68/75/65/1032687565.db2.gz VVKRQVCHBJSLLK-MRXNPFEDSA-N 1 0 341.411 3.686 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083171886 1017758575 /nfs/dbraw/zinc/75/85/75/1017758575.db2.gz SBEGXBRTBCSJMD-ZDUSSCGKSA-N 1 0 335.429 3.844 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000185876063 1017792403 /nfs/dbraw/zinc/79/24/03/1017792403.db2.gz PNRKMSQTMGYSIX-CQSZACIVSA-N 1 0 330.388 3.799 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)[C@@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099337 1018470370 /nfs/dbraw/zinc/47/03/70/1018470370.db2.gz LPSCNUHECWEEGT-CHWSQXEVSA-N 1 0 330.384 3.591 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000592396646 1032767241 /nfs/dbraw/zinc/76/72/41/1032767241.db2.gz IERKKCPJTKGQTJ-MZMPZRCHSA-N 1 0 327.384 3.561 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCCNc1ccccn1 ZINC000468625115 1018498532 /nfs/dbraw/zinc/49/85/32/1018498532.db2.gz KEUYTFKWTKAFCY-SSZFMOIBSA-N 1 0 340.427 3.875 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)[C@H](CCO)c1ccccc1 ZINC000122710013 1018570608 /nfs/dbraw/zinc/57/06/08/1018570608.db2.gz QNYMJPRYRJEXMZ-MRXNPFEDSA-N 1 0 334.803 3.804 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3[C@@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000576293283 1018732001 /nfs/dbraw/zinc/73/20/01/1018732001.db2.gz PBTKQXFROPCPFM-UOIKSKOESA-N 1 0 328.368 3.752 20 5 EHBDRO C[C@H]([NH2+][C@H]1C[C@H](C)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997939 1018935162 /nfs/dbraw/zinc/93/51/62/1018935162.db2.gz CRGBNLRVOJOOIM-BXWFABGCSA-N 1 0 339.439 3.908 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccccc1F ZINC000592402473 1032797850 /nfs/dbraw/zinc/79/78/50/1032797850.db2.gz HMPJIQVBDMOLDB-KBXCAEBGSA-N 1 0 346.402 3.768 20 5 EHBDRO C[C@@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000610422091 1019028979 /nfs/dbraw/zinc/02/89/79/1019028979.db2.gz YRUHTUPVMLEHFU-BEFAXECRSA-N 1 0 336.395 3.883 20 5 EHBDRO C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000473507440 1019077486 /nfs/dbraw/zinc/07/74/86/1019077486.db2.gz LAARLNPUCTZRCF-IBGZPJMESA-N 1 0 348.406 3.636 20 5 EHBDRO Cc1c(C[NH2+][C@H](Cn2cccn2)c2ccccc2)cccc1[N+](=O)[O-] ZINC000610433073 1019093901 /nfs/dbraw/zinc/09/39/01/1019093901.db2.gz VMDKBAGMOXNNHL-GOSISDBHSA-N 1 0 336.395 3.631 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109672 1019362018 /nfs/dbraw/zinc/36/20/18/1019362018.db2.gz BJBSHLLBVDYCGK-WMLDXEAASA-N 1 0 331.416 3.922 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000513412989 1019643444 /nfs/dbraw/zinc/64/34/44/1019643444.db2.gz FQJGSDCNOXFQJS-GNJLHFKMSA-N 1 0 348.406 3.905 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H](CO)c1ccsc1 ZINC000471601711 1019734789 /nfs/dbraw/zinc/73/47/89/1019734789.db2.gz KVNLBQGRRHFZNQ-XKQJLSEDSA-N 1 0 346.452 3.691 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2c3c(ccc2[N+](=O)[O-])NCC3)CC1 ZINC000430504955 1019947568 /nfs/dbraw/zinc/94/75/68/1019947568.db2.gz ZJYCRYNZWDXNJG-UHFFFAOYSA-N 1 0 346.475 3.511 20 5 EHBDRO CCC[C@H](C)[N@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000048070682 1020059032 /nfs/dbraw/zinc/05/90/32/1020059032.db2.gz NERQALGUEKEALP-JTQLQIEISA-N 1 0 332.347 3.825 20 5 EHBDRO C[N@@H+](Cc1ccccc1[N+](=O)[O-])C[C@@H]1CCN(c2ccccc2)C1 ZINC000602440624 1032890205 /nfs/dbraw/zinc/89/02/05/1032890205.db2.gz QNHYCXNBOCGUQN-INIZCTEOSA-N 1 0 325.412 3.553 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CC[NH+](C2CCCCC2)CC1 ZINC000473536149 1020590308 /nfs/dbraw/zinc/59/03/08/1020590308.db2.gz ZOUYNCWCLHMRJD-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413084579 1020663812 /nfs/dbraw/zinc/66/38/12/1020663812.db2.gz LYJOXVOCPUPLNM-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138303 1020727340 /nfs/dbraw/zinc/72/73/40/1020727340.db2.gz XTNUSENHHZKUON-KBPBESRZSA-N 1 0 333.432 3.822 20 5 EHBDRO CC1(C)C[C@@H](O)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449616943 1032936239 /nfs/dbraw/zinc/93/62/39/1032936239.db2.gz FQFGWOMDRKIMOB-AWEZNQCLSA-N 1 0 344.411 3.838 20 5 EHBDRO CC(=O)c1ccc(NCc2ccc(CC[NH+](C)C)cc2)c([N+](=O)[O-])c1 ZINC000276251579 1020962589 /nfs/dbraw/zinc/96/25/89/1020962589.db2.gz DMXLKHHSLVSKPY-UHFFFAOYSA-N 1 0 341.411 3.514 20 5 EHBDRO CCOCCC1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCC1 ZINC000602565785 1032978491 /nfs/dbraw/zinc/97/84/91/1032978491.db2.gz GLNUBSBZANUIPO-UHFFFAOYSA-N 1 0 347.415 3.813 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCOC[C@@H]1Cc1ccccc1 ZINC000507685691 1021435049 /nfs/dbraw/zinc/43/50/49/1021435049.db2.gz ULEVWCKOYIUJQE-IUYMFKLXSA-N 1 0 338.407 3.552 20 5 EHBDRO COCCC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602568766 1032981418 /nfs/dbraw/zinc/98/14/18/1032981418.db2.gz MBLRGKFTCBWHIW-UHFFFAOYSA-N 1 0 332.322 3.520 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437108299 1021564267 /nfs/dbraw/zinc/56/42/67/1021564267.db2.gz NBLCBAVJGFWJHL-KXBFYZLASA-N 1 0 339.439 3.944 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)cc1[N+](=O)[O-] ZINC000506646278 1021634570 /nfs/dbraw/zinc/63/45/70/1021634570.db2.gz BLZNAROHALUDID-UHFFFAOYSA-N 1 0 326.396 3.988 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000518934492 1021687735 /nfs/dbraw/zinc/68/77/35/1021687735.db2.gz ZFLXEEKDGIIYBQ-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602582214 1033001649 /nfs/dbraw/zinc/00/16/49/1033001649.db2.gz MFRCTUALILCRFT-BXUZGUMPSA-N 1 0 332.322 3.518 20 5 EHBDRO CCC(CC)[C@@H](CC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)OC ZINC000602581255 1032998820 /nfs/dbraw/zinc/99/88/20/1032998820.db2.gz JCCHWFMUALMBCQ-OAHLLOKOSA-N 1 0 335.404 3.667 20 5 EHBDRO CC(C)[C@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602581379 1032999308 /nfs/dbraw/zinc/99/93/08/1032999308.db2.gz JEHVEEHNNPNJEW-DZGCQCFKSA-N 1 0 346.349 3.907 20 5 EHBDRO Cc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cn2)[NH+]2CCCC2)cc1 ZINC000141071110 1021844877 /nfs/dbraw/zinc/84/48/77/1021844877.db2.gz OUUGPTHYKZTENF-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]([C@@H]2CCOC2)C1 ZINC000441295809 1022138704 /nfs/dbraw/zinc/13/87/04/1022138704.db2.gz UATQVSYPTUBEPB-JKSUJKDBSA-N 1 0 348.443 3.631 20 5 EHBDRO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCOc1ccccc1F ZINC000506140911 1022176756 /nfs/dbraw/zinc/17/67/56/1022176756.db2.gz LMSANYKSWDPYEN-SOFGYWHQSA-N 1 0 330.359 3.758 20 5 EHBDRO CC(C)[C@@H]1[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])CC12CCOCC2 ZINC000894921027 1022249862 /nfs/dbraw/zinc/24/98/62/1022249862.db2.gz VLJVRMAKDYWOFN-INIZCTEOSA-N 1 0 338.835 3.885 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000187564763 1022338295 /nfs/dbraw/zinc/33/82/95/1022338295.db2.gz NNPPACQJHLSKBS-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@H](OC)C3)o2)c([N+](=O)[O-])c1 ZINC000471819818 1022399684 /nfs/dbraw/zinc/39/96/84/1022399684.db2.gz DOLXHLMIUARDPE-STQMWFEESA-N 1 0 346.383 3.521 20 5 EHBDRO CC1(C)C[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602686744 1033066988 /nfs/dbraw/zinc/06/69/88/1033066988.db2.gz HKQIGRADNKSLKA-LLVKDONJSA-N 1 0 346.349 3.908 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC[C@H]1C ZINC000517722935 1022597298 /nfs/dbraw/zinc/59/72/98/1022597298.db2.gz HWCUTLJXQGKXTL-RBSFLKMASA-N 1 0 338.473 3.728 20 5 EHBDRO CC1=C(C)C[N@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280781523 1022706490 /nfs/dbraw/zinc/70/64/90/1022706490.db2.gz QCUGQSBAXMESCM-CYBMUJFWSA-N 1 0 328.372 3.748 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000438541926 1022769934 /nfs/dbraw/zinc/76/99/34/1022769934.db2.gz RZRCXGISBNDTCE-JQWIXIFHSA-N 1 0 344.358 3.526 20 5 EHBDRO COc1cccc([C@H](CNc2ccc([N+](=O)[O-])c(C)c2)[NH+](C)C)c1 ZINC000058940584 1033080552 /nfs/dbraw/zinc/08/05/52/1033080552.db2.gz UTANRYRFHVJXRH-SFHVURJKSA-N 1 0 329.400 3.627 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCCC1 ZINC000602683434 1033084007 /nfs/dbraw/zinc/08/40/07/1033084007.db2.gz VRXMRNOUGFQZRR-QGZVFWFLSA-N 1 0 332.448 3.517 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](CNC(=O)C(C)(C)C)C1 ZINC000075740991 1033095089 /nfs/dbraw/zinc/09/50/89/1033095089.db2.gz UPNMSOQLMODUQD-LSDHHAIUSA-N 1 0 347.459 3.530 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000506417040 1023088348 /nfs/dbraw/zinc/08/83/48/1023088348.db2.gz PEZOOLRZYCBPCL-KRWDZBQOSA-N 1 0 343.427 3.771 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](CCO)C3)s2)cc1 ZINC000093105936 1023151684 /nfs/dbraw/zinc/15/16/84/1023151684.db2.gz ZFBPJZMPFYIXGD-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000449725197 1033113779 /nfs/dbraw/zinc/11/37/79/1033113779.db2.gz NWMHFGNBVXKZHP-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO CCn1nc(C)c(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1C ZINC000602729223 1033117246 /nfs/dbraw/zinc/11/72/46/1033117246.db2.gz UXWMSHSDAPSQFJ-NTMALXAHSA-N 1 0 328.416 3.573 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](O)C[C@@H]1c1ccccc1 ZINC000602729765 1033117866 /nfs/dbraw/zinc/11/78/66/1033117866.db2.gz CLMOGNKHTAMATJ-RBUKOAKNSA-N 1 0 326.396 3.601 20 5 EHBDRO CC[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)[C@@H](C)C1 ZINC000341770829 1023299019 /nfs/dbraw/zinc/29/90/19/1023299019.db2.gz JVNQSRSWSXCHBB-HNNXBMFYSA-N 1 0 333.435 3.554 20 5 EHBDRO CCC[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000548488331 1023496539 /nfs/dbraw/zinc/49/65/39/1023496539.db2.gz NRVKQVNJVSQZQB-RHSMWYFYSA-N 1 0 333.432 3.790 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)CC2CCCC2)cc1[N+](=O)[O-] ZINC000510944350 1023525929 /nfs/dbraw/zinc/52/59/29/1023525929.db2.gz JLORAVFSXGDMRL-XJKSGUPXSA-N 1 0 336.432 3.585 20 5 EHBDRO CN(C)c1cccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000610865039 1023809296 /nfs/dbraw/zinc/80/92/96/1023809296.db2.gz HTTLMFLWJMEFLS-UHFFFAOYSA-N 1 0 325.412 3.825 20 5 EHBDRO C[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1ccccc1-c1ccccc1 ZINC000176224925 1023899275 /nfs/dbraw/zinc/89/92/75/1023899275.db2.gz DIVQKJCCVIZYPE-UHFFFAOYSA-N 1 0 336.395 3.590 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@H]3CCCC(F)(F)C3)CC2)c1 ZINC000513973417 1024003828 /nfs/dbraw/zinc/00/38/28/1024003828.db2.gz WBEBOXIBZAOXLY-AWEZNQCLSA-N 1 0 339.386 3.542 20 5 EHBDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780080 1024007262 /nfs/dbraw/zinc/00/72/62/1024007262.db2.gz MMRFSTUITBHBJC-CJNGLKHVSA-N 1 0 342.436 3.896 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000441529661 1024039516 /nfs/dbraw/zinc/03/95/16/1024039516.db2.gz AHCIWVCVONQCCL-ARFHVFGLSA-N 1 0 347.459 3.673 20 5 EHBDRO COc1ccccc1C(C)(C)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000507783405 1024210953 /nfs/dbraw/zinc/21/09/53/1024210953.db2.gz BUINICHVOIFBFX-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000380677269 1024434912 /nfs/dbraw/zinc/43/49/12/1024434912.db2.gz OUUNGGKQDFMRRA-FTRWYGJKSA-N 1 0 339.439 3.908 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](C1CCCCC1)[NH+](C)C ZINC000474161932 1024469845 /nfs/dbraw/zinc/46/98/45/1024469845.db2.gz XFSZCUAEZBXGML-SFHVURJKSA-N 1 0 335.448 3.664 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310314753 1024476671 /nfs/dbraw/zinc/47/66/71/1024476671.db2.gz UVVJYXRHXVNUIT-HNNXBMFYSA-N 1 0 329.375 3.668 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000472057779 1024524240 /nfs/dbraw/zinc/52/42/40/1024524240.db2.gz LSCDUXZFOYUGDB-BEFAXECRSA-N 1 0 327.428 3.684 20 5 EHBDRO CCOC(=O)C[C@@H](C)[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346336820 1024658977 /nfs/dbraw/zinc/65/89/77/1024658977.db2.gz PQOGFGFSHPKIHY-CYBMUJFWSA-N 1 0 346.383 3.628 20 5 EHBDRO COc1ccc(C[NH2+]CC2CC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000237335233 1024841084 /nfs/dbraw/zinc/84/10/84/1024841084.db2.gz AEHNDWBJHFGZMS-UHFFFAOYSA-N 1 0 342.395 3.682 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ncccc1[N+](=O)[O-] ZINC000071954894 1024884882 /nfs/dbraw/zinc/88/48/82/1024884882.db2.gz MCKZAEKEUAMFJQ-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000474023464 1024987878 /nfs/dbraw/zinc/98/78/78/1024987878.db2.gz MGTSPTPYYLVGLG-LLVKDONJSA-N 1 0 328.359 3.907 20 5 EHBDRO Cc1ccc([C@H](C)C[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000515054413 1024988363 /nfs/dbraw/zinc/98/83/63/1024988363.db2.gz GUVFTAJFGNUTAK-OAHLLOKOSA-N 1 0 341.411 3.625 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1cccc(OC)c1 ZINC000346785772 1025098463 /nfs/dbraw/zinc/09/84/63/1025098463.db2.gz AFDHQZLZYVFYKW-KRWDZBQOSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3C[C@H]4CCC[C@@H]43)cs2)c1 ZINC000897952467 1033259195 /nfs/dbraw/zinc/25/91/95/1033259195.db2.gz GRIRILLYCPDBSO-XFBWCDHKSA-N 1 0 329.425 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(CNC[C@H]2CCC[N@@H+]2C2CCCCC2)c(F)c1 ZINC000435746951 1025122554 /nfs/dbraw/zinc/12/25/54/1025122554.db2.gz CDXJZUPXBCSLFB-QGZVFWFLSA-N 1 0 335.423 3.621 20 5 EHBDRO Cc1cc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310352387 1025131429 /nfs/dbraw/zinc/13/14/29/1025131429.db2.gz HFQOPBUEDMJJFX-KRWDZBQOSA-N 1 0 325.412 3.837 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(F)c2cccnc12 ZINC000511075950 1025305708 /nfs/dbraw/zinc/30/57/08/1025305708.db2.gz UVOMFXLMHYWULS-UHFFFAOYSA-N 1 0 339.370 3.957 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346993834 1025395843 /nfs/dbraw/zinc/39/58/43/1025395843.db2.gz BAYSOFGYSZEQME-CJNGLKHVSA-N 1 0 329.400 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334246 1025506262 /nfs/dbraw/zinc/50/62/62/1025506262.db2.gz UIYFFZSXAPYMGB-ZIAGYGMSSA-N 1 0 331.441 3.985 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)cc1 ZINC000046556707 1033292152 /nfs/dbraw/zinc/29/21/52/1033292152.db2.gz GOKFLXCUQPCWFJ-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)OC(C)C ZINC000185726846 1025700266 /nfs/dbraw/zinc/70/02/66/1025700266.db2.gz WQXKUFFFPWYSJZ-IBGZPJMESA-N 1 0 344.411 3.859 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@H](Nc2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000530384532 1025760532 /nfs/dbraw/zinc/76/05/32/1025760532.db2.gz NFUQYYUCZHKKKE-QGZVFWFLSA-N 1 0 334.379 3.742 20 5 EHBDRO Cc1noc2ncc(C[NH2+]CCCCc3ccc([N+](=O)[O-])cc3)cc12 ZINC000894316555 1025776437 /nfs/dbraw/zinc/77/64/37/1025776437.db2.gz WLCSYBMOGCGLDG-UHFFFAOYSA-N 1 0 340.383 3.552 20 5 EHBDRO C/C=C/C[C@@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000185822750 1025947572 /nfs/dbraw/zinc/94/75/72/1025947572.db2.gz MBEXILMJOAEBSM-HSWBROFVSA-N 1 0 332.425 3.740 20 5 EHBDRO Cc1nc(C)c(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000119796125 1025996764 /nfs/dbraw/zinc/99/67/64/1025996764.db2.gz KISVBPJYLQCNCQ-HNNXBMFYSA-N 1 0 331.441 3.779 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@@H]2CCCO[C@@H]2C1(C)C ZINC000451480215 1025997344 /nfs/dbraw/zinc/99/73/44/1025997344.db2.gz PQUIVNNTUQBODP-JQHSSLGASA-N 1 0 348.443 3.675 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)c2ccc(F)cc2C)c1[N+](=O)[O-] ZINC000896803857 1026023851 /nfs/dbraw/zinc/02/38/51/1026023851.db2.gz KSUQOAZBKYJUTG-NSHDSACASA-N 1 0 334.347 3.607 20 5 EHBDRO C[C@@H](CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)OCc1ccccc1 ZINC000530548276 1026030368 /nfs/dbraw/zinc/03/03/68/1026030368.db2.gz JPZSILILHRIFNF-INIZCTEOSA-N 1 0 340.423 3.948 20 5 EHBDRO CC(C)C[C@@H](CNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)[NH+](C)C ZINC000511109205 1026070477 /nfs/dbraw/zinc/07/04/77/1026070477.db2.gz KBLNAJDFXLTPGZ-AWEZNQCLSA-N 1 0 349.456 3.516 20 5 EHBDRO Cc1ncsc1CC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451554466 1026107451 /nfs/dbraw/zinc/10/74/51/1026107451.db2.gz ZVDUIFPVVULFRA-HNNXBMFYSA-N 1 0 331.441 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCc3ccncc3)C2)cc1 ZINC000451554172 1026108480 /nfs/dbraw/zinc/10/84/80/1026108480.db2.gz ZLMWIOHUZWTCRB-SFHVURJKSA-N 1 0 325.412 3.802 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2)C2CCCCC2)c1 ZINC000530626631 1026152206 /nfs/dbraw/zinc/15/22/06/1026152206.db2.gz OVOVSAZWWXYSNT-UHFFFAOYSA-N 1 0 328.416 3.626 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H]3CCCCO3)o2)c([N+](=O)[O-])c1 ZINC000237430378 1026230456 /nfs/dbraw/zinc/23/04/56/1026230456.db2.gz NBDKVIJRANBXJV-CQSZACIVSA-N 1 0 346.383 3.522 20 5 EHBDRO Cc1cnc(C2CC[NH+](CCOc3ccccc3[N+](=O)[O-])CC2)s1 ZINC000277608682 1026292338 /nfs/dbraw/zinc/29/23/38/1026292338.db2.gz XXZCIXLOSMYTSB-UHFFFAOYSA-N 1 0 347.440 3.618 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCCC[C@H]1C ZINC000530855961 1026354961 /nfs/dbraw/zinc/35/49/61/1026354961.db2.gz XNTOVWNKPHESMM-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@H](NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000452182651 1026551451 /nfs/dbraw/zinc/55/14/51/1026551451.db2.gz HZKJIBHPCCQYRY-KSSFIOAISA-N 1 0 345.443 3.569 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000531092532 1026559935 /nfs/dbraw/zinc/55/99/35/1026559935.db2.gz BWGPFDMNOYWNLV-UHFFFAOYSA-N 1 0 345.365 3.924 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237516025 1026645289 /nfs/dbraw/zinc/64/52/89/1026645289.db2.gz JTFULGTVBDAEMT-CABCVRRESA-N 1 0 342.443 3.911 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)N(C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000158629892 1026752956 /nfs/dbraw/zinc/75/29/56/1026752956.db2.gz PLLMEWWTZGNGAY-SFHVURJKSA-N 1 0 341.411 3.641 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+][C@@H]1CCCCC[C@H]1O ZINC000562108024 1026786613 /nfs/dbraw/zinc/78/66/13/1026786613.db2.gz PHVQNAGBQHAVJW-KLICCBINSA-N 1 0 332.444 3.589 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N(C)C)cc1[N+](=O)[O-] ZINC000479847522 1026855563 /nfs/dbraw/zinc/85/55/63/1026855563.db2.gz BQWDGSOQROSHRD-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO CC(C)C[C@@H](CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@@H](C)c1ccccc1 ZINC000347326215 1026923587 /nfs/dbraw/zinc/92/35/87/1026923587.db2.gz WWRZQWCBGVLCKN-HOCLYGCPSA-N 1 0 345.447 3.506 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)Cc1ccsc1 ZINC000187786747 1027081211 /nfs/dbraw/zinc/08/12/11/1027081211.db2.gz NCOUYHQDXCOPFQ-SUMWQHHRSA-N 1 0 334.441 3.643 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N3CCC[C@H]([NH+]4CCCC4)CC3)c2c1 ZINC000413156658 1027138997 /nfs/dbraw/zinc/13/89/97/1027138997.db2.gz ORYBSKINPDYRCB-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2ccccc2)CCOCC1)c1ccc([N+](=O)[O-])cc1 ZINC000178644060 1027230418 /nfs/dbraw/zinc/23/04/18/1027230418.db2.gz BTEZMEQFWFMUBX-MRXNPFEDSA-N 1 0 340.423 3.994 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178648830 1027266398 /nfs/dbraw/zinc/26/63/98/1027266398.db2.gz MMGDGDSQKBHUSQ-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO COc1cccc(C2([NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000453162232 1027475513 /nfs/dbraw/zinc/47/55/13/1027475513.db2.gz GEPMJZWFNJRKLT-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1cccc(O[C@H](C)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178659606 1027620297 /nfs/dbraw/zinc/62/02/97/1027620297.db2.gz AXRQXVDJDMDHOC-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO Cc1ccc(C)c(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000501902777 1027632514 /nfs/dbraw/zinc/63/25/14/1027632514.db2.gz YVSHDWUOABZGHZ-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001167625277 1027948541 /nfs/dbraw/zinc/94/85/41/1027948541.db2.gz JGWIQTFJIZFMAL-UHFFFAOYSA-N 1 0 346.406 3.767 20 5 EHBDRO CC[N@H+](CCC1CCN(c2ccccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000536621575 1027966515 /nfs/dbraw/zinc/96/65/15/1027966515.db2.gz SXSPAVRPQFZOAQ-UHFFFAOYSA-N 1 0 331.460 3.933 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000300421469 1027966990 /nfs/dbraw/zinc/96/69/90/1027966990.db2.gz FAUQPZUEACTAGG-GHMZBOCLSA-N 1 0 342.237 3.560 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(N3CCc4ccccc43)CC2)c1 ZINC000502313802 1028113808 /nfs/dbraw/zinc/11/38/08/1028113808.db2.gz CNMFZCCNKPGXAG-UHFFFAOYSA-N 1 0 337.423 3.622 20 5 EHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H](C)Cc1ccsc1 ZINC000444670188 1028142868 /nfs/dbraw/zinc/14/28/68/1028142868.db2.gz AFHWLRPSWITDCB-LBPRGKRZSA-N 1 0 344.440 3.986 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCCC1(O)CCC1 ZINC000421374932 1028335208 /nfs/dbraw/zinc/33/52/08/1028335208.db2.gz FTLVGGRZHRHOSS-RDJZCZTQSA-N 1 0 332.444 3.591 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000421394503 1028372154 /nfs/dbraw/zinc/37/21/54/1028372154.db2.gz XOQZVQDHXKYQLX-KGLIPLIRSA-N 1 0 330.384 3.902 20 5 EHBDRO CCc1ccccc1[C@H](N)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505224 1028469852 /nfs/dbraw/zinc/46/98/52/1028469852.db2.gz OCHUTDGQJMZGDA-RDTXWAMCSA-N 1 0 327.428 3.816 20 5 EHBDRO COC(=O)c1oc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1C ZINC000064349968 1028474731 /nfs/dbraw/zinc/47/47/31/1028474731.db2.gz YZXHEYPDGIIMFA-UHFFFAOYSA-N 1 0 346.383 3.693 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN1CC=C(c2ccc(O)cc2)CC1 ZINC000343005287 1028613324 /nfs/dbraw/zinc/61/33/24/1028613324.db2.gz BYEHSHYSLVUJOB-UHFFFAOYSA-N 1 0 340.379 3.598 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCN(Cc2cccc(F)c2)CC1 ZINC000502771754 1028656590 /nfs/dbraw/zinc/65/65/90/1028656590.db2.gz YSQSWBFZLIOXRQ-OAHLLOKOSA-N 1 0 343.402 3.613 20 5 EHBDRO CN(C[C@H]1CCC[N@@H+]1C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000421706670 1028702002 /nfs/dbraw/zinc/70/20/02/1028702002.db2.gz VLZJCTIZZUOALV-MRXNPFEDSA-N 1 0 333.435 3.554 20 5 EHBDRO C[C@H](CNc1ccc(Br)cc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000061591086 1028743696 /nfs/dbraw/zinc/74/36/96/1028743696.db2.gz UHMFOCYSHNOMPP-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO Cc1c(NC(=O)CC[C@H]([NH3+])CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000424076196 1028775335 /nfs/dbraw/zinc/77/53/35/1028775335.db2.gz LLGCRYOTVACLHB-HNNXBMFYSA-N 1 0 333.432 3.920 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000524189016 1028952883 /nfs/dbraw/zinc/95/28/83/1028952883.db2.gz RGPZFSARAFOZLS-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504906418 1029049476 /nfs/dbraw/zinc/04/94/76/1029049476.db2.gz XSFHVCQTHSZNNN-XHSDSOJGSA-N 1 0 349.475 3.765 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504906417 1029050158 /nfs/dbraw/zinc/05/01/58/1029050158.db2.gz XSFHVCQTHSZNNN-PMPSAXMXSA-N 1 0 349.475 3.765 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOC2CCCCC2)cc1[N+](=O)[O-] ZINC000504911089 1029053604 /nfs/dbraw/zinc/05/36/04/1029053604.db2.gz AIQDUIBUTADNOJ-CQSZACIVSA-N 1 0 336.432 3.993 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927451 1029072732 /nfs/dbraw/zinc/07/27/32/1029072732.db2.gz PAQMFSIPRGYPME-HOTGVXAUSA-N 1 0 349.475 3.766 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066367 1029237427 /nfs/dbraw/zinc/23/74/27/1029237427.db2.gz WSJVREGQZGKCNL-DYVFJYSZSA-N 1 0 334.416 3.862 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000505259069 1029416881 /nfs/dbraw/zinc/41/68/81/1029416881.db2.gz BXOSJCFRWCMWOB-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO CCC[C@H]([NH2+]C[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000169151433 1029522978 /nfs/dbraw/zinc/52/29/78/1029522978.db2.gz OHWDJZOGAWSWNA-OALUTQOASA-N 1 0 328.412 3.933 20 5 EHBDRO CC[S@@](=O)[C@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000162911750 1029681086 /nfs/dbraw/zinc/68/10/86/1029681086.db2.gz UHDQDNICDCNOQF-NIUAMNACSA-N 1 0 338.473 3.634 20 5 EHBDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407733 1029839312 /nfs/dbraw/zinc/83/93/12/1029839312.db2.gz HLAMISMXLMIVHU-CABCVRRESA-N 1 0 326.824 3.884 20 5 EHBDRO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525409447 1029840014 /nfs/dbraw/zinc/84/00/14/1029840014.db2.gz ZWWZRGJZHAADCE-ZTFGCOKTSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)c1cn[nH]c1 ZINC000533803614 1029850835 /nfs/dbraw/zinc/85/08/35/1029850835.db2.gz VHGBYLRZIVFFBQ-LLVKDONJSA-N 1 0 328.397 3.897 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])CCc1ccccc1 ZINC000441198662 1029932861 /nfs/dbraw/zinc/93/28/61/1029932861.db2.gz NFAUPPYBDGSPIP-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO CC(C)[N@H+](CCc1ccc2c(c1)CCO2)Cc1ccc([N+](=O)[O-])cc1 ZINC000441212496 1029963901 /nfs/dbraw/zinc/96/39/01/1029963901.db2.gz XMVDKUKSKKGZQK-UHFFFAOYSA-N 1 0 340.423 3.983 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453263935 1029998062 /nfs/dbraw/zinc/99/80/62/1029998062.db2.gz VFCKEGIKTONELZ-YPMHNXCESA-N 1 0 334.338 3.911 20 5 EHBDRO C[C@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1C ZINC000525709364 1030048019 /nfs/dbraw/zinc/04/80/19/1030048019.db2.gz VNFCZCWSPMQWII-ZFWWWQNUSA-N 1 0 345.468 3.896 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000531955763 1030133588 /nfs/dbraw/zinc/13/35/88/1030133588.db2.gz GMZHJWRJDIUZQN-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CC1(C)C[C@H]([N@@H+]2CCC[C@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381838 1030162176 /nfs/dbraw/zinc/16/21/76/1030162176.db2.gz RIGNCQNQXOEKMD-HKUYNNGSSA-N 1 0 330.428 3.820 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccccc2Cl)n1 ZINC000447522965 1030243778 /nfs/dbraw/zinc/24/37/78/1030243778.db2.gz ROJVTWQVKILMPV-CABCVRRESA-N 1 0 334.807 3.718 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447509105 1030257078 /nfs/dbraw/zinc/25/70/78/1030257078.db2.gz LUISUPNLAKOLBL-KXBFYZLASA-N 1 0 331.460 3.826 20 5 EHBDRO Cc1ccc([C@H](C)C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447538423 1030273253 /nfs/dbraw/zinc/27/32/53/1030273253.db2.gz CAWQFZHYUPKJIB-NXHRZFHOSA-N 1 0 342.443 3.977 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000447546696 1030279727 /nfs/dbraw/zinc/27/97/27/1030279727.db2.gz YBEXPMUXMSEHIK-OKZBNKHCSA-N 1 0 330.428 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCc2ccc3c(c2)CCO3)c(Cl)c1 ZINC000482237185 1030280190 /nfs/dbraw/zinc/28/01/90/1030280190.db2.gz ANRAXYUZMFKKID-UHFFFAOYSA-N 1 0 346.814 3.906 20 5 EHBDRO CCc1ccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000447546231 1030281433 /nfs/dbraw/zinc/28/14/33/1030281433.db2.gz UGOLLQOSVMTLOR-HUUCEWRRSA-N 1 0 334.445 3.689 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCC1 ZINC000447576692 1030338969 /nfs/dbraw/zinc/33/89/69/1030338969.db2.gz ZMHFOQPPQCJCLC-RDTXWAMCSA-N 1 0 332.444 3.751 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000593064130 1030346822 /nfs/dbraw/zinc/34/68/22/1030346822.db2.gz KKXOSOVYSIVDNN-DOMZBBRYSA-N 1 0 345.374 3.802 20 5 EHBDRO COC(=O)c1coc([C@@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c1 ZINC000447583033 1030347004 /nfs/dbraw/zinc/34/70/04/1030347004.db2.gz AVMCUJBDAIQXKK-CYBMUJFWSA-N 1 0 346.383 3.648 20 5 EHBDRO COc1ccc(OC)c(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000532199050 1030472536 /nfs/dbraw/zinc/47/25/36/1030472536.db2.gz JSELAAFSZGQWQQ-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000482528262 1030507581 /nfs/dbraw/zinc/50/75/81/1030507581.db2.gz CGGABHNBCPDVMV-ZDUSSCGKSA-N 1 0 332.375 3.944 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCN(C)[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177393 1031078250 /nfs/dbraw/zinc/07/82/50/1031078250.db2.gz YKLAVQXVDLWFLU-QUCCMNQESA-N 1 0 339.439 3.828 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000537698513 1031138196 /nfs/dbraw/zinc/13/81/96/1031138196.db2.gz VUCLSPDYJCHPQR-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000052719920 1031273353 /nfs/dbraw/zinc/27/33/53/1031273353.db2.gz KLTQQULBIMNLSU-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468943 1031587435 /nfs/dbraw/zinc/58/74/35/1031587435.db2.gz BWONYPJNWXYMHT-BXKDBHETSA-N 1 0 342.367 3.600 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594489570 1033394721 /nfs/dbraw/zinc/39/47/21/1033394721.db2.gz DBLAHPLPVKHPGT-YVEFUNNKSA-N 1 0 342.395 3.950 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490672 1033395102 /nfs/dbraw/zinc/39/51/02/1033395102.db2.gz PFCFJCIYYQESEE-UGSOOPFHSA-N 1 0 349.394 3.514 20 5 EHBDRO Cc1nc2ccccn2c1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000898275265 1033421486 /nfs/dbraw/zinc/42/14/86/1033421486.db2.gz ZOMURONCWQCQLA-CQSZACIVSA-N 1 0 338.411 3.662 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)c2ccncc21 ZINC000594596692 1033443508 /nfs/dbraw/zinc/44/35/08/1033443508.db2.gz BEDQPNFWQPHNQO-FUHWJXTLSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCC[N@@H+]4CCCC[C@@H]34)c2c1 ZINC000594599888 1033445929 /nfs/dbraw/zinc/44/59/29/1033445929.db2.gz KAYVLJIRRCHUNT-IRXDYDNUSA-N 1 0 326.400 3.572 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761291529 1033540242 /nfs/dbraw/zinc/54/02/42/1033540242.db2.gz MZFMCFAZQHGMLU-OAHLLOKOSA-N 1 0 348.472 3.818 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583489 1033575166 /nfs/dbraw/zinc/57/51/66/1033575166.db2.gz KKHBVVLBNFZYOE-DOTOQJQBSA-N 1 0 325.412 3.775 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CCC[C@@H]3C[C@@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594974836 1033579678 /nfs/dbraw/zinc/57/96/78/1033579678.db2.gz KGZVYUIXHUGNDG-VKJFTORMSA-N 1 0 340.427 3.521 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000594977985 1033579760 /nfs/dbraw/zinc/57/97/60/1033579760.db2.gz PGAQYJMMUXDPCX-JKNJVXJCSA-N 1 0 329.444 3.605 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3COC(C)(C)C3)o2)c([N+](=O)[O-])c1 ZINC000594962799 1033603326 /nfs/dbraw/zinc/60/33/26/1033603326.db2.gz KGDNFEHEYRMVGY-LBPRGKRZSA-N 1 0 346.383 3.521 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](c2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000595009658 1033632241 /nfs/dbraw/zinc/63/22/41/1033632241.db2.gz ZDZLOLRTBIZGMZ-LIRRHRJNSA-N 1 0 328.412 3.930 20 5 EHBDRO O=[N+]([O-])c1cccc(CN2CCC[N@H+](CC3CCCCC3)CC2)c1 ZINC000059424662 1033660226 /nfs/dbraw/zinc/66/02/26/1033660226.db2.gz WZXOGBNWCFDPET-UHFFFAOYSA-N 1 0 331.460 3.683 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccccn1 ZINC000595041460 1033660893 /nfs/dbraw/zinc/66/08/93/1033660893.db2.gz LTPQVRZKZPQNHA-CYBMUJFWSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2noc3ccccc32)cccc1[N+](=O)[O-] ZINC000595050637 1033668057 /nfs/dbraw/zinc/66/80/57/1033668057.db2.gz SUEZOCDBGNQPFW-ZDUSSCGKSA-N 1 0 325.368 3.938 20 5 EHBDRO CCCOc1ccc2c(c1)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC001168301955 1033675232 /nfs/dbraw/zinc/67/52/32/1033675232.db2.gz GQPZSDSQXOFUDV-UHFFFAOYSA-N 1 0 340.423 3.984 20 5 EHBDRO COc1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1C ZINC000595101055 1033690471 /nfs/dbraw/zinc/69/04/71/1033690471.db2.gz AQTQSLARXYHULP-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO COCc1csc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000595075954 1033693911 /nfs/dbraw/zinc/69/39/11/1033693911.db2.gz CGSXPDWEEVFPKA-QGZVFWFLSA-N 1 0 332.425 3.970 20 5 EHBDRO COc1cccc(OC)c1C[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000595075794 1033694747 /nfs/dbraw/zinc/69/47/47/1033694747.db2.gz YVZPSVOVHIKPBZ-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000599059523 1033698711 /nfs/dbraw/zinc/69/87/11/1033698711.db2.gz HZWXTFRQVVYAKP-KDOFPFPSSA-N 1 0 326.396 3.695 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000599077309 1033720310 /nfs/dbraw/zinc/72/03/10/1033720310.db2.gz BRISSAWCAWHISA-QWHCGFSZSA-N 1 0 344.406 3.936 20 5 EHBDRO CCn1cc(C[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C(C)C)cn1 ZINC000593677282 1033734508 /nfs/dbraw/zinc/73/45/08/1033734508.db2.gz XCYJMFQFZBOVSN-CLFYSBASSA-N 1 0 328.416 3.735 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000595419294 1033792135 /nfs/dbraw/zinc/79/21/35/1033792135.db2.gz KDVWPSDHBQVCGR-KSSFIOAISA-N 1 0 344.386 3.991 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1Nc1cnn(-c2cc[nH+]cc2)c1 ZINC000608909376 1033941183 /nfs/dbraw/zinc/94/11/83/1033941183.db2.gz KVBBYKGLLIACDR-UHFFFAOYSA-N 1 0 349.272 3.938 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)c1ccc(F)cc1[N+](=O)[O-] ZINC000608974293 1033967069 /nfs/dbraw/zinc/96/70/69/1033967069.db2.gz PJJDRBLWWMTKBY-UHFFFAOYSA-N 1 0 331.391 3.822 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000595765104 1033970510 /nfs/dbraw/zinc/97/05/10/1033970510.db2.gz HAPBIONMMDYVRV-LBPRGKRZSA-N 1 0 344.358 3.526 20 5 EHBDRO CC[NH+](CC)CCOc1ccc(CNc2ccccc2[N+](=O)[O-])cc1 ZINC000603859212 1033982818 /nfs/dbraw/zinc/98/28/18/1033982818.db2.gz SYXNUSCDDOWPCC-UHFFFAOYSA-N 1 0 343.427 3.928 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](CCF)C1 ZINC000595754767 1033983417 /nfs/dbraw/zinc/98/34/17/1033983417.db2.gz BULVCDAIMWZLBJ-CHWSQXEVSA-N 1 0 348.378 3.777 20 5 EHBDRO CC(C)(C)[NH2+]CCNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000609029398 1033984708 /nfs/dbraw/zinc/98/47/08/1033984708.db2.gz QXKCEZPXMHQJAN-UHFFFAOYSA-N 1 0 341.411 3.626 20 5 EHBDRO CC(C)CC1([NH2+][C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000595832520 1034016459 /nfs/dbraw/zinc/01/64/59/1034016459.db2.gz WPDADNVJGGCPDT-GFCCVEGCSA-N 1 0 330.388 3.874 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCc2nc(C3CC3)ncc2C1 ZINC000599620190 1034040239 /nfs/dbraw/zinc/04/02/39/1034040239.db2.gz QSQVNBAMNWMHMT-ZDUSSCGKSA-N 1 0 338.411 3.690 20 5 EHBDRO C[C@H]1CC[N@H+](CCN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610448 1034071612 /nfs/dbraw/zinc/07/16/12/1034071612.db2.gz MAWXHWOMPSNDJR-OXJNMPFZSA-N 1 0 339.439 3.616 20 5 EHBDRO COc1cc(NC[C@H]2CCC[N@@H+](C(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596096600 1034081688 /nfs/dbraw/zinc/08/16/88/1034081688.db2.gz VGJMZCBBMKZPOT-GFCCVEGCSA-N 1 0 341.839 3.789 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1Cc1ccc(F)cc1 ZINC000604016834 1034141581 /nfs/dbraw/zinc/14/15/81/1034141581.db2.gz GKVBZQAMYNJEND-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1cc(NC[C@H]2CC[N@@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596308838 1034165236 /nfs/dbraw/zinc/16/52/36/1034165236.db2.gz WMXKRKQTIDMZNB-LLVKDONJSA-N 1 0 341.839 3.789 20 5 EHBDRO O=[N+]([O-])c1c(NCC2CC[NH+](CC3CC3)CC2)ccc2ncccc21 ZINC000596563139 1034289917 /nfs/dbraw/zinc/28/99/17/1034289917.db2.gz QNPYLBSAAIHYFN-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596570437 1034294588 /nfs/dbraw/zinc/29/45/88/1034294588.db2.gz KZESNYDUKJOFJP-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)c3ccc(F)cc3[N+](=O)[O-])ccc21 ZINC000456282643 1034302462 /nfs/dbraw/zinc/30/24/62/1034302462.db2.gz SGDZINADHLFNEO-INIZCTEOSA-N 1 0 343.358 3.535 20 5 EHBDRO Cc1ccc(CNCC(C)(C)[NH+]2C[C@H](C)C[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000604417944 1034371940 /nfs/dbraw/zinc/37/19/40/1034371940.db2.gz SUAASUWSEFVDLY-HUUCEWRRSA-N 1 0 333.476 3.749 20 5 EHBDRO CC(C)C[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000179702583 1034584898 /nfs/dbraw/zinc/58/48/98/1034584898.db2.gz FWIRBZZJDUYBQD-UHFFFAOYSA-N 1 0 330.432 3.862 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000597225013 1034625510 /nfs/dbraw/zinc/62/55/10/1034625510.db2.gz LOTZPSJAFNQSCE-WPGJWXSHSA-N 1 0 330.428 3.889 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)c3c(F)cccc3[N+](=O)[O-])ccc21 ZINC000601617199 1034642775 /nfs/dbraw/zinc/64/27/75/1034642775.db2.gz JFAHIBSPPIJNNH-OAHLLOKOSA-N 1 0 343.358 3.535 20 5 EHBDRO COc1ccc(C[NH2+]CC[C@H]2CCc3ccccc3N2)cc1[N+](=O)[O-] ZINC000593319714 1034657126 /nfs/dbraw/zinc/65/71/26/1034657126.db2.gz WXUIFOGQZKRFSB-MRXNPFEDSA-N 1 0 341.411 3.510 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC=C(C(C)(C)C)CC2)cccc1[N+](=O)[O-] ZINC000534660735 1034782202 /nfs/dbraw/zinc/78/22/02/1034782202.db2.gz HYRKOKQZTANYOA-UHFFFAOYSA-N 1 0 345.443 3.910 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000167458556 1034903055 /nfs/dbraw/zinc/90/30/55/1034903055.db2.gz YBJDYWWERUDXLV-TZMCWYRMSA-N 1 0 347.365 3.803 20 5 EHBDRO COc1ccccc1C1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)CCC1 ZINC000612692095 1035167526 /nfs/dbraw/zinc/16/75/26/1035167526.db2.gz ROADZBUEEZICEM-UHFFFAOYSA-N 1 0 344.386 3.954 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]C2CC(c3cc(F)cc(F)c3)C2)cc1 ZINC000580603063 1035447352 /nfs/dbraw/zinc/44/73/52/1035447352.db2.gz UEEBGJCUJIZFME-UHFFFAOYSA-N 1 0 348.349 3.788 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000581965939 1035659641 /nfs/dbraw/zinc/65/96/41/1035659641.db2.gz DUIJNBPMKTZCKB-UHFFFAOYSA-N 1 0 344.411 3.945 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000534837241 1035684356 /nfs/dbraw/zinc/68/43/56/1035684356.db2.gz KEYOGYYFQKTUPF-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000492374096 1035702890 /nfs/dbraw/zinc/70/28/90/1035702890.db2.gz GKLVQWFTZVMMJI-SUMWQHHRSA-N 1 0 349.862 3.697 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389346 1035719377 /nfs/dbraw/zinc/71/93/77/1035719377.db2.gz IQQQROXKKQNDTB-BLLLJJGKSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c(C)c1OC ZINC000492415826 1035749275 /nfs/dbraw/zinc/74/92/75/1035749275.db2.gz HSDKPGGTWJZYOJ-UHFFFAOYSA-N 1 0 344.411 3.945 20 5 EHBDRO C[N@H+](CCCCNC(=O)c1cc2ccccc2c2cccnc12)C1CC1 ZINC000457204914 1035842388 /nfs/dbraw/zinc/84/23/88/1035842388.db2.gz QEUWPVOKRQMGER-UHFFFAOYSA-N 1 0 347.462 3.992 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347457 1035925912 /nfs/dbraw/zinc/92/59/12/1035925912.db2.gz COJYULJOMAEZBW-LSDHHAIUSA-N 1 0 333.432 3.728 20 5 EHBDRO COc1cc(C[N@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1F ZINC000464102839 1036125820 /nfs/dbraw/zinc/12/58/20/1036125820.db2.gz BZSGYKIFVYYGOL-ZDUSSCGKSA-N 1 0 332.375 3.978 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[C@@H](CO)C2)o1 ZINC000588931484 1036188345 /nfs/dbraw/zinc/18/83/45/1036188345.db2.gz IJNKWNUXAHADHV-LSDHHAIUSA-N 1 0 344.411 3.743 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)OCC2CC2)cc1[N+](=O)[O-] ZINC000414249861 1036277526 /nfs/dbraw/zinc/27/75/26/1036277526.db2.gz ARZYLTYGXLCGNC-ZDUSSCGKSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1n[nH]c(C)c1[C@@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589207293 1036313762 /nfs/dbraw/zinc/31/37/62/1036313762.db2.gz JZAHVOFTHNCDGG-AFCDSYGPSA-N 1 0 326.400 3.785 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000589281442 1036340576 /nfs/dbraw/zinc/34/05/76/1036340576.db2.gz HFNRDCVUDKWDCV-KXBFYZLASA-N 1 0 337.423 3.793 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000026227444 1036400755 /nfs/dbraw/zinc/40/07/55/1036400755.db2.gz DZDUWKCDOAMESU-LBPRGKRZSA-N 1 0 347.802 3.928 20 5 EHBDRO CCC[N@@H+](Cc1cc(OC)c(F)cc1[N+](=O)[O-])C[C@H]1CCCCO1 ZINC000464676754 1036651198 /nfs/dbraw/zinc/65/11/98/1036651198.db2.gz JFXGEYJVTZAOPJ-CQSZACIVSA-N 1 0 340.395 3.524 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1CC(O)C1 ZINC000191162287 1036703456 /nfs/dbraw/zinc/70/34/56/1036703456.db2.gz YTHIFWLNQHNMDE-UHFFFAOYSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000414349214 1036849627 /nfs/dbraw/zinc/84/96/27/1036849627.db2.gz PARTVEGLXSIZMP-WMLDXEAASA-N 1 0 343.402 3.533 20 5 EHBDRO C[C@H](O)C(C)(C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000539521261 1036858640 /nfs/dbraw/zinc/85/86/40/1036858640.db2.gz XUERTMURKSCFIR-LBPRGKRZSA-N 1 0 348.374 3.775 20 5 EHBDRO C[C@]1(CO)CCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237743793 1036902257 /nfs/dbraw/zinc/90/22/57/1036902257.db2.gz QHJPJQVJCUMEGX-QZTJIDSGSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000443643641 1036915274 /nfs/dbraw/zinc/91/52/74/1036915274.db2.gz SEOLYIDDGLRGJV-KGLIPLIRSA-N 1 0 333.432 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[NH+](Cc3ccccc3)CC2)cc1Cl ZINC000761510509 1037082250 /nfs/dbraw/zinc/08/22/50/1037082250.db2.gz GMTXUGQCCBBWJC-UHFFFAOYSA-N 1 0 345.830 3.566 20 5 EHBDRO COc1ccc(C)cc1CC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761522476 1037090265 /nfs/dbraw/zinc/09/02/65/1037090265.db2.gz QVUSGIYAFRKYNK-UHFFFAOYSA-N 1 0 334.803 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2COc3ccccc3C2)cc1Cl ZINC000761515421 1037092484 /nfs/dbraw/zinc/09/24/84/1037092484.db2.gz KWDMNULKXPFMQK-ZDUSSCGKSA-N 1 0 332.787 3.589 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Oc1ccc(F)cc1 ZINC000761524428 1037093450 /nfs/dbraw/zinc/09/34/50/1037093450.db2.gz CQYRVLCULQGUTR-LLVKDONJSA-N 1 0 338.766 3.944 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493240364 1037104396 /nfs/dbraw/zinc/10/43/96/1037104396.db2.gz VRIYWYIVEOOETC-ZDUSSCGKSA-N 1 0 325.840 3.554 20 5 EHBDRO CC[C@H](CCO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738893 1037133937 /nfs/dbraw/zinc/13/39/37/1037133937.db2.gz MHZBLGFFSLEZNF-BEFAXECRSA-N 1 0 328.412 3.682 20 5 EHBDRO COc1ccc(-c2ccc(C[NH+]3CC4(CC(F)C4)C3)o2)c([N+](=O)[O-])c1 ZINC000590969280 1037147827 /nfs/dbraw/zinc/14/78/27/1037147827.db2.gz HVPQAPTVIOLYJB-UHFFFAOYSA-N 1 0 346.358 3.797 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000493282112 1037218787 /nfs/dbraw/zinc/21/87/87/1037218787.db2.gz SDXYCQBBINWWBQ-STQMWFEESA-N 1 0 325.840 3.553 20 5 EHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829597 1037254986 /nfs/dbraw/zinc/25/49/86/1037254986.db2.gz REKKBSJDDNWHES-CJNGLKHVSA-N 1 0 328.416 3.616 20 5 EHBDRO COc1cc(C[NH2+]C[C@@H](C)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000493605484 1037508850 /nfs/dbraw/zinc/50/88/50/1037508850.db2.gz ZBJBCJUVBOMLQZ-LLVKDONJSA-N 1 0 346.374 3.629 20 5 EHBDRO COCCc1nc(C)c([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])s1 ZINC000271859627 1037524496 /nfs/dbraw/zinc/52/44/96/1037524496.db2.gz ZFADGJPYQDCYKB-RYUDHWBXSA-N 1 0 349.456 3.960 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000462905014 1037532130 /nfs/dbraw/zinc/53/21/30/1037532130.db2.gz IOTAMRIXQGBSJP-SFHVURJKSA-N 1 0 330.384 3.760 20 5 EHBDRO CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])c(OC)c1)[NH+]1CCCC1 ZINC000462920840 1037559818 /nfs/dbraw/zinc/55/98/18/1037559818.db2.gz WTZBMEHDPFYINT-QGZVFWFLSA-N 1 0 335.448 3.916 20 5 EHBDRO CC[N@H+](CCNc1ccc([N+](=O)[O-])cc1Cl)CCC(F)(F)F ZINC000491583590 1037560176 /nfs/dbraw/zinc/56/01/76/1037560176.db2.gz LEOLPAMWIGCJSD-UHFFFAOYSA-N 1 0 339.745 3.934 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000532553301 1037609055 /nfs/dbraw/zinc/60/90/55/1037609055.db2.gz YRQVJPCGSZUNOF-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCN(C)[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000540154107 1037625761 /nfs/dbraw/zinc/62/57/61/1037625761.db2.gz VYHSENHDAXVHBO-ZAAXVRCTSA-N 1 0 339.439 3.999 20 5 EHBDRO Cc1cc(N(C)C[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000463068807 1037733904 /nfs/dbraw/zinc/73/39/04/1037733904.db2.gz MRZCKULQHKTOKL-SFHVURJKSA-N 1 0 339.439 3.862 20 5 EHBDRO C[C@H](CO)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCCC1 ZINC000549945975 1037766777 /nfs/dbraw/zinc/76/67/77/1037766777.db2.gz PASRZLPNQNQXOW-LLVKDONJSA-N 1 0 346.349 3.739 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341220237 1037783664 /nfs/dbraw/zinc/78/36/64/1037783664.db2.gz PMBXVCVRYONYBR-QGZVFWFLSA-N 1 0 327.384 3.664 20 5 EHBDRO Cc1nn(C(C)C)c(C)c1C[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897458716 1037799259 /nfs/dbraw/zinc/79/92/59/1037799259.db2.gz CVLFOLZLHLDMON-CYBMUJFWSA-N 1 0 330.432 3.882 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c(F)c1OC ZINC000897459307 1037832461 /nfs/dbraw/zinc/83/24/61/1037832461.db2.gz JYFUUELWDGQZBY-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO CC(C)C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000540341425 1037846404 /nfs/dbraw/zinc/84/64/04/1037846404.db2.gz KLJOLBAEGRXLNR-KRWDZBQOSA-N 1 0 341.411 3.910 20 5 EHBDRO CC(C)(C)O[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000592375753 1037923398 /nfs/dbraw/zinc/92/33/98/1037923398.db2.gz YTUZTSUNHZCVAT-BJHJDKERSA-N 1 0 344.358 3.632 20 5 EHBDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000463385174 1038088371 /nfs/dbraw/zinc/08/83/71/1038088371.db2.gz AAPIMBPREPRLMO-OOHWJJMZSA-N 1 0 326.396 3.993 20 5 EHBDRO COc1cccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c1OC ZINC000897470019 1038218933 /nfs/dbraw/zinc/21/89/33/1038218933.db2.gz WHXDPMFGGGLZSR-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000549407634 1038343194 /nfs/dbraw/zinc/34/31/94/1038343194.db2.gz HJHGWIAFJTXBKS-UHFFFAOYSA-N 1 0 344.411 3.595 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104661361 1038439936 /nfs/dbraw/zinc/43/99/36/1038439936.db2.gz SMXRCLODSAKXLU-OKILXGFUSA-N 1 0 329.400 3.770 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cc(F)c(F)c(F)c1 ZINC000538638341 1038441574 /nfs/dbraw/zinc/44/15/74/1038441574.db2.gz YFSFIGWZBCHFRV-UHFFFAOYSA-N 1 0 340.301 3.523 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717337 1038487995 /nfs/dbraw/zinc/48/79/95/1038487995.db2.gz UXNFTKTYNVEJRB-MAUKXSAKSA-N 1 0 333.476 3.880 20 5 EHBDRO Cc1ccc(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000538731435 1038498106 /nfs/dbraw/zinc/49/81/06/1038498106.db2.gz KKOWYLPPPZNHNW-LJQANCHMSA-N 1 0 340.423 3.775 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@@H]1C ZINC000538937425 1038603538 /nfs/dbraw/zinc/60/35/38/1038603538.db2.gz RXEDLIPLELGNDY-WCQYABFASA-N 1 0 343.374 3.505 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000539069132 1038669692 /nfs/dbraw/zinc/66/96/92/1038669692.db2.gz PGVQASGVKDHAEL-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCc1ccc(F)cc1)C1CC1 ZINC000479858623 1038794473 /nfs/dbraw/zinc/79/44/73/1038794473.db2.gz KIXVZEULLMEQCI-SFHVURJKSA-N 1 0 328.387 3.887 20 5 EHBDRO CC(C)(O)CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000479869826 1038812090 /nfs/dbraw/zinc/81/20/90/1038812090.db2.gz ACMWYLJMNOWULA-UHFFFAOYSA-N 1 0 348.374 3.777 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@H](CNCc1ccccc1[N+](=O)[O-])C1CC1 ZINC000479876362 1038823850 /nfs/dbraw/zinc/82/38/50/1038823850.db2.gz NLKHUBZNBCDYHC-HXUWFJFHSA-N 1 0 339.439 3.595 20 5 EHBDRO CC(C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236693529 1038994280 /nfs/dbraw/zinc/99/42/80/1038994280.db2.gz AMELGBJBKUJLFQ-QGZVFWFLSA-N 1 0 334.441 3.820 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480090348 1039140181 /nfs/dbraw/zinc/14/01/81/1039140181.db2.gz WGSCCDPFVCXOKK-SJLPKXTDSA-N 1 0 339.439 3.828 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]Cc1nnc2n1CCC2 ZINC000030652460 1039216451 /nfs/dbraw/zinc/21/64/51/1039216451.db2.gz KCSCLEHSQNPXGA-UHFFFAOYSA-N 1 0 328.419 3.821 20 5 EHBDRO CC(C)CC[C@@H]1CCCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC001167905007 1039380091 /nfs/dbraw/zinc/38/00/91/1039380091.db2.gz PUNSRPWNFBMKGH-KRWDZBQOSA-N 1 0 347.459 3.848 20 5 EHBDRO CC[NH+](CC)CCCCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000500791665 1039513776 /nfs/dbraw/zinc/51/37/76/1039513776.db2.gz BWYQAZSGAOENKZ-UHFFFAOYSA-N 1 0 349.475 3.744 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000552924226 1039622609 /nfs/dbraw/zinc/62/26/09/1039622609.db2.gz BEBYVFOQAHJUFA-UCLAIMLFSA-N 1 0 325.412 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cc(F)ccc3F)c2c1 ZINC000554723158 1039649085 /nfs/dbraw/zinc/64/90/85/1039649085.db2.gz SEBRTCDKOYMLLV-UHFFFAOYSA-N 1 0 331.322 3.687 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340921 1039705636 /nfs/dbraw/zinc/70/56/36/1039705636.db2.gz AXNCEQHAGFIKLE-CXAGYDPISA-N 1 0 342.395 3.916 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCO[C@@H](C3CC3)C1)CCCC2 ZINC000417346585 1039708046 /nfs/dbraw/zinc/70/80/46/1039708046.db2.gz ULPSZSCQRDUJIA-ATZDWAIDSA-N 1 0 330.428 3.910 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCCO)ccc1Oc1ccccc1Cl ZINC000072713114 1039934185 /nfs/dbraw/zinc/93/41/85/1039934185.db2.gz VASRATSAEAZLBV-UHFFFAOYSA-N 1 0 336.775 3.513 20 5 EHBDRO CC[C@H]1CCC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000042145535 1040022988 /nfs/dbraw/zinc/02/29/88/1040022988.db2.gz OEFKWKVBBIYNSF-STQMWFEESA-N 1 0 330.388 3.828 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](c2ccc(F)cc2)N(C)C)cc1[N+](=O)[O-] ZINC000480896511 1040143991 /nfs/dbraw/zinc/14/39/91/1040143991.db2.gz CZQPPFWYOCYOMZ-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO C[N@H+](CCSc1ncc(Cl)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000432927606 1040199139 /nfs/dbraw/zinc/19/91/39/1040199139.db2.gz NDKFGFTWEHBFGV-UHFFFAOYSA-N 1 0 337.832 3.867 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782287 1040442107 /nfs/dbraw/zinc/44/21/07/1040442107.db2.gz UJBUFUDKSBNXCH-INIZCTEOSA-N 1 0 333.432 3.602 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H]1CCC(C)C ZINC000486783619 1040442350 /nfs/dbraw/zinc/44/23/50/1040442350.db2.gz ZKLFLDZONMPAIZ-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804449 1040471972 /nfs/dbraw/zinc/47/19/72/1040471972.db2.gz YQTBZWDQIKKDOP-GUYCJALGSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1c(C)cc(C[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1C ZINC000110296426 1040493727 /nfs/dbraw/zinc/49/37/27/1040493727.db2.gz RLFPGIMMFJMSCC-UHFFFAOYSA-N 1 0 344.411 3.731 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@@H]1O ZINC000555420384 1040557589 /nfs/dbraw/zinc/55/75/89/1040557589.db2.gz GXVWRWVKWOIUED-ABAIWWIYSA-N 1 0 346.349 3.597 20 5 EHBDRO C[C@H]1CC[C@@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051140 1040564623 /nfs/dbraw/zinc/56/46/23/1040564623.db2.gz GLUQZTUZOLYFQO-SUMWQHHRSA-N 1 0 328.416 3.616 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000481278580 1040599987 /nfs/dbraw/zinc/59/99/87/1040599987.db2.gz YCBSKKJSHVTHFP-HNNXBMFYSA-N 1 0 325.412 3.617 20 5 EHBDRO C[C@@H]([NH2+]CC1(CO)CC(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000433066076 1040619286 /nfs/dbraw/zinc/61/92/86/1040619286.db2.gz HWZVKYALSAFIOI-MYWSLZCHSA-N 1 0 340.423 3.802 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC001167752307 1040833533 /nfs/dbraw/zinc/83/35/33/1040833533.db2.gz DQMZOXBNXRTPPX-LLVKDONJSA-N 1 0 346.353 3.685 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)c(Cl)c1 ZINC000600213457 1040833607 /nfs/dbraw/zinc/83/36/07/1040833607.db2.gz GESTWNZQBMORMP-ZDUSSCGKSA-N 1 0 332.787 3.943 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022890 1040869333 /nfs/dbraw/zinc/86/93/33/1040869333.db2.gz QDAMCVZUECETNM-YLJYHZDGSA-N 1 0 337.423 3.511 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc3c(c2)OCO3)c2cc([N+](=O)[O-])ccc21 ZINC000433145630 1040902958 /nfs/dbraw/zinc/90/29/58/1040902958.db2.gz IEUKOOYDYSPYQH-MRXNPFEDSA-N 1 0 340.379 3.836 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2Cl)C1 ZINC001169005419 1132629731 /nfs/dbraw/zinc/62/97/31/1132629731.db2.gz UDTMXBXWMDNCKG-BXKDBHETSA-N 1 0 347.640 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]Cc3cnn4ccccc34)o2)cc1 ZINC000512861371 1041124274 /nfs/dbraw/zinc/12/42/74/1041124274.db2.gz ODZNYTPKWKHWIW-UHFFFAOYSA-N 1 0 348.362 3.792 20 5 EHBDRO COC1(C(F)(F)F)CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000419336905 1041413228 /nfs/dbraw/zinc/41/32/28/1041413228.db2.gz VPQVOYLLEOORPT-LLVKDONJSA-N 1 0 332.322 3.699 20 5 EHBDRO Cc1ccc(C[N@H+](C)C[C@@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000511674079 1041452702 /nfs/dbraw/zinc/45/27/02/1041452702.db2.gz XJBJWVNYFIHJSW-IBGZPJMESA-N 1 0 326.396 3.649 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000093116537 1041889638 /nfs/dbraw/zinc/88/96/38/1041889638.db2.gz RCUCRXADAABZMU-INIZCTEOSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]Cc1cc(Br)cs1 ZINC000048068849 1042275495 /nfs/dbraw/zinc/27/54/95/1042275495.db2.gz KGWRKLIEDLTJHS-UHFFFAOYSA-N 1 0 327.203 3.709 20 5 EHBDRO Cc1cnc([C@@H](C)C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000893576983 1042734670 /nfs/dbraw/zinc/73/46/70/1042734670.db2.gz WEZCDXIERJYZOL-VIFPVBQESA-N 1 0 325.821 3.906 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCC[N@@H+](C4CCCC4)CC3)ccnc21 ZINC000432315434 1042806140 /nfs/dbraw/zinc/80/61/40/1042806140.db2.gz UVMDFCRBNHHDIN-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)c1 ZINC000122126663 1042863004 /nfs/dbraw/zinc/86/30/04/1042863004.db2.gz PXORFWZJNQVXQJ-LIRRHRJNSA-N 1 0 343.427 3.557 20 5 EHBDRO C[NH+](C)CCOc1ccccc1CNc1c(Cl)cccc1[N+](=O)[O-] ZINC000432338583 1042973702 /nfs/dbraw/zinc/97/37/02/1042973702.db2.gz FQKYTBUMUWPUBK-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO CC(C)[NH+](CCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(C)C ZINC000032244464 1042997344 /nfs/dbraw/zinc/99/73/44/1042997344.db2.gz KLONYBGUXFNWBD-UHFFFAOYSA-N 1 0 349.456 3.658 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029792 1043220618 /nfs/dbraw/zinc/22/06/18/1043220618.db2.gz IHPPRCYEJUXYNH-CVEARBPZSA-N 1 0 330.384 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@H]4CCCC[C@@H]43)o2)cc1 ZINC000072971114 1043373275 /nfs/dbraw/zinc/37/32/75/1043373275.db2.gz VNLBGXLWBNUKIC-CJNGLKHVSA-N 1 0 342.399 3.799 20 5 EHBDRO C[C@H](O)c1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178544028 1043634622 /nfs/dbraw/zinc/63/46/22/1043634622.db2.gz DNNMZXOSQKHVHP-IFXJQAMLSA-N 1 0 340.423 3.759 20 5 EHBDRO CCn1nccc1C1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000279463270 1044108085 /nfs/dbraw/zinc/10/80/85/1044108085.db2.gz RGBUSWNZFQLUCE-FNORWQNLSA-N 1 0 340.427 3.704 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083214634 1127234347 /nfs/dbraw/zinc/23/43/47/1127234347.db2.gz SDHQLKUHSZJTOA-AAEUAGOBSA-N 1 0 335.429 3.842 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H]1C ZINC000764434255 1127493781 /nfs/dbraw/zinc/49/37/81/1127493781.db2.gz VSZQTDUYNXQJDG-SPYBWZPUSA-N 1 0 331.460 3.978 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765039958 1127568697 /nfs/dbraw/zinc/56/86/97/1127568697.db2.gz USRGYCZPIAHOLJ-ZFWWWQNUSA-N 1 0 348.472 3.816 20 5 EHBDRO CC(C)(C)c1cnc(N2C[C@@H](CC[NH3+])c3ccccc32)c([N+](=O)[O-])c1 ZINC001168545482 1127680979 /nfs/dbraw/zinc/68/09/79/1127680979.db2.gz PESUPJQDSQQHIR-CYBMUJFWSA-N 1 0 340.427 3.871 20 5 EHBDRO COc1ccccc1C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000130738860 1127737909 /nfs/dbraw/zinc/73/79/09/1127737909.db2.gz JTTNDVMITJNPNH-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO COc1cc(NC[C@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000301337537 1127738446 /nfs/dbraw/zinc/73/84/46/1127738446.db2.gz DPCYWWAQNWBDBB-MRXNPFEDSA-N 1 0 345.399 3.836 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000301371202 1127739223 /nfs/dbraw/zinc/73/92/23/1127739223.db2.gz VHACGHCBSUSVLW-KRWDZBQOSA-N 1 0 329.375 3.983 20 5 EHBDRO C[C@@H]1C[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000301398763 1127741189 /nfs/dbraw/zinc/74/11/89/1127741189.db2.gz ARWFIRQVVHLYJM-ZYHUDNBSSA-N 1 0 331.338 3.533 20 5 EHBDRO Cc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+]2CCCC2)cc1 ZINC000301427795 1127766418 /nfs/dbraw/zinc/76/64/18/1127766418.db2.gz IJUKQZNCJQPQMM-SFHVURJKSA-N 1 0 340.427 3.856 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000172373185 1127919930 /nfs/dbraw/zinc/91/99/30/1127919930.db2.gz VQAJRBAEDBVEKI-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc2cc(C[NH2+]CCOc3ccc([N+](=O)[O-])cc3)[nH]c2c1 ZINC001649112712 1128305387 /nfs/dbraw/zinc/30/53/87/1128305387.db2.gz UNHDOWUIHAIJNS-UHFFFAOYSA-N 1 0 325.368 3.553 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428833 1128486435 /nfs/dbraw/zinc/48/64/35/1128486435.db2.gz OSHFTHORABYXHH-GOEBONIOSA-N 1 0 326.400 3.546 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@@H+]1Cc1ccccc1 ZINC000301636021 1128774899 /nfs/dbraw/zinc/77/48/99/1128774899.db2.gz WRDYUQICNGYRKI-OCCSQVGLSA-N 1 0 346.818 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+]([C@@H]3CCc4ccc(Cl)cc43)CC2)n1 ZINC000488968492 1128888674 /nfs/dbraw/zinc/88/86/74/1128888674.db2.gz ASFJMTBZWSILFG-MRXNPFEDSA-N 1 0 346.818 3.769 20 5 EHBDRO CC(C)(C)OC1CC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000495367505 1121139319 /nfs/dbraw/zinc/13/93/19/1121139319.db2.gz CCEHPHFPSGHTKU-UHFFFAOYSA-N 1 0 326.824 3.726 20 5 EHBDRO CC(C)Sc1ccc([C@@H](C)[NH2+]CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000090538180 1121147399 /nfs/dbraw/zinc/14/73/99/1121147399.db2.gz ZEMLMVFEEUJXDU-CYBMUJFWSA-N 1 0 334.445 3.643 20 5 EHBDRO Cc1ccc(NC(=O)/C=C\c2ccc([N+](=O)[O-])cc2)c(C[NH+](C)C)c1 ZINC000254951540 1128968236 /nfs/dbraw/zinc/96/82/36/1128968236.db2.gz AZLMYLIZWKASSB-XFFZJAGNSA-N 1 0 339.395 3.617 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000089512024 1121276885 /nfs/dbraw/zinc/27/68/85/1121276885.db2.gz SSCIQTFRVOZTNL-GFCCVEGCSA-N 1 0 339.395 3.675 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000193454834 1121318403 /nfs/dbraw/zinc/31/84/03/1121318403.db2.gz VIVDZQFUMHBLJW-SJKOYZFVSA-N 1 0 346.456 3.734 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@@H]2COCC[C@H]2C1 ZINC000921976312 1128988741 /nfs/dbraw/zinc/98/87/41/1128988741.db2.gz NBAVAFAASXDRKM-SQWLQELKSA-N 1 0 338.835 3.586 20 5 EHBDRO C[C@H]([NH2+]CCc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000090660093 1121675613 /nfs/dbraw/zinc/67/56/13/1121675613.db2.gz JPZXDQSEYRRNFL-ZDUSSCGKSA-N 1 0 338.367 3.538 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@@H]21 ZINC000301735103 1129011679 /nfs/dbraw/zinc/01/16/79/1129011679.db2.gz ZPKKDYFANIYQHD-AAEUAGOBSA-N 1 0 343.349 3.534 20 5 EHBDRO CC(=O)c1c(NC[C@@H](c2cccc(F)c2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207097 1121876585 /nfs/dbraw/zinc/87/65/85/1121876585.db2.gz QOOVDTRCUQBLTP-KRWDZBQOSA-N 1 0 345.374 3.651 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1CCCn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000544529522 1122240460 /nfs/dbraw/zinc/24/04/60/1122240460.db2.gz HRYAAJRPBHEBKU-AWEZNQCLSA-N 1 0 347.415 3.547 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C3CCCC3)C2)c2ccncc21 ZINC000301172533 1122248988 /nfs/dbraw/zinc/24/89/88/1122248988.db2.gz FBVFNPCQFCRFIX-CYBMUJFWSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)c(F)c1 ZINC000301184172 1122311185 /nfs/dbraw/zinc/31/11/85/1122311185.db2.gz IWJTWWCDUWYRKK-MRXNPFEDSA-N 1 0 343.402 3.710 20 5 EHBDRO CC[NH+](CC)CCSc1ccc([N+](=O)[O-])cc1Br ZINC000497139547 1122349454 /nfs/dbraw/zinc/34/94/54/1122349454.db2.gz ASPOUKARSWOKJG-UHFFFAOYSA-N 1 0 333.251 3.791 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCCO2 ZINC000194619301 1122789186 /nfs/dbraw/zinc/78/91/86/1122789186.db2.gz IPLYHAZQLBFETM-CYBMUJFWSA-N 1 0 328.368 3.607 20 5 EHBDRO COc1ncc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1Cl ZINC000556574802 1123042018 /nfs/dbraw/zinc/04/20/18/1123042018.db2.gz SMTFYEONGIUGHV-LLVKDONJSA-N 1 0 335.791 3.811 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000609894749 1123689442 /nfs/dbraw/zinc/68/94/42/1123689442.db2.gz OKDXAZKYTFNMMB-UHFFFAOYSA-N 1 0 340.855 3.592 20 5 EHBDRO O=[N+]([O-])c1c(NCC[N@@H+]2CCc3ccccc3C2)ccc2ncccc21 ZINC000195664938 1123712076 /nfs/dbraw/zinc/71/20/76/1123712076.db2.gz JYSQOBLYYZXWHN-UHFFFAOYSA-N 1 0 348.406 3.613 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCN1Cc2ccccc2C1 ZINC000615720475 1123863517 /nfs/dbraw/zinc/86/35/17/1123863517.db2.gz CKYVMWDYNYUAOC-WJDWOHSUSA-N 1 0 337.423 3.604 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](c2ccnn2C)C(C)C)cc1[N+](=O)[O-] ZINC000615943441 1123912596 /nfs/dbraw/zinc/91/25/96/1123912596.db2.gz KHXBOBWHNMCTBS-QGZVFWFLSA-N 1 0 344.459 3.981 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000255641277 1129168620 /nfs/dbraw/zinc/16/86/20/1129168620.db2.gz WKYNLOMPHWPJDJ-OPXCAZNSSA-N 1 0 341.455 3.557 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000617491705 1124614713 /nfs/dbraw/zinc/61/47/13/1124614713.db2.gz LQOZOIJHJGAYOZ-INIZCTEOSA-N 1 0 340.427 3.577 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)O[C@@H](C)C2 ZINC000069752209 1125036918 /nfs/dbraw/zinc/03/69/18/1125036918.db2.gz XZLKKCYSQYRWDF-STQMWFEESA-N 1 0 342.395 3.778 20 5 EHBDRO CC(C)Sc1ccc([C@H](C)[NH2+]CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000182095947 1125154609 /nfs/dbraw/zinc/15/46/09/1125154609.db2.gz VHVLKUPNGQWAAV-ZDUSSCGKSA-N 1 0 334.445 3.643 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CCOCC1 ZINC000618798276 1125205165 /nfs/dbraw/zinc/20/51/65/1125205165.db2.gz LTRWAOJRPOHBMC-HNNXBMFYSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000182906866 1125391597 /nfs/dbraw/zinc/39/15/97/1125391597.db2.gz CGYQUBWQYYUVGF-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO COc1cc(NC[C@H](c2ccco2)[NH+]2CCCC2)c(F)cc1[N+](=O)[O-] ZINC000301870807 1129251559 /nfs/dbraw/zinc/25/15/59/1129251559.db2.gz PILKGGZUGNXPIW-OAHLLOKOSA-N 1 0 349.362 3.585 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000301893604 1129289154 /nfs/dbraw/zinc/28/91/54/1129289154.db2.gz WMOFRFGCBUKGBN-UHFFFAOYSA-N 1 0 340.427 3.942 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096510 1129399740 /nfs/dbraw/zinc/39/97/40/1129399740.db2.gz XUPBLFHDHOYJRW-CRAIPNDOSA-N 1 0 349.475 3.544 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](CCC(C)C)C1CC1 ZINC000533243947 1129467123 /nfs/dbraw/zinc/46/71/23/1129467123.db2.gz NRCPIAGVIHMDFX-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[C@@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418038 1129474883 /nfs/dbraw/zinc/47/48/83/1129474883.db2.gz MFRPFGRKJBZBSX-HZPDHXFCSA-N 1 0 349.475 3.909 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000466474250 1129477787 /nfs/dbraw/zinc/47/77/87/1129477787.db2.gz NYDMXKXUPSXYKC-MLGOLLRUSA-N 1 0 326.824 3.789 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884140 1129547615 /nfs/dbraw/zinc/54/76/15/1129547615.db2.gz RAWDOSCMDNCLJR-WFASDCNBSA-N 1 0 326.824 3.764 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(Cc3csc([N+](=O)[O-])c3)C2)CC1 ZINC000154708817 1129582026 /nfs/dbraw/zinc/58/20/26/1129582026.db2.gz PHTRIJRTFXQBAV-HNNXBMFYSA-N 1 0 337.489 3.600 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000555228867 1129587246 /nfs/dbraw/zinc/58/72/46/1129587246.db2.gz LMSUWWPGZFGISG-BVGQSLNGSA-N 1 0 326.396 3.885 20 5 EHBDRO COc1cccc(N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)c1[N+](=O)[O-] ZINC000389794510 1129589730 /nfs/dbraw/zinc/58/97/30/1129589730.db2.gz SGRBJJCNIXSKJF-YOEHRIQHSA-N 1 0 341.411 3.536 20 5 EHBDRO C[C@@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482612 1129590735 /nfs/dbraw/zinc/59/07/35/1129590735.db2.gz IJKAJLKDYVRGLE-ZIAGYGMSSA-N 1 0 330.384 3.590 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CN(Cc3ccccc3)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000389826714 1129591032 /nfs/dbraw/zinc/59/10/32/1129591032.db2.gz RTMDDHFJTJUPFC-HNAYVOBHSA-N 1 0 339.439 3.513 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000390058590 1129602444 /nfs/dbraw/zinc/60/24/44/1129602444.db2.gz QMTBAKIIPGISCC-UHFFFAOYSA-N 1 0 344.411 3.559 20 5 EHBDRO CO[C@H]1CCN(Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)C1 ZINC000282384171 1129674660 /nfs/dbraw/zinc/67/46/60/1129674660.db2.gz QWCRPNPRXCMMBZ-LRDDRELGSA-N 1 0 347.440 3.718 20 5 EHBDRO C[C@]1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCCO1 ZINC000922816732 1129679751 /nfs/dbraw/zinc/67/97/51/1129679751.db2.gz KJXRZKVKTXFDOK-QGZVFWFLSA-N 1 0 347.440 3.767 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000156181605 1129702982 /nfs/dbraw/zinc/70/29/82/1129702982.db2.gz XNBROPWKTNXWJY-HNAYVOBHSA-N 1 0 327.428 3.857 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000126050890 1129733073 /nfs/dbraw/zinc/73/30/73/1129733073.db2.gz HSDPIBDXZAEAOS-INIZCTEOSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@@H]([NH+](C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302003708 1129763030 /nfs/dbraw/zinc/76/30/30/1129763030.db2.gz JZABMMGOMHNWNS-ZIAGYGMSSA-N 1 0 328.416 3.736 20 5 EHBDRO C[C@H](CCNc1ccc2ncccc2c1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000302087161 1129766896 /nfs/dbraw/zinc/76/68/96/1129766896.db2.gz ADABDOKKFRIIMF-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@@H](CCNc1ccc2ncccc2c1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000302087158 1129766957 /nfs/dbraw/zinc/76/69/57/1129766957.db2.gz ADABDOKKFRIIMF-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO Cc1cc(N(C)CCc2nccs2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302103588 1129768272 /nfs/dbraw/zinc/76/82/72/1129768272.db2.gz WCKRKVATSXJPJG-UHFFFAOYSA-N 1 0 328.397 3.587 20 5 EHBDRO Cc1cc(NCC[N@H+]2CC=C(C)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302138890 1129769393 /nfs/dbraw/zinc/76/93/93/1129769393.db2.gz FWFNYIKIOWJCNL-UHFFFAOYSA-N 1 0 326.400 3.515 20 5 EHBDRO Cc1cc(NC[C@@H](C)CC2(C)OCCO2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302211973 1129773568 /nfs/dbraw/zinc/77/35/68/1129773568.db2.gz YWXVHLAKKUOTPN-LBPRGKRZSA-N 1 0 345.399 3.653 20 5 EHBDRO O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000161817533 1129774719 /nfs/dbraw/zinc/77/47/19/1129774719.db2.gz VZEKHHDTCKEKAY-UHFFFAOYSA-N 1 0 342.742 3.891 20 5 EHBDRO CO[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000131410245 1129793557 /nfs/dbraw/zinc/79/35/57/1129793557.db2.gz DBLQHSMRPDNLFB-UYAOXDASSA-N 1 0 340.423 3.893 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196836 1129805799 /nfs/dbraw/zinc/80/57/99/1129805799.db2.gz VJEGJRHJRRZYOX-HUUCEWRRSA-N 1 0 341.411 3.687 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000056196535 1129805851 /nfs/dbraw/zinc/80/58/51/1129805851.db2.gz SFRHNZAVTFYKIL-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000162242683 1129819043 /nfs/dbraw/zinc/81/90/43/1129819043.db2.gz XMAYITZNQMEZJP-AWEZNQCLSA-N 1 0 338.411 3.912 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](CO)C2)s1 ZINC000305230076 1129914915 /nfs/dbraw/zinc/91/49/15/1129914915.db2.gz XRIBHHQLWYAZLU-ZDUSSCGKSA-N 1 0 332.425 3.528 20 5 EHBDRO CC[C@@H]([NH2+]CCN1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000132884158 1129921807 /nfs/dbraw/zinc/92/18/07/1129921807.db2.gz ITHWGKBAZYUNRN-QGZVFWFLSA-N 1 0 345.468 3.755 20 5 EHBDRO Cn1cc2c(n1)CCC[C@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000282480952 1129927962 /nfs/dbraw/zinc/92/79/62/1129927962.db2.gz QEQNPZGYILVDSL-SJLPKXTDSA-N 1 0 340.427 3.718 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000766046225 1129940201 /nfs/dbraw/zinc/94/02/01/1129940201.db2.gz WQGBMMOFDUYDOM-MLGOLLRUSA-N 1 0 326.400 3.730 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCCC23CCOCC3)cc1[N+](=O)[O-] ZINC000282494880 1129947030 /nfs/dbraw/zinc/94/70/30/1129947030.db2.gz HWOHIMOPSQPMGF-KDOFPFPSSA-N 1 0 348.443 3.993 20 5 EHBDRO C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422068 1130202265 /nfs/dbraw/zinc/20/22/65/1130202265.db2.gz ILYCMPHIXDWONU-IFXJQAMLSA-N 1 0 339.395 3.616 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCCCN2CC)cc1[N+](=O)[O-] ZINC000245503906 1130224015 /nfs/dbraw/zinc/22/40/15/1130224015.db2.gz JAKUJWWHJAJSBM-GDBMZVCRSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515208 1130228179 /nfs/dbraw/zinc/22/81/79/1130228179.db2.gz DFVPQKYQLNKJSS-IAGOWNOFSA-N 1 0 331.460 3.915 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2OCC[C@H]21 ZINC000245551284 1130236045 /nfs/dbraw/zinc/23/60/45/1130236045.db2.gz OZUKGUZJUILZFB-FABMQREXSA-N 1 0 344.455 3.853 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000245553735 1130237933 /nfs/dbraw/zinc/23/79/33/1130237933.db2.gz QSXLGQPTBGGAEI-DHSIGJKJSA-N 1 0 342.443 3.699 20 5 EHBDRO CC(C)O[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C1(C)C ZINC000766090461 1130255853 /nfs/dbraw/zinc/25/58/53/1130255853.db2.gz SZKPBENVBGJPGO-LSDHHAIUSA-N 1 0 326.824 3.930 20 5 EHBDRO CCCO[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OCC)CC1 ZINC000175217175 1130413745 /nfs/dbraw/zinc/41/37/45/1130413745.db2.gz KSCUSPMUNBALIF-KRWDZBQOSA-N 1 0 336.432 3.775 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000731208707 1130779233 /nfs/dbraw/zinc/77/92/33/1130779233.db2.gz GCNWWYWTPDPLHO-LBPRGKRZSA-N 1 0 334.445 3.737 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(Cl)c1 ZINC000732917909 1130970377 /nfs/dbraw/zinc/97/03/77/1130970377.db2.gz SDDCWTSVKIHBIR-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000733299942 1131017448 /nfs/dbraw/zinc/01/74/48/1131017448.db2.gz KXXUPBZFVWVBSY-NSHDSACASA-N 1 0 331.338 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000733998889 1131184474 /nfs/dbraw/zinc/18/44/74/1131184474.db2.gz FGAWMCAZLTWXMP-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1C ZINC000740870792 1131550969 /nfs/dbraw/zinc/55/09/69/1131550969.db2.gz IMMFFGIVLRDOKA-RYUDHWBXSA-N 1 0 334.445 3.514 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000741260329 1131591188 /nfs/dbraw/zinc/59/11/88/1131591188.db2.gz HDJWVBPLUHWRGS-INIZCTEOSA-N 1 0 342.351 3.579 20 5 EHBDRO Cc1nn(CN2CCCC[C@H]2c2ccc(C)cc2)c(C)c1[N+](=O)[O-] ZINC000742156813 1131694340 /nfs/dbraw/zinc/69/43/40/1131694340.db2.gz KZNMDEPVZBGGCE-KRWDZBQOSA-N 1 0 328.416 3.901 20 5 EHBDRO Cc1nc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899039 1131882812 /nfs/dbraw/zinc/88/28/12/1131882812.db2.gz LBNVLCVHHMRUCS-XHDPSFHLSA-N 1 0 331.441 3.958 20 5 EHBDRO COc1cccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172899487 1131882832 /nfs/dbraw/zinc/88/28/32/1131882832.db2.gz ZUYVSTOILBLTKJ-KRWDZBQOSA-N 1 0 326.396 3.641 20 5 EHBDRO C[C@H](CCCC(C)(C)O)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172901570 1131883419 /nfs/dbraw/zinc/88/34/19/1131883419.db2.gz NUCLJUYMKDKFNH-PBHICJAKSA-N 1 0 334.460 3.762 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172900753 1131883677 /nfs/dbraw/zinc/88/36/77/1131883677.db2.gz ZHMULQXWCKACTD-QGZVFWFLSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCCCc1ccccn1)CC2 ZINC001172901209 1131883956 /nfs/dbraw/zinc/88/39/56/1131883956.db2.gz LBYPYESFQMYMPT-LJQANCHMSA-N 1 0 339.439 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCc3c1cccc3O)CC2 ZINC001172907489 1131888208 /nfs/dbraw/zinc/88/82/08/1131888208.db2.gz FRWYKHXYFIFJCW-HNAYVOBHSA-N 1 0 338.407 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCc3c1cccc3O)CC2 ZINC001172907487 1131888489 /nfs/dbraw/zinc/88/84/89/1131888489.db2.gz FRWYKHXYFIFJCW-BEFAXECRSA-N 1 0 338.407 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](c3ccccn3)C1)CC2 ZINC001172914250 1131903262 /nfs/dbraw/zinc/90/32/62/1131903262.db2.gz FSYUFEQUSQZVQT-ROUUACIJSA-N 1 0 337.423 3.727 20 5 EHBDRO CC[N@H+](Cc1cccnc1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916375 1131904260 /nfs/dbraw/zinc/90/42/60/1131904260.db2.gz RJHXDCXLJCEUAU-GOSISDBHSA-N 1 0 325.412 3.759 20 5 EHBDRO C[N@H+](Cc1cccc(O)c1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910428 1131916155 /nfs/dbraw/zinc/91/61/55/1131916155.db2.gz ZPKCJBFYEUZENQ-KRWDZBQOSA-N 1 0 326.396 3.680 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2cccc(C)c2)c1F ZINC001173175171 1131990751 /nfs/dbraw/zinc/99/07/51/1131990751.db2.gz LGGBAGKIBAPNDP-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2ccsc2)c1F ZINC001173180886 1131992848 /nfs/dbraw/zinc/99/28/48/1131992848.db2.gz YXDUEFPUGIJDJZ-LLVKDONJSA-N 1 0 338.404 3.567 20 5 EHBDRO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H](O)c1ccc(C)cc1 ZINC000743867025 1131993916 /nfs/dbraw/zinc/99/39/16/1131993916.db2.gz QVSYJEHJZOBRHH-LJQANCHMSA-N 1 0 328.412 3.767 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1C ZINC001173219343 1132002856 /nfs/dbraw/zinc/00/28/56/1132002856.db2.gz AZSAOGOMALHCFP-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO Cc1ccc(N2CC[NH+]([C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173224332 1132005127 /nfs/dbraw/zinc/00/51/27/1132005127.db2.gz DTBCUJJLDCHKJB-KRWDZBQOSA-N 1 0 339.439 3.656 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(CC2CCC2)CCOCC1 ZINC001173224078 1132005917 /nfs/dbraw/zinc/00/59/17/1132005917.db2.gz LJLHMSUULGOZEO-OAHLLOKOSA-N 1 0 332.444 3.855 20 5 EHBDRO COc1cc([C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccn1 ZINC001173227431 1132006828 /nfs/dbraw/zinc/00/68/28/1132006828.db2.gz FPWLZHAKFSBJNM-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)[C@H](c2ccccc2)C1 ZINC001173227928 1132008317 /nfs/dbraw/zinc/00/83/17/1132008317.db2.gz SPMVACWSVHGVDQ-JXFKEZNVSA-N 1 0 339.439 3.515 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCC(=O)c1ccccc1 ZINC001173233724 1132009836 /nfs/dbraw/zinc/00/98/36/1132009836.db2.gz MRTTYXRRNXWJFX-OAHLLOKOSA-N 1 0 326.396 3.731 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001173232497 1132010160 /nfs/dbraw/zinc/01/01/60/1132010160.db2.gz BSOOPMRUTNGUSX-LSDHHAIUSA-N 1 0 330.428 3.750 20 5 EHBDRO Cc1ccccc1OC[C@H](C)[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232736 1132010395 /nfs/dbraw/zinc/01/03/95/1132010395.db2.gz FUUTUUXRWMWPIU-HOTGVXAUSA-N 1 0 328.412 3.891 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cnccc1C(F)(F)F ZINC001173210328 1132014267 /nfs/dbraw/zinc/01/42/67/1132014267.db2.gz IUOQIVMNSAOPOR-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO CC(C)(C)O[C@H]1C[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001174565692 1132417652 /nfs/dbraw/zinc/41/76/52/1132417652.db2.gz RPLPDEQHZZHFGR-IRXDYDNUSA-N 1 0 348.443 3.690 20 5 EHBDRO C[C@H]([NH2+]Cc1c2ccccc2cc2ccccc21)[C@H]1CN(C)CCO1 ZINC000773403268 1132459798 /nfs/dbraw/zinc/45/97/98/1132459798.db2.gz DBMJKWGTOMSDND-KSFYIVLOSA-N 1 0 334.463 3.802 20 5 EHBDRO [NH3+]Cc1nnnn1-c1c2ccccc2cc2c3ccccc3ccc21 ZINC001168924627 1132606239 /nfs/dbraw/zinc/60/62/39/1132606239.db2.gz OOLHJBJZVHOXAQ-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168975977 1132617390 /nfs/dbraw/zinc/61/73/90/1132617390.db2.gz XVHLSLUBWGREFY-SMDDNHRTSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001168965928 1132621758 /nfs/dbraw/zinc/62/17/58/1132621758.db2.gz DMZWPERZBNKMRU-WDEREUQCSA-N 1 0 336.741 3.894 20 5 EHBDRO [NH2+]=C(N[C@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C(F)(F)F)ccc1Cl ZINC001168997908 1132627418 /nfs/dbraw/zinc/62/74/18/1132627418.db2.gz GJIPVCRLXAKHFC-WPRPVWTQSA-N 1 0 349.740 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccnc(C(F)(F)F)c2)C2CC2)C1 ZINC001168997037 1132627847 /nfs/dbraw/zinc/62/78/47/1132627847.db2.gz BCEWAKORJOXNGL-YVLXSGLVSA-N 1 0 343.349 3.587 20 5 EHBDRO COc1cccc2c1CC[C@H](CCC[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169006856 1132630391 /nfs/dbraw/zinc/63/03/91/1132630391.db2.gz ZLSLWNITDCDARV-XYJFISCASA-N 1 0 346.471 3.615 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990238 1132634667 /nfs/dbraw/zinc/63/46/67/1132634667.db2.gz YUOIIIBSAMEHOZ-SOUVJXGZSA-N 1 0 330.432 3.700 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCc3c(cccc3C(F)(F)F)C2)C1 ZINC001169040027 1132638126 /nfs/dbraw/zinc/63/81/26/1132638126.db2.gz XCAHBRMZIXAPMC-DGCLKSJQSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041699 1132638445 /nfs/dbraw/zinc/63/84/45/1132638445.db2.gz CBNJSOPBCHCETQ-SJLPKXTDSA-N 1 0 334.485 3.830 20 5 EHBDRO C[C@](CO)([NH2+]Cc1ccc2ccccc2c1)c1cccc([N+](=O)[O-])c1 ZINC001175323544 1132639330 /nfs/dbraw/zinc/63/93/30/1132639330.db2.gz OGHCTCPSKUQORJ-HXUWFJFHSA-N 1 0 336.391 3.745 20 5 EHBDRO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046720 1132641762 /nfs/dbraw/zinc/64/17/62/1132641762.db2.gz MGIQHAOMOMFCIQ-HIFRSBDPSA-N 1 0 330.350 3.973 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3ccc(F)cc32)C1 ZINC001169049672 1132643034 /nfs/dbraw/zinc/64/30/34/1132643034.db2.gz XSMDBWXZLLUZOM-CZUORRHYSA-N 1 0 345.418 3.865 20 5 EHBDRO CC[C@@H]1CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC001169090077 1132660740 /nfs/dbraw/zinc/66/07/40/1132660740.db2.gz DYUSBGWJUHRQQB-QGZVFWFLSA-N 1 0 345.468 3.753 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1OC ZINC001175522104 1132698416 /nfs/dbraw/zinc/69/84/16/1132698416.db2.gz CUQJUJZJEGGHOW-KRWDZBQOSA-N 1 0 344.411 3.895 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC001169395952 1132746490 /nfs/dbraw/zinc/74/64/90/1132746490.db2.gz OLOLBPLGJXMWJA-IBGZPJMESA-N 1 0 346.402 3.897 20 5 EHBDRO CC[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@@H]1C ZINC001169495396 1132772031 /nfs/dbraw/zinc/77/20/31/1132772031.db2.gz RGIBIXISCNJULE-GHMZBOCLSA-N 1 0 327.222 3.978 20 5 EHBDRO CO[C@H](C[N@H+](C)CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1 ZINC001169666274 1132813456 /nfs/dbraw/zinc/81/34/56/1132813456.db2.gz JMEVLRAYYSLEQZ-GOSISDBHSA-N 1 0 332.375 3.596 20 5 EHBDRO CC1(C)C[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC(C)(C)C1 ZINC000767516142 1133011239 /nfs/dbraw/zinc/01/12/39/1133011239.db2.gz OBNACLAVIYQESL-UHFFFAOYSA-N 1 0 343.431 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H](O)c3ccccc3)o2)cc1 ZINC001177117477 1133029221 /nfs/dbraw/zinc/02/92/21/1133029221.db2.gz WOCLFXHOLCUWMF-GOSISDBHSA-N 1 0 338.363 3.678 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767761888 1133048945 /nfs/dbraw/zinc/04/89/45/1133048945.db2.gz LDDBUQJSKMDJJR-MRXNPFEDSA-N 1 0 343.431 3.856 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCCCn3ccnc3)o2)c1 ZINC001177442828 1133067248 /nfs/dbraw/zinc/06/72/48/1133067248.db2.gz WFGVSCIDPJKCJT-UHFFFAOYSA-N 1 0 340.383 3.621 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccco1 ZINC001177554216 1133075288 /nfs/dbraw/zinc/07/52/88/1133075288.db2.gz QECFLXCRQBFVTF-KRWDZBQOSA-N 1 0 331.416 3.669 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccncc1Cl ZINC001178327027 1133159987 /nfs/dbraw/zinc/15/99/87/1133159987.db2.gz VUNRGAGNHKHBQI-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CC2(CC(N)=O)CCCCC2)cc1[N+](=O)[O-] ZINC001179244122 1133238914 /nfs/dbraw/zinc/23/89/14/1133238914.db2.gz WINFTSOOZJSVPQ-UHFFFAOYSA-N 1 0 347.459 3.634 20 5 EHBDRO C=C(F)C(=O)Nc1cc2oc3cc(=[NH2+])ccc-3nc2c2ccccc12 ZINC001180120771 1133334113 /nfs/dbraw/zinc/33/41/13/1133334113.db2.gz YLGBORYZOSJSLS-UHFFFAOYSA-N 1 0 333.322 3.987 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+]1CCN(C)c2ccccc2C1 ZINC001180212659 1133344811 /nfs/dbraw/zinc/34/48/11/1133344811.db2.gz DVZQCVPIKRRLFO-UHFFFAOYSA-N 1 0 325.412 3.664 20 5 EHBDRO C[C@@H]1CSCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC001181444478 1133487861 /nfs/dbraw/zinc/48/78/61/1133487861.db2.gz ALPBRXDQWYJMIO-JTQLQIEISA-N 1 0 334.363 3.799 20 5 EHBDRO CC(C)(C)[C@H](Cn1ccnc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133925 1133620726 /nfs/dbraw/zinc/62/07/26/1133620726.db2.gz JRHLCGWLNROLLS-MSOLQXFVSA-N 1 0 342.443 3.873 20 5 EHBDRO O=C(OCc1ccccc1[N+](=O)[O-])c1cccc(C[NH+]2CCCC2)c1 ZINC000785712750 1133746713 /nfs/dbraw/zinc/74/67/13/1133746713.db2.gz DVVRXKRZYZGVBW-UHFFFAOYSA-N 1 0 340.379 3.548 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000786810182 1133909366 /nfs/dbraw/zinc/90/93/66/1133909366.db2.gz ROONUCCWTJBLDG-NQUDRAQSSA-N 1 0 338.407 3.839 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000786812687 1133910150 /nfs/dbraw/zinc/91/01/50/1133910150.db2.gz IVQSRTQAXQOYDP-KAMYIIQDSA-N 1 0 341.367 3.739 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1ccsc1 ZINC000786815965 1133910465 /nfs/dbraw/zinc/91/04/65/1133910465.db2.gz UQPVFLACUUUXLE-KMGMULKOSA-N 1 0 332.425 3.557 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCCC[C@H]([C@@H]2CCOC2)C1 ZINC001184252503 1133916097 /nfs/dbraw/zinc/91/60/97/1133916097.db2.gz QEIBLZXQABJSQE-DLBZAZTESA-N 1 0 332.444 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000746666118 1133985412 /nfs/dbraw/zinc/98/54/12/1133985412.db2.gz NCIBLWHJUDZWDX-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC(C[NH+]2CCCC2)CC1 ZINC000746666707 1133986073 /nfs/dbraw/zinc/98/60/73/1133986073.db2.gz PFQPAKDPYUUZPD-UHFFFAOYSA-N 1 0 337.851 3.556 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1c(F)cc([N+](=O)[O-])cc1F ZINC001184874474 1134000729 /nfs/dbraw/zinc/00/07/29/1134000729.db2.gz OKRJSKAXXDPFCF-LBPRGKRZSA-N 1 0 327.375 3.940 20 5 EHBDRO C[C@@H]([NH2+]CCCCOCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788585928 1134147947 /nfs/dbraw/zinc/14/79/47/1134147947.db2.gz XTAVBJMQZZKIQZ-OAHLLOKOSA-N 1 0 343.427 3.825 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602152 1134149685 /nfs/dbraw/zinc/14/96/85/1134149685.db2.gz LYSUSBHBEYNQCT-RVSPLBMKSA-N 1 0 335.448 3.669 20 5 EHBDRO CC[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000788629347 1134153676 /nfs/dbraw/zinc/15/36/76/1134153676.db2.gz TULYRBPZKLWEJO-TZMCWYRMSA-N 1 0 347.390 3.824 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccccc1OC ZINC000775070035 1134284102 /nfs/dbraw/zinc/28/41/02/1134284102.db2.gz VBROHKRGXKSTEJ-QGZVFWFLSA-N 1 0 330.384 3.723 20 5 EHBDRO CCOC(=O)NC1CCC([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000790746187 1134461437 /nfs/dbraw/zinc/46/14/37/1134461437.db2.gz IXQJMAWJDCSDCR-JEYLPNPQSA-N 1 0 349.431 3.611 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@H]4C3)nc2c1 ZINC000775180554 1134483750 /nfs/dbraw/zinc/48/37/50/1134483750.db2.gz ZZCMDSVIHPIGPF-MELADBBJSA-N 1 0 328.416 3.920 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775370113 1134672658 /nfs/dbraw/zinc/67/26/58/1134672658.db2.gz LAABKVIHKKQADN-ZBFHGGJFSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCc2cccs2)c([N+](=O)[O-])c1 ZINC001170296617 1134737578 /nfs/dbraw/zinc/73/75/78/1134737578.db2.gz GUWIRWBRIFYFEE-CYBMUJFWSA-N 1 0 334.441 3.818 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326683 1134748356 /nfs/dbraw/zinc/74/83/56/1134748356.db2.gz BOOOAQJSJARJMU-OLZOCXBDSA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170307209 1134752980 /nfs/dbraw/zinc/75/29/80/1134752980.db2.gz FHERTLUMDKRHAG-CQSZACIVSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCc2cccc(F)c2)c([N+](=O)[O-])c1 ZINC001170354804 1134753665 /nfs/dbraw/zinc/75/36/65/1134753665.db2.gz PJHYZANXPKHFPA-AWEZNQCLSA-N 1 0 346.402 3.848 20 5 EHBDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879226 1134810933 /nfs/dbraw/zinc/81/09/33/1134810933.db2.gz GPKSEPOWJBUJNU-DZGCQCFKSA-N 1 0 339.417 3.657 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)[C@@H](O)c1ccccc1 ZINC000793235937 1134881053 /nfs/dbraw/zinc/88/10/53/1134881053.db2.gz IBNXUBHYQKBDJR-MOPGFXCFSA-N 1 0 328.412 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1cccnc1F ZINC000793279192 1134900852 /nfs/dbraw/zinc/90/08/52/1134900852.db2.gz BBCCMOXNNIPPEN-CZUORRHYSA-N 1 0 329.375 3.630 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1cc(C)cc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000775539438 1135038787 /nfs/dbraw/zinc/03/87/87/1135038787.db2.gz LOCBASNONYCRCQ-RTBURBONSA-N 1 0 328.412 3.986 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCc1ccc(CC[NH+](C)C)cc1 ZINC000804645180 1135151190 /nfs/dbraw/zinc/15/11/90/1135151190.db2.gz SAAVBJJEJGMWSH-UHFFFAOYSA-N 1 0 341.411 3.514 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1OC ZINC001194090211 1135230639 /nfs/dbraw/zinc/23/06/39/1135230639.db2.gz DWAGFCSWPOEFHT-CABCVRRESA-N 1 0 326.824 3.932 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C12CCCCC2 ZINC001194092430 1135231567 /nfs/dbraw/zinc/23/15/67/1135231567.db2.gz OZJZPMZDXYNHMU-SJORKVTESA-N 1 0 336.407 3.951 20 5 EHBDRO CO[C@@H]1[C@H](C)[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC001194458717 1135270314 /nfs/dbraw/zinc/27/03/14/1135270314.db2.gz TULWHEYSGKDACG-BIGNPOOSSA-N 1 0 346.349 3.763 20 5 EHBDRO C[C@H](C[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000805820336 1135336818 /nfs/dbraw/zinc/33/68/18/1135336818.db2.gz KXSWGQJAYVUOAY-CABCVRRESA-N 1 0 346.402 3.720 20 5 EHBDRO Cc1c(C[N@H+]2CC[C@@H](C)[C@@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195495921 1135433888 /nfs/dbraw/zinc/43/38/88/1135433888.db2.gz AZTAXIBMQFYEQG-CJNGLKHVSA-N 1 0 348.443 3.703 20 5 EHBDRO COC(=O)CC[C@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468857 1135693808 /nfs/dbraw/zinc/69/38/08/1135693808.db2.gz OMFCEDPZEFFEGA-LSDHHAIUSA-N 1 0 334.416 3.629 20 5 EHBDRO C[C@@H](NCc1ccc(-c2ccccn2)nc1)c1ccccc1[N+](=O)[O-] ZINC001197514100 1135697102 /nfs/dbraw/zinc/69/71/02/1135697102.db2.gz IFYXZWLDSKKLKB-CQSZACIVSA-N 1 0 334.379 3.903 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@H](c3c(F)cccc3F)C2)c1 ZINC001197639455 1135722133 /nfs/dbraw/zinc/72/21/33/1135722133.db2.gz QAIKAGYXHPYBHC-ZDUSSCGKSA-N 1 0 348.349 3.741 20 5 EHBDRO C[C@H](COCC1CCCCC1)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC001197989255 1135764021 /nfs/dbraw/zinc/76/40/21/1135764021.db2.gz LJGNBKWCYUGHEE-OAHLLOKOSA-N 1 0 336.432 3.549 20 5 EHBDRO C[C@@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000809975086 1135907935 /nfs/dbraw/zinc/90/79/35/1135907935.db2.gz WBLBBOCRVJDJNN-LSDHHAIUSA-N 1 0 345.226 3.949 20 5 EHBDRO CC(C)C1(C[NH2+]Cc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001200891179 1135964288 /nfs/dbraw/zinc/96/42/88/1135964288.db2.gz JXQLXYGXSDFEST-UHFFFAOYSA-N 1 0 327.222 3.883 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001201692466 1136057435 /nfs/dbraw/zinc/05/74/35/1136057435.db2.gz AJVSCKVJEGZGCQ-ZBFHGGJFSA-N 1 0 326.824 3.584 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@H](C3CCOCC3)C2)c1 ZINC001201822638 1136067841 /nfs/dbraw/zinc/06/78/41/1136067841.db2.gz OIVUYXQKAAWTAU-ROUUACIJSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC[C@H]1CCCCO1 ZINC000811488837 1136093043 /nfs/dbraw/zinc/09/30/43/1136093043.db2.gz NEKWEQZQAXJEEO-GFCCVEGCSA-N 1 0 333.215 3.950 20 5 EHBDRO CC(C)(C)C[C@@H](O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480004 1136097320 /nfs/dbraw/zinc/09/73/20/1136097320.db2.gz PUCMUOFKTVWYGQ-LLVKDONJSA-N 1 0 335.231 3.788 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H]2c2cccc(F)c2)cc1 ZINC000776276944 1136130588 /nfs/dbraw/zinc/13/05/88/1136130588.db2.gz LXKCYTDSODXMBI-ROUUACIJSA-N 1 0 330.359 3.604 20 5 EHBDRO Cc1ccc(CN2CCN(c3cccc(F)c3)C[C@H]2C)cc1[N+](=O)[O-] ZINC001170722916 1136395323 /nfs/dbraw/zinc/39/53/23/1136395323.db2.gz MQMOGJQBBQIKJN-OAHLLOKOSA-N 1 0 343.402 3.753 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCCC[C@@H]2c2ccco2)cc1 ZINC000776583352 1136441967 /nfs/dbraw/zinc/44/19/67/1136441967.db2.gz DNXJTSNBXZBCOU-SJORKVTESA-N 1 0 330.384 3.839 20 5 EHBDRO C[N@@H+](Cc1ccc(Cl)c(F)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597186 1136457780 /nfs/dbraw/zinc/45/77/80/1136457780.db2.gz HUDNGQVMXAIFMK-MRXNPFEDSA-N 1 0 338.766 3.553 20 5 EHBDRO C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc(C(F)F)cc1[N+](=O)[O-] ZINC000853618898 1136549617 /nfs/dbraw/zinc/54/96/17/1136549617.db2.gz OQWZVURJABSUPL-AAEUAGOBSA-N 1 0 325.359 3.595 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741653 1136617606 /nfs/dbraw/zinc/61/76/06/1136617606.db2.gz WKBSWZTXHPAWDV-YOEHRIQHSA-N 1 0 334.416 3.711 20 5 EHBDRO CCC(CC)[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCO1 ZINC000815614704 1136619013 /nfs/dbraw/zinc/61/90/13/1136619013.db2.gz ZBQGPGFZFQCPTH-MRAWALMUSA-N 1 0 335.448 3.811 20 5 EHBDRO Cc1[nH]c2ccc(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)cc2c1C ZINC000818975165 1136900881 /nfs/dbraw/zinc/90/08/81/1136900881.db2.gz JKEALWHJQNSGJZ-LJQANCHMSA-N 1 0 339.395 3.516 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819015763 1136903435 /nfs/dbraw/zinc/90/34/35/1136903435.db2.gz PEWPSEUISIJEAZ-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1ccccc1[C@H](O)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000819092010 1136907660 /nfs/dbraw/zinc/90/76/60/1136907660.db2.gz PQKVILPACLWFJZ-LJQANCHMSA-N 1 0 328.412 3.549 20 5 EHBDRO Cc1cc(F)ccc1[C@H](O)C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000819091277 1136907918 /nfs/dbraw/zinc/90/79/18/1136907918.db2.gz CWRZMPPYJBIMDU-LJQANCHMSA-N 1 0 346.402 3.688 20 5 EHBDRO CC[C@@H](CSc1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819187129 1136921250 /nfs/dbraw/zinc/92/12/50/1136921250.db2.gz BIBJOGSTFWVAHE-MAUKXSAKSA-N 1 0 346.452 3.789 20 5 EHBDRO Cc1oc2ccccc2c1CC[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819231770 1136926873 /nfs/dbraw/zinc/92/68/73/1136926873.db2.gz APNMEAADGCFWIW-GOSISDBHSA-N 1 0 340.379 3.515 20 5 EHBDRO CC[C@@H](CCc1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000858363324 1136961834 /nfs/dbraw/zinc/96/18/34/1136961834.db2.gz SOENBGMELSHLOS-HKUYNNGSSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@@H]2Cc3cc(Cl)ccc3[C@@H]21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000858456775 1136969490 /nfs/dbraw/zinc/96/94/90/1136969490.db2.gz CQKJNMJIVBHZAI-JRXCTEAYSA-N 1 0 343.814 3.819 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000120234850 1137245471 /nfs/dbraw/zinc/24/54/71/1137245471.db2.gz SKKHULZGXIPSKL-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000865783062 1137311543 /nfs/dbraw/zinc/31/15/43/1137311543.db2.gz FWRLPAOZBUGVQB-MJTSJRRZSA-N 1 0 330.428 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)c1 ZINC000846109298 1137333289 /nfs/dbraw/zinc/33/32/89/1137333289.db2.gz UMMAQHNLAIFJRI-AWEZNQCLSA-N 1 0 348.296 3.817 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000866238594 1137337911 /nfs/dbraw/zinc/33/79/11/1137337911.db2.gz PZLWRYNNLCRIBK-GUYCJALGSA-N 1 0 348.422 3.566 20 5 EHBDRO CC(C)n1cc([C@@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cn1 ZINC000866265576 1137340548 /nfs/dbraw/zinc/34/05/48/1137340548.db2.gz NVRRDDJOGDEPRN-CHWSQXEVSA-N 1 0 334.395 3.793 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCc1ccc(Cl)nc1 ZINC000866286177 1137342846 /nfs/dbraw/zinc/34/28/46/1137342846.db2.gz WAPYUJSMASAISA-NSHDSACASA-N 1 0 337.782 3.546 20 5 EHBDRO CSCC1(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866386533 1137350885 /nfs/dbraw/zinc/35/08/85/1137350885.db2.gz FZNHZKKRYUXTET-LBPRGKRZSA-N 1 0 326.437 3.788 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(C2(C)OCCO2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000866421711 1137353358 /nfs/dbraw/zinc/35/33/58/1137353358.db2.gz XSFDIQHXJWAHAD-AWEZNQCLSA-N 1 0 342.395 3.665 20 5 EHBDRO CCc1noc(C2CCC([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)CC2)n1 ZINC000866540950 1137363173 /nfs/dbraw/zinc/36/31/73/1137363173.db2.gz VBTWTYKABFPXRM-UHFFFAOYSA-N 1 0 344.415 3.665 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCn1nc(C)cc1C ZINC000872018246 1137564724 /nfs/dbraw/zinc/56/47/24/1137564724.db2.gz KJQNYQWZAYRTMY-CQSZACIVSA-N 1 0 348.472 3.871 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019550 1137564848 /nfs/dbraw/zinc/56/48/48/1137564848.db2.gz WSBBIQQDKAHOTF-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000872039620 1137566979 /nfs/dbraw/zinc/56/69/79/1137566979.db2.gz UNLNMZFROVSPAH-SPGJAERMSA-N 1 0 336.457 3.781 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872045533 1137567516 /nfs/dbraw/zinc/56/75/16/1137567516.db2.gz NXLXXVWJPRQEOX-WWGRRREGSA-N 1 0 332.375 3.549 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000872051180 1137568016 /nfs/dbraw/zinc/56/80/16/1137568016.db2.gz IGGJNRZVGWKIKO-AGNJHWRGSA-N 1 0 342.461 3.764 20 5 EHBDRO C[C@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052593 1137568206 /nfs/dbraw/zinc/56/82/06/1137568206.db2.gz PJFCIJCSPRBKJE-SCLBCKFNSA-N 1 0 344.386 3.898 20 5 EHBDRO COCCOc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000873012748 1137588039 /nfs/dbraw/zinc/58/80/39/1137588039.db2.gz WXMHAJKCIVQFRG-UHFFFAOYSA-N 1 0 344.411 3.527 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2cccc(OC(C)C)c2)cccc1[N+](=O)[O-] ZINC000873053116 1137589003 /nfs/dbraw/zinc/58/90/03/1137589003.db2.gz FFSWSGXUFOGNMK-LJQANCHMSA-N 1 0 344.411 3.514 20 5 EHBDRO COc1ccc2c(c1)OCC[C@@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873061736 1137589244 /nfs/dbraw/zinc/58/92/44/1137589244.db2.gz LBAWTASMTFUMNS-INIZCTEOSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](C[C@@H](C)O)c1ccccc1 ZINC000873079572 1137589655 /nfs/dbraw/zinc/58/96/55/1137589655.db2.gz VZDUDXXYZPPKPF-CRAIPNDOSA-N 1 0 342.439 3.856 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C(c3ccccc3)c3ccccc3)C2)c1 ZINC000876892297 1137664696 /nfs/dbraw/zinc/66/46/96/1137664696.db2.gz AKKDGDLWPKECNQ-UHFFFAOYSA-N 1 0 348.406 3.874 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(Cl)c1 ZINC000876928356 1137665467 /nfs/dbraw/zinc/66/54/67/1137665467.db2.gz AYTKIWHJAYVDMJ-XUJLQICISA-N 1 0 334.807 3.889 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(Cl)c1 ZINC000876928357 1137665520 /nfs/dbraw/zinc/66/55/20/1137665520.db2.gz AYTKIWHJAYVDMJ-ZBCRRDGASA-N 1 0 334.807 3.889 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H](c3ccc(F)cc3)C3CCC3)C2)c1 ZINC000877011643 1137667496 /nfs/dbraw/zinc/66/74/96/1137667496.db2.gz FRCCRHHAXKQBKB-HTWSVDAQSA-N 1 0 344.390 3.765 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@H]1CCSC1 ZINC000877661522 1137684743 /nfs/dbraw/zinc/68/47/43/1137684743.db2.gz CTWDSBWZBQYMPG-JTQLQIEISA-N 1 0 334.363 3.846 20 5 EHBDRO CC(C)(O)C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000877754091 1137688036 /nfs/dbraw/zinc/68/80/36/1137688036.db2.gz VWPQVRPPRYAVJA-UHFFFAOYSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@H]2O1 ZINC000877804830 1137690443 /nfs/dbraw/zinc/69/04/43/1137690443.db2.gz FAPDISZVZOJNPL-VZJVUDMVSA-N 1 0 344.333 3.661 20 5 EHBDRO CCCC[N@H+](CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877908362 1137695163 /nfs/dbraw/zinc/69/51/63/1137695163.db2.gz SRPCMTQQIVERQU-UHFFFAOYSA-N 1 0 338.795 3.920 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000877960181 1137697136 /nfs/dbraw/zinc/69/71/36/1137697136.db2.gz HJNNZUDLDNFBGJ-UHFFFAOYSA-N 1 0 332.404 3.903 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135255 1137704017 /nfs/dbraw/zinc/70/40/17/1137704017.db2.gz VXWHCXYCNFINFV-NFAWXSAZSA-N 1 0 342.399 3.798 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1C ZINC000878659359 1137724026 /nfs/dbraw/zinc/72/40/26/1137724026.db2.gz BGCFQIPSOVERTR-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO CC(C)(C)C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878693650 1137725446 /nfs/dbraw/zinc/72/54/46/1137725446.db2.gz XKTYZLHFFWPAHT-ZDUSSCGKSA-N 1 0 344.415 3.903 20 5 EHBDRO C=C/C=C/CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000878754802 1137727047 /nfs/dbraw/zinc/72/70/47/1137727047.db2.gz BRCFUCVGUDYOFR-CTWCUAEASA-N 1 0 330.428 3.833 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066652 1137736859 /nfs/dbraw/zinc/73/68/59/1137736859.db2.gz QMBGXUOBVWUHQV-SFAKSCPVSA-N 1 0 342.399 3.823 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@@H]1CCCn2nccc21 ZINC000879788090 1137758750 /nfs/dbraw/zinc/75/87/50/1137758750.db2.gz QRKCLXQHLOPPNV-GFCCVEGCSA-N 1 0 341.198 3.723 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2CCC3(CCOCC3)CO2)cccc1[N+](=O)[O-] ZINC000883261778 1137851125 /nfs/dbraw/zinc/85/11/25/1137851125.db2.gz MNCJKUHMSKMGNO-CVEARBPZSA-N 1 0 348.443 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H]1CCC2(CCOCC2)CO1 ZINC000883261940 1137851187 /nfs/dbraw/zinc/85/11/87/1137851187.db2.gz QZWPAAGTDCBBGM-WBVHZDCISA-N 1 0 348.443 3.530 20 5 EHBDRO CO[C@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000883263387 1137851354 /nfs/dbraw/zinc/85/13/54/1137851354.db2.gz RFJYHUFZDPHWJE-JOCQHMNTSA-N 1 0 332.425 3.838 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H]2C[C@@H](COC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000883319497 1137854638 /nfs/dbraw/zinc/85/46/38/1137854638.db2.gz DQULFWFLSGWRFJ-OHNRDTAOSA-N 1 0 344.411 3.854 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC3(CCC3)O2)cc1[N+](=O)[O-] ZINC000883356839 1137857217 /nfs/dbraw/zinc/85/72/17/1137857217.db2.gz XCDLCXAKZQTJGS-ZFWWWQNUSA-N 1 0 334.416 3.746 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000119294327 1137940219 /nfs/dbraw/zinc/94/02/19/1137940219.db2.gz LNVVYNVYKYFIAO-OIISXLGYSA-N 1 0 332.444 3.853 20 5 EHBDRO CC[C@@H]([NH2+][C@H](CCO)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120282919 1137948012 /nfs/dbraw/zinc/94/80/12/1137948012.db2.gz RQHRFURZEFBQPP-RTBURBONSA-N 1 0 344.411 3.768 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000348319322 1137949117 /nfs/dbraw/zinc/94/91/17/1137949117.db2.gz LDLNCMQRTFFKIS-LLVKDONJSA-N 1 0 333.413 3.508 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@@H]2C)O1)c1cccc([N+](=O)[O-])c1 ZINC000886771908 1138137548 /nfs/dbraw/zinc/13/75/48/1138137548.db2.gz PSKYXSHSYBZREI-BHHKEHIISA-N 1 0 348.443 3.608 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@@H]2C)O1 ZINC000886772070 1138137675 /nfs/dbraw/zinc/13/76/75/1138137675.db2.gz RVIWMFGTYXILMM-BBHOWBALSA-N 1 0 348.443 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000093563705 1138238853 /nfs/dbraw/zinc/23/88/53/1138238853.db2.gz IDEGDDWVSWEWHK-KRZKXXONSA-N 1 0 329.444 3.558 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000337348541 1138540457 /nfs/dbraw/zinc/54/04/57/1138540457.db2.gz ZAVGYHWMVLGANT-WBVHZDCISA-N 1 0 341.411 3.814 20 5 EHBDRO CCN(CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)OC(C)(C)C ZINC000301643157 1138612004 /nfs/dbraw/zinc/61/20/04/1138612004.db2.gz NJTPRPBDWPOEPA-CYBMUJFWSA-N 1 0 337.420 3.502 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC(C)=C(c2ccco2)C1 ZINC000338344015 1138843750 /nfs/dbraw/zinc/84/37/50/1138843750.db2.gz OCQZNWYGIYWWQB-UHFFFAOYSA-N 1 0 328.368 3.876 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC(C)=C(c3ccco3)C2)cc1[N+](=O)[O-] ZINC000338346941 1138844712 /nfs/dbraw/zinc/84/47/12/1138844712.db2.gz SKVGBNWSQBRKEL-UHFFFAOYSA-N 1 0 328.368 3.876 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311277 1139566346 /nfs/dbraw/zinc/56/63/46/1139566346.db2.gz AYOJDMNMENZCKH-ZAKOAHRUSA-N 1 0 348.443 3.876 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1COC2(CCC(C)CC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777314757 1139584725 /nfs/dbraw/zinc/58/47/25/1139584725.db2.gz WEIPAKFDUHJCKM-VLNFIEOWSA-N 1 0 334.416 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](CCO)c1ccccc1)CCC2 ZINC000192889905 1140553737 /nfs/dbraw/zinc/55/37/37/1140553737.db2.gz ZYBKDRGJLNGLGA-PXNSSMCTSA-N 1 0 340.423 3.728 20 5 EHBDRO Nc1ccc([N+](=O)[O-])c(NCC2CC[NH+](Cc3cccs3)CC2)c1 ZINC000193399145 1140575285 /nfs/dbraw/zinc/57/52/85/1140575285.db2.gz KDUUQUNAMLQXDP-UHFFFAOYSA-N 1 0 346.456 3.563 20 5 EHBDRO COc1cccc(N2CC[C@@H]([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000267453769 1140793296 /nfs/dbraw/zinc/79/32/96/1140793296.db2.gz SFJVIVCRBJBIJM-GOEBONIOSA-N 1 0 341.411 3.533 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccccc1OCCOC)c1cccc([N+](=O)[O-])c1 ZINC000268846100 1141006972 /nfs/dbraw/zinc/00/69/72/1141006972.db2.gz OOCVEAWURFFMAP-SFHVURJKSA-N 1 0 344.411 3.861 20 5 EHBDRO CCC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCOCC1 ZINC000268976062 1141038592 /nfs/dbraw/zinc/03/85/92/1141038592.db2.gz NLGGNXKRKWDAFU-QGZVFWFLSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000270680341 1141256401 /nfs/dbraw/zinc/25/64/01/1141256401.db2.gz YJBOWCWPIHSVPM-VBHSOAQHSA-N 1 0 332.375 3.897 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000271512409 1141385171 /nfs/dbraw/zinc/38/51/71/1141385171.db2.gz STPOZRGGFBOENV-MSOLQXFVSA-N 1 0 332.375 3.898 20 5 EHBDRO CN(CCC[NH+]1CCCC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339155949 1141512982 /nfs/dbraw/zinc/51/29/82/1141512982.db2.gz RSBGBSZJSYIWFL-UHFFFAOYSA-N 1 0 345.365 3.531 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc2cc([N+](=O)[O-])ccc2n1)c1ccccc1 ZINC000097466709 219026085 /nfs/dbraw/zinc/02/60/85/219026085.db2.gz ZITYVUMSOWUFGH-SFHVURJKSA-N 1 0 336.395 3.858 20 5 EHBDRO CC(C)C[C@H]([NH3+])c1noc(-c2cc3cc([N+](=O)[O-])ccc3s2)n1 ZINC000339389572 1014323613 /nfs/dbraw/zinc/32/36/13/1014323613.db2.gz HAPKDJFQSOAJIH-NSHDSACASA-N 1 0 332.385 3.905 20 5 EHBDRO CCOc1cc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)ccc1O ZINC000459424911 1032109058 /nfs/dbraw/zinc/10/90/58/1032109058.db2.gz LNMURNMBTABDGJ-UHFFFAOYSA-N 1 0 344.411 3.812 20 5 EHBDRO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(O)c1 ZINC000471165706 1015183312 /nfs/dbraw/zinc/18/33/12/1015183312.db2.gz PXCYFRHWPPPERE-AWEZNQCLSA-N 1 0 330.384 3.762 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)CC[C@H]2CCCC[N@@H+]2C)cc1[N+](=O)[O-] ZINC000189929016 1016780379 /nfs/dbraw/zinc/78/03/79/1016780379.db2.gz ZZCCUGAZLFJOPE-MRXNPFEDSA-N 1 0 347.459 3.665 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@H]2CCO)s1 ZINC000189977551 1016821040 /nfs/dbraw/zinc/82/10/40/1016821040.db2.gz FBGZJOKKGZLXHE-XJKSGUPXSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)O1 ZINC000414512832 1016946135 /nfs/dbraw/zinc/94/61/35/1016946135.db2.gz JCPYWWNMTZYQRM-NFAWXSAZSA-N 1 0 330.384 3.758 20 5 EHBDRO CCc1nc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])sc1C ZINC000449113249 1032234630 /nfs/dbraw/zinc/23/46/30/1032234630.db2.gz FYHJLIOLFQRBJW-GFCCVEGCSA-N 1 0 333.457 3.685 20 5 EHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615520 1032353095 /nfs/dbraw/zinc/35/30/95/1032353095.db2.gz PEABAZIOVPVEOP-YVEFUNNKSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)c1ccc(Cl)cc1 ZINC000449249257 1032353488 /nfs/dbraw/zinc/35/34/88/1032353488.db2.gz IRQCVNGPQNWVQM-MLGOLLRUSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000459650943 1032373493 /nfs/dbraw/zinc/37/34/93/1032373493.db2.gz ONDCQVBBVVHFBG-HOTGVXAUSA-N 1 0 327.428 3.922 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000449278347 1032397706 /nfs/dbraw/zinc/39/77/06/1032397706.db2.gz IVJDHZWCXYZDNY-CXAGYDPISA-N 1 0 326.396 3.899 20 5 EHBDRO C[C@H](CCCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000088762861 1032509634 /nfs/dbraw/zinc/50/96/34/1032509634.db2.gz UHVPIMGRRXPGNU-LLVKDONJSA-N 1 0 338.791 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(Cl)cc2Cl)cc1 ZINC000754250137 1017316149 /nfs/dbraw/zinc/31/61/49/1017316149.db2.gz BFQQHDJIBMXLBZ-HNNXBMFYSA-N 1 0 341.194 3.725 20 5 EHBDRO C[C@@H]1[NH2+]CCC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000414961249 1017361411 /nfs/dbraw/zinc/36/14/11/1017361411.db2.gz VNQUGHPWCOGUIA-WFASDCNBSA-N 1 0 331.441 3.553 20 5 EHBDRO C[C@@H]([NH3+])[C@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415012778 1017408776 /nfs/dbraw/zinc/40/87/76/1017408776.db2.gz JYXHIEIEDDZFGA-NEPJUHHUSA-N 1 0 349.818 3.866 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000155463944 1017783300 /nfs/dbraw/zinc/78/33/00/1017783300.db2.gz DLZDYJGVMIGQRB-CYBMUJFWSA-N 1 0 327.384 3.712 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548010022 1018197951 /nfs/dbraw/zinc/19/79/51/1018197951.db2.gz BSXIIFICMOXOGP-WMLDXEAASA-N 1 0 340.427 3.678 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000592399400 1032756374 /nfs/dbraw/zinc/75/63/74/1032756374.db2.gz ZSWCQLJCJVBGQC-LSBZLQRGSA-N 1 0 341.411 3.869 20 5 EHBDRO COc1cc(NC2CC[NH+](C3CCCC3)CC2)c(F)cc1[N+](=O)[O-] ZINC000271095124 1018592098 /nfs/dbraw/zinc/59/20/98/1018592098.db2.gz MLYPWQYREHWMIX-UHFFFAOYSA-N 1 0 337.395 3.561 20 5 EHBDRO Cc1ccc([C@@H](C)N[C@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404506 1032777324 /nfs/dbraw/zinc/77/73/24/1032777324.db2.gz ZARRCMMRNNKBKZ-CXAGYDPISA-N 1 0 332.375 3.817 20 5 EHBDRO Cc1cccc2nc(CC[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3C)cn21 ZINC000592404615 1032777700 /nfs/dbraw/zinc/77/77/00/1032777700.db2.gz UMJWNAFYXRRVGE-OAHLLOKOSA-N 1 0 338.411 3.753 20 5 EHBDRO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCCCCC1 ZINC000052331329 1018927497 /nfs/dbraw/zinc/92/74/97/1018927497.db2.gz ZDODXTZOVNWDNN-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO CC(C)[C@@H](CN(C)Cc1ccccc1)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000398036559 1018957560 /nfs/dbraw/zinc/95/75/60/1018957560.db2.gz NKFJLKOAQDVSFN-QGZVFWFLSA-N 1 0 347.484 3.903 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473512380 1019114435 /nfs/dbraw/zinc/11/44/35/1019114435.db2.gz HSGSJIGMHALZOG-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](OC3CCC3)C2)ccc1[N+](=O)[O-] ZINC000594027219 1032808788 /nfs/dbraw/zinc/80/87/88/1032808788.db2.gz SNRFKHCRDDUIOK-INIZCTEOSA-N 1 0 334.416 3.527 20 5 EHBDRO Cc1nc2c(o1)CCC[C@H]2[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000926113191 1019651757 /nfs/dbraw/zinc/65/17/57/1019651757.db2.gz NABLIGBAJMOMIQ-CYBMUJFWSA-N 1 0 335.791 3.754 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)c1 ZINC000345274856 1020104263 /nfs/dbraw/zinc/10/42/63/1020104263.db2.gz FSIFNUVTZBDALP-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000449614110 1032887687 /nfs/dbraw/zinc/88/76/87/1032887687.db2.gz FKMLUPXBNCALDY-OJFHPMDPSA-N 1 0 339.395 3.513 20 5 EHBDRO CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000236982664 1020281130 /nfs/dbraw/zinc/28/11/30/1020281130.db2.gz ADDYDFXLJNZHMY-UGSOOPFHSA-N 1 0 332.400 3.742 20 5 EHBDRO OC[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)[C@@H]1CCOC1 ZINC000280361978 1020323432 /nfs/dbraw/zinc/32/34/32/1020323432.db2.gz UBORJXVNZCJESA-MOPGFXCFSA-N 1 0 335.447 3.728 20 5 EHBDRO CC[C@@](C)(CCO)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000134471283 1020851688 /nfs/dbraw/zinc/85/16/88/1020851688.db2.gz RLFUJBGXEDFVAL-SFHVURJKSA-N 1 0 348.399 3.504 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000610505283 1020855909 /nfs/dbraw/zinc/85/59/09/1020855909.db2.gz FBXLLIVWOPSUCY-KRWDZBQOSA-N 1 0 343.358 3.510 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@@H]1c1cccc(F)c1)Nc1ccc([N+](=O)[O-])cc1 ZINC000610505284 1020856400 /nfs/dbraw/zinc/85/64/00/1020856400.db2.gz FBXLLIVWOPSUCY-QGZVFWFLSA-N 1 0 343.358 3.510 20 5 EHBDRO Cc1cnn(CCCCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000135219569 1020904170 /nfs/dbraw/zinc/90/41/70/1020904170.db2.gz RKCHYCLONPNUKZ-UHFFFAOYSA-N 1 0 342.443 3.935 20 5 EHBDRO CC(C)C(=O)Nc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602506696 1032940974 /nfs/dbraw/zinc/94/09/74/1032940974.db2.gz LEIUPJUQOPIKMW-UHFFFAOYSA-N 1 0 341.411 3.522 20 5 EHBDRO CO[C@@H]([C@@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633534 1032966988 /nfs/dbraw/zinc/96/69/88/1032966988.db2.gz ULVVFSATIJVLKE-XIKOKIGWSA-N 1 0 330.384 3.758 20 5 EHBDRO CC(C)c1ccc(C[N@H+](CCO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000505886440 1021270850 /nfs/dbraw/zinc/27/08/50/1021270850.db2.gz FLHXACSEYIKICA-UHFFFAOYSA-N 1 0 328.412 3.713 20 5 EHBDRO C[N@H+](CCC1CCCCC1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000507602287 1021392238 /nfs/dbraw/zinc/39/22/38/1021392238.db2.gz VUMFCKBPJOYUMP-UHFFFAOYSA-N 1 0 334.416 3.864 20 5 EHBDRO Cc1ccc([C@@H]2[C@H](C)CCC[N@@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477785 1021458834 /nfs/dbraw/zinc/45/88/34/1021458834.db2.gz HVEYZHABZJGNCI-PBHICJAKSA-N 1 0 328.416 3.610 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000157905408 1021586992 /nfs/dbraw/zinc/58/69/92/1021586992.db2.gz PXAGZTZSMKBNNC-INIZCTEOSA-N 1 0 345.468 3.822 20 5 EHBDRO COc1ccc2c(c1)CC[N@@H+](Cc1ccc(C)c([N+](=O)[O-])c1)CC2 ZINC000439788477 1021717667 /nfs/dbraw/zinc/71/76/67/1021717667.db2.gz WJQKPHMLEWKTIH-UHFFFAOYSA-N 1 0 326.396 3.513 20 5 EHBDRO CC(C)(C)c1nc(CC[NH2+]CCc2ccc([N+](=O)[O-])cc2)cs1 ZINC000602580071 1032999322 /nfs/dbraw/zinc/99/93/22/1032999322.db2.gz MSYXJHKKIXKUQH-UHFFFAOYSA-N 1 0 333.457 3.724 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920827 1021819865 /nfs/dbraw/zinc/81/98/65/1021819865.db2.gz BWEJWJDXYGWFEP-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936242 1021949259 /nfs/dbraw/zinc/94/92/59/1021949259.db2.gz SGGMYLMGKVJXLQ-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1ccc(CN(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])nc1 ZINC000602646032 1033036449 /nfs/dbraw/zinc/03/64/49/1033036449.db2.gz PDZQQSNPAVKJCZ-UHFFFAOYSA-N 1 0 339.317 3.949 20 5 EHBDRO CCc1ccc(C(=O)NCCCC[N@@H+]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000471802842 1022281711 /nfs/dbraw/zinc/28/17/11/1022281711.db2.gz DCSYSHOUEJPKQS-HNNXBMFYSA-N 1 0 347.459 3.542 20 5 EHBDRO NC(=[NH2+])N(c1ccc(F)cc1)c1ccc(C(F)(F)F)c([N+](=O)[O-])c1 ZINC001167992548 1022312452 /nfs/dbraw/zinc/31/24/52/1022312452.db2.gz QBIKQEJMIBCENU-UHFFFAOYSA-N 1 0 342.252 3.784 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000543542255 1022509463 /nfs/dbraw/zinc/50/94/63/1022509463.db2.gz ITJBVRWROMDGQW-LPMFXHHGSA-N 1 0 326.396 3.946 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000438331420 1022555033 /nfs/dbraw/zinc/55/50/33/1022555033.db2.gz XUDHQJCCZPHXMF-MRXNPFEDSA-N 1 0 342.443 3.863 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)O1 ZINC000602690099 1033072165 /nfs/dbraw/zinc/07/21/65/1033072165.db2.gz LLQNFDORLKDHNZ-JFGNBEQYSA-N 1 0 332.322 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccnn3C3CCC3)C2)cc1 ZINC000894719945 1022790182 /nfs/dbraw/zinc/79/01/82/1022790182.db2.gz QYVIVXNNYSPANS-INIZCTEOSA-N 1 0 340.427 3.896 20 5 EHBDRO CC1(C)OCC[C@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602722069 1033088260 /nfs/dbraw/zinc/08/82/60/1033088260.db2.gz LTWCDNFTVYJTAX-LBPRGKRZSA-N 1 0 332.322 3.518 20 5 EHBDRO COc1ccc(OCC[N@@H+]2[C@H](C)C[C@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000441476438 1023096650 /nfs/dbraw/zinc/09/66/50/1023096650.db2.gz POUOFLFSBIRUEM-FMKPAKJESA-N 1 0 334.416 3.635 20 5 EHBDRO CN(Cc1c(Cl)cccc1[N+](=O)[O-])CC1(O)CCCCCC1 ZINC000426216322 1023108662 /nfs/dbraw/zinc/10/86/62/1023108662.db2.gz QGJOQPWTKZGMCS-UHFFFAOYSA-N 1 0 326.824 3.765 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000507174223 1023175329 /nfs/dbraw/zinc/17/53/29/1023175329.db2.gz CCSKOLXRZDRGNW-MRXNPFEDSA-N 1 0 326.396 3.901 20 5 EHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000507189954 1023181607 /nfs/dbraw/zinc/18/16/07/1023181607.db2.gz XHEQJTCKAAEKQM-QGZVFWFLSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@H](C)C1 ZINC000535799470 1023646617 /nfs/dbraw/zinc/64/66/17/1023646617.db2.gz QDNHRWUFFNRLCY-LSDHHAIUSA-N 1 0 342.443 3.863 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1COc2c(cccc2OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000610809842 1023700901 /nfs/dbraw/zinc/70/09/01/1023700901.db2.gz VNQRRPSWMYUKQS-RDJZCZTQSA-N 1 0 342.395 3.648 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000610809814 1023701262 /nfs/dbraw/zinc/70/12/62/1023701262.db2.gz LUZCWPXXQLFFGF-CJNGLKHVSA-N 1 0 342.395 3.566 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(Nc2cccc(CC[N@@H+](C)C3CC3)c2)n1 ZINC000538137228 1023845678 /nfs/dbraw/zinc/84/56/78/1023845678.db2.gz ZYKPQJBMSROULN-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000610997466 1024018386 /nfs/dbraw/zinc/01/83/86/1024018386.db2.gz TTZIOQFXLQUOMW-AWEZNQCLSA-N 1 0 334.416 3.711 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1ccc(F)cc1)C1CC1 ZINC000522660599 1024162764 /nfs/dbraw/zinc/16/27/64/1024162764.db2.gz FBFKVJCQOCGTET-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO C[NH+](C)CC[C@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000895319937 1024283269 /nfs/dbraw/zinc/28/32/69/1024283269.db2.gz KEUBWPUNEUDKKN-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO CC(=O)NC1CCC([N@@H+](C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000346275631 1024566366 /nfs/dbraw/zinc/56/63/66/1024566366.db2.gz QSAZQMGUSLLJJX-UHFFFAOYSA-N 1 0 347.459 3.597 20 5 EHBDRO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CCCCO1 ZINC000435057618 1024586543 /nfs/dbraw/zinc/58/65/43/1024586543.db2.gz QEWHBKSHKKXRQG-AWEZNQCLSA-N 1 0 333.388 3.517 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000514593750 1024594546 /nfs/dbraw/zinc/59/45/46/1024594546.db2.gz WZFRMRCDGNZVRG-GOSISDBHSA-N 1 0 344.411 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000514626286 1024617251 /nfs/dbraw/zinc/61/72/51/1024617251.db2.gz IRIOUENAPBCGMR-GOSISDBHSA-N 1 0 329.375 3.983 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000342298994 1024756862 /nfs/dbraw/zinc/75/68/62/1024756862.db2.gz YYNQXKDLSMSETD-HNNXBMFYSA-N 1 0 347.802 3.928 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCOc1c(C)cccc1C ZINC000507912163 1024763171 /nfs/dbraw/zinc/76/31/71/1024763171.db2.gz FGPQUIIACNDRJR-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1cc([C@H](C)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)ccn1 ZINC000342297948 1024765153 /nfs/dbraw/zinc/76/51/53/1024765153.db2.gz KJZNWLYNGGQFOH-ZDUSSCGKSA-N 1 0 329.400 3.973 20 5 EHBDRO C[NH2+]C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435375543 1024843187 /nfs/dbraw/zinc/84/31/87/1024843187.db2.gz NBAATNSQDUWYJW-GFCCVEGCSA-N 1 0 349.818 3.550 20 5 EHBDRO Cc1nn(C)cc1[C@@H](C)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000179139917 1033240598 /nfs/dbraw/zinc/24/05/98/1033240598.db2.gz QSXLGQPTBGGAEI-SIIHOXLZSA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000425368573 1024882886 /nfs/dbraw/zinc/88/28/86/1024882886.db2.gz FDTPUMWNZKDBSX-GOSISDBHSA-N 1 0 330.428 3.684 20 5 EHBDRO C[NH+](C)CC[C@@H](Nc1ccc(Cl)cc1[N+](=O)[O-])c1cccnc1 ZINC000895890109 1024945805 /nfs/dbraw/zinc/94/58/05/1024945805.db2.gz DAJOGDGEQJXCAK-CQSZACIVSA-N 1 0 334.807 3.748 20 5 EHBDRO O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)Nc1cccc([N+](=O)[O-])c1 ZINC000435770332 1025130871 /nfs/dbraw/zinc/13/08/71/1025130871.db2.gz OOTRCWJKKQQPSE-KRWDZBQOSA-N 1 0 346.431 3.513 20 5 EHBDRO COc1ccc(CCC[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000072014210 1025147332 /nfs/dbraw/zinc/14/73/32/1025147332.db2.gz HCGYSIHGCGLINC-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO CCC1CCC([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000444026936 1025187662 /nfs/dbraw/zinc/18/76/62/1025187662.db2.gz ADIMLZJDWIAJKS-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000119795931 1025219827 /nfs/dbraw/zinc/21/98/27/1025219827.db2.gz DOAFZFYLOVCCMU-AWEZNQCLSA-N 1 0 339.823 3.745 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCOC(F)(F)F)c2ccccc2)c1 ZINC000474031642 1025251759 /nfs/dbraw/zinc/25/17/59/1025251759.db2.gz MPUHRBJEIHBWMK-HNNXBMFYSA-N 1 0 340.301 3.810 20 5 EHBDRO Cc1ccc(CN(CC[NH+](C)C)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000521317912 1025326217 /nfs/dbraw/zinc/32/62/17/1025326217.db2.gz DUJFTKKEEOOFPC-UHFFFAOYSA-N 1 0 345.418 3.606 20 5 EHBDRO COc1ccc([C@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000521480041 1025405802 /nfs/dbraw/zinc/40/58/02/1025405802.db2.gz DVWJZUWKYALKGN-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO CC(C)OC(=O)C[C@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000185583007 1025442240 /nfs/dbraw/zinc/44/22/40/1025442240.db2.gz DQXYVPNYDFFAQC-YXMGTMDOSA-N 1 0 346.427 3.662 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451107425 1025539645 /nfs/dbraw/zinc/53/96/45/1025539645.db2.gz RJXKHOPTNWCEMH-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@]2(CO)CCCc3ccccc32)ccc1Cl ZINC000281840460 1025562725 /nfs/dbraw/zinc/56/27/25/1025562725.db2.gz YKPWDRANDVJEIK-GOSISDBHSA-N 1 0 346.814 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCCC[C@H]([NH+]4CCCC4)C3)ccc2c1 ZINC000521664974 1025583422 /nfs/dbraw/zinc/58/34/22/1025583422.db2.gz HJQCLLAXIFPQGD-KRWDZBQOSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1)N(C)C ZINC000442997124 1025639651 /nfs/dbraw/zinc/63/96/51/1025639651.db2.gz YZNSVQYINLHLBN-HNAYVOBHSA-N 1 0 327.428 3.684 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])OC(C)C ZINC000185720665 1025691352 /nfs/dbraw/zinc/69/13/52/1025691352.db2.gz SAMMCZRADIDHIP-LJQANCHMSA-N 1 0 344.411 3.859 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H]1NC(=O)c1cc2ccccc2c2cccnc12 ZINC000684845591 1026054252 /nfs/dbraw/zinc/05/42/52/1026054252.db2.gz OOVNRKZLQNXKMR-RTBURBONSA-N 1 0 333.435 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCCCn3cccn3)C2)cc1 ZINC000451550141 1026101285 /nfs/dbraw/zinc/10/12/85/1026101285.db2.gz RHBUAXUIUJXKOE-GOSISDBHSA-N 1 0 342.443 3.841 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](CO)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000516208275 1026138171 /nfs/dbraw/zinc/13/81/71/1026138171.db2.gz LIYKCSUHLXPHJN-QGZVFWFLSA-N 1 0 332.375 3.681 20 5 EHBDRO C[C@@H](NCc1cc(COC(C)(C)C)on1)c1ccc([N+](=O)[O-])cc1 ZINC000186063286 1026205524 /nfs/dbraw/zinc/20/55/24/1026205524.db2.gz LLXNAFGAXWACSN-GFCCVEGCSA-N 1 0 333.388 3.749 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141482 1026234617 /nfs/dbraw/zinc/23/46/17/1026234617.db2.gz WCQGTNDXSBZOFG-ICEKFOEVSA-N 1 0 340.423 3.798 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC2CCN(c3ccccc3)CC2)c1 ZINC000475291271 1026446518 /nfs/dbraw/zinc/44/65/18/1026446518.db2.gz NWDDLSUHWNCGGB-UHFFFAOYSA-N 1 0 325.412 3.601 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000452074974 1026464340 /nfs/dbraw/zinc/46/43/40/1026464340.db2.gz BKEKHZNAJPECQP-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2Cc2ccccc2)cc1 ZINC000520059636 1026712677 /nfs/dbraw/zinc/71/26/77/1026712677.db2.gz YWPAAMDCLTYHFG-GOSISDBHSA-N 1 0 326.396 3.681 20 5 EHBDRO C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@H]1CCCN(c2ccccc2)C1 ZINC000531379275 1026844709 /nfs/dbraw/zinc/84/47/09/1026844709.db2.gz ZOHWILYIOYCHLE-IBGZPJMESA-N 1 0 325.412 3.696 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Cn2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178642374 1026998537 /nfs/dbraw/zinc/99/85/37/1026998537.db2.gz IHQRABPFXINXCM-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO CC(C)[C@@H](c1ccccc1Cl)[N@H+](C)CCn1cc([N+](=O)[O-])cn1 ZINC000472247233 1027034489 /nfs/dbraw/zinc/03/44/89/1027034489.db2.gz CKRJVOTVOGVBIR-INIZCTEOSA-N 1 0 336.823 3.774 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)C1 ZINC000310510721 1027052495 /nfs/dbraw/zinc/05/24/95/1027052495.db2.gz DHYUNJJBSDRJNN-HUUCEWRRSA-N 1 0 349.431 3.520 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC(C(F)F)CC1 ZINC000419789414 1027192276 /nfs/dbraw/zinc/19/22/76/1027192276.db2.gz RNTWNOLKYZQJMB-UHFFFAOYSA-N 1 0 328.359 3.907 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](Cc1ccccc1)CN(C)C ZINC000531684223 1027211049 /nfs/dbraw/zinc/21/10/49/1027211049.db2.gz FBWYMNPZZCHQKR-AEFFLSMTSA-N 1 0 341.455 3.727 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000413172858 1027210958 /nfs/dbraw/zinc/21/09/58/1027210958.db2.gz GCZXUORFIXRFPA-HIFRSBDPSA-N 1 0 344.390 3.594 20 5 EHBDRO [NH3+]C1C[C@H]2CC[C@@H](C1)C2Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000420294950 1027435390 /nfs/dbraw/zinc/43/53/90/1027435390.db2.gz ZZFXBNONIJIIBB-HZNSRWLBSA-N 1 0 329.322 3.541 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000323832338 1027464695 /nfs/dbraw/zinc/46/46/95/1027464695.db2.gz IHIBYFHFRUWGNA-OALUTQOASA-N 1 0 327.428 3.938 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1OCC[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783597568 1027600596 /nfs/dbraw/zinc/60/05/96/1027600596.db2.gz TWHRJGOLANLOIW-WBMJQRKESA-N 1 0 326.824 3.933 20 5 EHBDRO C[C@]1(O)C[NH2+][C@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211936009 1027603758 /nfs/dbraw/zinc/60/37/58/1027603758.db2.gz XWZMSCUIVYOREO-GHTZIAJQSA-N 1 0 345.402 3.828 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccccc2F)C2CCCCC2)c1 ZINC000472257224 1027619796 /nfs/dbraw/zinc/61/97/96/1027619796.db2.gz MEHSKJNNKQDTSW-UHFFFAOYSA-N 1 0 346.406 3.765 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CNC1CC([NH+]2CCCCC2)C1 ZINC000475576817 1027681260 /nfs/dbraw/zinc/68/12/60/1027681260.db2.gz XZEBNIUHORZWEV-XNTDXEJSSA-N 1 0 329.444 3.605 20 5 EHBDRO CC(C)(C)[C@@H](Cn1ccnc1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000783598631 1027721351 /nfs/dbraw/zinc/72/13/51/1027721351.db2.gz MMXLLPNWDGNMOP-OAHLLOKOSA-N 1 0 336.823 3.649 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]CC2(c3ccccc3)CCCC2)c1 ZINC000016849075 1027785869 /nfs/dbraw/zinc/78/58/69/1027785869.db2.gz QYIXIGQINWZTLH-IBGZPJMESA-N 1 0 340.423 3.730 20 5 EHBDRO CN(CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1Cl ZINC000503570834 1027909484 /nfs/dbraw/zinc/90/94/84/1027909484.db2.gz KSMRMFZBXUVKOF-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+]([C@H]3CCCc4ccccc43)CC2)n1 ZINC000366743546 1027956984 /nfs/dbraw/zinc/95/69/84/1027956984.db2.gz GHBMCSSJKIWHSO-KRWDZBQOSA-N 1 0 326.400 3.506 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCC[C@H]1c1cccc2ccccc21 ZINC000362854135 1028028090 /nfs/dbraw/zinc/02/80/90/1028028090.db2.gz WQXUIDRZVJUJBF-KRWDZBQOSA-N 1 0 336.395 3.819 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)CC1(c2ccccc2)CC1 ZINC000444686752 1028133645 /nfs/dbraw/zinc/13/36/45/1028133645.db2.gz TVQCSESQUFSQTA-UHFFFAOYSA-N 1 0 336.395 3.635 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C(C)C)C1CCCCC1 ZINC000532694050 1028207460 /nfs/dbraw/zinc/20/74/60/1028207460.db2.gz NMXVCHXMVOYDEP-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H]1OC(F)F ZINC000503943999 1028246993 /nfs/dbraw/zinc/24/69/93/1028246993.db2.gz YAMLWDRBEJJSNY-NJZAAPMLSA-N 1 0 328.359 3.666 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444774634 1028264496 /nfs/dbraw/zinc/26/44/96/1028264496.db2.gz XIPOTSPPRPLUJG-CABCVRRESA-N 1 0 333.432 3.598 20 5 EHBDRO CCCC[C@@H](C[NH3+])N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423304400 1028358204 /nfs/dbraw/zinc/35/82/04/1028358204.db2.gz YRAHKPJFUVAIAG-HKUYNNGSSA-N 1 0 327.428 3.791 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000421388719 1028361631 /nfs/dbraw/zinc/36/16/31/1028361631.db2.gz QIYPNNHPEJKNDD-GDBMZVCRSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc(C[NH+](C)C)cc2C)cc([N+](=O)[O-])c1 ZINC000909612045 1028392743 /nfs/dbraw/zinc/39/27/43/1028392743.db2.gz CIENKLISBLEKPJ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCc1ccc([C@H](N[C@@H]2CC[NH2+][C@@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423391994 1028405517 /nfs/dbraw/zinc/40/55/17/1028405517.db2.gz XGKVZPGMNQXDAP-ZBQZNYHESA-N 1 0 343.427 3.570 20 5 EHBDRO C[C@@H](CO)[C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000077423179 1028484527 /nfs/dbraw/zinc/48/45/27/1028484527.db2.gz RPAXQPVNVIJCBL-QWRGUYRKSA-N 1 0 338.791 3.615 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CC[C@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513804 1028490148 /nfs/dbraw/zinc/49/01/48/1028490148.db2.gz RNQSIBIAACHOPK-ZUEVXXBESA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3cc([N+](=O)[O-])ccc3OC)C2)cc1 ZINC000504521290 1028709464 /nfs/dbraw/zinc/70/94/64/1028709464.db2.gz KECRQWJUEYAWFG-OAHLLOKOSA-N 1 0 342.395 3.602 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000074994028 1028777823 /nfs/dbraw/zinc/77/78/23/1028777823.db2.gz KOFXMAHYUWMVHJ-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000524221852 1028994131 /nfs/dbraw/zinc/99/41/31/1028994131.db2.gz NKXUIVQVXQGKEV-LLVKDONJSA-N 1 0 342.237 3.644 20 5 EHBDRO CCOc1ccc([C@H](C)NCC2([NH+](C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000504911513 1029052869 /nfs/dbraw/zinc/05/28/69/1029052869.db2.gz HOMWCUQRJSRJMQ-HNNXBMFYSA-N 1 0 349.475 3.909 20 5 EHBDRO O=C(CC[N@@H+]1CCCC2(CCCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000615000544 1029236848 /nfs/dbraw/zinc/23/68/48/1029236848.db2.gz UWWUCZNAQYLIDI-UHFFFAOYSA-N 1 0 331.416 3.580 20 5 EHBDRO CC(C)[C@@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000533247934 1029524275 /nfs/dbraw/zinc/52/42/75/1029524275.db2.gz WZPCOCSTAQVODS-INIZCTEOSA-N 1 0 329.400 3.913 20 5 EHBDRO CC[C@@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533299916 1029602959 /nfs/dbraw/zinc/60/29/59/1029602959.db2.gz QZJWCCHTONFXCT-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO Nc1ccc2c(c1)CCC[C@@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841059219 1029716829 /nfs/dbraw/zinc/71/68/29/1029716829.db2.gz NKXIQNYIEXCQFD-INIZCTEOSA-N 1 0 331.803 3.998 20 5 EHBDRO Cc1ccc(C[NH2+]C2(c3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000525183425 1029732339 /nfs/dbraw/zinc/73/23/39/1029732339.db2.gz KPQPPTPHDCULTJ-UHFFFAOYSA-N 1 0 326.396 3.699 20 5 EHBDRO C[C@H]1CCN(Cc2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000525268989 1029776530 /nfs/dbraw/zinc/77/65/30/1029776530.db2.gz CABIVGVJMHDWAW-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc4ccccc4c3)nc2c1 ZINC000446854862 1029833899 /nfs/dbraw/zinc/83/38/99/1029833899.db2.gz CUSKCOJFHGOLHK-UHFFFAOYSA-N 1 0 332.363 3.914 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H]3CCO)s2)cc1 ZINC000428462391 1029874480 /nfs/dbraw/zinc/87/44/80/1029874480.db2.gz SWQAFTIYYGJZEB-CQSZACIVSA-N 1 0 332.425 3.670 20 5 EHBDRO CC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1C ZINC000441182331 1029881182 /nfs/dbraw/zinc/88/11/82/1029881182.db2.gz UIIDVNYAMBOXBT-UHFFFAOYSA-N 1 0 344.411 3.813 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H](CCCc3ccccc3)C2)c1 ZINC000441190799 1029918120 /nfs/dbraw/zinc/91/81/20/1029918120.db2.gz SGQOSAWMEHSUGJ-SFHVURJKSA-N 1 0 342.443 3.526 20 5 EHBDRO C[C@H](CCO)CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453230095 1029950959 /nfs/dbraw/zinc/95/09/59/1029950959.db2.gz GTUAFMUDTLAUMS-HNAYVOBHSA-N 1 0 328.412 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCOC3(CCC3)C1)CCC2 ZINC000453308525 1030079249 /nfs/dbraw/zinc/07/92/49/1030079249.db2.gz CQYAHZQDBMGJPG-KBXCAEBGSA-N 1 0 330.428 3.911 20 5 EHBDRO CCC[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000441243271 1030087783 /nfs/dbraw/zinc/08/77/83/1030087783.db2.gz HHFKFQJRYVYSLW-UHFFFAOYSA-N 1 0 344.411 3.894 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441266382 1030217550 /nfs/dbraw/zinc/21/75/50/1030217550.db2.gz UJVYFWWKWVJMMM-KRWDZBQOSA-N 1 0 339.439 3.782 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@@H]2C[C@H]2C2CCCCC2)n1 ZINC000447586431 1030320291 /nfs/dbraw/zinc/32/02/91/1030320291.db2.gz NTUREXGMFUQJFW-MWDXBVQZSA-N 1 0 332.448 3.833 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1F ZINC000593064783 1030352726 /nfs/dbraw/zinc/35/27/26/1030352726.db2.gz PDMROAVNMFOXHF-INIZCTEOSA-N 1 0 345.374 3.722 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[C@@H]2O)s1 ZINC000453622968 1030414087 /nfs/dbraw/zinc/41/40/87/1030414087.db2.gz BDCLSDPTMGLJOF-WBMJQRKESA-N 1 0 332.425 3.574 20 5 EHBDRO C[C@@H](CC[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729483 1030441474 /nfs/dbraw/zinc/44/14/74/1030441474.db2.gz NWROGQFDYQHODM-RDJZCZTQSA-N 1 0 340.427 3.670 20 5 EHBDRO CN(C)c1cccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c1 ZINC000537659799 1030914711 /nfs/dbraw/zinc/91/47/11/1030914711.db2.gz RHTRPGLZJITJGS-YFHOEESVSA-N 1 0 325.412 3.806 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000448368405 1031017358 /nfs/dbraw/zinc/01/73/58/1031017358.db2.gz UUHUZWZUHKMIIL-HUUCEWRRSA-N 1 0 344.411 3.980 20 5 EHBDRO C[C@H](O)[C@](C)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000249293666 1031111187 /nfs/dbraw/zinc/11/11/87/1031111187.db2.gz BOHZMKUVXSHKGZ-FTRWYGJKSA-N 1 0 342.439 3.875 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000483739117 1031311767 /nfs/dbraw/zinc/31/17/67/1031311767.db2.gz CNJNKXBZSYVKRX-UONOGXRCSA-N 1 0 333.432 3.870 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C12CCC2 ZINC000483742198 1031312177 /nfs/dbraw/zinc/31/21/77/1031312177.db2.gz JFGRTQCXHALQGF-BHIYHBOVSA-N 1 0 344.455 3.853 20 5 EHBDRO CC[C@H](N[C@@H]1CC[N@H+](CC2CCCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000483807239 1031342649 /nfs/dbraw/zinc/34/26/49/1031342649.db2.gz LZSWMABKDKUVPZ-MJGOQNOKSA-N 1 0 331.460 3.900 20 5 EHBDRO COc1ncc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1Cl ZINC000551785751 1031655868 /nfs/dbraw/zinc/65/58/68/1031655868.db2.gz LBKGWGNPYRKQPF-NSHDSACASA-N 1 0 335.791 3.545 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@H]1c1ccsc1)Nc1ccccc1[N+](=O)[O-] ZINC000052803845 1031699090 /nfs/dbraw/zinc/69/90/90/1031699090.db2.gz RQYSBNHQSMCTJP-HNNXBMFYSA-N 1 0 345.424 3.822 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000475737446 1031721081 /nfs/dbraw/zinc/72/10/81/1031721081.db2.gz ZYZPVWRETIBIAB-GOSISDBHSA-N 1 0 328.412 3.593 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@@H]34)s2)cc1 ZINC000249991016 1033305056 /nfs/dbraw/zinc/30/50/56/1033305056.db2.gz ZUNOSBVKTMFHBL-BBWFWOEESA-N 1 0 344.436 3.980 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(CN3CC(CC4CC4)C3)cs2)c1 ZINC000598678789 1033378029 /nfs/dbraw/zinc/37/80/29/1033378029.db2.gz UMCZNBXZHIKNOH-UHFFFAOYSA-N 1 0 329.425 3.950 20 5 EHBDRO Cc1cnc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c(C)c1 ZINC000594510008 1033415384 /nfs/dbraw/zinc/41/53/84/1033415384.db2.gz MSFMPVOWIWDGIV-IBGZPJMESA-N 1 0 325.412 3.816 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C(=O)OC(C)(C)C ZINC000594513102 1033418154 /nfs/dbraw/zinc/41/81/54/1033418154.db2.gz BDPQCLYWJIJMJC-XXYUJHKVSA-N 1 0 334.416 3.566 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)ccc2ncccc21 ZINC000594598795 1033445939 /nfs/dbraw/zinc/44/59/39/1033445939.db2.gz HYBMALIREUWTBL-WBVHZDCISA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583490 1033574111 /nfs/dbraw/zinc/57/41/11/1033574111.db2.gz KKHBVVLBNFZYOE-NVXWUHKLSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000594977983 1033581575 /nfs/dbraw/zinc/58/15/75/1033581575.db2.gz PGAQYJMMUXDPCX-BQLWYNFJSA-N 1 0 329.444 3.605 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000594936928 1033585469 /nfs/dbraw/zinc/58/54/69/1033585469.db2.gz YCSNGXBBSBXQGJ-PBHICJAKSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023878 1033617091 /nfs/dbraw/zinc/61/70/91/1033617091.db2.gz ZDYMKGXOENHQBS-JKSUJKDBSA-N 1 0 349.475 3.622 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CO[C@@H](C3CC3)C2)o1 ZINC000599006855 1033641988 /nfs/dbraw/zinc/64/19/88/1033641988.db2.gz LNXHIIRFKQMHOX-FZKQIMNGSA-N 1 0 328.368 3.512 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595069810 1033647149 /nfs/dbraw/zinc/64/71/49/1033647149.db2.gz SGRBXTQTUJZJGD-KUHUBIRLSA-N 1 0 344.411 3.950 20 5 EHBDRO CCc1cnccc1[C@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595029587 1033650931 /nfs/dbraw/zinc/65/09/31/1033650931.db2.gz ZREGFAXQTFPQSW-STQMWFEESA-N 1 0 329.400 3.973 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599023697 1033651119 /nfs/dbraw/zinc/65/11/19/1033651119.db2.gz JUZSGJIJHNDSEI-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)C1CCOCC1 ZINC000593665403 1033665772 /nfs/dbraw/zinc/66/57/72/1033665772.db2.gz BYHTWSNQICSVJQ-LIRRHRJNSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000599044667 1033673145 /nfs/dbraw/zinc/67/31/45/1033673145.db2.gz RYDJUNZYWTUKPW-HZMBPMFUSA-N 1 0 332.322 3.661 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000599073559 1033713793 /nfs/dbraw/zinc/71/37/93/1033713793.db2.gz KDKIHOYVMLLXSO-CRAIPNDOSA-N 1 0 331.460 3.522 20 5 EHBDRO C[C@@H](COCC1CC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000593682580 1033753379 /nfs/dbraw/zinc/75/33/79/1033753379.db2.gz WEYFWKKHPRRIDQ-ZDUSSCGKSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000595418030 1033793031 /nfs/dbraw/zinc/79/30/31/1033793031.db2.gz NHOLPJJANCZFDK-MAUKXSAKSA-N 1 0 330.359 3.601 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000595419293 1033793354 /nfs/dbraw/zinc/79/33/54/1033793354.db2.gz KDVWPSDHBQVCGR-KDOFPFPSSA-N 1 0 344.386 3.991 20 5 EHBDRO C[C@@H](CCO)[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694702 1033804122 /nfs/dbraw/zinc/80/41/22/1033804122.db2.gz QGXVPDLDYFUOPN-ZDUSSCGKSA-N 1 0 348.374 3.729 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCC[C@@H]2CCO)c2ccccc2)c1 ZINC000188027267 1033807142 /nfs/dbraw/zinc/80/71/42/1033807142.db2.gz VPDMOKMWYWYCRC-UIAACRFSSA-N 1 0 340.423 3.825 20 5 EHBDRO CC[C@@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000593714896 1033821030 /nfs/dbraw/zinc/82/10/30/1033821030.db2.gz GBKGSKTWQIAMQW-UXHICEINSA-N 1 0 340.423 3.512 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@H]1c1ccccc1 ZINC000550704417 1033894408 /nfs/dbraw/zinc/89/44/08/1033894408.db2.gz XKSPOEQZIJADTE-ICSRJNTNSA-N 1 0 339.439 3.562 20 5 EHBDRO O=C(CC[NH+]1CCC2(CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000608833520 1033908852 /nfs/dbraw/zinc/90/88/52/1033908852.db2.gz MQUPOIBSEYAYMQ-UHFFFAOYSA-N 1 0 345.443 3.970 20 5 EHBDRO COc1ccc(OC2CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000603854782 1033979288 /nfs/dbraw/zinc/97/92/88/1033979288.db2.gz KPHGOHUCXWAGJH-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H]2CCCCO2)CC1 ZINC000595787977 1033998395 /nfs/dbraw/zinc/99/83/95/1033998395.db2.gz LFXILHHOWDVJLE-SFHVURJKSA-N 1 0 348.443 3.775 20 5 EHBDRO COCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)cc1C ZINC000603895113 1034003806 /nfs/dbraw/zinc/00/38/06/1034003806.db2.gz RKMOAIPZQZAVGD-UHFFFAOYSA-N 1 0 328.412 3.860 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCC(C[NH+]3CCCC3)CC2)c1 ZINC000171139430 1034138710 /nfs/dbraw/zinc/13/87/10/1034138710.db2.gz SSLGOQJONHQBIZ-UHFFFAOYSA-N 1 0 337.851 3.556 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000596308808 1034163115 /nfs/dbraw/zinc/16/31/15/1034163115.db2.gz VWEHPJJDYSRUHH-JTQLQIEISA-N 1 0 346.353 3.541 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000179424323 1034296960 /nfs/dbraw/zinc/29/69/60/1034296960.db2.gz MIYYSKNJWVPKIO-GFCCVEGCSA-N 1 0 331.441 3.823 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])nc2)[C@@H]1c1ccc(Cl)cc1 ZINC000450413163 1034298991 /nfs/dbraw/zinc/29/89/91/1034298991.db2.gz SNTUGSTUYGHHCY-ZBFHGGJFSA-N 1 0 332.791 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484498 1034388264 /nfs/dbraw/zinc/38/82/64/1034388264.db2.gz XRGADLLIOPOVLK-LJQANCHMSA-N 1 0 342.395 3.906 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600319 1034552114 /nfs/dbraw/zinc/55/21/14/1034552114.db2.gz NGSUKYRUVHZTSN-MGPUTAFESA-N 1 0 340.423 3.724 20 5 EHBDRO CCC[N@@H+](CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC000060495473 1034600723 /nfs/dbraw/zinc/60/07/23/1034600723.db2.gz SMUHEMDGQXWSID-UHFFFAOYSA-N 1 0 347.459 3.850 20 5 EHBDRO Cc1cc(N2CCC(OCC3CC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000364663190 1034728111 /nfs/dbraw/zinc/72/81/11/1034728111.db2.gz UXFKAYBPKMZMOM-UHFFFAOYSA-N 1 0 341.411 3.847 20 5 EHBDRO COc1cc(C[NH2+]CCCF)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000136505557 1034798652 /nfs/dbraw/zinc/79/86/52/1034798652.db2.gz XAFOKZMNWJKVJO-UHFFFAOYSA-N 1 0 348.374 3.632 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000172258408 1034870215 /nfs/dbraw/zinc/87/02/15/1034870215.db2.gz PQSCDTCUBQTESB-LJQANCHMSA-N 1 0 344.386 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593289 1035084206 /nfs/dbraw/zinc/08/42/06/1035084206.db2.gz ZMXSRVXWQQCWNQ-CRAIPNDOSA-N 1 0 348.349 3.883 20 5 EHBDRO C[C@@H]1CC[C@@H]([N@H+](CCO)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000580922882 1035462986 /nfs/dbraw/zinc/46/29/86/1035462986.db2.gz GDFGLRSNFKFCJM-HUUCEWRRSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@@H]3CCO[C@H]3C13CCC3)CCC2 ZINC000248753910 1035536275 /nfs/dbraw/zinc/53/62/75/1035536275.db2.gz CHCJRZSZSMLRPZ-DZOHQFGASA-N 1 0 328.412 3.519 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CSC[C@@H]1C ZINC000571528592 1035545321 /nfs/dbraw/zinc/54/53/21/1035545321.db2.gz YSVKVPSZRMFLAC-YNEHKIRRSA-N 1 0 326.487 3.807 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cn1 ZINC000156680662 1035586148 /nfs/dbraw/zinc/58/61/48/1035586148.db2.gz CUPFSVKKBXKUHA-CQSZACIVSA-N 1 0 329.400 3.938 20 5 EHBDRO C[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCCO1 ZINC000271984688 1035634759 /nfs/dbraw/zinc/63/47/59/1035634759.db2.gz KMMXGIUVCSRALF-LRDDRELGSA-N 1 0 347.440 3.766 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000588216023 1035826203 /nfs/dbraw/zinc/82/62/03/1035826203.db2.gz KJGKWWFZZYIOPU-UHFFFAOYSA-N 1 0 328.359 3.873 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000588232721 1035833041 /nfs/dbraw/zinc/83/30/41/1035833041.db2.gz YYWYVAXISQSRRE-IUODEOHRSA-N 1 0 334.803 3.675 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3)[C@@H]3CCC[C@@H]32)c1[N+](=O)[O-] ZINC000595489384 1035848221 /nfs/dbraw/zinc/84/82/21/1035848221.db2.gz ABBHJUKMPPXTFV-XHSDSOJGSA-N 1 0 327.384 3.659 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[NH+]1[C@@H](C)CCC[C@@H]1C ZINC000443946456 1035883923 /nfs/dbraw/zinc/88/39/23/1035883923.db2.gz LXOKJWJVWMIDIR-KBPBESRZSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCCOc3cc(F)ccc32)cc1 ZINC000540990518 1035886786 /nfs/dbraw/zinc/88/67/86/1035886786.db2.gz RHRWNOMWNZXUBH-QGZVFWFLSA-N 1 0 346.358 3.616 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+][C@@H]2C[C@H]2c2ccccc2F)n1 ZINC000414186670 1035964564 /nfs/dbraw/zinc/96/45/64/1035964564.db2.gz PZNFZNUCMYOYDV-SVGFKBNWSA-N 1 0 344.390 3.560 20 5 EHBDRO COCC[C@H](C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000414213301 1036092894 /nfs/dbraw/zinc/09/28/94/1036092894.db2.gz XXFWZPAZKPUZFZ-HNAYVOBHSA-N 1 0 328.412 3.946 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492660033 1036152673 /nfs/dbraw/zinc/15/26/73/1036152673.db2.gz XWNLNJKYVKFKBM-QGZVFWFLSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(N)ccc21 ZINC000594738161 1036233734 /nfs/dbraw/zinc/23/37/34/1036233734.db2.gz BCDHIPREQBYIIF-SCLBCKFNSA-N 1 0 325.412 3.775 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589110888 1036256642 /nfs/dbraw/zinc/25/66/42/1036256642.db2.gz OYADUEDEZYTIQZ-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@H]1CCOc2ccccc21 ZINC000589185021 1036296154 /nfs/dbraw/zinc/29/61/54/1036296154.db2.gz MMLZJDFXJCFUHO-MRXNPFEDSA-N 1 0 326.396 3.635 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@H](C3CC3)C2)c1 ZINC000589209852 1036312538 /nfs/dbraw/zinc/31/25/38/1036312538.db2.gz UXBLHMJHNNYWDG-GFCCVEGCSA-N 1 0 326.343 3.818 20 5 EHBDRO CCCC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CCC1 ZINC000541593966 1036478651 /nfs/dbraw/zinc/47/86/51/1036478651.db2.gz KEIRFBLHRWHHLJ-KRWDZBQOSA-N 1 0 333.432 3.790 20 5 EHBDRO CC[NH+](CC)CCOc1ccccc1CNc1ccc([N+](=O)[O-])s1 ZINC000589559705 1036524079 /nfs/dbraw/zinc/52/40/79/1036524079.db2.gz ZUTNWZAPCSMEQX-UHFFFAOYSA-N 1 0 349.456 3.989 20 5 EHBDRO CCCC[N@H+](C)C[C@@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000589598916 1036564352 /nfs/dbraw/zinc/56/43/52/1036564352.db2.gz GURTZHJZPIBFGR-SNVBAGLBSA-N 1 0 334.342 3.541 20 5 EHBDRO Cc1cc(C)cc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180396862 1036771162 /nfs/dbraw/zinc/77/11/62/1036771162.db2.gz XNYIIEWCXRWNQQ-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000180396919 1036772674 /nfs/dbraw/zinc/77/26/74/1036772674.db2.gz ZWARRULMMWBKEK-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000464838371 1036855852 /nfs/dbraw/zinc/85/58/52/1036855852.db2.gz VLLSUFCBEVSJAC-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO CCOc1cccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831178 1036912813 /nfs/dbraw/zinc/91/28/13/1036912813.db2.gz YXIIDBRCVPPYJT-MRXNPFEDSA-N 1 0 341.411 3.680 20 5 EHBDRO COc1ccc(CCC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000761524075 1037091208 /nfs/dbraw/zinc/09/12/08/1037091208.db2.gz SYQFTGMGZTWYQD-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2cccc(F)c2F)cc1Cl ZINC000761519778 1037097629 /nfs/dbraw/zinc/09/76/29/1037097629.db2.gz IKWCGGLTMUPKMU-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N(C)Cc1ccccc1 ZINC000761527956 1037104050 /nfs/dbraw/zinc/10/40/50/1037104050.db2.gz VLERBTQVPCOXTE-CQSZACIVSA-N 1 0 347.846 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2[C@@H]3Cc4ccccc4[C@H]23)cc1Cl ZINC000761528209 1037104093 /nfs/dbraw/zinc/10/40/93/1037104093.db2.gz OSWWPFWOTWCLQM-DAYGRLMNSA-N 1 0 328.799 3.924 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000057877840 1037238951 /nfs/dbraw/zinc/23/89/51/1037238951.db2.gz AWFBCLSXRIZUBW-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO CN(Cc1cccc([N+](=O)[O-])c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109834 1037324877 /nfs/dbraw/zinc/32/48/77/1037324877.db2.gz WRKRLLLLXQNTMD-LJQANCHMSA-N 1 0 339.439 3.549 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)n1 ZINC000311066170 1037334309 /nfs/dbraw/zinc/33/43/09/1037334309.db2.gz YDKDFSJKEDCVDQ-KRWDZBQOSA-N 1 0 340.427 3.622 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163411163 1037393434 /nfs/dbraw/zinc/39/34/34/1037393434.db2.gz XTSAZFUQMBCSMZ-SWLSCSKDSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@](C)(OC)C1CC1 ZINC000462807045 1037426265 /nfs/dbraw/zinc/42/62/65/1037426265.db2.gz KZVGYELDVYRAKT-YOEHRIQHSA-N 1 0 338.473 3.870 20 5 EHBDRO C=Cc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000462819378 1037441953 /nfs/dbraw/zinc/44/19/53/1037441953.db2.gz LVYWFZAXJVFUBL-ROUUACIJSA-N 1 0 340.427 3.750 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000462862131 1037485769 /nfs/dbraw/zinc/48/57/69/1037485769.db2.gz LMAQECXBLITDOQ-YPMHNXCESA-N 1 0 345.365 3.780 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000462914713 1037545639 /nfs/dbraw/zinc/54/56/39/1037545639.db2.gz YRUMRGYDDTXTGG-MRXNPFEDSA-N 1 0 343.402 3.658 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@@H]34)o2)cc1 ZINC000249845511 1037692130 /nfs/dbraw/zinc/69/21/30/1037692130.db2.gz OIRLCRDVXGEPKW-JZXOWHBKSA-N 1 0 328.368 3.512 20 5 EHBDRO Cc1ccncc1CCC[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000290463594 1037698176 /nfs/dbraw/zinc/69/81/76/1037698176.db2.gz UHQGLBFBXJOWGS-UHFFFAOYSA-N 1 0 333.819 3.717 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3F)o2)c([N+](=O)[O-])c1 ZINC000549935343 1037714556 /nfs/dbraw/zinc/71/45/56/1037714556.db2.gz AKEURVHZTJSYMZ-LSDHHAIUSA-N 1 0 334.347 3.844 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCOCC1 ZINC000897450445 1037746343 /nfs/dbraw/zinc/74/63/43/1037746343.db2.gz JPTMFDIRGMBRCC-UHFFFAOYSA-N 1 0 326.824 3.791 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328654 1037825326 /nfs/dbraw/zinc/82/53/26/1037825326.db2.gz OWBCTZQYDFUUMM-XJKSGUPXSA-N 1 0 347.440 3.623 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c(F)c1OC ZINC000897459308 1037832177 /nfs/dbraw/zinc/83/21/77/1037832177.db2.gz JYFUUELWDGQZBY-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](Cc1ccccc1)[C@H]1CC[C@H](O)CC1 ZINC000592130700 1037841134 /nfs/dbraw/zinc/84/11/34/1037841134.db2.gz JLTWMJJZJAELLK-WGSAOQKQSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCS[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000592379941 1037951450 /nfs/dbraw/zinc/95/14/50/1037951450.db2.gz BFIWMJJAQVIIJE-XHDPSFHLSA-N 1 0 348.424 3.847 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cn1 ZINC000492111615 1037993267 /nfs/dbraw/zinc/99/32/67/1037993267.db2.gz VMPFYTSCVNFSAI-UHFFFAOYSA-N 1 0 342.443 3.859 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000538717336 1038487413 /nfs/dbraw/zinc/48/74/13/1038487413.db2.gz UXNFTKTYNVEJRB-CRAIPNDOSA-N 1 0 333.476 3.880 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967820 1038768878 /nfs/dbraw/zinc/76/88/78/1038768878.db2.gz FHEJZPQPHJFNCB-CHWSQXEVSA-N 1 0 334.416 3.860 20 5 EHBDRO COc1ccc(COc2ccc([C@@H]3CCC[NH2+]3)cc2)cc1[N+](=O)[O-] ZINC000905619282 1039004413 /nfs/dbraw/zinc/00/44/13/1039004413.db2.gz UOXUAVVIFCFZOH-INIZCTEOSA-N 1 0 328.368 3.607 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCCC[C@@]2(CC[NH2+]C2)C1 ZINC000906094827 1039289271 /nfs/dbraw/zinc/28/92/71/1039289271.db2.gz QRDVDNYUMNONLA-INIZCTEOSA-N 1 0 325.359 3.502 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)[C@H]1CO ZINC000249062709 1039343534 /nfs/dbraw/zinc/34/35/34/1039343534.db2.gz ICDCRLXCZNLTPG-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1cc(NC[C@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549465144 1039479049 /nfs/dbraw/zinc/47/90/49/1039479049.db2.gz HXGAKJISGZAREM-LLVKDONJSA-N 1 0 343.349 3.818 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440159 1039547371 /nfs/dbraw/zinc/54/73/71/1039547371.db2.gz AIJXJZIAWXBZLI-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000485813618 1039586043 /nfs/dbraw/zinc/58/60/43/1039586043.db2.gz OJROVBWFABAGKA-GFCCVEGCSA-N 1 0 343.408 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccc(CO)c1)CCCC2 ZINC000417312693 1039665612 /nfs/dbraw/zinc/66/56/12/1039665612.db2.gz ODTDKRMNAVTYNW-LJQANCHMSA-N 1 0 326.396 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(CCO)CCCC1)CCCC2 ZINC000417314619 1039668837 /nfs/dbraw/zinc/66/88/37/1039668837.db2.gz RNQFRJYWHPGBSW-GOSISDBHSA-N 1 0 332.444 3.895 20 5 EHBDRO Cc1ccc(Sc2ccc(C[N@@H+](C)[C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000554883841 1039906873 /nfs/dbraw/zinc/90/68/73/1039906873.db2.gz CBQBIHZRHARFPP-AWEZNQCLSA-N 1 0 346.452 3.867 20 5 EHBDRO CC(=O)c1cc(NCCC[N@@H+](C)C2CCCCC2)ccc1[N+](=O)[O-] ZINC000553308887 1039972889 /nfs/dbraw/zinc/97/28/89/1039972889.db2.gz AWZZJHPBASHGKP-UHFFFAOYSA-N 1 0 333.432 3.864 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000489495470 1040039783 /nfs/dbraw/zinc/03/97/83/1040039783.db2.gz JJBPHZUQGQRICA-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO Cc1cc(NC2CC([NH+]3CCCCC3)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000480823080 1040065683 /nfs/dbraw/zinc/06/56/83/1040065683.db2.gz LRVYKNFRDSJUEH-UHFFFAOYSA-N 1 0 340.427 3.880 20 5 EHBDRO CCOc1cc(NC[C@@H](c2cccc(F)c2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000486449156 1040145804 /nfs/dbraw/zinc/14/58/04/1040145804.db2.gz IMBXQKSVBHFBAK-KRWDZBQOSA-N 1 0 347.390 3.847 20 5 EHBDRO Cn1cc(C[N@H+](C)Cc2ccsc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000120450368 1040239569 /nfs/dbraw/zinc/23/95/69/1040239569.db2.gz MPVMURZXILILML-UHFFFAOYSA-N 1 0 342.424 3.689 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](c1ccco1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000120280826 1040282337 /nfs/dbraw/zinc/28/23/37/1040282337.db2.gz AHDWUTUEJYNZIR-DLBZAZTESA-N 1 0 331.416 3.922 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C[N@H+](C)CC2CC2)C1 ZINC000490037572 1040302335 /nfs/dbraw/zinc/30/23/35/1040302335.db2.gz IBUOPEXCVKJFDK-DOTOQJQBSA-N 1 0 331.460 3.628 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2cc3ccccc3o2)ccc1[N+](=O)[O-] ZINC000490016259 1040309211 /nfs/dbraw/zinc/30/92/11/1040309211.db2.gz XNVDYKOVTAZPJT-UHFFFAOYSA-N 1 0 326.352 3.982 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCCc2ccccc2F)n1 ZINC000479511042 1040330969 /nfs/dbraw/zinc/33/09/69/1040330969.db2.gz FYUWNVSZXPTCFJ-IAGOWNOFSA-N 1 0 346.406 3.637 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000479581132 1040403172 /nfs/dbraw/zinc/40/31/72/1040403172.db2.gz RGBALOZMLPGJPE-HZPDHXFCSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H](CCOC)C1 ZINC000467269246 1040514110 /nfs/dbraw/zinc/51/41/10/1040514110.db2.gz RHINOVZMEKOZAZ-HNNXBMFYSA-N 1 0 336.432 3.632 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CCC[C@@H](c4ccccc4)C3)nc2c1 ZINC000433053569 1040575224 /nfs/dbraw/zinc/57/52/24/1040575224.db2.gz QRMNRMOTPUBHDJ-OAHLLOKOSA-N 1 0 336.395 3.851 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccn1 ZINC000453288439 1040636133 /nfs/dbraw/zinc/63/61/33/1040636133.db2.gz KPDPUHBEYSKSHC-QGZVFWFLSA-N 1 0 325.412 3.935 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000433074285 1040642869 /nfs/dbraw/zinc/64/28/69/1040642869.db2.gz HYOVZUYDEAEDIM-QGZVFWFLSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123225699 1040784957 /nfs/dbraw/zinc/78/49/57/1040784957.db2.gz FLRKFHOXPAVSMS-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371478 1040791960 /nfs/dbraw/zinc/79/19/60/1040791960.db2.gz MXYURLXIVJSOIU-PWSUYJOCSA-N 1 0 344.358 3.825 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000600197035 1040812938 /nfs/dbraw/zinc/81/29/38/1040812938.db2.gz QDSCQURWABUJNA-PBHICJAKSA-N 1 0 348.443 3.703 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC001167752308 1040833571 /nfs/dbraw/zinc/83/35/71/1040833571.db2.gz DQMZOXBNXRTPPX-NSHDSACASA-N 1 0 346.353 3.685 20 5 EHBDRO CC[C@H]1COCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509798610 1040840453 /nfs/dbraw/zinc/84/04/53/1040840453.db2.gz INORURFVFMOSIY-AWEZNQCLSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1(Cc2cccc(F)c2)CCOCC1 ZINC000555619012 1040927292 /nfs/dbraw/zinc/92/72/92/1040927292.db2.gz XLINPNMAXWRPAH-UHFFFAOYSA-N 1 0 344.386 3.615 20 5 EHBDRO COCC[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCSC1 ZINC000433192869 1041038565 /nfs/dbraw/zinc/03/85/65/1041038565.db2.gz NIPYQCVJOWFMTD-AWEZNQCLSA-N 1 0 344.864 3.592 20 5 EHBDRO C[C@H]1CCC[N@H+](CCCCNc2ncnc3sc([N+](=O)[O-])cc32)C1 ZINC000341522972 1041092034 /nfs/dbraw/zinc/09/20/34/1041092034.db2.gz HHKZBDSYEOIVEC-LBPRGKRZSA-N 1 0 349.460 3.524 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000120292269 1041211660 /nfs/dbraw/zinc/21/16/60/1041211660.db2.gz OPHLENNXXTYIGS-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854385 1041235803 /nfs/dbraw/zinc/23/58/03/1041235803.db2.gz KZQAWKQAQTVDBG-OAHLLOKOSA-N 1 0 341.411 3.577 20 5 EHBDRO CC(C)[C@H](O)C(C)(C)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433295451 1041247203 /nfs/dbraw/zinc/24/72/03/1041247203.db2.gz DMNSNURCXGDWBW-IRXDYDNUSA-N 1 0 334.460 3.950 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000600470749 1041249764 /nfs/dbraw/zinc/24/97/64/1041249764.db2.gz IHKGLNMGZZFVLM-PAPYEOQZSA-N 1 0 333.432 3.645 20 5 EHBDRO CC(=O)c1ccc(N[C@@H](C)C[N@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000511711000 1041474226 /nfs/dbraw/zinc/47/42/26/1041474226.db2.gz CHYNDCFCJONRGN-MJBXVCDLSA-N 1 0 333.432 3.576 20 5 EHBDRO CC(C)(C)[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000111057345 1041718495 /nfs/dbraw/zinc/71/84/95/1041718495.db2.gz JLFQBAGJOBBNAN-KGLIPLIRSA-N 1 0 333.432 3.728 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000093116535 1041889854 /nfs/dbraw/zinc/88/98/54/1041889854.db2.gz RCUCRXADAABZMU-MRXNPFEDSA-N 1 0 330.359 3.910 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccc(Cl)cc1 ZINC000125472259 1042142592 /nfs/dbraw/zinc/14/25/92/1042142592.db2.gz NORXQVIFOHBHHJ-MSOLQXFVSA-N 1 0 345.830 3.783 20 5 EHBDRO CC[C@@H]([NH2+]C[C@](C)(O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000181794874 1042211804 /nfs/dbraw/zinc/21/18/04/1042211804.db2.gz UZBDFNIUTCSXNF-MSOLQXFVSA-N 1 0 332.375 3.682 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+]C(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000541643881 1042353900 /nfs/dbraw/zinc/35/39/00/1042353900.db2.gz IPCRYVBZEANBAC-UHFFFAOYSA-N 1 0 347.440 3.818 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)Cc1ccccc1 ZINC000253354800 1042556916 /nfs/dbraw/zinc/55/69/16/1042556916.db2.gz MPMYGZNRVADRHH-GKCIPKSASA-N 1 0 340.423 3.554 20 5 EHBDRO CC[C@](C)([NH2+]CCOc1ccccc1[N+](=O)[O-])c1nc(C)cs1 ZINC000072863309 1042633180 /nfs/dbraw/zinc/63/31/80/1042633180.db2.gz NGULZSAGRSNRQD-INIZCTEOSA-N 1 0 335.429 3.654 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072897480 1042764492 /nfs/dbraw/zinc/76/44/92/1042764492.db2.gz HYHHRJFHHWYJOS-KGLIPLIRSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000120374286 1042772257 /nfs/dbraw/zinc/77/22/57/1042772257.db2.gz NFPBVMLHPWXHLB-CYBMUJFWSA-N 1 0 332.425 3.525 20 5 EHBDRO Cc1ccc(Br)cc1C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000190298289 1042911781 /nfs/dbraw/zinc/91/17/81/1042911781.db2.gz GXBARKQWDSPFEY-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000106466637 1042986151 /nfs/dbraw/zinc/98/61/51/1042986151.db2.gz DVEYXKKGQPIXNV-NWDGAFQWSA-N 1 0 332.322 3.814 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC2(CCOCC2)CC1 ZINC000585767940 1043030209 /nfs/dbraw/zinc/03/02/09/1043030209.db2.gz IQXKNKAYYVAZPX-SSZFMOIBSA-N 1 0 330.428 3.891 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2ccnc2)cc1 ZINC000344065279 1043199430 /nfs/dbraw/zinc/19/94/30/1043199430.db2.gz OBJVQTAIQINSQQ-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO COCCOc1cc(C)ccc1C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000167616997 1043315300 /nfs/dbraw/zinc/31/53/00/1043315300.db2.gz RJRSUDZSCXWERX-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCO[C@@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279094767 1043337538 /nfs/dbraw/zinc/33/75/38/1043337538.db2.gz NUQWYJCGCKHNAG-DOPJRALCSA-N 1 0 330.428 3.864 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1nc2ccccc2s1 ZINC000051909151 1044131853 /nfs/dbraw/zinc/13/18/53/1044131853.db2.gz NWPPDTMNKBLMPA-UHFFFAOYSA-N 1 0 327.409 3.879 20 5 EHBDRO CC[C@@H](C)[C@@H](O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236868108 1044858803 /nfs/dbraw/zinc/85/88/03/1044858803.db2.gz BVSUVOGHAYQZOI-WBMJQRKESA-N 1 0 334.441 3.820 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(Cc1ccco1)C[C@H]1CCCO1 ZINC000183295543 1125516886 /nfs/dbraw/zinc/51/68/86/1125516886.db2.gz YQTFYDOLXLXBQX-GOSISDBHSA-N 1 0 330.384 3.677 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000083170488 1127225183 /nfs/dbraw/zinc/22/51/83/1127225183.db2.gz CAKPTOIUDWLGCA-ZDUSSCGKSA-N 1 0 325.368 3.972 20 5 EHBDRO C[C@@H]1COCC[C@H]1C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552099325 1127578491 /nfs/dbraw/zinc/57/84/91/1127578491.db2.gz FNOIBEHYGLKEQD-MOXGXCLJSA-N 1 0 340.423 3.946 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000765252146 1127589149 /nfs/dbraw/zinc/58/91/49/1127589149.db2.gz RFQBMHXEUQVFIR-RHSMWYFYSA-N 1 0 330.432 3.865 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)o1 ZINC000131339598 1127626606 /nfs/dbraw/zinc/62/66/06/1127626606.db2.gz RXAUPRJXIMDHKP-KRWDZBQOSA-N 1 0 346.383 3.550 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCSCC(F)(F)F)C1CC1 ZINC000552588297 1127759683 /nfs/dbraw/zinc/75/96/83/1127759683.db2.gz VBKDWRQAFAPDRT-CYBMUJFWSA-N 1 0 348.390 3.801 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000765767496 1128072619 /nfs/dbraw/zinc/07/26/19/1128072619.db2.gz KNRUPDQYOGKDES-CQSZACIVSA-N 1 0 344.411 3.723 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508532 1128483954 /nfs/dbraw/zinc/48/39/54/1128483954.db2.gz AQIKWZGFWHYRPZ-WBVHZDCISA-N 1 0 340.427 3.763 20 5 EHBDRO CCCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765849376 1128572817 /nfs/dbraw/zinc/57/28/17/1128572817.db2.gz PSXURBSZZYBFME-LIRRHRJNSA-N 1 0 344.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)cc1 ZINC000765849006 1128573387 /nfs/dbraw/zinc/57/33/87/1128573387.db2.gz NMGIHOQPPJCILJ-XUVXKRRUSA-N 1 0 340.423 3.944 20 5 EHBDRO C[N@H+](CCCC1CCOCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000765931794 1128772811 /nfs/dbraw/zinc/77/28/11/1128772811.db2.gz HOHGJFKHKYBEOM-UHFFFAOYSA-N 1 0 326.824 3.887 20 5 EHBDRO CC(C)[C@@H](C)NC(=O)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153853383 1128773319 /nfs/dbraw/zinc/77/33/19/1128773319.db2.gz DJCQNAAYWWBYHM-CABCVRRESA-N 1 0 347.459 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2Cc2ccccc2)c2ccncc21 ZINC000715711904 1128810355 /nfs/dbraw/zinc/81/03/55/1128810355.db2.gz KYWVJRXURMAUFF-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO Cc1ccc(CN[C@@H](C[NH+](C)C)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000554938854 1128888341 /nfs/dbraw/zinc/88/83/41/1128888341.db2.gz YPVLMEHAQIKDBJ-KRWDZBQOSA-N 1 0 347.846 3.949 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC([NH+]2CCCCC2)CC1 ZINC000485740058 1120355570 /nfs/dbraw/zinc/35/55/70/1120355570.db2.gz VMSYUUVBOATKIT-INIZCTEOSA-N 1 0 331.460 3.915 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2Cc3ccccc3C2)cc(C(F)(F)F)c1 ZINC000494458749 1120564190 /nfs/dbraw/zinc/56/41/90/1120564190.db2.gz SMGQULSNXUXTQA-UHFFFAOYSA-N 1 0 336.313 3.871 20 5 EHBDRO Cc1cc(N2CC[C@@H](C(C)(C)C)[C@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542508630 1120855781 /nfs/dbraw/zinc/85/57/81/1120855781.db2.gz LUNDWWWSTQQVIK-CRAIPNDOSA-N 1 0 343.427 3.685 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](c1cccs1)C1CC1 ZINC000542511477 1120865775 /nfs/dbraw/zinc/86/57/75/1120865775.db2.gz RFDFIGGJFFMSBZ-QGZVFWFLSA-N 1 0 345.424 3.644 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000542533856 1120932664 /nfs/dbraw/zinc/93/26/64/1120932664.db2.gz XSIKUJSWJATBAR-XJKSGUPXSA-N 1 0 334.416 3.757 20 5 EHBDRO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1cc(F)c(Cl)cc1Cl ZINC000090538369 1121146926 /nfs/dbraw/zinc/14/69/26/1121146926.db2.gz VOPGDTRZEQESKN-QMMMGPOBSA-N 1 0 347.177 3.588 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@H]1CCCN(C(=O)OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000495562544 1121274395 /nfs/dbraw/zinc/27/43/95/1121274395.db2.gz ZJKADZAATMBGLS-KMFMINBZSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)cc1 ZINC000780400262 1121575399 /nfs/dbraw/zinc/57/53/99/1121575399.db2.gz UQZPVQNKRTVKJO-NCJCTJFTSA-N 1 0 338.407 3.806 20 5 EHBDRO C[C@@H](O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536202 1121683403 /nfs/dbraw/zinc/68/34/03/1121683403.db2.gz OCUXWHABLIVFPY-CHWSQXEVSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@H]1CC[N@@H+]2CCCC[C@H]12 ZINC000301104695 1121920132 /nfs/dbraw/zinc/92/01/32/1121920132.db2.gz VMIAJXLYRFLMSP-QWHCGFSZSA-N 1 0 329.322 3.652 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000302268896 1121934931 /nfs/dbraw/zinc/93/49/31/1121934931.db2.gz GPNOAGSTHSFZQL-QMTHXVAHSA-N 1 0 344.242 3.822 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+]CC=Cc2ccccc2[N+](=O)[O-])c1 ZINC000496586385 1122128392 /nfs/dbraw/zinc/12/83/92/1122128392.db2.gz YXXUORBRQUOPTR-VMPITWQZSA-N 1 0 341.367 3.576 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H]1C ZINC000916575983 1122201516 /nfs/dbraw/zinc/20/15/16/1122201516.db2.gz GDIVFOCCNNNBII-MDZLAQPJSA-N 1 0 339.823 3.601 20 5 EHBDRO COCCOc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000154079002 1122210999 /nfs/dbraw/zinc/21/09/99/1122210999.db2.gz OBMJVTCQOBWGMX-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCC[C@@H]1O ZINC000497157477 1122354256 /nfs/dbraw/zinc/35/42/56/1122354256.db2.gz AFRLKOUSTVCDGC-QAPCUYQASA-N 1 0 344.411 3.838 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000917454505 1122610904 /nfs/dbraw/zinc/61/09/04/1122610904.db2.gz PXXXQDUWMPBHPM-UHFFFAOYSA-N 1 0 331.420 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@H]2C2CCCCC2)c1 ZINC000917477204 1122612521 /nfs/dbraw/zinc/61/25/21/1122612521.db2.gz FAPQXFLXJZBTPU-KRWDZBQOSA-N 1 0 328.416 3.947 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc([S@](C)=O)cc1 ZINC000154466653 1122653667 /nfs/dbraw/zinc/65/36/67/1122653667.db2.gz GSJDLZVOTHLGTA-XMMPIXPASA-N 1 0 346.452 3.743 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cnc3n2CCCC3)c2cc([N+](=O)[O-])ccc21 ZINC000556608190 1123056592 /nfs/dbraw/zinc/05/65/92/1123056592.db2.gz GFCARIVXPRCBPQ-QGZVFWFLSA-N 1 0 340.427 3.640 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cc1 ZINC000130783052 1123736457 /nfs/dbraw/zinc/73/64/57/1123736457.db2.gz AIIBYIGRSPLDBX-BEFAXECRSA-N 1 0 328.412 3.548 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([C@H]3CCOC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000543047983 1129158431 /nfs/dbraw/zinc/15/84/31/1129158431.db2.gz LHFGRVBYLMKKKU-CABCVRRESA-N 1 0 341.411 3.704 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2ccnn2C)C(C)C)cccc1[N+](=O)[O-] ZINC000615967234 1123919592 /nfs/dbraw/zinc/91/95/92/1123919592.db2.gz WYZHBOALTWTEIR-GOEBONIOSA-N 1 0 330.432 3.727 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCCCO2)s1 ZINC000237956455 1123930508 /nfs/dbraw/zinc/93/05/08/1123930508.db2.gz HXYKPDNTAMRANQ-CYBMUJFWSA-N 1 0 332.425 3.982 20 5 EHBDRO CC[C@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOC1 ZINC000616487685 1124011331 /nfs/dbraw/zinc/01/13/31/1124011331.db2.gz BJEGEOUXDNKVHI-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000618197813 1125017710 /nfs/dbraw/zinc/01/77/10/1125017710.db2.gz AZBYWEZGZRZQLK-MXHVWWQHSA-N 1 0 338.407 3.851 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000181815292 1125048664 /nfs/dbraw/zinc/04/86/64/1125048664.db2.gz ORJFHJBKNJGWIL-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCCC1 ZINC000182933151 1125397077 /nfs/dbraw/zinc/39/70/77/1125397077.db2.gz WCHZJMQDDGBQHU-LBPRGKRZSA-N 1 0 330.388 3.703 20 5 EHBDRO CCC[N@@H+]1CC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000619895224 1125425126 /nfs/dbraw/zinc/42/51/26/1125425126.db2.gz RWTGHAKYJROUJW-INIZCTEOSA-N 1 0 333.435 3.602 20 5 EHBDRO CCOc1cccc(NC[C@@H](c2cccs2)[NH+](C)C)c1[N+](=O)[O-] ZINC000183135175 1125453545 /nfs/dbraw/zinc/45/35/45/1125453545.db2.gz OWEDYPDYULTHII-ZDUSSCGKSA-N 1 0 335.429 3.770 20 5 EHBDRO C[NH+]1CCC(CCNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000301865897 1129226027 /nfs/dbraw/zinc/22/60/27/1129226027.db2.gz MWOCYESQYKONCA-UHFFFAOYSA-N 1 0 340.427 3.801 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000079723936 1129289677 /nfs/dbraw/zinc/28/96/77/1129289677.db2.gz URGOGUHJMOHPQD-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO CSc1ccc([C@@H](CNc2nccc(C)c2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338834816 1129397953 /nfs/dbraw/zinc/39/79/53/1129397953.db2.gz FHKBSUDHOUAMOA-OAHLLOKOSA-N 1 0 346.456 3.735 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000124746010 1129463015 /nfs/dbraw/zinc/46/30/15/1129463015.db2.gz ROLZCRWYFALSJK-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO Cc1cc(Nc2cccc(CC[N@@H+](C)C3CC3)c2)ncc1[N+](=O)[O-] ZINC000301979916 1129466047 /nfs/dbraw/zinc/46/60/47/1129466047.db2.gz GDNGUCJZEUSORR-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO CN(CCC1CCN(c2cc[nH+]cc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000301988768 1129482466 /nfs/dbraw/zinc/48/24/66/1129482466.db2.gz WKGXAEAAOGUJCP-UHFFFAOYSA-N 1 0 340.427 3.733 20 5 EHBDRO Cc1ccc([C@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N2CCCC2)o1 ZINC000154053443 1129530536 /nfs/dbraw/zinc/53/05/36/1129530536.db2.gz XTDNMJIUVQPJRB-YJBOKZPZSA-N 1 0 343.427 3.984 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884135 1129547849 /nfs/dbraw/zinc/54/78/49/1129547849.db2.gz RAWDOSCMDNCLJR-IUODEOHRSA-N 1 0 326.824 3.764 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000154455602 1129559886 /nfs/dbraw/zinc/55/98/86/1129559886.db2.gz SPRZGUPBLQGVDQ-KRWDZBQOSA-N 1 0 330.384 3.590 20 5 EHBDRO Cc1ccc(C[NH2+]C(C)(C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000389964629 1129597625 /nfs/dbraw/zinc/59/76/25/1129597625.db2.gz SOQWRYFDBHJSDM-UHFFFAOYSA-N 1 0 328.412 3.988 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](C2CCOCC2)C1 ZINC000330447106 1129637703 /nfs/dbraw/zinc/63/77/03/1129637703.db2.gz HTDXEZHURAWAKY-MRXNPFEDSA-N 1 0 348.443 3.631 20 5 EHBDRO CC1([NH+]2CCC2)CCC([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000922847403 1129690100 /nfs/dbraw/zinc/69/01/00/1129690100.db2.gz OTAXJHLSWDVHPV-UHFFFAOYSA-N 1 0 337.851 3.745 20 5 EHBDRO COc1ccc([C@@H](CNc2sccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000302011634 1129763279 /nfs/dbraw/zinc/76/32/79/1129763279.db2.gz YVVDKDNHGYBCHB-MRXNPFEDSA-N 1 0 347.440 3.914 20 5 EHBDRO COc1ccc([C@@H](C[NH+]2CCCC2)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000302049412 1129764697 /nfs/dbraw/zinc/76/46/97/1129764697.db2.gz MZEFWKJZMZECCN-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1cc(N[C@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302140661 1129770124 /nfs/dbraw/zinc/77/01/24/1129770124.db2.gz FGXSZLZJZSLTOV-OALUTQOASA-N 1 0 335.363 3.522 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000056197008 1129805529 /nfs/dbraw/zinc/80/55/29/1129805529.db2.gz VMWPOULIDSQJPY-MNOVXSKESA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl ZINC000056196902 1129806209 /nfs/dbraw/zinc/80/62/09/1129806209.db2.gz FJZVWWJBUHAAIJ-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196864 1129806270 /nfs/dbraw/zinc/80/62/70/1129806270.db2.gz FCTRYDTZNDVFSN-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(-c3cccnc3)c2)cc1 ZINC000132205043 1129882429 /nfs/dbraw/zinc/88/24/29/1129882429.db2.gz KXXYEECYTCFNLZ-UHFFFAOYSA-N 1 0 333.391 3.989 20 5 EHBDRO CC(C)[C@@H](CO)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000162727888 1129902149 /nfs/dbraw/zinc/90/21/49/1129902149.db2.gz NKQJUZLWOCASQW-GXTWGEPZSA-N 1 0 334.441 3.991 20 5 EHBDRO CCc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cn1 ZINC000347852976 1129928588 /nfs/dbraw/zinc/92/85/88/1129928588.db2.gz BDYLTGVIGBOIOZ-UHFFFAOYSA-N 1 0 341.411 3.596 20 5 EHBDRO O=[N+]([O-])c1cncc(Cl)c1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000306114693 1129932499 /nfs/dbraw/zinc/93/24/99/1129932499.db2.gz YCEKBCRBHULQQO-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)c1cccc(Cl)c1 ZINC000008196822 1130038672 /nfs/dbraw/zinc/03/86/72/1130038672.db2.gz KDMATTVWJXQIDW-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000245422067 1130202854 /nfs/dbraw/zinc/20/28/54/1130202854.db2.gz ILYCMPHIXDWONU-AUUYWEPGSA-N 1 0 339.395 3.616 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173334068 1130210252 /nfs/dbraw/zinc/21/02/52/1130210252.db2.gz OMRWSIXZNSGDNF-UGSOOPFHSA-N 1 0 331.391 3.687 20 5 EHBDRO CC[C@@](C)([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000173940644 1130325280 /nfs/dbraw/zinc/32/52/80/1130325280.db2.gz YUOKCYJJACPWTG-MRXNPFEDSA-N 1 0 335.429 3.654 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000245870645 1130325303 /nfs/dbraw/zinc/32/53/03/1130325303.db2.gz LBOPCOLJZKIQAC-DUFGSWQCSA-N 1 0 347.459 3.637 20 5 EHBDRO C[C@@H](O)CC(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174464460 1130360477 /nfs/dbraw/zinc/36/04/77/1130360477.db2.gz AKFVXSHQKICFFV-GFCCVEGCSA-N 1 0 349.456 3.605 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000246429287 1130380717 /nfs/dbraw/zinc/38/07/17/1130380717.db2.gz MVSOINKKYRPZFS-DNVCBOLYSA-N 1 0 342.443 3.998 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246462463 1130384950 /nfs/dbraw/zinc/38/49/50/1130384950.db2.gz FNOSIDDXGZQZIQ-SUMWQHHRSA-N 1 0 349.862 3.697 20 5 EHBDRO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCCC[C@@H]1C ZINC000731206204 1130779133 /nfs/dbraw/zinc/77/91/33/1130779133.db2.gz BHKMWMZJYNVBEX-NWDGAFQWSA-N 1 0 334.445 3.879 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc(C[NH+](C)C)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000347990815 1131112162 /nfs/dbraw/zinc/11/21/62/1131112162.db2.gz DCCHGHBRKAFMPR-GFCCVEGCSA-N 1 0 345.374 3.538 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCCC12CCOCC2 ZINC000282654702 1131134418 /nfs/dbraw/zinc/13/44/18/1131134418.db2.gz IFZLFYPESRDBTO-INIZCTEOSA-N 1 0 338.835 3.730 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000738228765 1131463746 /nfs/dbraw/zinc/46/37/46/1131463746.db2.gz ZNMMIKVUACILEQ-HNNXBMFYSA-N 1 0 334.445 3.510 20 5 EHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150032 1131693496 /nfs/dbraw/zinc/69/34/96/1131693496.db2.gz TYFOILBQSHBOSC-ZBFHGGJFSA-N 1 0 343.431 3.711 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154508 1131693995 /nfs/dbraw/zinc/69/39/95/1131693995.db2.gz KMEYHTLHRXOUIZ-GJZGRUSLSA-N 1 0 328.416 3.926 20 5 EHBDRO COc1cccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1F ZINC001172904031 1131886157 /nfs/dbraw/zinc/88/61/57/1131886157.db2.gz VFIPIZCIWPODHO-INIZCTEOSA-N 1 0 344.386 3.780 20 5 EHBDRO CC1([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ccccc2C1 ZINC001172904008 1131886233 /nfs/dbraw/zinc/88/62/33/1131886233.db2.gz UUNLBCMIHHFIBX-LJQANCHMSA-N 1 0 336.435 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCc3c1cccc3O)CC2 ZINC001172907488 1131887863 /nfs/dbraw/zinc/88/78/63/1131887863.db2.gz FRWYKHXYFIFJCW-DNVCBOLYSA-N 1 0 338.407 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc(F)c(F)c1)CC2 ZINC001172895681 1131900698 /nfs/dbraw/zinc/90/06/98/1131900698.db2.gz HHIHSROTHVKXET-OAHLLOKOSA-N 1 0 332.350 3.910 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000743381101 1131915003 /nfs/dbraw/zinc/91/50/03/1131915003.db2.gz VZVFOFQIPWOCED-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+]CCC3CCC3)CC2)c(F)c1 ZINC001173011207 1131935620 /nfs/dbraw/zinc/93/56/20/1131935620.db2.gz USWJYUOHEAONJQ-UHFFFAOYSA-N 1 0 339.386 3.622 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2sccc2C)c1F ZINC001173175646 1131991206 /nfs/dbraw/zinc/99/12/06/1131991206.db2.gz QIZUSMFWTNTQTF-LLVKDONJSA-N 1 0 338.404 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)Cc2ccccc2)c1F ZINC001173184661 1131993554 /nfs/dbraw/zinc/99/35/54/1131993554.db2.gz NYIBZUKAZWCKTR-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2CC23CCCCC3)c1F ZINC001173184182 1131993956 /nfs/dbraw/zinc/99/39/56/1131993956.db2.gz OQBITZFOZKNJLO-WBMJQRKESA-N 1 0 336.407 3.986 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC(SC)CC2)c1F ZINC001173189540 1131995504 /nfs/dbraw/zinc/99/55/04/1131995504.db2.gz KPDZSMBUYSXHQU-LLVKDONJSA-N 1 0 342.436 3.501 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCc1ccc2ccccc2n1 ZINC001173220911 1132004754 /nfs/dbraw/zinc/00/47/54/1132004754.db2.gz IAVUDXQZBNWCBW-HNNXBMFYSA-N 1 0 335.407 3.906 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2ccc(F)cc2C1 ZINC001173222926 1132004921 /nfs/dbraw/zinc/00/49/21/1132004921.db2.gz GBBXNGNCQFNVAG-UGSOOPFHSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](c2ccccn2)C1 ZINC001173225011 1132005346 /nfs/dbraw/zinc/00/53/46/1132005346.db2.gz ARUOZBIDDPDJDI-DOTOQJQBSA-N 1 0 325.412 3.800 20 5 EHBDRO Cc1cnccc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223352 1132005662 /nfs/dbraw/zinc/00/56/62/1132005662.db2.gz IDMLJGXGJJFAJA-KUHUBIRLSA-N 1 0 325.412 3.970 20 5 EHBDRO CC(C)CC1(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CCOCC1 ZINC001173231493 1132008748 /nfs/dbraw/zinc/00/87/48/1132008748.db2.gz ZWUABYOZPRLGDD-INIZCTEOSA-N 1 0 334.460 3.958 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CCOCC1 ZINC001173213921 1132015090 /nfs/dbraw/zinc/01/50/90/1132015090.db2.gz MBHFGKUFHWPFDG-MRXNPFEDSA-N 1 0 340.423 3.821 20 5 EHBDRO C[C@@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000746076758 1132361218 /nfs/dbraw/zinc/36/12/18/1132361218.db2.gz PNMGMYFHMMPBDV-TUAOUCFPSA-N 1 0 340.807 3.553 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(Nc3ccc([N+](=O)[O-])cc3)cc2)CC1 ZINC001174480388 1132382207 /nfs/dbraw/zinc/38/22/07/1132382207.db2.gz OBUNQQCPMFYZDH-UHFFFAOYSA-N 1 0 327.384 3.811 20 5 EHBDRO CC[C@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@@H]1c1ccccc1 ZINC000746382295 1132505263 /nfs/dbraw/zinc/50/52/63/1132505263.db2.gz LLHYMIIRJVZQLA-WMZOPIPTSA-N 1 0 342.443 3.881 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000746391175 1132506907 /nfs/dbraw/zinc/50/69/07/1132506907.db2.gz ZKUBBCOMKVOUQV-IBGZPJMESA-N 1 0 325.412 3.696 20 5 EHBDRO C/C=C\C[C@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052534 1132550167 /nfs/dbraw/zinc/55/01/67/1132550167.db2.gz HAWVDZIQYFGLBP-SFAKSCPVSA-N 1 0 349.406 3.741 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)[C@@]12C[C@@H]1CCCC2 ZINC001175293077 1132615598 /nfs/dbraw/zinc/61/55/98/1132615598.db2.gz XEGRMQMKKCHWRT-ZRGWGRIASA-N 1 0 345.443 3.790 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001168956339 1132620468 /nfs/dbraw/zinc/62/04/68/1132620468.db2.gz AXRQLSSOQZCFCA-BXKDBHETSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(C(F)(F)F)c(Cl)c2)C1 ZINC001168971829 1132623906 /nfs/dbraw/zinc/62/39/06/1132623906.db2.gz LNTJDJRETYFTJH-GHMZBOCLSA-N 1 0 336.741 3.894 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168973384 1132625253 /nfs/dbraw/zinc/62/52/53/1132625253.db2.gz ONVGLUOKKVESIN-UHIISALHSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3ccccc32)C1 ZINC001169027884 1132634657 /nfs/dbraw/zinc/63/46/57/1132634657.db2.gz RLIHNUSCRVVHNH-GOEBONIOSA-N 1 0 327.428 3.726 20 5 EHBDRO CC1(C)OC2(CC[NH+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169040158 1132638157 /nfs/dbraw/zinc/63/81/57/1132638157.db2.gz YKHUPARIRPJWAY-CVEARBPZSA-N 1 0 344.455 3.688 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025940 1132640329 /nfs/dbraw/zinc/64/03/29/1132640329.db2.gz KCLKROIDROIISD-XPKDYRNWSA-N 1 0 342.361 3.940 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(c3nc4ccccc4s3)CC2)C1 ZINC001169025913 1132641003 /nfs/dbraw/zinc/64/10/03/1132641003.db2.gz JWRPEHDFXKETNW-DZGCQCFKSA-N 1 0 345.468 3.921 20 5 EHBDRO C[C@H](c1cccc(Br)c1)[N@H+](C)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169057841 1132646525 /nfs/dbraw/zinc/64/65/25/1132646525.db2.gz XZYGCMJLHFNDNO-JMSVASOKSA-N 1 0 341.249 3.887 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(C)ccc1C ZINC001175362167 1132650085 /nfs/dbraw/zinc/65/00/85/1132650085.db2.gz RKRKEOPDAUUNEW-MRXNPFEDSA-N 1 0 341.411 3.891 20 5 EHBDRO COc1c(F)cc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169148263 1132678171 /nfs/dbraw/zinc/67/81/71/1132678171.db2.gz VLRZUWIXTAWMHD-YVEFUNNKSA-N 1 0 339.411 3.698 20 5 EHBDRO CCOc1cc(N[C@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)ccc1[N+](=O)[O-] ZINC001169151497 1132678555 /nfs/dbraw/zinc/67/85/55/1132678555.db2.gz KIWOCIHNAZLBCC-KSSFIOAISA-N 1 0 335.448 3.949 20 5 EHBDRO C[C@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C1 ZINC001169396212 1132747261 /nfs/dbraw/zinc/74/72/61/1132747261.db2.gz PZCBRPNEPHZTLG-NSHDSACASA-N 1 0 327.222 3.979 20 5 EHBDRO Clc1nc2ccc3ccccc3c2nc1NCC[C@H]1CCC[NH2+]1 ZINC001169562668 1132786750 /nfs/dbraw/zinc/78/67/50/1132786750.db2.gz HDHZVEKRCBWSMH-CYBMUJFWSA-N 1 0 326.831 3.990 20 5 EHBDRO C[NH+](C)CCOc1ccc(Nc2ccc(/C=C/[N+](=O)[O-])cc2)cc1 ZINC001175902586 1132794448 /nfs/dbraw/zinc/79/44/48/1132794448.db2.gz QDCUEENGCVBDST-VAWYXSNFSA-N 1 0 327.384 3.618 20 5 EHBDRO COc1nc(C)c(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)cc1[N+](=O)[O-] ZINC001169699389 1132826620 /nfs/dbraw/zinc/82/66/20/1132826620.db2.gz XKPJWZUOCZWCSC-CQSZACIVSA-N 1 0 342.399 3.547 20 5 EHBDRO CCC[N@H+](CCc1cccs1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000766932707 1132916018 /nfs/dbraw/zinc/91/60/18/1132916018.db2.gz RXKYHUBKFZGONE-QGZVFWFLSA-N 1 0 334.441 3.644 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000804352046 1132981671 /nfs/dbraw/zinc/98/16/71/1132981671.db2.gz NLRDJWMYEDSYIL-CYBMUJFWSA-N 1 0 336.392 3.570 20 5 EHBDRO Cc1ccc(C[NH2+][C@@]2(CO)CC[C@H](C)c3ccccc32)cc1[N+](=O)[O-] ZINC001176933652 1133011496 /nfs/dbraw/zinc/01/14/96/1133011496.db2.gz YQAYKXXMRAPHNX-VBKZILBWSA-N 1 0 340.423 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3cc(O)ccc3C2)c1 ZINC000767730129 1133044949 /nfs/dbraw/zinc/04/49/49/1133044949.db2.gz XVUMDBGZHDZTHG-AWEZNQCLSA-N 1 0 332.787 3.601 20 5 EHBDRO CCCCC[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767761887 1133048290 /nfs/dbraw/zinc/04/82/90/1133048290.db2.gz LDDBUQJSKMDJJR-INIZCTEOSA-N 1 0 343.431 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)c1 ZINC000773705257 1133095737 /nfs/dbraw/zinc/09/57/37/1133095737.db2.gz UQUJVVMDMQUHKX-KGLIPLIRSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c(C)cc(C)cc2C)cc1[N+](=O)[O-] ZINC001178276096 1133152338 /nfs/dbraw/zinc/15/23/38/1133152338.db2.gz APWLVNKQRCVUQP-UHFFFAOYSA-N 1 0 328.412 3.861 20 5 EHBDRO CC(C)OCCCC[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001178291337 1133153613 /nfs/dbraw/zinc/15/36/13/1133153613.db2.gz WSTDSNMYAYGBFJ-UHFFFAOYSA-N 1 0 345.237 3.652 20 5 EHBDRO CC[C@@H]1OCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC001178927392 1133208788 /nfs/dbraw/zinc/20/87/88/1133208788.db2.gz XNYHSHZHYACEBL-ZBFHGGJFSA-N 1 0 332.425 3.980 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@@H](O)C23CCC3)s1 ZINC001179154600 1133231963 /nfs/dbraw/zinc/23/19/63/1133231963.db2.gz YLJZFRCPLDHBQA-IAGOWNOFSA-N 1 0 344.436 3.716 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc2oc(=O)[nH]c2c1 ZINC001179526115 1133255633 /nfs/dbraw/zinc/25/56/33/1133255633.db2.gz YSUKJQHOISEEDR-KPKJPENVSA-N 1 0 339.351 3.635 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H](C)C(C)(C)OC)o2)c([N+](=O)[O-])c1 ZINC001179647412 1133266874 /nfs/dbraw/zinc/26/68/74/1133266874.db2.gz ZHNBLDSWPXEYEL-LBPRGKRZSA-N 1 0 348.399 3.767 20 5 EHBDRO COC(=O)C[C@@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769446983 1133291849 /nfs/dbraw/zinc/29/18/49/1133291849.db2.gz PVBBWFSJDAXAQY-GOSISDBHSA-N 1 0 349.430 3.757 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2cc(F)ccc12 ZINC001183481177 1133812486 /nfs/dbraw/zinc/81/24/86/1133812486.db2.gz FDEFQFSFQOUVNI-LBPRGKRZSA-N 1 0 343.358 3.986 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1cc(C)oc1C ZINC000786812132 1133910704 /nfs/dbraw/zinc/91/07/04/1133910704.db2.gz GTKCNORSQXJEQB-FSENSJEKSA-N 1 0 344.411 3.705 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925740 1134006432 /nfs/dbraw/zinc/00/64/32/1134006432.db2.gz CVJODBUBEIIZLT-QLFBSQMISA-N 1 0 335.423 3.884 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1 ZINC001185428578 1134084690 /nfs/dbraw/zinc/08/46/90/1134084690.db2.gz CKHORGORYMHRBW-MRXNPFEDSA-N 1 0 325.412 3.696 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C(C)C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000788541828 1134140372 /nfs/dbraw/zinc/14/03/72/1134140372.db2.gz YSJFKIGVTBQSRK-OALUTQOASA-N 1 0 328.412 3.751 20 5 EHBDRO Cc1ccccc1O[C@H](C)C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788610934 1134145657 /nfs/dbraw/zinc/14/56/57/1134145657.db2.gz KEGYVOMTOBUEFP-KGLIPLIRSA-N 1 0 329.400 3.604 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788609359 1134145667 /nfs/dbraw/zinc/14/56/67/1134145667.db2.gz HRSGIICIROAYLN-DIFFPNOSSA-N 1 0 349.818 3.869 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000788576378 1134146995 /nfs/dbraw/zinc/14/69/95/1134146995.db2.gz ZJAZAJNQHNTTTO-SUMWQHHRSA-N 1 0 346.431 3.504 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602149 1134149688 /nfs/dbraw/zinc/14/96/88/1134149688.db2.gz LYSUSBHBEYNQCT-QEORTHHSSA-N 1 0 335.448 3.669 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1Cl ZINC000788670163 1134159939 /nfs/dbraw/zinc/15/99/39/1134159939.db2.gz SQFUMQBDUUGQIR-DIFFPNOSSA-N 1 0 349.818 3.869 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789501755 1134286269 /nfs/dbraw/zinc/28/62/69/1134286269.db2.gz CZFJCCGIFIETIA-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO CN(C)c1cc[nH+]c(CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)c1 ZINC001187624900 1134357508 /nfs/dbraw/zinc/35/75/08/1134357508.db2.gz MCSNVIZIUKFSKG-UHFFFAOYSA-N 1 0 340.305 3.687 20 5 EHBDRO Cc1ccccc1C[C@H](C)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000775205526 1134515301 /nfs/dbraw/zinc/51/53/01/1134515301.db2.gz ZDTXTXOHOXTGQM-AWEZNQCLSA-N 1 0 343.383 3.874 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C)cc2F)c([N+](=O)[O-])c1 ZINC001170304471 1134738811 /nfs/dbraw/zinc/73/88/11/1134738811.db2.gz CDYFQNKYLLGSIR-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CC2Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170324135 1134747362 /nfs/dbraw/zinc/74/73/62/1134747362.db2.gz ORKBEKRURYQQAT-AWEZNQCLSA-N 1 0 340.423 3.539 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccccc3C[C@H]2C)c([N+](=O)[O-])c1 ZINC001170353121 1134754192 /nfs/dbraw/zinc/75/41/92/1134754192.db2.gz WGZOCBFUQGLFNY-HUUCEWRRSA-N 1 0 340.423 3.981 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000792878187 1134811357 /nfs/dbraw/zinc/81/13/57/1134811357.db2.gz YMZXYCGOYZFCTL-QWHCGFSZSA-N 1 0 329.356 3.785 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001192681618 1135044035 /nfs/dbraw/zinc/04/40/35/1135044035.db2.gz NDGBYMPYOKDPDF-UHFFFAOYSA-N 1 0 344.411 3.816 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)c(F)c1 ZINC001192909038 1135071311 /nfs/dbraw/zinc/07/13/11/1135071311.db2.gz BQLDSKFDQIEDIG-MSOLQXFVSA-N 1 0 332.375 3.817 20 5 EHBDRO C[C@H](Nc1c([N+](=O)[O-])cccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000804606404 1135136449 /nfs/dbraw/zinc/13/64/49/1135136449.db2.gz LPUBJPMEHXKOHB-STQMWFEESA-N 1 0 348.403 3.568 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]Cc2c(F)cccc2[N+](=O)[O-])C12CCCCC2 ZINC001194092423 1135231588 /nfs/dbraw/zinc/23/15/88/1135231588.db2.gz OZJZPMZDXYNHMU-DLBZAZTESA-N 1 0 336.407 3.951 20 5 EHBDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])C1(C)C ZINC001194457535 1135270536 /nfs/dbraw/zinc/27/05/36/1135270536.db2.gz NVYPKEHUIDKLNS-GJZGRUSLSA-N 1 0 326.824 3.930 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000775618554 1135335715 /nfs/dbraw/zinc/33/57/15/1135335715.db2.gz RLYGBIBTOYUNOY-LLVKDONJSA-N 1 0 339.823 3.745 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCC[C@@H](C)C1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001195179243 1135378735 /nfs/dbraw/zinc/37/87/35/1135378735.db2.gz MYGITJPJDWZFNP-QPSCCSFWSA-N 1 0 333.432 3.726 20 5 EHBDRO CC1(C)CCC[C@@H]1[C@@H]1CC[N@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424185 1135428057 /nfs/dbraw/zinc/42/80/57/1135428057.db2.gz HXMKKWKEOXIZGJ-KBAYOESNSA-N 1 0 332.444 3.776 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC001196613676 1135589370 /nfs/dbraw/zinc/58/93/70/1135589370.db2.gz KVZAUSKWLRDCPT-NMONBKHDSA-N 1 0 331.416 3.600 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000747529480 1135742445 /nfs/dbraw/zinc/74/24/45/1135742445.db2.gz DNBYUKCMODMRON-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO C[C@@H]1CC=CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Br ZINC001198604936 1135837044 /nfs/dbraw/zinc/83/70/44/1135837044.db2.gz VJPJTRIOWRYFCC-QMTHXVAHSA-N 1 0 325.206 3.802 20 5 EHBDRO C[C@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@H]1C1CC1 ZINC000809975084 1135907999 /nfs/dbraw/zinc/90/79/99/1135907999.db2.gz WBLBBOCRVJDJNN-GJZGRUSLSA-N 1 0 345.226 3.949 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2)C2(CO)CCCC2)c1 ZINC001170615070 1136001209 /nfs/dbraw/zinc/00/12/09/1136001209.db2.gz VITNCEVWRMSEDF-UHFFFAOYSA-N 1 0 340.423 3.902 20 5 EHBDRO CC(C)c1ccc(C(=O)O[C@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810836979 1136012025 /nfs/dbraw/zinc/01/20/25/1136012025.db2.gz JQJQZJOYOGOLAM-GJZGRUSLSA-N 1 0 332.400 3.502 20 5 EHBDRO O=C(OCCC[NH+]1CCCC1)c1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811373310 1136077485 /nfs/dbraw/zinc/07/74/85/1136077485.db2.gz CFUPZDYNKSJGHY-UHFFFAOYSA-N 1 0 347.198 3.544 20 5 EHBDRO CC1(O)CCC([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000811482667 1136092152 /nfs/dbraw/zinc/09/21/52/1136092152.db2.gz NYLREJHLNLBUDF-UHFFFAOYSA-N 1 0 333.215 3.685 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000811518394 1136098404 /nfs/dbraw/zinc/09/84/04/1136098404.db2.gz MQJXFMPTCOVTNG-CQSZACIVSA-N 1 0 332.787 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)cc1Cl ZINC000811512710 1136103949 /nfs/dbraw/zinc/10/39/49/1136103949.db2.gz QFSYZAZHWISVPM-CRAIPNDOSA-N 1 0 346.814 3.504 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000776277100 1136126536 /nfs/dbraw/zinc/12/65/36/1136126536.db2.gz PEUDBWMDOMLULX-MSOLQXFVSA-N 1 0 332.375 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCc2ccc3ccccc3c2)cc1 ZINC000776273961 1136128380 /nfs/dbraw/zinc/12/83/80/1136128380.db2.gz BSRXMAJMDJDVCD-HXUWFJFHSA-N 1 0 336.391 3.614 20 5 EHBDRO CC(C)(C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000776276961 1136130638 /nfs/dbraw/zinc/13/06/38/1136130638.db2.gz MNYMXWOSTMNBSF-KRWDZBQOSA-N 1 0 348.830 3.849 20 5 EHBDRO C[N@@H+](Cc1csc2ccccc12)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277923 1136130813 /nfs/dbraw/zinc/13/08/13/1136130813.db2.gz QURRCFRMVAJQAM-QGZVFWFLSA-N 1 0 342.420 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(c3ccccc3)CCCC2)cc1 ZINC000776279898 1136134031 /nfs/dbraw/zinc/13/40/31/1136134031.db2.gz YTBWBQRSBMCDGX-LJQANCHMSA-N 1 0 340.423 3.730 20 5 EHBDRO COc1ccc(C[NH2+]CCCc2c[nH]c3ccccc23)cc1[N+](=O)[O-] ZINC000107714371 1136176506 /nfs/dbraw/zinc/17/65/06/1136176506.db2.gz ABEKKNPUSVFOIL-UHFFFAOYSA-N 1 0 339.395 3.807 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851220 1136261605 /nfs/dbraw/zinc/26/16/05/1136261605.db2.gz QOSAXEJOFLIJFB-DNVCBOLYSA-N 1 0 328.412 3.847 20 5 EHBDRO Cc1ccc(C[C@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583741 1136442406 /nfs/dbraw/zinc/44/24/06/1136442406.db2.gz GMKLKTWJRPXIIA-UXHICEINSA-N 1 0 340.423 3.644 20 5 EHBDRO Cc1ccccc1C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776579095 1136443920 /nfs/dbraw/zinc/44/39/20/1136443920.db2.gz JAMYTFOPHLIZSL-IBGZPJMESA-N 1 0 326.396 3.601 20 5 EHBDRO CCc1ccc(C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000776579779 1136444671 /nfs/dbraw/zinc/44/46/71/1136444671.db2.gz QFTSAZORRFPJHA-FQEVSTJZSA-N 1 0 340.423 3.855 20 5 EHBDRO CCC(C)(C)[C@@H](C)[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000852355398 1136451490 /nfs/dbraw/zinc/45/14/90/1136451490.db2.gz FQZGZUPZQGOLNK-SNVBAGLBSA-N 1 0 327.812 3.601 20 5 EHBDRO C[N@@H+](Cc1cc2ccccc2o1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590374 1136453131 /nfs/dbraw/zinc/45/31/31/1136453131.db2.gz DCCSQKBBFMACOP-KRWDZBQOSA-N 1 0 326.352 3.506 20 5 EHBDRO C[C@@H]1[C@@H](Cc2ccccc2)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592489 1136454272 /nfs/dbraw/zinc/45/42/72/1136454272.db2.gz OXCPKEBBPPXBKE-XFQXTVEOSA-N 1 0 340.423 3.581 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852779364 1136485640 /nfs/dbraw/zinc/48/56/40/1136485640.db2.gz DTJVBSPKENRENK-LBPRGKRZSA-N 1 0 330.359 3.910 20 5 EHBDRO Cc1ccc(OCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)c1 ZINC000815567495 1136611908 /nfs/dbraw/zinc/61/19/08/1136611908.db2.gz BCSXUHJMIJIFKD-AWEZNQCLSA-N 1 0 329.400 3.523 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1COC2(CCCCCC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776741647 1136617765 /nfs/dbraw/zinc/61/77/65/1136617765.db2.gz WKBSWZTXHPAWDV-PBHICJAKSA-N 1 0 334.416 3.711 20 5 EHBDRO Cc1ccc(OC[C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815570713 1136617888 /nfs/dbraw/zinc/61/78/88/1136617888.db2.gz KSOVYIOUMWPGCC-UONOGXRCSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173316966 1136745681 /nfs/dbraw/zinc/74/56/81/1136745681.db2.gz KIVYZPGADGTVRD-HOTGVXAUSA-N 1 0 325.412 3.772 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000819177122 1136919662 /nfs/dbraw/zinc/91/96/62/1136919662.db2.gz APHVAWIGOBKMGI-MSOLQXFVSA-N 1 0 326.396 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CC2(c3ccccc3Cl)CC2)cc1 ZINC000819195872 1136921487 /nfs/dbraw/zinc/92/14/87/1136921487.db2.gz LVLOSSOQTGOUQO-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CCCCCc2ccc(F)cc2)c1 ZINC000819243676 1136923821 /nfs/dbraw/zinc/92/38/21/1136923821.db2.gz BKLRSAMQOPGZLA-LJQANCHMSA-N 1 0 346.402 3.770 20 5 EHBDRO CC[N@@H+](c1ccc(NC[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000819397296 1136935505 /nfs/dbraw/zinc/93/55/05/1136935505.db2.gz JLPIILHKMNZKPC-LJQANCHMSA-N 1 0 343.427 3.975 20 5 EHBDRO C[NH+](C)[C@H](CNc1cc(Cl)c(F)cc1[N+](=O)[O-])c1ccco1 ZINC000820604534 1136999584 /nfs/dbraw/zinc/99/95/84/1136999584.db2.gz KFWYNXGUWROVKA-CYBMUJFWSA-N 1 0 327.743 3.695 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859585274 1137021505 /nfs/dbraw/zinc/02/15/05/1137021505.db2.gz MMZIJTMMDVNQFC-KXBFYZLASA-N 1 0 326.396 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)cc1Cl ZINC000824696977 1137147085 /nfs/dbraw/zinc/14/70/85/1137147085.db2.gz WUUHAZPOHMBJTC-FRFSOERESA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)cc1Cl ZINC000824696979 1137147248 /nfs/dbraw/zinc/14/72/48/1137147248.db2.gz WUUHAZPOHMBJTC-UNEWFSDZSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1Cl ZINC000824696256 1137148780 /nfs/dbraw/zinc/14/87/80/1137148780.db2.gz JHCMHNHIVMOSIB-YSVLISHTSA-N 1 0 338.835 3.764 20 5 EHBDRO Cc1nn(C[N@H+](CC2CC2)CC2CCC2)c2ccc([N+](=O)[O-])cc12 ZINC000794710239 1137240265 /nfs/dbraw/zinc/24/02/65/1137240265.db2.gz KOXSHIIQIBYQOU-UHFFFAOYSA-N 1 0 328.416 3.723 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000866278179 1137342179 /nfs/dbraw/zinc/34/21/79/1137342179.db2.gz WHSNQPQCIHHSCV-IAQYHMDHSA-N 1 0 336.363 3.544 20 5 EHBDRO Cc1csc([C@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866336677 1137347029 /nfs/dbraw/zinc/34/70/29/1137347029.db2.gz GMDWAQRNAJYBBW-GHMZBOCLSA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)c1c(F)cncc1F ZINC000866356295 1137348863 /nfs/dbraw/zinc/34/88/63/1137348863.db2.gz CKFSMWCKXZILDQ-UWVGGRQHSA-N 1 0 339.317 3.689 20 5 EHBDRO Cc1cccc(CCC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866359266 1137349113 /nfs/dbraw/zinc/34/91/13/1137349113.db2.gz RHIPNEIZWOVZDF-CQSZACIVSA-N 1 0 331.391 3.591 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H](C[C@H]1CCOC1)c1ccccc1 ZINC000339074427 1137350671 /nfs/dbraw/zinc/35/06/71/1137350671.db2.gz LHMHEYGRKJCKHR-APWZRJJASA-N 1 0 340.423 3.895 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCc1noc2ccccc12 ZINC000866384835 1137350870 /nfs/dbraw/zinc/35/08/70/1137350870.db2.gz DOHXCQGNPUHOKT-GFCCVEGCSA-N 1 0 343.358 3.638 20 5 EHBDRO COCc1csc(C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])c1 ZINC000866390873 1137351136 /nfs/dbraw/zinc/35/11/36/1137351136.db2.gz VAZHKZODHMOUGO-LLVKDONJSA-N 1 0 338.404 3.663 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])nc1 ZINC000866398051 1137351670 /nfs/dbraw/zinc/35/16/70/1137351670.db2.gz KQMFRZKBGBTJKK-AWEZNQCLSA-N 1 0 345.418 3.936 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1ccc(Br)cn1 ZINC000866570643 1137365839 /nfs/dbraw/zinc/36/58/39/1137365839.db2.gz IEPXYEHNSSURSV-AWEZNQCLSA-N 1 0 348.200 3.529 20 5 EHBDRO Cn1cc([C@@H]2C[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846932792 1137376161 /nfs/dbraw/zinc/37/61/61/1137376161.db2.gz UJDXWKRGWBLTDS-HNNXBMFYSA-N 1 0 348.834 3.607 20 5 EHBDRO CCC(=O)c1ccc(N2CCC(C[N@H+](C)C(C)C)CC2)c([N+](=O)[O-])c1 ZINC000795074363 1137448876 /nfs/dbraw/zinc/44/88/76/1137448876.db2.gz SNWBSXGXPNAYST-UHFFFAOYSA-N 1 0 347.459 3.744 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@H](O)c1cccc(F)c1 ZINC000773045268 1137461297 /nfs/dbraw/zinc/46/12/97/1137461297.db2.gz YORLBCMPSRFDGN-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO [NH3+]C[C@H]1COc2ccccc2N1c1cc2cccnc2c2ncccc12 ZINC001171395352 1137470103 /nfs/dbraw/zinc/47/01/03/1137470103.db2.gz ZRLSDZQXWSKDEN-HNNXBMFYSA-N 1 0 342.402 3.641 20 5 EHBDRO C[NH+](C)C1CCC(Nc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000715570796 1137477258 /nfs/dbraw/zinc/47/72/58/1137477258.db2.gz NHVRBZVMGZESOK-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872017252 1137564820 /nfs/dbraw/zinc/56/48/20/1137564820.db2.gz XROCXGTWDHKWFH-CJNGLKHVSA-N 1 0 347.390 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1c(C)nn(C)c1C ZINC000872032245 1137566537 /nfs/dbraw/zinc/56/65/37/1137566537.db2.gz YUTMNCISBOHYAJ-SNVBAGLBSA-N 1 0 334.445 3.518 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc(C)nc1 ZINC000872033633 1137566657 /nfs/dbraw/zinc/56/66/57/1137566657.db2.gz CVIVDNYXMRLRMF-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[S@@](=O)C(C)(C)C ZINC000872033201 1137566728 /nfs/dbraw/zinc/56/67/28/1137566728.db2.gz BRRDNAYHDUOSCE-KPWVOAKYSA-N 1 0 344.502 3.515 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc(CO)cc1 ZINC000872054163 1137568345 /nfs/dbraw/zinc/56/83/45/1137568345.db2.gz QEFHSBXJNMIZLR-CYBMUJFWSA-N 1 0 346.452 3.702 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872074745 1137569860 /nfs/dbraw/zinc/56/98/60/1137569860.db2.gz HAVVDNAFEARCRB-ZJUUUORDSA-N 1 0 338.301 3.742 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1c2ccccc2CN1C)c1c(F)cccc1[N+](=O)[O-] ZINC000872091964 1137570948 /nfs/dbraw/zinc/57/09/48/1137570948.db2.gz KRQJEEJQUOAXAH-SJCJKPOMSA-N 1 0 329.375 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](O)c2c(Cl)cccc2Cl)cc1 ZINC000124251530 1137584517 /nfs/dbraw/zinc/58/45/17/1137584517.db2.gz DEFUHJPZXQVDNF-CQSZACIVSA-N 1 0 341.194 3.725 20 5 EHBDRO Cc1c(CNc2cccc3c2OCC[C@@H]3[NH+](C)C)cccc1[N+](=O)[O-] ZINC000873116409 1137590497 /nfs/dbraw/zinc/59/04/97/1137590497.db2.gz DTOFAVSYIHVEBZ-SFHVURJKSA-N 1 0 341.411 3.901 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(C(F)(F)F)nc1 ZINC000873186732 1137593289 /nfs/dbraw/zinc/59/32/89/1137593289.db2.gz WVELAPWKDNXJKI-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc2c(c1)CCCC2 ZINC000876898077 1137664826 /nfs/dbraw/zinc/66/48/26/1137664826.db2.gz ZBVYCGURHPQWII-TZYSRNFLSA-N 1 0 340.427 3.724 20 5 EHBDRO CSCC[C@H](C)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000877054831 1137668852 /nfs/dbraw/zinc/66/88/52/1137668852.db2.gz IAJSMLQYRGUBLA-ZETCQYMHSA-N 1 0 339.280 3.650 20 5 EHBDRO CCOC(=O)N1CCC(C)(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000877131096 1137671119 /nfs/dbraw/zinc/67/11/19/1137671119.db2.gz URHZURPWGJZYQM-CQSZACIVSA-N 1 0 349.431 3.504 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H](C3CCC3)C3CCCCC3)C2)c1 ZINC000877606615 1137682686 /nfs/dbraw/zinc/68/26/86/1137682686.db2.gz GRHXXHLUFHJJHZ-LEOMRAHMSA-N 1 0 332.448 3.833 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000877796722 1137690334 /nfs/dbraw/zinc/69/03/34/1137690334.db2.gz KTEXTLABFYQGKB-HNNXBMFYSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@H](C1CC1)[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000877929849 1137695920 /nfs/dbraw/zinc/69/59/20/1137695920.db2.gz ORXHGQGFQSOOQG-SECBINFHSA-N 1 0 336.779 3.529 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878149625 1137704501 /nfs/dbraw/zinc/70/45/01/1137704501.db2.gz ZXLJFZXZSXNQJX-QGZVFWFLSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878165121 1137705298 /nfs/dbraw/zinc/70/52/98/1137705298.db2.gz RPXACHOXKHZGFK-NXEZZACHSA-N 1 0 336.779 3.529 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878187144 1137706387 /nfs/dbraw/zinc/70/63/87/1137706387.db2.gz QVBSNZFPSUBVIU-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476034 1137717325 /nfs/dbraw/zinc/71/73/25/1137717325.db2.gz VJXRXJWQEBZFJR-TZMCWYRMSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCCC23CCC3)o1 ZINC000878518319 1137718672 /nfs/dbraw/zinc/71/86/72/1137718672.db2.gz KRXPGDJFSWKEQH-UHFFFAOYSA-N 1 0 348.790 3.817 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCCN(C(=O)CC(C)C)CC1 ZINC000879760764 1137758275 /nfs/dbraw/zinc/75/82/75/1137758275.db2.gz LKJXTSPJHQYZBD-MRXNPFEDSA-N 1 0 347.459 3.545 20 5 EHBDRO CC1([NH+]2CCCCC2)CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC000879949169 1137762992 /nfs/dbraw/zinc/76/29/92/1137762992.db2.gz RTPFHCZLHLREPS-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO CC1([NH+]2CCCCC2)CCN(Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000879952153 1137763070 /nfs/dbraw/zinc/76/30/70/1137763070.db2.gz TXJOXJPUHKCABK-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2nccc(C)c2[N+](=O)[O-])CC1 ZINC000882816869 1137834973 /nfs/dbraw/zinc/83/49/73/1137834973.db2.gz DXMPLARSDXEDBM-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000130372370 1137836590 /nfs/dbraw/zinc/83/65/90/1137836590.db2.gz UPFVSCMSDZTCOX-ZWKOTPCHSA-N 1 0 332.375 3.898 20 5 EHBDRO CC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC(F)(F)C1 ZINC000883254964 1137850795 /nfs/dbraw/zinc/85/07/95/1137850795.db2.gz HRKRFMPJYDOLEM-UHFFFAOYSA-N 1 0 339.386 3.589 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC[C@@H]2CCCC2(F)F)n1 ZINC000883274641 1137851893 /nfs/dbraw/zinc/85/18/93/1137851893.db2.gz QSDUOKXPCBCYLR-MELADBBJSA-N 1 0 342.390 3.690 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107070304 1137885334 /nfs/dbraw/zinc/88/53/34/1137885334.db2.gz WIEMDAXVWDXFQZ-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO CC[NH+](CC)CCCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000800112967 1137898160 /nfs/dbraw/zinc/89/81/60/1137898160.db2.gz HMUCXJJJTSHPRJ-UHFFFAOYSA-N 1 0 336.413 3.698 20 5 EHBDRO C[C@H](NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708405 1137917839 /nfs/dbraw/zinc/91/78/39/1137917839.db2.gz BWGDENVWHVUCBW-KBXCAEBGSA-N 1 0 345.443 3.569 20 5 EHBDRO C[C@H]1SCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H]1C ZINC000118417387 1137933727 /nfs/dbraw/zinc/93/37/27/1137933727.db2.gz XCGZTMJVADXCBW-CHWSQXEVSA-N 1 0 347.440 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)cc1 ZINC000134796609 1137960778 /nfs/dbraw/zinc/96/07/78/1137960778.db2.gz VZFNFTRZJMLAMS-OALUTQOASA-N 1 0 344.386 3.822 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC000884707081 1137969741 /nfs/dbraw/zinc/96/97/41/1137969741.db2.gz XKPKDFFXZDVUFT-UHFFFAOYSA-N 1 0 342.399 3.521 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC000884706204 1137969774 /nfs/dbraw/zinc/96/97/74/1137969774.db2.gz VMEYNNBDINQSOG-UHFFFAOYSA-N 1 0 342.399 3.521 20 5 EHBDRO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@H]1CCCO[C@H]1c1ccccc1 ZINC000885973466 1138029513 /nfs/dbraw/zinc/02/95/13/1138029513.db2.gz SXRSJVMZDUQPHW-AEFFLSMTSA-N 1 0 341.411 3.590 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccccc2OCC(F)F)cc1[N+](=O)[O-] ZINC000886178902 1138056390 /nfs/dbraw/zinc/05/63/90/1138056390.db2.gz IHPNPCQHXFEBKT-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO CCCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@@H]1CCc2ncsc2C1 ZINC000886265911 1138063026 /nfs/dbraw/zinc/06/30/26/1138063026.db2.gz URWXYVAPFCGRLW-CQSZACIVSA-N 1 0 346.456 3.606 20 5 EHBDRO Cc1nc(C2CC[NH+]([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886670043 1138112045 /nfs/dbraw/zinc/11/20/45/1138112045.db2.gz ILRUNIMYYMBUCQ-CQSZACIVSA-N 1 0 328.416 3.875 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@]1(C)CCOC2(CCC2)C1 ZINC000886776451 1138138868 /nfs/dbraw/zinc/13/88/68/1138138868.db2.gz GOTQTPHKZQGABP-RDTXWAMCSA-N 1 0 348.443 3.993 20 5 EHBDRO C[C@@H]1C[C@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644279 1138239435 /nfs/dbraw/zinc/23/94/35/1138239435.db2.gz QVJALBYKUFALHM-HUUCEWRRSA-N 1 0 343.427 3.769 20 5 EHBDRO C[NH+](C)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000125466910 1138309338 /nfs/dbraw/zinc/30/93/38/1138309338.db2.gz BTFAVUIDFLIGMK-CQSZACIVSA-N 1 0 345.468 3.707 20 5 EHBDRO Cc1c(CN2CCc3c(cnn3-c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000337372049 1138548247 /nfs/dbraw/zinc/54/82/47/1138548247.db2.gz WWWLTEGAIDFTFB-UHFFFAOYSA-N 1 0 348.406 3.647 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1COC2(CCCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000777316144 1139577184 /nfs/dbraw/zinc/57/71/84/1139577184.db2.gz RSGAYGHEGXUSJG-PBHICJAKSA-N 1 0 334.416 3.711 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313944 1139583308 /nfs/dbraw/zinc/58/33/08/1139583308.db2.gz SBUIGHYUTUAKNH-MNCVFJLESA-N 1 0 348.443 3.876 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000178205806 1139679413 /nfs/dbraw/zinc/67/94/13/1139679413.db2.gz LFYMIPKFVTTWKQ-LLVKDONJSA-N 1 0 333.413 3.562 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H](C)c1ccccc1 ZINC000181358203 1139901736 /nfs/dbraw/zinc/90/17/36/1139901736.db2.gz QQPSDHNIIJXLIK-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C[S@](C)=O)c1ccccc1 ZINC000183176760 1140018312 /nfs/dbraw/zinc/01/83/12/1140018312.db2.gz ZLAKVNTXIXQVGM-OSDILXSKSA-N 1 0 346.452 3.674 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@H](C)c1nccs1 ZINC000184004029 1140073124 /nfs/dbraw/zinc/07/31/24/1140073124.db2.gz DHEDWPUIICLGAF-LBPRGKRZSA-N 1 0 335.429 3.686 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419790 1140255009 /nfs/dbraw/zinc/25/50/09/1140255009.db2.gz VKNPKYQIIMLSQJ-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192723994 1140546416 /nfs/dbraw/zinc/54/64/16/1140546416.db2.gz HMAYABNBDWIFCQ-BFUOFWGJSA-N 1 0 326.396 3.815 20 5 EHBDRO COC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000192994578 1140558758 /nfs/dbraw/zinc/55/87/58/1140558758.db2.gz UMBOREFCTZYDQF-OALUTQOASA-N 1 0 326.396 3.950 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)c2sccc2C[NH+](C)C)cc1[N+](=O)[O-] ZINC000268181695 1140899181 /nfs/dbraw/zinc/89/91/81/1140899181.db2.gz WLCOKEDRDUBHEE-GFCCVEGCSA-N 1 0 347.440 3.517 20 5 EHBDRO CCOCCCC[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000271163817 1141315980 /nfs/dbraw/zinc/31/59/80/1141315980.db2.gz SJSOCPKLKOBHDC-CQSZACIVSA-N 1 0 326.462 3.872 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccccn1 ZINC000271203308 1141324342 /nfs/dbraw/zinc/32/43/42/1141324342.db2.gz ZREUEPQOUIPANT-CQSZACIVSA-N 1 0 331.441 3.693 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2Cn2cnc3ccccc32)cs1 ZINC000271410728 1141360627 /nfs/dbraw/zinc/36/06/27/1141360627.db2.gz PHGACGZJPLIXPC-AWEZNQCLSA-N 1 0 342.424 3.671 20 5 EHBDRO C[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000271562450 1141398460 /nfs/dbraw/zinc/39/84/60/1141398460.db2.gz WBJNJPDVSNYGHO-KBPBESRZSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000274470350 1141538077 /nfs/dbraw/zinc/53/80/77/1141538077.db2.gz OFWBAMKSGGPBKY-OAHLLOKOSA-N 1 0 326.396 3.639 20 5 EHBDRO COc1cc(C)c([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1OC ZINC000283256948 1141579860 /nfs/dbraw/zinc/57/98/60/1141579860.db2.gz VTYNJFHSANYKID-GFCCVEGCSA-N 1 0 348.374 3.910 20 5 EHBDRO Cc1ccccc1[C@@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246844009 1014259692 /nfs/dbraw/zinc/25/96/92/1014259692.db2.gz KNTSUMGVDXLVHI-HUUCEWRRSA-N 1 0 326.400 3.546 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153893982 1014484471 /nfs/dbraw/zinc/48/44/71/1014484471.db2.gz DOONYQSNLXFHDE-NWDGAFQWSA-N 1 0 347.415 3.880 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C[C@H]1CCCO1)C1CCCC1 ZINC000430215918 1015045619 /nfs/dbraw/zinc/04/56/19/1015045619.db2.gz DHZSZBAXZHFAAR-QGZVFWFLSA-N 1 0 334.416 3.527 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430219874 1015089145 /nfs/dbraw/zinc/08/91/45/1015089145.db2.gz ODSXFXQTKIQRGJ-SFHVURJKSA-N 1 0 342.395 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CCC(F)(F)CC2)c1 ZINC000535620264 1015709913 /nfs/dbraw/zinc/70/99/13/1015709913.db2.gz IYBWZQDHTKRAJL-UHFFFAOYSA-N 1 0 336.285 3.864 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)n1 ZINC000247132401 1016597709 /nfs/dbraw/zinc/59/77/09/1016597709.db2.gz VPEOTBVGWDMZPF-CZUORRHYSA-N 1 0 346.456 3.855 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)O1 ZINC000414515915 1016949752 /nfs/dbraw/zinc/94/97/52/1016949752.db2.gz OCSJDXOHGSVJNY-NFAWXSAZSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1nn(C)c2ccccc12 ZINC000547832181 1016999813 /nfs/dbraw/zinc/99/98/13/1016999813.db2.gz UJFBBXBNZMNLKL-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000181520265 1017022461 /nfs/dbraw/zinc/02/24/61/1017022461.db2.gz VWSBSWCPKBGUDX-LSDHHAIUSA-N 1 0 341.411 3.705 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2[NH2+]CC[C@@H]3CCCC[C@H]23)n1 ZINC000904604346 1032153923 /nfs/dbraw/zinc/15/39/23/1032153923.db2.gz QEYCSSCYRNESIC-VBNZEHGJSA-N 1 0 342.399 3.794 20 5 EHBDRO C[C@H]([NH2+]CCN1CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000538174773 1032196101 /nfs/dbraw/zinc/19/61/01/1032196101.db2.gz DOCBOROEWIWEGX-HNNXBMFYSA-N 1 0 325.412 3.698 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@@H]1OC ZINC000538194814 1032212431 /nfs/dbraw/zinc/21/24/31/1032212431.db2.gz MJEREIDZCSSXQV-FMKPAKJESA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000449121744 1032216098 /nfs/dbraw/zinc/21/60/98/1032216098.db2.gz IVKNOMPNIZOEGW-BLLLJJGKSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1cc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])ccc1C ZINC000449162979 1032278170 /nfs/dbraw/zinc/27/81/70/1032278170.db2.gz KXNTYZGJQYVBSL-HNNXBMFYSA-N 1 0 328.412 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC[NH+](C3CCC3)CC1)CCC2 ZINC000278745112 1032281375 /nfs/dbraw/zinc/28/13/75/1032281375.db2.gz NOEGGZYHTVRXHR-LJQANCHMSA-N 1 0 329.444 3.579 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449188187 1032282331 /nfs/dbraw/zinc/28/23/31/1032282331.db2.gz NOXGTUICMSMXSI-GUYCJALGSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](C[C@H]2CCOC2)c2ccccc2)cc1F ZINC000278746236 1032291292 /nfs/dbraw/zinc/29/12/92/1032291292.db2.gz WTGCZHRXNOOWDM-CRAIPNDOSA-N 1 0 344.386 3.991 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)CC(C)(C)C ZINC000536835372 1032330690 /nfs/dbraw/zinc/33/06/90/1032330690.db2.gz YBBHYYTTZGQAOP-ZIAGYGMSSA-N 1 0 340.489 3.852 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000536856861 1032354358 /nfs/dbraw/zinc/35/43/58/1032354358.db2.gz GYJLXIZCJXMAMO-LSDHHAIUSA-N 1 0 344.411 3.764 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000449251089 1032358190 /nfs/dbraw/zinc/35/81/90/1032358190.db2.gz QSGBNJMILMKJQN-GUXCAODWSA-N 1 0 341.455 3.807 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000459643072 1032363751 /nfs/dbraw/zinc/36/37/51/1032363751.db2.gz UDRCDUHSADLGPR-LBPRGKRZSA-N 1 0 335.354 3.769 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000449327429 1032439936 /nfs/dbraw/zinc/43/99/36/1032439936.db2.gz DIOSLYPGNWWXIB-OAHLLOKOSA-N 1 0 340.423 3.856 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCCc3nn(C)cc32)cc1[N+](=O)[O-] ZINC000376759395 1017093043 /nfs/dbraw/zinc/09/30/43/1017093043.db2.gz URRJYNDRSSIUBT-MRXNPFEDSA-N 1 0 328.416 3.619 20 5 EHBDRO Cc1cc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449401459 1032523762 /nfs/dbraw/zinc/52/37/62/1032523762.db2.gz HCVQZJTUUPQPPN-FUHWJXTLSA-N 1 0 325.412 3.799 20 5 EHBDRO CC(C)([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc(F)c(F)c1 ZINC000537134794 1032531412 /nfs/dbraw/zinc/53/14/12/1032531412.db2.gz JGUFKXAXRSOLBL-UHFFFAOYSA-N 1 0 336.338 3.777 20 5 EHBDRO CC[C@@H]1CCC[C@H]1C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449433209 1032549322 /nfs/dbraw/zinc/54/93/22/1032549322.db2.gz LEKSDSYLYWPJLW-UWWQBHOKSA-N 1 0 342.443 3.834 20 5 EHBDRO CO[C@@](C)(C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449483168 1032634882 /nfs/dbraw/zinc/63/48/82/1032634882.db2.gz GVEIBNBAKOXNGG-KXBFYZLASA-N 1 0 328.412 3.677 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CF)CCOCC2)o1 ZINC000449483590 1032632245 /nfs/dbraw/zinc/63/22/45/1032632245.db2.gz BAXNABYPXYLCJN-UHFFFAOYSA-N 1 0 348.374 3.711 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1O ZINC000190052774 1017265492 /nfs/dbraw/zinc/26/54/92/1017265492.db2.gz CJIMKUAUUMBZER-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO CC[NH2+][C@H](C)CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414952114 1017350895 /nfs/dbraw/zinc/35/08/95/1017350895.db2.gz ICMOTKKFJVDWQH-CYBMUJFWSA-N 1 0 347.390 3.614 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1CN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000728686681 1017381142 /nfs/dbraw/zinc/38/11/42/1017381142.db2.gz VTKUWNZWQYSCGS-INIZCTEOSA-N 1 0 349.450 3.822 20 5 EHBDRO C[NH2+]CCCN(C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000415124879 1017586911 /nfs/dbraw/zinc/58/69/11/1017586911.db2.gz CVVPJXUSPSCVGQ-UHFFFAOYSA-N 1 0 347.390 3.568 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccsc1[N+](=O)[O-] ZINC000610285213 1017661478 /nfs/dbraw/zinc/66/14/78/1017661478.db2.gz PNKBZQBEYRPYEL-OAHLLOKOSA-N 1 0 331.441 3.615 20 5 EHBDRO COc1ccc(C[NH+]2CCC(OCC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000177479027 1017678861 /nfs/dbraw/zinc/67/88/61/1017678861.db2.gz OUMVMWSOUIPDNH-UHFFFAOYSA-N 1 0 348.443 3.775 20 5 EHBDRO CC[C@@H](C)C[N@H+](C)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000341022504 1017781022 /nfs/dbraw/zinc/78/10/22/1017781022.db2.gz ZXMMVFXIQQVCLL-SNVBAGLBSA-N 1 0 332.347 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC=C(c3ccccn3)C2)cc1 ZINC000593995140 1032729684 /nfs/dbraw/zinc/72/96/84/1032729684.db2.gz OXMBACLLURCQLC-UHFFFAOYSA-N 1 0 339.395 3.548 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H](C)O ZINC000449545700 1032736950 /nfs/dbraw/zinc/73/69/50/1032736950.db2.gz UCLODQUDXLHCEM-WBMJQRKESA-N 1 0 348.374 3.775 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(CCC[NH3+])CC1CCCC1 ZINC000415489219 1018093010 /nfs/dbraw/zinc/09/30/10/1018093010.db2.gz WQFMXNHSIMVIPQ-UHFFFAOYSA-N 1 0 348.447 3.585 20 5 EHBDRO CC[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000341065961 1018390500 /nfs/dbraw/zinc/39/05/00/1018390500.db2.gz VKUZGRDBGNLKTG-SFHVURJKSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000610367959 1018536143 /nfs/dbraw/zinc/53/61/43/1018536143.db2.gz SAAWRGAYDFTKDR-BRWVUGGUSA-N 1 0 337.423 3.724 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC[C@H]1COc2ccccc2O1 ZINC000560908653 1018637550 /nfs/dbraw/zinc/63/75/50/1018637550.db2.gz LWSDNYIUAKYOHA-ZBFHGGJFSA-N 1 0 342.395 3.784 20 5 EHBDRO Cc1ccc(CC[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000610394376 1018724151 /nfs/dbraw/zinc/72/41/51/1018724151.db2.gz WECFGELNBTVQNO-UHFFFAOYSA-N 1 0 340.423 3.989 20 5 EHBDRO COc1cccc(N[C@@H]2C[C@H](C)[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000398111387 1018973223 /nfs/dbraw/zinc/97/32/23/1018973223.db2.gz DFSMWKCWEXNGRC-GOEBONIOSA-N 1 0 341.411 3.678 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182329513 1019064002 /nfs/dbraw/zinc/06/40/02/1019064002.db2.gz PFXCSDVMEBZKFF-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1c(CN2CC[C@H]([N@H+](C)Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000610433478 1019125735 /nfs/dbraw/zinc/12/57/35/1019125735.db2.gz NBGRSVXYGOLOOY-IBGZPJMESA-N 1 0 339.439 3.610 20 5 EHBDRO C[C@@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCC2)no1 ZINC000261697336 1019388240 /nfs/dbraw/zinc/38/82/40/1019388240.db2.gz HXFYYAXKYMLAKL-SNVBAGLBSA-N 1 0 334.401 3.559 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000119294469 1019906722 /nfs/dbraw/zinc/90/67/22/1019906722.db2.gz LNVVYNVYKYFIAO-PVAVHDDUSA-N 1 0 332.444 3.853 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000513656615 1019909790 /nfs/dbraw/zinc/90/97/90/1019909790.db2.gz VZGXZHWDAGMXPE-KRWDZBQOSA-N 1 0 328.416 3.588 20 5 EHBDRO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCCO1 ZINC000594040398 1032860926 /nfs/dbraw/zinc/86/09/26/1032860926.db2.gz FLAVSUSGIZRYLN-IRXDYDNUSA-N 1 0 345.399 3.687 20 5 EHBDRO CC(C)[NH2+][C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021817893 1020299590 /nfs/dbraw/zinc/29/95/90/1020299590.db2.gz RRKRQPKZDIIRHQ-MRXNPFEDSA-N 1 0 347.802 3.926 20 5 EHBDRO CCC[C@@H]([NH2+]CC[C@@H](OC)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000345497721 1020319321 /nfs/dbraw/zinc/31/93/21/1020319321.db2.gz ZVLLIPJWAGXFTG-ZIAGYGMSSA-N 1 0 334.338 3.993 20 5 EHBDRO OC[C@H](C[NH2+]Cc1c2ccccc2cc2ccccc21)[C@H]1CCOC1 ZINC000280361982 1020322030 /nfs/dbraw/zinc/32/20/30/1020322030.db2.gz UBORJXVNZCJESA-OALUTQOASA-N 1 0 335.447 3.728 20 5 EHBDRO CCC1(C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000513697666 1020475383 /nfs/dbraw/zinc/47/53/83/1020475383.db2.gz QKQWTQRLFJQKDZ-QGZVFWFLSA-N 1 0 342.443 3.978 20 5 EHBDRO CCC(C)(C)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501009921 1020645752 /nfs/dbraw/zinc/64/57/52/1020645752.db2.gz GECIJMWBGYYDQU-MRXNPFEDSA-N 1 0 333.432 3.824 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000413092220 1020680327 /nfs/dbraw/zinc/68/03/27/1020680327.db2.gz KUTCCMWTHRSAAQ-NSHDSACASA-N 1 0 346.353 3.541 20 5 EHBDRO CCC[NH+]1CCC(CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413103630 1020688972 /nfs/dbraw/zinc/68/89/72/1020688972.db2.gz LEUBEUOCOISKAK-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417366 1020818778 /nfs/dbraw/zinc/81/87/78/1020818778.db2.gz PSRKECAYOSWZQN-KRWDZBQOSA-N 1 0 336.395 3.700 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000361032301 1020891415 /nfs/dbraw/zinc/89/14/15/1020891415.db2.gz OREAQPCDRXTXAB-AWEZNQCLSA-N 1 0 329.400 3.536 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cnn(C(C)(C)C)c2C)cc1[N+](=O)[O-] ZINC000276356896 1021090121 /nfs/dbraw/zinc/09/01/21/1021090121.db2.gz MEMJKPVEPQYWAA-LBPRGKRZSA-N 1 0 346.431 3.714 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000426308141 1021227149 /nfs/dbraw/zinc/22/71/49/1021227149.db2.gz UVHWLXQKYWGESB-HOCLYGCPSA-N 1 0 343.402 3.972 20 5 EHBDRO CC(C)c1nc(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cs1 ZINC000602527073 1032963028 /nfs/dbraw/zinc/96/30/28/1032963028.db2.gz JLZOVEINKWBQDB-UHFFFAOYSA-N 1 0 346.412 3.648 20 5 EHBDRO CO[C@@H]([C@@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633671 1032965313 /nfs/dbraw/zinc/96/53/13/1032965313.db2.gz UQPIZIORFVPSQV-XIKOKIGWSA-N 1 0 330.384 3.758 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2cccc(C(F)(F)F)c2[N+](=O)[O-])CC1 ZINC000894847243 1021362623 /nfs/dbraw/zinc/36/26/23/1021362623.db2.gz ATCXIBULRLPJHO-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO C[C@]1(CCCO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000516478521 1021475509 /nfs/dbraw/zinc/47/55/09/1021475509.db2.gz KNLNCWWMIFGVOP-LJQANCHMSA-N 1 0 344.411 3.982 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3C[C@H]3C3CCCCC3)CC2)cn1 ZINC000602590537 1032988194 /nfs/dbraw/zinc/98/81/94/1032988194.db2.gz VXEJFQUPNHIYIA-ROUUACIJSA-N 1 0 344.459 3.517 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(C)(C(=O)OC(C)(C)C)CC1 ZINC000592525810 1033022242 /nfs/dbraw/zinc/02/22/42/1033022242.db2.gz UZEJZCXDWIGFEQ-UHFFFAOYSA-N 1 0 348.443 3.847 20 5 EHBDRO CC(C)[N@H+](Cc1cn2ccnc2s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891626262 1022147655 /nfs/dbraw/zinc/14/76/55/1022147655.db2.gz XDADVPRHOHLXPV-UHFFFAOYSA-N 1 0 330.413 3.715 20 5 EHBDRO Cc1nc(CCNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)cs1 ZINC000302157355 1022159551 /nfs/dbraw/zinc/15/95/51/1022159551.db2.gz JAFLVSVUOQGFIL-UHFFFAOYSA-N 1 0 328.397 3.871 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC(C)(C)[C@@H]3CCC[C@H]32)cccc1[N+](=O)[O-] ZINC000550079250 1022360948 /nfs/dbraw/zinc/36/09/48/1022360948.db2.gz KSBMYMARPMGBNT-RHSMWYFYSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548336455 1022376413 /nfs/dbraw/zinc/37/64/13/1022376413.db2.gz JTMBQUVGXPWYQY-LSDHHAIUSA-N 1 0 340.427 3.678 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000441424529 1022462724 /nfs/dbraw/zinc/46/27/24/1022462724.db2.gz IVMYTRMCMZNUPY-OAHLLOKOSA-N 1 0 328.412 3.709 20 5 EHBDRO CCCc1cccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000425971366 1022510289 /nfs/dbraw/zinc/51/02/89/1022510289.db2.gz OOTOEIUVZOKFIO-UHFFFAOYSA-N 1 0 328.416 3.581 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@@H]1O ZINC000438346716 1022585377 /nfs/dbraw/zinc/58/53/77/1022585377.db2.gz LUYVSZYBKOPLMU-KRWDZBQOSA-N 1 0 346.452 3.916 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC3(CCCC3)C2)c([N+](=O)[O-])cc1OC ZINC000438369527 1022600985 /nfs/dbraw/zinc/60/09/85/1022600985.db2.gz YQRWAWXPTPJRPZ-UHFFFAOYSA-N 1 0 334.416 3.768 20 5 EHBDRO CCSCC[C@@H](C)[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184264148 1022678986 /nfs/dbraw/zinc/67/89/86/1022678986.db2.gz MTDPJXCVFOAZGU-LLVKDONJSA-N 1 0 330.425 3.706 20 5 EHBDRO COCC1(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602701000 1033091250 /nfs/dbraw/zinc/09/12/50/1033091250.db2.gz PQTLNGYACWEVJL-UHFFFAOYSA-N 1 0 332.322 3.520 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449717911 1033092625 /nfs/dbraw/zinc/09/26/25/1033092625.db2.gz FIKUEQYMCJRHHQ-GOEBONIOSA-N 1 0 334.460 3.693 20 5 EHBDRO CCC(F)(F)C(C)(C)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602724584 1033110742 /nfs/dbraw/zinc/11/07/42/1033110742.db2.gz HTUYWXLLCPUCKM-UHFFFAOYSA-N 1 0 327.331 3.897 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](O)C[C@@H]1c1ccccc1 ZINC000602729766 1033117026 /nfs/dbraw/zinc/11/70/26/1033117026.db2.gz CLMOGNKHTAMATJ-RTBURBONSA-N 1 0 326.396 3.601 20 5 EHBDRO Cn1cc(C[NH2+]C2(c3cccc(Cl)c3)CCCC2)c([N+](=O)[O-])n1 ZINC000602803275 1033176318 /nfs/dbraw/zinc/17/63/18/1033176318.db2.gz BMMXDCBENQIVQH-UHFFFAOYSA-N 1 0 334.807 3.541 20 5 EHBDRO COc1cc(C[N@H+](C)C[C@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000514103225 1024134529 /nfs/dbraw/zinc/13/45/29/1024134529.db2.gz ANBYODPNHVEAQY-AWEZNQCLSA-N 1 0 344.411 3.848 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000514176642 1024201010 /nfs/dbraw/zinc/20/10/10/1024201010.db2.gz SQNCQEZVSKNKDW-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCOCCOc2ccccc2)cc1[N+](=O)[O-] ZINC000538277021 1024287701 /nfs/dbraw/zinc/28/77/01/1024287701.db2.gz WUJGRVSMYGWRGH-MRXNPFEDSA-N 1 0 344.411 3.649 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](OCc2ccncc2)C1 ZINC000280899673 1024411489 /nfs/dbraw/zinc/41/14/89/1024411489.db2.gz DSUPKIIDKRLVOC-YJBOKZPZSA-N 1 0 341.411 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)nc1 ZINC000025370923 1024732335 /nfs/dbraw/zinc/73/23/35/1024732335.db2.gz MQMZHNLIRQNNGR-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO CCc1nc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000157053129 1024741617 /nfs/dbraw/zinc/74/16/17/1024741617.db2.gz OKTNIHHXPKWFCV-MRXNPFEDSA-N 1 0 345.468 3.767 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)o1 ZINC000895843993 1024891327 /nfs/dbraw/zinc/89/13/27/1024891327.db2.gz KXBZGBSLIKLNMI-KDOFPFPSSA-N 1 0 342.395 3.856 20 5 EHBDRO CCCCNC(=O)C1([NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CCCCC1 ZINC000428084554 1024964074 /nfs/dbraw/zinc/96/40/74/1024964074.db2.gz OQMNVCZZMJOHDO-UHFFFAOYSA-N 1 0 347.459 3.612 20 5 EHBDRO CCn1nc(C)c(CN(C)[C@H](C)c2cc([N+](=O)[O-])ccc2C)c1C ZINC000602926405 1033256526 /nfs/dbraw/zinc/25/65/26/1033256526.db2.gz PQTKFDPOKHYZCQ-CQSZACIVSA-N 1 0 330.432 3.929 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000539304857 1025073129 /nfs/dbraw/zinc/07/31/29/1025073129.db2.gz PVAKYJPZSMVHKE-QGZVFWFLSA-N 1 0 348.834 3.966 20 5 EHBDRO Cc1nc(CC[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)c(C)o1 ZINC000346816004 1025144316 /nfs/dbraw/zinc/14/43/16/1025144316.db2.gz DAJWZOGKAZFKHQ-UHFFFAOYSA-N 1 0 341.367 3.792 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237363605 1025179128 /nfs/dbraw/zinc/17/91/28/1025179128.db2.gz JBBUPGYHQQDVBY-GDBMZVCRSA-N 1 0 342.443 3.911 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]CCOc1cccc([N+](=O)[O-])c1 ZINC000157879178 1025184275 /nfs/dbraw/zinc/18/42/75/1025184275.db2.gz JGNDSRGICDQKLU-CYBMUJFWSA-N 1 0 346.431 3.584 20 5 EHBDRO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000515392847 1025202811 /nfs/dbraw/zinc/20/28/11/1025202811.db2.gz BOJFNZMLJZMNNF-HUUCEWRRSA-N 1 0 340.427 3.514 20 5 EHBDRO Cc1cc(N2C[C@H]([NH+]3CCCC3)C[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000515392848 1025203708 /nfs/dbraw/zinc/20/37/08/1025203708.db2.gz BOJFNZMLJZMNNF-LSDHHAIUSA-N 1 0 340.427 3.514 20 5 EHBDRO CC(=O)c1ccc(NC2CCC(C)([NH+]3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000896255009 1025286579 /nfs/dbraw/zinc/28/65/79/1025286579.db2.gz MDVAQWNYGHRDRJ-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO CCN(Cc1ccccn1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000119857537 1025339248 /nfs/dbraw/zinc/33/92/48/1025339248.db2.gz RPYDNFPVIXKCHC-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2ccccc2Cl)[NH+]2CCCC2)cn1 ZINC000521504251 1025441785 /nfs/dbraw/zinc/44/17/85/1025441785.db2.gz DOWMJJHFKHRXME-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]CC1Cc2ccccc2C1 ZINC000521701100 1025608465 /nfs/dbraw/zinc/60/84/65/1025608465.db2.gz ADKYQFHBERVHTB-UHFFFAOYSA-N 1 0 330.815 3.795 20 5 EHBDRO CCSCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000281895195 1025647205 /nfs/dbraw/zinc/64/72/05/1025647205.db2.gz FHRKGJNOGPGDCZ-UHFFFAOYSA-N 1 0 337.470 3.951 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000487423003 1025672338 /nfs/dbraw/zinc/67/23/38/1025672338.db2.gz VEJMGQQWTSVOJI-IRXDYDNUSA-N 1 0 347.462 3.991 20 5 EHBDRO CC(C)[NH+](CCCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(C)C ZINC000436401472 1025683442 /nfs/dbraw/zinc/68/34/42/1025683442.db2.gz PPRVNLVYIMWOTH-UHFFFAOYSA-N 1 0 348.369 3.929 20 5 EHBDRO Cc1cc(NCc2nccn2CC(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302160356 1025849055 /nfs/dbraw/zinc/84/90/55/1025849055.db2.gz JQEVITYVCYUMGD-UHFFFAOYSA-N 1 0 339.399 3.916 20 5 EHBDRO CCOC[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000474921288 1025858223 /nfs/dbraw/zinc/85/82/23/1025858223.db2.gz BRZGPVLFIBFAKE-ZFWWWQNUSA-N 1 0 326.824 3.586 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063417 1025948102 /nfs/dbraw/zinc/94/81/02/1025948102.db2.gz SXSUOJOGLYPKTA-MNOVXSKESA-N 1 0 336.775 3.775 20 5 EHBDRO C[N@H+](CCCOCc1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000511107658 1026026362 /nfs/dbraw/zinc/02/63/62/1026026362.db2.gz LJOAPCZAZZTRPP-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO COCCOc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000478492543 1026127329 /nfs/dbraw/zinc/12/73/29/1026127329.db2.gz NZVFPWOJHFVHDN-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)sc1C ZINC000127683011 1026314748 /nfs/dbraw/zinc/31/47/48/1026314748.db2.gz ZTXQMEAIRAVJIC-INIZCTEOSA-N 1 0 345.468 3.822 20 5 EHBDRO CCOC[C@@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000475197890 1026376965 /nfs/dbraw/zinc/37/69/65/1026376965.db2.gz ZEMZRSKYHAVLEH-SWLSCSKDSA-N 1 0 346.349 3.908 20 5 EHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000451955028 1026415462 /nfs/dbraw/zinc/41/54/62/1026415462.db2.gz ONSLEMHHASMHTA-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1cccc(N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000475394562 1026558114 /nfs/dbraw/zinc/55/81/14/1026558114.db2.gz WLWZULMALJSBFH-HZPDHXFCSA-N 1 0 347.459 3.694 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2cccc(F)c2)N(C)C)cc1[N+](=O)[O-] ZINC000479847523 1026852015 /nfs/dbraw/zinc/85/20/15/1026852015.db2.gz BQWDGSOQROSHRD-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1ccc2nccc(N3CC[C@H](Cc4nccs4)C3)c2c1 ZINC000897279632 1026878881 /nfs/dbraw/zinc/87/88/81/1026878881.db2.gz VHRHPPFKRODIBR-GFCCVEGCSA-N 1 0 340.408 3.669 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480080373 1026981931 /nfs/dbraw/zinc/98/19/31/1026981931.db2.gz GFGLCKFGCAXABE-OAHLLOKOSA-N 1 0 347.459 3.967 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CSCCc3ccccc32)cc1 ZINC000531704293 1027227777 /nfs/dbraw/zinc/22/77/77/1027227777.db2.gz UAFKAYORKGZBBO-SFHVURJKSA-N 1 0 328.437 3.758 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178652576 1027374544 /nfs/dbraw/zinc/37/45/44/1027374544.db2.gz BUWFDUQOMSHNAZ-MJGOQNOKSA-N 1 0 328.412 3.802 20 5 EHBDRO Cc1cc(N2CCC3(C2)CC[NH2+]CC3)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000420228871 1027408076 /nfs/dbraw/zinc/40/80/76/1027408076.db2.gz SEBFHHHFCYYZQA-UHFFFAOYSA-N 1 0 343.349 3.502 20 5 EHBDRO Cn1c2ccccc2nc1C(C)(C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000186576011 1027564342 /nfs/dbraw/zinc/56/43/42/1027564342.db2.gz IZDWEWSYRBKAHW-UHFFFAOYSA-N 1 0 338.411 3.549 20 5 EHBDRO COc1ccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178659897 1027620018 /nfs/dbraw/zinc/62/00/18/1027620018.db2.gz OPSPQHGBLUQKJB-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N2[C@H](C)CCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000178682925 1027871597 /nfs/dbraw/zinc/87/15/97/1027871597.db2.gz RLQIJHSZSDBTOM-XUWVNRHRSA-N 1 0 347.459 3.732 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CC[C@@H](C4CCCC4)C3)n2)c1 ZINC000420960213 1027930268 /nfs/dbraw/zinc/93/02/68/1027930268.db2.gz GLPDDEAHNBPUQK-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)Nc1ccc([C@@H](C)[NH3+])cc1 ZINC000422878449 1028010946 /nfs/dbraw/zinc/01/09/46/1028010946.db2.gz TVLQTTLMRGUTKR-CYBMUJFWSA-N 1 0 327.384 3.792 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)cc2C)c1 ZINC000909606001 1028055548 /nfs/dbraw/zinc/05/55/48/1028055548.db2.gz CCRMCYOQEYQRJC-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ccccc1[C@@H]1CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000444610078 1028075088 /nfs/dbraw/zinc/07/50/88/1028075088.db2.gz NYXYVDSSNQSNTC-CQSZACIVSA-N 1 0 336.395 3.769 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(N3CCc4ccccc43)CC2)cc1 ZINC000502309234 1028106659 /nfs/dbraw/zinc/10/66/59/1028106659.db2.gz KLDCVYCKRWHPJN-UHFFFAOYSA-N 1 0 337.423 3.622 20 5 EHBDRO COc1cc(C[N@H+](C)CC2(c3ccccc3)CC2)c([N+](=O)[O-])cc1F ZINC000444670992 1028140006 /nfs/dbraw/zinc/14/00/06/1028140006.db2.gz HIQNUASHDZWAGT-UHFFFAOYSA-N 1 0 344.386 3.906 20 5 EHBDRO C[C@@]1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCc2ccccc21 ZINC000444671633 1028141654 /nfs/dbraw/zinc/14/16/54/1028141654.db2.gz ZWJJZKMXEFQSSB-LJQANCHMSA-N 1 0 336.395 3.812 20 5 EHBDRO C[C@]1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCCc2ccccc21 ZINC000444671631 1028142940 /nfs/dbraw/zinc/14/29/40/1028142940.db2.gz ZWJJZKMXEFQSSB-IBGZPJMESA-N 1 0 336.395 3.812 20 5 EHBDRO CCOC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCC1 ZINC000582952836 1028351582 /nfs/dbraw/zinc/35/15/82/1028351582.db2.gz GUEJGAXQHDONJQ-UHFFFAOYSA-N 1 0 344.358 3.635 20 5 EHBDRO C[C@H]1CCCC[C@H]1[NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000162344124 1028611019 /nfs/dbraw/zinc/61/10/19/1028611019.db2.gz JKENJBHNNHVYSI-XJKSGUPXSA-N 1 0 329.400 3.961 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000445255349 1028664896 /nfs/dbraw/zinc/66/48/96/1028664896.db2.gz SMZUGOOCBUVIBB-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO C[C@@H](CNc1ccc(Br)cc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000061591085 1028744484 /nfs/dbraw/zinc/74/44/84/1028744484.db2.gz UHMFOCYSHNOMPP-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H](C)N(C2CC2)C1 ZINC000504893860 1029038579 /nfs/dbraw/zinc/03/85/79/1029038579.db2.gz IQTMABBXSOMICH-RRFJBIMHSA-N 1 0 349.500 3.680 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](OC)C(C)C ZINC000504912269 1029056682 /nfs/dbraw/zinc/05/66/82/1029056682.db2.gz SZCYTJGCKTZDLF-HIFRSBDPSA-N 1 0 326.462 3.726 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926338 1029072855 /nfs/dbraw/zinc/07/28/55/1029072855.db2.gz IFXOJFJNEITEKA-JYJNAYRXSA-N 1 0 349.475 3.765 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513821041 1029522219 /nfs/dbraw/zinc/52/22/19/1029522219.db2.gz AXEMMGWPMLGEHO-BUIAKZPTSA-N 1 0 334.460 3.693 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cn2cc(C)ccc2n1 ZINC000583295210 1029577255 /nfs/dbraw/zinc/57/72/55/1029577255.db2.gz TWTRUMSCXBLOAA-OVCLIPMQSA-N 1 0 336.395 3.744 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ccsc2[N+](=O)[O-])CC1 ZINC000611764565 1029648257 /nfs/dbraw/zinc/64/82/57/1029648257.db2.gz CTKVGOBRJMKRFO-UHFFFAOYSA-N 1 0 325.478 3.995 20 5 EHBDRO CCCC[C@H]([NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000544414305 1029689862 /nfs/dbraw/zinc/68/98/62/1029689862.db2.gz BHCFKOUDUZSWQC-HIFRSBDPSA-N 1 0 333.432 3.870 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccccc2)C2CC2)c2c(c1)COCO2 ZINC000192501986 1029714757 /nfs/dbraw/zinc/71/47/57/1029714757.db2.gz MXTSZELMHJXYRT-SFHVURJKSA-N 1 0 340.379 3.702 20 5 EHBDRO C[C@@H](CCc1ccsc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446844736 1029824929 /nfs/dbraw/zinc/82/49/29/1029824929.db2.gz VPKRAFZRNJAKQR-NSHDSACASA-N 1 0 330.413 3.644 20 5 EHBDRO COC1CC[NH+](C2(CNc3cc(C)ccc3[N+](=O)[O-])CCCC2)CC1 ZINC000447049708 1029891819 /nfs/dbraw/zinc/89/18/19/1029891819.db2.gz WELFYXBJSJCVNP-UHFFFAOYSA-N 1 0 347.459 3.739 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000237948158 1030023227 /nfs/dbraw/zinc/02/32/27/1030023227.db2.gz COIVCIPXCDGSJC-MOTZXUDYSA-N 1 0 341.411 3.628 20 5 EHBDRO C[C@H](CCCCO)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453288604 1030030516 /nfs/dbraw/zinc/03/05/16/1030030516.db2.gz POEICHMGSDUQRY-DNVCBOLYSA-N 1 0 328.412 3.825 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1C ZINC000525709362 1030047923 /nfs/dbraw/zinc/04/79/23/1030047923.db2.gz VNFCZCWSPMQWII-HIFRSBDPSA-N 1 0 345.468 3.896 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000453340678 1030124052 /nfs/dbraw/zinc/12/40/52/1030124052.db2.gz HXMRYHUBEQEOPA-GMBSWORKSA-N 1 0 341.411 3.869 20 5 EHBDRO CCC[C@]1(COC)CCC[N@@H+]1Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000447403420 1030172585 /nfs/dbraw/zinc/17/25/85/1030172585.db2.gz ONBLECABKGVTNZ-QGZVFWFLSA-N 1 0 340.395 3.524 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000453367750 1030182479 /nfs/dbraw/zinc/18/24/79/1030182479.db2.gz MKRZPQMBHNLCGY-XKGZKEIXSA-N 1 0 344.455 3.809 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327134 1030265163 /nfs/dbraw/zinc/26/51/63/1030265163.db2.gz XWTWASJTLPYNLB-KDOFPFPSSA-N 1 0 342.443 3.823 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447537335 1030272633 /nfs/dbraw/zinc/27/26/33/1030272633.db2.gz VANHMOLEEKTGSM-ZWKOTPCHSA-N 1 0 342.443 3.724 20 5 EHBDRO Cc1ccc([C@H](C)C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447538419 1030274072 /nfs/dbraw/zinc/27/40/72/1030274072.db2.gz CAWQFZHYUPKJIB-KBAYOESNSA-N 1 0 342.443 3.977 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447563186 1030308996 /nfs/dbraw/zinc/30/89/96/1030308996.db2.gz OUDBPZCWIVUAPM-PXNSSMCTSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CCC2CC(F)(F)C2)c1 ZINC000453585043 1030376571 /nfs/dbraw/zinc/37/65/71/1030376571.db2.gz FTCQNKLGGZBVRY-UHFFFAOYSA-N 1 0 336.285 3.721 20 5 EHBDRO Cc1cc(N2CCO[C@@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000447814754 1030514669 /nfs/dbraw/zinc/51/46/69/1030514669.db2.gz BEHBMQMNLCJLCR-QGZVFWFLSA-N 1 0 329.400 3.703 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000160181250 1030583068 /nfs/dbraw/zinc/58/30/68/1030583068.db2.gz SNCBRMBXSDWGQM-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000482693576 1030643633 /nfs/dbraw/zinc/64/36/33/1030643633.db2.gz CBBQYKMNLNNPMU-UHFFFAOYSA-N 1 0 338.411 3.926 20 5 EHBDRO CN(C)C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776188 1030705036 /nfs/dbraw/zinc/70/50/36/1030705036.db2.gz TXLRGRAJRBHTFZ-YEODSOHDSA-N 1 0 343.402 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](c2ccco2)N2CCCCC2)cc1 ZINC000237981337 1030720534 /nfs/dbraw/zinc/72/05/34/1030720534.db2.gz IWMVHMXSUJCRHY-QGZVFWFLSA-N 1 0 329.400 3.505 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2c(C)cccc2[N+](=O)[O-])c1 ZINC000278431177 1030787897 /nfs/dbraw/zinc/78/78/97/1030787897.db2.gz DFKUPBOLYZQGGC-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1cc([C@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000550916480 1030795050 /nfs/dbraw/zinc/79/50/50/1030795050.db2.gz GXDJKMSNGADKAK-NSHDSACASA-N 1 0 335.791 3.545 20 5 EHBDRO CC(C)(CCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000080536236 1030903079 /nfs/dbraw/zinc/90/30/79/1030903079.db2.gz IBMGIWNVZTWXSG-UHFFFAOYSA-N 1 0 334.441 3.822 20 5 EHBDRO C[C@H]1CCCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000187926236 1030960990 /nfs/dbraw/zinc/96/09/90/1030960990.db2.gz UHRRCUJYQQGKEZ-AWEZNQCLSA-N 1 0 329.400 3.914 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1(O)CCCCCC1)C1CC1 ZINC000483149670 1031004060 /nfs/dbraw/zinc/00/40/60/1031004060.db2.gz GNTVKTNRSVJCDS-KRWDZBQOSA-N 1 0 332.444 3.591 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCN(C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177391 1031077983 /nfs/dbraw/zinc/07/79/83/1031077983.db2.gz YKLAVQXVDLWFLU-AZUAARDMSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)O[C@]2(CCCOC2)C1 ZINC000483340552 1031126250 /nfs/dbraw/zinc/12/62/50/1031126250.db2.gz KVHQGZVPPYLDNM-DNVCBOLYSA-N 1 0 348.443 3.624 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000161129107 1031346632 /nfs/dbraw/zinc/34/66/32/1031346632.db2.gz XBMJGNOFVHSSLF-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000161502251 1031576004 /nfs/dbraw/zinc/57/60/04/1031576004.db2.gz DGURAIKWTVKJPY-MJGOQNOKSA-N 1 0 328.412 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CCCCC34CC[NH2+]CC4)n2)cc1 ZINC000904080161 1031713395 /nfs/dbraw/zinc/71/33/95/1031713395.db2.gz XUBTXIKFZGZRPX-HNNXBMFYSA-N 1 0 342.399 3.672 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CC[C@H]4CCCC[C@H]4[NH2+]3)n2)s1 ZINC000904110277 1031735189 /nfs/dbraw/zinc/73/51/89/1031735189.db2.gz QVZGCMQWAYALEB-MXWKQRLJSA-N 1 0 334.401 3.690 20 5 EHBDRO C[N@@H+]1CC[C@@H](Cc2nc(-c3c4ccccc4nc4ccccc43)no2)C1 ZINC000904132214 1031769766 /nfs/dbraw/zinc/76/97/66/1031769766.db2.gz UQACGJSBJWXRBV-AWEZNQCLSA-N 1 0 344.418 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(CCO)CCCCC1)CCC2 ZINC000192941462 1031975037 /nfs/dbraw/zinc/97/50/37/1031975037.db2.gz PIUGJDIPVDMKJH-GOSISDBHSA-N 1 0 332.444 3.895 20 5 EHBDRO COCC1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000594509790 1033415291 /nfs/dbraw/zinc/41/52/91/1033415291.db2.gz HGZBWDALZYGBRU-SFHVURJKSA-N 1 0 326.396 3.700 20 5 EHBDRO Cc1nn(C[N@H+](C)CCCc2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761288926 1033456697 /nfs/dbraw/zinc/45/66/97/1033456697.db2.gz YFNPHZPSWDBCRR-UHFFFAOYSA-N 1 0 338.411 3.775 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(C/C(C)=C/c2cccc([N+](=O)[O-])c2)CC1 ZINC000594610778 1033475093 /nfs/dbraw/zinc/47/50/93/1033475093.db2.gz CNKNFUKAOUGTHA-DTQAZKPQSA-N 1 0 331.460 3.804 20 5 EHBDRO Nc1cccc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000594737195 1033511235 /nfs/dbraw/zinc/51/12/35/1033511235.db2.gz YRHDQUKMWQRQKQ-MAUKXSAKSA-N 1 0 325.412 3.678 20 5 EHBDRO Cn1ncc(C2CCC2)c1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000594928990 1033548744 /nfs/dbraw/zinc/54/87/44/1033548744.db2.gz IPZNVNUEDBIYMO-UHFFFAOYSA-N 1 0 342.443 3.708 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@H](C[NH+]3CCCCC3)C2)c1 ZINC000173867147 1033563674 /nfs/dbraw/zinc/56/36/74/1033563674.db2.gz ZWSDQTUINFBHCV-CQSZACIVSA-N 1 0 337.851 3.556 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccco1 ZINC000574822458 1033572600 /nfs/dbraw/zinc/57/26/00/1033572600.db2.gz HXLNCAWDZTWNGQ-FUHWJXTLSA-N 1 0 343.427 3.848 20 5 EHBDRO COC[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000594969938 1033576603 /nfs/dbraw/zinc/57/66/03/1033576603.db2.gz UOGVBCCKHWTWQL-YOCVDRLZSA-N 1 0 342.395 3.594 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])cc2OC(F)F)CC1 ZINC000760509617 1033577267 /nfs/dbraw/zinc/57/72/67/1033577267.db2.gz LSDHNNNIYDWABM-UHFFFAOYSA-N 1 0 343.374 3.507 20 5 EHBDRO COC1CC(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000594961716 1033600978 /nfs/dbraw/zinc/60/09/78/1033600978.db2.gz GTPCAEKCHOSZGG-UHFFFAOYSA-N 1 0 330.384 3.760 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)Cc1ccc(O)cc1 ZINC000595015584 1033607413 /nfs/dbraw/zinc/60/74/13/1033607413.db2.gz ZEVMRHQRCAKKKE-STQMWFEESA-N 1 0 330.384 3.591 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000598974651 1033623115 /nfs/dbraw/zinc/62/31/15/1033623115.db2.gz SJLVCABVAAZCSC-GFCCVEGCSA-N 1 0 345.399 3.567 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]CC3COC3)cc2[N+](=O)[O-])cc1 ZINC000599012170 1033645135 /nfs/dbraw/zinc/64/51/35/1033645135.db2.gz NYMWGHYZNISHEL-UHFFFAOYSA-N 1 0 344.436 3.790 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC[C@@H](COCc2ccccc2)C1 ZINC000173985891 1033663867 /nfs/dbraw/zinc/66/38/67/1033663867.db2.gz HECFSHWGWYJIHU-MRXNPFEDSA-N 1 0 344.386 3.773 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1Cc2ccccc2[C@@H]1OC ZINC000595050778 1033666921 /nfs/dbraw/zinc/66/69/21/1033666921.db2.gz KRWHSTKCQVBWDH-LLSQANQASA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1Cc3ccccc3CO1)CCC2 ZINC000599058390 1033695808 /nfs/dbraw/zinc/69/58/08/1033695808.db2.gz LHOBCOLJDTUCPE-AZUAARDMSA-N 1 0 338.407 3.703 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H]1CCCOC1 ZINC000599059614 1033698775 /nfs/dbraw/zinc/69/87/75/1033698775.db2.gz ZOGNPTJMJLEFMK-XYJFISCASA-N 1 0 332.444 3.712 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2Cc3ccccc3CO2)cccc1[N+](=O)[O-] ZINC000599060062 1033699030 /nfs/dbraw/zinc/69/90/30/1033699030.db2.gz MCVZZHYQPVEQNH-YOEHRIQHSA-N 1 0 326.396 3.695 20 5 EHBDRO CCCC[N@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000046773491 1033748145 /nfs/dbraw/zinc/74/81/45/1033748145.db2.gz SVFJMIHFHCVELL-UHFFFAOYSA-N 1 0 344.358 3.969 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(CCCn2ccnc2)CC1 ZINC000595425736 1033795240 /nfs/dbraw/zinc/79/52/40/1033795240.db2.gz LYRACRCNKOMOBW-UHFFFAOYSA-N 1 0 346.406 3.623 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2cc(C)cc(C)c2)c1 ZINC000593020572 1033825309 /nfs/dbraw/zinc/82/53/09/1033825309.db2.gz PCNKPFQNNHVKIQ-AWEZNQCLSA-N 1 0 342.395 3.849 20 5 EHBDRO CCC(C)(C)[N@H+](C)Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000491218120 1033928076 /nfs/dbraw/zinc/92/80/76/1033928076.db2.gz VDUYYRFHKONREE-UHFFFAOYSA-N 1 0 346.374 3.868 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNc2cccnc2[N+](=O)[O-])cc1 ZINC000603857853 1033980904 /nfs/dbraw/zinc/98/09/04/1033980904.db2.gz VQJKLBMHDSZLBK-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000603868401 1033993622 /nfs/dbraw/zinc/99/36/22/1033993622.db2.gz LHPRXFQRZJDXCB-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)CC(F)(F)F ZINC000596099814 1034061805 /nfs/dbraw/zinc/06/18/05/1034061805.db2.gz XQLOKWPXDWFOIR-NWDGAFQWSA-N 1 0 348.369 3.843 20 5 EHBDRO CCC[NH+]1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000612110189 1034061957 /nfs/dbraw/zinc/06/19/57/1034061957.db2.gz AZHAGPLOLMBDJM-UHFFFAOYSA-N 1 0 347.462 3.992 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C2CC2)cn1 ZINC000599697917 1034101098 /nfs/dbraw/zinc/10/10/98/1034101098.db2.gz INWDMRDWFMVBPE-SFHVURJKSA-N 1 0 327.384 3.548 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000119233631 1034118478 /nfs/dbraw/zinc/11/84/78/1034118478.db2.gz YCPFURRTVXLPNA-CQSZACIVSA-N 1 0 337.851 3.556 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@H+](CC3CC3)C2)ccc2ncccc21 ZINC000596571585 1034293802 /nfs/dbraw/zinc/29/38/02/1034293802.db2.gz XADIJVOQMCIRRA-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1Cc2cnn(C)c2CC(C)(C)C1 ZINC000596598339 1034314483 /nfs/dbraw/zinc/31/44/83/1034314483.db2.gz LTKVHVUFAPNFPF-AWEZNQCLSA-N 1 0 342.443 3.782 20 5 EHBDRO Cc1ccc([C@@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000596647740 1034345726 /nfs/dbraw/zinc/34/57/26/1034345726.db2.gz ALVLCPIDXBQGDW-ATZDWAIDSA-N 1 0 339.439 3.700 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](Oc2cccc(F)c2)C1 ZINC000612174540 1034378451 /nfs/dbraw/zinc/37/84/51/1034378451.db2.gz FTRCTTWJOZAUOI-UGSOOPFHSA-N 1 0 330.359 3.948 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](COC)C(C)C ZINC000534329517 1034404025 /nfs/dbraw/zinc/40/40/25/1034404025.db2.gz AZRZRRZRFZCPRM-KGLIPLIRSA-N 1 0 326.462 3.726 20 5 EHBDRO Cc1c(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000054355510 1034410598 /nfs/dbraw/zinc/41/05/98/1034410598.db2.gz QHPOIARBYBJAJR-ZDUSSCGKSA-N 1 0 348.447 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000054349131 1034410943 /nfs/dbraw/zinc/41/09/43/1034410943.db2.gz UHHYAFLGDGRLMO-CYBMUJFWSA-N 1 0 348.447 3.535 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCn2nccc21 ZINC000601321344 1034451950 /nfs/dbraw/zinc/45/19/50/1034451950.db2.gz PUXHRNJXDYUSMJ-UONOGXRCSA-N 1 0 346.456 3.787 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCc2ccccc2NC1=O ZINC000594511437 1034592506 /nfs/dbraw/zinc/59/25/06/1034592506.db2.gz NHIABZZVCMTQBF-ACJLOTCBSA-N 1 0 339.395 3.507 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000597206583 1034592550 /nfs/dbraw/zinc/59/25/50/1034592550.db2.gz RTODRXHTBFJMCQ-AZUAARDMSA-N 1 0 340.423 3.501 20 5 EHBDRO C[C@]12COC[C@H]1C[N@H+](Cc1ccc(-c3ccc([N+](=O)[O-])cc3)s1)C2 ZINC000597212091 1034597126 /nfs/dbraw/zinc/59/71/26/1034597126.db2.gz RPSMVSYVNXMZIZ-KDOFPFPSSA-N 1 0 344.436 3.792 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000597224939 1034625547 /nfs/dbraw/zinc/62/55/47/1034625547.db2.gz KUGSAPAOBKIGLN-KGLIPLIRSA-N 1 0 330.384 3.854 20 5 EHBDRO O=C(CC[NH2+]C1(c2ccccc2)CCC1)Nc1ccccc1[N+](=O)[O-] ZINC000411324010 1034860318 /nfs/dbraw/zinc/86/03/18/1034860318.db2.gz KPCIYVIKPFQFPN-UHFFFAOYSA-N 1 0 339.395 3.592 20 5 EHBDRO O=C(CC[NH2+][C@@H](c1cccs1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411446210 1034883950 /nfs/dbraw/zinc/88/39/50/1034883950.db2.gz AJYGGSNFOXOGLB-QGZVFWFLSA-N 1 0 345.424 3.726 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000450855931 1034898473 /nfs/dbraw/zinc/89/84/73/1034898473.db2.gz HRVJMHHUWWDRGR-HFBAOOFYSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000612465508 1034964111 /nfs/dbraw/zinc/96/41/11/1034964111.db2.gz MNTSUPUHBSTKBR-INIZCTEOSA-N 1 0 337.379 3.847 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@@H]1C ZINC000612530866 1035036483 /nfs/dbraw/zinc/03/64/83/1035036483.db2.gz ZBFSZOHKGMNFCC-PZROIBLQSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H]2CCO[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000431703019 1035296492 /nfs/dbraw/zinc/29/64/92/1035296492.db2.gz FFRLWRDJCZEOSH-IEBWSBKVSA-N 1 0 326.396 3.771 20 5 EHBDRO Cn1ccnc1[C@H](N[C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000580844564 1035459065 /nfs/dbraw/zinc/45/90/65/1035459065.db2.gz QNPJRONRJCKDQF-IEBWSBKVSA-N 1 0 348.406 3.695 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c(C)c1 ZINC000414084780 1035465279 /nfs/dbraw/zinc/46/52/79/1035465279.db2.gz XTJPXWGULLFYGL-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H](N2CCCC2=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000581380755 1035493201 /nfs/dbraw/zinc/49/32/01/1035493201.db2.gz DWRYRLGNDKMKOU-BQFCYCMXSA-N 1 0 345.443 3.569 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)C12CCC2 ZINC000581967308 1035662621 /nfs/dbraw/zinc/66/26/21/1035662621.db2.gz NDQWVNBNLWZVCO-QZTJIDSGSA-N 1 0 343.427 3.556 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389357 1035721426 /nfs/dbraw/zinc/72/14/26/1035721426.db2.gz IQQQROXKKQNDTB-WBMJQRKESA-N 1 0 334.803 3.502 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000588232505 1035831836 /nfs/dbraw/zinc/83/18/36/1035831836.db2.gz KJZUWEUZFHUZKN-BBRMVZONSA-N 1 0 348.830 3.983 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347454 1035922820 /nfs/dbraw/zinc/92/28/20/1035922820.db2.gz COJYULJOMAEZBW-CABCVRRESA-N 1 0 333.432 3.728 20 5 EHBDRO COC1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000180199223 1036172322 /nfs/dbraw/zinc/17/23/22/1036172322.db2.gz VVFMXEZUOULVHW-SFHVURJKSA-N 1 0 326.396 3.843 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000588928740 1036188689 /nfs/dbraw/zinc/18/86/89/1036188689.db2.gz OOVFUNJCDMWZMW-WMHVBEDNSA-N 1 0 346.814 3.627 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](c2cnn(C)c2)C(C)(C)C)ccc1[N+](=O)[O-] ZINC000492765748 1036266853 /nfs/dbraw/zinc/26/68/53/1036266853.db2.gz DNAJLSAWBXKTSF-KRWDZBQOSA-N 1 0 346.431 3.604 20 5 EHBDRO CCN(CC)c1ncc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000589183962 1036297291 /nfs/dbraw/zinc/29/72/91/1036297291.db2.gz YWCFZSGUYHQLNU-UHFFFAOYSA-N 1 0 348.472 3.572 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541545024 1036423274 /nfs/dbraw/zinc/42/32/74/1036423274.db2.gz HIBLNSCQMPDPIF-RBUKOAKNSA-N 1 0 346.427 3.980 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(CN2CCC[C@@H]2c2cccs2)c1 ZINC000589495341 1036437860 /nfs/dbraw/zinc/43/78/60/1036437860.db2.gz QBKWEDKSHSCMRY-OAHLLOKOSA-N 1 0 346.408 3.780 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1ccc(NC(N)=O)cc1 ZINC000165433944 1036557133 /nfs/dbraw/zinc/55/71/33/1036557133.db2.gz PRTXGXBNCBKYFA-STQMWFEESA-N 1 0 342.399 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000541691068 1036563657 /nfs/dbraw/zinc/56/36/57/1036563657.db2.gz URABNAIBUJMKBI-XEKQOVJPSA-N 1 0 342.395 3.646 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000539509365 1036849050 /nfs/dbraw/zinc/84/90/50/1036849050.db2.gz JOSOUODNYXFZNU-YJBOKZPZSA-N 1 0 346.471 3.694 20 5 EHBDRO CC(C)[C@](C)(O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528231 1036919346 /nfs/dbraw/zinc/91/93/46/1036919346.db2.gz KDLNFJOAUYJPJO-RTBURBONSA-N 1 0 328.412 3.681 20 5 EHBDRO Cc1cccc(NC2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000153046023 1036920902 /nfs/dbraw/zinc/92/09/02/1036920902.db2.gz FLACCCDLSXCWLX-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([S@@](C)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090220739 1036948911 /nfs/dbraw/zinc/94/89/11/1036948911.db2.gz QUERRIOMIHKXKL-UUOWRZLLSA-N 1 0 346.452 3.963 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000541999092 1036964271 /nfs/dbraw/zinc/96/42/71/1036964271.db2.gz VGLVYDOGEBNJNV-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000542049075 1037025413 /nfs/dbraw/zinc/02/54/13/1037025413.db2.gz QBNUFHDVKNYMBN-ZVZYQTTQSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1CCCC[C@H]1C ZINC000761520401 1037097840 /nfs/dbraw/zinc/09/78/40/1037097840.db2.gz FAYVCUCMLRBQLX-CHWSQXEVSA-N 1 0 325.840 3.601 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)C[C@H]1CC=CCC1 ZINC000542242642 1037206934 /nfs/dbraw/zinc/20/69/34/1037206934.db2.gz KOWUNHORRHGYDV-HNNXBMFYSA-N 1 0 331.416 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CC[C@@H](C4CCC4)C3)co2)cc1 ZINC000591063380 1037225560 /nfs/dbraw/zinc/22/55/60/1037225560.db2.gz SFICJGCAMYKMMA-OAHLLOKOSA-N 1 0 327.384 3.872 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCOCC(F)(F)F)CCCC2 ZINC000591347893 1037367824 /nfs/dbraw/zinc/36/78/24/1037367824.db2.gz PPKHKDDVRCYZHR-OAHLLOKOSA-N 1 0 346.349 3.921 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](CO)Cc1ccc(F)cc1 ZINC000532470081 1037405131 /nfs/dbraw/zinc/40/51/31/1037405131.db2.gz VGVSRXJLZACGDT-HOCLYGCPSA-N 1 0 346.402 3.544 20 5 EHBDRO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCCC1 ZINC000539992846 1037430507 /nfs/dbraw/zinc/43/05/07/1037430507.db2.gz IGWAQOCNNVXTNF-CQSZACIVSA-N 1 0 343.374 3.729 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c(C)s1 ZINC000171127831 1037468847 /nfs/dbraw/zinc/46/88/47/1037468847.db2.gz QASPOCQRZCGPHT-NSHDSACASA-N 1 0 348.424 3.990 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1C[C@H](F)CN1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591581105 1037516673 /nfs/dbraw/zinc/51/66/73/1037516673.db2.gz KTFBRVDYZWRVPY-AGIUHOORSA-N 1 0 349.431 3.674 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccncc2CC)ccc1[N+](=O)[O-] ZINC000491597674 1037578586 /nfs/dbraw/zinc/57/85/86/1037578586.db2.gz XZNGANVRGROYEY-CYBMUJFWSA-N 1 0 329.400 3.802 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN(C)Cc1ccc(F)cc1 ZINC000532550556 1037595265 /nfs/dbraw/zinc/59/52/65/1037595265.db2.gz QNWOESULDKDMHB-OAHLLOKOSA-N 1 0 345.418 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccc2c(c1)COC2)C1CC1 ZINC000540161167 1037620108 /nfs/dbraw/zinc/62/01/08/1037620108.db2.gz PQKCAYUQSWDGGG-IBGZPJMESA-N 1 0 338.407 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCC[C@H]3CCCCO3)CC2)cc1 ZINC000760907731 1037703310 /nfs/dbraw/zinc/70/33/10/1037703310.db2.gz RZZGXESQFCWSII-LJQANCHMSA-N 1 0 347.459 3.503 20 5 EHBDRO CC(C)CC1CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000760927712 1037825590 /nfs/dbraw/zinc/82/55/90/1037825590.db2.gz SZSUBVIOTJZVKV-UHFFFAOYSA-N 1 0 333.432 3.682 20 5 EHBDRO C[C@H](C[NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000897466203 1037877748 /nfs/dbraw/zinc/87/77/48/1037877748.db2.gz PRAYJKVXJYJGAT-MLGOLLRUSA-N 1 0 347.440 3.796 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000540395325 1037887835 /nfs/dbraw/zinc/88/78/35/1037887835.db2.gz RBJFFNUFRWBZPN-ZDUSSCGKSA-N 1 0 330.432 3.537 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1csc(C)c1 ZINC000592189442 1037927560 /nfs/dbraw/zinc/92/75/60/1037927560.db2.gz UWLYARMRSPBPNO-ZDUSSCGKSA-N 1 0 333.413 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc(CO)cc1)CCCC2 ZINC000592392980 1037934216 /nfs/dbraw/zinc/93/42/16/1037934216.db2.gz NTLZHNCQAYUZTB-LJQANCHMSA-N 1 0 326.396 3.644 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180722 1038149313 /nfs/dbraw/zinc/14/93/13/1038149313.db2.gz AHQOCJHQLSNDQH-HUUCEWRRSA-N 1 0 328.416 3.636 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000538760044 1038509587 /nfs/dbraw/zinc/50/95/87/1038509587.db2.gz NPJDZVPOWSSHTC-LSDHHAIUSA-N 1 0 347.459 3.513 20 5 EHBDRO CN(CCOc1ccc(F)cc1Cl)Cc1ccccc1[N+](=O)[O-] ZINC000538743201 1038509754 /nfs/dbraw/zinc/50/97/54/1038509754.db2.gz JVDSRCYSYLPJIL-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000538870306 1038575546 /nfs/dbraw/zinc/57/55/46/1038575546.db2.gz WYHPNMXYRMUQEG-UHFFFAOYSA-N 1 0 343.374 3.730 20 5 EHBDRO Cc1cc(N2CC[NH+](C3CCC3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461940155 1038687402 /nfs/dbraw/zinc/68/74/02/1038687402.db2.gz ZTPANEXTVPTPJH-UHFFFAOYSA-N 1 0 343.349 3.597 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290613 1038762771 /nfs/dbraw/zinc/76/27/71/1038762771.db2.gz ARCFYBURAKYVCX-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000479865981 1038842617 /nfs/dbraw/zinc/84/26/17/1038842617.db2.gz XJJAJVHHFMFDAE-LPHOPBHVSA-N 1 0 341.455 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccc3c1CCOC3)CCC2 ZINC000601304632 1038936226 /nfs/dbraw/zinc/93/62/26/1038936226.db2.gz QINBCWNRPLSESU-HXUWFJFHSA-N 1 0 338.407 3.835 20 5 EHBDRO C[C@H](C[NH2+]C[C@H](O)c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000905643268 1039025449 /nfs/dbraw/zinc/02/54/49/1039025449.db2.gz LGJOPDWSSQEFEC-PXAZEXFGSA-N 1 0 334.803 3.675 20 5 EHBDRO CCc1onc(C)c1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000927133238 1039128899 /nfs/dbraw/zinc/12/88/99/1039128899.db2.gz BBHPRSXCQBKQCQ-MRXNPFEDSA-N 1 0 329.400 3.966 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1CO ZINC000249068150 1039379751 /nfs/dbraw/zinc/37/97/51/1039379751.db2.gz JEGGOZVALSRULW-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1ccccc1F)[C@H](C)O ZINC000584634741 1039397203 /nfs/dbraw/zinc/39/72/03/1039397203.db2.gz JHDJPZBMCULTGG-TYILLQQXSA-N 1 0 346.402 3.767 20 5 EHBDRO C[C@@H]([NH2+]CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)c1cccnc1 ZINC000181622121 1039430267 /nfs/dbraw/zinc/43/02/67/1039430267.db2.gz AUVSFJJCXNNPLS-CYBMUJFWSA-N 1 0 338.367 3.538 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1NC1CC[NH+](C2CC2)CC1 ZINC000552907009 1039608177 /nfs/dbraw/zinc/60/81/77/1039608177.db2.gz MITXTDKCFWGNMP-UHFFFAOYSA-N 1 0 330.215 3.940 20 5 EHBDRO CC(C)[NH+]1CCC(N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417316982 1039658248 /nfs/dbraw/zinc/65/82/48/1039658248.db2.gz VMFYWFSWELJXCT-IBGZPJMESA-N 1 0 331.460 3.825 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000417308845 1039664184 /nfs/dbraw/zinc/66/41/84/1039664184.db2.gz FNVGNHKOLWSVIX-QGZVFWFLSA-N 1 0 331.441 3.960 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417313582 1039669045 /nfs/dbraw/zinc/66/90/45/1039669045.db2.gz WQLABOYEDPZAST-SFHVURJKSA-N 1 0 340.427 3.613 20 5 EHBDRO Cc1cccc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417333858 1039690338 /nfs/dbraw/zinc/69/03/38/1039690338.db2.gz QNLVHFGZAATGCS-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO CCOc1ncccc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417333881 1039692923 /nfs/dbraw/zinc/69/29/23/1039692923.db2.gz ZKSBBAVYUKELPY-GOSISDBHSA-N 1 0 341.411 3.946 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@@H]1COCc2ccccc21)C1CC1 ZINC000417364469 1039730607 /nfs/dbraw/zinc/73/06/07/1039730607.db2.gz MVUHVKZPWQPQJD-RBUKOAKNSA-N 1 0 338.407 3.777 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN1CCCCCC1 ZINC000480660232 1039824496 /nfs/dbraw/zinc/82/44/96/1039824496.db2.gz FJIVVIBNADVIOX-IRXDYDNUSA-N 1 0 333.476 3.770 20 5 EHBDRO Cn1ncc2ccc(C[NH2+][C@@H]3CCCc4ccc([N+](=O)[O-])cc43)cc21 ZINC000567533245 1040088061 /nfs/dbraw/zinc/08/80/61/1040088061.db2.gz DAOLORKRMNKMLU-GOSISDBHSA-N 1 0 336.395 3.649 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2ccc(F)cc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480907366 1040169638 /nfs/dbraw/zinc/16/96/38/1040169638.db2.gz ZJXIWTBXRVXBED-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CCC[C@H]1C[NH+]1CCCC1 ZINC000489880201 1040218721 /nfs/dbraw/zinc/21/87/21/1040218721.db2.gz DRRRRUCTXWBRBX-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128287124 1040289153 /nfs/dbraw/zinc/28/91/53/1040289153.db2.gz BAXAMESXXUOEJA-CHWSQXEVSA-N 1 0 337.395 3.573 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H](Nc2ccccc2)C1 ZINC000490064884 1040330136 /nfs/dbraw/zinc/33/01/36/1040330136.db2.gz IWGNVUAITJYTMZ-KRWDZBQOSA-N 1 0 341.411 3.550 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000490092146 1040353716 /nfs/dbraw/zinc/35/37/16/1040353716.db2.gz YVCISCVTMHAOBR-QGTPRVQTSA-N 1 0 348.443 3.629 20 5 EHBDRO CC[N@H+](CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000490191576 1040394963 /nfs/dbraw/zinc/39/49/63/1040394963.db2.gz UQENBBDXYNAWED-HXUWFJFHSA-N 1 0 339.439 3.758 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769533 1040425500 /nfs/dbraw/zinc/42/55/00/1040425500.db2.gz FFQDXJPJAMMJGN-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787133 1040443984 /nfs/dbraw/zinc/44/39/84/1040443984.db2.gz HEDIZDDHMCMDDG-WMLDXEAASA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000481184754 1040447918 /nfs/dbraw/zinc/44/79/18/1040447918.db2.gz TVVOPVFLNODLGR-GOEBONIOSA-N 1 0 333.432 3.790 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000092626565 1040463665 /nfs/dbraw/zinc/46/36/65/1040463665.db2.gz FWZRHNPMWZMTKO-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847069 1040575508 /nfs/dbraw/zinc/57/55/08/1040575508.db2.gz LQPGOCDWAWMIPC-OLZOCXBDSA-N 1 0 342.399 3.806 20 5 EHBDRO CC(C)[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487154084 1040726789 /nfs/dbraw/zinc/72/67/89/1040726789.db2.gz HFUIISXUJQBDQR-ZFWWWQNUSA-N 1 0 346.349 3.907 20 5 EHBDRO COc1cc(NCc2ccccc2C[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000174674419 1040914058 /nfs/dbraw/zinc/91/40/58/1040914058.db2.gz APAQBSWTQZOXJM-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCc3ccccc3[N+](=O)[O-])cccc21 ZINC000433205149 1041060739 /nfs/dbraw/zinc/06/07/39/1041060739.db2.gz BSEGZEBHZMDWOR-KRWDZBQOSA-N 1 0 327.384 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc(C[NH+]3CCCCC3)cc2)nc1 ZINC000015117540 1041249087 /nfs/dbraw/zinc/24/90/87/1041249087.db2.gz XRMDXHMFSWYLQL-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CN(C[C@H]1CCC3(CCCCC3)O1)CCO2 ZINC000571368350 1041295352 /nfs/dbraw/zinc/29/53/52/1041295352.db2.gz SDXVEXBQKNCHKH-QGZVFWFLSA-N 1 0 346.427 3.671 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000511745223 1041548858 /nfs/dbraw/zinc/54/88/58/1041548858.db2.gz ZCDPCMKDRABFBB-LLVKDONJSA-N 1 0 331.338 3.900 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000247201380 1041582569 /nfs/dbraw/zinc/58/25/69/1041582569.db2.gz CBFNYVDKCTXXDZ-PBFPGSCMSA-N 1 0 332.400 3.614 20 5 EHBDRO COC(=O)C(C)(C)[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283789 1042138819 /nfs/dbraw/zinc/13/88/19/1042138819.db2.gz IQTARADSKNIRTJ-HIFRSBDPSA-N 1 0 334.416 3.567 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000111177884 1042238003 /nfs/dbraw/zinc/23/80/03/1042238003.db2.gz CLGDZKOQRMFWHV-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([N@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311637 1042260890 /nfs/dbraw/zinc/26/08/90/1042260890.db2.gz XPFUJEKIFQLAKF-HNNXBMFYSA-N 1 0 347.440 3.748 20 5 EHBDRO CC[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000111384901 1042265349 /nfs/dbraw/zinc/26/53/49/1042265349.db2.gz QIFCAJDXUXNMIG-MRXNPFEDSA-N 1 0 338.791 3.759 20 5 EHBDRO CO[C@@H]1[C@H]2C[C@H]3C[N@H+](Cc4ccc(C(C)C)c([N+](=O)[O-])c4)[C@H]1[C@H]3C2 ZINC000567650797 1042459400 /nfs/dbraw/zinc/45/94/00/1042459400.db2.gz TZOUWMNTWZOKKR-NZMUHZMNSA-N 1 0 330.428 3.573 20 5 EHBDRO Cc1ccc(NC(=O)/C=C/c2cccc([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000072841124 1042604381 /nfs/dbraw/zinc/60/43/81/1042604381.db2.gz GWMLUWCDYZXZJQ-CSKARUKUSA-N 1 0 339.395 3.617 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC001167799437 1042700840 /nfs/dbraw/zinc/70/08/40/1042700840.db2.gz ZMGDHQPYHQJVRS-CJNGLKHVSA-N 1 0 334.416 3.782 20 5 EHBDRO C[C@@H]1CC[C@H](C)C[N@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072897483 1042764262 /nfs/dbraw/zinc/76/42/62/1042764262.db2.gz HYHHRJFHHWYJOS-UONOGXRCSA-N 1 0 329.400 3.913 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2ccnc2)cc1 ZINC000344065278 1043199524 /nfs/dbraw/zinc/19/95/24/1043199524.db2.gz OBJVQTAIQINSQQ-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000344099805 1043248662 /nfs/dbraw/zinc/24/86/62/1043248662.db2.gz YQLHTLIDTAQKDY-KRWDZBQOSA-N 1 0 326.396 3.949 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cnn1C ZINC000279209479 1043570882 /nfs/dbraw/zinc/57/08/82/1043570882.db2.gz YAJHMCQRQPFBNY-GTNSWQLSSA-N 1 0 328.416 3.710 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000107675340 1043756655 /nfs/dbraw/zinc/75/66/55/1043756655.db2.gz CPUAFUQSUNRXDU-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNCc1csc([N+](=O)[O-])c1 ZINC000236914593 1043981450 /nfs/dbraw/zinc/98/14/50/1043981450.db2.gz AKXYDQKONRTCTR-UHFFFAOYSA-N 1 0 333.457 3.788 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1cc([N+](=O)[O-])c[nH]1 ZINC000344446665 1044021174 /nfs/dbraw/zinc/02/11/74/1044021174.db2.gz ZODUPDSGRQGVJJ-UHFFFAOYSA-N 1 0 342.399 3.551 20 5 EHBDRO CC[C@H](O)CCC[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000344483596 1044063480 /nfs/dbraw/zinc/06/34/80/1044063480.db2.gz LUBFVFFVGOIRTK-ZDUSSCGKSA-N 1 0 348.399 3.504 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1C[C@H]1c1ccccc1 ZINC000236849576 1044188153 /nfs/dbraw/zinc/18/81/53/1044188153.db2.gz ASAIPUQWZZOJKS-YJBOKZPZSA-N 1 0 326.396 3.887 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NCc1ccc(C[NH+](C)C)c(F)c1 ZINC000342781902 1044192746 /nfs/dbraw/zinc/19/27/46/1044192746.db2.gz RBIRPTQAISPJPR-UHFFFAOYSA-N 1 0 347.390 3.554 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccccc1 ZINC000344746351 1044375436 /nfs/dbraw/zinc/37/54/36/1044375436.db2.gz MLFJRRVOBBDSCU-YJBOKZPZSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697753 1126856382 /nfs/dbraw/zinc/85/63/82/1126856382.db2.gz SIPRZQUQFUHMJU-HIFRSBDPSA-N 1 0 329.400 3.913 20 5 EHBDRO C[C@@H]1C[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)S1 ZINC000072771192 1126877798 /nfs/dbraw/zinc/87/77/98/1126877798.db2.gz DGRNNWVMYOGKEA-CHWSQXEVSA-N 1 0 347.440 3.618 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](c1ccccc1)C1CC1 ZINC000192501280 1126911913 /nfs/dbraw/zinc/91/19/13/1126911913.db2.gz XUHDVFXPOZBDCB-IBGZPJMESA-N 1 0 339.395 3.583 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283260 1127473380 /nfs/dbraw/zinc/47/33/80/1127473380.db2.gz PFKBJQOHBYXWMX-RYUDHWBXSA-N 1 0 341.839 3.943 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](O)C34CCCC4)o2)cc1 ZINC000552085209 1127579141 /nfs/dbraw/zinc/57/91/41/1127579141.db2.gz UFWFXSYEVSMERO-SFHVURJKSA-N 1 0 342.395 3.734 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+](C3CCCC3)C2)c2ncccc12 ZINC000301404589 1127741912 /nfs/dbraw/zinc/74/19/12/1127741912.db2.gz SSEKZXRKSRNZFI-ZDUSSCGKSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC(Cc3ccccc3CO)CC2)cs1 ZINC000347625060 1128151735 /nfs/dbraw/zinc/15/17/35/1128151735.db2.gz AZCZHOYDNDVFLN-UHFFFAOYSA-N 1 0 346.452 3.603 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCC[C@@H](C3CCOCC3)C2)cc1 ZINC001649111936 1128291067 /nfs/dbraw/zinc/29/10/67/1128291067.db2.gz GKXLLPZXJALEKQ-SJORKVTESA-N 1 0 348.443 3.549 20 5 EHBDRO Cc1ccnc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000301562905 1128497643 /nfs/dbraw/zinc/49/76/43/1128497643.db2.gz IWOZSXXQNCVHOU-WBVHZDCISA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000301558586 1128497102 /nfs/dbraw/zinc/49/71/02/1128497102.db2.gz TZEAJJYXLGIMGN-HNNXBMFYSA-N 1 0 335.423 3.826 20 5 EHBDRO CC[C@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC001168632974 1128506244 /nfs/dbraw/zinc/50/62/44/1128506244.db2.gz HAGCHJYIXSQBFE-KRWDZBQOSA-N 1 0 336.338 3.993 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301603656 1128521865 /nfs/dbraw/zinc/52/18/65/1128521865.db2.gz LFPCLLHSHBNHKS-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO Cc1nc2sccn2c1CN(C)Cc1ccc([N+](=O)[O-])cc1C ZINC000273428966 1128527129 /nfs/dbraw/zinc/52/71/29/1128527129.db2.gz KTXVYBLSPRYJHD-UHFFFAOYSA-N 1 0 330.413 3.553 20 5 EHBDRO Cc1nc(NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301618288 1128527558 /nfs/dbraw/zinc/52/75/58/1128527558.db2.gz CTVGMIACEGGSBE-ZDUSSCGKSA-N 1 0 328.416 3.840 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(=S)n(C[NH+](CC3CC3)CC3CC3)c2c1 ZINC000734477537 1131243161 /nfs/dbraw/zinc/24/31/61/1131243161.db2.gz GVEQCNDMDMFGDZ-UHFFFAOYSA-N 1 0 333.413 3.951 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000554067257 1128610509 /nfs/dbraw/zinc/61/05/09/1128610509.db2.gz PMRPVUISFWLFFT-KBPBESRZSA-N 1 0 348.830 3.983 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000338711793 1128733651 /nfs/dbraw/zinc/73/36/51/1128733651.db2.gz BOKOGGWIWFWHEU-UITAMQMPSA-N 1 0 348.406 3.643 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000327310352 1128767352 /nfs/dbraw/zinc/76/73/52/1128767352.db2.gz QGBFKKVIDVCWII-CQSZACIVSA-N 1 0 342.395 3.568 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCc3nccs3)o2)c1 ZINC001648993152 1120338083 /nfs/dbraw/zinc/33/80/83/1120338083.db2.gz XWHWHLRUNSORKO-UHFFFAOYSA-N 1 0 329.381 3.644 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+]C2(c3ccc(F)cc3)CCC2)c1 ZINC000609194326 1120543367 /nfs/dbraw/zinc/54/33/67/1120543367.db2.gz RBHSXUMCYLSHNE-UHFFFAOYSA-N 1 0 330.359 3.782 20 5 EHBDRO COC[C@H](CC(C)C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494516370 1120576967 /nfs/dbraw/zinc/57/69/67/1120576967.db2.gz TYOMGBYIUUWDRB-ZDUSSCGKSA-N 1 0 334.338 3.764 20 5 EHBDRO C[C@@H](CO)CCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494956149 1120914040 /nfs/dbraw/zinc/91/40/40/1120914040.db2.gz UHCZUWMOCCCTMC-BEFAXECRSA-N 1 0 328.412 3.682 20 5 EHBDRO CC(C)C[C@@H](CNc1ccc([N+](=O)[O-])cc1Br)[NH+](C)C ZINC000303011827 1121114936 /nfs/dbraw/zinc/11/49/36/1121114936.db2.gz RBJNGCJIINAUSD-LBPRGKRZSA-N 1 0 344.253 3.746 20 5 EHBDRO COc1ccc(CSCC[NH+](C(C)C)C(C)C)cc1[N+](=O)[O-] ZINC000762199467 1121167869 /nfs/dbraw/zinc/16/78/69/1121167869.db2.gz PORFBETXKIHILA-UHFFFAOYSA-N 1 0 326.462 3.955 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000495415770 1121178486 /nfs/dbraw/zinc/17/84/86/1121178486.db2.gz TXYGFFVOLHNJMP-LLVKDONJSA-N 1 0 348.786 3.870 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CC(C)(C)OC2(C)C)cc1[N+](=O)[O-] ZINC000495427639 1121186975 /nfs/dbraw/zinc/18/69/75/1121186975.db2.gz SINPBWCHBDNUQE-BLLLJJGKSA-N 1 0 336.432 3.990 20 5 EHBDRO COc1cccc([C@H](CNc2ccc([N+](=O)[O-])cc2)[NH+]2CCCC2)c1 ZINC000301056057 1121191366 /nfs/dbraw/zinc/19/13/66/1121191366.db2.gz JUODOELZXRVGDV-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO C[C@@H](CCSc1ccccc1)[N@@H+]1CCc2ncc([N+](=O)[O-])cc2C1 ZINC000495475335 1121225981 /nfs/dbraw/zinc/22/59/81/1121225981.db2.gz JQKYMYIMASFFAX-AWEZNQCLSA-N 1 0 343.452 3.919 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000495492507 1121231651 /nfs/dbraw/zinc/23/16/51/1121231651.db2.gz MLROMLWVTDXBJG-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)[C@@H]2CCCC[C@H]12 ZINC000915209643 1121253675 /nfs/dbraw/zinc/25/36/75/1121253675.db2.gz LXKJZHXWDJDXRQ-KBRIMQKVSA-N 1 0 328.416 3.803 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC000762634434 1121390512 /nfs/dbraw/zinc/39/05/12/1121390512.db2.gz PBBUJTREURDSHB-RTBURBONSA-N 1 0 326.396 3.855 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2c2ccccc2)c1 ZINC000762634423 1121392607 /nfs/dbraw/zinc/39/26/07/1121392607.db2.gz PBBUJTREURDSHB-MOPGFXCFSA-N 1 0 326.396 3.855 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301087853 1121533444 /nfs/dbraw/zinc/53/34/44/1121533444.db2.gz KEYUIKSVPRIXEO-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000193855409 1121722365 /nfs/dbraw/zinc/72/23/65/1121722365.db2.gz CSKRLVIBGUYMCU-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272575240 1121728913 /nfs/dbraw/zinc/72/89/13/1121728913.db2.gz WZRWMWFRLPBNDG-QRTARXTBSA-N 1 0 328.416 3.586 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2cc(F)ccc2[N+](=O)[O-])C2CC2)cc1 ZINC000194014062 1121752341 /nfs/dbraw/zinc/75/23/41/1121752341.db2.gz RAJUIEUSVUUCMI-GOSISDBHSA-N 1 0 330.359 3.983 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000194103362 1121780943 /nfs/dbraw/zinc/78/09/43/1121780943.db2.gz AVWYDMYSBXLZLY-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCC1CC[NH+](Cc2cccs2)CC1 ZINC000301165069 1122210333 /nfs/dbraw/zinc/21/03/33/1122210333.db2.gz BYFOLUIWPUQZDG-UHFFFAOYSA-N 1 0 346.456 3.684 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3ccc([N+](=O)[O-])c(C)c3)cc2)CC1 ZINC000917003648 1122435302 /nfs/dbraw/zinc/43/53/02/1122435302.db2.gz QPRYEYMRKOHHFF-UHFFFAOYSA-N 1 0 340.427 3.789 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccccc1)[NH+]1CCCC1 ZINC000301198248 1122449727 /nfs/dbraw/zinc/44/97/27/1122449727.db2.gz OVUFPOFNIDFBHF-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO CCCC[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](C)CC ZINC000917438451 1122602408 /nfs/dbraw/zinc/60/24/08/1122602408.db2.gz VEFJWLBSNUARMY-AWEZNQCLSA-N 1 0 331.420 3.711 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000301788531 1129069493 /nfs/dbraw/zinc/06/94/93/1129069493.db2.gz PWIIBULWHPASRI-SWLSCSKDSA-N 1 0 335.835 3.701 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(C(F)(F)F)CC2)cc1[N+](=O)[O-] ZINC000556919605 1123208519 /nfs/dbraw/zinc/20/85/19/1123208519.db2.gz GUZQHULDWVRMJR-SNVBAGLBSA-N 1 0 332.322 3.987 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCc3sccc3C2)cc1 ZINC000609323027 1123450613 /nfs/dbraw/zinc/45/06/13/1123450613.db2.gz RAEHJHXXTGVNFD-UHFFFAOYSA-N 1 0 332.425 3.874 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NC2CC[NH+](CC3CCCC3)CC2)c(F)c1 ZINC000301811855 1129127042 /nfs/dbraw/zinc/12/70/42/1129127042.db2.gz YFXSZGDMLYYBBW-UHFFFAOYSA-N 1 0 339.386 3.940 20 5 EHBDRO C[C@](O)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000609564519 1123609586 /nfs/dbraw/zinc/60/95/86/1123609586.db2.gz OBBSVNDSKXVKSX-KRWDZBQOSA-N 1 0 332.425 3.574 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672697 1123641748 /nfs/dbraw/zinc/64/17/48/1123641748.db2.gz XXCWCCCRXYAPRV-RDJZCZTQSA-N 1 0 326.396 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800494 1123664362 /nfs/dbraw/zinc/66/43/62/1123664362.db2.gz JYPGPRHONUBLLT-GOSISDBHSA-N 1 0 328.437 3.927 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000609891711 1123687576 /nfs/dbraw/zinc/68/75/76/1123687576.db2.gz GGBQDJNXZXMYNN-AWEZNQCLSA-N 1 0 326.828 3.566 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])N1CCC2(CCCC2)CC1 ZINC000610004340 1123712273 /nfs/dbraw/zinc/71/22/73/1123712273.db2.gz DYNZQJWLUNPPGG-AWEZNQCLSA-N 1 0 331.416 3.578 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1 ZINC000616357540 1123988092 /nfs/dbraw/zinc/98/80/92/1123988092.db2.gz ZPYKIGFYIWANDY-HOCLYGCPSA-N 1 0 342.443 3.889 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc(-n3cccn3)cc2)cccc1[N+](=O)[O-] ZINC000180842576 1124088744 /nfs/dbraw/zinc/08/87/44/1124088744.db2.gz LBTLDTQGFSCRRS-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000078635511 1129174787 /nfs/dbraw/zinc/17/47/87/1129174787.db2.gz JIQYWUVQQMMZRH-MRXNPFEDSA-N 1 0 328.368 3.607 20 5 EHBDRO CCc1nn(C)c(CC)c1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000090846003 1125002404 /nfs/dbraw/zinc/00/24/04/1125002404.db2.gz IFCMZLUCTZYZJM-CYBMUJFWSA-N 1 0 330.432 3.612 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000618197811 1125017327 /nfs/dbraw/zinc/01/73/27/1125017327.db2.gz AZBYWEZGZRZQLK-GIIHOQTISA-N 1 0 338.407 3.851 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000181840945 1125057902 /nfs/dbraw/zinc/05/79/02/1125057902.db2.gz IKSPYHAZTKOJRO-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCN1Cc3ccccc3C1)CCC2 ZINC000618566867 1125113594 /nfs/dbraw/zinc/11/35/94/1125113594.db2.gz MBXKKBLMUWMTJI-FQEVSTJZSA-N 1 0 337.423 3.578 20 5 EHBDRO CN1Cc2ccccc2[C@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000618572320 1125114794 /nfs/dbraw/zinc/11/47/94/1125114794.db2.gz TVPRCJXFFRPEMN-VQTJNVASSA-N 1 0 337.423 3.749 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1cccc(N(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000090850701 1125169601 /nfs/dbraw/zinc/16/96/01/1125169601.db2.gz RGLYEQXPKDWCRG-QGZVFWFLSA-N 1 0 328.416 3.687 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493203 1131352724 /nfs/dbraw/zinc/35/27/24/1131352724.db2.gz YGTATWMVBNCDRH-CPUCHLNUSA-N 1 0 335.423 3.571 20 5 EHBDRO Cc1c(C(=O)Nc2ccccc2Nc2cc[nH+]cc2)cccc1[N+](=O)[O-] ZINC000619582033 1125367912 /nfs/dbraw/zinc/36/79/12/1125367912.db2.gz VBSPBVXNDQVAGC-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCCC1 ZINC000182940940 1125406397 /nfs/dbraw/zinc/40/63/97/1125406397.db2.gz MPLMVYJDMFRYOO-GFCCVEGCSA-N 1 0 330.388 3.703 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(F)cc1 ZINC000301880076 1129252172 /nfs/dbraw/zinc/25/21/72/1129252172.db2.gz ZPLFHHVYMVASKC-IRXDYDNUSA-N 1 0 333.338 3.730 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301884962 1129261982 /nfs/dbraw/zinc/26/19/82/1129261982.db2.gz ZFBICBNHWZSNRL-OAHLLOKOSA-N 1 0 340.427 3.801 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602941 1129278094 /nfs/dbraw/zinc/27/80/94/1129278094.db2.gz OOZBPHORPQZRLD-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1ccccc1 ZINC000499668766 1129285299 /nfs/dbraw/zinc/28/52/99/1129285299.db2.gz FCGGSHRKTUWRRT-GOSISDBHSA-N 1 0 336.395 3.858 20 5 EHBDRO CN1CC[C@H](Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccc(F)c(F)c1 ZINC000301915218 1129345733 /nfs/dbraw/zinc/34/57/33/1129345733.db2.gz VGUKRBFFWXTONX-RDJZCZTQSA-N 1 0 333.338 3.730 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301914350 1129346067 /nfs/dbraw/zinc/34/60/67/1129346067.db2.gz IDPHIHWRZAUALQ-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070394 1129420785 /nfs/dbraw/zinc/42/07/85/1129420785.db2.gz YJQWGTIAHPTTAD-CYBMUJFWSA-N 1 0 331.372 3.518 20 5 EHBDRO C[C@H]([NH2+][C@H](c1ccccc1)C1CC1)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000012674622 1129451133 /nfs/dbraw/zinc/45/11/33/1129451133.db2.gz PCHGDBFDYKENHJ-SCLBCKFNSA-N 1 0 339.395 3.663 20 5 EHBDRO C[C@@H](C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000533263855 1129467719 /nfs/dbraw/zinc/46/77/19/1129467719.db2.gz QQXVEJIYQZCIFR-HNNXBMFYSA-N 1 0 341.411 3.659 20 5 EHBDRO Cc1ccc(CN(Cc2ccco2)C[C@@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436536 1129546004 /nfs/dbraw/zinc/54/60/04/1129546004.db2.gz MSLKURBLPVUAMC-KRWDZBQOSA-N 1 0 330.384 3.677 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000124338384 1129598935 /nfs/dbraw/zinc/59/89/35/1129598935.db2.gz BVZZSCMLHHMPPR-JTQLQIEISA-N 1 0 348.321 3.529 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000154964266 1129602035 /nfs/dbraw/zinc/60/20/35/1129602035.db2.gz WOADWVKXAQVIIQ-YOEHRIQHSA-N 1 0 329.400 3.676 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(C[NH2+][C@@H](Cc2ccccc2)C2CC2)c(F)c1 ZINC000509020815 1129656842 /nfs/dbraw/zinc/65/68/42/1129656842.db2.gz GRDCDMRLUZQMQK-SFHVURJKSA-N 1 0 332.350 3.984 20 5 EHBDRO Cc1nc2c(cccc2CC[NH2+]Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000922772650 1129659299 /nfs/dbraw/zinc/65/92/99/1129659299.db2.gz PSYIBOJRSURTIX-UHFFFAOYSA-N 1 0 325.368 3.685 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000922844760 1129691121 /nfs/dbraw/zinc/69/11/21/1129691121.db2.gz ZESQCZXUIVSJSO-MWLCHTKSSA-N 1 0 332.372 3.570 20 5 EHBDRO Cc1cc(NCCC(=O)OC(C)(C)C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302166487 1129771180 /nfs/dbraw/zinc/77/11/80/1129771180.db2.gz KXNIBXYOKAFHON-UHFFFAOYSA-N 1 0 331.372 3.595 20 5 EHBDRO Cc1nc(CN(C)c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)cs1 ZINC000302174971 1129771858 /nfs/dbraw/zinc/77/18/58/1129771858.db2.gz MQVKNXADGXZEKT-UHFFFAOYSA-N 1 0 328.397 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(-c3ccc(C[NH+]4CCCC4)cc3)n2)o1 ZINC000351151768 1129802216 /nfs/dbraw/zinc/80/22/16/1129802216.db2.gz VHBSDBTXKSGAHY-UHFFFAOYSA-N 1 0 340.339 3.501 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000766031317 1129854698 /nfs/dbraw/zinc/85/46/98/1129854698.db2.gz WVORTLDORGJWNP-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000132102759 1129875589 /nfs/dbraw/zinc/87/55/89/1129875589.db2.gz CFBOFYQGOWCHAU-RBUKOAKNSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[N@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000132094097 1129875734 /nfs/dbraw/zinc/87/57/34/1129875734.db2.gz SVPOATPLILJMFJ-HNNXBMFYSA-N 1 0 341.411 3.752 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@@H]2CCO[C@H]21 ZINC000245556734 1130237240 /nfs/dbraw/zinc/23/72/40/1130237240.db2.gz SDHAOCBRJSFQAQ-MWMOWRLXSA-N 1 0 344.455 3.709 20 5 EHBDRO C[C@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000246068367 1130339540 /nfs/dbraw/zinc/33/95/40/1130339540.db2.gz ZBHGKOVUIYECET-UONOGXRCSA-N 1 0 329.400 3.770 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@H]2[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000246201022 1130356064 /nfs/dbraw/zinc/35/60/64/1130356064.db2.gz WALCDVDUTBFCFG-XNRPHZJLSA-N 1 0 342.399 3.798 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000246352086 1130374731 /nfs/dbraw/zinc/37/47/31/1130374731.db2.gz HUUGRIKWGPMQOV-JVPBZIDWSA-N 1 0 325.412 3.691 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000246596483 1130394132 /nfs/dbraw/zinc/39/41/32/1130394132.db2.gz ZUSRWJPZZBESAI-ZQIUZPCESA-N 1 0 336.457 3.609 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H](c2nccs2)C1 ZINC000175147138 1130409786 /nfs/dbraw/zinc/40/97/86/1130409786.db2.gz WVUSJPJYJAZACI-ZDUSSCGKSA-N 1 0 347.440 3.830 20 5 EHBDRO CCC(CC)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+](C)C ZINC000731208437 1130779222 /nfs/dbraw/zinc/77/92/22/1130779222.db2.gz GKYRAGKEAWAVPJ-AWEZNQCLSA-N 1 0 336.461 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000731678489 1130830693 /nfs/dbraw/zinc/83/06/93/1130830693.db2.gz NGXNJWZLULUTFD-SFHVURJKSA-N 1 0 338.363 3.678 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@@H]1CCN1Cc1ccccc1 ZINC000716276185 1131447124 /nfs/dbraw/zinc/44/71/24/1131447124.db2.gz HLOPVCLOQYJZOG-KRWDZBQOSA-N 1 0 345.830 3.612 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@H]1C ZINC000740870793 1131551149 /nfs/dbraw/zinc/55/11/49/1131551149.db2.gz IMMFFGIVLRDOKA-VXGBXAGGSA-N 1 0 334.445 3.514 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)cn1 ZINC001172899174 1131882091 /nfs/dbraw/zinc/88/20/91/1131882091.db2.gz LNCAFJVIYCCKFD-MLGOLLRUSA-N 1 0 329.375 3.727 20 5 EHBDRO Cc1nc([C@@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cs1 ZINC001172899036 1131883084 /nfs/dbraw/zinc/88/30/84/1131883084.db2.gz LBNVLCVHHMRUCS-IAQYHMDHSA-N 1 0 331.441 3.958 20 5 EHBDRO Cc1ccccc1OCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900473 1131884355 /nfs/dbraw/zinc/88/43/55/1131884355.db2.gz UDFCEATYZQWEBD-GOSISDBHSA-N 1 0 340.423 3.819 20 5 EHBDRO CC1([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)Cc2ccccc2C1 ZINC001172904007 1131886451 /nfs/dbraw/zinc/88/64/51/1131886451.db2.gz UUNLBCMIHHFIBX-IBGZPJMESA-N 1 0 336.435 3.989 20 5 EHBDRO CCC1(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCOCC1 ZINC001172907253 1131887988 /nfs/dbraw/zinc/88/79/88/1131887988.db2.gz RMEQWUJKHJWIGS-KRWDZBQOSA-N 1 0 332.444 3.639 20 5 EHBDRO CCC[C@]1(C)CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000743407242 1131916910 /nfs/dbraw/zinc/91/69/10/1131916910.db2.gz RNVHQAANGZNINI-GOSISDBHSA-N 1 0 343.431 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1COc3ccc(F)cc31)CC2 ZINC001172912098 1131917691 /nfs/dbraw/zinc/91/76/91/1131917691.db2.gz LUNZOAYNQZYMAM-YJBOKZPZSA-N 1 0 342.370 3.705 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(N)cc1 ZINC001172911271 1131918010 /nfs/dbraw/zinc/91/80/10/1131918010.db2.gz IBDIWNOQBZUCMD-UGSOOPFHSA-N 1 0 325.412 3.775 20 5 EHBDRO C[C@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014069 1131936064 /nfs/dbraw/zinc/93/60/64/1131936064.db2.gz JJJVZGPDWFDUDB-LBPRGKRZSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CCC(F)(F)CC2)c1F ZINC001173174657 1131991387 /nfs/dbraw/zinc/99/13/87/1131991387.db2.gz AESMKYCRFVTIJB-JTQLQIEISA-N 1 0 346.349 3.841 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CC(c3ccccc3)C2)c1F ZINC001173194954 1131994822 /nfs/dbraw/zinc/99/48/22/1131994822.db2.gz BCUHXMLYIMWAMT-CYBMUJFWSA-N 1 0 344.386 3.773 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](Cc2ccco2)C2CC2)c1F ZINC001173194178 1131995273 /nfs/dbraw/zinc/99/52/73/1131995273.db2.gz YIZTWHWXYOVXBG-GFCCVEGCSA-N 1 0 348.374 3.931 20 5 EHBDRO COC(=O)c1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173216530 1132002108 /nfs/dbraw/zinc/00/21/08/1132002108.db2.gz CPKYOPAXZRMSSS-KBPBESRZSA-N 1 0 342.395 3.663 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001173219588 1132003561 /nfs/dbraw/zinc/00/35/61/1132003561.db2.gz DOQUWDGPIXOBRQ-RDTXWAMCSA-N 1 0 348.443 3.627 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC001173220379 1132004726 /nfs/dbraw/zinc/00/47/26/1132004726.db2.gz ZMCYLABZFVQHGD-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1cccc(CC2([NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173223325 1132004938 /nfs/dbraw/zinc/00/49/38/1132004938.db2.gz ICVHWUJMTOPTRV-OAHLLOKOSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](OCc2ccccc2)C1 ZINC001173225457 1132006657 /nfs/dbraw/zinc/00/66/57/1132006657.db2.gz CGAYBEKHFCWWEH-OXQOHEQNSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1ccccc1Cl ZINC001173225554 1132006896 /nfs/dbraw/zinc/00/68/96/1132006896.db2.gz RRROGRDBLGAUEU-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)c1ccc(F)cn1 ZINC001173225256 1132007238 /nfs/dbraw/zinc/00/72/38/1132007238.db2.gz REXODOMKIWVQBW-ZDUSSCGKSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CC2CCCCC2)CC1 ZINC001173229843 1132007897 /nfs/dbraw/zinc/00/78/97/1132007897.db2.gz VUKHOGGZKCZLOX-KRWDZBQOSA-N 1 0 345.487 3.724 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001173231907 1132008853 /nfs/dbraw/zinc/00/88/53/1132008853.db2.gz DMDFPERPPXTMGB-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccnc1C(F)(F)F ZINC001173235691 1132010688 /nfs/dbraw/zinc/01/06/88/1132010688.db2.gz ULSPYULDVOHGAR-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1C[C@H]([NH3+])C2 ZINC001173235491 1132010811 /nfs/dbraw/zinc/01/08/11/1132010811.db2.gz UDUVRFHFIPPALM-DZGCQCFKSA-N 1 0 335.407 3.779 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC001173213772 1132014682 /nfs/dbraw/zinc/01/46/82/1132014682.db2.gz KEYXXHCJYUDARP-HNNXBMFYSA-N 1 0 336.395 3.501 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@@H]2CCCC[C@H]2OCc2ccccc2)C1 ZINC001168958889 1132620044 /nfs/dbraw/zinc/62/00/44/1132620044.db2.gz RDRYBDZEEHHBPG-INDMIFKZSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](CC2CCOCC2)c2ccccc2)C1 ZINC001169003522 1132628792 /nfs/dbraw/zinc/62/87/92/1132628792.db2.gz NWMUHWHRCGLSIZ-NEWSRXKRSA-N 1 0 332.444 3.579 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038399 1132637241 /nfs/dbraw/zinc/63/72/41/1132637241.db2.gz YLFGDRTXIUVSHS-INWMFGNUSA-N 1 0 342.361 3.940 20 5 EHBDRO CC[N@H+](Cc1ccc(Br)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169040062 1132638665 /nfs/dbraw/zinc/63/86/65/1132638665.db2.gz XLGICOTYVBMQIY-DZGCQCFKSA-N 1 0 341.249 3.716 20 5 EHBDRO CCC1(CC)CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC001169431005 1132762003 /nfs/dbraw/zinc/76/20/03/1132762003.db2.gz PZHZJFVIIIZKTO-AWEZNQCLSA-N 1 0 333.432 3.824 20 5 EHBDRO COc1cccc(N2CCC[C@H]([NH3+])c3cc(C)ccc32)c1[N+](=O)[O-] ZINC001169696201 1132823861 /nfs/dbraw/zinc/82/38/61/1132823861.db2.gz KNGHKVHGYOTWCV-AWEZNQCLSA-N 1 0 327.384 3.844 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1F ZINC001176037134 1132826305 /nfs/dbraw/zinc/82/63/05/1132826305.db2.gz RFYBHTHBJAUJLH-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO [NH3+]Cc1ccn(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)c1 ZINC001169726325 1132826798 /nfs/dbraw/zinc/82/67/98/1132826798.db2.gz RZZNYNTZZGWNTA-UHFFFAOYSA-N 1 0 325.393 3.995 20 5 EHBDRO COc1ccc(Nc2cccc3c2OCC[C@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC001176362068 1132920902 /nfs/dbraw/zinc/92/09/02/1132920902.db2.gz RSNKWOCLYJCATA-OAHLLOKOSA-N 1 0 343.383 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc(Br)c(C[N@@H+]2CCCC23CCC3)c1 ZINC001176372589 1132924213 /nfs/dbraw/zinc/92/42/13/1132924213.db2.gz HUSOJLAAGRBZCH-UHFFFAOYSA-N 1 0 325.206 3.876 20 5 EHBDRO C[C@@]1(Cc2ccccc2)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937199 1133073044 /nfs/dbraw/zinc/07/30/44/1133073044.db2.gz YXRZKEPQVQGTDB-UXHICEINSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1 ZINC001178326161 1133160161 /nfs/dbraw/zinc/16/01/61/1133160161.db2.gz COIXWFBKJHLWSD-CYBMUJFWSA-N 1 0 349.793 3.756 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001417 1133241471 /nfs/dbraw/zinc/24/14/71/1133241471.db2.gz KODWAIVWIVCRNR-ROUUACIJSA-N 1 0 348.443 3.821 20 5 EHBDRO OCCO[C@H]1CCC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769384868 1133273950 /nfs/dbraw/zinc/27/39/50/1133273950.db2.gz XRFKCKXJMHNSDF-IBGZPJMESA-N 1 0 335.447 3.966 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H](O)C2CC2)s1 ZINC001179768499 1133277477 /nfs/dbraw/zinc/27/74/77/1133277477.db2.gz QADKHBYJAKNTHT-INIZCTEOSA-N 1 0 332.425 3.574 20 5 EHBDRO COC(=O)C[C@H]1C[N@H+](Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000769446988 1133291715 /nfs/dbraw/zinc/29/17/15/1133291715.db2.gz PVBBWFSJDAXAQY-SFHVURJKSA-N 1 0 349.430 3.757 20 5 EHBDRO CCCN(CC[NH+](CC)CC)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001180671764 1133399927 /nfs/dbraw/zinc/39/99/27/1133399927.db2.gz CEUHMGBILDXIDR-UHFFFAOYSA-N 1 0 327.856 3.802 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC001181871607 1133544183 /nfs/dbraw/zinc/54/41/83/1133544183.db2.gz XGSCIXHQTFCLGD-QGZVFWFLSA-N 1 0 334.803 3.900 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])OCC1CC1 ZINC001182395852 1133653138 /nfs/dbraw/zinc/65/31/38/1133653138.db2.gz ASYMUAVBNZMWDU-UHFFFAOYSA-N 1 0 346.349 3.908 20 5 EHBDRO O=C(CCc1c2ccccc2cc2ccccc21)N1CC[N@@H+]2CC[C@H]2C1 ZINC001182413876 1133656966 /nfs/dbraw/zinc/65/69/66/1133656966.db2.gz RRIHCINPEGFQDL-IBGZPJMESA-N 1 0 344.458 3.842 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC[C@@H](O)C1CCCC1 ZINC001183427908 1133805409 /nfs/dbraw/zinc/80/54/09/1133805409.db2.gz DGIKHXRVMAPZEJ-ILZDJORESA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCC2CC=CC2)cc1Br ZINC001183756236 1133856047 /nfs/dbraw/zinc/85/60/47/1133856047.db2.gz ZQYRXWAKLCBDQA-UHFFFAOYSA-N 1 0 331.235 3.865 20 5 EHBDRO C[C@@H]1C[C@H]1[C@@H]1C[C@H]1[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC001183885125 1133870347 /nfs/dbraw/zinc/87/03/47/1133870347.db2.gz DDCBYTUQDQTEEI-GPUHXXMPSA-N 1 0 331.235 3.553 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@@H](c1cccs1)[NH+](C)C ZINC000786574763 1133875917 /nfs/dbraw/zinc/87/59/17/1133875917.db2.gz PNWJPIKLQCFWFZ-HNNXBMFYSA-N 1 0 333.413 3.574 20 5 EHBDRO C[C@@H](C[C@@H]1CCOC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786925044 1133929999 /nfs/dbraw/zinc/92/99/99/1133929999.db2.gz FVPSCFRHKJRKKO-QWRGUYRKSA-N 1 0 332.322 3.518 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001184598668 1133963615 /nfs/dbraw/zinc/96/36/15/1133963615.db2.gz QKHVZPUQQUDYLF-CQSZACIVSA-N 1 0 334.464 3.791 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC001185097810 1134028184 /nfs/dbraw/zinc/02/81/84/1134028184.db2.gz DRHFDBUCSVYPNG-LBPRGKRZSA-N 1 0 349.460 3.666 20 5 EHBDRO CC(C)[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1ccnn1C ZINC000788074889 1134077372 /nfs/dbraw/zinc/07/73/72/1134077372.db2.gz GPXJTEVHVBBJHU-CQSZACIVSA-N 1 0 336.823 3.511 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000774877082 1134085648 /nfs/dbraw/zinc/08/56/48/1134085648.db2.gz VYKICJUBPXHKBK-ZDUSSCGKSA-N 1 0 329.356 3.739 20 5 EHBDRO C[N@H+](CCOc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788474715 1134129189 /nfs/dbraw/zinc/12/91/89/1134129189.db2.gz SNWCPZODEOOQOL-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000788795633 1134170560 /nfs/dbraw/zinc/17/05/60/1134170560.db2.gz AOYODKVMERTDQM-FASAQXTFSA-N 1 0 343.427 3.586 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc(F)cc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804997 1134172165 /nfs/dbraw/zinc/17/21/65/1134172165.db2.gz ZTVNEGCXUQXELO-NSHDSACASA-N 1 0 342.374 3.691 20 5 EHBDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774981595 1134176414 /nfs/dbraw/zinc/17/64/14/1134176414.db2.gz RASXMRULHYRVOE-KBXCAEBGSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788825764 1134178011 /nfs/dbraw/zinc/17/80/11/1134178011.db2.gz ZOKXQCYOEZJEII-MEBBXXQBSA-N 1 0 331.803 3.648 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccc(C)cc1 ZINC000775015557 1134211882 /nfs/dbraw/zinc/21/18/82/1134211882.db2.gz TVKBSXJESCWMTI-JVVYVMHDSA-N 1 0 326.396 3.630 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CC[N@@H+]2C2CCCCC2)ccc2cnccc21 ZINC001187063619 1134291735 /nfs/dbraw/zinc/29/17/35/1134291735.db2.gz KQQLRVQOHNTLFB-INIZCTEOSA-N 1 0 340.427 3.962 20 5 EHBDRO COc1ccc(C[C@@H](C)n2ccc3ccc(C[NH3+])cc32)c([N+](=O)[O-])c1 ZINC001170296685 1134737154 /nfs/dbraw/zinc/73/71/54/1134737154.db2.gz HNKNZRCKVANSJO-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO CCc1ccc(CC[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297014 1134737284 /nfs/dbraw/zinc/73/72/84/1134737284.db2.gz JZVRVXNEEGQCTJ-HNNXBMFYSA-N 1 0 342.439 3.929 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170298580 1134738181 /nfs/dbraw/zinc/73/81/81/1134738181.db2.gz MPIICRFTVBNPTF-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC001170299216 1134738232 /nfs/dbraw/zinc/73/82/32/1134738232.db2.gz SOUKEARGEWWGHV-LSDHHAIUSA-N 1 0 328.412 3.928 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3ccc(O)cc32)c([N+](=O)[O-])c1 ZINC001170312165 1134744560 /nfs/dbraw/zinc/74/45/60/1134744560.db2.gz DFCQQIBTFWISKU-KZULUSFZSA-N 1 0 342.395 3.517 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001170312739 1134745028 /nfs/dbraw/zinc/74/50/28/1134745028.db2.gz HLJLZRFJLPBMMW-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329062 1134748900 /nfs/dbraw/zinc/74/89/00/1134748900.db2.gz NVNNDWBXFAZDSU-KSSFIOAISA-N 1 0 341.411 3.767 20 5 EHBDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879228 1134810906 /nfs/dbraw/zinc/81/09/06/1134810906.db2.gz GPKSEPOWJBUJNU-UKRRQHHQSA-N 1 0 339.417 3.657 20 5 EHBDRO C[C@@]12CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C[C@@H]1C2(Cl)Cl ZINC000792916273 1134824275 /nfs/dbraw/zinc/82/42/75/1134824275.db2.gz XDQOEUWFYRKOPG-UONOGXRCSA-N 1 0 329.227 3.653 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192196258 1134977869 /nfs/dbraw/zinc/97/78/69/1134977869.db2.gz AZLOPFGKFAFTQW-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H](c2ccc(F)cc2F)C2CC2)c1 ZINC001192617516 1135040757 /nfs/dbraw/zinc/04/07/57/1135040757.db2.gz UPOSFOPNHBMSFY-QZTJIDSGSA-N 1 0 348.349 3.647 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](CC(C)C)c1ccccc1C ZINC001192791202 1135061263 /nfs/dbraw/zinc/06/12/63/1135061263.db2.gz HNSDYACLEXGVDW-QGZVFWFLSA-N 1 0 330.432 3.785 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1c([N+](=O)[O-])cccc1[N+](=O)[O-])c1ccco1 ZINC000804781930 1135199519 /nfs/dbraw/zinc/19/95/19/1135199519.db2.gz LBNHQALBKBOHIH-NEPJUHHUSA-N 1 0 348.359 3.637 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001195756179 1135461030 /nfs/dbraw/zinc/46/10/30/1135461030.db2.gz DFFWBIWYEWMNJC-PXAZEXFGSA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939164 1135486979 /nfs/dbraw/zinc/48/69/79/1135486979.db2.gz WXYJXKKZGOANJM-HZMBPMFUSA-N 1 0 347.242 3.885 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CCCSC[C@H]1C1CC1 ZINC001198270906 1135798455 /nfs/dbraw/zinc/79/84/55/1135798455.db2.gz SKZXLKIPADJJKB-HNNXBMFYSA-N 1 0 326.849 3.966 20 5 EHBDRO [NH3+]CCN(Cc1cccc(-c2ccccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000809736537 1135874577 /nfs/dbraw/zinc/87/45/77/1135874577.db2.gz YXLLQROUNSKDPA-UHFFFAOYSA-N 1 0 348.406 3.622 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(C(C)C)cc2)c([N+](=O)[O-])cc1O ZINC001199701689 1135924632 /nfs/dbraw/zinc/92/46/32/1135924632.db2.gz UPXDARDGSVJVBD-UHFFFAOYSA-N 1 0 330.384 3.722 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)c1ccco1 ZINC001199866243 1135935620 /nfs/dbraw/zinc/93/56/20/1135935620.db2.gz XAYBPSGTFMUYPP-GOSISDBHSA-N 1 0 345.443 3.977 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@@H](C3CCOCC3)C2)c1 ZINC001201822635 1136067563 /nfs/dbraw/zinc/06/75/63/1136067563.db2.gz OIVUYXQKAAWTAU-MSOLQXFVSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCC[C@@H](O)C1 ZINC000811481533 1136091639 /nfs/dbraw/zinc/09/16/39/1136091639.db2.gz FDWSICKOMNCOQE-JOYOIKCWSA-N 1 0 333.215 3.542 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1ccccc1O ZINC000811477513 1136097025 /nfs/dbraw/zinc/09/70/25/1136097025.db2.gz UHVOJGNUBWSJRW-UHFFFAOYSA-N 1 0 341.194 3.940 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(c3ccccc3)CC2)cc1 ZINC000776279734 1136134840 /nfs/dbraw/zinc/13/48/40/1136134840.db2.gz XJDBHXSBWMSTJL-LJQANCHMSA-N 1 0 326.396 3.508 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@]23OCCC[C@H]2C3(F)F)cc1[N+](=O)[O-] ZINC000850378230 1136245316 /nfs/dbraw/zinc/24/53/16/1136245316.db2.gz YXPPNPJDUKPPOX-CVEARBPZSA-N 1 0 340.370 3.622 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1COc2ccccc2C1 ZINC000850428997 1136256829 /nfs/dbraw/zinc/25/68/29/1136256829.db2.gz WNHDYTVWHTWLRC-KBPBESRZSA-N 1 0 342.395 3.505 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812850651 1136261287 /nfs/dbraw/zinc/26/12/87/1136261287.db2.gz XTGQUSPTOIHAER-AUUYWEPGSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@](C)(O)c1ccccc1 ZINC000850462395 1136264228 /nfs/dbraw/zinc/26/42/28/1136264228.db2.gz NYKQYMIBXZROPK-IFXJQAMLSA-N 1 0 344.411 3.552 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCCC[C@H]2c2ccccc2)c1 ZINC000776487381 1136304107 /nfs/dbraw/zinc/30/41/07/1136304107.db2.gz ZBYQSOBGOVGDIQ-XUVXKRRUSA-N 1 0 340.423 3.944 20 5 EHBDRO C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+](C2CCC2)C1 ZINC000813630981 1136354562 /nfs/dbraw/zinc/35/45/62/1136354562.db2.gz UBNPOWRDABKORH-GFCCVEGCSA-N 1 0 346.456 3.515 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216719537 1136378216 /nfs/dbraw/zinc/37/82/16/1136378216.db2.gz XKOPXSPGDSVWOT-CYBMUJFWSA-N 1 0 328.368 3.907 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](Cc2ccco2)C2CCCC2)cc1 ZINC000776578109 1136443489 /nfs/dbraw/zinc/44/34/89/1136443489.db2.gz DLDWMERNLVLFJB-GOSISDBHSA-N 1 0 330.384 3.666 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446118 1136456684 /nfs/dbraw/zinc/45/66/84/1136456684.db2.gz DJTQCZWZZCYTOG-ROUUACIJSA-N 1 0 332.375 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccn2)cc1 ZINC000852567115 1136467315 /nfs/dbraw/zinc/46/73/15/1136467315.db2.gz MPJZVHPROPNRIO-QFBILLFUSA-N 1 0 325.412 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2(c3ccc(Cl)cc3)CC2)cc1 ZINC000776606716 1136469853 /nfs/dbraw/zinc/46/98/53/1136469853.db2.gz ZZOKUGQEBBXDAF-MRXNPFEDSA-N 1 0 332.787 3.561 20 5 EHBDRO CC1(C)C[C@@]1([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000852771736 1136484922 /nfs/dbraw/zinc/48/49/22/1136484922.db2.gz CJUMNAUDOWEHOP-IEBWSBKVSA-N 1 0 326.396 3.543 20 5 EHBDRO Cc1cccc(OC[C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815563456 1136611241 /nfs/dbraw/zinc/61/12/41/1136611241.db2.gz CKFNSZVDMWPBMJ-UONOGXRCSA-N 1 0 329.400 3.604 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000815577290 1136613267 /nfs/dbraw/zinc/61/32/67/1136613267.db2.gz MAVAFKMOAPDNSM-KBXCAEBGSA-N 1 0 342.443 3.964 20 5 EHBDRO Cc1ccc(OCCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815572473 1136617880 /nfs/dbraw/zinc/61/78/80/1136617880.db2.gz DQQHONGYDVNFNO-CQSZACIVSA-N 1 0 329.400 3.605 20 5 EHBDRO C[C@@H](CCOCc1ccccc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626504 1136620834 /nfs/dbraw/zinc/62/08/34/1136620834.db2.gz FUUJOOBRZXTTRG-GJZGRUSLSA-N 1 0 343.427 3.823 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000776753788 1136643244 /nfs/dbraw/zinc/64/32/44/1136643244.db2.gz GYDDVGSMQSCXRL-KKUMJFAQSA-N 1 0 349.431 3.502 20 5 EHBDRO CC1(C)CCC[C@@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816641197 1136743534 /nfs/dbraw/zinc/74/35/34/1136743534.db2.gz LBPLEUHLBTZYJV-OAHLLOKOSA-N 1 0 347.242 3.932 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173316979 1136745765 /nfs/dbraw/zinc/74/57/65/1136745765.db2.gz KIVYZPGADGTVRD-CVEARBPZSA-N 1 0 325.412 3.772 20 5 EHBDRO C[C@@H](CC[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000856812960 1136814624 /nfs/dbraw/zinc/81/46/24/1136814624.db2.gz BAVPNKUYJJVICH-LEJCZOIISA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3(c4ccccc4)CC3)CC2)cc1 ZINC000776967849 1136907710 /nfs/dbraw/zinc/90/77/10/1136907710.db2.gz HQRBYZQJAMZZMD-UHFFFAOYSA-N 1 0 337.423 3.843 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000819143112 1136913073 /nfs/dbraw/zinc/91/30/73/1136913073.db2.gz ZTCYCHIHZNGWGO-NJZAAPMLSA-N 1 0 346.349 3.587 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(Cl)cc1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000820664144 1137000271 /nfs/dbraw/zinc/00/02/71/1137000271.db2.gz JKDUGQGBNIBGJG-UHFFFAOYSA-N 1 0 341.814 3.842 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000824799032 1137152820 /nfs/dbraw/zinc/15/28/20/1137152820.db2.gz JKIXDWQAUKMERW-BLLLJJGKSA-N 1 0 326.824 3.789 20 5 EHBDRO [NH3+][C@@H]1CCc2c3ccccc3n(-c3cc([N+](=O)[O-])cc4cc[nH]c43)c2C1 ZINC001171093612 1137185467 /nfs/dbraw/zinc/18/54/67/1137185467.db2.gz LHLCEMPWKAZQKF-CYBMUJFWSA-N 1 0 346.390 3.836 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@]2(CC2(F)F)C1 ZINC000844436974 1137222706 /nfs/dbraw/zinc/22/27/06/1137222706.db2.gz JXOIIJQSHFYJTJ-HNNXBMFYSA-N 1 0 326.343 3.615 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3c(Cl)cncc3[N+](=O)[O-])c2c1 ZINC001171167502 1137278181 /nfs/dbraw/zinc/27/81/81/1137278181.db2.gz GIYXYGDDRLTFAW-NSHDSACASA-N 1 0 344.802 3.785 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000846190126 1137340812 /nfs/dbraw/zinc/34/08/12/1137340812.db2.gz SKPHYQWOVYZHOT-ZOCIIQOWSA-N 1 0 328.412 3.932 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866282126 1137342548 /nfs/dbraw/zinc/34/25/48/1137342548.db2.gz XVMUOGYPXLMNCZ-NSHDSACASA-N 1 0 335.379 3.568 20 5 EHBDRO CC(C)OC1CCC([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866309985 1137344294 /nfs/dbraw/zinc/34/42/94/1137344294.db2.gz RMNSSRLMDGWTKE-IGEOTXOUSA-N 1 0 338.423 3.991 20 5 EHBDRO C[C@@H](CCc1cccnc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000866336488 1137347008 /nfs/dbraw/zinc/34/70/08/1137347008.db2.gz KEXIXCNYLQYUOX-ZDUSSCGKSA-N 1 0 333.819 3.797 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000866538588 1137362983 /nfs/dbraw/zinc/36/29/83/1137362983.db2.gz CPYRACVLQGETCZ-HNNXBMFYSA-N 1 0 341.411 3.719 20 5 EHBDRO C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308941 1137408630 /nfs/dbraw/zinc/40/86/30/1137408630.db2.gz VDKSTEAYKZWVOI-UKRRQHHQSA-N 1 0 334.416 3.537 20 5 EHBDRO Cc1cccc(C)c1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000773066855 1137462878 /nfs/dbraw/zinc/46/28/78/1137462878.db2.gz FSZQZXFAUWKMAB-UHFFFAOYSA-N 1 0 339.439 3.970 20 5 EHBDRO C[C@H]1CN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC[N@@H+](C2CCC2)C1 ZINC000795122227 1137492929 /nfs/dbraw/zinc/49/29/29/1137492929.db2.gz QUPKPWHXWIJCLP-ZDUSSCGKSA-N 1 0 337.851 3.554 20 5 EHBDRO C[C@@H]1C[N@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001171741355 1137511086 /nfs/dbraw/zinc/51/10/86/1137511086.db2.gz NMLIPYJQUVXDPC-OAHLLOKOSA-N 1 0 326.396 3.635 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017905 1137564726 /nfs/dbraw/zinc/56/47/26/1137564726.db2.gz GUWQZFMHHLPXOD-XHDPSFHLSA-N 1 0 337.420 3.749 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(N(C)C)nc1 ZINC000872020307 1137565119 /nfs/dbraw/zinc/56/51/19/1137565119.db2.gz FRLVYVBQCOFBON-LBPRGKRZSA-N 1 0 346.456 3.629 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCn1ccnc1C ZINC000872037394 1137566839 /nfs/dbraw/zinc/56/68/39/1137566839.db2.gz BIYTXWKRIFTKGV-CYBMUJFWSA-N 1 0 348.472 3.953 20 5 EHBDRO C[C@H](C[C@H](O)c1cccs1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042356 1137567217 /nfs/dbraw/zinc/56/72/17/1137567217.db2.gz BUBHINSOYIXJBU-SUNKGSAMSA-N 1 0 338.404 3.958 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc(C)cn1 ZINC000872077436 1137570064 /nfs/dbraw/zinc/57/00/64/1137570064.db2.gz IHWIPTYCDCGRCR-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1 ZINC000872086900 1137570534 /nfs/dbraw/zinc/57/05/34/1137570534.db2.gz CASCTAWVXQNKIH-PXAZEXFGSA-N 1 0 348.374 3.781 20 5 EHBDRO C[C@@H](CC(=O)N(C)c1ccccc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129787 1137573128 /nfs/dbraw/zinc/57/31/28/1137573128.db2.gz TZLRSULDVHQSIH-GJZGRUSLSA-N 1 0 341.411 3.687 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000873128821 1137590728 /nfs/dbraw/zinc/59/07/28/1137590728.db2.gz AOTIAWVRPFZVIT-DNVCBOLYSA-N 1 0 341.411 3.617 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cnccc1C(F)(F)F ZINC000873139877 1137591166 /nfs/dbraw/zinc/59/11/66/1137591166.db2.gz GSEQCDMOVIGMNG-UHFFFAOYSA-N 1 0 339.317 3.915 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000877099157 1137670161 /nfs/dbraw/zinc/67/01/61/1137670161.db2.gz IVZUYRKIHGNKIM-QWQCLYJRSA-N 1 0 326.400 3.507 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000877690647 1137685955 /nfs/dbraw/zinc/68/59/55/1137685955.db2.gz SFTCZVDFBYXXSI-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 ZINC000126717087 1137689137 /nfs/dbraw/zinc/68/91/37/1137689137.db2.gz QFRRFGZFIZSMRV-SKDRFNHKSA-N 1 0 326.805 3.694 20 5 EHBDRO COCC(C)(C)CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000877803149 1137690414 /nfs/dbraw/zinc/69/04/14/1137690414.db2.gz DXLZVNLVFQZDFO-UHFFFAOYSA-N 1 0 334.338 3.766 20 5 EHBDRO CC[N@@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)CC(C)C ZINC000877958158 1137697065 /nfs/dbraw/zinc/69/70/65/1137697065.db2.gz ICSHCYDHCWUKMV-UHFFFAOYSA-N 1 0 338.795 3.776 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+](C2CC2)C2CCCCC2)o1 ZINC000877965561 1137697432 /nfs/dbraw/zinc/69/74/32/1137697432.db2.gz XFLKFHNGXHVUCE-UHFFFAOYSA-N 1 0 342.399 3.942 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351737 1137712180 /nfs/dbraw/zinc/71/21/80/1137712180.db2.gz YYYORIHGIMNKLG-VXGBXAGGSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H]2CCCC[C@@H]12 ZINC000878398807 1137714152 /nfs/dbraw/zinc/71/41/52/1137714152.db2.gz DMVRHLXQHOMSCM-IPYPFGDCSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC1CCC(C)([NH+](C)C)CC1 ZINC000879352299 1137745203 /nfs/dbraw/zinc/74/52/03/1137745203.db2.gz NHUPOBCKAPXIRT-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCOC1 ZINC000880469362 1137779632 /nfs/dbraw/zinc/77/96/32/1137779632.db2.gz KEDDAQTURDFCBJ-RHSMWYFYSA-N 1 0 345.399 3.545 20 5 EHBDRO Cc1csc([C@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)n1 ZINC000332259990 1137937515 /nfs/dbraw/zinc/93/75/15/1137937515.db2.gz DSVVMPPUJKPYIU-ZDUSSCGKSA-N 1 0 335.404 3.878 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332367250 1137941689 /nfs/dbraw/zinc/94/16/89/1137941689.db2.gz WCKCRHAAJZOUCW-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO CC[C@H]([NH2+][C@H](CCO)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120282775 1137948005 /nfs/dbraw/zinc/94/80/05/1137948005.db2.gz RQHRFURZEFBQPP-RBUKOAKNSA-N 1 0 344.411 3.768 20 5 EHBDRO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H]1CCCO[C@@H]1c1ccccc1 ZINC000885973467 1138029689 /nfs/dbraw/zinc/02/96/89/1138029689.db2.gz SXRSJVMZDUQPHW-FUHWJXTLSA-N 1 0 341.411 3.590 20 5 EHBDRO COc1cccc([C@H]2CC[N@H+](Cc3cccnc3[N+](=O)[O-])C2(C)C)c1 ZINC000886316744 1138066671 /nfs/dbraw/zinc/06/66/71/1138066671.db2.gz LJMLYIXJHGKRCJ-QGZVFWFLSA-N 1 0 341.411 3.767 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1cc(C2CC2)no1)C1CC1 ZINC000886684678 1138114844 /nfs/dbraw/zinc/11/48/44/1138114844.db2.gz PVOHXFACGYNXCT-INIZCTEOSA-N 1 0 327.384 3.571 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000886711113 1138122520 /nfs/dbraw/zinc/12/25/20/1138122520.db2.gz NDZFRRWVLSKERY-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000886777000 1138138700 /nfs/dbraw/zinc/13/87/00/1138138700.db2.gz VNSYUSWOIUSDMU-GUYCJALGSA-N 1 0 333.432 3.567 20 5 EHBDRO C[C@@]1(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886776479 1138138780 /nfs/dbraw/zinc/13/87/80/1138138780.db2.gz HRXCAVJSRVSVPK-SJLPKXTDSA-N 1 0 330.428 3.911 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cccc3c2OCCCO3)cccc1[N+](=O)[O-] ZINC000090546616 1138211866 /nfs/dbraw/zinc/21/18/66/1138211866.db2.gz NWVOYWJCWRANNB-AWEZNQCLSA-N 1 0 342.395 3.915 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000124410300 1138286134 /nfs/dbraw/zinc/28/61/34/1138286134.db2.gz NDCOBTXKBWNKAC-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000264326240 1138477330 /nfs/dbraw/zinc/47/73/30/1138477330.db2.gz ITIFNAGFZORHQN-OAHLLOKOSA-N 1 0 346.358 3.746 20 5 EHBDRO COc1ccccc1N1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000151857273 1139061100 /nfs/dbraw/zinc/06/11/00/1139061100.db2.gz CLBMFHUTJQAXRK-HOCLYGCPSA-N 1 0 341.411 3.533 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2COC3(CCC(C)CC3)O2)cc1[N+](=O)[O-] ZINC000777313941 1139583231 /nfs/dbraw/zinc/58/32/31/1139583231.db2.gz SBUIGHYUTUAKNH-LJQUFJLCSA-N 1 0 348.443 3.876 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@]2(CCSC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000181456595 1139907875 /nfs/dbraw/zinc/90/78/75/1139907875.db2.gz XCCWITFNBDFPRB-DJIMGWMZSA-N 1 0 336.457 3.690 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1ccc(Cl)cn1)C1CC1 ZINC000182127184 1139952756 /nfs/dbraw/zinc/95/27/56/1139952756.db2.gz MDBNSKJSXULSIK-INIZCTEOSA-N 1 0 331.803 3.754 20 5 EHBDRO CC(C)(C)c1ccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000777445088 1140300847 /nfs/dbraw/zinc/30/08/47/1140300847.db2.gz FFJGUDHPHGHWIP-HNNXBMFYSA-N 1 0 334.441 3.777 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ccc(F)nc2)CC1 ZINC000190502028 1140407293 /nfs/dbraw/zinc/40/72/93/1140407293.db2.gz DTTDDRHXCMFHLR-CYBMUJFWSA-N 1 0 345.374 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCO[C@]3(CCSC3)C1)CCC2 ZINC000193030951 1140560723 /nfs/dbraw/zinc/56/07/23/1140560723.db2.gz PILMHKXSNSXJHL-ZTFGCOKTSA-N 1 0 348.468 3.617 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193043632 1140561969 /nfs/dbraw/zinc/56/19/69/1140561969.db2.gz SQWFJQZZYMJHRC-PIGZYNQJSA-N 1 0 329.400 3.970 20 5 EHBDRO CC(C)(O)c1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000193304992 1140570787 /nfs/dbraw/zinc/57/07/87/1140570787.db2.gz WNZSBCHJPYRMKR-LJQANCHMSA-N 1 0 340.423 3.989 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000269633864 1141129506 /nfs/dbraw/zinc/12/95/06/1141129506.db2.gz GNBCBKDESGSINQ-DLBZAZTESA-N 1 0 330.384 3.839 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CC[C@H](O)CC2)s1 ZINC000269859592 1141151338 /nfs/dbraw/zinc/15/13/38/1141151338.db2.gz IQYHDWNDCBJUBQ-JOCQHMNTSA-N 1 0 332.425 3.716 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025737 1141296434 /nfs/dbraw/zinc/29/64/34/1141296434.db2.gz BBXDJHABSSFHEL-PXAZEXFGSA-N 1 0 348.374 3.517 20 5 EHBDRO COC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000271029846 1141296861 /nfs/dbraw/zinc/29/68/61/1141296861.db2.gz GHIZILTVPXOHJD-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000271129501 1141312442 /nfs/dbraw/zinc/31/24/42/1141312442.db2.gz LLILJUMXISVDLZ-AUUYWEPGSA-N 1 0 344.411 3.552 20 5 EHBDRO CCC[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)(C)O ZINC000271162513 1141316278 /nfs/dbraw/zinc/31/62/78/1141316278.db2.gz LXKRIMLESCPTHE-UHFFFAOYSA-N 1 0 349.456 3.701 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCCC2 ZINC000271600144 1141404536 /nfs/dbraw/zinc/40/45/36/1141404536.db2.gz VGADSUFTUPDDNO-GFCCVEGCSA-N 1 0 331.441 3.823 20 5 EHBDRO C[N@H+](CC[C@@H]1CCCO1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339116651 1141501637 /nfs/dbraw/zinc/50/16/37/1141501637.db2.gz UZYHIOCVNHUJJL-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1cnc(C(F)(F)F)s1 ZINC000348672611 1141564994 /nfs/dbraw/zinc/56/49/94/1141564994.db2.gz MHDWUDBPMAYWAY-UHFFFAOYSA-N 1 0 345.346 3.745 20 5 EHBDRO C[C@@H](c1ccco1)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000283371421 1141611626 /nfs/dbraw/zinc/61/16/26/1141611626.db2.gz SJDKNNVGLIHXBB-ZDUSSCGKSA-N 1 0 343.383 3.742 20 5 EHBDRO COCC[N@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)Cc1cccnc1 ZINC000349005713 1141620829 /nfs/dbraw/zinc/62/08/29/1141620829.db2.gz LAIDCCRBEXSYQB-WJDWOHSUSA-N 1 0 341.411 3.542 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)Oc1ccccc1 ZINC000537985421 1032062226 /nfs/dbraw/zinc/06/22/26/1032062226.db2.gz AYHRIGKVTKKBNO-HNAYVOBHSA-N 1 0 340.423 3.973 20 5 EHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000117349715 1015072466 /nfs/dbraw/zinc/07/24/66/1015072466.db2.gz NKWUWLWPRFYDSB-HNNXBMFYSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](Cc1ccccc1)C1CC1 ZINC000430219547 1015070146 /nfs/dbraw/zinc/07/01/46/1015070146.db2.gz OCOLMYKJASUBJX-GOSISDBHSA-N 1 0 326.396 3.714 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1Cl)c1ccccc1[N+](=O)[O-] ZINC000274824584 1015438342 /nfs/dbraw/zinc/43/83/42/1015438342.db2.gz KRUQDRPNIAYHFF-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000246920402 1016050715 /nfs/dbraw/zinc/05/07/15/1016050715.db2.gz QAQHGOUQEAQKCA-KGLIPLIRSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCCC[C@H]2n2cccn2)cccc1[N+](=O)[O-] ZINC000246963196 1016235593 /nfs/dbraw/zinc/23/55/93/1016235593.db2.gz HXFMPCRKEDGZKZ-YXJHDRRASA-N 1 0 328.416 3.934 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226896 1016661324 /nfs/dbraw/zinc/66/13/24/1016661324.db2.gz DJIBNAFALYIQGT-DGCLKSJQSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2c3ccccc3CC23CCOCC3)c1 ZINC000290227577 1016819967 /nfs/dbraw/zinc/81/99/67/1016819967.db2.gz XLIBGSJXEICECG-LJQANCHMSA-N 1 0 338.407 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H](CO)C3)s2)cc1 ZINC000414565735 1016978218 /nfs/dbraw/zinc/97/82/18/1016978218.db2.gz FJIDHPSXMYAOHN-UKRRQHHQSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc2ccccc2n1 ZINC000449107657 1032188304 /nfs/dbraw/zinc/18/83/04/1032188304.db2.gz NKXFIKWJRCUPTJ-HNNXBMFYSA-N 1 0 335.407 3.906 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000074741417 1032206460 /nfs/dbraw/zinc/20/64/60/1032206460.db2.gz VKMFWFPGWRTFOV-UHFFFAOYSA-N 1 0 340.427 3.683 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2ccc(F)cc12 ZINC000449136425 1032230210 /nfs/dbraw/zinc/23/02/10/1032230210.db2.gz BEQDRBDGFWZSAY-CYBMUJFWSA-N 1 0 341.386 3.979 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000461090153 1032246644 /nfs/dbraw/zinc/24/66/44/1032246644.db2.gz RZTUJVKREQTYDO-CABCVRRESA-N 1 0 343.402 3.911 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnc(C4CC4)nc3)C2)cc1 ZINC000459582416 1032280902 /nfs/dbraw/zinc/28/09/02/1032280902.db2.gz RFQCDNIFWNGRPS-KRWDZBQOSA-N 1 0 338.411 3.642 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)c1ccc(Cl)cc1 ZINC000449249256 1032353435 /nfs/dbraw/zinc/35/34/35/1032353435.db2.gz IRQCVNGPQNWVQM-LRDDRELGSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000536856856 1032355101 /nfs/dbraw/zinc/35/51/01/1032355101.db2.gz GYJLXIZCJXMAMO-GJZGRUSLSA-N 1 0 344.411 3.764 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000459691617 1032418464 /nfs/dbraw/zinc/41/84/64/1032418464.db2.gz GKOPOHHWGWPRAH-RHSMWYFYSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)C2 ZINC000459732184 1032436619 /nfs/dbraw/zinc/43/66/19/1032436619.db2.gz RHIYNSVHUMMTPR-ZGUWOUCSSA-N 1 0 338.407 3.764 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000449333723 1032445548 /nfs/dbraw/zinc/44/55/48/1032445548.db2.gz VQPWHYFTEWTGGC-DZGCQCFKSA-N 1 0 348.830 3.545 20 5 EHBDRO CC[C@@H](CO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000449379241 1032505508 /nfs/dbraw/zinc/50/55/08/1032505508.db2.gz ZVLUDVVBAXEDIX-NSHDSACASA-N 1 0 338.791 3.711 20 5 EHBDRO CC[C@@H]1CCC[C@H]1C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000449433206 1032549852 /nfs/dbraw/zinc/54/98/52/1032549852.db2.gz LEKSDSYLYWPJLW-HFTRVMKXSA-N 1 0 342.443 3.834 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H](C)CC(C)(C)O)o2)c([N+](=O)[O-])c1 ZINC000449452285 1032569897 /nfs/dbraw/zinc/56/98/97/1032569897.db2.gz UDOCRZVCPMXTDT-GFCCVEGCSA-N 1 0 348.399 3.503 20 5 EHBDRO CC(C)CC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)(C)C ZINC000537288849 1032615617 /nfs/dbraw/zinc/61/56/17/1032615617.db2.gz AAJWZIJVQBKART-MRXNPFEDSA-N 1 0 335.448 3.634 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1ncccc1C ZINC000449483856 1032632113 /nfs/dbraw/zinc/63/21/13/1032632113.db2.gz CTVQSGMJTWESSQ-NTCAYCPXSA-N 1 0 325.412 3.924 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)[C@H](C)c1ccccc1 ZINC000181533351 1017119542 /nfs/dbraw/zinc/11/95/42/1017119542.db2.gz BOHNFPCEUCZYCK-LSDHHAIUSA-N 1 0 341.411 3.624 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(F)c(C[NH+](C)C)c1 ZINC000120910020 1017182927 /nfs/dbraw/zinc/18/29/27/1017182927.db2.gz FWSWSIGYKUJQLU-CQSZACIVSA-N 1 0 345.418 3.955 20 5 EHBDRO CC[C@@H]([NH3+])CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414975828 1017369023 /nfs/dbraw/zinc/36/90/23/1017369023.db2.gz HEPHNNCBFMRQKC-CYBMUJFWSA-N 1 0 349.818 3.867 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000377255645 1017544734 /nfs/dbraw/zinc/54/47/34/1017544734.db2.gz YKOKVIHNXNUBBM-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC2 ZINC000468035650 1017600905 /nfs/dbraw/zinc/60/09/05/1017600905.db2.gz ABGPYLOLQNXERV-OAHLLOKOSA-N 1 0 346.814 3.904 20 5 EHBDRO Cc1cc(NC(=O)N[C@@H](CCC[NH3+])c2ccccc2)ccc1[N+](=O)[O-] ZINC000415421325 1018001883 /nfs/dbraw/zinc/00/18/83/1018001883.db2.gz UOGMCDASSKKJMR-INIZCTEOSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000275678453 1018080358 /nfs/dbraw/zinc/08/03/58/1018080358.db2.gz YPYZXVINCDPESJ-CEXWTWQISA-N 1 0 326.396 3.554 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCC[C@H]2c2ccccc2)c1 ZINC000275678457 1018080915 /nfs/dbraw/zinc/08/09/15/1018080915.db2.gz YPYZXVINCDPESJ-GBESFXJTSA-N 1 0 326.396 3.554 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1COc2ccccc21)C1CC1 ZINC000290317993 1018146129 /nfs/dbraw/zinc/14/61/29/1018146129.db2.gz OCUSVULIGUWJPJ-FUHWJXTLSA-N 1 0 338.407 3.682 20 5 EHBDRO C[C@H](CO)[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000101594381 1018371485 /nfs/dbraw/zinc/37/14/85/1018371485.db2.gz HSWYFFJAFDHXFU-LLVKDONJSA-N 1 0 336.775 3.511 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(CC[NH+](C)C)Cc1cccs1 ZINC000349300421 1018721728 /nfs/dbraw/zinc/72/17/28/1018721728.db2.gz SUHRSBOQRVUKLL-UHFFFAOYSA-N 1 0 333.457 3.529 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C2CC2)cc1 ZINC000419347138 1018734782 /nfs/dbraw/zinc/73/47/82/1018734782.db2.gz WJXPDJHVFASSAI-CYBMUJFWSA-N 1 0 339.395 3.762 20 5 EHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410596 1018933359 /nfs/dbraw/zinc/93/33/59/1018933359.db2.gz VJCAACNBIZWXAK-CMPLNLGQSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075196 1018999404 /nfs/dbraw/zinc/99/94/04/1018999404.db2.gz XGALUINHRBIZIA-RISCZKNCSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[N@@H+]2CCc3ccccc3C2)c(F)c1 ZINC000513098035 1019017120 /nfs/dbraw/zinc/01/71/20/1019017120.db2.gz ZWYAGBAQNLZIMV-UHFFFAOYSA-N 1 0 329.375 3.594 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000015128887 1019040432 /nfs/dbraw/zinc/04/04/32/1019040432.db2.gz QWHFAWMHWISTDZ-HNNXBMFYSA-N 1 0 333.819 3.833 20 5 EHBDRO O=[N+]([O-])c1cnccc1NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310910801 1019089884 /nfs/dbraw/zinc/08/98/84/1019089884.db2.gz QRYXRPZQBONTSX-QGZVFWFLSA-N 1 0 340.427 3.704 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109874 1019361191 /nfs/dbraw/zinc/36/11/91/1019361191.db2.gz BJBSHLLBVDYCGK-RHSMWYFYSA-N 1 0 331.416 3.922 20 5 EHBDRO C[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC[NH+](C)CC1 ZINC000319682548 1019473152 /nfs/dbraw/zinc/47/31/52/1019473152.db2.gz JTYCGTSJQWTSEO-JTQLQIEISA-N 1 0 331.338 3.756 20 5 EHBDRO CC(C)N(CC(=O)NCC1CCCCC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000513380305 1019582303 /nfs/dbraw/zinc/58/23/03/1019582303.db2.gz FGVWCGLZFXJRMU-UHFFFAOYSA-N 1 0 347.459 3.502 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[NH2+]C23CCCC3)o1 ZINC000592439079 1032844440 /nfs/dbraw/zinc/84/44/40/1032844440.db2.gz ZPVPKKZTRBYGOS-SFHVURJKSA-N 1 0 341.411 3.619 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H](CO)c1ccsc1 ZINC000471601708 1019736263 /nfs/dbraw/zinc/73/62/63/1019736263.db2.gz KVNLBQGRRHFZNQ-IAOVAPTHSA-N 1 0 346.452 3.691 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513661938 1019929615 /nfs/dbraw/zinc/92/96/15/1019929615.db2.gz RJZGKLUOLZGCPN-KYJSFNMBSA-N 1 0 342.443 3.834 20 5 EHBDRO CCC(=O)c1ccc(N2CCC([NH+]3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000280746763 1020611147 /nfs/dbraw/zinc/61/11/47/1020611147.db2.gz PBDAFWFWQYVCBG-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1ccc(-c2nc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)co2)cc1 ZINC000610497340 1020727376 /nfs/dbraw/zinc/72/73/76/1020727376.db2.gz ZUNUCDUYSTZEDW-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602511489 1032946210 /nfs/dbraw/zinc/94/62/10/1032946210.db2.gz SYENWQFOTKZEIP-YOEHRIQHSA-N 1 0 332.448 3.517 20 5 EHBDRO COC1CC[NH+](C2(CNc3c(C)cccc3[N+](=O)[O-])CCCC2)CC1 ZINC000341092811 1020975140 /nfs/dbraw/zinc/97/51/40/1020975140.db2.gz DXFMALOVYKOEFL-UHFFFAOYSA-N 1 0 347.459 3.739 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393853554 1021078640 /nfs/dbraw/zinc/07/86/40/1021078640.db2.gz XBVIWQYUTFVSBC-WBVHZDCISA-N 1 0 325.412 3.917 20 5 EHBDRO COc1cccc(COCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090806559 1021090343 /nfs/dbraw/zinc/09/03/43/1021090343.db2.gz NCIMVPFIDVRXRV-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1cccc(O[C@@H](C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602548667 1032955373 /nfs/dbraw/zinc/95/53/73/1032955373.db2.gz UVTACBWGVNDXEB-ZDUSSCGKSA-N 1 0 341.367 3.602 20 5 EHBDRO CCc1nc(C)c(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000426324785 1021263847 /nfs/dbraw/zinc/26/38/47/1021263847.db2.gz RWCNGGVEJVVKQH-ZBFHGGJFSA-N 1 0 343.427 3.955 20 5 EHBDRO COc1ccc(NC(=O)C[N@H+](C(C)C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000120844800 1021282409 /nfs/dbraw/zinc/28/24/09/1021282409.db2.gz KJHNGKFDSRTXGP-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO C[N@@H+]1C[C@H]2C[C@@H](C1)N(C(=O)c1ccc3cc4ccccc4cc3c1)C2 ZINC001270141168 1021383497 /nfs/dbraw/zinc/38/34/97/1021383497.db2.gz SOGKHDXMNAUXNW-VFNWGFHPSA-N 1 0 330.431 3.769 20 5 EHBDRO CC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CCCCC1 ZINC000602569710 1032980570 /nfs/dbraw/zinc/98/05/70/1032980570.db2.gz RHJFUZCUBCRIOW-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO Cc1ccc([C@@H]2[C@@H](C)CCC[N@@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477788 1021459148 /nfs/dbraw/zinc/45/91/48/1021459148.db2.gz HVEYZHABZJGNCI-YOEHRIQHSA-N 1 0 328.416 3.610 20 5 EHBDRO C[C@@]1(NCc2c(F)cc([N+](=O)[O-])cc2F)CCOc2ccccc21 ZINC000933371915 1021499887 /nfs/dbraw/zinc/49/98/87/1021499887.db2.gz STIZTBBSFFVXTR-QGZVFWFLSA-N 1 0 334.322 3.661 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000519706577 1021638100 /nfs/dbraw/zinc/63/81/00/1021638100.db2.gz LYUYLCLZSGVUKG-QGZVFWFLSA-N 1 0 340.427 3.613 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)ccc1OC ZINC000090910089 1021687284 /nfs/dbraw/zinc/68/72/84/1021687284.db2.gz LFEVSJPQEJZAIY-AWEZNQCLSA-N 1 0 344.411 3.643 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H]4CCC[C@@H]43)o2)c1 ZINC000426485340 1021689194 /nfs/dbraw/zinc/68/91/94/1021689194.db2.gz JDJHGYABTPFXGD-BBRMVZONSA-N 1 0 327.384 3.667 20 5 EHBDRO CC[C@H](CSC)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602580038 1032998259 /nfs/dbraw/zinc/99/82/59/1032998259.db2.gz CDRFCEKJRYCXIR-SSDOTTSWSA-N 1 0 339.280 3.650 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000602614534 1033007568 /nfs/dbraw/zinc/00/75/68/1033007568.db2.gz SNNBLVHNYAAQCL-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC([NH+]2CCCCC2)CC1 ZINC000276585107 1021905526 /nfs/dbraw/zinc/90/55/26/1021905526.db2.gz JAOHWXQGKBJDNL-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@]4(CCOC4)C3)o2)cc1 ZINC000449679603 1033029350 /nfs/dbraw/zinc/02/93/50/1033029350.db2.gz AJSMRDGJCLZCRK-IBGZPJMESA-N 1 0 342.395 3.857 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000178205993 1022148613 /nfs/dbraw/zinc/14/86/13/1022148613.db2.gz CTOIPTDTYSEIAT-VIFPVBQESA-N 1 0 339.804 3.599 20 5 EHBDRO CCC[C@]1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCOC1 ZINC000550095651 1022428519 /nfs/dbraw/zinc/42/85/19/1022428519.db2.gz ACDVMZOGDONQIX-AWEZNQCLSA-N 1 0 332.322 3.662 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000438331419 1022553588 /nfs/dbraw/zinc/55/35/88/1022553588.db2.gz XUDHQJCCZPHXMF-INIZCTEOSA-N 1 0 342.443 3.863 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000438347714 1022585650 /nfs/dbraw/zinc/58/56/50/1022585650.db2.gz PIYUAIIPERJEMF-KRWDZBQOSA-N 1 0 346.452 3.916 20 5 EHBDRO CCC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C1CCC1 ZINC000602688712 1033069629 /nfs/dbraw/zinc/06/96/29/1033069629.db2.gz YHLAWLGWOIZNKB-KRWDZBQOSA-N 1 0 332.448 3.517 20 5 EHBDRO Cc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)ccc1Br ZINC000073852689 1022689119 /nfs/dbraw/zinc/68/91/19/1022689119.db2.gz CJHYSMDBQYXOGS-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO C[C@H]1C[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942858 1022931162 /nfs/dbraw/zinc/93/11/62/1022931162.db2.gz NCOKEUMGQYQKJU-ZBEGNZNMSA-N 1 0 349.818 3.596 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000060862597 1033095147 /nfs/dbraw/zinc/09/51/47/1033095147.db2.gz XQEOJCIXURNGFB-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000507174222 1023174970 /nfs/dbraw/zinc/17/49/70/1023174970.db2.gz CCSKOLXRZDRGNW-INIZCTEOSA-N 1 0 326.396 3.901 20 5 EHBDRO COc1ccc(OCC[N@H+](C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000441486312 1023193771 /nfs/dbraw/zinc/19/37/71/1023193771.db2.gz DZMDKTHHIGCLLC-OAHLLOKOSA-N 1 0 344.411 3.718 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@]23C[C@@H]2CCCC3)cc1Br ZINC000602733066 1033123194 /nfs/dbraw/zinc/12/31/94/1033123194.db2.gz SGWAVFMKAJCLRP-UFBFGSQYSA-N 1 0 331.235 3.841 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000341807622 1023354233 /nfs/dbraw/zinc/35/42/33/1023354233.db2.gz KESQCHOXCXWSDU-JTQLQIEISA-N 1 0 332.347 3.681 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)cc1[N+](=O)[O-] ZINC000458269157 1023842011 /nfs/dbraw/zinc/84/20/11/1023842011.db2.gz HJLPUZJZNNAAMT-UHFFFAOYSA-N 1 0 333.413 3.587 20 5 EHBDRO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@@H](C)c1cc2ccccc2o1 ZINC000176216730 1023882620 /nfs/dbraw/zinc/88/26/20/1023882620.db2.gz VYOCXYMTXQQJDA-ZDUSSCGKSA-N 1 0 328.372 3.621 20 5 EHBDRO C[N@H+](CCCc1ccc2c(c1)CCO2)CCc1cccc([N+](=O)[O-])c1 ZINC000574707006 1024211453 /nfs/dbraw/zinc/21/14/53/1024211453.db2.gz OPWXXDARHMQKGZ-UHFFFAOYSA-N 1 0 340.423 3.637 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000358367530 1024241246 /nfs/dbraw/zinc/24/12/46/1024241246.db2.gz MFLILXIPANDSCC-IBGZPJMESA-N 1 0 326.396 3.813 20 5 EHBDRO CC[C@@H]1C[C@H](C)C[N@@H+]1Cc1ccc(Br)cc1[N+](=O)[O-] ZINC001167500304 1024242854 /nfs/dbraw/zinc/24/28/54/1024242854.db2.gz SMICETROQZKRJV-GXFFZTMASA-N 1 0 327.222 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3ccc4ncccc4c3)c2c1 ZINC000520648625 1024334324 /nfs/dbraw/zinc/33/43/24/1024334324.db2.gz HUCXLQCANLJABH-UHFFFAOYSA-N 1 0 346.390 3.957 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@H](CC2CCCC2)c2ccccc2)n1 ZINC000342192904 1024359996 /nfs/dbraw/zinc/35/99/96/1024359996.db2.gz MUKMKQPYTQVPJA-QGZVFWFLSA-N 1 0 328.416 3.703 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000277291406 1024480948 /nfs/dbraw/zinc/48/09/48/1024480948.db2.gz ZPNWNVPCOCBGNO-LLVKDONJSA-N 1 0 331.338 3.534 20 5 EHBDRO COCC[N@H+](C)CC[C@H](Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000505582720 1024535341 /nfs/dbraw/zinc/53/53/41/1024535341.db2.gz VNMSJVXCUCVPEO-KRWDZBQOSA-N 1 0 343.427 3.716 20 5 EHBDRO Cc1ccc(C)c([C@@H](C)[N@H+](C)Cc2ccc(C(N)=O)cc2[N+](=O)[O-])c1 ZINC000346275569 1024566106 /nfs/dbraw/zinc/56/61/06/1024566106.db2.gz AWVZBOPZDFMDOF-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H]1CCCO1 ZINC000119656871 1024658178 /nfs/dbraw/zinc/65/81/78/1024658178.db2.gz WYAVDWSOZGHXDA-JKSUJKDBSA-N 1 0 347.440 3.766 20 5 EHBDRO COCCC1(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)CCCCC1 ZINC000185225045 1024664594 /nfs/dbraw/zinc/66/45/94/1024664594.db2.gz FMKSBAFEJXDTDP-UHFFFAOYSA-N 1 0 336.432 3.680 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c1[N+](=O)[O-] ZINC000895666924 1024713564 /nfs/dbraw/zinc/71/35/64/1024713564.db2.gz YXNUBHYQDDVDER-AWEZNQCLSA-N 1 0 348.786 3.740 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCc3cc(F)c(OC)cc32)cc1[N+](=O)[O-] ZINC000281310043 1024875274 /nfs/dbraw/zinc/87/52/74/1024875274.db2.gz RUOCFMLUYXZWOZ-OAHLLOKOSA-N 1 0 346.358 3.528 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])O1 ZINC000427971123 1024915834 /nfs/dbraw/zinc/91/58/34/1024915834.db2.gz JFXQUDOXNUMOFH-OIISXLGYSA-N 1 0 332.444 3.853 20 5 EHBDRO C[NH+](C)CC[C@H](Nc1ccc([N+](=O)[O-])cc1Cl)c1cccnc1 ZINC000895892766 1024950009 /nfs/dbraw/zinc/95/00/09/1024950009.db2.gz RJBYCUNIRMGXDM-HNNXBMFYSA-N 1 0 334.807 3.748 20 5 EHBDRO Cc1c(C[NH+]2CCC(c3ccc(F)cn3)CC2)cccc1[N+](=O)[O-] ZINC000602903665 1033253046 /nfs/dbraw/zinc/25/30/46/1033253046.db2.gz KHRQCMNVYZLGPT-UHFFFAOYSA-N 1 0 329.375 3.817 20 5 EHBDRO COc1cc(C[NH+]2CCC(c3ccc(F)cn3)CC2)ccc1[N+](=O)[O-] ZINC000602905946 1033253355 /nfs/dbraw/zinc/25/33/55/1033253355.db2.gz WDVIJULAZYNKNE-UHFFFAOYSA-N 1 0 345.374 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@@H]3CCc4ccccc4C3)c2c1 ZINC000520879483 1025100752 /nfs/dbraw/zinc/10/07/52/1025100752.db2.gz GMFDAXDOCXWNOW-QGZVFWFLSA-N 1 0 335.407 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(CNC[C@@H]2CCC[N@@H+]2CC2CCCCC2)c1 ZINC000520974068 1025141176 /nfs/dbraw/zinc/14/11/76/1025141176.db2.gz QPSHVGQERVHJQE-IBGZPJMESA-N 1 0 331.460 3.729 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000474596647 1025181292 /nfs/dbraw/zinc/18/12/92/1025181292.db2.gz LDKYIMPNQMLMEP-UQHVZDHRSA-N 1 0 334.416 3.757 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc2ccccc21 ZINC000119690219 1025192105 /nfs/dbraw/zinc/19/21/05/1025192105.db2.gz YEJZBGKEMUIEEC-CYBMUJFWSA-N 1 0 349.390 3.698 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC(CCO)C3)s2)cc1 ZINC000898008274 1033272556 /nfs/dbraw/zinc/27/25/56/1033272556.db2.gz MECGRDVTBGKPPX-UHFFFAOYSA-N 1 0 332.425 3.574 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000121022147 1025324650 /nfs/dbraw/zinc/32/46/50/1025324650.db2.gz GBBIZBSVDCSPRL-KRWDZBQOSA-N 1 0 329.400 3.664 20 5 EHBDRO CC(=O)c1ccc(NCCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000515550769 1025344538 /nfs/dbraw/zinc/34/45/38/1025344538.db2.gz ITCHDEQCZDZGEO-GASCZTMLSA-N 1 0 347.459 3.967 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1Cc1cccc(F)c1 ZINC000521424640 1025382148 /nfs/dbraw/zinc/38/21/48/1025382148.db2.gz QWNHDIBXDHKWKR-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000381380982 1025421440 /nfs/dbraw/zinc/42/14/40/1025421440.db2.gz PFMKMBNXAQZATA-AVGNSLFASA-N 1 0 337.420 3.547 20 5 EHBDRO C[NH+](C)C1(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CCCCC1 ZINC000436269224 1025536831 /nfs/dbraw/zinc/53/68/31/1025536831.db2.gz KHJSNEQYZNZSNV-UHFFFAOYSA-N 1 0 346.353 3.685 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](COc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000505844011 1025858978 /nfs/dbraw/zinc/85/89/78/1025858978.db2.gz CSUXFGUWZZDHHW-MRXNPFEDSA-N 1 0 326.396 3.804 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1[N+](=O)[O-] ZINC000451355440 1025861560 /nfs/dbraw/zinc/86/15/60/1025861560.db2.gz VCNMCLQGFCRNPC-JZXOWHBKSA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCCC[C@H]3O)s2)cc1 ZINC000074371294 1025919393 /nfs/dbraw/zinc/91/93/93/1025919393.db2.gz HQRDEGUYIDLUPK-HZPDHXFCSA-N 1 0 332.425 3.716 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000451622436 1026159549 /nfs/dbraw/zinc/15/95/49/1026159549.db2.gz ZXGOBXSASDKREG-PBHICJAKSA-N 1 0 334.391 3.515 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000530901689 1026387303 /nfs/dbraw/zinc/38/73/03/1026387303.db2.gz QALZDDPMZPDKGL-RDJZCZTQSA-N 1 0 349.475 3.687 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000618197814 1026397843 /nfs/dbraw/zinc/39/78/43/1026397843.db2.gz AZBYWEZGZRZQLK-WAFIBAPDSA-N 1 0 338.407 3.851 20 5 EHBDRO COC[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000452100932 1026477037 /nfs/dbraw/zinc/47/70/37/1026477037.db2.gz IXZDMZSZVQPOPV-GFCCVEGCSA-N 1 0 346.349 3.862 20 5 EHBDRO COc1cc(C[NH2+]C[C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000282002706 1026664695 /nfs/dbraw/zinc/66/46/95/1026664695.db2.gz MEOJPMISRMNMQB-NSHDSACASA-N 1 0 344.358 3.527 20 5 EHBDRO C[C@H]1COCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277719212 1026669959 /nfs/dbraw/zinc/66/99/59/1026669959.db2.gz JBELWOVLZPWBLU-SWLSCSKDSA-N 1 0 332.425 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](OCCCc3ccccc3)C2)cc1 ZINC000531211146 1026690199 /nfs/dbraw/zinc/69/01/99/1026690199.db2.gz ZADSHXPRMDNMBS-HXUWFJFHSA-N 1 0 340.423 3.819 20 5 EHBDRO C[C@]1(CNC(=O)c2cc3ccccc3c3cccnc23)CCC[NH2+]C1 ZINC000342705289 1026784226 /nfs/dbraw/zinc/78/42/26/1026784226.db2.gz FRVQPMLPRYATNN-NRFANRHFSA-N 1 0 333.435 3.508 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000582636345 1026834690 /nfs/dbraw/zinc/83/46/90/1026834690.db2.gz JHFDRTMZHKQOSI-CRAIPNDOSA-N 1 0 340.423 3.818 20 5 EHBDRO CN(Cc1ccccc1)[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000479871575 1026865970 /nfs/dbraw/zinc/86/59/70/1026865970.db2.gz GVHSJWNKVYSZRJ-FQEVSTJZSA-N 1 0 339.439 3.595 20 5 EHBDRO C[C@@]1(CO)CCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237478501 1027052233 /nfs/dbraw/zinc/05/22/33/1027052233.db2.gz YKUBOZWVUIBTKS-MSOLQXFVSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CC[N@H+](C)CC1 ZINC000272949625 1027192502 /nfs/dbraw/zinc/19/25/02/1027192502.db2.gz MRAIMZSQIOPHEJ-HNNXBMFYSA-N 1 0 345.446 3.768 20 5 EHBDRO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000413172856 1027212205 /nfs/dbraw/zinc/21/22/05/1027212205.db2.gz GCZXUORFIXRFPA-DZGCQCFKSA-N 1 0 344.390 3.594 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178652612 1027372765 /nfs/dbraw/zinc/37/27/65/1027372765.db2.gz BUWFDUQOMSHNAZ-HKUYNNGSSA-N 1 0 328.412 3.802 20 5 EHBDRO C[C@@H](C[NH+]1CCCCC1)Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000320863369 1027373129 /nfs/dbraw/zinc/37/31/29/1027373129.db2.gz QJPJCZKTAUUSTE-NSHDSACASA-N 1 0 331.338 3.900 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN1C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000310635231 1027517105 /nfs/dbraw/zinc/51/71/05/1027517105.db2.gz BKFBUAMSYJDZAP-BBRMVZONSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000178656781 1027612512 /nfs/dbraw/zinc/61/25/12/1027612512.db2.gz HRKWAPPXAAMQAH-RDJZCZTQSA-N 1 0 325.412 3.914 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000310751874 1027765701 /nfs/dbraw/zinc/76/57/01/1027765701.db2.gz INFZEXCXLRFDRJ-LPHOPBHVSA-N 1 0 339.439 3.656 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@H](C(C)C)CC1 ZINC000533418056 1027836209 /nfs/dbraw/zinc/83/62/09/1027836209.db2.gz POWDWVBPAHFRIX-HNNXBMFYSA-N 1 0 333.432 3.600 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000422738068 1027905198 /nfs/dbraw/zinc/90/51/98/1027905198.db2.gz JCMNQTSPDBJJMV-UHFFFAOYSA-N 1 0 327.384 3.573 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000178687221 1027970362 /nfs/dbraw/zinc/97/03/62/1027970362.db2.gz JABCKJXFUBVLMC-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000178689662 1027991068 /nfs/dbraw/zinc/99/10/68/1027991068.db2.gz DIPWNNQXAKAFNW-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]([C@@H]3CCCc4ccccc43)C2)nc1 ZINC000440486075 1028065171 /nfs/dbraw/zinc/06/51/71/1028065171.db2.gz JBFKATVZRJARLJ-MAUKXSAKSA-N 1 0 338.411 3.554 20 5 EHBDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685665 1028130254 /nfs/dbraw/zinc/13/02/54/1028130254.db2.gz PAIQAFHEMYBTQK-ZFWWWQNUSA-N 1 0 334.445 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@@H]3c3ccccc3)nc2c1 ZINC000444684582 1028158042 /nfs/dbraw/zinc/15/80/42/1028158042.db2.gz NDPWTPLOQVIPRX-HZPDHXFCSA-N 1 0 336.395 3.897 20 5 EHBDRO C[C@@H](N[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178619 1028248411 /nfs/dbraw/zinc/24/84/11/1028248411.db2.gz CEWQDLKJGBPAFE-CHWSQXEVSA-N 1 0 331.441 3.726 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000502511876 1028299192 /nfs/dbraw/zinc/29/91/92/1028299192.db2.gz UZYDOBDJUWUMDN-DGCLKSJQSA-N 1 0 334.750 3.888 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](N)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000423232355 1028299500 /nfs/dbraw/zinc/29/95/00/1028299500.db2.gz BYTXJAFFSWWZLW-ZWKOTPCHSA-N 1 0 325.412 3.607 20 5 EHBDRO C[C@H]1C[C@@H](CO)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369113 1028328920 /nfs/dbraw/zinc/32/89/20/1028328920.db2.gz XVUCUWGEVRCRJP-UONOGXRCSA-N 1 0 346.452 3.774 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000421391336 1028368166 /nfs/dbraw/zinc/36/81/66/1028368166.db2.gz UAFNQWCTPWXDCW-CZUORRHYSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@@H](NC[C@H]([NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423333858 1028371257 /nfs/dbraw/zinc/37/12/57/1028371257.db2.gz WEXDMJSEEMJPAI-RISCZKNCSA-N 1 0 331.441 3.711 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NCc2cccc(-n3ccnc3)c2)c(F)c1 ZINC000440592286 1028397495 /nfs/dbraw/zinc/39/74/95/1028397495.db2.gz VLCCUEHDPQNWIW-UHFFFAOYSA-N 1 0 330.294 3.671 20 5 EHBDRO CCc1ccc([C@H](N[C@@H]2CCC[C@@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375034 1028413437 /nfs/dbraw/zinc/41/34/37/1028413437.db2.gz IPIWAEXTGNMUPC-SPYBWZPUSA-N 1 0 343.427 3.699 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000423442177 1028431779 /nfs/dbraw/zinc/43/17/79/1028431779.db2.gz JMMHBHFHFCHIIS-CQSZACIVSA-N 1 0 325.412 3.674 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCc2cccnc2CC1 ZINC000421835787 1028826748 /nfs/dbraw/zinc/82/67/48/1028826748.db2.gz FXJWHQKOGNXIOE-INIZCTEOSA-N 1 0 345.830 3.723 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1(C2CCC2)CC1 ZINC000593079596 1028919560 /nfs/dbraw/zinc/91/95/60/1028919560.db2.gz FQTYUNSGJHCXIF-UHFFFAOYSA-N 1 0 325.206 3.780 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000524236643 1029013932 /nfs/dbraw/zinc/01/39/32/1029013932.db2.gz YZWNNPKZDZPTHA-GFCCVEGCSA-N 1 0 326.828 3.710 20 5 EHBDRO Cn1cc(C[N@H+](CC2CC2)C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000355725752 1029022683 /nfs/dbraw/zinc/02/26/83/1029022683.db2.gz GSQMSIWNZHDBFH-UHFFFAOYSA-N 1 0 340.427 3.760 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912416 1029054490 /nfs/dbraw/zinc/05/44/90/1029054490.db2.gz VYOCRIWNPWZXNL-CZUORRHYSA-N 1 0 326.462 3.606 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cscn1 ZINC000504912357 1029054715 /nfs/dbraw/zinc/05/47/15/1029054715.db2.gz VDQLCGVXBCPUQO-GFCCVEGCSA-N 1 0 337.470 3.754 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2CCC(OC)CC2)cc1[N+](=O)[O-] ZINC000504912301 1029055483 /nfs/dbraw/zinc/05/54/83/1029055483.db2.gz UBTPIKYODKDKMD-VQCLRJIVSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1cccc(C[N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000532919993 1029072002 /nfs/dbraw/zinc/07/20/02/1029072002.db2.gz CBZIYQJZRQGNNI-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152172186 1029296596 /nfs/dbraw/zinc/29/65/96/1029296596.db2.gz MSTGUUIQCVKAJR-LBPRGKRZSA-N 1 0 342.424 3.908 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCC[C@H](C)C1 ZINC000533248714 1029526380 /nfs/dbraw/zinc/52/63/80/1029526380.db2.gz MLFHECFMTIZLJF-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513829989 1029528783 /nfs/dbraw/zinc/52/87/83/1029528783.db2.gz NPNCCIPNULMQMY-HOCLYGCPSA-N 1 0 348.443 3.627 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@@H](C)[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042867 1029660972 /nfs/dbraw/zinc/66/09/72/1029660972.db2.gz GECBPPXFLXQJQY-IFXJQAMLSA-N 1 0 326.396 3.727 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H](C)SC)o2)c([N+](=O)[O-])c1 ZINC000128126710 1029694789 /nfs/dbraw/zinc/69/47/89/1029694789.db2.gz IFWGDZDLPOJBJG-LLVKDONJSA-N 1 0 336.413 3.705 20 5 EHBDRO CC[C@@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525246129 1029756456 /nfs/dbraw/zinc/75/64/56/1029756456.db2.gz NMPWJKFSHMQQCY-KGLIPLIRSA-N 1 0 332.400 3.742 20 5 EHBDRO Cc1cccc(-c2n[nH]cc2CN2CCc3c(cccc3[N+](=O)[O-])C2)c1 ZINC000537626259 1029906414 /nfs/dbraw/zinc/90/64/14/1029906414.db2.gz LBVOMYGFQRSJAA-UHFFFAOYSA-N 1 0 348.406 3.852 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257839 1029953252 /nfs/dbraw/zinc/95/32/52/1029953252.db2.gz ZMFIFAWYRINOJK-CMPLNLGQSA-N 1 0 338.795 3.778 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H]2CC[C@@H](CO)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453264522 1029997035 /nfs/dbraw/zinc/99/70/35/1029997035.db2.gz ACQKKNDJNCCDBK-WTANOLMUSA-N 1 0 344.411 3.590 20 5 EHBDRO C[C@@H]1CCN(Cc2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000525781333 1030115873 /nfs/dbraw/zinc/11/58/73/1030115873.db2.gz CTXZGDOUOZLXMW-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453385880 1030168810 /nfs/dbraw/zinc/16/88/10/1030168810.db2.gz OHMWZAJHZUCNDH-YJLNNSPDSA-N 1 0 344.411 3.590 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453390114 1030235452 /nfs/dbraw/zinc/23/54/52/1030235452.db2.gz XWNNIVVCDYNPNA-CJCBUOBESA-N 1 0 332.444 3.709 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1ccccc1F)CCC2 ZINC000447513325 1030260643 /nfs/dbraw/zinc/26/06/43/1030260643.db2.gz VHHGYEOGEJHRED-KRWDZBQOSA-N 1 0 330.359 3.780 20 5 EHBDRO C[C@H](CC(=O)OC(C)(C)C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447588979 1030324014 /nfs/dbraw/zinc/32/40/14/1030324014.db2.gz WCAZTBOLUDPQGN-MLGOLLRUSA-N 1 0 334.416 3.682 20 5 EHBDRO Cc1cnccc1OC1CC[NH+](Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000429725055 1030380967 /nfs/dbraw/zinc/38/09/67/1030380967.db2.gz RCGGVOXGIVNJJE-UHFFFAOYSA-N 1 0 341.411 3.650 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@](C)(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000532293462 1030527926 /nfs/dbraw/zinc/52/79/26/1030527926.db2.gz YJTYSAOZKAVYHG-LJQANCHMSA-N 1 0 326.396 3.767 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2CCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000160082631 1030528877 /nfs/dbraw/zinc/52/88/77/1030528877.db2.gz ISJMEQPLZLDLHT-SFHVURJKSA-N 1 0 327.384 3.514 20 5 EHBDRO COc1ccc2c(c1)CCCN(Cc1cc(F)ccc1[N+](=O)[O-])C2 ZINC000728574817 1030624403 /nfs/dbraw/zinc/62/44/03/1030624403.db2.gz HTGHBVPMAXVYRI-UHFFFAOYSA-N 1 0 330.359 3.691 20 5 EHBDRO C[C@@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@@H+]1C ZINC000161118623 1031338062 /nfs/dbraw/zinc/33/80/62/1031338062.db2.gz OYIGLBRRJYIXCG-ZYHUDNBSSA-N 1 0 331.338 3.533 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(O)CCCC[C@@H]2C1 ZINC000161145865 1031358602 /nfs/dbraw/zinc/35/86/02/1031358602.db2.gz PDQXHOAEAXOKNL-APWZRJJASA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@@H](C(F)(F)F)C3)nc2c1 ZINC000278596231 1031576693 /nfs/dbraw/zinc/57/66/93/1031576693.db2.gz FJYSYNCJOLCNHJ-NXEZZACHSA-N 1 0 342.321 3.682 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000475737447 1031720357 /nfs/dbraw/zinc/72/03/57/1031720357.db2.gz ZYZPVWRETIBIAB-SFHVURJKSA-N 1 0 328.412 3.593 20 5 EHBDRO C[C@H]([NH3+])C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000178848714 1031735217 /nfs/dbraw/zinc/73/52/17/1031735217.db2.gz DIAHQDCFVBKRTM-AWEZNQCLSA-N 1 0 333.435 3.587 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@H](C)[C@H]1C ZINC000475744894 1031789823 /nfs/dbraw/zinc/78/98/23/1031789823.db2.gz DFHCTBQZBXBXAU-VNHYZAJKSA-N 1 0 333.432 3.598 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@H](C)[C@@H]1C ZINC000475744891 1031791857 /nfs/dbraw/zinc/79/18/57/1031791857.db2.gz DFHCTBQZBXBXAU-IPYPFGDCSA-N 1 0 333.432 3.598 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nc(C)no2)C1 ZINC000347365244 1031848556 /nfs/dbraw/zinc/84/85/56/1031848556.db2.gz SZUBITLGGQRBPE-OVHOFWQVSA-N 1 0 342.399 3.569 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCc2ccccc2NC1=O ZINC000594511440 1033415899 /nfs/dbraw/zinc/41/58/99/1033415899.db2.gz NHIABZZVCMTQBF-UGSOOPFHSA-N 1 0 339.395 3.507 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C2CC2)[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594512885 1033417973 /nfs/dbraw/zinc/41/79/73/1033417973.db2.gz SKUPXPACVHQJSS-FASAQXTFSA-N 1 0 348.443 3.992 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000594515336 1033423431 /nfs/dbraw/zinc/42/34/31/1033423431.db2.gz NVSQIRPVUHDZFX-FZKQIMNGSA-N 1 0 325.412 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(CNc2ccc([C@@H]3C[NH2+]CCO3)cc2)c(Cl)c1 ZINC000594740329 1033511085 /nfs/dbraw/zinc/51/10/85/1033511085.db2.gz VTNSADYPWNMNKJ-KRWDZBQOSA-N 1 0 347.802 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(F)ccc2OC(F)F)cc1 ZINC000594918572 1033545009 /nfs/dbraw/zinc/54/50/09/1033545009.db2.gz BZRGHDPRUMZPFW-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO C[C@@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CC[N@H+](C)CC1 ZINC000511307902 1033550263 /nfs/dbraw/zinc/55/02/63/1033550263.db2.gz NMJHOMKSIXYKHK-SNVBAGLBSA-N 1 0 329.322 3.676 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583491 1033574963 /nfs/dbraw/zinc/57/49/63/1033574963.db2.gz KKHBVVLBNFZYOE-RDJZCZTQSA-N 1 0 325.412 3.775 20 5 EHBDRO C[C@]1(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1(F)F ZINC000594978650 1033581640 /nfs/dbraw/zinc/58/16/40/1033581640.db2.gz USRLBZZUMHIMSF-ZDUSSCGKSA-N 1 0 336.285 3.721 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])c1 ZINC000059372101 1033590445 /nfs/dbraw/zinc/59/04/45/1033590445.db2.gz PVBGRNJSXJXQEA-KRWDZBQOSA-N 1 0 342.395 3.819 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(C3(O)CC3)CC2)o1 ZINC000593647874 1033609818 /nfs/dbraw/zinc/60/98/18/1033609818.db2.gz OUIDCQAKBQXNSR-UHFFFAOYSA-N 1 0 342.395 3.592 20 5 EHBDRO O=C(NCCNc1ccccn1)c1cc2ccccc2c2cccnc12 ZINC000063705031 1033618729 /nfs/dbraw/zinc/61/87/29/1033618729.db2.gz GMGHSMBSOJJPSL-UHFFFAOYSA-N 1 0 342.402 3.625 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](c2ccccc2)[C@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000594992906 1033624435 /nfs/dbraw/zinc/62/44/35/1033624435.db2.gz ZZDRSVPLMRXHRN-RTBURBONSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCO[C@@H](C(C)C)C1 ZINC000595040267 1033661088 /nfs/dbraw/zinc/66/10/88/1033661088.db2.gz FUZXKXGKHPWZDU-GRDNDAEWSA-N 1 0 336.432 3.705 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CO1 ZINC000595050151 1033667808 /nfs/dbraw/zinc/66/78/08/1033667808.db2.gz QIJFDDZLWDWEGL-WMZOPIPTSA-N 1 0 326.396 3.841 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@H]1CCCCO1 ZINC000599044668 1033672501 /nfs/dbraw/zinc/67/25/01/1033672501.db2.gz RYDJUNZYWTUKPW-IINYFYTJSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000595100576 1033689585 /nfs/dbraw/zinc/68/95/85/1033689585.db2.gz VPEKNWJLCXMBTA-ZUEVXXBESA-N 1 0 328.412 3.718 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595109145 1033694262 /nfs/dbraw/zinc/69/42/62/1033694262.db2.gz UQKOCTCUHKMDDT-DJIMGWMZSA-N 1 0 332.444 3.711 20 5 EHBDRO CCC[C@H]([NH2+]Cc1c(C2CC2)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000595078363 1033695920 /nfs/dbraw/zinc/69/59/20/1033695920.db2.gz VGEFLYVEXCQPBH-KRWDZBQOSA-N 1 0 328.416 3.837 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081589 1033696225 /nfs/dbraw/zinc/69/62/25/1033696225.db2.gz SMNLMMRBTQRECB-GJZGRUSLSA-N 1 0 347.459 3.661 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@H]2Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000595083758 1033698886 /nfs/dbraw/zinc/69/88/86/1033698886.db2.gz CAMGBAPOOJLOKC-JCGIZDLHSA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](n1cccn1)C(F)(F)F ZINC000599053931 1033705042 /nfs/dbraw/zinc/70/50/42/1033705042.db2.gz BAMDBHGJVIUABI-FZMZJTMJSA-N 1 0 342.321 3.554 20 5 EHBDRO CCC[C@@H]([NH2+]CC(C)(C)C(=O)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599085160 1033724689 /nfs/dbraw/zinc/72/46/89/1033724689.db2.gz VRNRFWUKGGPAPA-QGZVFWFLSA-N 1 0 347.459 3.674 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@@H](Cc2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595331246 1033732012 /nfs/dbraw/zinc/73/20/12/1033732012.db2.gz SWUNBSREQFIVFR-HNNXBMFYSA-N 1 0 335.379 3.729 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599098556 1033732856 /nfs/dbraw/zinc/73/28/56/1033732856.db2.gz LTVIQWIUMRDFHY-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@H]2CCCc2ccccc2)c1[N+](=O)[O-] ZINC000595351752 1033776620 /nfs/dbraw/zinc/77/66/20/1033776620.db2.gz NRIJTCDZSHPPRJ-MRXNPFEDSA-N 1 0 329.400 3.879 20 5 EHBDRO Cc1noc(C[NH2+][C@H](C)C2(c3ccccc3)CCCC2)c1[N+](=O)[O-] ZINC000595442501 1033805233 /nfs/dbraw/zinc/80/52/33/1033805233.db2.gz UIERGBNFSVFXCD-CQSZACIVSA-N 1 0 329.400 3.881 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000595467664 1033821261 /nfs/dbraw/zinc/82/12/61/1033821261.db2.gz SPTZADJTEBLXAR-JZXOWHBKSA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@H]([NH2+][C@H](CO)CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593718988 1033832539 /nfs/dbraw/zinc/83/25/39/1033832539.db2.gz SGMMQYCLNAVCLZ-RYUDHWBXSA-N 1 0 338.404 3.694 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2cc(C)sc2C)c1 ZINC000593021337 1033834476 /nfs/dbraw/zinc/83/44/76/1033834476.db2.gz VZWOZILEWAOQLX-LLVKDONJSA-N 1 0 348.424 3.911 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@]2(C)Cc2cccc(F)c2)c1[N+](=O)[O-] ZINC000595564067 1033844746 /nfs/dbraw/zinc/84/47/46/1033844746.db2.gz WETIFXKNCLFLEQ-KRWDZBQOSA-N 1 0 333.363 3.628 20 5 EHBDRO Cc1c(C[NH2+]C2(Cc3ccccc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000451942409 1033992660 /nfs/dbraw/zinc/99/26/60/1033992660.db2.gz RYXSWOHTFKFNOQ-UHFFFAOYSA-N 1 0 340.423 3.785 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000603871494 1033996320 /nfs/dbraw/zinc/99/63/20/1033996320.db2.gz NMITVNNAQRUFMT-UHFFFAOYSA-N 1 0 325.840 3.805 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H]([C@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787961 1033998724 /nfs/dbraw/zinc/99/87/24/1033998724.db2.gz LAZXWPQISLFDEP-FUHWJXTLSA-N 1 0 348.443 3.775 20 5 EHBDRO CC(C)(C)OC(=O)[C@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC1 ZINC000596064344 1034067092 /nfs/dbraw/zinc/06/70/92/1034067092.db2.gz WNXNLIFQLGEXIL-CYBMUJFWSA-N 1 0 340.445 3.504 20 5 EHBDRO O=[N+]([O-])c1cc(NC[C@H]2CC[N@@H+](C3CC3)C2)ccc1C(F)(F)F ZINC000596079347 1034071247 /nfs/dbraw/zinc/07/12/47/1034071247.db2.gz OUZAZLXXZAJNAL-SNVBAGLBSA-N 1 0 329.322 3.510 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625117 1034072211 /nfs/dbraw/zinc/07/22/11/1034072211.db2.gz FZZHRHYDQOAXFV-RZGXBDKHSA-N 1 0 332.322 3.515 20 5 EHBDRO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093695 1034079585 /nfs/dbraw/zinc/07/95/85/1034079585.db2.gz DPIRGJCUGCTNFT-WBVHZDCISA-N 1 0 331.460 3.676 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677016 1034084756 /nfs/dbraw/zinc/08/47/56/1034084756.db2.gz GEZXEZSPZOTISK-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)CC2 ZINC000596183679 1034101521 /nfs/dbraw/zinc/10/15/21/1034101521.db2.gz YUECJWROVSZGCB-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)C2)C1 ZINC000596244810 1034134037 /nfs/dbraw/zinc/13/40/37/1034134037.db2.gz UNSZKSFSQIUMPK-HNNXBMFYSA-N 1 0 343.349 3.536 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000596308862 1034165406 /nfs/dbraw/zinc/16/54/06/1034165406.db2.gz XCMITZQLDDEYHO-CYBMUJFWSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000179375765 1034245191 /nfs/dbraw/zinc/24/51/91/1034245191.db2.gz IIRXERFSJJUMLV-NWDGAFQWSA-N 1 0 347.440 3.951 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc3c(c2)CC[C@H]3[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000456267179 1034266858 /nfs/dbraw/zinc/26/68/58/1034266858.db2.gz ILCACTDGBZHSNW-GOSISDBHSA-N 1 0 339.395 3.704 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc2c(s1)CCCC2 ZINC000179424306 1034297325 /nfs/dbraw/zinc/29/73/25/1034297325.db2.gz MIYYSKNJWVPKIO-LBPRGKRZSA-N 1 0 331.441 3.823 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H]1COc2ccccc2O1 ZINC000604427981 1034375543 /nfs/dbraw/zinc/37/55/43/1034375543.db2.gz MVWJWWGIEUPJTK-QGZVFWFLSA-N 1 0 342.395 3.645 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCCn3nccc32)c2cc([N+](=O)[O-])ccc21 ZINC000601320380 1034451923 /nfs/dbraw/zinc/45/19/23/1034451923.db2.gz GDPSCIGVRYUYMV-CVEARBPZSA-N 1 0 326.400 3.638 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@]2(CO)CCc3ccccc32)cc1[N+](=O)[O-] ZINC000135885162 1034452368 /nfs/dbraw/zinc/45/23/68/1034452368.db2.gz HQWHWLMTTUFRNQ-HXUWFJFHSA-N 1 0 340.423 3.642 20 5 EHBDRO CC1(O)CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000179724281 1034591325 /nfs/dbraw/zinc/59/13/25/1034591325.db2.gz JTHXTBXBZNBSRA-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO CC(C)c1ccc(CNCc2ccc(C[NH3+])cc2F)cc1[N+](=O)[O-] ZINC000593315836 1034634077 /nfs/dbraw/zinc/63/40/77/1034634077.db2.gz FPPUTUBJNXKKFW-UHFFFAOYSA-N 1 0 331.391 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Cc3ccncc3)C2)c(Cl)c1 ZINC000612402214 1034892974 /nfs/dbraw/zinc/89/29/74/1034892974.db2.gz VNGCYPZIWRSNMD-AWEZNQCLSA-N 1 0 331.803 3.708 20 5 EHBDRO CC(C)(C)[NH+]1CCC(NCc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000236638660 1034998870 /nfs/dbraw/zinc/99/88/70/1034998870.db2.gz DREDDRKLEIZJGM-UHFFFAOYSA-N 1 0 325.840 3.601 20 5 EHBDRO CC(C)OCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000612593489 1035083362 /nfs/dbraw/zinc/08/33/62/1035083362.db2.gz BFBNUWQUNXUVSI-UHFFFAOYSA-N 1 0 343.427 3.877 20 5 EHBDRO Cn1cc([C@@H]2C[N@H+](Cc3c(Cl)cccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000580841782 1035458573 /nfs/dbraw/zinc/45/85/73/1035458573.db2.gz MHGNXKVKQZKAHT-AWEZNQCLSA-N 1 0 348.834 3.607 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCCC12CCCCC2 ZINC000534728785 1035527568 /nfs/dbraw/zinc/52/75/68/1035527568.db2.gz OTTFKJIQWDDEBB-UHFFFAOYSA-N 1 0 331.416 3.640 20 5 EHBDRO COCC1(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000581681403 1035547032 /nfs/dbraw/zinc/54/70/32/1035547032.db2.gz NCYUNGUPBIYYCE-QGZVFWFLSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)([NH2+]Cc1cc2ccccc2[nH]c1=O)c1ccccc1[N+](=O)[O-] ZINC000492397742 1035724111 /nfs/dbraw/zinc/72/41/11/1035724111.db2.gz KXINXBYUNILLII-UHFFFAOYSA-N 1 0 337.379 3.874 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](CO)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000588231256 1035828579 /nfs/dbraw/zinc/82/85/79/1035828579.db2.gz ZBKXUDLTYYHPFY-HNAYVOBHSA-N 1 0 346.427 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cc(C4CC4)no3)C2)cc1 ZINC000595527663 1035923481 /nfs/dbraw/zinc/92/34/81/1035923481.db2.gz WOQMFCSVBDBRIG-OAHLLOKOSA-N 1 0 327.384 3.840 20 5 EHBDRO COC1CCC([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000414191591 1035976743 /nfs/dbraw/zinc/97/67/43/1035976743.db2.gz UJXRXDHENSJHAZ-AGERRDQYSA-N 1 0 332.444 3.853 20 5 EHBDRO COC1CCC([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000414191599 1035977457 /nfs/dbraw/zinc/97/74/57/1035977457.db2.gz UJXRXDHENSJHAZ-LTDKPHRXSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000463951743 1035993434 /nfs/dbraw/zinc/99/34/34/1035993434.db2.gz BVQRSDNXQODSDR-GJZGRUSLSA-N 1 0 348.447 3.596 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000492652214 1036112180 /nfs/dbraw/zinc/11/21/80/1036112180.db2.gz LBSGHDGRYFHYIQ-AWEZNQCLSA-N 1 0 344.411 3.762 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056197232 1036139165 /nfs/dbraw/zinc/13/91/65/1036139165.db2.gz AXLNYAHKWDMCJO-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@](C)(OC)C2CC2)cc1[N+](=O)[O-] ZINC000414226281 1036151338 /nfs/dbraw/zinc/15/13/38/1036151338.db2.gz BUMXOKKBSBOSII-VEVIJQCQSA-N 1 0 336.432 3.848 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000152277043 1036271285 /nfs/dbraw/zinc/27/12/85/1036271285.db2.gz JVJQZGIPLOGXEY-YJBOKZPZSA-N 1 0 343.427 3.984 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCOc2ccccc21 ZINC000589185020 1036297260 /nfs/dbraw/zinc/29/72/60/1036297260.db2.gz MMLZJDFXJCFUHO-INIZCTEOSA-N 1 0 326.396 3.635 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589209664 1036313269 /nfs/dbraw/zinc/31/32/69/1036313269.db2.gz QFBIVFKFHBHRAE-MRXNPFEDSA-N 1 0 340.427 3.617 20 5 EHBDRO COc1cccc(C2(C[NH2+]Cc3ccc([N+](=O)[O-])cc3F)CC2)c1 ZINC000589319604 1036357477 /nfs/dbraw/zinc/35/74/77/1036357477.db2.gz IXQDOXQKNURXRA-UHFFFAOYSA-N 1 0 330.359 3.564 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541548177 1036427479 /nfs/dbraw/zinc/42/74/79/1036427479.db2.gz FJPOYKCDDPOOFI-OAHLLOKOSA-N 1 0 334.803 3.596 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])c1csnn1 ZINC000414293531 1036495445 /nfs/dbraw/zinc/49/54/45/1036495445.db2.gz CYPFUKIPSPWTGU-SCRDCRAPSA-N 1 0 332.429 3.508 20 5 EHBDRO C[C@@H](NC(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000249745222 1036531327 /nfs/dbraw/zinc/53/13/27/1036531327.db2.gz BYSRBXHYQHLBJS-KFWWJZLASA-N 1 0 341.411 3.511 20 5 EHBDRO CC(C)[C@@H](O)CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050287 1036580850 /nfs/dbraw/zinc/58/08/50/1036580850.db2.gz BKIQFWBDZJERCU-RBUKOAKNSA-N 1 0 328.412 3.681 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742948 1036601034 /nfs/dbraw/zinc/60/10/34/1036601034.db2.gz KHVSPHNMVGDLFF-OEAJRASXSA-N 1 0 338.473 3.808 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@H](CO)C1 ZINC000414337137 1036743656 /nfs/dbraw/zinc/74/36/56/1036743656.db2.gz KMTHLFMWDLVAMN-RRFJBIMHSA-N 1 0 338.473 3.606 20 5 EHBDRO CCOc1ccccc1OCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180406093 1036780722 /nfs/dbraw/zinc/78/07/22/1036780722.db2.gz CMTSMRNBLYSJGI-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@H+]2CCCCC[C@H]2CCO)c1 ZINC000590180601 1036788356 /nfs/dbraw/zinc/78/83/56/1036788356.db2.gz LDQPXJAIFDMYAI-ZDUSSCGKSA-N 1 0 346.349 3.741 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414339779 1036794031 /nfs/dbraw/zinc/79/40/31/1036794031.db2.gz GBYWZGINMBZHKU-CJNGLKHVSA-N 1 0 329.375 3.663 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@@H]2[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000539511941 1036836930 /nfs/dbraw/zinc/83/69/30/1036836930.db2.gz JGJNHOMBZXTPJI-RDJZCZTQSA-N 1 0 332.425 3.975 20 5 EHBDRO C[C@@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000180469528 1036871968 /nfs/dbraw/zinc/87/19/68/1036871968.db2.gz MWVWBTBHKHNSBR-YWZLYKJASA-N 1 0 339.439 3.757 20 5 EHBDRO C[N@H+](CCOc1ccccc1F)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761504962 1037087704 /nfs/dbraw/zinc/08/77/04/1037087704.db2.gz BIALGYUOWLMQIE-UHFFFAOYSA-N 1 0 338.766 3.898 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCNc2ccccn2)c2ccccc2)c1 ZINC000493276724 1037212761 /nfs/dbraw/zinc/21/27/61/1037212761.db2.gz MEIYXIWBWFPTJM-FQEVSTJZSA-N 1 0 348.406 3.781 20 5 EHBDRO CC(C)N(C)c1ccc(CNCc2ccc([N+](=O)[O-])cc2Cl)cn1 ZINC000191611063 1037281566 /nfs/dbraw/zinc/28/15/66/1037281566.db2.gz GFHCNMJMEJKGEL-UHFFFAOYSA-N 1 0 348.834 3.778 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000532449028 1037302276 /nfs/dbraw/zinc/30/22/76/1037302276.db2.gz RKAVVSDRKJIKFX-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H]([NH2+]CCCOCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000532447859 1037309148 /nfs/dbraw/zinc/30/91/48/1037309148.db2.gz FSVFLTOLDCOGGA-MRXNPFEDSA-N 1 0 328.412 3.895 20 5 EHBDRO CN(Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076109669 1037325610 /nfs/dbraw/zinc/32/56/10/1037325610.db2.gz FHPVBXZAUXZMAL-LJQANCHMSA-N 1 0 339.439 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CC[C@H](O)C3)s2)cc1 ZINC000188808838 1037331795 /nfs/dbraw/zinc/33/17/95/1037331795.db2.gz JJUXJCVKBBVTCS-WFASDCNBSA-N 1 0 332.425 3.574 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@H]2CC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601349 1037487318 /nfs/dbraw/zinc/48/73/18/1037487318.db2.gz BOXHHPOAESDGLA-ZBFHGGJFSA-N 1 0 336.432 3.631 20 5 EHBDRO CC[C@@H](CO)[N@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000573407123 1037507621 /nfs/dbraw/zinc/50/76/21/1037507621.db2.gz FDNITPYINLYIAO-SFHVURJKSA-N 1 0 328.412 3.676 20 5 EHBDRO CCc1ccc([C@@H](N[C@H]2CCC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578386 1037517535 /nfs/dbraw/zinc/51/75/35/1037517535.db2.gz YIQJZLXTHBPKRW-KXBFYZLASA-N 1 0 343.427 3.571 20 5 EHBDRO C[C@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790590 1037534089 /nfs/dbraw/zinc/53/40/89/1037534089.db2.gz PFZNVOGXPLJXBL-QWQRMKEZSA-N 1 0 344.411 3.836 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])cn1)c1ccccc1Cl ZINC000546899177 1037571329 /nfs/dbraw/zinc/57/13/29/1037571329.db2.gz WQFSYHDVYMIUOP-HNNXBMFYSA-N 1 0 349.822 3.533 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCC2 ZINC000760889293 1037577339 /nfs/dbraw/zinc/57/73/39/1037577339.db2.gz YBYBXNGCJKBIKF-VBKZILBWSA-N 1 0 340.423 3.858 20 5 EHBDRO COc1ccc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)cc1O ZINC000468639247 1037674521 /nfs/dbraw/zinc/67/45/21/1037674521.db2.gz RRZMRPICZMMZHO-MDWZMJQESA-N 1 0 328.368 3.502 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCC2 ZINC000760903752 1037696787 /nfs/dbraw/zinc/69/67/87/1037696787.db2.gz YBYBXNGCJKBIKF-JLTOFOAXSA-N 1 0 340.423 3.858 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000341207216 1037762608 /nfs/dbraw/zinc/76/26/08/1037762608.db2.gz JRHQUQCAQMYVRD-OAHLLOKOSA-N 1 0 327.384 3.583 20 5 EHBDRO F[C@@H]1CC[NH2+]C[C@@H]1Nc1nc2c(ccc3ccccc32)nc1Cl ZINC001168227385 1037814878 /nfs/dbraw/zinc/81/48/78/1037814878.db2.gz QOIODTUOZLHYBM-OCCSQVGLSA-N 1 0 330.794 3.548 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC000540375881 1037859433 /nfs/dbraw/zinc/85/94/33/1037859433.db2.gz INEYAFGZSMUSTK-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC[C@@H](C)C[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375088 1037924650 /nfs/dbraw/zinc/92/46/50/1037924650.db2.gz QAYJXFDGLQVHIT-OCCSQVGLSA-N 1 0 349.456 3.605 20 5 EHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cc2n(n1)CCCC2 ZINC000592387711 1037953162 /nfs/dbraw/zinc/95/31/62/1037953162.db2.gz IMNGOBOOODONND-OAHLLOKOSA-N 1 0 342.443 3.801 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000468647093 1038144924 /nfs/dbraw/zinc/14/49/24/1038144924.db2.gz HOIKSIXLXUUXPZ-GRFAERAESA-N 1 0 339.439 3.891 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000538751731 1038515511 /nfs/dbraw/zinc/51/55/11/1038515511.db2.gz KKLZMCYQVAEUES-GOSISDBHSA-N 1 0 325.412 3.980 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CN(C)Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000539049348 1038653909 /nfs/dbraw/zinc/65/39/09/1038653909.db2.gz OXFMZCLTSOHXGH-OALUTQOASA-N 1 0 325.412 3.822 20 5 EHBDRO CC(C)c1ccc([C@H]([NH2+]CCn2ccc([N+](=O)[O-])n2)C(C)C)cc1 ZINC000539244594 1038750695 /nfs/dbraw/zinc/75/06/95/1038750695.db2.gz ZCKDHMQXRYJRJL-GOSISDBHSA-N 1 0 330.432 3.902 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000539316625 1038770940 /nfs/dbraw/zinc/77/09/40/1038770940.db2.gz AYPNMYKXKVEUGK-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO CCC(=O)c1ccc(NC2CC(C)(C)[NH2+]C(C)(C)C2)c([N+](=O)[O-])c1 ZINC000479930498 1038908522 /nfs/dbraw/zinc/90/85/22/1038908522.db2.gz MWZQYYAWQRLCBI-UHFFFAOYSA-N 1 0 333.432 3.909 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCOC2CCSCC2)cc1[N+](=O)[O-] ZINC000898442028 1039049987 /nfs/dbraw/zinc/04/99/87/1039049987.db2.gz ISGFFRQSGWYJTL-UHFFFAOYSA-N 1 0 338.473 3.720 20 5 EHBDRO COc1cc(CN2CCSC[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000485507307 1039175790 /nfs/dbraw/zinc/17/57/90/1039175790.db2.gz VMYOVDMQUYROFQ-KRWDZBQOSA-N 1 0 344.436 3.894 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000570189655 1039260321 /nfs/dbraw/zinc/26/03/21/1039260321.db2.gz FKBQORGHIHZAQX-XLAORIBOSA-N 1 0 340.427 3.668 20 5 EHBDRO COc1ccc([C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485763341 1039537022 /nfs/dbraw/zinc/53/70/22/1039537022.db2.gz BRNDNGKXKZWRDI-ZDUSSCGKSA-N 1 0 330.384 3.805 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485796080 1039549268 /nfs/dbraw/zinc/54/92/68/1039549268.db2.gz UIUDOLKYZPUJMM-KRWDZBQOSA-N 1 0 342.395 3.949 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000485846428 1039612295 /nfs/dbraw/zinc/61/22/95/1039612295.db2.gz IBKONDIZFNCVMO-GFCCVEGCSA-N 1 0 343.408 3.934 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000552924224 1039621389 /nfs/dbraw/zinc/62/13/89/1039621389.db2.gz BEBYVFOQAHJUFA-FNHZYXHNSA-N 1 0 325.412 3.691 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1cccs1 ZINC000417314618 1039668151 /nfs/dbraw/zinc/66/81/51/1039668151.db2.gz RNOWDYYCMFOVGL-TUKIKUTGSA-N 1 0 332.425 3.947 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOCC(F)(F)F)CCCC2 ZINC000417346717 1039708918 /nfs/dbraw/zinc/70/89/18/1039708918.db2.gz WCLWIOJYVWZAEI-AWEZNQCLSA-N 1 0 332.322 3.531 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000570411043 1039792265 /nfs/dbraw/zinc/79/22/65/1039792265.db2.gz LLISXCQCAMQQLB-MRXNPFEDSA-N 1 0 340.379 3.533 20 5 EHBDRO CC(C)[C@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000489388681 1039903816 /nfs/dbraw/zinc/90/38/16/1039903816.db2.gz JCBCIDDUTLDZEE-HXUWFJFHSA-N 1 0 347.462 3.800 20 5 EHBDRO COc1ccc(F)c(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000549804533 1039924199 /nfs/dbraw/zinc/92/41/99/1039924199.db2.gz IMGYQCBFMDVHCO-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO CC(C)N(C)C[C@H](C)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990961 1040026429 /nfs/dbraw/zinc/02/64/29/1040026429.db2.gz HEUIXBDWCXXSOL-XYJFISCASA-N 1 0 333.476 3.624 20 5 EHBDRO CCOc1ccc(NC(=O)C[N@H+](C)C2CCCCCC2)c([N+](=O)[O-])c1 ZINC000029166230 1040196548 /nfs/dbraw/zinc/19/65/48/1040196548.db2.gz PRCIYTYMWNLPAB-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(Nc2cccc3c2OCC[C@H]3[NH+](C)C)n1 ZINC000432926896 1040196868 /nfs/dbraw/zinc/19/68/68/1040196868.db2.gz DRGIWJWHWCUESW-OAHLLOKOSA-N 1 0 342.399 3.735 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H]2C2CCC2)c1 ZINC000512622028 1040293383 /nfs/dbraw/zinc/29/33/83/1040293383.db2.gz HPWZCJADNDPVJS-AWEZNQCLSA-N 1 0 326.343 3.961 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000490038972 1040301895 /nfs/dbraw/zinc/30/18/95/1040301895.db2.gz BFDBVCYSMOIBGQ-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000490092143 1040354896 /nfs/dbraw/zinc/35/48/96/1040354896.db2.gz YVCISCVTMHAOBR-BMGDILEWSA-N 1 0 348.443 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@H]3CC4CCC3CC4)co2)cc1 ZINC000432987652 1040375065 /nfs/dbraw/zinc/37/50/65/1040375065.db2.gz FAXVMIBURIITIT-FVKWTLKZSA-N 1 0 327.384 3.918 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CC[C@@H](CO)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453264521 1040576705 /nfs/dbraw/zinc/57/67/05/1040576705.db2.gz ACQKKNDJNCCDBK-FRIZHTMISA-N 1 0 344.411 3.590 20 5 EHBDRO CN(C)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000418119135 1040613794 /nfs/dbraw/zinc/61/37/94/1040613794.db2.gz XGQKUZUNGFDHRS-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(CN2CCCC(F)(F)CC2)c1 ZINC000600190307 1040799770 /nfs/dbraw/zinc/79/97/70/1040799770.db2.gz YWIIUBHXMBGEBE-UHFFFAOYSA-N 1 0 336.285 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]Cc2cccc(CO)c2)c2ccccc2)c1 ZINC000491031213 1040876491 /nfs/dbraw/zinc/87/64/91/1040876491.db2.gz MNQPJECGOCBRCU-NRFANRHFSA-N 1 0 348.402 3.966 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000433157845 1040940404 /nfs/dbraw/zinc/94/04/04/1040940404.db2.gz NVXBQRSEEVIWMN-IAGOWNOFSA-N 1 0 343.427 3.803 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433163705 1040949720 /nfs/dbraw/zinc/94/97/20/1040949720.db2.gz CLLKUZIWXSMBEM-VQIMIIECSA-N 1 0 340.423 3.510 20 5 EHBDRO CC(C)[N@@H+](C)C[C@H](C)NCc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000566649903 1041019371 /nfs/dbraw/zinc/01/93/71/1041019371.db2.gz PJZGTUDYWIXYAY-AWEZNQCLSA-N 1 0 331.416 3.673 20 5 EHBDRO C[C@H](COc1ccc(F)cc1F)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481541311 1041039099 /nfs/dbraw/zinc/03/90/99/1041039099.db2.gz HUEOIWWLQXKFDN-VXGBXAGGSA-N 1 0 336.338 3.991 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CNc1cccc2c1OCC[C@@H]2[NH+](C)C ZINC000433207706 1041096753 /nfs/dbraw/zinc/09/67/53/1041096753.db2.gz RKHIYAUTJNIXMC-SFHVURJKSA-N 1 0 341.411 3.901 20 5 EHBDRO CCc1ccc([C@H]2CCCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871431 1041204297 /nfs/dbraw/zinc/20/42/97/1041204297.db2.gz BEAXNIJYHRQLGZ-MRXNPFEDSA-N 1 0 332.404 3.564 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@]2(C)CCCC[C@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000433305202 1041247429 /nfs/dbraw/zinc/24/74/29/1041247429.db2.gz PDLXVBIACBOBTL-SCTDSRPQSA-N 1 0 332.444 3.848 20 5 EHBDRO COCc1ccccc1/C=C(\C)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000511827162 1041669377 /nfs/dbraw/zinc/66/93/77/1041669377.db2.gz URYUKXBOCIUIRW-FOWTUZBSSA-N 1 0 340.423 3.977 20 5 EHBDRO COc1ccc([C@H](CNc2ccsc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000063256128 1041927239 /nfs/dbraw/zinc/92/72/39/1041927239.db2.gz JWKWNRASCQRPRZ-INIZCTEOSA-N 1 0 347.440 3.914 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000165005164 1042596147 /nfs/dbraw/zinc/59/61/47/1042596147.db2.gz LYEFQXAJSBDNKV-KRWDZBQOSA-N 1 0 327.384 3.664 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)COc1ccc(F)cc1F)c1ccc([N+](=O)[O-])cc1 ZINC000481541307 1042758769 /nfs/dbraw/zinc/75/87/69/1042758769.db2.gz HUEOIWWLQXKFDN-NWDGAFQWSA-N 1 0 336.338 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cc1F ZINC000291235467 1042789301 /nfs/dbraw/zinc/78/93/01/1042789301.db2.gz UMBLVXLIQURAOC-YXJHDRRASA-N 1 0 336.407 3.640 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000165640983 1042865209 /nfs/dbraw/zinc/86/52/09/1042865209.db2.gz OMSMQWGUVBFUBY-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000432339477 1042972744 /nfs/dbraw/zinc/97/27/44/1042972744.db2.gz ITYXSOHXACWZBI-SWLSCSKDSA-N 1 0 335.835 3.701 20 5 EHBDRO Cc1nc2ccc(C[NH2+]CCc3ccccc3[N+](=O)[O-])cc2s1 ZINC000344085311 1043224487 /nfs/dbraw/zinc/22/44/87/1043224487.db2.gz DQCMTGMSMMVLOY-UHFFFAOYSA-N 1 0 327.409 3.845 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000279096226 1043345433 /nfs/dbraw/zinc/34/54/33/1043345433.db2.gz NWMUECOQNGGICJ-QGZVFWFLSA-N 1 0 340.427 3.568 20 5 EHBDRO CCOC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000072975804 1043373989 /nfs/dbraw/zinc/37/39/89/1043373989.db2.gz IGWHMTPZNAEAIY-HNNXBMFYSA-N 1 0 336.432 3.631 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898520 1043599586 /nfs/dbraw/zinc/59/95/86/1043599586.db2.gz YMKUBPLKMLTKQD-RDTXWAMCSA-N 1 0 328.416 3.926 20 5 EHBDRO CC[C@@H](CSC)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182134386 1044098330 /nfs/dbraw/zinc/09/83/30/1044098330.db2.gz FWVKBRDBECUJPB-LBPRGKRZSA-N 1 0 337.470 3.950 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2COc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000572402182 1044711841 /nfs/dbraw/zinc/71/18/41/1044711841.db2.gz YMOWEGUVYWWFAF-BLLLJJGKSA-N 1 0 330.359 3.697 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@H]2[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000072746567 1126872153 /nfs/dbraw/zinc/87/21/53/1126872153.db2.gz WUIUWBHSLTUBGM-RTBURBONSA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1nn(C[N@@H+]2CC[C@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946919 1127558396 /nfs/dbraw/zinc/55/83/96/1127558396.db2.gz YVCKSHGHAKJKHG-INIZCTEOSA-N 1 0 336.395 3.700 20 5 EHBDRO Cc1cc(CC[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)on1 ZINC000552099695 1127578548 /nfs/dbraw/zinc/57/85/48/1127578548.db2.gz QOORYYCOJBPGTJ-IBGZPJMESA-N 1 0 337.379 3.813 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@@H]1C ZINC001168541730 1127623375 /nfs/dbraw/zinc/62/33/75/1127623375.db2.gz JWXZKDVVZARPHF-XNJJOIOASA-N 1 0 348.834 3.740 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC001168603733 1128288207 /nfs/dbraw/zinc/28/82/07/1128288207.db2.gz IFJPWURNUIRXQG-CYBMUJFWSA-N 1 0 345.374 3.722 20 5 EHBDRO Cc1cnc(NCc2ccc(C[NH+]3CCCCC3)cc2)c([N+](=O)[O-])c1 ZINC000301451579 1128349703 /nfs/dbraw/zinc/34/97/03/1128349703.db2.gz QGLWFRDLLIGLBG-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCSC(C)(C)C1 ZINC000903280812 1128465299 /nfs/dbraw/zinc/46/52/99/1128465299.db2.gz DHOKAAJUBWHWLV-RISCZKNCSA-N 1 0 326.437 3.929 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCSc3c(F)cccc32)cc1 ZINC000765849491 1128570037 /nfs/dbraw/zinc/57/00/37/1128570037.db2.gz QLYHEOVJSSFVTD-HZPDHXFCSA-N 1 0 348.399 3.594 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000273535805 1128583832 /nfs/dbraw/zinc/58/38/32/1128583832.db2.gz WFFRCXXCXMZRMG-WMZOPIPTSA-N 1 0 330.359 3.744 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@]2(O)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000765879121 1128635979 /nfs/dbraw/zinc/63/59/79/1128635979.db2.gz UAJXXOHBBPDZSO-YWZLYKJASA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000091350139 1128642433 /nfs/dbraw/zinc/64/24/33/1128642433.db2.gz NYDSDCZNPLVQHN-IBGZPJMESA-N 1 0 341.411 3.829 20 5 EHBDRO CC(C)[C@H](C)NC(=O)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153853704 1128773402 /nfs/dbraw/zinc/77/34/02/1128773402.db2.gz DJCQNAAYWWBYHM-LSDHHAIUSA-N 1 0 347.459 3.529 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000554945287 1128917864 /nfs/dbraw/zinc/91/78/64/1128917864.db2.gz GQADKLUSSFVRDP-WBVHZDCISA-N 1 0 337.423 3.793 20 5 EHBDRO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(O)c1 ZINC000494544615 1120590519 /nfs/dbraw/zinc/59/05/19/1120590519.db2.gz DUFOVEJCQGEDCZ-CQSZACIVSA-N 1 0 330.384 3.762 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc(C(C)(C)C)no1 ZINC000191573477 1120679514 /nfs/dbraw/zinc/67/95/14/1120679514.db2.gz WLXPVLJVQDJWCM-OLZOCXBDSA-N 1 0 346.431 3.947 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@H](CCO)C1CCCCC1 ZINC000494803690 1120846828 /nfs/dbraw/zinc/84/68/28/1120846828.db2.gz HQKFRJNJDNTSGJ-OAHLLOKOSA-N 1 0 326.824 3.669 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193069257 1120887989 /nfs/dbraw/zinc/88/79/89/1120887989.db2.gz FHHNAQQESBYAAP-LJQANCHMSA-N 1 0 342.443 3.545 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000495007013 1120930371 /nfs/dbraw/zinc/93/03/71/1120930371.db2.gz IDPDQHCFKSJJPH-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCO1 ZINC000495024770 1120932869 /nfs/dbraw/zinc/93/28/69/1120932869.db2.gz FQHRYYHYNCUWHZ-BJZITVGISA-N 1 0 326.396 3.841 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000495373680 1121145025 /nfs/dbraw/zinc/14/50/25/1121145025.db2.gz HGVBSARCUBIXLM-JKSUJKDBSA-N 1 0 338.835 3.728 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2)[NH+]2CCCC2)c1 ZINC000301056058 1121191197 /nfs/dbraw/zinc/19/11/97/1121191197.db2.gz JUODOELZXRVGDV-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO C[C@@H]1CC[N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)[C@H]2CCCC[C@@H]12 ZINC000915210190 1121254481 /nfs/dbraw/zinc/25/44/81/1121254481.db2.gz WUHGRNYEGJIRFI-SKDZVZGDSA-N 1 0 328.416 3.803 20 5 EHBDRO Cc1cnc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039582 1128977556 /nfs/dbraw/zinc/97/75/56/1128977556.db2.gz DWZQUFWAEDXCEL-RDJZCZTQSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCC[C@H](C)C1 ZINC000301075498 1121358562 /nfs/dbraw/zinc/35/85/62/1121358562.db2.gz FCUUQZBLNYAFTN-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1cc(C)c(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000193589829 1121475418 /nfs/dbraw/zinc/47/54/18/1121475418.db2.gz ZPMBECGNYFALLW-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO C[C@H](NCc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380203 1121598243 /nfs/dbraw/zinc/59/82/43/1121598243.db2.gz BRNLJXUGSOIIOA-LPHOPBHVSA-N 1 0 339.439 3.595 20 5 EHBDRO CC(C)CCOCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113330363 1129001293 /nfs/dbraw/zinc/00/12/93/1129001293.db2.gz FHAPIUWQACNZIZ-UHFFFAOYSA-N 1 0 349.456 3.871 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](C(C)C)C1CCOCC1 ZINC000077323819 1129012499 /nfs/dbraw/zinc/01/24/99/1129012499.db2.gz DLCCZHFRPWHUND-UHFFFAOYSA-N 1 0 336.432 3.771 20 5 EHBDRO CC[C@@H](CCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000077453478 1129032620 /nfs/dbraw/zinc/03/26/20/1129032620.db2.gz FJFDBHDZNOPWBF-NSHDSACASA-N 1 0 338.791 3.759 20 5 EHBDRO CC(C)[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176370 1122356879 /nfs/dbraw/zinc/35/68/79/1122356879.db2.gz AJDHYCUBDAYEHU-SFHVURJKSA-N 1 0 330.384 3.712 20 5 EHBDRO CN(CCCOc1ccc(F)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000917046844 1122445068 /nfs/dbraw/zinc/44/50/68/1122445068.db2.gz UBOJRCYJCXUGRV-UHFFFAOYSA-N 1 0 336.338 3.774 20 5 EHBDRO COc1cccc([C@@H](CNc2c(C)cccc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301192786 1122449692 /nfs/dbraw/zinc/44/96/92/1122449692.db2.gz SLZQNXJYIPQTIU-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1c(F)cncc1F ZINC000556916372 1123200888 /nfs/dbraw/zinc/20/08/88/1123200888.db2.gz IDLJTEXNDQOAPZ-NEPJUHHUSA-N 1 0 335.354 3.940 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000073388208 1123201021 /nfs/dbraw/zinc/20/10/21/1123201021.db2.gz AFVGUFONFGUFKO-UHFFFAOYSA-N 1 0 342.395 3.689 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000078270602 1129124924 /nfs/dbraw/zinc/12/49/24/1129124924.db2.gz DRZIBRQPZJJXJX-COPLHBTASA-N 1 0 339.823 3.744 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000609599061 1123619385 /nfs/dbraw/zinc/61/93/85/1123619385.db2.gz HCFXYZAEADOEAC-OAHLLOKOSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc(NC(=O)/C=C\c2cccc([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000255584037 1129147203 /nfs/dbraw/zinc/14/72/03/1129147203.db2.gz GWMLUWCDYZXZJQ-NTMALXAHSA-N 1 0 339.395 3.617 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000615838775 1123884663 /nfs/dbraw/zinc/88/46/63/1123884663.db2.gz CHYYPNGXYRDDJB-WJDWOHSUSA-N 1 0 330.428 3.891 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000618988526 1125263075 /nfs/dbraw/zinc/26/30/75/1125263075.db2.gz XZFSMPBSIRLSND-IBGZPJMESA-N 1 0 340.423 3.642 20 5 EHBDRO CCn1nccc1C1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000619078460 1125273808 /nfs/dbraw/zinc/27/38/08/1125273808.db2.gz RGBUSWNZFQLUCE-ALCCZGGFSA-N 1 0 340.427 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCc3ccc(O)cc3CC2)c1 ZINC000735490446 1131352428 /nfs/dbraw/zinc/35/24/28/1131352428.db2.gz LAPBNLZHEGEWAM-UHFFFAOYSA-N 1 0 332.787 3.555 20 5 EHBDRO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@@H+]1C1CC1 ZINC000301846027 1129189859 /nfs/dbraw/zinc/18/98/59/1129189859.db2.gz ALBPLEWMCWDQED-ZFWWWQNUSA-N 1 0 338.411 3.694 20 5 EHBDRO CC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845875 1129193564 /nfs/dbraw/zinc/19/35/64/1129193564.db2.gz TXXGTEDYCCIEBF-PKOBYXMFSA-N 1 0 339.395 3.655 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ccc1[N+](=O)[O-] ZINC000301891196 1129283179 /nfs/dbraw/zinc/28/31/79/1129283179.db2.gz UNHCMNHRBYCPRR-RHSMWYFYSA-N 1 0 346.818 3.809 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894153 1129288263 /nfs/dbraw/zinc/28/82/63/1129288263.db2.gz WWEOAMCRNSXCSQ-RHSMWYFYSA-N 1 0 346.818 3.809 20 5 EHBDRO COc1cccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000080347401 1129348143 /nfs/dbraw/zinc/34/81/43/1129348143.db2.gz XHDWKCBMWCUTPL-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO COc1ccc(OC)c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000080347339 1129348161 /nfs/dbraw/zinc/34/81/61/1129348161.db2.gz IJSWZTDLMZRZDE-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO CC(C)[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000068448957 1129371848 /nfs/dbraw/zinc/37/18/48/1129371848.db2.gz AKALMZUXNROEEQ-UHFFFAOYSA-N 1 0 339.823 3.840 20 5 EHBDRO Cc1nc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000716229533 1131371774 /nfs/dbraw/zinc/37/17/74/1131371774.db2.gz NMPVILUDZPTSDS-RHSMWYFYSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(-n2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000123730674 1129548539 /nfs/dbraw/zinc/54/85/39/1129548539.db2.gz ORIHQNHBSFYTSA-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](C3CCOCC3)C2)cc1[N+](=O)[O-] ZINC000330609976 1129641608 /nfs/dbraw/zinc/64/16/08/1129641608.db2.gz MUSTUFZWXDJIDU-QGZVFWFLSA-N 1 0 332.444 3.967 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000331182521 1129655896 /nfs/dbraw/zinc/65/58/96/1129655896.db2.gz SBLZXIAUWRMBIO-USXIJHARSA-N 1 0 347.459 3.637 20 5 EHBDRO CC(C)[C@H](C)NC(=O)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000331276512 1129658780 /nfs/dbraw/zinc/65/87/80/1129658780.db2.gz QXOVRYXMMYBKEP-GJZGRUSLSA-N 1 0 347.459 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000281116672 1129703513 /nfs/dbraw/zinc/70/35/13/1129703513.db2.gz XFGUYLVWYCAWSQ-CGTJXYLNSA-N 1 0 336.407 3.640 20 5 EHBDRO Cc1cc(N[C@H]2CCC[C@@H]([NH+](C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302003707 1129762933 /nfs/dbraw/zinc/76/29/33/1129762933.db2.gz JZABMMGOMHNWNS-UONOGXRCSA-N 1 0 328.416 3.736 20 5 EHBDRO Cc1ccc2[nH+]ccc(N3CC[C@@H](Nc4ccc([N+](=O)[O-])cn4)C3)c2c1 ZINC000302795371 1129792179 /nfs/dbraw/zinc/79/21/79/1129792179.db2.gz OPDWVRGSBNGQLC-CQSZACIVSA-N 1 0 349.394 3.537 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000056196236 1129805428 /nfs/dbraw/zinc/80/54/28/1129805428.db2.gz QBDOCWXEWJGZFW-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)cc1F ZINC000056197012 1129805683 /nfs/dbraw/zinc/80/56/83/1129805683.db2.gz VMWPOULIDSQJPY-GHMZBOCLSA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(F)c(F)c1 ZINC000056196710 1129806278 /nfs/dbraw/zinc/80/62/78/1129806278.db2.gz KBEJRSLEWBUAJG-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO O=C(CC[N@@H+]1CCC2(C1)CCCCC2)Nc1ccc([N+](=O)[O-])cc1 ZINC000303923068 1129872953 /nfs/dbraw/zinc/87/29/53/1129872953.db2.gz PDAISLUNLDMQCJ-UHFFFAOYSA-N 1 0 331.416 3.580 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000132246590 1129886328 /nfs/dbraw/zinc/88/63/28/1129886328.db2.gz OVQKRFRSVILQDJ-LJQANCHMSA-N 1 0 340.423 3.757 20 5 EHBDRO COCCC[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000282477038 1129921143 /nfs/dbraw/zinc/92/11/43/1129921143.db2.gz WRVAEMCXVIVORU-KRWDZBQOSA-N 1 0 332.375 3.991 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000008196755 1130038895 /nfs/dbraw/zinc/03/88/95/1130038895.db2.gz HNTSCCUYRDSTEV-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000142113242 1130167493 /nfs/dbraw/zinc/16/74/93/1130167493.db2.gz IOVFAOAXMJXBQQ-AXFHLTTASA-N 1 0 327.812 3.599 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H]2CCC[C@@H]([NH+](C)C)C2)cc1[N+](=O)[O-] ZINC000245508723 1130224085 /nfs/dbraw/zinc/22/40/85/1130224085.db2.gz SMTSRYDHQNRPOY-NUEKZKHPSA-N 1 0 335.448 3.517 20 5 EHBDRO CCc1ccccc1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000766121240 1130352601 /nfs/dbraw/zinc/35/26/01/1130352601.db2.gz NXEUSSOKZVPFNL-UHFFFAOYSA-N 1 0 339.439 3.916 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC([NH+]4CCCCC4)CC3)sc2c1 ZINC000731206600 1130779552 /nfs/dbraw/zinc/77/95/52/1130779552.db2.gz NMDPGPAZRATTAA-UHFFFAOYSA-N 1 0 346.456 3.659 20 5 EHBDRO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000731893301 1130853987 /nfs/dbraw/zinc/85/39/87/1130853987.db2.gz OYQRGHFUBZRXCT-SPYBWZPUSA-N 1 0 326.396 3.945 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(Cl)c1 ZINC000732917907 1130969995 /nfs/dbraw/zinc/96/99/95/1130969995.db2.gz SDDCWTSVKIHBIR-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000348085968 1131151369 /nfs/dbraw/zinc/15/13/69/1131151369.db2.gz NEQJQSRSCRNUCG-GOSISDBHSA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1cccc(C2(O)CC[NH+](Cc3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC000741810526 1131650237 /nfs/dbraw/zinc/65/02/37/1131650237.db2.gz NSFJCMGQOPKHIK-UHFFFAOYSA-N 1 0 340.423 3.695 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCC(C[NH+]2CCCCCC2)CC1 ZINC000742392972 1131714493 /nfs/dbraw/zinc/71/44/93/1131714493.db2.gz WHIRTANZPUQSAU-UHFFFAOYSA-N 1 0 335.423 3.826 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000742423497 1131724089 /nfs/dbraw/zinc/72/40/89/1131724089.db2.gz VGTFBWHSXCFCHW-MRXNPFEDSA-N 1 0 345.830 3.959 20 5 EHBDRO C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000742431374 1131729788 /nfs/dbraw/zinc/72/97/88/1131729788.db2.gz XXSLUIYRFCBGOJ-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO Cc1ccnc([C@@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172897608 1131881274 /nfs/dbraw/zinc/88/12/74/1131881274.db2.gz BCSMAHBHAXMJBV-RHSMWYFYSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cncc(Cl)c1)CC2 ZINC001172899546 1131882118 /nfs/dbraw/zinc/88/21/18/1131882118.db2.gz CNBAHWHYQANMFF-INIZCTEOSA-N 1 0 331.803 3.680 20 5 EHBDRO Cc1csc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172898999 1131882184 /nfs/dbraw/zinc/88/21/84/1131882184.db2.gz KJIWLGTUXOCGCO-SWLSCSKDSA-N 1 0 331.441 3.958 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(O)c1 ZINC001172897981 1131882682 /nfs/dbraw/zinc/88/26/82/1131882682.db2.gz FQOJMQWHRDHWKY-DYVFJYSZSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCCCc1ccccn1)CC2 ZINC001172901208 1131883718 /nfs/dbraw/zinc/88/37/18/1131883718.db2.gz LBYPYESFQMYMPT-IBGZPJMESA-N 1 0 339.439 3.850 20 5 EHBDRO CC(C)(O)[C@H]1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172902552 1131885630 /nfs/dbraw/zinc/88/56/30/1131885630.db2.gz ZRXXZVNHHNGGCA-BZSNNMDCSA-N 1 0 346.471 3.762 20 5 EHBDRO COc1cccc2c1C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172921011 1131905421 /nfs/dbraw/zinc/90/54/21/1131905421.db2.gz NXVUQSHNRNJYDO-KRWDZBQOSA-N 1 0 338.407 3.867 20 5 EHBDRO [NH3+][C@@H]1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc21 ZINC001172911180 1131918312 /nfs/dbraw/zinc/91/83/12/1131918312.db2.gz GTMXFBDMWFGDAS-VQIMIIECSA-N 1 0 337.423 3.752 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2ccc(C)cc2)c1F ZINC001173175669 1131991447 /nfs/dbraw/zinc/99/14/47/1131991447.db2.gz QNQGKPFPWQIOFZ-CQSZACIVSA-N 1 0 346.402 3.814 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C(C)(C)c2cccnc2)c1F ZINC001173174655 1131991632 /nfs/dbraw/zinc/99/16/32/1131991632.db2.gz AERRXTQBPDNQFZ-GFCCVEGCSA-N 1 0 347.390 3.593 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccccn1 ZINC001173187679 1131993703 /nfs/dbraw/zinc/99/37/03/1131993703.db2.gz FGBPOJVIOVSWAO-TZMCWYRMSA-N 1 0 347.390 3.809 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccncc1 ZINC001173190024 1131995101 /nfs/dbraw/zinc/99/51/01/1131995101.db2.gz UCNQCELXDBVGHT-IUODEOHRSA-N 1 0 347.390 3.809 20 5 EHBDRO Cc1nc2cc(C[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC001173215940 1132002323 /nfs/dbraw/zinc/00/23/23/1132002323.db2.gz GBFVFHRGJPHELN-GFCCVEGCSA-N 1 0 325.368 3.765 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC001173219582 1132003597 /nfs/dbraw/zinc/00/35/97/1132003597.db2.gz DOQUWDGPIXOBRQ-KBXCAEBGSA-N 1 0 348.443 3.627 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]2[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220648 1132003905 /nfs/dbraw/zinc/00/39/05/1132003905.db2.gz GIFVGNGEZUPMRC-YJYMSZOUSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)C[C@@H]1c1ccccc1 ZINC001173223485 1132005737 /nfs/dbraw/zinc/00/57/37/1132005737.db2.gz ANFJYUGABFRLNS-OXQOHEQNSA-N 1 0 339.439 3.515 20 5 EHBDRO COc1cccc2c1C[N@@H+]([C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173223963 1132005897 /nfs/dbraw/zinc/00/58/97/1132005897.db2.gz CJRGJRLXVZNVCP-CQSZACIVSA-N 1 0 326.396 3.593 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173230521 1132008190 /nfs/dbraw/zinc/00/81/90/1132008190.db2.gz RTWFDIAOJRDPAN-HNNXBMFYSA-N 1 0 327.428 3.797 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230669 1132009170 /nfs/dbraw/zinc/00/91/70/1132009170.db2.gz TYHPNKMEALALBU-KGLIPLIRSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H]1C1CCCCC1 ZINC001173231065 1132009427 /nfs/dbraw/zinc/00/94/27/1132009427.db2.gz JGKGABKPWVFJSP-HNAYVOBHSA-N 1 0 332.444 3.807 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC001173232281 1132009472 /nfs/dbraw/zinc/00/94/72/1132009472.db2.gz AGTAKDGXOQJYAH-IFXJQAMLSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cncc1-c1ccc(C[NH3+])cc1 ZINC001173230657 1132009585 /nfs/dbraw/zinc/00/95/85/1132009585.db2.gz SSMBTKSOMAOPQP-CQSZACIVSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ncccc1F)C1CC1 ZINC001173230561 1132009653 /nfs/dbraw/zinc/00/96/53/1132009653.db2.gz RXMFQNAMAZRWFE-SJKOYZFVSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCCC(=O)c1cccnc1 ZINC001173232318 1132009674 /nfs/dbraw/zinc/00/96/74/1132009674.db2.gz FCTSOBXKKIMZOG-HNNXBMFYSA-N 1 0 341.411 3.516 20 5 EHBDRO CCOc1ccccc1OCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235490 1132010877 /nfs/dbraw/zinc/01/08/77/1132010877.db2.gz UBYZOSTWXGKAKW-OAHLLOKOSA-N 1 0 344.411 3.593 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccc2c(c1)OCCO2 ZINC001173210065 1132012676 /nfs/dbraw/zinc/01/26/76/1132012676.db2.gz HKSYQPFEJRHBTL-ZIAGYGMSSA-N 1 0 342.395 3.648 20 5 EHBDRO CCOC(=O)CCCCCC[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173214522 1132015071 /nfs/dbraw/zinc/01/50/71/1132015071.db2.gz OLFYQLGMWGQIMJ-OAHLLOKOSA-N 1 0 336.432 3.629 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746070428 1132364969 /nfs/dbraw/zinc/36/49/69/1132364969.db2.gz NDWPWZAWDCUJMK-UHFFFAOYSA-N 1 0 330.413 3.528 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCCc2cccc(C(F)(F)F)c2)C1 ZINC001168978202 1132618187 /nfs/dbraw/zinc/61/81/87/1132618187.db2.gz PTRAKQDYFAKPFR-HIFRSBDPSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCCCCCCCCCCCO)C1 ZINC001168983790 1132619325 /nfs/dbraw/zinc/61/93/25/1132619325.db2.gz LFBNOWTZPWLROY-MSOLQXFVSA-N 1 0 328.497 3.915 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001168986784 1132635068 /nfs/dbraw/zinc/63/50/68/1132635068.db2.gz ZLANGDHMMZOHRH-RISCZKNCSA-N 1 0 328.334 3.730 20 5 EHBDRO CC[N@H+](Cc1cccc(Br)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035070 1132636886 /nfs/dbraw/zinc/63/68/86/1132636886.db2.gz ADLOSRCAFXEMDG-HIFRSBDPSA-N 1 0 341.249 3.716 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCc3cc(Cl)cc(Cl)c3C2)C1 ZINC001169048731 1132641827 /nfs/dbraw/zinc/64/18/27/1132641827.db2.gz BCEVZSGTKCSIOT-ZWNOBZJWSA-N 1 0 329.227 3.797 20 5 EHBDRO CC1(C)C[C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@](C)(C[NH3+])C1 ZINC001169142961 1132673998 /nfs/dbraw/zinc/67/39/98/1132673998.db2.gz IPECSGCNNZCWPC-QFYYESIMSA-N 1 0 349.460 3.555 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cncs1 ZINC001175497721 1132684474 /nfs/dbraw/zinc/68/44/74/1132684474.db2.gz GHTHBZRFCACYGF-UHFFFAOYSA-N 1 0 336.420 3.701 20 5 EHBDRO Nc1ccc(NCc2ccccc2C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000804333136 1132796020 /nfs/dbraw/zinc/79/60/20/1132796020.db2.gz GCUUKWYDAQCUJO-UHFFFAOYSA-N 1 0 340.427 3.775 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CC[C@H](c2ccccc2)O1 ZINC001169667948 1132814732 /nfs/dbraw/zinc/81/47/32/1132814732.db2.gz YFFZMRHXIDAXRE-WOJBJXKFSA-N 1 0 340.423 3.989 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001177294666 1133047769 /nfs/dbraw/zinc/04/77/69/1133047769.db2.gz ONJUDYXXJUPIEV-FGRIUMGMSA-N 1 0 345.487 3.956 20 5 EHBDRO Cc1ccc(-c2cccc(C[NH2+]CCn3cc([N+](=O)[O-])cn3)c2)cc1 ZINC001178064306 1133129405 /nfs/dbraw/zinc/12/94/05/1133129405.db2.gz BZRFKUXUPSPJBT-UHFFFAOYSA-N 1 0 336.395 3.557 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc(C)c2ncccc2c1 ZINC001178295878 1133154550 /nfs/dbraw/zinc/15/45/50/1133154550.db2.gz YNNGNEVQMAHESG-UHFFFAOYSA-N 1 0 337.379 3.750 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000768543571 1133158314 /nfs/dbraw/zinc/15/83/14/1133158314.db2.gz AXWLULBJFVARCX-UHFFFAOYSA-N 1 0 341.367 3.710 20 5 EHBDRO CCO[C@H]1CCC[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC001178326685 1133160132 /nfs/dbraw/zinc/16/01/32/1133160132.db2.gz OVZHWJVVZWEDRV-CABCVRRESA-N 1 0 326.824 3.728 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+]Cc2cc(Cl)cc3c2OCC3)c1 ZINC001178393476 1133161580 /nfs/dbraw/zinc/16/15/80/1133161580.db2.gz PLDYCDVNZBSDDX-UHFFFAOYSA-N 1 0 332.787 3.515 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348065 1133243306 /nfs/dbraw/zinc/24/33/06/1133243306.db2.gz NFFKLIRTWXZGTI-ZVZLLHMNSA-N 1 0 330.384 3.756 20 5 EHBDRO Cc1cn2c(C[NH2+]C[C@H](C)c3ccccc3[N+](=O)[O-])c(C)nc2s1 ZINC001179686297 1133270302 /nfs/dbraw/zinc/27/03/02/1133270302.db2.gz VBXNHELQLLQLPT-NSHDSACASA-N 1 0 344.440 3.814 20 5 EHBDRO CC[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483383 1133288673 /nfs/dbraw/zinc/28/86/73/1133288673.db2.gz MNSYVIMCBYMZKI-IEJURRBGSA-N 1 0 340.423 3.972 20 5 EHBDRO C[C@@H](C[NH+]1CCN(c2ccccc2[N+](=O)[O-])CC1)C1CCCCC1 ZINC001180497205 1133385207 /nfs/dbraw/zinc/38/52/07/1133385207.db2.gz FAGCTGSRNYWZTB-INIZCTEOSA-N 1 0 331.460 3.933 20 5 EHBDRO O=C(CC12CCC[NH+]1CCC2)Nc1cc2cccnc2c2ncccc12 ZINC001181107823 1133451784 /nfs/dbraw/zinc/45/17/84/1133451784.db2.gz KKWYLJSTIQOOBS-UHFFFAOYSA-N 1 0 346.434 3.740 20 5 EHBDRO CC(C)O[C@H](CN(CC[NH3+])c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001181465156 1133490724 /nfs/dbraw/zinc/49/07/24/1133490724.db2.gz VFGIAJVNWIBOPQ-LJQANCHMSA-N 1 0 343.427 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1COc3ccccc3C1)CCC2 ZINC000774140150 1133613768 /nfs/dbraw/zinc/61/37/68/1133613768.db2.gz RRULJFDDOBJHAY-KUHUBIRLSA-N 1 0 338.407 3.813 20 5 EHBDRO CC[C@H](CSC)[N@H+](C)Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000774640339 1133815096 /nfs/dbraw/zinc/81/50/96/1133815096.db2.gz RDBITTDCCDSFMF-LLVKDONJSA-N 1 0 342.852 3.629 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1c(F)cccc1F ZINC000786815392 1133910402 /nfs/dbraw/zinc/91/04/02/1133910402.db2.gz SGBLQLASBDRRBI-UEICXMAYSA-N 1 0 348.349 3.600 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1COC2(CCCCC2)O1 ZINC000786821906 1133911080 /nfs/dbraw/zinc/91/10/80/1133911080.db2.gz WIFPPDWACRINMY-KAPURRDVSA-N 1 0 346.427 3.664 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000746666410 1133985047 /nfs/dbraw/zinc/98/50/47/1133985047.db2.gz MQWQZKRXFNWNIV-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@@H+]1CCCC[C@@H]1C ZINC001184856820 1133998923 /nfs/dbraw/zinc/99/89/23/1133998923.db2.gz MTYGYMMSRLNJFS-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925738 1134006458 /nfs/dbraw/zinc/00/64/58/1134006458.db2.gz CVJODBUBEIIZLT-KFWWJZLASA-N 1 0 335.423 3.884 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C(C)C)[C@@H](O)c1ccccc1 ZINC000788540202 1134139441 /nfs/dbraw/zinc/13/94/41/1134139441.db2.gz RMFXHKWUXRRDPH-OALUTQOASA-N 1 0 328.412 3.751 20 5 EHBDRO Cc1ccccc1[C@@H](O)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000788580141 1134147089 /nfs/dbraw/zinc/14/70/89/1134147089.db2.gz JMPUVVGEPQKPEW-MOPGFXCFSA-N 1 0 340.423 3.949 20 5 EHBDRO Cc1ccccc1[C@H](O)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000788580145 1134147176 /nfs/dbraw/zinc/14/71/76/1134147176.db2.gz JMPUVVGEPQKPEW-RBUKOAKNSA-N 1 0 340.423 3.949 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000788575967 1134147336 /nfs/dbraw/zinc/14/73/36/1134147336.db2.gz INPGIBXGHYKTFB-QZTJIDSGSA-N 1 0 326.396 3.640 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788668909 1134159935 /nfs/dbraw/zinc/15/99/35/1134159935.db2.gz BLNSPNWYYNJWBL-NSHDSACASA-N 1 0 335.791 3.560 20 5 EHBDRO CN(CCCC[NH+]1CCCCC1)c1c2ccccc2ncc1[N+](=O)[O-] ZINC001187437637 1134334909 /nfs/dbraw/zinc/33/49/09/1134334909.db2.gz JXKMFOHAVRBEMA-UHFFFAOYSA-N 1 0 342.443 3.845 20 5 EHBDRO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CCO2 ZINC000790695137 1134453958 /nfs/dbraw/zinc/45/39/58/1134453958.db2.gz KODLOONWQPRSMF-QGZVFWFLSA-N 1 0 342.395 3.915 20 5 EHBDRO CCOC(=O)NC1CCC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000790746186 1134461430 /nfs/dbraw/zinc/46/14/30/1134461430.db2.gz IXQJMAWJDCSDCR-IUDNXUCKSA-N 1 0 349.431 3.611 20 5 EHBDRO COC1(CO)CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000775204480 1134516471 /nfs/dbraw/zinc/51/64/71/1134516471.db2.gz OEWMWOYUQKVUQX-UHFFFAOYSA-N 1 0 335.447 3.966 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)CC2 ZINC000792184382 1134665690 /nfs/dbraw/zinc/66/56/90/1134665690.db2.gz VMXZGONCYHABIN-AWEZNQCLSA-N 1 0 348.834 3.673 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(F)ccc2C)c([N+](=O)[O-])c1 ZINC001170297546 1134737353 /nfs/dbraw/zinc/73/73/53/1134737353.db2.gz PBTLUCYFMFYTJK-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](c2ccccn2)C(C)C)c([N+](=O)[O-])c1 ZINC001170304332 1134739224 /nfs/dbraw/zinc/73/92/24/1134739224.db2.gz BQCRQNZAZIBMTA-KUHUBIRLSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)COc2ccccc2)c([N+](=O)[O-])c1 ZINC001170317240 1134746598 /nfs/dbraw/zinc/74/65/98/1134746598.db2.gz CYSHRZAVZVFZAY-HUUCEWRRSA-N 1 0 344.411 3.592 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C(C)(C)Cc2ccccn2)c([N+](=O)[O-])c1 ZINC001170323886 1134747451 /nfs/dbraw/zinc/74/74/51/1134747451.db2.gz NGQWDVBSMRXJGC-CQSZACIVSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3cc(C)ccc3C2)c([N+](=O)[O-])c1 ZINC001170354166 1134754394 /nfs/dbraw/zinc/75/43/94/1134754394.db2.gz HVZXSTBDMZJNNF-HNNXBMFYSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345844 1134759537 /nfs/dbraw/zinc/75/95/37/1134759537.db2.gz MXANIWHQPWSNIJ-RDTXWAMCSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000792913112 1134823810 /nfs/dbraw/zinc/82/38/10/1134823810.db2.gz LXXBCWHCFXSCGY-KGLIPLIRSA-N 1 0 345.226 3.619 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[N@@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199958 1134978903 /nfs/dbraw/zinc/97/89/03/1134978903.db2.gz PXVCSAZDSWHBLK-HZPDHXFCSA-N 1 0 347.459 3.988 20 5 EHBDRO C[N@H+](CCN(Cc1ccccc1[N+](=O)[O-])C1CC1)Cc1ccccc1 ZINC001192391328 1135013358 /nfs/dbraw/zinc/01/33/58/1135013358.db2.gz RTCYHTOHBAJZOW-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO C[NH2+]CCN(c1ccc2c(ccc(Cl)c2[N+](=O)[O-])n1)C(C)(C)C ZINC001157829788 1135017584 /nfs/dbraw/zinc/01/75/84/1135017584.db2.gz HDGUCEBDJVBJTG-UHFFFAOYSA-N 1 0 336.823 3.621 20 5 EHBDRO CCCCC[C@@H](C)NC(=O)C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000775549924 1135060499 /nfs/dbraw/zinc/06/04/99/1135060499.db2.gz RTIPSDATMOCODV-CABCVRRESA-N 1 0 335.448 3.639 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)C1CCCCCC1 ZINC001193261376 1135118784 /nfs/dbraw/zinc/11/87/84/1135118784.db2.gz NTPILQLVYLPLHM-CQSZACIVSA-N 1 0 333.432 3.506 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C1(c2ccccc2)CCCC1 ZINC001193509017 1135148095 /nfs/dbraw/zinc/14/80/95/1135148095.db2.gz SXYIKFUCLPTKLB-OAHLLOKOSA-N 1 0 325.412 3.980 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC001193954721 1135205995 /nfs/dbraw/zinc/20/59/95/1135205995.db2.gz LDUBLLPGWHSNBP-ZHALLVOQSA-N 1 0 332.444 3.809 20 5 EHBDRO CCCC1CCC([N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC001194052307 1135222311 /nfs/dbraw/zinc/22/23/11/1135222311.db2.gz SMFVZMKGSIXJJO-UHFFFAOYSA-N 1 0 347.459 3.848 20 5 EHBDRO CC(C)C[N@H+](C)CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC001130524212 1135396875 /nfs/dbraw/zinc/39/68/75/1135396875.db2.gz ZADQZPASAKSUMD-UHFFFAOYSA-N 1 0 349.456 3.517 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C2CCCC2)C1 ZINC001195305310 1135409618 /nfs/dbraw/zinc/40/96/18/1135409618.db2.gz BOJPSZNUJBIURB-INIZCTEOSA-N 1 0 345.443 3.744 20 5 EHBDRO CC[C@@H]1C[C@H]1C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC001195546584 1135438444 /nfs/dbraw/zinc/43/84/44/1135438444.db2.gz GZZTVRUFUNSORS-BZZMCLGOSA-N 1 0 332.444 3.746 20 5 EHBDRO COc1cccc(C[NH+]2CCC(Nc3sccc3[N+](=O)[O-])CC2)c1 ZINC000775669432 1135455659 /nfs/dbraw/zinc/45/56/59/1135455659.db2.gz ZTOUKQYFBBLSOA-UHFFFAOYSA-N 1 0 347.440 3.741 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])[C@H](C)C1 ZINC000775684040 1135505376 /nfs/dbraw/zinc/50/53/76/1135505376.db2.gz WFYALWGCWJDYEP-WZRBSPASSA-N 1 0 339.823 3.601 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1cc([N+](=O)[O-])ccc1C(C)=O)c1ccco1 ZINC000807944487 1135594768 /nfs/dbraw/zinc/59/47/68/1135594768.db2.gz CRFQORFYHLVXJG-QGZVFWFLSA-N 1 0 345.399 3.885 20 5 EHBDRO CCOc1ccc(CC[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001198523890 1135827154 /nfs/dbraw/zinc/82/71/54/1135827154.db2.gz ACOSOKRDGYISAF-UHFFFAOYSA-N 1 0 328.412 3.976 20 5 EHBDRO CCc1ccc([C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2C)N(C)C)cc1 ZINC001198968966 1135870317 /nfs/dbraw/zinc/87/03/17/1135870317.db2.gz LJICPCMWVODRGN-FQEVSTJZSA-N 1 0 341.455 3.858 20 5 EHBDRO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1CCOCC1 ZINC000809969002 1135904685 /nfs/dbraw/zinc/90/46/85/1135904685.db2.gz LHLLHYSRDHXAQJ-UHFFFAOYSA-N 1 0 333.215 3.760 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNC1CC[NH+](C2CC2)CC1 ZINC000811472751 1136096005 /nfs/dbraw/zinc/09/60/05/1136096005.db2.gz JRXOXOYUXVUDHA-UHFFFAOYSA-N 1 0 344.242 3.618 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCCOC(F)F ZINC000811502278 1136100599 /nfs/dbraw/zinc/10/05/99/1136100599.db2.gz OUWITYMMJRWKEU-UHFFFAOYSA-N 1 0 329.130 3.621 20 5 EHBDRO COC(=O)CCCCC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811507381 1136101094 /nfs/dbraw/zinc/10/10/94/1136101094.db2.gz ZXOWYVOATZYAPW-UHFFFAOYSA-N 1 0 349.214 3.725 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)s1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776273948 1136128322 /nfs/dbraw/zinc/12/83/22/1136128322.db2.gz FNCPWWMGZXSYGZ-CQSZACIVSA-N 1 0 340.832 3.865 20 5 EHBDRO CC[C@H]1c2ccsc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275031 1136129037 /nfs/dbraw/zinc/12/90/37/1136129037.db2.gz FOMIBXORJSPDOV-JKSUJKDBSA-N 1 0 332.425 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276943 1136130617 /nfs/dbraw/zinc/13/06/17/1136130617.db2.gz LXKCYTDSODXMBI-QZTJIDSGSA-N 1 0 330.359 3.604 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000850312338 1136234071 /nfs/dbraw/zinc/23/40/71/1136234071.db2.gz JHYGVEYSHYOILR-CABCVRRESA-N 1 0 344.411 3.859 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1COc2ccccc2C1 ZINC000850428999 1136257273 /nfs/dbraw/zinc/25/72/73/1136257273.db2.gz WNHDYTVWHTWLRC-UONOGXRCSA-N 1 0 342.395 3.505 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812847473 1136259440 /nfs/dbraw/zinc/25/94/40/1136259440.db2.gz DDMSFPDZTCEGED-IFXJQAMLSA-N 1 0 344.411 3.547 20 5 EHBDRO COC(=O)CC(C)(C)C[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000850444020 1136259877 /nfs/dbraw/zinc/25/98/77/1136259877.db2.gz HAGYGOVIXCGNEQ-NSHDSACASA-N 1 0 342.823 3.706 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@@H](O)c1cccc(F)c1 ZINC000850444412 1136259993 /nfs/dbraw/zinc/25/99/93/1136259993.db2.gz JFUZKKSGQMVWSO-VNBZBWLYSA-N 1 0 348.374 3.515 20 5 EHBDRO CCc1ccc([C@@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470244 1136265210 /nfs/dbraw/zinc/26/52/10/1136265210.db2.gz ZVKFZCPSWDFQDQ-UGSOOPFHSA-N 1 0 344.411 3.550 20 5 EHBDRO COc1cccc(C2([NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)CCC2)c1 ZINC000850567093 1136287418 /nfs/dbraw/zinc/28/74/18/1136287418.db2.gz XNNKAQRXIPEWRO-CYBMUJFWSA-N 1 0 341.411 3.916 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCN(c3ccccc3F)C2)c1 ZINC000813792241 1136363181 /nfs/dbraw/zinc/36/31/81/1136363181.db2.gz TYWOMUKTMOOBSO-CYBMUJFWSA-N 1 0 349.793 3.756 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(F)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580589 1136444570 /nfs/dbraw/zinc/44/45/70/1136444570.db2.gz WQHYSQOCZCSCFH-SFHVURJKSA-N 1 0 332.375 3.678 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)c1ccc2c(c1)CCCO2 ZINC000852780172 1136485865 /nfs/dbraw/zinc/48/58/65/1136485865.db2.gz ICEOULYDVATPCQ-ZDUSSCGKSA-N 1 0 342.395 3.779 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000815253544 1136573980 /nfs/dbraw/zinc/57/39/80/1136573980.db2.gz GGIGXMPJKZUALZ-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815556083 1136610284 /nfs/dbraw/zinc/61/02/84/1136610284.db2.gz NPIVZIJAADQLTF-STQMWFEESA-N 1 0 329.400 3.988 20 5 EHBDRO COc1ccccc1C(C)(C)C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572011 1136617864 /nfs/dbraw/zinc/61/78/64/1136617864.db2.gz RZLBMBZRSXUKDA-ZDUSSCGKSA-N 1 0 343.427 3.814 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(Cl)cc2c1OCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815616842 1136619383 /nfs/dbraw/zinc/61/93/83/1136619383.db2.gz ZHWFIPXLGAZKIW-SNVBAGLBSA-N 1 0 347.802 3.616 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740097 1136620006 /nfs/dbraw/zinc/62/00/06/1136620006.db2.gz IEXHTURWYJIJHP-YHOSQGMISA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@H]([NH2+][C@@H](CCO)c1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626534 1136620775 /nfs/dbraw/zinc/62/07/75/1136620775.db2.gz GMECIVRALUKRJI-ZBEGNZNMSA-N 1 0 349.818 3.605 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CCOCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815626506 1136620898 /nfs/dbraw/zinc/62/08/98/1136620898.db2.gz FUUJOOBRZXTTRG-LSDHHAIUSA-N 1 0 343.427 3.823 20 5 EHBDRO C[C@H]([NH2+]C1(Cc2ccccc2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815606879 1136622290 /nfs/dbraw/zinc/62/22/90/1136622290.db2.gz JOJNSYYUSPZSBL-AWEZNQCLSA-N 1 0 325.412 3.993 20 5 EHBDRO Cc1ccc(NC(=O)c2cccc([N+](=O)[O-])c2Cl)c(C[NH+](C)C)c1 ZINC000816924982 1136763777 /nfs/dbraw/zinc/76/37/77/1136763777.db2.gz CFNXSQQSYOKALQ-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC(C)(C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000818984358 1136896906 /nfs/dbraw/zinc/89/69/06/1136896906.db2.gz FOUUBTKUYXANRP-KRWDZBQOSA-N 1 0 348.830 3.849 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000821361733 1137024645 /nfs/dbraw/zinc/02/46/45/1137024645.db2.gz WEMZFEJEVDKBFZ-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@@](C)(O)c1ccccc1 ZINC000822516264 1137064107 /nfs/dbraw/zinc/06/41/07/1137064107.db2.gz JNBNMGQVXPBUIW-QGZVFWFLSA-N 1 0 334.803 3.588 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)Cc1ccccc1 ZINC000824592033 1137144191 /nfs/dbraw/zinc/14/41/91/1137144191.db2.gz XSFNLWBDSJEOHG-OAHLLOKOSA-N 1 0 334.803 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@H](c3ccc(O)cc3)C2)cc1Cl ZINC000862540661 1137149211 /nfs/dbraw/zinc/14/92/11/1137149211.db2.gz IYIQTBSQHDEAIX-AWEZNQCLSA-N 1 0 332.787 3.943 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000824764596 1137150857 /nfs/dbraw/zinc/15/08/57/1137150857.db2.gz CAAMCWUASWSEFR-CYBMUJFWSA-N 1 0 333.215 3.667 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCO1 ZINC000824799384 1137152857 /nfs/dbraw/zinc/15/28/57/1137152857.db2.gz NFBYTSLDLSPAGB-CZUORRHYSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCCc3ccc(Cl)cc32)c1 ZINC000863583195 1137192811 /nfs/dbraw/zinc/19/28/11/1137192811.db2.gz PRWJGQAMUGBLIU-ROUUACIJSA-N 1 0 346.814 3.949 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC(C)(C)C1 ZINC001171099486 1137196144 /nfs/dbraw/zinc/19/61/44/1137196144.db2.gz VWUQDIFXVSGSIZ-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO C/C=C(\C)C(=O)n1c2ccc(OCC)cc2c(=[NH2+])c2ccc(N)cc21 ZINC001143944028 1137217053 /nfs/dbraw/zinc/21/70/53/1137217053.db2.gz YYHDDRWRBMBIEJ-WUOYABIWSA-N 1 0 335.407 3.861 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3cnc(Cl)cc3[N+](=O)[O-])c2c1 ZINC001171169189 1137280020 /nfs/dbraw/zinc/28/00/20/1137280020.db2.gz XRCRKQKQYFHCFN-LLVKDONJSA-N 1 0 344.802 3.785 20 5 EHBDRO C[NH+]1CCC([C@H]2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)C2)CC1 ZINC000865641834 1137301165 /nfs/dbraw/zinc/30/11/65/1137301165.db2.gz KDDIJNAVMREPQZ-ZDUSSCGKSA-N 1 0 339.386 3.701 20 5 EHBDRO C[NH+]1CCC2(CC1)CN(c1sccc1[N+](=O)[O-])Cc1ccccc12 ZINC000866017014 1137324758 /nfs/dbraw/zinc/32/47/58/1137324758.db2.gz CDMDYNOZNJIKBQ-UHFFFAOYSA-N 1 0 343.452 3.640 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000866020568 1137324881 /nfs/dbraw/zinc/32/48/81/1137324881.db2.gz NQVPIQQUWLSIQI-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO C[C@H]([NH2+]CCC[C@@H]1CC1(Cl)Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000846215278 1137341974 /nfs/dbraw/zinc/34/19/74/1137341974.db2.gz NQJVBTSHPWNIBV-GXSJLCMTSA-N 1 0 332.231 3.802 20 5 EHBDRO Cc1nc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])sc1C ZINC000866286720 1137342837 /nfs/dbraw/zinc/34/28/37/1137342837.db2.gz CICMTEOVQWBZDU-SNVBAGLBSA-N 1 0 337.420 3.571 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cc(F)cnc1Cl ZINC000866365941 1137349646 /nfs/dbraw/zinc/34/96/46/1137349646.db2.gz JCZMZAAMFFUSDN-SECBINFHSA-N 1 0 341.745 3.642 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000866394345 1137351357 /nfs/dbraw/zinc/35/13/57/1137351357.db2.gz VWMIESWRAOCHIV-KOLCDFICSA-N 1 0 335.206 3.838 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3cccc(F)c3F)CC2)cc1 ZINC000866476773 1137357923 /nfs/dbraw/zinc/35/79/23/1137357923.db2.gz RVMMUUCKBCMJCG-UHFFFAOYSA-N 1 0 347.365 3.632 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)CCC2 ZINC000866539122 1137362931 /nfs/dbraw/zinc/36/29/31/1137362931.db2.gz GTJIVTZRBXIDLS-IEZWGBDMSA-N 1 0 330.428 3.625 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)ccc1OC ZINC000866539300 1137362951 /nfs/dbraw/zinc/36/29/51/1137362951.db2.gz JQFRTRQWJFLXAR-AWEZNQCLSA-N 1 0 344.411 3.909 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cn(C)c2ncccc12 ZINC000866569906 1137365712 /nfs/dbraw/zinc/36/57/12/1137365712.db2.gz BEGWGMQYZBOFBH-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1cn(C)c2ncccc12 ZINC000866569905 1137365714 /nfs/dbraw/zinc/36/57/14/1137365714.db2.gz BEGWGMQYZBOFBH-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO Cc1ccnc([C@H]2CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)c1 ZINC000846972734 1137377775 /nfs/dbraw/zinc/37/77/75/1137377775.db2.gz YJESTWKNCXGEEW-AWEZNQCLSA-N 1 0 331.803 3.941 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@]1(O)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000773097628 1137465493 /nfs/dbraw/zinc/46/54/93/1137465493.db2.gz HELPCCXZLHODQT-PMACEKPBSA-N 1 0 340.423 3.860 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](O)c1cccc(F)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872048734 1137567748 /nfs/dbraw/zinc/56/77/48/1137567748.db2.gz LAWKYIBGSUKNQU-DINDLPBHSA-N 1 0 336.338 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@@H]3CCOC4(CCCC4)C3)c2c1 ZINC000872072566 1137569767 /nfs/dbraw/zinc/56/97/67/1137569767.db2.gz HHXWYGMVKYIFQP-OAHLLOKOSA-N 1 0 343.427 3.700 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129595 1137573131 /nfs/dbraw/zinc/57/31/31/1137573131.db2.gz REMXLQIKFZEWMM-CHWSQXEVSA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1 ZINC000873184941 1137593043 /nfs/dbraw/zinc/59/30/43/1137593043.db2.gz MNQFFRXECXXVLK-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)c2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873298183 1137596919 /nfs/dbraw/zinc/59/69/19/1137596919.db2.gz FXECDTNJFQMYCB-UHFFFAOYSA-N 1 0 327.384 3.573 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCC[N@H+]1CCCC[C@H]1C ZINC000874048328 1137609910 /nfs/dbraw/zinc/60/99/10/1137609910.db2.gz PNEKLSQOVXHYKC-OAHLLOKOSA-N 1 0 347.459 3.596 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CC[C@H](c4cccc(F)c4)C3)C2)c1 ZINC000877491348 1137678342 /nfs/dbraw/zinc/67/83/42/1137678342.db2.gz JENPXBAWEMCIFC-OBTMHIKCSA-N 1 0 344.390 3.560 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CCC[C@H]3CC3(Cl)Cl)nc2c1 ZINC000877614835 1137682934 /nfs/dbraw/zinc/68/29/34/1137682934.db2.gz NHAHAGDUTMPTDD-VIFPVBQESA-N 1 0 344.198 3.800 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1C[C@H]2CCC[C@H]2O1 ZINC000877804829 1137690497 /nfs/dbraw/zinc/69/04/97/1137690497.db2.gz FAPDISZVZOJNPL-RIEGTJTDSA-N 1 0 344.333 3.661 20 5 EHBDRO CC(C)(O)[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000877835566 1137692936 /nfs/dbraw/zinc/69/29/36/1137692936.db2.gz UALYJWKLMSSAPP-AWEZNQCLSA-N 1 0 346.452 3.916 20 5 EHBDRO CCC1(C)CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878030913 1137700172 /nfs/dbraw/zinc/70/01/72/1137700172.db2.gz KZKCMZRLUNZTSA-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@@H]1C[C@@H](C)[C@@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497112 1137717958 /nfs/dbraw/zinc/71/79/58/1137717958.db2.gz QTVGNSHLRMFMIN-JHJVBQTASA-N 1 0 330.388 3.511 20 5 EHBDRO C[C@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1cc2cnccc2o1 ZINC000879713684 1137756308 /nfs/dbraw/zinc/75/63/08/1137756308.db2.gz RBFALWHEHNZNFL-ZDUSSCGKSA-N 1 0 341.367 3.856 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)cc1[N+](=O)[O-] ZINC000883356838 1137857238 /nfs/dbraw/zinc/85/72/38/1137857238.db2.gz XCDLCXAKZQTJGS-UKRRQHHQSA-N 1 0 334.416 3.746 20 5 EHBDRO CC[C@@H]([NH2+]C[C@](C)(CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000348276777 1137891989 /nfs/dbraw/zinc/89/19/89/1137891989.db2.gz FLIMUCGLCVUBEF-RTBURBONSA-N 1 0 328.412 3.586 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901880 1137925174 /nfs/dbraw/zinc/92/51/74/1137925174.db2.gz JRXSICFUKJONQJ-AMTGTPFRSA-N 1 0 332.444 3.917 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000120271807 1137948078 /nfs/dbraw/zinc/94/80/78/1137948078.db2.gz ZMBRXYGVOYHCBP-KDOFPFPSSA-N 1 0 344.411 3.686 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[N@@H+]1CC[C@H](CSc2ccccc2)C1 ZINC000886022464 1138032868 /nfs/dbraw/zinc/03/28/68/1138032868.db2.gz CAWSCRNTSBCBHR-AWEZNQCLSA-N 1 0 329.425 3.604 20 5 EHBDRO COc1cc(C[N@H+](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053814353 1138048210 /nfs/dbraw/zinc/04/82/10/1138048210.db2.gz YJYWEINLOBAPBZ-UHFFFAOYSA-N 1 0 330.331 3.579 20 5 EHBDRO CCCC[N@H+](Cc1cccnc1[N+](=O)[O-])[C@H]1CCc2ncsc2C1 ZINC000886265910 1138062950 /nfs/dbraw/zinc/06/29/50/1138062950.db2.gz URWXYVAPFCGRLW-AWEZNQCLSA-N 1 0 346.456 3.606 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000123245614 1138268364 /nfs/dbraw/zinc/26/83/64/1138268364.db2.gz GKIOWLYRMGFCMK-CYBMUJFWSA-N 1 0 330.432 3.748 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC[N@@H+]1C ZINC000130639206 1138466263 /nfs/dbraw/zinc/46/62/63/1138466263.db2.gz ORYPXUNXPRKABX-PBHICJAKSA-N 1 0 343.427 3.769 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@H](c3cccnc3)C2)c1 ZINC000337321997 1138532388 /nfs/dbraw/zinc/53/23/88/1138532388.db2.gz ZRBRWGUDXPGIQE-WMZOPIPTSA-N 1 0 325.412 3.848 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000134640979 1138699275 /nfs/dbraw/zinc/69/92/75/1138699275.db2.gz LKGTVSHSUDJSNO-HZSPNIEDSA-N 1 0 344.436 3.911 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cccc(COC)c2)cc1[N+](=O)[O-] ZINC000152951638 1139115235 /nfs/dbraw/zinc/11/52/35/1139115235.db2.gz ZWIYVMIRVMRSSO-AWEZNQCLSA-N 1 0 344.411 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H]3O4)s2)cc1 ZINC000152943479 1139115357 /nfs/dbraw/zinc/11/53/57/1139115357.db2.gz FQNMGHZJQHRSKP-BMFZPTHFSA-N 1 0 330.409 3.733 20 5 EHBDRO CCC(CC)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000173727601 1139373881 /nfs/dbraw/zinc/37/38/81/1139373881.db2.gz WWBPRWATCVMIEI-VIFPVBQESA-N 1 0 347.337 3.719 20 5 EHBDRO CC[C@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000173931730 1139387689 /nfs/dbraw/zinc/38/76/89/1139387689.db2.gz MNWMVYIPUBFKRR-HNNXBMFYSA-N 1 0 347.440 3.620 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000179219019 1139743083 /nfs/dbraw/zinc/74/30/83/1139743083.db2.gz ZPACPJRVBCFVHC-GDBMZVCRSA-N 1 0 333.435 3.587 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627593 1139769587 /nfs/dbraw/zinc/76/95/87/1139769587.db2.gz QCOJKNZTCZWMNS-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1ccc(CN(C)[C@H](C)c2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000180281923 1139824070 /nfs/dbraw/zinc/82/40/70/1139824070.db2.gz BOLIXRGAGDXEAI-SHACYNPGSA-N 1 0 346.452 3.834 20 5 EHBDRO CC[C@H]([NH2+]CCCNC(=O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180833342 1139866956 /nfs/dbraw/zinc/86/69/56/1139866956.db2.gz DGPSZQDXDFINEH-HNNXBMFYSA-N 1 0 347.440 3.517 20 5 EHBDRO Cc1ccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000180863025 1139868280 /nfs/dbraw/zinc/86/82/80/1139868280.db2.gz IIGRMALKLYXUIJ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H]1C[C@H](O)c1ccco1 ZINC000183392247 1140034208 /nfs/dbraw/zinc/03/42/08/1140034208.db2.gz RNZVXZWIFKYFJD-WBVHZDCISA-N 1 0 330.384 3.584 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1C[C@H](O)c1ccco1 ZINC000183392270 1140034237 /nfs/dbraw/zinc/03/42/37/1140034237.db2.gz RNZVXZWIFKYFJD-RDJZCZTQSA-N 1 0 330.384 3.584 20 5 EHBDRO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CCS1 ZINC000192190775 1140509060 /nfs/dbraw/zinc/50/90/60/1140509060.db2.gz RDCANXHLQMLPHH-CYBMUJFWSA-N 1 0 347.440 3.620 20 5 EHBDRO COc1ccc(OC)c(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268748625 1140982310 /nfs/dbraw/zinc/98/23/10/1140982310.db2.gz ISYYUOUAJLEHGG-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)c1 ZINC000269687377 1141135628 /nfs/dbraw/zinc/13/56/28/1141135628.db2.gz TVZMAYBXGOUAOA-QZTJIDSGSA-N 1 0 330.359 3.604 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C)nn(C)c1C ZINC000271121788 1141310740 /nfs/dbraw/zinc/31/07/40/1141310740.db2.gz JOUUZCONFAGIOU-AWEZNQCLSA-N 1 0 348.472 3.606 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCCc2nccs2)cc1[N+](=O)[O-] ZINC000271483663 1141378460 /nfs/dbraw/zinc/37/84/60/1141378460.db2.gz KQMYZZKMZLUQQM-GFCCVEGCSA-N 1 0 335.429 3.733 20 5 EHBDRO C[NH+](C)CC1CCN(c2nc3ccccc3c(Cl)c2[N+](=O)[O-])CC1 ZINC001165042103 721944701 /nfs/dbraw/zinc/94/47/01/721944701.db2.gz MDHXRRJUGJMGID-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)Oc1ccccc1 ZINC000537985425 1032060230 /nfs/dbraw/zinc/06/02/30/1032060230.db2.gz AYHRIGKVTKKBNO-KXBFYZLASA-N 1 0 340.423 3.973 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)CCOC1 ZINC000120157598 1014510830 /nfs/dbraw/zinc/51/08/30/1014510830.db2.gz PTGIPQHFRVUXBE-SFHVURJKSA-N 1 0 346.358 3.795 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@@H]1CCc2ccccc2C1 ZINC000430196375 1014813131 /nfs/dbraw/zinc/81/31/31/1014813131.db2.gz QYRIGMRLVCSBNC-QGZVFWFLSA-N 1 0 326.396 3.593 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC000692958650 1015033807 /nfs/dbraw/zinc/03/38/07/1015033807.db2.gz YTZSCBZDGPRNJN-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO CC(=O)Nc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000126980401 1015149539 /nfs/dbraw/zinc/14/95/39/1015149539.db2.gz HKGWBKHNNOTUNT-UHFFFAOYSA-N 1 0 339.395 3.718 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H]([NH+]4CCCC4)C3)o2)cc1 ZINC000127043457 1015194273 /nfs/dbraw/zinc/19/42/73/1015194273.db2.gz OLZCVQAHQXPQSM-QGZVFWFLSA-N 1 0 341.411 3.525 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000154258438 1015319955 /nfs/dbraw/zinc/31/99/55/1015319955.db2.gz RSEYKXYFKWIAKM-PWXKEOIMSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000578252213 1015529872 /nfs/dbraw/zinc/52/98/72/1015529872.db2.gz LODRBORZDQPQRI-MORSLUCNSA-N 1 0 326.396 3.885 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CCC2(CCOCC2)CC1 ZINC000360017065 1016011159 /nfs/dbraw/zinc/01/11/59/1016011159.db2.gz CGMLAAQLGXJYGT-HWKANZROSA-N 1 0 330.428 3.937 20 5 EHBDRO COc1ccc(CCC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000449085182 1032142084 /nfs/dbraw/zinc/14/20/84/1032142084.db2.gz KYIUUMMFQBPOIL-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO C[NH2+]Cc1cn(-c2nc(Cl)cc(C)c2[N+](=O)[O-])c2ccc(C)cc12 ZINC001167122786 1016181438 /nfs/dbraw/zinc/18/14/38/1016181438.db2.gz CNYJOJGCKVDTKZ-UHFFFAOYSA-N 1 0 344.802 3.923 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@H]2CCCC[C@@H]2O)c2ccccc2)c1 ZINC000180612800 1016910677 /nfs/dbraw/zinc/91/06/77/1016910677.db2.gz XMNBZJCSZPKVEB-HOJAQTOUSA-N 1 0 340.423 3.825 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CS1 ZINC000414497056 1016943220 /nfs/dbraw/zinc/94/32/20/1016943220.db2.gz JOGMNYVXJDLFPB-PWSUYJOCSA-N 1 0 335.454 3.702 20 5 EHBDRO CC(C)[C@H]1[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527941 1016953959 /nfs/dbraw/zinc/95/39/59/1016953959.db2.gz NJYBVTZHILJHEM-LZCIBIBXSA-N 1 0 330.428 3.745 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449074461 1032160764 /nfs/dbraw/zinc/16/07/64/1032160764.db2.gz CGHNINNCHZHFIV-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3[NH2+]CC[C@@H]4CCCC[C@@H]34)n2)s1 ZINC000904689497 1032183130 /nfs/dbraw/zinc/18/31/30/1032183130.db2.gz KGNKJMSUAAVPIG-OPQQBVKSSA-N 1 0 334.401 3.547 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000449090058 1032193995 /nfs/dbraw/zinc/19/39/95/1032193995.db2.gz MELZVDNOQITTKB-AWEZNQCLSA-N 1 0 342.395 3.997 20 5 EHBDRO COc1cccc(C[C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449145401 1032247714 /nfs/dbraw/zinc/24/77/14/1032247714.db2.gz XTEMKDGDWVHPNY-CABCVRRESA-N 1 0 328.412 3.755 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449178102 1032273713 /nfs/dbraw/zinc/27/37/13/1032273713.db2.gz TZRJLHMDEJCFRG-UGSOOPFHSA-N 1 0 332.375 3.642 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000449202801 1032328072 /nfs/dbraw/zinc/32/80/72/1032328072.db2.gz GRBCIRBDSKUREC-KPVUDJQRSA-N 1 0 346.452 3.614 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCc3c(F)cccc32)c([N+](=O)[O-])cc1O ZINC000449347388 1032463442 /nfs/dbraw/zinc/46/34/42/1032463442.db2.gz CEQYLESLSHUODF-OAHLLOKOSA-N 1 0 346.358 3.615 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc(F)c1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449349566 1032464887 /nfs/dbraw/zinc/46/48/87/1032464887.db2.gz QXXPEUZVUWCBGW-OLZOCXBDSA-N 1 0 345.374 3.802 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000537029087 1032493101 /nfs/dbraw/zinc/49/31/01/1032493101.db2.gz FZVONEHQGDHXAA-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO C[C@H](CCO)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449355536 1032493259 /nfs/dbraw/zinc/49/32/59/1032493259.db2.gz AJYZOYWENFODEC-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnc(OC2CCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000090911925 1032579271 /nfs/dbraw/zinc/57/92/71/1032579271.db2.gz YNKITYMTVLXKFN-CYBMUJFWSA-N 1 0 327.384 3.772 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1ncccc1C ZINC000449483857 1032632938 /nfs/dbraw/zinc/63/29/38/1032632938.db2.gz CTVQSGMJTWESSQ-QINSGFPZSA-N 1 0 325.412 3.924 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH3+])CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000414664045 1017114688 /nfs/dbraw/zinc/11/46/88/1017114688.db2.gz SVCSUYXTTHAPAH-KRWDZBQOSA-N 1 0 342.399 3.540 20 5 EHBDRO CC(C)(C)n1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449501159 1032680337 /nfs/dbraw/zinc/68/03/37/1032680337.db2.gz PARZJEHSTJVMKI-QGZVFWFLSA-N 1 0 342.443 3.926 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)N(CC)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181526308 1017147535 /nfs/dbraw/zinc/14/75/35/1017147535.db2.gz KJMWCAQLTSCKEG-GOSISDBHSA-N 1 0 341.411 3.689 20 5 EHBDRO CC(C)(CCO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000610271355 1017158745 /nfs/dbraw/zinc/15/87/45/1017158745.db2.gz JXDUYDDHRWELAP-UHFFFAOYSA-N 1 0 348.374 3.777 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000579934966 1017322201 /nfs/dbraw/zinc/32/22/01/1017322201.db2.gz MKYQYPUAHVDZAE-IBGZPJMESA-N 1 0 342.443 3.985 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnccc1OC ZINC000340401605 1017366225 /nfs/dbraw/zinc/36/62/25/1017366225.db2.gz XEMJSFGOYVOMCF-CQSZACIVSA-N 1 0 347.440 3.659 20 5 EHBDRO CC[C@@](C)([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1 ZINC000892972293 1018009497 /nfs/dbraw/zinc/00/94/97/1018009497.db2.gz IPYHIMDEGRRNFV-GOSISDBHSA-N 1 0 330.384 3.724 20 5 EHBDRO CCC[C@](C)(CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236794767 1018316482 /nfs/dbraw/zinc/31/64/82/1018316482.db2.gz QTIURTXMWMEUSJ-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CCc2ccc(Br)s2)c1 ZINC000063560204 1018357510 /nfs/dbraw/zinc/35/75/10/1018357510.db2.gz JDAPXDCATGRIKO-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCc3nc[nH]c3C2)c2ccccc2)c1 ZINC000377799747 1018393439 /nfs/dbraw/zinc/39/34/39/1018393439.db2.gz YWSRMZCRZGKJLG-OXJNMPFZSA-N 1 0 348.406 3.554 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000064915971 1018717064 /nfs/dbraw/zinc/71/70/64/1018717064.db2.gz QJQGRMXYQGBGPK-CJNGLKHVSA-N 1 0 329.375 3.981 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580215760 1018807127 /nfs/dbraw/zinc/80/71/27/1018807127.db2.gz CPIQFBYNQOHMHA-KSSFIOAISA-N 1 0 325.412 3.978 20 5 EHBDRO CC(C)[C@H](CN(C)Cc1ccccc1)[NH2+]Cc1csc([N+](=O)[O-])c1 ZINC000398036558 1018955848 /nfs/dbraw/zinc/95/58/48/1018955848.db2.gz NKFJLKOAQDVSFN-KRWDZBQOSA-N 1 0 347.484 3.903 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000025447893 1018981749 /nfs/dbraw/zinc/98/17/49/1018981749.db2.gz QWVVMFCSNMGONE-CYBMUJFWSA-N 1 0 330.384 3.805 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CO)C2CCCC2)s1 ZINC000580367074 1019201561 /nfs/dbraw/zinc/20/15/61/1019201561.db2.gz LXVXRPDHPFKLEZ-INIZCTEOSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182345479 1019458445 /nfs/dbraw/zinc/45/84/45/1019458445.db2.gz NZPIHVYVCZBBOD-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)(C)c1ccc(-c2nc(C3([NH3+])CCCC3)no2)cc1[N+](=O)[O-] ZINC000261772988 1019523460 /nfs/dbraw/zinc/52/34/60/1019523460.db2.gz NGTVUNDFIXXWNO-UHFFFAOYSA-N 1 0 330.388 3.670 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412992 1019643954 /nfs/dbraw/zinc/64/39/54/1019643954.db2.gz FQJGSDCNOXFQJS-MTIYJEKLSA-N 1 0 348.406 3.905 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH+](CC2CC2)CC2CC2)ccc1Br ZINC000157815198 1032880128 /nfs/dbraw/zinc/88/01/28/1032880128.db2.gz MRUWXNIKJAAGOH-UHFFFAOYSA-N 1 0 339.233 3.979 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000610468537 1020274131 /nfs/dbraw/zinc/27/41/31/1020274131.db2.gz OGNFNUOBXJEOJG-NSHDSACASA-N 1 0 331.338 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC(C[NH+]3CCCCCC3)CC2)c(F)c1 ZINC000610476219 1020403273 /nfs/dbraw/zinc/40/32/73/1020403273.db2.gz FETNHEMGZZFJCW-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO COC(=O)C[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@H]1C ZINC000280660049 1020551892 /nfs/dbraw/zinc/55/18/92/1020551892.db2.gz BMAJPMZNGJLGHY-YXWQFLTLSA-N 1 0 334.416 3.532 20 5 EHBDRO CCC(C)(C)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000501009920 1020645421 /nfs/dbraw/zinc/64/54/21/1020645421.db2.gz GECIJMWBGYYDQU-INIZCTEOSA-N 1 0 333.432 3.824 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](C)[N@H+](C)Cc2ccccc2)c1 ZINC000361032303 1020891866 /nfs/dbraw/zinc/89/18/66/1020891866.db2.gz OREAQPCDRXTXAB-CQSZACIVSA-N 1 0 329.400 3.536 20 5 EHBDRO CC(C)CCC[C@H](C)[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602505748 1032940568 /nfs/dbraw/zinc/94/05/68/1032940568.db2.gz YKIDLHBNNZYGME-HNNXBMFYSA-N 1 0 334.464 3.763 20 5 EHBDRO COCC(C)(C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000426314728 1021246284 /nfs/dbraw/zinc/24/62/84/1021246284.db2.gz QXMBJWVPRACZHO-GOSISDBHSA-N 1 0 328.412 3.946 20 5 EHBDRO CCO[C@H]1C[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837396 1021262544 /nfs/dbraw/zinc/26/25/44/1021262544.db2.gz DXSXNWJGDRJLCH-CVEARBPZSA-N 1 0 345.399 3.516 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000449633670 1032964933 /nfs/dbraw/zinc/96/49/33/1032964933.db2.gz UQPIZIORFVPSQV-SGTLLEGYSA-N 1 0 330.384 3.758 20 5 EHBDRO CSc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000439478643 1021470075 /nfs/dbraw/zinc/47/00/75/1021470075.db2.gz OZRMBOJUQPXDIU-GFCCVEGCSA-N 1 0 345.424 3.606 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(OC)c([N+](=O)[O-])c2)C1 ZINC000157895884 1021515772 /nfs/dbraw/zinc/51/57/72/1021515772.db2.gz HUKSTPBGYFEXHJ-HNNXBMFYSA-N 1 0 342.395 3.602 20 5 EHBDRO CCOC(C)(C)C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000437085301 1021554854 /nfs/dbraw/zinc/55/48/54/1021554854.db2.gz ZQJOFZQNIZPSRH-CYBMUJFWSA-N 1 0 326.462 3.870 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000247353885 1021624947 /nfs/dbraw/zinc/62/49/47/1021624947.db2.gz XDIJAMQUBZNTHA-UHFFFAOYSA-N 1 0 345.830 3.961 20 5 EHBDRO C[C@@H]1C[C@H](C)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000127274904 1021670855 /nfs/dbraw/zinc/67/08/55/1021670855.db2.gz SUSAXAMKTUKPHK-CHWSQXEVSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602580792 1033000779 /nfs/dbraw/zinc/00/07/79/1033000779.db2.gz HBQNNVNIJZWIEC-MNOVXSKESA-N 1 0 332.322 3.518 20 5 EHBDRO COc1cc(C)c([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000090910224 1021699532 /nfs/dbraw/zinc/69/95/32/1021699532.db2.gz RAEDGXIFJHAIKD-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)s1 ZINC000051233142 1021808925 /nfs/dbraw/zinc/80/89/25/1021808925.db2.gz XNHUKQXSIWZHAW-UHFFFAOYSA-N 1 0 326.805 3.821 20 5 EHBDRO Cc1ccc(CN2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467892 1021880360 /nfs/dbraw/zinc/88/03/60/1021880360.db2.gz UEEZFDTZUUCHJV-BQFCYCMXSA-N 1 0 331.460 3.740 20 5 EHBDRO C[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602626184 1033019879 /nfs/dbraw/zinc/01/98/79/1033019879.db2.gz JLMKWIAGIAHWJH-LSDHHAIUSA-N 1 0 332.448 3.517 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)n1 ZINC000178201360 1022099999 /nfs/dbraw/zinc/09/99/99/1022099999.db2.gz LHOKEVPWLAWQKO-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000141433266 1033031648 /nfs/dbraw/zinc/03/16/48/1033031648.db2.gz UMLJVGSVNPXWHR-HNNXBMFYSA-N 1 0 345.468 3.578 20 5 EHBDRO CCC(O)(CC)CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000471787805 1022205574 /nfs/dbraw/zinc/20/55/74/1022205574.db2.gz NPSKPUHRTPJYGS-RDJZCZTQSA-N 1 0 334.460 3.837 20 5 EHBDRO CCO[C@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCCC2 ZINC000517287579 1022215316 /nfs/dbraw/zinc/21/53/16/1022215316.db2.gz MSYJNNALQMBIPL-CVEARBPZSA-N 1 0 345.399 3.563 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602652060 1033040904 /nfs/dbraw/zinc/04/09/04/1033040904.db2.gz VRVJMPQMOGHGET-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](CO)Cc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000467419041 1022257669 /nfs/dbraw/zinc/25/76/69/1022257669.db2.gz MMVZFCDTYPYKQE-AZUAARDMSA-N 1 0 342.439 3.938 20 5 EHBDRO CC(C)OC1CC([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000425961852 1022478478 /nfs/dbraw/zinc/47/84/78/1022478478.db2.gz VCLUQVMOQYCJSV-UHFFFAOYSA-N 1 0 332.322 3.659 20 5 EHBDRO Cc1cc(NCc2nc3cc([N+](=O)[O-])ccc3o2)ccc1C[NH+](C)C ZINC000602687080 1033068392 /nfs/dbraw/zinc/06/83/92/1033068392.db2.gz HZMAIIPHVQPGPD-UHFFFAOYSA-N 1 0 340.383 3.718 20 5 EHBDRO CC[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602697139 1033077239 /nfs/dbraw/zinc/07/72/39/1033077239.db2.gz IARDJUUJYNZTCL-QWHCGFSZSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@H+]1CCC[C@H](CCO)CC1 ZINC000602693293 1033073755 /nfs/dbraw/zinc/07/37/55/1033073755.db2.gz FJXRZFUUQHYYNG-LBPRGKRZSA-N 1 0 346.349 3.598 20 5 EHBDRO CCC[C@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)C(C)(C)C ZINC000602676893 1033078889 /nfs/dbraw/zinc/07/88/89/1033078889.db2.gz UBGUHRMPHSSDSU-INIZCTEOSA-N 1 0 334.464 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000729469206 1022842296 /nfs/dbraw/zinc/84/22/96/1022842296.db2.gz KKXWUDMVLQHCJI-CQSZACIVSA-N 1 0 340.358 3.531 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@]2(CC2(F)F)C1 ZINC000602704178 1033092184 /nfs/dbraw/zinc/09/21/84/1033092184.db2.gz GFYWRZHYQZIAOA-LBPRGKRZSA-N 1 0 336.260 3.845 20 5 EHBDRO CC[NH+](CC)CC1CC[NH+](C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000506926734 1023013188 /nfs/dbraw/zinc/01/31/88/1023013188.db2.gz GMIIKFHVVTXVRZ-VQHVLOKHSA-N 1 0 331.460 3.662 20 5 EHBDRO CC(C)(C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602716690 1033102791 /nfs/dbraw/zinc/10/27/91/1033102791.db2.gz WUHNTSWMSLIYDA-UHFFFAOYSA-N 1 0 331.294 3.804 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000484896107 1023165543 /nfs/dbraw/zinc/16/55/43/1023165543.db2.gz WMWUHZQSKMVWHT-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCCc2ccco2)cc1Br ZINC000602723765 1033110636 /nfs/dbraw/zinc/11/06/36/1033110636.db2.gz SSVQUJFBJIQCEG-UHFFFAOYSA-N 1 0 345.218 3.734 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccc(OC)cc2)ccc1[N+](=O)[O-] ZINC000276874657 1023278256 /nfs/dbraw/zinc/27/82/56/1023278256.db2.gz HZEJEKFYQZGVCS-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO CC[N@@H+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)[C@H](C)C1 ZINC000341770830 1023299576 /nfs/dbraw/zinc/29/95/76/1023299576.db2.gz JVNQSRSWSXCHBB-OAHLLOKOSA-N 1 0 333.435 3.554 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000602738543 1033125432 /nfs/dbraw/zinc/12/54/32/1033125432.db2.gz MIUGLHZDRVYPGK-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H](O)C3CCC3)s2)cc1 ZINC000449738902 1033139606 /nfs/dbraw/zinc/13/96/06/1033139606.db2.gz GTNKVUKGOLFXLK-INIZCTEOSA-N 1 0 332.425 3.574 20 5 EHBDRO CCc1cc(C[NH2+][C@@H](CC)CSc2ccccc2[N+](=O)[O-])on1 ZINC000535777814 1023627903 /nfs/dbraw/zinc/62/79/03/1023627903.db2.gz WMVFOPLUYKKWHW-ZDUSSCGKSA-N 1 0 335.429 3.806 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+][C@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])C2)CO1 ZINC000897779292 1033172157 /nfs/dbraw/zinc/17/21/57/1033172157.db2.gz OXWFYWMPZCJWDB-IOYRGVHDSA-N 1 0 344.455 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000248427139 1024089220 /nfs/dbraw/zinc/08/92/20/1024089220.db2.gz OOZQBERVYYPXTJ-KSSFIOAISA-N 1 0 349.862 3.697 20 5 EHBDRO COc1ccc([C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000522269025 1024127558 /nfs/dbraw/zinc/12/75/58/1024127558.db2.gz SDJGWZVSTAVXFO-IBGZPJMESA-N 1 0 326.396 3.983 20 5 EHBDRO CCOC[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000474097934 1024164282 /nfs/dbraw/zinc/16/42/82/1024164282.db2.gz SXNHWDHDNUPQLN-NXHRZFHOSA-N 1 0 334.460 3.957 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccccc2Cl)cc1[N+](=O)[O-] ZINC000538275548 1024278426 /nfs/dbraw/zinc/27/84/26/1024278426.db2.gz GWJCSTNQDHZDEK-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C)C[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641876 1024301735 /nfs/dbraw/zinc/30/17/35/1024301735.db2.gz MRWWXEVIYQOYGL-UONOGXRCSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)C1 ZINC000507003546 1024309139 /nfs/dbraw/zinc/30/91/39/1024309139.db2.gz WLQJUULOZPGUBZ-DZGCQCFKSA-N 1 0 329.375 3.981 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000538717339 1024493495 /nfs/dbraw/zinc/49/34/95/1024493495.db2.gz UXNFTKTYNVEJRB-YJBOKZPZSA-N 1 0 333.476 3.880 20 5 EHBDRO Cc1cccc(C)c1[C@H](C)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000544893485 1024517790 /nfs/dbraw/zinc/51/77/90/1024517790.db2.gz FNHAUOGFAYJZQG-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000472057355 1024528496 /nfs/dbraw/zinc/52/84/96/1024528496.db2.gz HNMRHJUUVMMZJR-MENRCCPVSA-N 1 0 339.439 3.889 20 5 EHBDRO CCOC(=O)C[C@@H](C)[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343883 1024667131 /nfs/dbraw/zinc/66/71/31/1024667131.db2.gz WDPPMVPAQJPMLM-CYBMUJFWSA-N 1 0 346.383 3.628 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc2c1OCCCO2 ZINC000539058164 1024717270 /nfs/dbraw/zinc/71/72/70/1024717270.db2.gz GTOJRYKKAGTGRU-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1CCC2(COC2)CC1 ZINC000895695101 1024721776 /nfs/dbraw/zinc/72/17/76/1024721776.db2.gz RWXZDCIHRLTSCQ-UHFFFAOYSA-N 1 0 345.226 3.950 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]([C@H]4CCCO4)C3)o2)cc1 ZINC000895843870 1024890934 /nfs/dbraw/zinc/89/09/34/1024890934.db2.gz JESKMVLCRAJWGS-MAUKXSAKSA-N 1 0 342.395 3.856 20 5 EHBDRO COc1cc(N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185528 1024900969 /nfs/dbraw/zinc/90/09/69/1024900969.db2.gz DYBSKHLKUGOSBA-WMLDXEAASA-N 1 0 341.411 3.851 20 5 EHBDRO CC[C@H]([NH2+]C1(C(=O)Nc2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000427988714 1024926781 /nfs/dbraw/zinc/92/67/81/1024926781.db2.gz PUOSCVIWSBWOBO-KRWDZBQOSA-N 1 0 339.395 3.807 20 5 EHBDRO NC(=O)c1ccc(C[N@@H+]2CCCC3(CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000346676810 1025012621 /nfs/dbraw/zinc/01/26/21/1025012621.db2.gz KPJXMGFOUKHXFN-UHFFFAOYSA-N 1 0 345.443 3.630 20 5 EHBDRO COc1ccc(CCC[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000072014193 1025148060 /nfs/dbraw/zinc/14/80/60/1025148060.db2.gz AGHQZTPGQFCQTO-UHFFFAOYSA-N 1 0 344.411 3.547 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000515333665 1025175545 /nfs/dbraw/zinc/17/55/45/1025175545.db2.gz ZSWZTAMRQRHYIU-LJQANCHMSA-N 1 0 326.396 3.649 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000474596646 1025180672 /nfs/dbraw/zinc/18/06/72/1025180672.db2.gz LDKYIMPNQMLMEP-MJJDPTRDSA-N 1 0 334.416 3.757 20 5 EHBDRO Cc1ccccc1[C@@H](O)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163185291 1025191116 /nfs/dbraw/zinc/19/11/16/1025191116.db2.gz ZWHLUTOXWQKDPT-QUCCMNQESA-N 1 0 340.423 3.548 20 5 EHBDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000515410669 1025219809 /nfs/dbraw/zinc/21/98/09/1025219809.db2.gz PPFOBYYESISMAD-STJZUHDESA-N 1 0 326.396 3.993 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccnn1-c1ccccc1 ZINC000467340212 1025326985 /nfs/dbraw/zinc/32/69/85/1025326985.db2.gz DUZHCPPROLTCOY-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO COC(=O)[C@@H](CC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000425470148 1025389355 /nfs/dbraw/zinc/38/93/55/1025389355.db2.gz GAVHKQBOHXKTGI-KSSFIOAISA-N 1 0 342.395 3.592 20 5 EHBDRO O=[N+]([O-])c1ccc(Nc2ccc(CC[NH+]3CCCCC3)cc2)nc1 ZINC000515607254 1025403801 /nfs/dbraw/zinc/40/38/01/1025403801.db2.gz ALIHDZWWBYTCNF-UHFFFAOYSA-N 1 0 326.400 3.762 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H]2OCCC[C@@H]12 ZINC000439060396 1025529950 /nfs/dbraw/zinc/52/99/50/1025529950.db2.gz VAIPYOKVHSEROB-HLPPOEQASA-N 1 0 336.457 3.623 20 5 EHBDRO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000436311838 1025574288 /nfs/dbraw/zinc/57/42/88/1025574288.db2.gz XVIUJYGWTNQQBW-WDEREUQCSA-N 1 0 346.353 3.683 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318944 1025582974 /nfs/dbraw/zinc/58/29/74/1025582974.db2.gz PXQAMXQWYDQGOR-WDEREUQCSA-N 1 0 346.353 3.541 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)C[C@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200895 1025641962 /nfs/dbraw/zinc/64/19/62/1025641962.db2.gz OGEPLPOIFJVRNC-DYVFJYSZSA-N 1 0 327.384 3.582 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000120007646 1025671211 /nfs/dbraw/zinc/67/12/11/1025671211.db2.gz ONKCJGGXBIPKMK-OCCSQVGLSA-N 1 0 346.818 3.573 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)OC(C)C ZINC000185726861 1025700914 /nfs/dbraw/zinc/70/09/14/1025700914.db2.gz WQXKUFFFPWYSJZ-LJQANCHMSA-N 1 0 344.411 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425559237 1025752257 /nfs/dbraw/zinc/75/22/57/1025752257.db2.gz ZBIRJJJWWAJTCR-QGZVFWFLSA-N 1 0 334.391 3.515 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)C ZINC000451442255 1025973963 /nfs/dbraw/zinc/97/39/63/1025973963.db2.gz UZOBGQJVAQSSGK-CQSZACIVSA-N 1 0 332.404 3.949 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000522137751 1026015966 /nfs/dbraw/zinc/01/59/66/1026015966.db2.gz YRNKQUZCTDNUSZ-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO CCOc1cc(N2CCC[C@H]2c2nc(C)c(C)[nH]2)ccc1[N+](=O)[O-] ZINC000895192170 1026084066 /nfs/dbraw/zinc/08/40/66/1026084066.db2.gz FXYDCKIBNCZOCM-HNNXBMFYSA-N 1 0 330.388 3.675 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](COc2ccccc2)C1 ZINC000505870418 1026089562 /nfs/dbraw/zinc/08/95/62/1026089562.db2.gz WZMIACGYTYQRSO-HNNXBMFYSA-N 1 0 342.395 3.504 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)CCc2n[nH]c3ccccc32)cccc1[N+](=O)[O-] ZINC000478500786 1026141821 /nfs/dbraw/zinc/14/18/21/1026141821.db2.gz OEAHFKOTHVGTNN-CYBMUJFWSA-N 1 0 338.411 3.890 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000127107514 1026255303 /nfs/dbraw/zinc/25/53/03/1026255303.db2.gz ZLRRFOYRXVMOSR-HNNXBMFYSA-N 1 0 343.427 3.812 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+]C1(Cc2ccccc2)CCOCC1 ZINC000451938132 1026383316 /nfs/dbraw/zinc/38/33/16/1026383316.db2.gz IESWQXVJHBSRPA-UHFFFAOYSA-N 1 0 344.386 3.615 20 5 EHBDRO Cc1cc(NC(=O)c2c(Cl)cccc2[N+](=O)[O-])ccc1C[NH+](C)C ZINC001142008223 1026495514 /nfs/dbraw/zinc/49/55/14/1026495514.db2.gz STSCYZNXOLGKOM-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000186327667 1026502082 /nfs/dbraw/zinc/50/20/82/1026502082.db2.gz SZBXIRMHOUOCJR-DOXZYTNZSA-N 1 0 327.428 3.937 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1-c1nc(-c2ccc(C[NH+](C)C)cc2)no1 ZINC000531110209 1026583408 /nfs/dbraw/zinc/58/34/08/1026583408.db2.gz UOBRZOIVRVDLSU-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCCC[C@@H]([NH+]3CCCC3)C2)c2cccnc21 ZINC000413136928 1027104455 /nfs/dbraw/zinc/10/44/55/1027104455.db2.gz OCJUOOMOFAHUJB-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1cc(N2CCCC3(CCOCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272814582 1027130315 /nfs/dbraw/zinc/13/03/15/1027130315.db2.gz HOMKTNIKMLQUQU-UHFFFAOYSA-N 1 0 341.411 3.848 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000366543697 1027373660 /nfs/dbraw/zinc/37/36/60/1027373660.db2.gz RZGQAMOHADHNKH-UHFFFAOYSA-N 1 0 343.349 3.812 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CO)CC2CCC2)s1 ZINC000475516724 1027533430 /nfs/dbraw/zinc/53/34/30/1027533430.db2.gz NORUFTUEIWSBAA-CQSZACIVSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000366690877 1027741117 /nfs/dbraw/zinc/74/11/17/1027741117.db2.gz BDGZKTYHLCPECG-RDTXWAMCSA-N 1 0 325.412 3.741 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)c2ccccc2C)cc1[N+](=O)[O-] ZINC000536626011 1028012512 /nfs/dbraw/zinc/01/25/12/1028012512.db2.gz VKRQGEBONFBZQA-PBHICJAKSA-N 1 0 344.411 3.686 20 5 EHBDRO Cc1cnc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668094 1028066875 /nfs/dbraw/zinc/06/68/75/1028066875.db2.gz NRPXYXQGNBOLEV-BBRMVZONSA-N 1 0 346.456 3.855 20 5 EHBDRO CCC[C@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000444764442 1028252118 /nfs/dbraw/zinc/25/21/18/1028252118.db2.gz BESVWZLVJPCVKH-GOSISDBHSA-N 1 0 336.432 3.509 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC([NH3+])(CC)CC ZINC000423287904 1028324767 /nfs/dbraw/zinc/32/47/67/1028324767.db2.gz PEVHAWXOHCJRNT-CYBMUJFWSA-N 1 0 325.478 3.573 20 5 EHBDRO CCCC[C@H](C[NH3+])N[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423304402 1028357174 /nfs/dbraw/zinc/35/71/74/1028357174.db2.gz YRAHKPJFUVAIAG-MJGOQNOKSA-N 1 0 327.428 3.791 20 5 EHBDRO CCc1ccc([C@@H](NCC[C@H]2CCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423376690 1028413202 /nfs/dbraw/zinc/41/32/02/1028413202.db2.gz YLLUTTLCDNJYOW-BEFAXECRSA-N 1 0 343.427 3.571 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838642 1028601144 /nfs/dbraw/zinc/60/11/44/1028601144.db2.gz SZOSBIKPZFXMPN-DLBZAZTESA-N 1 0 328.416 3.837 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H](C)Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000445255347 1028664097 /nfs/dbraw/zinc/66/40/97/1028664097.db2.gz SMZUGOOCBUVIBB-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO CCc1cnc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000130205472 1028774765 /nfs/dbraw/zinc/77/47/65/1028774765.db2.gz ITRJXHVQWXGCOR-INIZCTEOSA-N 1 0 345.468 3.767 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(O)CCCCCC2)cc1[N+](=O)[O-] ZINC000504899841 1029043144 /nfs/dbraw/zinc/04/31/44/1029043144.db2.gz NIEZBUFNOGDPLB-AWEZNQCLSA-N 1 0 336.432 3.729 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(C)[C@@H](C)C1 ZINC000504920105 1029046033 /nfs/dbraw/zinc/04/60/33/1029046033.db2.gz NDIKXVVYSGJAEK-RRFJBIMHSA-N 1 0 337.489 3.538 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532918390 1029069385 /nfs/dbraw/zinc/06/93/85/1029069385.db2.gz TVWJNQJALFDRQG-QANKJYHBSA-N 1 0 345.443 3.742 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000269027661 1029072059 /nfs/dbraw/zinc/07/20/59/1029072059.db2.gz QXRYASWIBPZQOF-INIZCTEOSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1c(C[NH2+]C2(c3ccccc3)CCOCC2)cccc1[N+](=O)[O-] ZINC000533060643 1029252098 /nfs/dbraw/zinc/25/20/98/1029252098.db2.gz DKXVCEZZTKRAAF-UHFFFAOYSA-N 1 0 326.396 3.699 20 5 EHBDRO Cc1cc(Cl)cc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000508679539 1029634553 /nfs/dbraw/zinc/63/45/53/1029634553.db2.gz MNUQIUWUZOOGIZ-HNNXBMFYSA-N 1 0 346.818 3.638 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000343224599 1029810130 /nfs/dbraw/zinc/81/01/30/1029810130.db2.gz YRXOKEUVWOVAEF-ZDUSSCGKSA-N 1 0 342.399 3.550 20 5 EHBDRO CC(C)Cc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446830004 1029812219 /nfs/dbraw/zinc/81/22/19/1029812219.db2.gz NOJLJZRIPCXKCW-UHFFFAOYSA-N 1 0 338.411 3.959 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000446895409 1029844873 /nfs/dbraw/zinc/84/48/73/1029844873.db2.gz CCQWWLHMSDHFRB-HNNXBMFYSA-N 1 0 339.439 3.980 20 5 EHBDRO COC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])C1CCCC1 ZINC000446887859 1029848239 /nfs/dbraw/zinc/84/82/39/1029848239.db2.gz ZGAWNZFWFPFKKP-OAHLLOKOSA-N 1 0 326.824 3.586 20 5 EHBDRO CC[C@@H](C)[NH2+][C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257841 1029954802 /nfs/dbraw/zinc/95/48/02/1029954802.db2.gz ZMFIFAWYRINOJK-PWSUYJOCSA-N 1 0 338.795 3.778 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453255099 1029986509 /nfs/dbraw/zinc/98/65/09/1029986509.db2.gz KLAHAFJFFJMIAM-SWLSCSKDSA-N 1 0 346.349 3.919 20 5 EHBDRO C[C@@H](CCCO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453285218 1030028837 /nfs/dbraw/zinc/02/88/37/1030028837.db2.gz WVYKEESVEKHGQE-HNAYVOBHSA-N 1 0 328.412 3.682 20 5 EHBDRO [NH3+][C@@H]1CCC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000567847675 1030143399 /nfs/dbraw/zinc/14/33/99/1030143399.db2.gz WMPDRKJYUUDALF-GDBMZVCRSA-N 1 0 333.435 3.635 20 5 EHBDRO CC[C@@H](O)[C@H](CC)[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000453380888 1030160540 /nfs/dbraw/zinc/16/05/40/1030160540.db2.gz RTAKCAIZKOYDRP-VNHYZAJKSA-N 1 0 326.462 3.605 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cn1 ZINC000453392288 1030239796 /nfs/dbraw/zinc/23/97/96/1030239796.db2.gz YUHSVTUYBAVBNW-HDMKZQKVSA-N 1 0 342.443 3.873 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOCc1ccccc1)CCC2 ZINC000447526752 1030247872 /nfs/dbraw/zinc/24/78/72/1030247872.db2.gz CJTUDOXMRQESHQ-IBGZPJMESA-N 1 0 326.396 3.779 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447527168 1030248323 /nfs/dbraw/zinc/24/83/23/1030248323.db2.gz FLKSNHDFEDFNOS-IRXDYDNUSA-N 1 0 342.443 3.842 20 5 EHBDRO Cc1cc(C)cc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447540247 1030275957 /nfs/dbraw/zinc/27/59/57/1030275957.db2.gz IYQTUHVFLGCITJ-ZWKOTPCHSA-N 1 0 342.443 3.724 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000447540198 1030276072 /nfs/dbraw/zinc/27/60/72/1030276072.db2.gz JCYHWBSIDUAFGK-LJQANCHMSA-N 1 0 325.412 3.828 20 5 EHBDRO C[C@H](CC(C)(C)C)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453430006 1030286043 /nfs/dbraw/zinc/28/60/43/1030286043.db2.gz QCYWCWJAUHGVON-CZUORRHYSA-N 1 0 330.432 3.832 20 5 EHBDRO COc1ccc(CN2CCC[C@@H]2c2cccc(C)n2)cc1[N+](=O)[O-] ZINC000159854317 1030399124 /nfs/dbraw/zinc/39/91/24/1030399124.db2.gz WUGBNKBHCASEEA-MRXNPFEDSA-N 1 0 327.384 3.644 20 5 EHBDRO C[C@H](CC[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000447729482 1030441564 /nfs/dbraw/zinc/44/15/64/1030441564.db2.gz NWROGQFDYQHODM-NVXWUHKLSA-N 1 0 340.427 3.670 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc2c(c1)OCO2 ZINC000532200100 1030473056 /nfs/dbraw/zinc/47/30/56/1030473056.db2.gz IBBICUCTQGKIKZ-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000532202644 1030476684 /nfs/dbraw/zinc/47/66/84/1030476684.db2.gz QBCQJCSTPJMDNC-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448126 1030504965 /nfs/dbraw/zinc/50/49/65/1030504965.db2.gz GDUPUWUVPYTMNF-VXGBXAGGSA-N 1 0 331.372 3.506 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2c[nH]cn2)CC1 ZINC000347361668 1030611176 /nfs/dbraw/zinc/61/11/76/1030611176.db2.gz PVULNJSFYRNFTQ-NTEUORMPSA-N 1 0 326.400 3.601 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2CCO[C@@H]2c2cccnc2)cc1[N+](=O)[O-] ZINC000343409858 1030739840 /nfs/dbraw/zinc/73/98/40/1030739840.db2.gz SVSCQPVYFFNTKP-PKOBYXMFSA-N 1 0 341.411 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117186 1030978024 /nfs/dbraw/zinc/97/80/24/1030978024.db2.gz OUIHPDHDRBPAJK-CYBMUJFWSA-N 1 0 340.358 3.600 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+](CC1CC1)CC1CCC1 ZINC000483282960 1031087902 /nfs/dbraw/zinc/08/79/02/1031087902.db2.gz GWYFHQDTULXGEM-UHFFFAOYSA-N 1 0 345.443 3.744 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000296040884 1031223847 /nfs/dbraw/zinc/22/38/47/1031223847.db2.gz UJBOYHGLOUVBPC-SJCJKPOMSA-N 1 0 328.416 3.884 20 5 EHBDRO CC(C)CC[C@](C)(O)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484137809 1031476112 /nfs/dbraw/zinc/47/61/12/1031476112.db2.gz UBYWTDDZHQEGEO-HKUYNNGSSA-N 1 0 334.460 3.693 20 5 EHBDRO COC1CCC(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000484274071 1031516322 /nfs/dbraw/zinc/51/63/22/1031516322.db2.gz CZKIXYSQSIQXDR-UYJHFMRCSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](CO)CC1CCCC1)CCC2 ZINC000343590951 1031524458 /nfs/dbraw/zinc/52/44/58/1031524458.db2.gz HNCSSTBRWKMDBG-KXBFYZLASA-N 1 0 332.444 3.751 20 5 EHBDRO O=[N+]([O-])c1ccccc1Cc1noc([C@@H]2CC[C@@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000904080168 1031713283 /nfs/dbraw/zinc/71/32/83/1031713283.db2.gz YPIAASJUTOYSIB-QEJZJMRPSA-N 1 0 342.399 3.552 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1nccs1)C(C)C ZINC000179050991 1031741858 /nfs/dbraw/zinc/74/18/58/1031741858.db2.gz OAMATBRLPNJGDZ-UHFFFAOYSA-N 1 0 349.456 3.903 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487854 1033369936 /nfs/dbraw/zinc/36/99/36/1033369936.db2.gz NYBDKGJUYQAWRW-ZFWWWQNUSA-N 1 0 334.445 3.508 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505827 1033407153 /nfs/dbraw/zinc/40/71/53/1033407153.db2.gz BPQJMDDVSWVTON-GWCFXTLKSA-N 1 0 332.322 3.529 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C(=O)OC(C)(C)C ZINC000594513100 1033417193 /nfs/dbraw/zinc/41/71/93/1033417193.db2.gz BDPQCLYWJIJMJC-RNQWEJQRSA-N 1 0 334.416 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCN3CCCC[C@@H]13)CCC2 ZINC000594518576 1033424866 /nfs/dbraw/zinc/42/48/66/1033424866.db2.gz IDLAHZAROJBWGZ-QRVBRYPASA-N 1 0 329.444 3.579 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000594615398 1033479980 /nfs/dbraw/zinc/47/99/80/1033479980.db2.gz OBQFYSBQKXHBCL-LBPRGKRZSA-N 1 0 332.425 3.669 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292775 1033555074 /nfs/dbraw/zinc/55/50/74/1033555074.db2.gz NEMYBXOUWMBCEA-DOTOQJQBSA-N 1 0 346.456 3.570 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CC[C@@H]3C[C@@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598986585 1033609859 /nfs/dbraw/zinc/60/98/59/1033609859.db2.gz DAZGJIPLMYPHFE-BMFZPTHFSA-N 1 0 340.427 3.521 20 5 EHBDRO CCCC[NH+]1CCC(N[C@@H](C)c2ccc([N+](=O)[O-])cc2OC)CC1 ZINC000595016107 1033610175 /nfs/dbraw/zinc/61/01/75/1033610175.db2.gz QCDDBVVNQWRCLN-AWEZNQCLSA-N 1 0 335.448 3.519 20 5 EHBDRO CC1(C)OC[C@H]2C[C@]21[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000598986449 1033612183 /nfs/dbraw/zinc/61/21/83/1033612183.db2.gz AFUPUDRJGIBPGS-ACJLOTCBSA-N 1 0 328.368 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1COc2ccc(C)cc21 ZINC000595022886 1033616680 /nfs/dbraw/zinc/61/66/80/1033616680.db2.gz QDWJLKHZQJMGCF-WBMJQRKESA-N 1 0 328.368 3.696 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCc3c(C)cccc32)c([N+](=O)[O-])cc1O ZINC000595000491 1033626606 /nfs/dbraw/zinc/62/66/06/1033626606.db2.gz JSXLRHUVAXBOTJ-MRXNPFEDSA-N 1 0 342.395 3.785 20 5 EHBDRO COCc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595003423 1033627254 /nfs/dbraw/zinc/62/72/54/1033627254.db2.gz FXVJUYPBHPBJMA-CYBMUJFWSA-N 1 0 330.384 3.601 20 5 EHBDRO COc1ccccc1CC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595006592 1033631274 /nfs/dbraw/zinc/63/12/74/1033631274.db2.gz LMNXQBFIXXXYHZ-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO COC[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1cccc(OC)c1 ZINC000595066512 1033644961 /nfs/dbraw/zinc/64/49/61/1033644961.db2.gz ICASTSIRBLXQOK-QZTJIDSGSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](C)c1nc(C)cs1 ZINC000595032015 1033652553 /nfs/dbraw/zinc/65/25/53/1033652553.db2.gz LCAVIGHTWWIZNH-ZYHUDNBSSA-N 1 0 335.429 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H]1CCCC12CCOCC2 ZINC000595037850 1033657402 /nfs/dbraw/zinc/65/74/02/1033657402.db2.gz DMSDNZPJJIAVOL-DYVFJYSZSA-N 1 0 334.416 3.603 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(O)CCC(F)(F)CC1)CCC2 ZINC000595093297 1033701772 /nfs/dbraw/zinc/70/17/72/1033701772.db2.gz HVTJWVNKEAQCRT-HNNXBMFYSA-N 1 0 340.370 3.502 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C2CCC2)cnn1C ZINC000595096556 1033704034 /nfs/dbraw/zinc/70/40/34/1033704034.db2.gz BLUVINKDXVZPRY-CQSZACIVSA-N 1 0 342.443 3.707 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095553 1033731698 /nfs/dbraw/zinc/73/16/98/1033731698.db2.gz GXGZCFZBSHKVNZ-APWZRJJASA-N 1 0 339.395 3.727 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000892416373 1033770336 /nfs/dbraw/zinc/77/03/36/1033770336.db2.gz WSCAIRKTIULZTJ-OAHLLOKOSA-N 1 0 346.383 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](c4ccccn4)C3)nc2c1 ZINC000595501906 1033832163 /nfs/dbraw/zinc/83/21/63/1033832163.db2.gz QEAFCGXRPLVEBB-CYBMUJFWSA-N 1 0 338.367 3.511 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545134 1033856368 /nfs/dbraw/zinc/85/63/68/1033856368.db2.gz ONLPOFYETGAMMF-OAHLLOKOSA-N 1 0 327.384 3.661 20 5 EHBDRO COc1cc(NC2CCC([NH+]3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000080247803 1033944618 /nfs/dbraw/zinc/94/46/18/1033944618.db2.gz QCAVHMSIOQFBIS-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO CC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C[C@@H]1COc2ccccc2O1 ZINC000603838773 1033950553 /nfs/dbraw/zinc/95/05/53/1033950553.db2.gz HWYGQQXPKVOZCW-MRXNPFEDSA-N 1 0 342.395 3.565 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCCNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000603859676 1033984859 /nfs/dbraw/zinc/98/48/59/1033984859.db2.gz QXBZWTKINNHOER-GASCZTMLSA-N 1 0 342.443 3.923 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754777 1033985468 /nfs/dbraw/zinc/98/54/68/1033985468.db2.gz BULVCDAIMWZLBJ-STQMWFEESA-N 1 0 348.378 3.777 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000064114238 1033995273 /nfs/dbraw/zinc/99/52/73/1033995273.db2.gz FXYKJVWGMBUTBN-KRWDZBQOSA-N 1 0 344.371 3.526 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000595787976 1033998375 /nfs/dbraw/zinc/99/83/75/1033998375.db2.gz LFXILHHOWDVJLE-GOSISDBHSA-N 1 0 348.443 3.775 20 5 EHBDRO CC(C)CC1([NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000595831690 1034015308 /nfs/dbraw/zinc/01/53/08/1034015308.db2.gz PLDJCPNIRNSLTJ-NSHDSACASA-N 1 0 339.823 3.744 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584502 1034026211 /nfs/dbraw/zinc/02/62/11/1034026211.db2.gz ADZICILGQCIYDR-QLFBSQMISA-N 1 0 348.443 3.956 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CCN(c3[nH+]ccc4[nH]ccc43)CC2)cc1 ZINC000596141629 1034089188 /nfs/dbraw/zinc/08/91/88/1034089188.db2.gz IIWFQHCTTNTXHO-UHFFFAOYSA-N 1 0 338.367 3.519 20 5 EHBDRO CCc1ccc([C@@H](NCC[C@@H]([NH3+])C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596653455 1034330428 /nfs/dbraw/zinc/33/04/28/1034330428.db2.gz KLZFWECNQNNRGW-MJGOQNOKSA-N 1 0 345.443 3.803 20 5 EHBDRO C[C@@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000596650811 1034348259 /nfs/dbraw/zinc/34/82/59/1034348259.db2.gz REFBMCBTCUATPN-UPRAQXHNSA-N 1 0 343.402 3.530 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000604484461 1034388055 /nfs/dbraw/zinc/38/80/55/1034388055.db2.gz PMMTYFLFIMXJLW-INIZCTEOSA-N 1 0 328.368 3.646 20 5 EHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000604493506 1034400839 /nfs/dbraw/zinc/40/08/39/1034400839.db2.gz VOBYBQKDVYIGCY-UHFFFAOYSA-N 1 0 334.441 3.990 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC1CC([NH+]2CCCCC2)C1 ZINC000450495793 1034429320 /nfs/dbraw/zinc/42/93/20/1034429320.db2.gz WWCFTTMUCRXWGB-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[N@@H+]1CCC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000302947726 1034443328 /nfs/dbraw/zinc/44/33/28/1034443328.db2.gz NCDSONKBDKYFCK-MRXNPFEDSA-N 1 0 333.435 3.602 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2cccc3[nH]ccc32)n1 ZINC000601321000 1034452014 /nfs/dbraw/zinc/45/20/14/1034452014.db2.gz MQXQDGNQYZGNKK-IAGOWNOFSA-N 1 0 339.399 3.546 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000364374426 1034604100 /nfs/dbraw/zinc/60/41/00/1034604100.db2.gz MTJHXNRZFOAFLE-BBRMVZONSA-N 1 0 328.416 3.580 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@@](O)(C4CC4)C3)o2)c1 ZINC000597203871 1034607740 /nfs/dbraw/zinc/60/77/40/1034607740.db2.gz AFXJJBSCNKLITM-IBGZPJMESA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1[C@@H]2Cc3cc(F)ccc3[C@@H]21 ZINC000597237395 1034617890 /nfs/dbraw/zinc/61/78/90/1034617890.db2.gz ZTFQSGMEPWLVJS-HINUTXJASA-N 1 0 340.398 3.983 20 5 EHBDRO O=C(Nc1ccc(CC[NH+]2CCCC2)cc1)c1ccc([N+](=O)[O-])s1 ZINC000065876204 1034794192 /nfs/dbraw/zinc/79/41/92/1034794192.db2.gz VAAAISRCIBVBIM-UHFFFAOYSA-N 1 0 345.424 3.547 20 5 EHBDRO Cc1c(F)cccc1NC(=O)CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000411449396 1034884517 /nfs/dbraw/zinc/88/45/17/1034884517.db2.gz GEJQVHKLTXVYAD-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO O=C(CC[NH2+][C@H](c1cccs1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000411446206 1034884851 /nfs/dbraw/zinc/88/48/51/1034884851.db2.gz AJYGGSNFOXOGLB-KRWDZBQOSA-N 1 0 345.424 3.726 20 5 EHBDRO CC1=C(c2ccco2)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000548930073 1034940962 /nfs/dbraw/zinc/94/09/62/1034940962.db2.gz FEWRPDQNDCLJNM-UHFFFAOYSA-N 1 0 328.368 3.746 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000411896565 1035065651 /nfs/dbraw/zinc/06/56/51/1035065651.db2.gz RVVVGUPXHIVUAP-SJORKVTESA-N 1 0 332.787 3.650 20 5 EHBDRO CO[C@](C)([C@H](C)[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C1CC1 ZINC000411970091 1035089495 /nfs/dbraw/zinc/08/94/95/1035089495.db2.gz MTUZZMUDVMCEMN-KPZWWZAWSA-N 1 0 345.399 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccccc2)cc1 ZINC000412001715 1035273938 /nfs/dbraw/zinc/27/39/38/1035273938.db2.gz QTIXEPGQNPTGGT-IBGZPJMESA-N 1 0 338.407 3.949 20 5 EHBDRO CC[C@@H](CN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)[NH+]1CCCC1 ZINC000581315206 1035483733 /nfs/dbraw/zinc/48/37/33/1035483733.db2.gz VQPBSINOEVVULO-ZFWWWQNUSA-N 1 0 345.365 3.662 20 5 EHBDRO COc1ccc(OCC[N@H+](CC(C)C)CC(C)(C)C)c([N+](=O)[O-])c1 ZINC001168164622 1035552723 /nfs/dbraw/zinc/55/27/23/1035552723.db2.gz RGGSCNMOHXAEEX-UHFFFAOYSA-N 1 0 338.448 3.986 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271988931 1035631377 /nfs/dbraw/zinc/63/13/77/1035631377.db2.gz FWHBJLUDBDXCLB-RTBURBONSA-N 1 0 326.396 3.678 20 5 EHBDRO Cc1cccn2cc(C[NH2+][C@@H](C)CCc3ccccc3[N+](=O)[O-])nc12 ZINC000090044766 1035644373 /nfs/dbraw/zinc/64/43/73/1035644373.db2.gz MJGIXJGKYGPNJO-HNNXBMFYSA-N 1 0 338.411 3.662 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[N@@H+]3CCCC[C@H]3C)C2)c1 ZINC000540906903 1035786193 /nfs/dbraw/zinc/78/61/93/1035786193.db2.gz AJWCMXNXBDGEAW-CVEARBPZSA-N 1 0 347.459 3.694 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000588232600 1035831343 /nfs/dbraw/zinc/83/13/43/1035831343.db2.gz QGZIJLHCIKBWSB-HIFRSBDPSA-N 1 0 348.830 3.983 20 5 EHBDRO Cn1cc(C[NH2+]CC2(C)CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000066594317 1035859718 /nfs/dbraw/zinc/85/97/18/1035859718.db2.gz CBJOIZMAZAUQHI-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO C[N@H+](CCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CCCC1 ZINC000582611031 1036041974 /nfs/dbraw/zinc/04/19/74/1036041974.db2.gz JCCWWWWYGGBTFX-HNNXBMFYSA-N 1 0 345.365 3.662 20 5 EHBDRO Cc1cc(NCc2ccc3c(c2)COC3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541191387 1036060276 /nfs/dbraw/zinc/06/02/76/1036060276.db2.gz WYULTQNMHQXGQW-UHFFFAOYSA-N 1 0 335.363 3.516 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@H](C)Cc2ccc(O)cc2)ccc1[N+](=O)[O-] ZINC000492652216 1036111756 /nfs/dbraw/zinc/11/17/56/1036111756.db2.gz LBSGHDGRYFHYIQ-CQSZACIVSA-N 1 0 344.411 3.762 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@](C)(OC)C2CC2)cc1[N+](=O)[O-] ZINC000414226278 1036148602 /nfs/dbraw/zinc/14/86/02/1036148602.db2.gz BUMXOKKBSBOSII-JCGVRSQUSA-N 1 0 336.432 3.848 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000582677780 1036177971 /nfs/dbraw/zinc/17/79/71/1036177971.db2.gz VHXOZDGXHQHBGM-BOUXLOLZSA-N 1 0 339.439 3.863 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492729411 1036218485 /nfs/dbraw/zinc/21/84/85/1036218485.db2.gz RZJOUGZHSMDSFA-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)[C@@H](O)C(F)(F)F ZINC000498356652 1036278710 /nfs/dbraw/zinc/27/87/10/1036278710.db2.gz ZVZRRRLASKOMQL-GXTWGEPZSA-N 1 0 334.338 3.510 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])[C@H](C)O1 ZINC000414252615 1036302417 /nfs/dbraw/zinc/30/24/17/1036302417.db2.gz ATJBXVQHPCVSRN-MISMHTLLSA-N 1 0 332.444 3.709 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H](O)C1CC1 ZINC000589197042 1036304051 /nfs/dbraw/zinc/30/40/51/1036304051.db2.gz VGJGAQJHJOCOTR-MRXNPFEDSA-N 1 0 332.425 3.526 20 5 EHBDRO CCC[C@]1(CO)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000589210515 1036313512 /nfs/dbraw/zinc/31/35/12/1036313512.db2.gz NKEJLVKCYGJOBZ-IBGZPJMESA-N 1 0 344.411 3.839 20 5 EHBDRO COc1ccc(OCC[N@H+](C2CC2)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000610367643 1036440083 /nfs/dbraw/zinc/44/00/83/1036440083.db2.gz MBQNACNURNYJQS-UHFFFAOYSA-N 1 0 334.416 3.779 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c(C)s1 ZINC000541581301 1036454370 /nfs/dbraw/zinc/45/43/70/1036454370.db2.gz KSJVHKRBRFEXHC-GFCCVEGCSA-N 1 0 347.440 3.871 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@H]2C)ccc1[N+](=O)[O-] ZINC000541685002 1036572045 /nfs/dbraw/zinc/57/20/45/1036572045.db2.gz JMLOCNBYQGEDKJ-VPZZIHKRSA-N 1 0 342.395 3.646 20 5 EHBDRO CC(C)N(C(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000180400962 1036754490 /nfs/dbraw/zinc/75/44/90/1036754490.db2.gz ZLJNVCQAORQPIP-HNNXBMFYSA-N 1 0 341.411 3.687 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000180446262 1036838857 /nfs/dbraw/zinc/83/88/57/1036838857.db2.gz GAZTWLLZVJYIKC-ZIAGYGMSSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1sc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1C ZINC000180446291 1036840439 /nfs/dbraw/zinc/84/04/39/1036840439.db2.gz BEQIKYJWGJWQTG-LBPRGKRZSA-N 1 0 347.440 3.871 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(c2ccc(F)cc2)C1 ZINC000414349213 1036848723 /nfs/dbraw/zinc/84/87/23/1036848723.db2.gz PARTVEGLXSIZMP-RHSMWYFYSA-N 1 0 343.402 3.533 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000539509362 1036848902 /nfs/dbraw/zinc/84/89/02/1036848902.db2.gz JOSOUODNYXFZNU-MAUKXSAKSA-N 1 0 346.471 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC(OC(F)F)CC2)c(Cl)c1 ZINC000590662267 1036995336 /nfs/dbraw/zinc/99/53/36/1036995336.db2.gz IBPQRSAHPIJXKF-UHFFFAOYSA-N 1 0 334.750 3.888 20 5 EHBDRO CCOc1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000590659571 1036996273 /nfs/dbraw/zinc/99/62/73/1036996273.db2.gz AOZGZINAIWZBDH-INIZCTEOSA-N 1 0 341.411 3.768 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000590779918 1037047917 /nfs/dbraw/zinc/04/79/17/1037047917.db2.gz ZLIXKNWLOAZDRP-QOKNQOGYSA-N 1 0 341.411 3.869 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000590779919 1037048226 /nfs/dbraw/zinc/04/82/26/1037048226.db2.gz ZLIXKNWLOAZDRP-URLQWDBASA-N 1 0 341.411 3.869 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)N(C)Cc1ccccc1 ZINC000761527954 1037103860 /nfs/dbraw/zinc/10/38/60/1037103860.db2.gz VLERBTQVPCOXTE-AWEZNQCLSA-N 1 0 347.846 3.858 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C)c1nc(C)cs1 ZINC000595032012 1037164327 /nfs/dbraw/zinc/16/43/27/1037164327.db2.gz LCAVIGHTWWIZNH-CMPLNLGQSA-N 1 0 335.429 3.823 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000057877832 1037238371 /nfs/dbraw/zinc/23/83/71/1037238371.db2.gz AWFBCLSXRIZUBW-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO CC[C@@H]([NH2+]CCCNC(=O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000180833359 1037254102 /nfs/dbraw/zinc/25/41/02/1037254102.db2.gz DGPSZQDXDFINEH-OAHLLOKOSA-N 1 0 347.440 3.517 20 5 EHBDRO CC[NH+](CC)C[C@H](C)Oc1cc([N+](=O)[O-])cc(F)c1Br ZINC001233904060 1037261827 /nfs/dbraw/zinc/26/18/27/1037261827.db2.gz YLAAGRDHIPFLLR-VIFPVBQESA-N 1 0 349.200 3.606 20 5 EHBDRO CO[C@](C)(C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000462801896 1037421720 /nfs/dbraw/zinc/42/17/20/1037421720.db2.gz DVCFRCPFOALLIO-POZUXBRTSA-N 1 0 332.444 3.711 20 5 EHBDRO C=Cc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000462819376 1037441689 /nfs/dbraw/zinc/44/16/89/1037441689.db2.gz LVYWFZAXJVFUBL-MSOLQXFVSA-N 1 0 340.427 3.750 20 5 EHBDRO CCc1ccc([C@@H](NCCC[NH2+]C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591577283 1037514142 /nfs/dbraw/zinc/51/41/42/1037514142.db2.gz LUFKIIXSRWWJKZ-IBGZPJMESA-N 1 0 345.443 3.817 20 5 EHBDRO CC1(C)C[C@@H](N[C@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582567 1037518037 /nfs/dbraw/zinc/51/80/37/1037518037.db2.gz LPNOQXBNVUQZRM-SUMWQHHRSA-N 1 0 329.444 3.582 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CC[C@H]2CCC[C@H]2C1 ZINC000532522760 1037549133 /nfs/dbraw/zinc/54/91/33/1037549133.db2.gz HVMOGMGFPYNLCF-PNBKFKSVSA-N 1 0 345.443 3.870 20 5 EHBDRO COc1cc(NC[C@H](c2ccccc2Cl)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000462922748 1037551988 /nfs/dbraw/zinc/55/19/88/1037551988.db2.gz DJWUEOBPVOKHGO-MRXNPFEDSA-N 1 0 349.818 3.972 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538076 1037565630 /nfs/dbraw/zinc/56/56/30/1037565630.db2.gz XLAUKQLNFHMHDJ-CABCVRRESA-N 1 0 328.416 3.636 20 5 EHBDRO Cc1cc(-c2noc([C@@H](CC(C)C)n3ccnc3)n2)cc([N+](=O)[O-])c1 ZINC000924092255 1037603863 /nfs/dbraw/zinc/60/38/63/1037603863.db2.gz AKODBMDQNGPMGT-OAHLLOKOSA-N 1 0 341.371 3.785 20 5 EHBDRO CO[C@@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1)c1ccccc1 ZINC000549390316 1037620273 /nfs/dbraw/zinc/62/02/73/1037620273.db2.gz ZNXWRVLFIYPQAX-IBGZPJMESA-N 1 0 326.396 3.947 20 5 EHBDRO CCC[C@H](C)[C@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573615413 1037630783 /nfs/dbraw/zinc/63/07/83/1037630783.db2.gz WTRXJQKKOCNUNP-HZMBPMFUSA-N 1 0 334.338 3.500 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCOc1ccccc1F)C1CC1 ZINC000540171311 1037638534 /nfs/dbraw/zinc/63/85/34/1037638534.db2.gz QMLPSEVJHQQKHR-KRWDZBQOSA-N 1 0 344.386 3.724 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221646 1037785232 /nfs/dbraw/zinc/78/52/32/1037785232.db2.gz QVBHBQJKBYYJCC-CXAGYDPISA-N 1 0 327.384 3.663 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328651 1037826987 /nfs/dbraw/zinc/82/69/87/1037826987.db2.gz OWBCTZQYDFUUMM-CJNGLKHVSA-N 1 0 347.440 3.623 20 5 EHBDRO Cc1cccc(C2([NH2+]CC(=O)Nc3ccccc3[N+](=O)[O-])CCC2)c1 ZINC000592145964 1037874603 /nfs/dbraw/zinc/87/46/03/1037874603.db2.gz HFGKBNZBWMPBNM-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540397869 1037914579 /nfs/dbraw/zinc/91/45/79/1037914579.db2.gz JZZMGCHSWVCINY-KLICCBINSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@H](c2cccc(Cl)c2)C2CCCC2)n1 ZINC000540426849 1037932706 /nfs/dbraw/zinc/93/27/06/1037932706.db2.gz MPSMZIIMBLQFKE-KRWDZBQOSA-N 1 0 348.834 3.966 20 5 EHBDRO O=[N+]([O-])c1cnccc1NC1CC[NH+](Cc2ccc(Cl)cc2)CC1 ZINC000066797049 1038164683 /nfs/dbraw/zinc/16/46/83/1038164683.db2.gz JOLICTWDXMCYBF-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO CC[NH+](CC)CCSCc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000461510887 1038460621 /nfs/dbraw/zinc/46/06/21/1038460621.db2.gz BDWNBXMOGFOSQR-UHFFFAOYSA-N 1 0 326.462 3.957 20 5 EHBDRO COc1ccc(C[NH2+][C@]2(C)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000538707804 1038483960 /nfs/dbraw/zinc/48/39/60/1038483960.db2.gz ZHBCCTQTSQUUEQ-LJQANCHMSA-N 1 0 326.396 3.945 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538878483 1038584456 /nfs/dbraw/zinc/58/44/56/1038584456.db2.gz ZIZISWLAUDTMMQ-UGSOOPFHSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1cc(NC2CC[NH+](C3CC3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461723097 1038586040 /nfs/dbraw/zinc/58/60/40/1038586040.db2.gz DVSVFYVXXZTNBT-UHFFFAOYSA-N 1 0 343.349 3.961 20 5 EHBDRO CC[N@H+](CCNc1cc(C)c([N+](=O)[O-])cc1F)CCC(F)(F)F ZINC000461933924 1038682488 /nfs/dbraw/zinc/68/24/88/1038682488.db2.gz HYZHHADHYGPJAH-UHFFFAOYSA-N 1 0 337.317 3.729 20 5 EHBDRO Cc1cc(NCc2ccc(CC[NH+](C)C)cc2)c(F)cc1[N+](=O)[O-] ZINC000461937416 1038686228 /nfs/dbraw/zinc/68/62/28/1038686228.db2.gz BHKLKYIXAGLFOC-UHFFFAOYSA-N 1 0 331.391 3.759 20 5 EHBDRO CC(C)(C)C[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000341468474 1038737521 /nfs/dbraw/zinc/73/75/21/1038737521.db2.gz ZRSJYXHGEKFQKZ-OAHLLOKOSA-N 1 0 334.395 3.698 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCc3c[nH+]ccc32)nc1-c1ccc(F)cc1 ZINC000485410523 1039036078 /nfs/dbraw/zinc/03/60/78/1039036078.db2.gz HLIGRIFDSIIWAL-UHFFFAOYSA-N 1 0 336.326 3.885 20 5 EHBDRO C[C@@H](NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000905851778 1039156737 /nfs/dbraw/zinc/15/67/37/1039156737.db2.gz DAAIPFKOFWGYLA-RBSFLKMASA-N 1 0 341.411 3.511 20 5 EHBDRO CCOC(=O)CC1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000485797561 1039568141 /nfs/dbraw/zinc/56/81/41/1039568141.db2.gz YMRYJNNHRSFLCG-CQSZACIVSA-N 1 0 334.416 3.629 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000512527628 1039590851 /nfs/dbraw/zinc/59/08/51/1039590851.db2.gz VLMLQGGOSAILNB-UHFFFAOYSA-N 1 0 334.416 3.719 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)n1 ZINC000480505403 1039616613 /nfs/dbraw/zinc/61/66/13/1039616613.db2.gz MHUQWBVZLKEVKS-KRWDZBQOSA-N 1 0 340.427 3.541 20 5 EHBDRO COc1ccccc1[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000489106245 1039626351 /nfs/dbraw/zinc/62/63/51/1039626351.db2.gz PPYXQCDENILANO-MRXNPFEDSA-N 1 0 342.395 3.949 20 5 EHBDRO C[C@@H](CN(C)C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000554727037 1039634185 /nfs/dbraw/zinc/63/41/85/1039634185.db2.gz UCAQNWLXNKEOEZ-NSHDSACASA-N 1 0 337.807 3.548 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@H+](CCO)CC1CCCCC1 ZINC000485884329 1039671651 /nfs/dbraw/zinc/67/16/51/1039671651.db2.gz RLBIHMWTBJUYAH-UHFFFAOYSA-N 1 0 326.824 3.623 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177919 1039701329 /nfs/dbraw/zinc/70/13/29/1039701329.db2.gz UFNRFKHHGYNPEY-INIZCTEOSA-N 1 0 342.395 3.602 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298577 1039813487 /nfs/dbraw/zinc/81/34/87/1039813487.db2.gz WZEQYKDAVIBUKV-NEPJUHHUSA-N 1 0 341.839 3.943 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)CCCC(F)(F)F)c1[N+](=O)[O-] ZINC000894028784 1039994192 /nfs/dbraw/zinc/99/41/92/1039994192.db2.gz JHLBJNPGJSLHEY-SECBINFHSA-N 1 0 336.310 3.520 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000573507029 1040137089 /nfs/dbraw/zinc/13/70/89/1040137089.db2.gz YXKOTMADSWXICX-DLBZAZTESA-N 1 0 346.814 3.949 20 5 EHBDRO C[NH+](C)Cc1cccc(NC(=O)C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000429844233 1040166246 /nfs/dbraw/zinc/16/62/46/1040166246.db2.gz XNHKCNFQMAYXSF-UHFFFAOYSA-N 1 0 341.411 3.573 20 5 EHBDRO Cc1cccc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000479466574 1040288247 /nfs/dbraw/zinc/28/82/47/1040288247.db2.gz WAVWFTWULDHAFG-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000573771616 1040377759 /nfs/dbraw/zinc/37/77/59/1040377759.db2.gz YJTROQGJPRLOJB-UHFFFAOYSA-N 1 0 333.432 3.805 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000481163579 1040414340 /nfs/dbraw/zinc/41/43/40/1040414340.db2.gz AFHIHBQLYDFIMG-YLJYHZDGSA-N 1 0 342.439 3.877 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H](C)C1 ZINC000481195101 1040474147 /nfs/dbraw/zinc/47/41/47/1040474147.db2.gz WVWSBKUHLCHVPG-WZRBSPASSA-N 1 0 339.823 3.601 20 5 EHBDRO CC(C)([NH2+]Cc1cccc(-n2cccn2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000151022799 1040501821 /nfs/dbraw/zinc/50/18/21/1040501821.db2.gz LYSDDRSBYMFMJQ-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO CC1(C)CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000512692380 1040551649 /nfs/dbraw/zinc/55/16/49/1040551649.db2.gz DNAHHUUYLQSBBW-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062302 1040581833 /nfs/dbraw/zinc/58/18/33/1040581833.db2.gz SUIZOFDZNNGMAK-NEQJSVFRSA-N 1 0 342.399 3.874 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC2CCC1CC2)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000433062403 1040582320 /nfs/dbraw/zinc/58/23/20/1040582320.db2.gz SUIZOFDZNNGMAK-OCLKLICZSA-N 1 0 342.399 3.874 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1C[C@H](C)CC(C)(C)C1 ZINC000542247172 1040650356 /nfs/dbraw/zinc/65/03/56/1040650356.db2.gz OPSJXTAFLYANIJ-CYBMUJFWSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1c(C)c(F)ccc1[N+](=O)[O-] ZINC000843814064 1041014749 /nfs/dbraw/zinc/01/47/49/1041014749.db2.gz GLCNHWCVYNRYNS-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](CO)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000433231743 1041119418 /nfs/dbraw/zinc/11/94/18/1041119418.db2.gz KAKXFBSMEPXLTO-CVEARBPZSA-N 1 0 332.425 3.702 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC1(C)C ZINC000419314403 1041270001 /nfs/dbraw/zinc/27/00/01/1041270001.db2.gz HYVWIHKXJYFOEK-YPMHNXCESA-N 1 0 339.823 3.601 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000107070916 1041814706 /nfs/dbraw/zinc/81/47/06/1041814706.db2.gz UVIVOMFVYMNLDJ-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO COc1cc(C[N@H+](C)C2CCCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000053778436 1041841108 /nfs/dbraw/zinc/84/11/08/1041841108.db2.gz ZEPCXNOROFWZAZ-UHFFFAOYSA-N 1 0 344.358 3.969 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](CCO)C2)s1 ZINC000093106417 1041873479 /nfs/dbraw/zinc/87/34/79/1041873479.db2.gz IZSLTAUWJUCDKF-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181787617 1042146542 /nfs/dbraw/zinc/14/65/42/1042146542.db2.gz HUUGRIKWGPMQOV-ZOCIIQOWSA-N 1 0 325.412 3.691 20 5 EHBDRO CC[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000111384899 1042264974 /nfs/dbraw/zinc/26/49/74/1042264974.db2.gz QIFCAJDXUXNMIG-INIZCTEOSA-N 1 0 338.791 3.759 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000569137886 1042945200 /nfs/dbraw/zinc/94/52/00/1042945200.db2.gz ILBRXVSRBSEQMT-INIZCTEOSA-N 1 0 325.412 3.853 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278966359 1043098996 /nfs/dbraw/zinc/09/89/96/1043098996.db2.gz BSTAOPNNOCHXCX-GOSISDBHSA-N 1 0 342.443 3.892 20 5 EHBDRO CC[C@H]([NH2+][C@H]1COc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000344017388 1043107171 /nfs/dbraw/zinc/10/71/71/1043107171.db2.gz FCFDHXCRKGXJIM-WBVHZDCISA-N 1 0 330.359 3.778 20 5 EHBDRO Cc1nn(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c2ccc([N+](=O)[O-])cc12 ZINC000764928033 1127553727 /nfs/dbraw/zinc/55/37/27/1127553727.db2.gz DKXQRDAVTFSKGX-KWOWKCNFSA-N 1 0 340.427 3.721 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@@H](C)c2ccsc2)CC1 ZINC000765088725 1127572383 /nfs/dbraw/zinc/57/23/83/1127572383.db2.gz UDLFOIOHSJACJE-AWEZNQCLSA-N 1 0 331.441 3.848 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765352309 1127603333 /nfs/dbraw/zinc/60/33/33/1127603333.db2.gz XASVRHPYSWHUJF-HUUCEWRRSA-N 1 0 331.460 3.978 20 5 EHBDRO COc1ccc2c(NCc3ccc(OC)c([N+](=O)[O-])c3)cc[nH+]c2c1 ZINC000765472708 1127617246 /nfs/dbraw/zinc/61/72/46/1127617246.db2.gz OHGSGLOZFWYXFI-UHFFFAOYSA-N 1 0 339.351 3.772 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000301380008 1127739832 /nfs/dbraw/zinc/73/98/32/1127739832.db2.gz YPXPIHQNKHXWHV-LBPRGKRZSA-N 1 0 343.349 3.536 20 5 EHBDRO COc1cc(NC[C@H](c2ccc(C)o2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301418002 1127742792 /nfs/dbraw/zinc/74/27/92/1127742792.db2.gz RJCSZIRDDYJVKQ-MRXNPFEDSA-N 1 0 345.399 3.754 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000765765539 1128005410 /nfs/dbraw/zinc/00/54/10/1128005410.db2.gz GKRNYIAPJPBSNJ-STQMWFEESA-N 1 0 331.441 3.678 20 5 EHBDRO C[NH+](C)Cc1cc(NCc2csc([N+](=O)[O-])c2)ccc1Cl ZINC000282239228 1128123696 /nfs/dbraw/zinc/12/36/96/1128123696.db2.gz NYUNIRYLWNYOKA-UHFFFAOYSA-N 1 0 325.821 3.983 20 5 EHBDRO COc1cc(NC2CC[NH+](C3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301463810 1128437373 /nfs/dbraw/zinc/43/73/73/1128437373.db2.gz GFCWSXPXAJZMJR-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC2CC[NH+](C3CCCC3)CC2)c1 ZINC000301569325 1128497681 /nfs/dbraw/zinc/49/76/81/1128497681.db2.gz WNLQLRACNQFDSK-UHFFFAOYSA-N 1 0 337.395 3.561 20 5 EHBDRO CC(C)Oc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765847350 1128557637 /nfs/dbraw/zinc/55/76/37/1128557637.db2.gz BCBZRXNGXLWMOS-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765848595 1128559831 /nfs/dbraw/zinc/55/98/31/1128559831.db2.gz ICAUTYRTXMLRHE-MOPGFXCFSA-N 1 0 346.402 3.624 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846229 1128550200 /nfs/dbraw/zinc/55/02/00/1128550200.db2.gz WKNYNNZKOFQCNA-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000554067260 1128608992 /nfs/dbraw/zinc/60/89/92/1128608992.db2.gz PMRPVUISFWLFFT-UONOGXRCSA-N 1 0 348.830 3.983 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C[C@H]1CC=CCC1 ZINC000162163224 1120197918 /nfs/dbraw/zinc/19/79/18/1120197918.db2.gz ZAXYAPNVORMSPV-NSHDSACASA-N 1 0 325.206 3.803 20 5 EHBDRO CC1(C)[C@H](O)C[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000494484485 1120570090 /nfs/dbraw/zinc/57/00/90/1120570090.db2.gz KLXAPQPBVZFBEU-JKSUJKDBSA-N 1 0 332.425 3.572 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC[C@@H](C)CO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496403 1120758229 /nfs/dbraw/zinc/75/82/29/1120758229.db2.gz PQTSZOTVRPDGHM-AUUYWEPGSA-N 1 0 346.427 3.838 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000542497324 1120785329 /nfs/dbraw/zinc/78/53/29/1120785329.db2.gz AICKVBSQJVWZAY-LSDHHAIUSA-N 1 0 332.400 3.795 20 5 EHBDRO CC(C)[NH+](CCN(C)Cc1c(Cl)cccc1[N+](=O)[O-])C(C)C ZINC000494779424 1120801830 /nfs/dbraw/zinc/80/18/30/1120801830.db2.gz LJNDWRBKFRWMLT-UHFFFAOYSA-N 1 0 327.856 3.799 20 5 EHBDRO O=C(NC[C@H]1CC[N@@H+](C2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000171709265 1121480405 /nfs/dbraw/zinc/48/04/05/1121480405.db2.gz LGFPHKNOZCDBRK-OAHLLOKOSA-N 1 0 345.446 3.602 20 5 EHBDRO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H]1C ZINC000122683331 1121522944 /nfs/dbraw/zinc/52/29/44/1121522944.db2.gz ZBHGKOVUIYECET-KGLIPLIRSA-N 1 0 329.400 3.770 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCN(C4CC4)C3)s2)cc1 ZINC000609223437 1121564169 /nfs/dbraw/zinc/56/41/69/1121564169.db2.gz RKTSCAUAYJQFKO-AWEZNQCLSA-N 1 0 343.452 3.650 20 5 EHBDRO C[C@@H]([NH2+]CCc1nnc(-c2ccccc2)o1)c1ccc([N+](=O)[O-])cc1 ZINC000090660094 1121675863 /nfs/dbraw/zinc/67/58/63/1121675863.db2.gz JPZXDQSEYRRNFL-CYBMUJFWSA-N 1 0 338.367 3.538 20 5 EHBDRO CCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000272565511 1121717922 /nfs/dbraw/zinc/71/79/22/1121717922.db2.gz UYUQLWGNSGAPOH-INIZCTEOSA-N 1 0 328.416 3.588 20 5 EHBDRO O=C(CN1CCC(C2CCCCC2)CC1)Nc1ccccc1[N+](=O)[O-] ZINC000917131422 1122527493 /nfs/dbraw/zinc/52/74/93/1122527493.db2.gz OHUVEJBIRNTSKF-UHFFFAOYSA-N 1 0 345.443 3.826 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000917137652 1122531158 /nfs/dbraw/zinc/53/11/58/1122531158.db2.gz XGSJZAZUCRLPCE-UHFFFAOYSA-N 1 0 327.384 3.542 20 5 EHBDRO C[NH+](C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccc(F)cc1 ZINC000301794642 1129084361 /nfs/dbraw/zinc/08/43/61/1129084361.db2.gz PWNPQHPBVMUTAL-HNNXBMFYSA-N 1 0 339.317 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(CC(F)(F)F)CC2)cc1 ZINC000556505147 1123003326 /nfs/dbraw/zinc/00/33/26/1123003326.db2.gz CORZHCSNVHANIL-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2c1cccc2O ZINC000130687042 1123180981 /nfs/dbraw/zinc/18/09/81/1123180981.db2.gz CFCCYPOJOJQQPR-SUMWQHHRSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000255437463 1129107764 /nfs/dbraw/zinc/10/77/64/1129107764.db2.gz PDGVPFBDGGNBAQ-YPLUBFQTSA-N 1 0 329.444 3.558 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H]1CCCc2ccccc21 ZINC000557049272 1123283538 /nfs/dbraw/zinc/28/35/38/1123283538.db2.gz WDVSFJYHZLJNLS-SFHVURJKSA-N 1 0 336.395 3.981 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[NH+](CC)CC ZINC000195339168 1123369345 /nfs/dbraw/zinc/36/93/45/1123369345.db2.gz ZWAJOEVMERENKY-UHFFFAOYSA-N 1 0 345.447 3.574 20 5 EHBDRO O=[N+]([O-])c1cc(CN(CCO)[C@@H]2CCCc3ccccc32)cs1 ZINC000114193016 1129123619 /nfs/dbraw/zinc/12/36/19/1129123619.db2.gz NJSRJWHSLFRISS-MRXNPFEDSA-N 1 0 332.425 3.528 20 5 EHBDRO CC(C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000609392922 1123563997 /nfs/dbraw/zinc/56/39/97/1123563997.db2.gz BEEXVNZBEPTFFE-CSKARUKUSA-N 1 0 339.395 3.615 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000609560415 1123608825 /nfs/dbraw/zinc/60/88/25/1123608825.db2.gz QQLASKFKHVQNQO-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO C[C@@H]1c2c(F)cccc2CCN1CCOc1ccccc1[N+](=O)[O-] ZINC000610004143 1123712295 /nfs/dbraw/zinc/71/22/95/1123712295.db2.gz BDXCKDUTKZCWMP-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([S@@](C)=O)cc1 ZINC000615724345 1123864039 /nfs/dbraw/zinc/86/40/39/1123864039.db2.gz XNSDEQWQBHETKT-FPSGLDNTSA-N 1 0 344.436 3.525 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nn(C)c2ccccc12 ZINC000615727582 1123864735 /nfs/dbraw/zinc/86/47/35/1123864735.db2.gz KFODWHWZJRYBLE-GXDHUFHOSA-N 1 0 336.395 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCc2cnn(C(C)C)c2C1 ZINC000616357539 1123988061 /nfs/dbraw/zinc/98/80/61/1123988061.db2.gz ZPYKIGFYIWANDY-GOEBONIOSA-N 1 0 342.443 3.889 20 5 EHBDRO Cc1c(C[NH2+]Cc2cnc(-c3ccccc3)nc2)cccc1[N+](=O)[O-] ZINC000616483542 1124003791 /nfs/dbraw/zinc/00/37/91/1124003791.db2.gz DDTGUZWLDBKLFF-UHFFFAOYSA-N 1 0 334.379 3.650 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000617491706 1124614476 /nfs/dbraw/zinc/61/44/76/1124614476.db2.gz LQOZOIJHJGAYOZ-MRXNPFEDSA-N 1 0 340.427 3.577 20 5 EHBDRO CCN(CC)C(=O)CCCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000181503875 1124899147 /nfs/dbraw/zinc/89/91/47/1124899147.db2.gz RRYTWYYIPJEURT-UHFFFAOYSA-N 1 0 344.415 3.512 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ncccc2[N+](=O)[O-])CC1 ZINC000301256581 1124959418 /nfs/dbraw/zinc/95/94/18/1124959418.db2.gz AHXUDCURQCHAEW-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]2CCCC[C@H]12 ZINC000182507074 1125321999 /nfs/dbraw/zinc/32/19/99/1125321999.db2.gz ZOMHRVPJMGIDPC-WQVCFCJDSA-N 1 0 342.399 3.655 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000619531728 1125358472 /nfs/dbraw/zinc/35/84/72/1125358472.db2.gz SUSGMARJVBLIML-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H]1c1ccc(O)cc1 ZINC000619531678 1125358514 /nfs/dbraw/zinc/35/85/14/1125358514.db2.gz RGBZNEDSPGCGIO-KRWDZBQOSA-N 1 0 328.368 3.646 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)s1 ZINC000619696384 1125383288 /nfs/dbraw/zinc/38/32/88/1125383288.db2.gz CMKZGEYJDFWUQM-CQSZACIVSA-N 1 0 332.429 3.690 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)Nc2cc([N+](=O)[O-])ccc2CC)CC1 ZINC000555010595 1129208425 /nfs/dbraw/zinc/20/84/25/1129208425.db2.gz BTENPPJAKKRBCY-UHFFFAOYSA-N 1 0 348.447 3.543 20 5 EHBDRO Cn1c2ccc(Nc3ccc([N+](=O)[O-])cn3)cc2nc1C(C)(C)C ZINC000301891189 1129289168 /nfs/dbraw/zinc/28/91/68/1129289168.db2.gz UMSWQSHBNKKMEA-UHFFFAOYSA-N 1 0 325.372 3.918 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC(C)(C)C1 ZINC000543182044 1129316315 /nfs/dbraw/zinc/31/63/15/1129316315.db2.gz NCNACEOJEUHGGI-LBPRGKRZSA-N 1 0 330.388 3.513 20 5 EHBDRO COCCOc1cccc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000080347079 1129348167 /nfs/dbraw/zinc/34/81/67/1129348167.db2.gz VRLRCPWQYIDMHW-UHFFFAOYSA-N 1 0 344.411 3.645 20 5 EHBDRO CCC(CC)(CO)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000116347783 1129353603 /nfs/dbraw/zinc/35/36/03/1129353603.db2.gz IZLSCXZFUGSPRC-UHFFFAOYSA-N 1 0 348.399 3.504 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938967 1129385224 /nfs/dbraw/zinc/38/52/24/1129385224.db2.gz XQZDCIBXUHPQOP-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NCC1CCN(c2cc[nH+]cc2)CC1 ZINC000301953323 1129415021 /nfs/dbraw/zinc/41/50/21/1129415021.db2.gz HZRWRMLABWAJJN-UHFFFAOYSA-N 1 0 326.400 3.627 20 5 EHBDRO Cc1cc(N(C)C2CC[NH+](C(C)C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000301988500 1129471581 /nfs/dbraw/zinc/47/15/81/1129471581.db2.gz DWAFXFFKJCSMCO-UHFFFAOYSA-N 1 0 342.443 3.760 20 5 EHBDRO CC[C@@H](O)CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000124387426 1129602827 /nfs/dbraw/zinc/60/28/27/1129602827.db2.gz XGZBGKBCTJKAQM-OAHLLOKOSA-N 1 0 348.374 3.777 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000125235370 1129672862 /nfs/dbraw/zinc/67/28/62/1129672862.db2.gz QCRDQFUORISOLM-STQMWFEESA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H](NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196824 1129806246 /nfs/dbraw/zinc/80/62/46/1129806246.db2.gz BYSRBXHYQHLBJS-ILXRZTDVSA-N 1 0 341.411 3.511 20 5 EHBDRO CCCC[N@H+](CC)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788039 1129841349 /nfs/dbraw/zinc/84/13/49/1129841349.db2.gz QLEBCFBIOQDKTP-NSHDSACASA-N 1 0 327.812 3.697 20 5 EHBDRO CCCC[N@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000131788236 1129841605 /nfs/dbraw/zinc/84/16/05/1129841605.db2.gz QLEBCFBIOQDKTP-LLVKDONJSA-N 1 0 327.812 3.697 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccccc1 ZINC000029873803 1129904467 /nfs/dbraw/zinc/90/44/67/1129904467.db2.gz HYXYYQFKDDERPU-GOSISDBHSA-N 1 0 336.395 3.858 20 5 EHBDRO O=C(C[NH+](C1CCC1)C1CCC1)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000429165614 1129906041 /nfs/dbraw/zinc/90/60/41/1129906041.db2.gz SODKQOHEUCAUSN-UHFFFAOYSA-N 1 0 337.807 3.594 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000766046224 1129940038 /nfs/dbraw/zinc/94/00/38/1129940038.db2.gz WQGBMMOFDUYDOM-LRDDRELGSA-N 1 0 326.400 3.730 20 5 EHBDRO Cc1ccc(NC(=O)CNC(C)(C)c2ccccc2[N+](=O)[O-])cc1C ZINC000429230107 1130100353 /nfs/dbraw/zinc/10/03/53/1130100353.db2.gz JRUWJLNEPRYXJP-UHFFFAOYSA-N 1 0 341.411 3.675 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](c2nnc(C3CC3)[nH]2)C1 ZINC000245710534 1130297545 /nfs/dbraw/zinc/29/75/45/1130297545.db2.gz FGHSMVRJFPVCSV-IUODEOHRSA-N 1 0 341.415 3.531 20 5 EHBDRO Cc1nc(C(C)(C)[NH2+]CCCOc2ccc([N+](=O)[O-])cc2)sc1C ZINC000173959685 1130326205 /nfs/dbraw/zinc/32/62/05/1130326205.db2.gz WNVDNQNASSIPBQ-UHFFFAOYSA-N 1 0 349.456 3.962 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H]2CCC[C@@H](O)C2)c2ccccc2)c1 ZINC000245953410 1130334522 /nfs/dbraw/zinc/33/45/22/1130334522.db2.gz LMXDYXDCLQPVJV-CWFSZBLJSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2cccc(Cl)c2Cl)cc1 ZINC000731678179 1130832035 /nfs/dbraw/zinc/83/20/35/1130832035.db2.gz HVISOTQSHAQTAG-CQSZACIVSA-N 1 0 341.194 3.725 20 5 EHBDRO C[C@@H]1CO[C@@H](c2ccccc2)[C@H](C)N1Cc1ccccc1[N+](=O)[O-] ZINC000731893303 1130853923 /nfs/dbraw/zinc/85/39/23/1130853923.db2.gz OYQRGHFUBZRXCT-ZRGWGRIASA-N 1 0 326.396 3.945 20 5 EHBDRO CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC001168766493 1131038209 /nfs/dbraw/zinc/03/82/09/1131038209.db2.gz SQGXRLJHXKZWRH-IBGZPJMESA-N 1 0 346.402 3.970 20 5 EHBDRO CC1(C)SC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000282649374 1131131729 /nfs/dbraw/zinc/13/17/29/1131131729.db2.gz HQRGEWWAGZWPJP-CYBMUJFWSA-N 1 0 335.454 3.702 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C[C@H]1CCN1Cc1ccccc1 ZINC000716276188 1131447258 /nfs/dbraw/zinc/44/72/58/1131447258.db2.gz HLOPVCLOQYJZOG-QGZVFWFLSA-N 1 0 345.830 3.612 20 5 EHBDRO Cn1cc([C@@H](O)C[NH2+]Cc2c3ccccc3cc3ccccc32)cn1 ZINC000742376155 1131717500 /nfs/dbraw/zinc/71/75/00/1131717500.db2.gz NMDYIRXTXIHWGY-NRFANRHFSA-N 1 0 331.419 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1ccccc1F)CC2 ZINC001172897119 1131880844 /nfs/dbraw/zinc/88/08/44/1131880844.db2.gz XKXCABZLYBSVQG-KRWDZBQOSA-N 1 0 328.387 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCc3ccccc3C1)CC2 ZINC001172900868 1131883324 /nfs/dbraw/zinc/88/33/24/1131883324.db2.gz GYLGMTNFLYDWOM-VQTJNVASSA-N 1 0 336.435 3.989 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccnc1 ZINC001172901096 1131883365 /nfs/dbraw/zinc/88/33/65/1131883365.db2.gz JJSDFNLWUIGXGD-MJGOQNOKSA-N 1 0 325.412 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCc3ccccc3C1)CC2 ZINC001172900869 1131884252 /nfs/dbraw/zinc/88/42/52/1131884252.db2.gz GYLGMTNFLYDWOM-WOJBJXKFSA-N 1 0 336.435 3.989 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172901899 1131884679 /nfs/dbraw/zinc/88/46/79/1131884679.db2.gz RDVKLZVRCBBFDN-GOSISDBHSA-N 1 0 340.423 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@H+]1C[C@@H]3CC(F)(F)C[C@@H]3C1)CC2 ZINC001172902713 1131885269 /nfs/dbraw/zinc/88/52/69/1131885269.db2.gz BTKULUXRZGJUQM-OWCLPIDISA-N 1 0 336.382 3.819 20 5 EHBDRO CC(C)(O)[C@H]1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172902553 1131885343 /nfs/dbraw/zinc/88/53/43/1131885343.db2.gz ZRXXZVNHHNGGCA-KZNAEPCWSA-N 1 0 346.471 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOC1CCCCC1)CC2 ZINC001172901695 1131885613 /nfs/dbraw/zinc/88/56/13/1131885613.db2.gz JGOOQTBJSZTORU-QGZVFWFLSA-N 1 0 332.444 3.781 20 5 EHBDRO CCC(CC)N1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903496 1131886322 /nfs/dbraw/zinc/88/63/22/1131886322.db2.gz HBRRSSTVUBMJRE-ROUUACIJSA-N 1 0 345.487 3.695 20 5 EHBDRO O=C1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@@H]12 ZINC001172908404 1131887614 /nfs/dbraw/zinc/88/76/14/1131887614.db2.gz MDOITLZGSHBJDY-QRQLOZEOSA-N 1 0 342.439 3.676 20 5 EHBDRO COC[C@@]12CCC[C@@H]1C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172908557 1131888479 /nfs/dbraw/zinc/88/84/79/1131888479.db2.gz OGIIBAHHDYYEDP-HBFSDRIKSA-N 1 0 344.455 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CCCOC3)CC1)CC2 ZINC001172919808 1131903790 /nfs/dbraw/zinc/90/37/90/1131903790.db2.gz HPBGYFMQYUGYBL-SFHVURJKSA-N 1 0 344.455 3.735 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC3(CCOCC3)CC1)CC2 ZINC001172920235 1131905439 /nfs/dbraw/zinc/90/54/39/1131905439.db2.gz JFGGIDRZRWZGHD-SFHVURJKSA-N 1 0 344.455 3.735 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC3(CCOCC3)CC1)CC2 ZINC001172920234 1131905565 /nfs/dbraw/zinc/90/55/65/1131905565.db2.gz JFGGIDRZRWZGHD-GOSISDBHSA-N 1 0 344.455 3.735 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccc(C)s2)c1F ZINC001173174766 1131990838 /nfs/dbraw/zinc/99/08/38/1131990838.db2.gz BESPKVCROYREHV-JTQLQIEISA-N 1 0 338.404 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CC[C@H]3CCC[C@@H]3C2)c1F ZINC001173178275 1131992209 /nfs/dbraw/zinc/99/22/09/1131992209.db2.gz ACFXDYLKKMQTEN-BFHYXJOUSA-N 1 0 336.407 3.796 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1cccnc1 ZINC001173187733 1131993279 /nfs/dbraw/zinc/99/32/79/1131993279.db2.gz GHQUYVQTUKQQAQ-SWLSCSKDSA-N 1 0 347.390 3.809 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccccn1 ZINC001173187677 1131993710 /nfs/dbraw/zinc/99/37/10/1131993710.db2.gz FGBPOJVIOVSWAO-GXTWGEPZSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)Cc2ccccc2)c1F ZINC001173184662 1131994346 /nfs/dbraw/zinc/99/43/46/1131994346.db2.gz NYIBZUKAZWCKTR-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)c1F ZINC001173190221 1131994563 /nfs/dbraw/zinc/99/45/63/1131994563.db2.gz WBPBJANKKMPBSH-SNVBAGLBSA-N 1 0 346.349 3.699 20 5 EHBDRO C[NH2+]Cc1ccc(N[C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])cc1 ZINC001173190471 1131995633 /nfs/dbraw/zinc/99/56/33/1131995633.db2.gz SZDQUTYFOREEFN-LBPRGKRZSA-N 1 0 347.390 3.505 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCO[C@@H](c2ccccc2)C1 ZINC001173227875 1132007776 /nfs/dbraw/zinc/00/77/76/1132007776.db2.gz SFKVVKZDQFDNCA-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC001173232279 1132009702 /nfs/dbraw/zinc/00/97/02/1132009702.db2.gz AGTAKDGXOQJYAH-AUUYWEPGSA-N 1 0 344.386 3.818 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCO)c1cccc(Cl)c1 ZINC001173233258 1132010539 /nfs/dbraw/zinc/01/05/39/1132010539.db2.gz HTQAOEORQKRUSR-SCLBCKFNSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](Cc1ccccc1)CC(C)(C)O ZINC001173233475 1132010585 /nfs/dbraw/zinc/01/05/85/1132010585.db2.gz WWWHLNQGGWCBTB-INIZCTEOSA-N 1 0 342.439 3.799 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)n1C ZINC001173209825 1132013037 /nfs/dbraw/zinc/01/30/37/1132013037.db2.gz GLGNMBYOIYPURU-NSHDSACASA-N 1 0 341.333 3.673 20 5 EHBDRO Cc1cccc2c1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173211934 1132013957 /nfs/dbraw/zinc/01/39/57/1132013957.db2.gz VOCJSBYLDUEVGP-RHSMWYFYSA-N 1 0 326.396 3.948 20 5 EHBDRO COc1cccc(CCC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214487 1132014852 /nfs/dbraw/zinc/01/48/52/1132014852.db2.gz NZAYOSLVPZGOAY-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC001173213775 1132015419 /nfs/dbraw/zinc/01/54/19/1132015419.db2.gz KEYXXHCJYUDARP-OAHLLOKOSA-N 1 0 336.395 3.501 20 5 EHBDRO CCC(CC)(CC)[NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000746478087 1132555999 /nfs/dbraw/zinc/55/59/99/1132555999.db2.gz MUGJFNLQQBGERA-UHFFFAOYSA-N 1 0 327.812 3.745 20 5 EHBDRO CC(C)(C)OC(=O)Nc1cccc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001168961181 1132620228 /nfs/dbraw/zinc/62/02/28/1132620228.db2.gz HPEKCSNGWSTCTF-LSDHHAIUSA-N 1 0 349.431 3.569 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccncc1 ZINC001168958869 1132620250 /nfs/dbraw/zinc/62/02/50/1132620250.db2.gz QNBHUNSISRCSCI-VDZJLULYSA-N 1 0 325.412 3.514 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccccc2N2CCCCCC2)C1 ZINC001168965702 1132621732 /nfs/dbraw/zinc/62/17/32/1132621732.db2.gz CEXAIADAXNVSNU-FUHWJXTLSA-N 1 0 331.460 3.602 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](OCc3ccccc3)CC2)C1 ZINC001169000658 1132628751 /nfs/dbraw/zinc/62/87/51/1132628751.db2.gz YLPXHEQNOYECPN-MKXGPGLRSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(Br)cc2Cl)C1 ZINC001169005422 1132629884 /nfs/dbraw/zinc/62/98/84/1132629884.db2.gz UDTMXBXWMDNCKG-SKDRFNHKSA-N 1 0 347.640 3.638 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001168986682 1132633826 /nfs/dbraw/zinc/63/38/26/1132633826.db2.gz YHODWRZUVLNGSN-BXUZGUMPSA-N 1 0 328.334 3.730 20 5 EHBDRO CCCCCCOC(=O)CCCCC[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168987916 1132634927 /nfs/dbraw/zinc/63/49/27/1132634927.db2.gz LHDLSBGFXBEAND-IRXDYDNUSA-N 1 0 342.480 3.705 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3cc(F)ccc32)C1 ZINC001169042837 1132637909 /nfs/dbraw/zinc/63/79/09/1132637909.db2.gz GIZKSRKSXZLNRF-CZUORRHYSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(Cc3ccc(F)cc3F)CC2)C1 ZINC001169039096 1132638274 /nfs/dbraw/zinc/63/82/74/1132638274.db2.gz NBJRDLMOCQYCNO-RHSMWYFYSA-N 1 0 338.398 3.665 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3c2cccc3F)C1 ZINC001169042041 1132638639 /nfs/dbraw/zinc/63/86/39/1132638639.db2.gz CQNGNDFPYPTFBP-HIFRSBDPSA-N 1 0 345.418 3.865 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([Si](C)(C)C)cc1)c1ccccc1[N+](=O)[O-] ZINC001175898235 1132780400 /nfs/dbraw/zinc/78/04/00/1132780400.db2.gz KSOULAUAVGSEJB-CQSZACIVSA-N 1 0 328.488 3.991 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539511 1132780991 /nfs/dbraw/zinc/78/09/91/1132780991.db2.gz OLJXNAQUIOADKG-CRAIPNDOSA-N 1 0 332.444 3.921 20 5 EHBDRO [NH3+]Cc1ccc2c(n1)N(c1cc3ccccc3c([N+](=O)[O-])c1)CCC2 ZINC001169591357 1132790014 /nfs/dbraw/zinc/79/00/14/1132790014.db2.gz HSMJGECGIGLINJ-UHFFFAOYSA-N 1 0 334.379 3.686 20 5 EHBDRO Nc1ccc2cc3ccc(Nc4ccc5[nH]nnc5c4)cc3[nH+]c2c1 ZINC001176003351 1132817414 /nfs/dbraw/zinc/81/74/14/1132817414.db2.gz AQNYMYBTSRQXHN-UHFFFAOYSA-N 1 0 326.363 3.985 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(OC(C)C)cc1NCC12CC[NH+](CC1)CC2 ZINC001169800551 1132854848 /nfs/dbraw/zinc/85/48/48/1132854848.db2.gz XZIGJIPCUBISMV-UHFFFAOYSA-N 1 0 333.432 3.588 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[NH+]1CCC(C)CC1 ZINC000804351785 1132979188 /nfs/dbraw/zinc/97/91/88/1132979188.db2.gz IEGWMYKMRGJDHR-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2ccccc2OCC2CC2)cc1 ZINC001177683769 1133091160 /nfs/dbraw/zinc/09/11/60/1133091160.db2.gz UIKNJYRJTYFGLL-UHFFFAOYSA-N 1 0 342.395 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOC3CCCC3)o2)cc1 ZINC001177729826 1133093692 /nfs/dbraw/zinc/09/36/92/1133093692.db2.gz YGUVXEIIZLSVDN-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000768542360 1133153952 /nfs/dbraw/zinc/15/39/52/1133153952.db2.gz VOVFQTGBSGTCHM-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO Cc1cc(C)cc(C[N@@H+](C)[C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC001169999462 1133223687 /nfs/dbraw/zinc/22/36/87/1133223687.db2.gz GBLXQPYPHAKDHQ-OAHLLOKOSA-N 1 0 341.411 3.671 20 5 EHBDRO COC[C@@H](CC(C)(C)C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001179034822 1133225308 /nfs/dbraw/zinc/22/53/08/1133225308.db2.gz RBIYFMLAXAOKNA-GFCCVEGCSA-N 1 0 346.374 3.737 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC001179965978 1133314253 /nfs/dbraw/zinc/31/42/53/1133314253.db2.gz DBUUEGNHRZWHQB-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO CC(=O)Nc1ccccc1C[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001180349496 1133359620 /nfs/dbraw/zinc/35/96/20/1133359620.db2.gz MJWIUNCPPLZAJB-UHFFFAOYSA-N 1 0 347.802 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]CCN2CCC3(CCCCC3)CC2)cc1 ZINC001181196433 1133465347 /nfs/dbraw/zinc/46/53/47/1133465347.db2.gz OIVXXOPHFZIYQZ-UHFFFAOYSA-N 1 0 345.487 3.773 20 5 EHBDRO CSC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC001181243406 1133468292 /nfs/dbraw/zinc/46/82/92/1133468292.db2.gz HEELFSMZWFWRED-UHFFFAOYSA-N 1 0 334.363 3.989 20 5 EHBDRO CC[N@@H+]1CCCC[C@H]1C(=O)Nc1cc2cccnc2c2ncccc12 ZINC001181999435 1133560728 /nfs/dbraw/zinc/56/07/28/1133560728.db2.gz YIUBKVUZEZEKDQ-KRWDZBQOSA-N 1 0 334.423 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](O)c1ccccc1Cl)CCC2 ZINC000774256043 1133645538 /nfs/dbraw/zinc/64/55/38/1133645538.db2.gz WGBBGZRFWGNKOD-ROUUACIJSA-N 1 0 346.814 3.949 20 5 EHBDRO COc1ccc([C@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000774407591 1133673107 /nfs/dbraw/zinc/67/31/07/1133673107.db2.gz BCDULDSTTMJCAH-RTBURBONSA-N 1 0 344.411 3.624 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001183136450 1133773740 /nfs/dbraw/zinc/77/37/40/1133773740.db2.gz KZMPHFOKRHVQNC-LSDHHAIUSA-N 1 0 341.411 3.971 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([C@H](C)O)cc1 ZINC000786811094 1133909037 /nfs/dbraw/zinc/90/90/37/1133909037.db2.gz ICWCOTAOROXXSH-LTBFUDJGSA-N 1 0 326.396 3.841 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1COc2ccccc2C1 ZINC000786810181 1133909413 /nfs/dbraw/zinc/90/94/13/1133909413.db2.gz ROONUCCWTJBLDG-KAKTVLCNSA-N 1 0 338.407 3.839 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1ccsc1 ZINC000786815967 1133910494 /nfs/dbraw/zinc/91/04/94/1133910494.db2.gz UQPVFLACUUUXLE-OLXGIWCBSA-N 1 0 332.425 3.557 20 5 EHBDRO Cc1cc(NCCC[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])s1 ZINC001184821546 1133994677 /nfs/dbraw/zinc/99/46/77/1133994677.db2.gz SYUNJHGZIGUJFT-UHFFFAOYSA-N 1 0 331.441 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(O)c2)CC2CC2)cc1F ZINC000788483599 1134130143 /nfs/dbraw/zinc/13/01/43/1134130143.db2.gz UAVMGKUCBIVSCF-UHFFFAOYSA-N 1 0 330.359 3.852 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000788574828 1134147341 /nfs/dbraw/zinc/14/73/41/1134147341.db2.gz BDJCYRWQLJCUBT-ROUUACIJSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(F)cc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788641084 1134154527 /nfs/dbraw/zinc/15/45/27/1134154527.db2.gz VHBDCTGRNGFPFB-JTQLQIEISA-N 1 0 337.782 3.863 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788693992 1134157852 /nfs/dbraw/zinc/15/78/52/1134157852.db2.gz SVWFQPVWEVPMKG-FMTVUPSXSA-N 1 0 347.390 3.743 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccccc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788668907 1134159928 /nfs/dbraw/zinc/15/99/28/1134159928.db2.gz BLNSPNWYYNJWBL-LLVKDONJSA-N 1 0 335.791 3.560 20 5 EHBDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788775625 1134173696 /nfs/dbraw/zinc/17/36/96/1134173696.db2.gz IUZBPMCXAVNRDE-BLLLJJGKSA-N 1 0 327.384 3.660 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC001187081683 1134296625 /nfs/dbraw/zinc/29/66/25/1134296625.db2.gz OTRRHGQOGIIJEC-OAHLLOKOSA-N 1 0 340.427 3.962 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000792355334 1134680372 /nfs/dbraw/zinc/68/03/72/1134680372.db2.gz RIZRZAOKKHZSNG-KBPBESRZSA-N 1 0 346.349 3.539 20 5 EHBDRO CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1C(F)(F)F ZINC000792355340 1134680778 /nfs/dbraw/zinc/68/07/78/1134680778.db2.gz RIZRZAOKKHZSNG-KGLIPLIRSA-N 1 0 346.349 3.539 20 5 EHBDRO CC[C@](C)([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000775386016 1134696842 /nfs/dbraw/zinc/69/68/42/1134696842.db2.gz BULSBCPZARIDEB-IBGZPJMESA-N 1 0 341.411 3.757 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001170295176 1134736630 /nfs/dbraw/zinc/73/66/30/1134736630.db2.gz AGEVQMUBDSKOGW-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@@H](C)n2c(C[NH3+])cc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297872 1134738274 /nfs/dbraw/zinc/73/82/74/1134738274.db2.gz URXBSEGRAOFUDL-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C)c(F)c2)c([N+](=O)[O-])c1 ZINC001170297837 1134738408 /nfs/dbraw/zinc/73/84/08/1134738408.db2.gz UAHLLGFEKDYPTK-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297891 1134738432 /nfs/dbraw/zinc/73/84/32/1134738432.db2.gz VEELMRHKECXYDN-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170304713 1134738690 /nfs/dbraw/zinc/73/86/90/1134738690.db2.gz GDMDZPIDSDDJLY-JEBQAFNWSA-N 1 0 326.396 3.680 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3c2cccc3F)c([N+](=O)[O-])c1 ZINC001170305489 1134739617 /nfs/dbraw/zinc/73/96/17/1134739617.db2.gz LRNPNEDMWAFSER-KPZWWZAWSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2cccc(C)n2)c([N+](=O)[O-])c1 ZINC001170305631 1134739799 /nfs/dbraw/zinc/73/97/99/1134739799.db2.gz OIOACKUJVQXWOL-KBPBESRZSA-N 1 0 329.400 3.589 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ncccc1C ZINC001170309229 1134753141 /nfs/dbraw/zinc/75/31/41/1134753141.db2.gz PNVKGNMETPSSRP-PBHICJAKSA-N 1 0 343.427 3.979 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc(Cl)nc2)c([N+](=O)[O-])c1 ZINC001170352937 1134754440 /nfs/dbraw/zinc/75/44/40/1134754440.db2.gz UXLQYHAPMPFGMH-GFCCVEGCSA-N 1 0 349.818 3.715 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170342613 1134758442 /nfs/dbraw/zinc/75/84/42/1134758442.db2.gz MMCSBLPDLJUDMO-HNNXBMFYSA-N 1 0 328.412 3.975 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCOc2ccccc2)c([N+](=O)[O-])c1 ZINC001170347629 1134759434 /nfs/dbraw/zinc/75/94/34/1134759434.db2.gz SOEYYEWWNAGYMY-HNNXBMFYSA-N 1 0 344.411 3.545 20 5 EHBDRO CN(CC[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC001191682329 1134899567 /nfs/dbraw/zinc/89/95/67/1134899567.db2.gz PQAPSIRHYHCXDL-UHFFFAOYSA-N 1 0 325.412 3.696 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2cc(F)cc(F)c2[N+](=O)[O-])CC1(C)C ZINC001170451365 1135072052 /nfs/dbraw/zinc/07/20/52/1135072052.db2.gz KLZJGAVWQLGPLC-UHFFFAOYSA-N 1 0 327.375 3.936 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H]2CCC(C)(C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001193660450 1135168450 /nfs/dbraw/zinc/16/84/50/1135168450.db2.gz DJWGTQLVNJAUCD-HIFRSBDPSA-N 1 0 336.432 3.787 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1cccs1 ZINC000805840168 1135333840 /nfs/dbraw/zinc/33/38/40/1135333840.db2.gz MMTQTRMJJPTKFD-GOEBONIOSA-N 1 0 332.425 3.773 20 5 EHBDRO CCC[NH2+]Cc1cc(OC)c(OCc2ccccc2)cc1[N+](=O)[O-] ZINC000101588381 1135356464 /nfs/dbraw/zinc/35/64/64/1135356464.db2.gz QTZXYBLCEONBMJ-UHFFFAOYSA-N 1 0 330.384 3.682 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1ccc(F)cc1)[NH+](C)C ZINC000807928795 1135591633 /nfs/dbraw/zinc/59/16/33/1135591633.db2.gz IIBHSIIJCNJMNW-SFHVURJKSA-N 1 0 345.374 3.651 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnn(C[N@@H+]3CCC[C@@H](C4CC4)C3)c2)c1 ZINC000808230212 1135632699 /nfs/dbraw/zinc/63/26/99/1135632699.db2.gz GWRPIHXARIERKT-MRXNPFEDSA-N 1 0 326.400 3.538 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@H](c3c(F)cccc3F)C2)c1 ZINC001197639454 1135722184 /nfs/dbraw/zinc/72/21/84/1135722184.db2.gz QAIKAGYXHPYBHC-CYBMUJFWSA-N 1 0 348.349 3.741 20 5 EHBDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000808761690 1135729202 /nfs/dbraw/zinc/72/92/02/1135729202.db2.gz QNAMVDLEQMFLHH-RTBURBONSA-N 1 0 344.411 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C[C@H]3CCOC3)C2)cc1Cl ZINC000809758410 1135887854 /nfs/dbraw/zinc/88/78/54/1135887854.db2.gz MFVUIQLNSTXQAX-UKRRQHHQSA-N 1 0 338.835 3.887 20 5 EHBDRO Cc1cc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc(Cl)n1 ZINC000809792383 1135893056 /nfs/dbraw/zinc/89/30/56/1135893056.db2.gz UACVYPKFZLGEGF-UHFFFAOYSA-N 1 0 344.802 3.765 20 5 EHBDRO C[C@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000809975083 1135908141 /nfs/dbraw/zinc/90/81/41/1135908141.db2.gz WBLBBOCRVJDJNN-CABCVRRESA-N 1 0 345.226 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]4OCC[C@H]43)o2)cc1 ZINC001200971404 1135969786 /nfs/dbraw/zinc/96/97/86/1135969786.db2.gz LIFCJTROTLJJNW-SCTDSRPQSA-N 1 0 342.395 3.902 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000776173129 1136020896 /nfs/dbraw/zinc/02/08/96/1136020896.db2.gz ZGNNRSXZXZQAAP-SJORKVTESA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCOC(F)(F)F ZINC000811493872 1136093909 /nfs/dbraw/zinc/09/39/09/1136093909.db2.gz LKPAZGMVPUSHJS-UHFFFAOYSA-N 1 0 333.093 3.528 20 5 EHBDRO CC(C)[C@@H](C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776274507 1136129725 /nfs/dbraw/zinc/12/97/25/1136129725.db2.gz DMQNEWCOWRLMOS-RTBURBONSA-N 1 0 328.412 3.658 20 5 EHBDRO Cc1ccc([C@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278195 1136133859 /nfs/dbraw/zinc/13/38/59/1136133859.db2.gz SNIKGPBPMFXYHI-RTBURBONSA-N 1 0 326.396 3.774 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@@H](O)c1ccc(C)cc1 ZINC000850468338 1136265266 /nfs/dbraw/zinc/26/52/66/1136265266.db2.gz BOMPPMDNXVNXJC-IQUTYRLHSA-N 1 0 344.411 3.685 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@H](O)c1ccc(C)cc1 ZINC000850468339 1136265306 /nfs/dbraw/zinc/26/53/06/1136265306.db2.gz BOMPPMDNXVNXJC-KSMMKXTCSA-N 1 0 344.411 3.685 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850530503 1136280086 /nfs/dbraw/zinc/28/00/86/1136280086.db2.gz ZFAWPLCUODHMNX-XZOAIXRZSA-N 1 0 342.395 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCC[C@H]4C[C@H]43)CC2)cc1 ZINC000850532999 1136280545 /nfs/dbraw/zinc/28/05/45/1136280545.db2.gz ZKWODDKAYCHRTM-YZVOILCLSA-N 1 0 329.444 3.589 20 5 EHBDRO COc1cccc(C2([NH2+][C@@H](C)c3ccc(N)c([N+](=O)[O-])c3)CCC2)c1 ZINC000850567094 1136287360 /nfs/dbraw/zinc/28/73/60/1136287360.db2.gz XNNKAQRXIPEWRO-ZDUSSCGKSA-N 1 0 341.411 3.916 20 5 EHBDRO CC[NH+](CC)CC(C)(C)COC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000813151495 1136295614 /nfs/dbraw/zinc/29/56/14/1136295614.db2.gz MIRYOXPXMZPOSS-CQSZACIVSA-N 1 0 336.432 3.610 20 5 EHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)[C@@H](O)c1ccccc1 ZINC000852066243 1136430746 /nfs/dbraw/zinc/43/07/46/1136430746.db2.gz MXBDBMKSLIXGSA-FZKQIMNGSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[C@H]1c2ccccc2CC[N@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582931 1136442330 /nfs/dbraw/zinc/44/23/30/1136442330.db2.gz DHHYJAJJTFQEHK-RBUKOAKNSA-N 1 0 326.396 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@H]2Cc2ccccc2)cc1 ZINC000776581260 1136444683 /nfs/dbraw/zinc/44/46/83/1136444683.db2.gz GEQAPSOUFLUXIZ-PMACEKPBSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000776593712 1136454419 /nfs/dbraw/zinc/45/44/19/1136454419.db2.gz WPQSEXMAZMXUNJ-RTBURBONSA-N 1 0 344.386 3.898 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597662 1136459387 /nfs/dbraw/zinc/45/93/87/1136459387.db2.gz JRQSRFKYPXMKRF-VLXJIEOASA-N 1 0 344.386 3.775 20 5 EHBDRO CCc1ccc(C(C)(C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776604298 1136466275 /nfs/dbraw/zinc/46/62/75/1136466275.db2.gz AYNYXGLDBBPXAW-GOSISDBHSA-N 1 0 328.412 3.716 20 5 EHBDRO CC(C)([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000776605855 1136472709 /nfs/dbraw/zinc/47/27/09/1136472709.db2.gz PPJKIHZBIDQHDV-INIZCTEOSA-N 1 0 334.803 3.807 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000814641931 1136488527 /nfs/dbraw/zinc/48/85/27/1136488527.db2.gz MGISQZGIWNSWHZ-OAHLLOKOSA-N 1 0 341.367 3.883 20 5 EHBDRO Cc1cccc2c1CCC[C@@H]2[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000853126136 1136512233 /nfs/dbraw/zinc/51/22/33/1136512233.db2.gz BXHDUDWFAPKGGD-RBUKOAKNSA-N 1 0 326.396 3.604 20 5 EHBDRO CC1CC[NH+](CCCNc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000111195205 1136520262 /nfs/dbraw/zinc/52/02/62/1136520262.db2.gz MMMHZTSUXSLEOB-UHFFFAOYSA-N 1 0 334.445 3.738 20 5 EHBDRO CSc1ccc([C@@H](CNc2cc(N)ccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000814959665 1136532071 /nfs/dbraw/zinc/53/20/71/1136532071.db2.gz JUAASLNLRSXMQK-QGZVFWFLSA-N 1 0 346.456 3.614 20 5 EHBDRO CN(c1ccc(C(F)F)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000853617590 1136549730 /nfs/dbraw/zinc/54/97/30/1136549730.db2.gz GMFDKFMVYGMSMW-FUNVUKJBSA-N 1 0 325.359 3.594 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000853746951 1136560330 /nfs/dbraw/zinc/56/03/30/1136560330.db2.gz MSOIGERZHJOVEY-NSHDSACASA-N 1 0 334.445 3.737 20 5 EHBDRO CCOC(=O)[C@H](CC(C)(C)F)Nc1ccccc1C[N+](C)(C)CC ZINC001170791144 1136608178 /nfs/dbraw/zinc/60/81/78/1136608178.db2.gz KXKBZQUPXUSALN-KRWDZBQOSA-N 1 0 339.475 3.765 20 5 EHBDRO Cc1ccc(O[C@@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815583515 1136614243 /nfs/dbraw/zinc/61/42/43/1136614243.db2.gz HWEAKEUAUDPGPF-KBPBESRZSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@H]1CCC[C@@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660469 1136746026 /nfs/dbraw/zinc/74/60/26/1136746026.db2.gz FURJEYKQAJZKCY-LKFCYVNXSA-N 1 0 333.215 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@H]1CC12CCSCC2 ZINC000817411223 1136805752 /nfs/dbraw/zinc/80/57/52/1136805752.db2.gz PSHVEWHFEAAXJD-GFCCVEGCSA-N 1 0 326.849 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H]2CC23CCSCC3)c1 ZINC000817411818 1136805971 /nfs/dbraw/zinc/80/59/71/1136805971.db2.gz WCVMYEASLZWIHV-LBPRGKRZSA-N 1 0 326.849 3.871 20 5 EHBDRO CC(C)c1ccc([C@H](N)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951847 1136851172 /nfs/dbraw/zinc/85/11/72/1136851172.db2.gz BCKFXLQUZIRPPA-SCLBCKFNSA-N 1 0 342.443 3.651 20 5 EHBDRO [NH3+][C@@H](CCc1nc(-c2ccc([N+](=O)[O-])cc2)no1)CC1CCCCC1 ZINC000818380594 1136876736 /nfs/dbraw/zinc/87/67/36/1136876736.db2.gz JDHPDMZVALFPNF-HNNXBMFYSA-N 1 0 344.415 3.875 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819015762 1136903210 /nfs/dbraw/zinc/90/32/10/1136903210.db2.gz PEWPSEUISIJEAZ-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1cccc([C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000858363680 1136961922 /nfs/dbraw/zinc/96/19/22/1136961922.db2.gz YGTGFWNQPCFANW-OALUTQOASA-N 1 0 328.412 3.924 20 5 EHBDRO CC(=O)N(C)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000858494775 1136973196 /nfs/dbraw/zinc/97/31/96/1136973196.db2.gz NLVSQEPOWHJLBB-CQSZACIVSA-N 1 0 341.411 3.737 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H]1CC[C@@H](CO)CC1 ZINC000824007432 1137120570 /nfs/dbraw/zinc/12/05/70/1137120570.db2.gz UXPOXWWTTBITSU-WVSHTKLVSA-N 1 0 333.215 3.542 20 5 EHBDRO CC(C)[N@@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000173480079 1137160074 /nfs/dbraw/zinc/16/00/74/1137160074.db2.gz RXLGMFDNNKOHMP-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H](CSc1ccccc1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362092 1137215333 /nfs/dbraw/zinc/21/53/33/1137215333.db2.gz XSEZFLYHLCEVTM-KDOFPFPSSA-N 1 0 346.452 3.741 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@]3(CC3(F)F)C2)ccc1[N+](=O)[O-] ZINC000844439014 1137223032 /nfs/dbraw/zinc/22/30/32/1137223032.db2.gz HKAZSTVOMRKYCA-HNNXBMFYSA-N 1 0 326.343 3.615 20 5 EHBDRO CCC1([NH+](C)C)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000866061442 1137327532 /nfs/dbraw/zinc/32/75/32/1137327532.db2.gz SAIHYEMFVIPRNI-UHFFFAOYSA-N 1 0 327.375 3.843 20 5 EHBDRO CCN1C[C@@H](C[NH2+]Cc2c3ccccc3cc3ccccc32)CC1=O ZINC000846092891 1137331846 /nfs/dbraw/zinc/33/18/46/1137331846.db2.gz JWOGSXYFJJVGEI-MRXNPFEDSA-N 1 0 332.447 3.951 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000339074433 1137346451 /nfs/dbraw/zinc/34/64/51/1137346451.db2.gz LHMHEYGRKJCKHR-LPHOPBHVSA-N 1 0 340.423 3.895 20 5 EHBDRO Cc1csc([C@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866336678 1137346985 /nfs/dbraw/zinc/34/69/85/1137346985.db2.gz GMDWAQRNAJYBBW-MNOVXSKESA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CC12CCSCC2 ZINC000866375598 1137350435 /nfs/dbraw/zinc/35/04/35/1137350435.db2.gz DGWGVHVNFKQPKE-GXTWGEPZSA-N 1 0 338.448 3.788 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@H]1c1ccccc1 ZINC000866400639 1137351979 /nfs/dbraw/zinc/35/19/79/1137351979.db2.gz FWCRADPDZVGZCI-XVSDVWIESA-N 1 0 344.386 3.785 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1ccnc(F)c1 ZINC000866472746 1137357564 /nfs/dbraw/zinc/35/75/64/1137357564.db2.gz DTWFQHLXRFPGKR-ZBFHGGJFSA-N 1 0 329.375 3.630 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@](C)(O)c1ccc(F)cc1 ZINC000773120153 1137466895 /nfs/dbraw/zinc/46/68/95/1137466895.db2.gz RBNLHBDNJBBYQM-SCLBCKFNSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@H]1CN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC[N@@H+](C2CCC2)C1 ZINC000795119018 1137491705 /nfs/dbraw/zinc/49/17/05/1137491705.db2.gz BAROTQSWAZVRAH-ZDUSSCGKSA-N 1 0 337.851 3.554 20 5 EHBDRO CC(C)(C)OC(=O)CCC1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC001171862311 1137516400 /nfs/dbraw/zinc/51/64/00/1137516400.db2.gz JZSBWSWZMWWSOJ-UHFFFAOYSA-N 1 0 348.443 3.929 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1nc(C)cs1 ZINC000872021185 1137565162 /nfs/dbraw/zinc/56/51/62/1137565162.db2.gz OEXIWGNSANVGEK-LLVKDONJSA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@@H](N[C@H](C[NH+](C)C)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070711 1137569606 /nfs/dbraw/zinc/56/96/06/1137569606.db2.gz HHMBKSZYOUBVRQ-MLGOLLRUSA-N 1 0 349.381 3.827 20 5 EHBDRO C[C@H](N[C@@H](C[NH+](C)C)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872070710 1137569662 /nfs/dbraw/zinc/56/96/62/1137569662.db2.gz HHMBKSZYOUBVRQ-LRDDRELGSA-N 1 0 349.381 3.827 20 5 EHBDRO CCC(CC)(C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000872226626 1137576040 /nfs/dbraw/zinc/57/60/40/1137576040.db2.gz QGVYPNAWDNJOSG-ZDUSSCGKSA-N 1 0 334.338 3.587 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000873039072 1137588665 /nfs/dbraw/zinc/58/86/65/1137588665.db2.gz WVENAWKXXWUOOR-UHFFFAOYSA-N 1 0 342.395 3.663 20 5 EHBDRO CCOc1cc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)ccc1OC ZINC000873050773 1137588935 /nfs/dbraw/zinc/58/89/35/1137588935.db2.gz SBXPXYIUKXMTQY-UHFFFAOYSA-N 1 0 344.411 3.909 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000873112159 1137590281 /nfs/dbraw/zinc/59/02/81/1137590281.db2.gz PCXZVOGSSVMLDO-INIZCTEOSA-N 1 0 330.359 3.964 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746338 1137608313 /nfs/dbraw/zinc/60/83/13/1137608313.db2.gz HJDYQJLKPRJTHQ-GTNSWQLSSA-N 1 0 336.338 3.566 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1cccc(C[NH+](C)C)c1 ZINC000873990780 1137608934 /nfs/dbraw/zinc/60/89/34/1137608934.db2.gz DHILXIQIHFWONL-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]CCc3csc4ccccc34)C2)c1 ZINC000876982801 1137666813 /nfs/dbraw/zinc/66/68/13/1137666813.db2.gz HDOQDXYXCMKNDD-UHFFFAOYSA-N 1 0 342.424 3.542 20 5 EHBDRO CC(C)c1ccc2c(c1)[C@@H]([NH2+]C1CC(n3cc([N+](=O)[O-])cn3)C1)CC2 ZINC000877438579 1137676194 /nfs/dbraw/zinc/67/61/94/1137676194.db2.gz SRTMZSOMIDBNIM-RJYAGPCLSA-N 1 0 340.427 3.895 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CC[C@@H](c4cccc(F)c4)C3)C2)c1 ZINC000877491349 1137678398 /nfs/dbraw/zinc/67/83/98/1137678398.db2.gz JENPXBAWEMCIFC-PMRDFSHISA-N 1 0 344.390 3.560 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(C)ccc1C ZINC000877658146 1137684569 /nfs/dbraw/zinc/68/45/69/1137684569.db2.gz VBRJRMCOBKSKBV-JTTJXQCZSA-N 1 0 328.416 3.853 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)s1 ZINC000126716858 1137688889 /nfs/dbraw/zinc/68/88/89/1137688889.db2.gz QFRRFGZFIZSMRV-CABZTGNLSA-N 1 0 326.805 3.694 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1C[C@H]2CCC[C@@H]2O1 ZINC000877804828 1137690390 /nfs/dbraw/zinc/69/03/90/1137690390.db2.gz FAPDISZVZOJNPL-DGFSRKRXSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@@H]1[C@@H](C)CC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878165123 1137705328 /nfs/dbraw/zinc/70/53/28/1137705328.db2.gz RPXACHOXKHZGFK-VHSXEESVSA-N 1 0 336.779 3.529 20 5 EHBDRO C[C@@H]1CC[C@@]2(CC[N@H+](Cc3nnc(-c4ccccc4[N+](=O)[O-])o3)C2)C1 ZINC000878399659 1137714308 /nfs/dbraw/zinc/71/43/08/1137714308.db2.gz PNGCDXXNPJEVBO-FZKQIMNGSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497110 1137717936 /nfs/dbraw/zinc/71/79/36/1137717936.db2.gz QTVGNSHLRMFMIN-AGIUHOORSA-N 1 0 330.388 3.511 20 5 EHBDRO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC(C)(C)C1 ZINC000878541795 1137719602 /nfs/dbraw/zinc/71/96/02/1137719602.db2.gz UATMRUCJMXKSDR-LBPRGKRZSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+]C2(C3CCC3)CC2)o1 ZINC000878808105 1137728657 /nfs/dbraw/zinc/72/86/57/1137728657.db2.gz YHIRUZBUMDNZLC-UHFFFAOYSA-N 1 0 348.790 3.721 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccc(F)cc1)C1CCOCC1 ZINC000883200700 1137848313 /nfs/dbraw/zinc/84/83/13/1137848313.db2.gz PHXYLWYPVKNNGG-LJQANCHMSA-N 1 0 344.386 3.991 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H]1CSCCS1)c1cccc([N+](=O)[O-])c1 ZINC000132569757 1137867455 /nfs/dbraw/zinc/86/74/55/1137867455.db2.gz LCAVRYHJNIQMPG-LSDHHAIUSA-N 1 0 326.487 3.874 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348312990 1137938028 /nfs/dbraw/zinc/93/80/28/1137938028.db2.gz FJZPRGCJDKJXFU-NSHDSACASA-N 1 0 333.413 3.508 20 5 EHBDRO CC(C)(C)c1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000332434373 1137943858 /nfs/dbraw/zinc/94/38/58/1137943858.db2.gz GNERPYPJVQEDDK-UHFFFAOYSA-N 1 0 342.443 3.926 20 5 EHBDRO CO[C@@H](c1ccccc1Cl)[C@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886116918 1138048498 /nfs/dbraw/zinc/04/84/98/1138048498.db2.gz VLEWLHJSIRRXRH-XHDPSFHLSA-N 1 0 335.791 3.509 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](c2ncccn2)C1 ZINC000886685949 1138115127 /nfs/dbraw/zinc/11/51/27/1138115127.db2.gz HGJWUBWRTKQUAU-HUUCEWRRSA-N 1 0 326.400 3.634 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@H](C)[C@H]3C)O2)cccc1[N+](=O)[O-] ZINC000886772360 1138137598 /nfs/dbraw/zinc/13/75/98/1138137598.db2.gz XGUVRZFXZGMNAX-NTODXPRQSA-N 1 0 348.443 3.526 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[NH2+]C2(C3CC3)CCC2)o1 ZINC000887148610 1138223209 /nfs/dbraw/zinc/22/32/09/1138223209.db2.gz MFFCWCNMJQTPKN-UHFFFAOYSA-N 1 0 348.790 3.721 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000092564382 1138229753 /nfs/dbraw/zinc/22/97/53/1138229753.db2.gz IHGXENPVUJVKQU-UHFFFAOYSA-N 1 0 334.416 3.585 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000122375550 1138257616 /nfs/dbraw/zinc/25/76/16/1138257616.db2.gz IEOWELXYNVHARK-IBGZPJMESA-N 1 0 342.395 3.853 20 5 EHBDRO CC(C)(C)OC(=O)C1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000124081698 1138279037 /nfs/dbraw/zinc/27/90/37/1138279037.db2.gz LEXWMSNAJMERNA-UHFFFAOYSA-N 1 0 334.416 3.585 20 5 EHBDRO Cc1ccc(C)n1C1CC[NH+](CCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000337640629 1138630433 /nfs/dbraw/zinc/63/04/33/1138630433.db2.gz FLRZYOGXECEQHA-UHFFFAOYSA-N 1 0 343.427 3.729 20 5 EHBDRO CC(C)[N@H+](C)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000264977536 1138692836 /nfs/dbraw/zinc/69/28/36/1138692836.db2.gz SMZUGJAOFYTFFZ-UHFFFAOYSA-N 1 0 348.472 3.538 20 5 EHBDRO COc1ccccc1N1CC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000151857116 1139061416 /nfs/dbraw/zinc/06/14/16/1139061416.db2.gz CLBMFHUTJQAXRK-GOEBONIOSA-N 1 0 341.411 3.533 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000178648887 1139708928 /nfs/dbraw/zinc/70/89/28/1139708928.db2.gz AZAJWVQDCZHFTD-OAHLLOKOSA-N 1 0 325.412 3.914 20 5 EHBDRO CCCNC(=O)c1cccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178646075 1139708973 /nfs/dbraw/zinc/70/89/73/1139708973.db2.gz PUSUBZDWNACLTN-CQSZACIVSA-N 1 0 341.411 3.585 20 5 EHBDRO CCOc1ccc([C@H](C)NC2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403462 1139831985 /nfs/dbraw/zinc/83/19/85/1139831985.db2.gz WLVXRACUKDAIRG-AWEZNQCLSA-N 1 0 335.448 3.517 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000181370472 1139902889 /nfs/dbraw/zinc/90/28/89/1139902889.db2.gz SBPOWWZMRIOMHJ-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000181810927 1139933142 /nfs/dbraw/zinc/93/31/42/1139933142.db2.gz KCWCRHZLQRZONC-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)OCCCO1 ZINC000192252467 1140514858 /nfs/dbraw/zinc/51/48/58/1140514858.db2.gz IEKGOWZYPNJHIL-UHFFFAOYSA-N 1 0 348.424 3.566 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000266142195 1140646994 /nfs/dbraw/zinc/64/69/94/1140646994.db2.gz HKKXRLHCJUEFLC-OLZOCXBDSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H](CCO)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268950006 1141032695 /nfs/dbraw/zinc/03/26/95/1141032695.db2.gz RUWBQRJGTLUGKD-CHWSQXEVSA-N 1 0 334.441 3.992 20 5 EHBDRO CC(C)C[C@@H](CCO)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268998698 1141042657 /nfs/dbraw/zinc/04/26/57/1141042657.db2.gz UIVKENVXZYNXNC-CRAIPNDOSA-N 1 0 334.460 3.550 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000270649533 1141250610 /nfs/dbraw/zinc/25/06/10/1141250610.db2.gz LRAQIMPFZIQLSA-ZFWWWQNUSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000271454716 1141372032 /nfs/dbraw/zinc/37/20/32/1141372032.db2.gz GPHBILIPEDXGEK-VQNPYFGKSA-N 1 0 332.425 3.744 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CCCc1nccs1 ZINC000271480089 1141377203 /nfs/dbraw/zinc/37/72/03/1141377203.db2.gz KEZLKEXDVRXDME-ZBFHGGJFSA-N 1 0 345.468 3.985 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1cccc(CO)c1 ZINC000272700827 1141421735 /nfs/dbraw/zinc/42/17/35/1141421735.db2.gz YNGRMLQIFWNSBG-GFCCVEGCSA-N 1 0 334.803 3.634 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](CCCC3CCOCC3)CC2)cc1 ZINC000274233118 1141488483 /nfs/dbraw/zinc/48/84/83/1141488483.db2.gz TUPZKZLQEBIQDB-UHFFFAOYSA-N 1 0 348.443 3.645 20 5 EHBDRO CC(C)OC(=O)C[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275498 1141491884 /nfs/dbraw/zinc/49/18/84/1141491884.db2.gz BYVYDFNBGKKQDA-GJZGRUSLSA-N 1 0 334.416 3.710 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000348933317 1141611518 /nfs/dbraw/zinc/61/15/18/1141611518.db2.gz IJHKYDYNXBETFK-QFSNBGPKSA-N 1 0 339.395 3.766 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOC[C@H](C2CCC2)C1 ZINC000430160273 1014484539 /nfs/dbraw/zinc/48/45/39/1014484539.db2.gz FWIYKJFUIJRHTA-SPQRHKFCSA-N 1 0 330.428 3.747 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](c1cccc(F)c1)N(C)C ZINC000449062936 1032107545 /nfs/dbraw/zinc/10/75/45/1032107545.db2.gz KZMMOTIOEWSUTI-IFXJQAMLSA-N 1 0 345.418 3.557 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430219872 1015089589 /nfs/dbraw/zinc/08/95/89/1015089589.db2.gz ODSXFXQTKIQRGJ-GOSISDBHSA-N 1 0 342.395 3.949 20 5 EHBDRO COc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1OC ZINC000127056867 1015209556 /nfs/dbraw/zinc/20/95/56/1015209556.db2.gz GNSOKZARYOQXBD-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000024252961 1015274791 /nfs/dbraw/zinc/27/47/91/1015274791.db2.gz ZXRCCZZGFLADMJ-AWEZNQCLSA-N 1 0 347.802 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cc1 ZINC000339905526 1015873755 /nfs/dbraw/zinc/87/37/55/1015873755.db2.gz MGMABUBANYZJQR-QGZVFWFLSA-N 1 0 336.395 3.609 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1C ZINC000154972034 1016013364 /nfs/dbraw/zinc/01/33/64/1016013364.db2.gz GRFRHOMCTHTTQK-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)c1ccccc1 ZINC000181374285 1016389991 /nfs/dbraw/zinc/38/99/91/1016389991.db2.gz MRHDUELFYRGOPN-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO O=[N+]([O-])c1cccc(CN(Cc2cccs2)C[C@H]2CCCO2)c1 ZINC000066696107 1016412929 /nfs/dbraw/zinc/41/29/29/1016412929.db2.gz FSVJFQOYXBYQQM-MRXNPFEDSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H]1COc2ccccc21 ZINC000120878056 1016720480 /nfs/dbraw/zinc/72/04/80/1016720480.db2.gz LARZKMXODTXFAZ-FZMZJTMJSA-N 1 0 332.787 3.903 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279948 1016849066 /nfs/dbraw/zinc/84/90/66/1016849066.db2.gz RQJIRDKWDPAXNH-IEBWSBKVSA-N 1 0 325.412 3.520 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC2(c3ccccc3)CC2)n1 ZINC000472641065 1016920384 /nfs/dbraw/zinc/92/03/84/1016920384.db2.gz ZPLJKMCXSMCHDY-IAGOWNOFSA-N 1 0 340.427 3.596 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000449094279 1032201428 /nfs/dbraw/zinc/20/14/28/1032201428.db2.gz YTIIOEPWTHGLDB-KUHUBIRLSA-N 1 0 345.418 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)cc1F ZINC000278746246 1032290576 /nfs/dbraw/zinc/29/05/76/1032290576.db2.gz WTGCZHRXNOOWDM-QAPCUYQASA-N 1 0 344.386 3.991 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(c1)COC2 ZINC000536849272 1032344679 /nfs/dbraw/zinc/34/46/79/1032344679.db2.gz AWMSPRWLFUTLBV-CQSZACIVSA-N 1 0 326.396 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CC4(C3)CCCOC4)s2)cc1 ZINC000459615898 1032352903 /nfs/dbraw/zinc/35/29/03/1032352903.db2.gz ZQOJRMMYHDPVNJ-UHFFFAOYSA-N 1 0 344.436 3.936 20 5 EHBDRO Cc1cccc(C)c1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000544893824 1017260067 /nfs/dbraw/zinc/26/00/67/1017260067.db2.gz MUWINFAPGHEBSM-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](CC(C)(C)O)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449449429 1032566963 /nfs/dbraw/zinc/56/69/63/1032566963.db2.gz LLKIDQAODJZKJI-GFCCVEGCSA-N 1 0 334.441 3.962 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000449453421 1032569989 /nfs/dbraw/zinc/56/99/89/1032569989.db2.gz MVZABNRCWVNIBJ-YDMZIXHMSA-N 1 0 330.428 3.624 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H](C)CC(C)(C)O)o2)c([N+](=O)[O-])c1 ZINC000449452286 1032570091 /nfs/dbraw/zinc/57/00/91/1032570091.db2.gz UDOCRZVCPMXTDT-LBPRGKRZSA-N 1 0 348.399 3.503 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H](CO)c1ccccc1 ZINC000449460829 1032577229 /nfs/dbraw/zinc/57/72/29/1032577229.db2.gz ZYNGXDJNWKVRJB-ILCZHQDMSA-N 1 0 326.396 3.664 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000537290974 1032596041 /nfs/dbraw/zinc/59/60/41/1032596041.db2.gz UFNGJJRKNSDGKA-LJQANCHMSA-N 1 0 339.395 3.583 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C(C)(C)C(=O)NCC(C)(C)C)cc1[N+](=O)[O-] ZINC000537322328 1032629594 /nfs/dbraw/zinc/62/95/94/1032629594.db2.gz XRGHMQMDLADCPA-UHFFFAOYSA-N 1 0 349.475 3.749 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2n2cccn2)cc1[N+](=O)[O-] ZINC000247214573 1017132851 /nfs/dbraw/zinc/13/28/51/1017132851.db2.gz WALVXTPQOCDSRE-USXIJHARSA-N 1 0 328.416 3.934 20 5 EHBDRO CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]CC1 ZINC000414940888 1017338613 /nfs/dbraw/zinc/33/86/13/1017338613.db2.gz KVXAHNXJSKHVNI-UHFFFAOYSA-N 1 0 331.441 3.555 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC[N@@H+](C2CCCC2)CC1 ZINC000593461532 1032717864 /nfs/dbraw/zinc/71/78/64/1032717864.db2.gz LPBQQMKBSLORKK-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CCC[C@H](Cc1ccccc1)[N@H+](CCC)Cc1cn(C)nc1[N+](=O)[O-] ZINC001167306697 1017728492 /nfs/dbraw/zinc/72/84/92/1017728492.db2.gz IGQYRKRDMGHIGH-GOSISDBHSA-N 1 0 344.459 3.952 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH2+]Cc2c([N+](=O)[O-])ncn2C)C(C)C)cc1 ZINC000341020571 1017781832 /nfs/dbraw/zinc/78/18/32/1017781832.db2.gz UGFIHWIMVJPHKG-KRWDZBQOSA-N 1 0 330.432 3.939 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610345617 1018360115 /nfs/dbraw/zinc/36/01/15/1018360115.db2.gz ICCAWGSJZNPUML-UKRRQHHQSA-N 1 0 332.400 3.742 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C1 ZINC000579380926 1018456146 /nfs/dbraw/zinc/45/61/46/1018456146.db2.gz OLOYNYHJACCUKZ-DOTOQJQBSA-N 1 0 348.443 3.629 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CC(C)(C)c3ccccc32)c1[N+](=O)[O-] ZINC000893143591 1018623374 /nfs/dbraw/zinc/62/33/74/1018623374.db2.gz LOLRMYZCYBWSQL-HNNXBMFYSA-N 1 0 342.395 3.821 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000580221183 1018818035 /nfs/dbraw/zinc/81/80/35/1018818035.db2.gz FFDWYDVQLLAHST-QUCCMNQESA-N 1 0 339.439 3.562 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cn2c(cccc2C)n1)c1cccc([N+](=O)[O-])c1 ZINC000592401809 1032797562 /nfs/dbraw/zinc/79/75/62/1032797562.db2.gz CZLCBLCRQSCVDN-GOSISDBHSA-N 1 0 338.411 3.834 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610420388 1019009981 /nfs/dbraw/zinc/00/99/81/1019009981.db2.gz FMJCYKJSXTZWAZ-CVEARBPZSA-N 1 0 325.412 3.772 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N[C@@H]1CC[N@@H+]2CCC[C@@H]2C1 ZINC000322407061 1019086911 /nfs/dbraw/zinc/08/69/11/1019086911.db2.gz XMEBHTCUMLYYBG-VXGBXAGGSA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1Nc1ccc(OCC[NH+]2CCCC2)cc1 ZINC001210953500 1019127655 /nfs/dbraw/zinc/12/76/55/1019127655.db2.gz KFHNINUKDJQMGA-UHFFFAOYSA-N 1 0 345.374 3.952 20 5 EHBDRO COc1cc(O[C@@H](CC[NH+](C)C)c2cccs2)ccc1[N+](=O)[O-] ZINC001225435050 1019281750 /nfs/dbraw/zinc/28/17/50/1019281750.db2.gz CLRNUFRNOHMVQI-AWEZNQCLSA-N 1 0 336.413 3.737 20 5 EHBDRO COC(=O)c1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000513386901 1019595160 /nfs/dbraw/zinc/59/51/60/1019595160.db2.gz RWQNGSLYXACFEW-UHFFFAOYSA-N 1 0 342.395 3.792 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000513661939 1019929134 /nfs/dbraw/zinc/92/91/34/1019929134.db2.gz RJZGKLUOLZGCPN-QGPMSJSTSA-N 1 0 342.443 3.834 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000093870288 1032917300 /nfs/dbraw/zinc/91/73/00/1032917300.db2.gz MSMMPSGWHNIFKM-MRXNPFEDSA-N 1 0 342.443 3.516 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H]2c2cccc(F)c2)cc1 ZINC000610505562 1020868709 /nfs/dbraw/zinc/86/87/09/1020868709.db2.gz PKUINJYQCACINJ-GOSISDBHSA-N 1 0 330.359 3.950 20 5 EHBDRO CC1(C)C[C@H](O)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000449616944 1032936690 /nfs/dbraw/zinc/93/66/90/1032936690.db2.gz FQFGWOMDRKIMOB-CQSZACIVSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@@H](CCc1ccccc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602504462 1032938339 /nfs/dbraw/zinc/93/83/39/1032938339.db2.gz QMZHDYZZYFHZFX-ZDUSSCGKSA-N 1 0 325.368 3.847 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cnn(C(C)(C)C)c2C)cc1[N+](=O)[O-] ZINC000276356889 1021089721 /nfs/dbraw/zinc/08/97/21/1021089721.db2.gz MEMJKPVEPQYWAA-GFCCVEGCSA-N 1 0 346.431 3.714 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C2CCN(C(=O)CC(C)C)CC2)cccc1[N+](=O)[O-] ZINC000178081854 1021150621 /nfs/dbraw/zinc/15/06/21/1021150621.db2.gz OTQPNTLSGRTZAZ-OAHLLOKOSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2nnc(C(C)C)s2)cccc1[N+](=O)[O-] ZINC000426295053 1021198000 /nfs/dbraw/zinc/19/80/00/1021198000.db2.gz LPLBUQPJDMEPKF-GFCCVEGCSA-N 1 0 334.445 3.771 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]C(C2CC2)C2CC2)cc1Br ZINC000602528114 1032962416 /nfs/dbraw/zinc/96/24/16/1032962416.db2.gz MXICZIIMTSNARJ-UHFFFAOYSA-N 1 0 331.235 3.697 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000518769716 1021519756 /nfs/dbraw/zinc/51/97/56/1021519756.db2.gz VGSVLUWNMLWKOY-UHFFFAOYSA-N 1 0 342.395 3.779 20 5 EHBDRO COC1(C)CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602590469 1032989150 /nfs/dbraw/zinc/98/91/50/1032989150.db2.gz IMJPVIGXCGHWID-UHFFFAOYSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000090909891 1021689171 /nfs/dbraw/zinc/68/91/71/1021689171.db2.gz SZIHIUOGQUYUAW-GFCCVEGCSA-N 1 0 331.441 3.823 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000090909805 1021693699 /nfs/dbraw/zinc/69/36/99/1021693699.db2.gz QBXFLMQNFQZGCJ-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(Cl)c1 ZINC000610538827 1021807356 /nfs/dbraw/zinc/80/73/56/1021807356.db2.gz FGPSVDJXPRLJQG-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO CC(C)(c1nc(-c2ccn3c[nH+]cc3c2)no1)c1ccccc1[N+](=O)[O-] ZINC000426570729 1021945604 /nfs/dbraw/zinc/94/56/04/1021945604.db2.gz OEMBADKNZSQJHI-UHFFFAOYSA-N 1 0 349.350 3.618 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)[C@H]1c1ccc(Cl)cc1 ZINC000517044464 1021977239 /nfs/dbraw/zinc/97/72/39/1021977239.db2.gz CBNAYZFDAQSXLQ-ZWKOTPCHSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)CC1 ZINC000602626181 1033020506 /nfs/dbraw/zinc/02/05/06/1033020506.db2.gz JLMKWIAGIAHWJH-CABCVRRESA-N 1 0 332.448 3.517 20 5 EHBDRO C[N@H+](CCc1ccncc1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602608650 1033026665 /nfs/dbraw/zinc/02/66/65/1033026665.db2.gz VEHYDFAJKJXWTC-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO C[NH+]1CC2(C1)CCN(C(=O)c1c3ccccc3nc3ccccc31)CC2 ZINC001270260923 1022115825 /nfs/dbraw/zinc/11/58/25/1022115825.db2.gz IWUOSASWXSXDOK-UHFFFAOYSA-N 1 0 345.446 3.556 20 5 EHBDRO C[NH+]1CC2(C1)CCCN(C(=O)c1c3ccccc3nc3ccccc31)C2 ZINC001270261174 1022118180 /nfs/dbraw/zinc/11/81/80/1022118180.db2.gz LFWMFPPDEMJDLC-UHFFFAOYSA-N 1 0 345.446 3.556 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]CCOc1ccc(F)cc1F ZINC000579251558 1022211864 /nfs/dbraw/zinc/21/18/64/1022211864.db2.gz ABPSWTBPUYNIIF-HNNXBMFYSA-N 1 0 334.322 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@@H]3CCC4(CCCCC4)O3)nc2c1 ZINC000602631084 1033042570 /nfs/dbraw/zinc/04/25/70/1033042570.db2.gz OMDIWRPKWVPHDQ-AWEZNQCLSA-N 1 0 345.399 3.708 20 5 EHBDRO Cc1cc(C)cc(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000058889707 1033059438 /nfs/dbraw/zinc/05/94/38/1033059438.db2.gz KJCQTLKMAJDQNJ-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccccc1[N+](=O)[O-] ZINC000303804915 1022512397 /nfs/dbraw/zinc/51/23/97/1022512397.db2.gz HKEQZMYNLDXXGI-INIZCTEOSA-N 1 0 325.412 3.696 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc(-n2cncn2)cc1 ZINC000178325495 1022668713 /nfs/dbraw/zinc/66/87/13/1022668713.db2.gz IVXIAYLPIPWLEZ-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCCc3c(F)cccc32)c1[N+](=O)[O-] ZINC000894659304 1022691558 /nfs/dbraw/zinc/69/15/58/1022691558.db2.gz QTKOOAJOSMHQRF-OAHLLOKOSA-N 1 0 346.358 3.615 20 5 EHBDRO Cc1cc(NC(=O)NCCCCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000473784514 1022775681 /nfs/dbraw/zinc/77/56/81/1022775681.db2.gz GVTZAKYYJVYVOL-UHFFFAOYSA-N 1 0 348.447 3.681 20 5 EHBDRO CC1(C)C[C@H](O)CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602683108 1033082342 /nfs/dbraw/zinc/08/23/42/1033082342.db2.gz IHLDWNGDWSHWMD-CYBMUJFWSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1noc(CN2CC=C(c3c[nH]c4ccccc43)CC2)c1[N+](=O)[O-] ZINC000933818957 1023043612 /nfs/dbraw/zinc/04/36/12/1023043612.db2.gz MMRWAJKTKGTGOO-UHFFFAOYSA-N 1 0 338.367 3.662 20 5 EHBDRO Cc1cccc2ncc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)n21 ZINC000507186519 1023169489 /nfs/dbraw/zinc/16/94/89/1023169489.db2.gz FTQKWIWWWUAPSW-UHFFFAOYSA-N 1 0 338.411 3.962 20 5 EHBDRO COc1ccc(C[C@@H](C)C[N@H+](C)Cc2csc([N+](=O)[O-])c2)cc1 ZINC000536417720 1023240259 /nfs/dbraw/zinc/24/02/59/1023240259.db2.gz XYVZCDZIYCUYPL-CYBMUJFWSA-N 1 0 334.441 3.976 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCOC(F)(F)F)s1 ZINC000473989501 1023268808 /nfs/dbraw/zinc/26/88/08/1023268808.db2.gz PEVVKVUNKNGCDD-UHFFFAOYSA-N 1 0 346.330 3.949 20 5 EHBDRO CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H]1COc2ccccc2O1 ZINC000610705516 1023276575 /nfs/dbraw/zinc/27/65/75/1023276575.db2.gz RIBLUEHQPADKBV-KRWDZBQOSA-N 1 0 342.395 3.647 20 5 EHBDRO C[C@H](C[C@@H]1CCOC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740640 1023403053 /nfs/dbraw/zinc/40/30/53/1023403053.db2.gz XERKNQOIYCNJKG-OLZOCXBDSA-N 1 0 347.440 3.623 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(C(=O)Nc2c(C)ccc([N+](=O)[O-])c2C)CC1 ZINC000594074726 1033147178 /nfs/dbraw/zinc/14/71/78/1033147178.db2.gz OJEKVLRWVYTQMC-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)s1 ZINC000065208837 1023916765 /nfs/dbraw/zinc/91/67/65/1023916765.db2.gz JZXXORFGTRGUQN-UHFFFAOYSA-N 1 0 326.805 3.821 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C(C)C)cc1 ZINC000602797885 1033172228 /nfs/dbraw/zinc/17/22/28/1033172228.db2.gz CWLWQIZAILLDHG-KRWDZBQOSA-N 1 0 330.432 3.939 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)n1 ZINC000176270086 1023949109 /nfs/dbraw/zinc/94/91/09/1023949109.db2.gz MSIRLEVTEFGLMH-LJQANCHMSA-N 1 0 348.406 3.591 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)c1 ZINC000449770914 1033186417 /nfs/dbraw/zinc/18/64/17/1033186417.db2.gz XMZDIZWCNQVHCJ-MRXNPFEDSA-N 1 0 332.425 3.650 20 5 EHBDRO Cc1noc(C2CCN(Cc3ccc(C(C)C)c([N+](=O)[O-])c3)CC2)n1 ZINC000091835702 1024411467 /nfs/dbraw/zinc/41/14/67/1024411467.db2.gz AKWCJZKGESBONU-UHFFFAOYSA-N 1 0 344.415 3.789 20 5 EHBDRO COc1ccc(OC)c(CCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000539046333 1024697418 /nfs/dbraw/zinc/69/74/18/1024697418.db2.gz JLXPGSDDUOVEET-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883985 1033233460 /nfs/dbraw/zinc/23/34/60/1033233460.db2.gz AFVYLFHFBCOFBK-MRXNPFEDSA-N 1 0 334.379 3.528 20 5 EHBDRO CC(C)[C@@H]([NH3+])CCN(C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000435383200 1024865638 /nfs/dbraw/zinc/86/56/38/1024865638.db2.gz HDACXEXNBDFTGR-INIZCTEOSA-N 1 0 348.472 3.524 20 5 EHBDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123991 1025034536 /nfs/dbraw/zinc/03/45/36/1025034536.db2.gz SHVSOWIRZUZHPQ-GFCCVEGCSA-N 1 0 336.338 3.945 20 5 EHBDRO Cc1ccccc1CN(C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000051380768 1025035184 /nfs/dbraw/zinc/03/51/84/1025035184.db2.gz JHDBMJMZIAHMAH-UHFFFAOYSA-N 1 0 338.367 3.585 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000539278029 1025035216 /nfs/dbraw/zinc/03/52/16/1025035216.db2.gz ACBOXEVHXUNJRO-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO C/C=C\C[C@@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000472142203 1025092238 /nfs/dbraw/zinc/09/22/38/1025092238.db2.gz MBEXILMJOAEBSM-SFAKSCPVSA-N 1 0 332.425 3.740 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000121021994 1025291744 /nfs/dbraw/zinc/29/17/44/1025291744.db2.gz GBBIZBSVDCSPRL-QGZVFWFLSA-N 1 0 329.400 3.664 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CC2(C(F)(F)F)CCC2)n1 ZINC000353963559 1025340144 /nfs/dbraw/zinc/34/01/44/1025340144.db2.gz XQFIHNZWAOLFDI-RYUDHWBXSA-N 1 0 346.353 3.597 20 5 EHBDRO C[C@@H]1CSCCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000934303743 1025349070 /nfs/dbraw/zinc/34/90/70/1025349070.db2.gz KWTQFRAHZMRUMH-GFCCVEGCSA-N 1 0 333.413 3.577 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000438996711 1025385167 /nfs/dbraw/zinc/38/51/67/1025385167.db2.gz PPOLSGIVJKGAMM-XCRHUMRWSA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1cccc(C(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000602962088 1033280680 /nfs/dbraw/zinc/28/06/80/1033280680.db2.gz GUABMZUPQVKMQI-KRWDZBQOSA-N 1 0 336.338 3.530 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)[C@H](C)NC(=O)OC(C)(C)C ZINC000381380981 1025420800 /nfs/dbraw/zinc/42/08/00/1025420800.db2.gz PFMKMBNXAQZATA-AGIUHOORSA-N 1 0 337.420 3.547 20 5 EHBDRO C[C@H]1[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000310399062 1025494356 /nfs/dbraw/zinc/49/43/56/1025494356.db2.gz UBVDILRTWNRYBB-LRDDRELGSA-N 1 0 346.818 3.718 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])cc1F ZINC000451166930 1025628069 /nfs/dbraw/zinc/62/80/69/1025628069.db2.gz UUEHJLXISKEHQT-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443001281 1025642309 /nfs/dbraw/zinc/64/23/09/1025642309.db2.gz PSIQZXDWDHEONN-UZLBHIALSA-N 1 0 341.455 3.993 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000443067261 1025684108 /nfs/dbraw/zinc/68/41/08/1025684108.db2.gz FHGZWFYMPSLDEI-KBPBESRZSA-N 1 0 330.384 3.854 20 5 EHBDRO CN1C[C@@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000436413279 1025692205 /nfs/dbraw/zinc/69/22/05/1025692205.db2.gz NPGYEZUDWMFCEY-CXOKCQFOSA-N 1 0 337.423 3.506 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCN(C2CCCCC2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000443079944 1025709362 /nfs/dbraw/zinc/70/93/62/1025709362.db2.gz POGBIIRXJQUZNM-KSSFIOAISA-N 1 0 345.443 3.569 20 5 EHBDRO Cc1cccc2oc(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3C)nc21 ZINC000281970921 1025835318 /nfs/dbraw/zinc/83/53/18/1025835318.db2.gz LAGIQMQRAGCRKH-UHFFFAOYSA-N 1 0 325.368 3.685 20 5 EHBDRO C[C@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000530495484 1025945873 /nfs/dbraw/zinc/94/58/73/1025945873.db2.gz QDPZCEGLPGBSJD-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417608 1026076750 /nfs/dbraw/zinc/07/67/50/1026076750.db2.gz RAQBFCDBVOTHAZ-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO CCOC(=O)CCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451544904 1026092565 /nfs/dbraw/zinc/09/25/65/1026092565.db2.gz GEDVJZGBYYYQFD-INIZCTEOSA-N 1 0 334.416 3.508 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000475158394 1026262595 /nfs/dbraw/zinc/26/25/95/1026262595.db2.gz MCLGCDHZXWWRAG-HOTGVXAUSA-N 1 0 333.432 3.646 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000562055840 1026374598 /nfs/dbraw/zinc/37/45/98/1026374598.db2.gz MHYLTXJYRTWCGQ-OCCSQVGLSA-N 1 0 334.803 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc([O-])cc1C[NH2+][C@@H]1CCC[C@H]1OCc1ccccc1 ZINC000339185688 1026419285 /nfs/dbraw/zinc/41/92/85/1026419285.db2.gz QIFUBISRPRIGIQ-IEBWSBKVSA-N 1 0 342.395 3.528 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127881541 1026600581 /nfs/dbraw/zinc/60/05/81/1026600581.db2.gz IFYAMQOEUQGVSF-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000582577709 1026663724 /nfs/dbraw/zinc/66/37/24/1026663724.db2.gz WMUWAKFQLPQYBY-ZVZYQTTQSA-N 1 0 334.460 3.693 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000531202476 1026684011 /nfs/dbraw/zinc/68/40/11/1026684011.db2.gz ZPWOFXDEQVNEJP-PBHICJAKSA-N 1 0 326.396 3.981 20 5 EHBDRO [NH3+]Cc1cccn1-c1ccc(Sc2ccc([N+](=O)[O-])cc2)cc1 ZINC001167593607 1026846552 /nfs/dbraw/zinc/84/65/52/1026846552.db2.gz VPWXUFYYJYTOOP-UHFFFAOYSA-N 1 0 325.393 3.995 20 5 EHBDRO CC(C)C[C@H](CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@H](C)c1ccccc1 ZINC000347326203 1026895699 /nfs/dbraw/zinc/89/56/99/1026895699.db2.gz WWRZQWCBGVLCKN-GDBMZVCRSA-N 1 0 345.447 3.506 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000531443670 1026926066 /nfs/dbraw/zinc/92/60/66/1026926066.db2.gz IGGZLBLMOAQKAK-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c2cccnc21 ZINC000413137592 1027104555 /nfs/dbraw/zinc/10/45/55/1027104555.db2.gz AYWVQKDLUCYGMW-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccsc1NC1CC([NH+]2CCC(C(F)(F)F)CC2)C1 ZINC000619501062 1027442184 /nfs/dbraw/zinc/44/21/84/1027442184.db2.gz MULNWUJQWXQEPL-UHFFFAOYSA-N 1 0 349.378 3.874 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C1(c2ccc3c(c2)OCO3)CC1 ZINC000453169084 1027487886 /nfs/dbraw/zinc/48/78/86/1027487886.db2.gz FPECSZXZKROHQL-ZDUSSCGKSA-N 1 0 340.379 3.533 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@@H+](C)[C@@H]1c1cccs1 ZINC000078338118 1027686643 /nfs/dbraw/zinc/68/66/43/1027686643.db2.gz YOQVSVIAXRKXSG-BBRMVZONSA-N 1 0 346.456 3.855 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN(C3CC3)[C@H]3CC[NH2+]C3)s2)cc1 ZINC000414664889 1027762735 /nfs/dbraw/zinc/76/27/35/1027762735.db2.gz UOYLJZAOOMBDTQ-INIZCTEOSA-N 1 0 343.452 3.650 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCN(Cc3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000310751879 1027766370 /nfs/dbraw/zinc/76/63/70/1027766370.db2.gz INFZEXCXLRFDRJ-QFBILLFUSA-N 1 0 339.439 3.656 20 5 EHBDRO CC[C@@H]1CCCCN1C(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178681112 1027869062 /nfs/dbraw/zinc/86/90/62/1027869062.db2.gz KLEXPDKRAPYGJK-ZMSDIMECSA-N 1 0 347.459 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CC[C@H](C4CCCC4)C3)n2)cc1 ZINC000420958745 1027928796 /nfs/dbraw/zinc/92/87/96/1027928796.db2.gz CLPIMNJYUZYSMP-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CO)c2ccccc2C)cc1[N+](=O)[O-] ZINC000536626014 1028014909 /nfs/dbraw/zinc/01/49/09/1028014909.db2.gz VKRQGEBONFBZQA-YOEHRIQHSA-N 1 0 344.411 3.686 20 5 EHBDRO CC[C@@](O)(CCC(F)(F)F)C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000897519346 1028032928 /nfs/dbraw/zinc/03/29/28/1028032928.db2.gz RDXGZUFBQCDYQV-UKRRQHHQSA-N 1 0 346.349 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCOC3)o2)c(Cl)c1 ZINC000237816836 1028067805 /nfs/dbraw/zinc/06/78/05/1028067805.db2.gz WKGHKOCGGMVQNA-NSHDSACASA-N 1 0 336.775 3.777 20 5 EHBDRO CC[C@H](c1ccc(F)cc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440496892 1028090627 /nfs/dbraw/zinc/09/06/27/1028090627.db2.gz TUFRHUSGOXDCPR-NVXWUHKLSA-N 1 0 344.390 3.766 20 5 EHBDRO O=C(Nc1cccc(-n2ccnc2)c1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342924930 1028158117 /nfs/dbraw/zinc/15/81/17/1028158117.db2.gz LVMIRXDZGPINBB-UHFFFAOYSA-N 1 0 347.334 3.514 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000523332954 1028180492 /nfs/dbraw/zinc/18/04/92/1028180492.db2.gz VHCRJFHGPLOASP-MRXNPFEDSA-N 1 0 347.462 3.848 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cnn(C2CCCC2)c1 ZINC000502421989 1028209440 /nfs/dbraw/zinc/20/94/40/1028209440.db2.gz ZSNIZWXMKMCAJZ-AWEZNQCLSA-N 1 0 328.416 3.800 20 5 EHBDRO CC1(C)CN(Cc2csc([N+](=O)[O-])c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440549935 1028259174 /nfs/dbraw/zinc/25/91/74/1028259174.db2.gz QEVIWYJITSAVQU-IFIJOSMWSA-N 1 0 336.457 3.826 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000421373208 1028332696 /nfs/dbraw/zinc/33/26/96/1028332696.db2.gz DPRQUGHKONQHEP-ZBFHGGJFSA-N 1 0 330.384 3.902 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](O)CC34CCC4)o2)c1 ZINC000421380632 1028341717 /nfs/dbraw/zinc/34/17/17/1028341717.db2.gz YQTDKUPWCPRRMS-INIZCTEOSA-N 1 0 342.395 3.734 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000909614994 1028481123 /nfs/dbraw/zinc/48/11/23/1028481123.db2.gz WNXYKPPVJVYQRK-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CO[C@@H](C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000583156218 1029039630 /nfs/dbraw/zinc/03/96/30/1029039630.db2.gz MQFAJBAZTNGMKR-IBGZPJMESA-N 1 0 326.396 3.947 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](OCC)C23CCC3)cc1[N+](=O)[O-] ZINC000504917982 1029043921 /nfs/dbraw/zinc/04/39/21/1029043921.db2.gz FLBQAAJDUXLONC-MORSLUCNSA-N 1 0 348.443 3.992 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504920411 1029044874 /nfs/dbraw/zinc/04/48/74/1029044874.db2.gz OPQFEIWPMLFPRP-CYBMUJFWSA-N 1 0 348.374 3.862 20 5 EHBDRO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739817 1029048337 /nfs/dbraw/zinc/04/83/37/1029048337.db2.gz JHNRTGOLNAWXPN-VXGBXAGGSA-N 1 0 336.823 3.606 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927453 1029073785 /nfs/dbraw/zinc/07/37/85/1029073785.db2.gz PAQMFSIPRGYPME-JKSUJKDBSA-N 1 0 349.475 3.766 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000191850697 1029080035 /nfs/dbraw/zinc/08/00/35/1029080035.db2.gz PHEQYYDZBHDNQV-IINYFYTJSA-N 1 0 339.823 3.744 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000615005793 1029231036 /nfs/dbraw/zinc/23/10/36/1029231036.db2.gz UPVGJPHCAJDDIX-LLVKDONJSA-N 1 0 331.294 3.803 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2=Cc3ccccc3OC2)c(Cl)c1 ZINC000183801750 1029535405 /nfs/dbraw/zinc/53/54/05/1029535405.db2.gz ODHBFFMWRDSQMM-UHFFFAOYSA-N 1 0 330.771 3.814 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000533288750 1029580708 /nfs/dbraw/zinc/58/07/08/1029580708.db2.gz YOVUDFKPJKPRIR-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN(Cc1cccs1)[C@@H]1C=C[C@H](CO)C1 ZINC000347387821 1029720382 /nfs/dbraw/zinc/72/03/82/1029720382.db2.gz ZOXCAMRCBVLWBC-GOEBONIOSA-N 1 0 344.436 3.596 20 5 EHBDRO CCOc1ccc2c(c1)CC[N@@H+](CCc1ccc([N+](=O)[O-])cc1)C2 ZINC000441094293 1029792830 /nfs/dbraw/zinc/79/28/30/1029792830.db2.gz JMYRABPVDWYWNJ-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO C[C@@H](CCc1ccc(F)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446845159 1029824115 /nfs/dbraw/zinc/82/41/15/1029824115.db2.gz YHMZDMGTNSJUIW-LBPRGKRZSA-N 1 0 342.374 3.721 20 5 EHBDRO CC(C)[C@H](COCc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000446939047 1029859882 /nfs/dbraw/zinc/85/98/82/1029859882.db2.gz LJJVLIMACOTXSH-IBGZPJMESA-N 1 0 328.412 3.926 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000441209107 1029978401 /nfs/dbraw/zinc/97/84/01/1029978401.db2.gz ZXTDMGZEAHRPPQ-WMZOPIPTSA-N 1 0 330.384 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@@H](Cc2ccccc2)C1 ZINC000525636775 1029987406 /nfs/dbraw/zinc/98/74/06/1029987406.db2.gz LJVIFZZPLRZQQS-KRWDZBQOSA-N 1 0 326.396 3.538 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C1CCN(C(=O)OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000186752391 1030068851 /nfs/dbraw/zinc/06/88/51/1030068851.db2.gz HRFBDDHIDQYCFK-DYVFJYSZSA-N 1 0 349.431 3.502 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1ccc2[nH]ccc2c1 ZINC000441241133 1030090407 /nfs/dbraw/zinc/09/04/07/1030090407.db2.gz YGHFIVMSDHDCAV-UHFFFAOYSA-N 1 0 339.395 3.807 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1CCOC2(CCC2)C1)C1CC1 ZINC000453318484 1030094429 /nfs/dbraw/zinc/09/44/29/1030094429.db2.gz MCOGOHWWWBFYPK-CRAIPNDOSA-N 1 0 344.455 3.855 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000572975211 1030098326 /nfs/dbraw/zinc/09/83/26/1030098326.db2.gz OPNVPFILTZFTEL-MOXGXCLJSA-N 1 0 338.407 3.950 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCc3sccc3[C@@H]2C)c([N+](=O)[O-])c1 ZINC000441250918 1030154477 /nfs/dbraw/zinc/15/44/77/1030154477.db2.gz AYBLORAWNWMANJ-LBPRGKRZSA-N 1 0 348.424 3.663 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cnc(C2CC2)o1)C1CC1 ZINC000453380192 1030204483 /nfs/dbraw/zinc/20/44/83/1030204483.db2.gz ZELNETKONSDMFI-MRXNPFEDSA-N 1 0 327.384 3.571 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1ccccc1[N+](=O)[O-] ZINC000453392557 1030238938 /nfs/dbraw/zinc/23/89/38/1030238938.db2.gz ZUNQWMMEGQGPSZ-HBUWYVDXSA-N 1 0 327.384 3.561 20 5 EHBDRO CCCc1ncc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000453393419 1030242000 /nfs/dbraw/zinc/24/20/00/1030242000.db2.gz RQDFVYMYYWWJLX-INIZCTEOSA-N 1 0 329.400 3.646 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCSc2ccccc2)n1 ZINC000447514728 1030260715 /nfs/dbraw/zinc/26/07/15/1030260715.db2.gz HICCRBXSLAXGHK-HOTGVXAUSA-N 1 0 346.456 3.657 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000052467193 1030282978 /nfs/dbraw/zinc/28/29/78/1030282978.db2.gz NUQXOBMABIPSOC-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])n1 ZINC000159856803 1030386340 /nfs/dbraw/zinc/38/63/40/1030386340.db2.gz VATMLYRYLYDUNS-MRXNPFEDSA-N 1 0 327.384 3.514 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C3(C4CC4)CC3)o2)c([N+](=O)[O-])c1 ZINC000532373703 1030709197 /nfs/dbraw/zinc/70/91/97/1030709197.db2.gz YJLYNVMOPHLODQ-UHFFFAOYSA-N 1 0 328.368 3.896 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623421 1030793110 /nfs/dbraw/zinc/79/31/10/1030793110.db2.gz AFUFJFGCNGIEKP-IAQYHMDHSA-N 1 0 339.823 3.697 20 5 EHBDRO C[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CCC(C)(C)C1 ZINC000483101600 1030956887 /nfs/dbraw/zinc/95/68/87/1030956887.db2.gz HSJBNQRPOAINQG-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483246059 1031056365 /nfs/dbraw/zinc/05/63/65/1031056365.db2.gz RWIOYWUCQRFFFF-CQSZACIVSA-N 1 0 333.432 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](CO)C1CCCCC1)CCC2 ZINC000551271971 1031183925 /nfs/dbraw/zinc/18/39/25/1031183925.db2.gz HIFPNVMUXLIUGC-VQIMIIECSA-N 1 0 332.444 3.751 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000483631316 1031254428 /nfs/dbraw/zinc/25/44/28/1031254428.db2.gz BFBFSIUMDKPDEM-HNNXBMFYSA-N 1 0 344.411 3.632 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C[C@@H]3CCOC3)C2)c(Cl)c1 ZINC000611797332 1031288275 /nfs/dbraw/zinc/28/82/75/1031288275.db2.gz UZYDNWKXJSGFCJ-KBPBESRZSA-N 1 0 338.835 3.887 20 5 EHBDRO CC[N@H+](CCc1cccs1)[C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343559070 1031397663 /nfs/dbraw/zinc/39/76/63/1031397663.db2.gz BMAWNEFCSFKXJG-ZDUSSCGKSA-N 1 0 347.440 3.548 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCOc2ccc(Cl)cn2)cc1[N+](=O)[O-] ZINC000537955278 1032044650 /nfs/dbraw/zinc/04/46/50/1032044650.db2.gz PMRAHJWXHSXHRD-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@H]3CC3(F)F)cs2)c1 ZINC000598647459 1033363680 /nfs/dbraw/zinc/36/36/80/1033363680.db2.gz MMFZUENCXBDAJG-NSHDSACASA-N 1 0 339.367 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](Cn1cccn1)c1ccccc1 ZINC000594494943 1033395966 /nfs/dbraw/zinc/39/59/66/1033395966.db2.gz INDCIBFLRFCGIP-RTBURBONSA-N 1 0 348.406 3.810 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCc3ccccc3NC2=O)cccc1[N+](=O)[O-] ZINC000594511763 1033415608 /nfs/dbraw/zinc/41/56/08/1033415608.db2.gz OHMDYVIFFFRNFH-SUMWQHHRSA-N 1 0 339.395 3.507 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000594515338 1033421938 /nfs/dbraw/zinc/42/19/38/1033421938.db2.gz NVSQIRPVUHDZFX-UGSOOPFHSA-N 1 0 325.412 3.933 20 5 EHBDRO Cc1nc2ccccn2c1C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000898279627 1033427672 /nfs/dbraw/zinc/42/76/72/1033427672.db2.gz ZLWZQUBAVDBEHG-UHFFFAOYSA-N 1 0 338.411 3.964 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000594603454 1033447820 /nfs/dbraw/zinc/44/78/20/1033447820.db2.gz VJSZVSRQCIOUKG-DOTOQJQBSA-N 1 0 326.400 3.572 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccco1 ZINC000574822457 1033572535 /nfs/dbraw/zinc/57/25/35/1033572535.db2.gz HXLNCAWDZTWNGQ-AEFFLSMTSA-N 1 0 343.427 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)cc1 ZINC000059393765 1033583989 /nfs/dbraw/zinc/58/39/89/1033583989.db2.gz QSRIXBJVAXYKEQ-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H](CO)C3CCC3)s2)cc1 ZINC000594955845 1033595940 /nfs/dbraw/zinc/59/59/40/1033595940.db2.gz FPPATGYGSNGLHL-INIZCTEOSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H](OC2CCCC2)C(F)(F)F)c1 ZINC000594966362 1033602934 /nfs/dbraw/zinc/60/29/34/1033602934.db2.gz HVPQOFOBJZYAAM-AWEZNQCLSA-N 1 0 332.322 3.575 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(CO)CC1 ZINC000594965772 1033604783 /nfs/dbraw/zinc/60/47/83/1033604783.db2.gz JPZDBNGJKMGEJQ-GFCCVEGCSA-N 1 0 332.425 3.574 20 5 EHBDRO CC1(C)OC[C@@H]2C[C@@]21[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000598986454 1033611850 /nfs/dbraw/zinc/61/18/50/1033611850.db2.gz AFUPUDRJGIBPGS-SCLBCKFNSA-N 1 0 328.368 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1[C@@H]2c3ccccc3C[C@H]12 ZINC000595023136 1033613474 /nfs/dbraw/zinc/61/34/74/1033613474.db2.gz SBXAPQBMJBFXPA-HFSCJMQWSA-N 1 0 338.407 3.840 20 5 EHBDRO CSc1ccc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)o1 ZINC000603430257 1033623128 /nfs/dbraw/zinc/62/31/28/1033623128.db2.gz YUNXYWSFFFPOKY-UHFFFAOYSA-N 1 0 331.397 3.723 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC000595003904 1033627868 /nfs/dbraw/zinc/62/78/68/1033627868.db2.gz NBMOZFUBBVJREZ-NEPJUHHUSA-N 1 0 344.367 3.744 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@H]3CCCOC3)cs2)c1 ZINC000598985019 1033632866 /nfs/dbraw/zinc/63/28/66/1033632866.db2.gz GMRUNOCJLUPRFK-CYBMUJFWSA-N 1 0 347.440 3.625 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1cccc(N(C)C)c1 ZINC000595009513 1033633474 /nfs/dbraw/zinc/63/34/74/1033633474.db2.gz CDRYDGLKIJBKJD-ZDUSSCGKSA-N 1 0 329.400 3.520 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCO[C@@H](CC(C)C)C1 ZINC000595027085 1033648222 /nfs/dbraw/zinc/64/82/22/1033648222.db2.gz MJGPWYFPHIQCCX-DZKIICNBSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCC1CCC(OC)CC1 ZINC000595034545 1033655251 /nfs/dbraw/zinc/65/52/51/1033655251.db2.gz XUJUKBVSCRHEOH-VQCLRJIVSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595035774 1033655651 /nfs/dbraw/zinc/65/56/51/1033655651.db2.gz MJTOVSCKRZTIND-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1csc([C@@H](C)[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000599046697 1033678095 /nfs/dbraw/zinc/67/80/95/1033678095.db2.gz KQQYNGHVANYEKC-LLVKDONJSA-N 1 0 330.413 3.734 20 5 EHBDRO COc1cccc(OC)c1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000595075793 1033693371 /nfs/dbraw/zinc/69/33/71/1033693371.db2.gz YVZPSVOVHIKPBZ-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081036 1033696260 /nfs/dbraw/zinc/69/62/60/1033696260.db2.gz PIOLWKHWNACIJD-RDTXWAMCSA-N 1 0 329.444 3.579 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+][C@@H]2CC[C@@H]2c2ccccc2)n1 ZINC000595088390 1033698423 /nfs/dbraw/zinc/69/84/23/1033698423.db2.gz BNEBPLJGABLBTD-BRSBDYLESA-N 1 0 340.427 3.811 20 5 EHBDRO CC[C@@H]([NH2+]Cc1c(C2CCC2)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000595097048 1033703194 /nfs/dbraw/zinc/70/31/94/1033703194.db2.gz GUJLBNQDKIHEND-QGZVFWFLSA-N 1 0 328.416 3.837 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000599072209 1033714597 /nfs/dbraw/zinc/71/45/97/1033714597.db2.gz FIWMVGRXYSOYJV-SJCJKPOMSA-N 1 0 342.395 3.950 20 5 EHBDRO Cc1noc(C[NH+]2CCC(c3c[nH]c4ccccc43)CC2)c1[N+](=O)[O-] ZINC000595291088 1033717895 /nfs/dbraw/zinc/71/78/95/1033717895.db2.gz XQQSNKQQIBTZBP-UHFFFAOYSA-N 1 0 340.383 3.752 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@]3(CCCc4ccccc43)C2)c1[N+](=O)[O-] ZINC000595339400 1033731177 /nfs/dbraw/zinc/73/11/77/1033731177.db2.gz OBOYBBUZYKGAOE-LJQANCHMSA-N 1 0 341.411 3.761 20 5 EHBDRO C[C@H](CO)C1CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000593676673 1033733959 /nfs/dbraw/zinc/73/39/59/1033733959.db2.gz NXECQFSBCQUROD-CQSZACIVSA-N 1 0 344.411 3.695 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC[C@H]1CC[N@@H+]1C1CCCC1 ZINC000599163109 1033780055 /nfs/dbraw/zinc/78/00/55/1033780055.db2.gz AZGHGTWRFOMUSR-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@H](Nc2ccccc2)C1 ZINC000595383841 1033784271 /nfs/dbraw/zinc/78/42/71/1033784271.db2.gz PFRMYFXSEIGNHP-KRWDZBQOSA-N 1 0 329.375 3.810 20 5 EHBDRO C[C@H](CCO)[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000593694701 1033803305 /nfs/dbraw/zinc/80/33/05/1033803305.db2.gz QGXVPDLDYFUOPN-CYBMUJFWSA-N 1 0 348.374 3.729 20 5 EHBDRO CCc1ccc([C@H]2CCC[N@H+](Cc3onc(C)c3[N+](=O)[O-])C2)cc1 ZINC000595481782 1033808912 /nfs/dbraw/zinc/80/89/12/1033808912.db2.gz AVXGCRKHHIQODY-INIZCTEOSA-N 1 0 329.400 3.833 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2cccs2)C2CC2)c1 ZINC000593017842 1033816193 /nfs/dbraw/zinc/81/61/93/1033816193.db2.gz BWWXZVMRQOKLPR-MRXNPFEDSA-N 1 0 346.408 3.684 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000595526606 1033841817 /nfs/dbraw/zinc/84/18/17/1033841817.db2.gz UWCOBFUTBKKTJB-CVEARBPZSA-N 1 0 334.391 3.515 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H]1C[C@H]2C[C@H]2C1)[C@H]1CC[C@H](O)CC1 ZINC000595562352 1033844292 /nfs/dbraw/zinc/84/42/92/1033844292.db2.gz ISPOPTKQQMPXAS-UXCMUTLZSA-N 1 0 344.455 3.746 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000595553798 1033858731 /nfs/dbraw/zinc/85/87/31/1033858731.db2.gz NRASDKAVIPHIBQ-QGZVFWFLSA-N 1 0 334.391 3.515 20 5 EHBDRO Cn1cc(C[NH2+]Cc2ccc(Cl)o2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000608835530 1033909473 /nfs/dbraw/zinc/90/94/73/1033909473.db2.gz RZQYKSLANOSRMO-UHFFFAOYSA-N 1 0 346.774 3.532 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccccc3[N+](=O)[O-])C2)cc1F ZINC000599677014 1034084528 /nfs/dbraw/zinc/08/45/28/1034084528.db2.gz GEZXEZSPZOTISK-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO CC[N@H+](CCNc1cc(C)sc1[N+](=O)[O-])CCC(F)(F)F ZINC000596211681 1034119880 /nfs/dbraw/zinc/11/98/80/1034119880.db2.gz YDQUJZFGBTVIKJ-UHFFFAOYSA-N 1 0 325.356 3.651 20 5 EHBDRO Cc1cc(N2CCC([NH2+]Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000596252226 1034136095 /nfs/dbraw/zinc/13/60/95/1034136095.db2.gz HUCSGQQDMJZLDA-UHFFFAOYSA-N 1 0 325.412 3.662 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1Cc1ccc(F)cc1 ZINC000604013121 1034138029 /nfs/dbraw/zinc/13/80/29/1034138029.db2.gz LZKMCUMGLRLEGW-KRWDZBQOSA-N 1 0 344.386 3.820 20 5 EHBDRO CCC(C)(C)[NH2+][C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1NC(C)C ZINC000456157331 1034171882 /nfs/dbraw/zinc/17/18/82/1034171882.db2.gz ARHBYOXUKMXWAI-GFCCVEGCSA-N 1 0 336.436 3.520 20 5 EHBDRO COc1cc(N[C@@H]2CC[N@@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596336137 1034179015 /nfs/dbraw/zinc/17/90/15/1034179015.db2.gz NAYWQKQIFSODNZ-SNVBAGLBSA-N 1 0 327.812 3.542 20 5 EHBDRO O=c1ccc([N+](=O)[O-])cn1CC[N@@H+]1CCC[C@@H]1CCC1CCCCC1 ZINC000534136284 1034182471 /nfs/dbraw/zinc/18/24/71/1034182471.db2.gz BOYLEADRFWXLIW-QGZVFWFLSA-N 1 0 347.459 3.581 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000179375550 1034258524 /nfs/dbraw/zinc/25/85/24/1034258524.db2.gz GTKIOQYBLLGLSL-RYUDHWBXSA-N 1 0 347.440 3.951 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000179394941 1034276367 /nfs/dbraw/zinc/27/63/67/1034276367.db2.gz WZHXLBPFUMNNSY-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397387 1034280307 /nfs/dbraw/zinc/28/03/07/1034280307.db2.gz IVNIQRFEIFZRBQ-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)CN(C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000310310076 1034315852 /nfs/dbraw/zinc/31/58/52/1034315852.db2.gz SYDBNZJSVOGAQP-MRXNPFEDSA-N 1 0 327.428 3.513 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000456340352 1034335331 /nfs/dbraw/zinc/33/53/31/1034335331.db2.gz XYYIOWQNQQZAAW-INIZCTEOSA-N 1 0 339.395 3.704 20 5 EHBDRO C[C@@H](c1ccc(-c2cc([N+](=O)[O-])ccc2CO)cc1)[NH+]1CCCC1 ZINC000596634949 1034337481 /nfs/dbraw/zinc/33/74/81/1034337481.db2.gz SNDKSXFQHFDTMX-AWEZNQCLSA-N 1 0 326.396 3.911 20 5 EHBDRO C[C@H]1CCC[N@@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CCO)c1 ZINC000596647170 1034345506 /nfs/dbraw/zinc/34/55/06/1034345506.db2.gz DOBQNGJLPIPZJC-HNNXBMFYSA-N 1 0 340.423 3.781 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H]2CCCn3nccc32)c2cc([N+](=O)[O-])ccc21 ZINC000601320383 1034452534 /nfs/dbraw/zinc/45/25/34/1034452534.db2.gz GDPSCIGVRYUYMV-JKSUJKDBSA-N 1 0 326.400 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC/C=C\c3ccccc3)C2)nc1 ZINC000450556369 1034520064 /nfs/dbraw/zinc/52/00/64/1034520064.db2.gz AVTHHOJQMCSCAH-RLXIPRIJSA-N 1 0 338.411 3.580 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000179692099 1034563632 /nfs/dbraw/zinc/56/36/32/1034563632.db2.gz JQKUQMBWLPLAOZ-CYBMUJFWSA-N 1 0 328.368 3.621 20 5 EHBDRO COCC1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000594509789 1034591192 /nfs/dbraw/zinc/59/11/92/1034591192.db2.gz HGZBWDALZYGBRU-GOSISDBHSA-N 1 0 326.396 3.700 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@](O)(C3CC3)C2)o1 ZINC000597206032 1034592475 /nfs/dbraw/zinc/59/24/75/1034592475.db2.gz POFZWIVDHVHUIF-IBGZPJMESA-N 1 0 342.395 3.592 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000450675300 1034701960 /nfs/dbraw/zinc/70/19/60/1034701960.db2.gz CRZRAQQPLWHZBE-ZRGWGRIASA-N 1 0 328.412 3.718 20 5 EHBDRO CO[C@H](C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC000548917044 1034787427 /nfs/dbraw/zinc/78/74/27/1034787427.db2.gz ZECDAUVDNRQZSO-GOSISDBHSA-N 1 0 346.814 3.994 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)C1CCCC1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000172170613 1034849114 /nfs/dbraw/zinc/84/91/14/1034849114.db2.gz ZWAXAGOWODDEBL-QWRGUYRKSA-N 1 0 339.823 3.744 20 5 EHBDRO COc1ccc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1Cl ZINC000548935526 1034996728 /nfs/dbraw/zinc/99/67/28/1034996728.db2.gz NPJNEEFUFFVPRK-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])cc1OC ZINC000179907162 1035011397 /nfs/dbraw/zinc/01/13/97/1035011397.db2.gz YIJOWODXVLFPAI-INIZCTEOSA-N 1 0 342.395 3.731 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2C[C@@H](O)C[C@@H]2c2ccccc2)c(Cl)c1 ZINC000411927676 1035078074 /nfs/dbraw/zinc/07/80/74/1035078074.db2.gz SQCFBAMUSNDDLZ-DOTOQJQBSA-N 1 0 332.787 3.556 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCOC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000136749666 1035086345 /nfs/dbraw/zinc/08/63/45/1035086345.db2.gz OUZWHQAKZDFADF-HNNXBMFYSA-N 1 0 334.416 3.575 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000580469639 1035439688 /nfs/dbraw/zinc/43/96/88/1035439688.db2.gz BGKDOBMFDBQNMP-GDBMZVCRSA-N 1 0 334.416 3.587 20 5 EHBDRO C[C@H]([NH2+]C1CC(OCc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000463561575 1035629733 /nfs/dbraw/zinc/62/97/33/1035629733.db2.gz BGELBQXTDJNEQE-STJZUHDESA-N 1 0 326.396 3.993 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535598 1035655195 /nfs/dbraw/zinc/65/51/95/1035655195.db2.gz IDXIPSDFYFZKEP-UONOGXRCSA-N 1 0 349.431 3.563 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000588232506 1035831040 /nfs/dbraw/zinc/83/10/40/1035831040.db2.gz KJZUWEUZFHUZKN-CJNGLKHVSA-N 1 0 348.830 3.983 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCO1 ZINC000511504783 1035905059 /nfs/dbraw/zinc/90/50/59/1035905059.db2.gz AMEBYCYLYMQKHH-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](OC)C23CCC3)cc1[N+](=O)[O-] ZINC000414188423 1035957045 /nfs/dbraw/zinc/95/70/45/1035957045.db2.gz QGHPNFFBJXXYNY-VUCTXSBTSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000464102574 1036125606 /nfs/dbraw/zinc/12/56/06/1036125606.db2.gz BCRNGCWYOVSRTN-ZDUSSCGKSA-N 1 0 348.349 3.871 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCOCc2ccccc2)ccc1[N+](=O)[O-] ZINC000492647733 1036129283 /nfs/dbraw/zinc/12/92/83/1036129283.db2.gz FATNIFQGDYPRMC-UHFFFAOYSA-N 1 0 344.411 3.642 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000056201702 1036139966 /nfs/dbraw/zinc/13/99/66/1036139966.db2.gz NWINZMQIQHUXKZ-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO CC(C)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)OCC1CC1 ZINC000414249889 1036276314 /nfs/dbraw/zinc/27/63/14/1036276314.db2.gz AYAQUNZRUNSVQI-QGZVFWFLSA-N 1 0 332.444 3.711 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)[C@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000492814354 1036331933 /nfs/dbraw/zinc/33/19/33/1036331933.db2.gz AOFHCMASMMHQGR-CZUORRHYSA-N 1 0 342.395 3.648 20 5 EHBDRO COc1cc(CN2CCc3ccc(Cl)cc3C2)ccc1[N+](=O)[O-] ZINC000492837587 1036354397 /nfs/dbraw/zinc/35/43/97/1036354397.db2.gz WLBOBDCFNGCVHL-UHFFFAOYSA-N 1 0 332.787 3.815 20 5 EHBDRO Cc1ccccc1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000026224067 1036394194 /nfs/dbraw/zinc/39/41/94/1036394194.db2.gz MJUMXTVZNBMEOX-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(Cl)c1 ZINC000026226302 1036418400 /nfs/dbraw/zinc/41/84/00/1036418400.db2.gz YZHBCFZVTKKYET-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO COc1ccc(C2(C[NH2+]Cc3csc([N+](=O)[O-])c3)CCC2)cc1 ZINC000541553675 1036447908 /nfs/dbraw/zinc/44/79/08/1036447908.db2.gz OPVKUWJMPCAENT-UHFFFAOYSA-N 1 0 332.425 3.876 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H]2C2CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000609133524 1036566833 /nfs/dbraw/zinc/56/68/33/1036566833.db2.gz DXBGFJMOFRBVPT-LBPRGKRZSA-N 1 0 342.342 3.579 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cc4ccccc4s3)nc2c1 ZINC000446849431 1036591652 /nfs/dbraw/zinc/59/16/52/1036591652.db2.gz YKNWOUOPFZEHAW-UHFFFAOYSA-N 1 0 338.392 3.976 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000152411610 1036597061 /nfs/dbraw/zinc/59/70/61/1036597061.db2.gz DGGCNARREVOJIK-HNNXBMFYSA-N 1 0 349.475 3.940 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2CCOCC2)c2ccccc2)c1 ZINC000180351878 1036716727 /nfs/dbraw/zinc/71/67/27/1036716727.db2.gz CZNJGOKKRKRPJI-LJQANCHMSA-N 1 0 326.396 3.700 20 5 EHBDRO CC(C)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1cccnc1 ZINC000414336229 1036735042 /nfs/dbraw/zinc/73/50/42/1036735042.db2.gz OYDXZFKCSHNQJA-SFHVURJKSA-N 1 0 339.439 3.878 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(Cl)c1 ZINC000180396900 1036771617 /nfs/dbraw/zinc/77/16/17/1036771617.db2.gz ZWARRULMMWBKEK-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180416263 1036774291 /nfs/dbraw/zinc/77/42/91/1036774291.db2.gz BJOSHONSNPBEHN-CQSZACIVSA-N 1 0 336.395 3.846 20 5 EHBDRO Cc1ccc(C)c(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000180404345 1036780275 /nfs/dbraw/zinc/78/02/75/1036780275.db2.gz RUIUVZPDQNPBOE-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000237675199 1036852384 /nfs/dbraw/zinc/85/23/84/1036852384.db2.gz VBXYIYBWMWBLBH-CYBMUJFWSA-N 1 0 325.840 3.602 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290605 1036890524 /nfs/dbraw/zinc/89/05/24/1036890524.db2.gz GKIYEJFGJXXJCQ-FZMZJTMJSA-N 1 0 330.388 3.874 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2cccs2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000452063513 1036944972 /nfs/dbraw/zinc/94/49/72/1036944972.db2.gz WRAKPRLZWBALLD-QGZVFWFLSA-N 1 0 346.452 3.958 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C)C[C@H](C)C1 ZINC000443663761 1036976515 /nfs/dbraw/zinc/97/65/15/1036976515.db2.gz YVLVVXCRERNYMZ-KGLIPLIRSA-N 1 0 333.432 3.600 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCO[C@H](CC(C)C)C1 ZINC000539615749 1036982247 /nfs/dbraw/zinc/98/22/47/1036982247.db2.gz JEUVXCKRADOIPW-DOTOQJQBSA-N 1 0 336.432 3.677 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC(C)(C)C[C@H]1C ZINC000412031153 1036991362 /nfs/dbraw/zinc/99/13/62/1036991362.db2.gz AMUPJCXCPXKGKX-NEPJUHHUSA-N 1 0 330.388 3.826 20 5 EHBDRO COc1cnccc1[C@@H](C)[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000188769437 1037213618 /nfs/dbraw/zinc/21/36/18/1037213618.db2.gz NOSWATYGOOUMNB-ZIAGYGMSSA-N 1 0 329.400 3.670 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539820977 1037243198 /nfs/dbraw/zinc/24/31/98/1037243198.db2.gz TZVWITFZARBKCS-AWEZNQCLSA-N 1 0 330.432 3.863 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800031 1037295630 /nfs/dbraw/zinc/29/56/30/1037295630.db2.gz PESJYSWBMYYIKQ-PIGZYNQJSA-N 1 0 336.338 3.566 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]3COCC[C@@H]32)o1 ZINC000539891721 1037314972 /nfs/dbraw/zinc/31/49/72/1037314972.db2.gz ZJAGFPLPTUJVIX-YOEHRIQHSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCc3n[nH]cc3C2)c2ccccc2)c1 ZINC000180949658 1037341715 /nfs/dbraw/zinc/34/17/15/1037341715.db2.gz BYSAXISKHRIREP-YLJYHZDGSA-N 1 0 348.406 3.554 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(N2CCCC2=O)cc1 ZINC000171128712 1037464960 /nfs/dbraw/zinc/46/49/60/1037464960.db2.gz AQSMIJNEXIONQE-CQSZACIVSA-N 1 0 339.395 3.572 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@@H]2CC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601346 1037486542 /nfs/dbraw/zinc/48/65/42/1037486542.db2.gz BOXHHPOAESDGLA-GOEBONIOSA-N 1 0 336.432 3.631 20 5 EHBDRO CC[N@H+](CCC1CC1)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883250 1037553570 /nfs/dbraw/zinc/55/35/70/1037553570.db2.gz BCSWVQAHHDNSMV-NSHDSACASA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2Nc2cc3c(c[nH+]2)CCCC3)n1 ZINC000462941440 1037563904 /nfs/dbraw/zinc/56/39/04/1037563904.db2.gz DHUJOCSONMBALH-HOTGVXAUSA-N 1 0 341.415 3.661 20 5 EHBDRO CC[C@H](Cc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000591733830 1037572134 /nfs/dbraw/zinc/57/21/34/1037572134.db2.gz RAXZQIDMIBNLBW-MRXNPFEDSA-N 1 0 341.411 3.534 20 5 EHBDRO CC(C)C[NH+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000026646985 1037574037 /nfs/dbraw/zinc/57/40/37/1037574037.db2.gz QWVYMUBCMZCGRC-UHFFFAOYSA-N 1 0 341.839 3.801 20 5 EHBDRO COc1cc(F)c([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000540150520 1037623194 /nfs/dbraw/zinc/62/31/94/1037623194.db2.gz GKDSVGXZMXYZBZ-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]CCSCC(F)(F)F ZINC000698969981 1037638854 /nfs/dbraw/zinc/63/88/54/1037638854.db2.gz YKHALEIRQMPSMV-UHFFFAOYSA-N 1 0 328.743 3.633 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2c3cc(F)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000540173948 1037642453 /nfs/dbraw/zinc/64/24/53/1037642453.db2.gz NLMBMVKLTCKRAJ-VOJFVSQTSA-N 1 0 330.359 3.766 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000491822863 1037691993 /nfs/dbraw/zinc/69/19/93/1037691993.db2.gz YAEQLTOPMBTXQJ-HUUCEWRRSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000493905411 1037702684 /nfs/dbraw/zinc/70/26/84/1037702684.db2.gz HSKMWFRRLCYJRU-AWEZNQCLSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@H](C[NH2+]Cc1cccc2c1CCOC2)c1ccccc1[N+](=O)[O-] ZINC000897461079 1037850204 /nfs/dbraw/zinc/85/02/04/1037850204.db2.gz YMLXFAOMVGXUAB-CQSZACIVSA-N 1 0 326.396 3.561 20 5 EHBDRO CCC1CCC([N@H+](Cc2ccc(C(N)=O)cc2[N+](=O)[O-])C2CC2)CC1 ZINC000053169652 1037941793 /nfs/dbraw/zinc/94/17/93/1037941793.db2.gz USTRLUGOHKITEW-UHFFFAOYSA-N 1 0 345.443 3.627 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]2C2CCC2)c2c(c1)COCO2 ZINC000592198794 1037943576 /nfs/dbraw/zinc/94/35/76/1037943576.db2.gz VEMHYIQHBODJLP-KRWDZBQOSA-N 1 0 332.400 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@H]3C3CCC3)o2)cc1 ZINC000592198765 1037943894 /nfs/dbraw/zinc/94/38/94/1037943894.db2.gz SGJFKDBSDBHXHL-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(C[C@H]1C)CCOCC2 ZINC000592529432 1038028559 /nfs/dbraw/zinc/02/85/59/1038028559.db2.gz ZIRDBJVHHPMVQO-DDITZMBXSA-N 1 0 330.428 3.889 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000120200321 1038125111 /nfs/dbraw/zinc/12/51/11/1038125111.db2.gz WGBRXNBEXNKUIF-KXBFYZLASA-N 1 0 327.428 3.857 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[C@H](c1ccccc1)[NH+](C)C ZINC000416121572 1038168639 /nfs/dbraw/zinc/16/86/39/1038168639.db2.gz KWUCXHIBLWOFTM-QGZVFWFLSA-N 1 0 327.384 3.535 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](C3CCCCC3)CC2)c2ccncc21 ZINC000152435447 1038183935 /nfs/dbraw/zinc/18/39/35/1038183935.db2.gz JBZYBKAFOAIDLH-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CC=C(c3c[nH]c4ncccc34)CC2)cc1 ZINC000532643398 1038213480 /nfs/dbraw/zinc/21/34/80/1038213480.db2.gz CXGHBKHRLTVCHF-UHFFFAOYSA-N 1 0 348.406 3.803 20 5 EHBDRO C[C@@H]1CC[C@@H]([N@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123758 1038359967 /nfs/dbraw/zinc/35/99/67/1038359967.db2.gz JOZUNRCOLRYLMO-DGCLKSJQSA-N 1 0 346.349 3.597 20 5 EHBDRO C[Si](C)(C[N@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccccc1 ZINC001167733754 1038367948 /nfs/dbraw/zinc/36/79/48/1038367948.db2.gz CHEGVQWGUNVPLF-UHFFFAOYSA-N 1 0 340.499 3.714 20 5 EHBDRO C[C@H]1CCN(C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000538739851 1038504267 /nfs/dbraw/zinc/50/42/67/1038504267.db2.gz NRWLYCVRFHPQIN-AWEZNQCLSA-N 1 0 345.468 3.849 20 5 EHBDRO COc1ccccc1[C@@H](CNc1cc(C)c([N+](=O)[O-])cc1F)[NH+](C)C ZINC000461719255 1038579457 /nfs/dbraw/zinc/57/94/57/1038579457.db2.gz QAZCCXKLUJUZFI-QGZVFWFLSA-N 1 0 347.390 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@]2(Cc3ccc(Cl)cc3)CCOC2)c1 ZINC000500469156 1038779372 /nfs/dbraw/zinc/77/93/72/1038779372.db2.gz KDMLQHMKLNOPAB-SFHVURJKSA-N 1 0 346.814 3.740 20 5 EHBDRO CCSc1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000905409068 1038865955 /nfs/dbraw/zinc/86/59/55/1038865955.db2.gz FMXOQTOUHHZNRR-QGZVFWFLSA-N 1 0 332.425 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCCC[C@H]2OC(F)F)c(Cl)c1 ZINC000500568118 1039000393 /nfs/dbraw/zinc/00/03/93/1039000393.db2.gz GFUOHJIBSAXTCY-CHWSQXEVSA-N 1 0 334.750 3.888 20 5 EHBDRO CCOc1ccc(CN(C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000015293042 1039088367 /nfs/dbraw/zinc/08/83/67/1039088367.db2.gz NNGGZSQNITZNIR-UHFFFAOYSA-N 1 0 330.384 3.634 20 5 EHBDRO C[C@@H]1CC2(CCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432786701 1039188179 /nfs/dbraw/zinc/18/81/79/1039188179.db2.gz DOCUPYAYQPJKNN-LLVKDONJSA-N 1 0 326.343 3.961 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000570189653 1039260832 /nfs/dbraw/zinc/26/08/32/1039260832.db2.gz FKBQORGHIHZAQX-FJIDUMEYSA-N 1 0 340.427 3.668 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H](c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000366071906 1039343236 /nfs/dbraw/zinc/34/32/36/1039343236.db2.gz GIAJHDZAIJJKRB-NUEKZKHPSA-N 1 0 328.416 3.705 20 5 EHBDRO Cc1ccccc1C[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128182296 1039458191 /nfs/dbraw/zinc/45/81/91/1039458191.db2.gz WIQHNOSVHOTQFU-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC1 ZINC000480535605 1039655489 /nfs/dbraw/zinc/65/54/89/1039655489.db2.gz KWTUTTHXVYZFLU-ICSRJNTNSA-N 1 0 345.487 3.626 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000841069518 1039806924 /nfs/dbraw/zinc/80/69/24/1039806924.db2.gz ASPNZURXDAPYIL-UHFFFAOYSA-N 1 0 331.803 3.896 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC000584831509 1040008643 /nfs/dbraw/zinc/00/86/43/1040008643.db2.gz IZTMQROKQBPGDC-MOPGFXCFSA-N 1 0 326.396 3.913 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCOc2ccccc2F)C2CC2)c1 ZINC000490043415 1040318004 /nfs/dbraw/zinc/31/80/04/1040318004.db2.gz QBWDHRWULWJQGK-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481093930 1040349037 /nfs/dbraw/zinc/34/90/37/1040349037.db2.gz VJASSWJHYDEEQC-KBPBESRZSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CC[C@@H](C)C[C@H]1C ZINC000481187225 1040451756 /nfs/dbraw/zinc/45/17/56/1040451756.db2.gz FTAMUCVNVSGJSQ-XNRPHZJLSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192847103 1040576648 /nfs/dbraw/zinc/57/66/48/1040576648.db2.gz BBPDWWNWHKGRLP-MRXNPFEDSA-N 1 0 331.441 3.878 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC([C@H](O)c3ccccc3)CC2)c1 ZINC000029475232 1040633428 /nfs/dbraw/zinc/63/34/28/1040633428.db2.gz HZGFYOBIPGUFJI-LJQANCHMSA-N 1 0 326.396 3.540 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](SC)C(C)(C)C ZINC000542315658 1040735549 /nfs/dbraw/zinc/73/55/49/1040735549.db2.gz UJUWOJIACNVBET-HNNXBMFYSA-N 1 0 326.462 3.861 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]Cc2cccc(O)c2)cc(C(F)(F)F)c1 ZINC000487193900 1040780037 /nfs/dbraw/zinc/78/00/37/1040780037.db2.gz WKHOFRDYVOSUQJ-UHFFFAOYSA-N 1 0 326.274 3.609 20 5 EHBDRO COc1cc(N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000569775647 1040820996 /nfs/dbraw/zinc/82/09/96/1040820996.db2.gz CSOANMCTILDFHS-UGSOOPFHSA-N 1 0 329.400 3.707 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@]2(C)CC[N@H+](Cc3ccccc3)C2)n1 ZINC000311199279 1040832694 /nfs/dbraw/zinc/83/26/94/1040832694.db2.gz JQLUJGYFYYDNDL-IBGZPJMESA-N 1 0 340.427 3.622 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000491066964 1040899438 /nfs/dbraw/zinc/89/94/38/1040899438.db2.gz PLBQAZWULQPQLD-UHFFFAOYSA-N 1 0 337.439 3.678 20 5 EHBDRO C[N@H+](CCNc1ccc([N+](=O)[O-])c2cnccc12)Cc1ccccc1 ZINC000053582859 1040915599 /nfs/dbraw/zinc/91/55/99/1040915599.db2.gz NCYONHCIZOAMBF-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO CC(C)(C)[NH+]1CCC(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192971998 1040927185 /nfs/dbraw/zinc/92/71/85/1040927185.db2.gz JWVRCNUYEUXVPO-GOSISDBHSA-N 1 0 331.460 3.825 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CSC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000512868901 1041138683 /nfs/dbraw/zinc/13/86/83/1041138683.db2.gz KCTQJDZXWLVRIP-ABAIWWIYSA-N 1 0 348.424 3.705 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCCC(F)(F)C1 ZINC000500350766 1041193500 /nfs/dbraw/zinc/19/35/00/1041193500.db2.gz APJDCMZLLUQIDT-LBPRGKRZSA-N 1 0 328.359 3.909 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282948 1041232448 /nfs/dbraw/zinc/23/24/48/1041232448.db2.gz NJYOOWYMVBWBLW-PMUMKWKESA-N 1 0 331.460 3.780 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282946 1041233252 /nfs/dbraw/zinc/23/32/52/1041233252.db2.gz NJYOOWYMVBWBLW-IYOUNJFTSA-N 1 0 331.460 3.780 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549507293 1041394747 /nfs/dbraw/zinc/39/47/47/1041394747.db2.gz BDSDDNUMFNHJTO-JTQLQIEISA-N 1 0 329.322 3.571 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC(=O)N[C@H]2C(C)(C)C)cc1[N+](=O)[O-] ZINC000513042350 1041411940 /nfs/dbraw/zinc/41/19/40/1041411940.db2.gz WTNNPZXLKWSBGH-CRAIPNDOSA-N 1 0 347.459 3.501 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072390 1041814962 /nfs/dbraw/zinc/81/49/62/1041814962.db2.gz BZGFPRFSLOUBKH-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1cc(N2CCC[C@@H]([NH+](C)C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549564596 1042292242 /nfs/dbraw/zinc/29/22/42/1042292242.db2.gz MSRWTANOZSNBOO-GFCCVEGCSA-N 1 0 345.365 3.843 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C[C@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000120374446 1042772291 /nfs/dbraw/zinc/77/22/91/1042772291.db2.gz NFPBVMLHPWXHLB-ZDUSSCGKSA-N 1 0 332.425 3.525 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000278991272 1043151168 /nfs/dbraw/zinc/15/11/68/1043151168.db2.gz DVGVTYNJLSPQTK-MSOLQXFVSA-N 1 0 326.396 3.640 20 5 EHBDRO Cc1cc(C[C@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000279114933 1043372975 /nfs/dbraw/zinc/37/29/75/1043372975.db2.gz PMSDKPHVTNPSSR-GTNSWQLSSA-N 1 0 328.416 3.570 20 5 EHBDRO CC[C@@H]1CCC[C@H]1[NH2+][C@@H](C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000279239363 1043639913 /nfs/dbraw/zinc/63/99/13/1043639913.db2.gz JWOLGSLRJKRMCZ-YWPYICTPSA-N 1 0 330.388 3.874 20 5 EHBDRO C[N@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C(C1CC1)C1CC1 ZINC000728900667 1043786025 /nfs/dbraw/zinc/78/60/25/1043786025.db2.gz OMWQXXCLEASQAN-UHFFFAOYSA-N 1 0 326.400 3.536 20 5 EHBDRO Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])cc1C ZINC001658277486 1126261880 /nfs/dbraw/zinc/26/18/80/1126261880.db2.gz VJBRVAQFBYPHPR-KRWDZBQOSA-N 1 0 348.830 3.558 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000072756342 1126874500 /nfs/dbraw/zinc/87/45/00/1126874500.db2.gz BQZRLDMKRMGCIG-RBUKOAKNSA-N 1 0 326.396 3.913 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1[N+](=O)[O-] ZINC000765421464 1127609729 /nfs/dbraw/zinc/60/97/29/1127609729.db2.gz SPJGWSSQPITCQF-LBPRGKRZSA-N 1 0 345.355 3.671 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+](C3CCCC3)C2)c2ncccc12 ZINC000301404587 1127742141 /nfs/dbraw/zinc/74/21/41/1127742141.db2.gz SSEKZXRKSRNZFI-CYBMUJFWSA-N 1 0 326.400 3.572 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@@H]1C[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC001168553467 1127751280 /nfs/dbraw/zinc/75/12/80/1127751280.db2.gz RLBZXSKKQMDBOO-NUEKZKHPSA-N 1 0 334.416 3.533 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571447 1128105059 /nfs/dbraw/zinc/10/50/59/1128105059.db2.gz REQQJRMIDGTPNJ-QWRGUYRKSA-N 1 0 344.358 3.683 20 5 EHBDRO Cc1cc(N2CCC(C[NH+]3CCCC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000301452055 1128379744 /nfs/dbraw/zinc/37/97/44/1128379744.db2.gz UIXOSBDYFIEQTH-UHFFFAOYSA-N 1 0 337.851 3.869 20 5 EHBDRO CC(=O)c1cc(NCCC[N@H+]2C[C@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000553297684 1128406102 /nfs/dbraw/zinc/40/61/02/1128406102.db2.gz HIAUHYGASVKTMT-OKILXGFUSA-N 1 0 333.432 3.577 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1 ZINC000326686163 1128430197 /nfs/dbraw/zinc/43/01/97/1128430197.db2.gz IUXMHICALQSZCN-OTWHNJEPSA-N 1 0 332.444 3.543 20 5 EHBDRO COc1ccccc1[C@H](CNc1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC000301591860 1128508946 /nfs/dbraw/zinc/50/89/46/1128508946.db2.gz ZIMRKQKYBZKPIL-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H](CC2CC2)c2ccccc2)cc1 ZINC000765845585 1128545274 /nfs/dbraw/zinc/54/52/74/1128545274.db2.gz QWJOPDIZOXKEDK-OALUTQOASA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC1CC[NH+](C2CCCCC2)CC1 ZINC000153890930 1128836229 /nfs/dbraw/zinc/83/62/29/1128836229.db2.gz CNEAXYNBXAGWAV-UHFFFAOYSA-N 1 0 338.839 3.852 20 5 EHBDRO Cc1nc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ccc1[N+](=O)[O-] ZINC000301651004 1128849488 /nfs/dbraw/zinc/84/94/88/1128849488.db2.gz JUODLXGCXRDQAN-DYVFJYSZSA-N 1 0 346.456 3.855 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000542929756 1128855878 /nfs/dbraw/zinc/85/58/78/1128855878.db2.gz GYBBSAGJJOBKQV-AWEZNQCLSA-N 1 0 325.840 3.554 20 5 EHBDRO CC1(C)CN(Cc2csc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000609196395 1120544320 /nfs/dbraw/zinc/54/43/20/1120544320.db2.gz OGALGCRUCWIJKB-UHFFFAOYSA-N 1 0 345.468 3.753 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC[C@H](C)CO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542496406 1120758635 /nfs/dbraw/zinc/75/86/35/1120758635.db2.gz PQTSZOTVRPDGHM-LIRRHRJNSA-N 1 0 346.427 3.838 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)C1CCCCC1 ZINC000542533563 1120933371 /nfs/dbraw/zinc/93/33/71/1120933371.db2.gz UDHXTSOXLREZJZ-ZIAGYGMSSA-N 1 0 333.432 3.728 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c(C(F)(F)F)c1)c1ccco1 ZINC000301055994 1121197233 /nfs/dbraw/zinc/19/72/33/1121197233.db2.gz IREGUTUSOIJIOC-ZDUSSCGKSA-N 1 0 343.305 3.921 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301057352 1121203234 /nfs/dbraw/zinc/20/32/34/1121203234.db2.gz BBYYIQWOAXWXMS-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CC(C)N(CC(=O)Nc1ccccc1F)Cc1ccc([N+](=O)[O-])cc1 ZINC000193508019 1121371874 /nfs/dbraw/zinc/37/18/74/1121371874.db2.gz CYSOSXMHXFKUOK-UHFFFAOYSA-N 1 0 345.374 3.583 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)C[NH+]1CCCCC1 ZINC000301103019 1121704949 /nfs/dbraw/zinc/70/49/49/1121704949.db2.gz RCACLLRTYUXJQK-CQSZACIVSA-N 1 0 328.416 3.677 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000130942101 1129007442 /nfs/dbraw/zinc/00/74/42/1129007442.db2.gz SCRZCZNSPCWDQL-QGZVFWFLSA-N 1 0 342.399 3.716 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cc1 ZINC000609234516 1121859682 /nfs/dbraw/zinc/85/96/82/1121859682.db2.gz TXCICFYAXWBQJH-LJQANCHMSA-N 1 0 326.396 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ccccc2)c2ccccn2)cc1 ZINC000326435869 1121942423 /nfs/dbraw/zinc/94/24/23/1121942423.db2.gz XSBDVODAGNDQSK-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(NC(=O)C(C)C)cc2)cccc1[N+](=O)[O-] ZINC000917134654 1122529369 /nfs/dbraw/zinc/52/93/69/1122529369.db2.gz ICFZEFPJELYIIT-UHFFFAOYSA-N 1 0 341.411 3.788 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@@H](C)[N@@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC000154339666 1122564530 /nfs/dbraw/zinc/56/45/30/1122564530.db2.gz XMVIHCHCPFVECL-MDYRTPRTSA-N 1 0 340.423 3.815 20 5 EHBDRO COc1cccc(N2CCC(CCC[NH+]3CCCC3)CC2)c1[N+](=O)[O-] ZINC000497564043 1122589396 /nfs/dbraw/zinc/58/93/96/1122589396.db2.gz JEQCFDGHJZYSML-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO CC1CCC([N@H+](Cn2ncc3cc([N+](=O)[O-])ccc32)C2CC2)CC1 ZINC000917438428 1122602501 /nfs/dbraw/zinc/60/25/01/1122602501.db2.gz QIFMFGMUOICDPM-UHFFFAOYSA-N 1 0 328.416 3.945 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000917454074 1122611150 /nfs/dbraw/zinc/61/11/50/1122611150.db2.gz HNKPORXRMHVWPY-UHFFFAOYSA-N 1 0 331.420 3.569 20 5 EHBDRO C[N@H+](Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@@H]1CCOC1 ZINC000132140224 1129075697 /nfs/dbraw/zinc/07/56/97/1129075697.db2.gz AAHOKDRFKIZMHL-OAHLLOKOSA-N 1 0 346.358 3.747 20 5 EHBDRO O=C(Nc1ccc(C[NH+]2CCCCCC2)cc1)c1ccc([N+](=O)[O-])o1 ZINC000195128648 1123160647 /nfs/dbraw/zinc/16/06/47/1123160647.db2.gz ZMAZKZSHNBAUAS-UHFFFAOYSA-N 1 0 343.383 3.816 20 5 EHBDRO CC(C)C(C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000556892182 1123176959 /nfs/dbraw/zinc/17/69/59/1123176959.db2.gz IPEOHBDNHBHVJW-SFHVURJKSA-N 1 0 344.459 3.936 20 5 EHBDRO CC[C@H]1c2ccccc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609625622 1123627937 /nfs/dbraw/zinc/62/79/37/1123627937.db2.gz CXKDLVUASJAOFQ-KRWDZBQOSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[nH]n1 ZINC000610009948 1123712958 /nfs/dbraw/zinc/71/29/58/1123712958.db2.gz JHBGLJACZUSOSD-UHFFFAOYSA-N 1 0 328.397 3.645 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1OCCc2ccccc21 ZINC000615724304 1123863942 /nfs/dbraw/zinc/86/39/42/1123863942.db2.gz YOASTLRVAMAYEU-UMDONVSZSA-N 1 0 338.407 3.902 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000615724302 1123864010 /nfs/dbraw/zinc/86/40/10/1123864010.db2.gz YOASTLRVAMAYEU-RNTFSAEZSA-N 1 0 338.407 3.902 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000615837656 1123884733 /nfs/dbraw/zinc/88/47/33/1123884733.db2.gz UPZHNPPLYLOFAU-HAZIXKIPSA-N 1 0 330.428 3.747 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000615837662 1123885325 /nfs/dbraw/zinc/88/53/25/1123885325.db2.gz UPZHNPPLYLOFAU-OTMARIDSSA-N 1 0 330.428 3.747 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)CN1CCC[C@@]2(CC=CCC2)C1 ZINC000114494586 1129152384 /nfs/dbraw/zinc/15/23/84/1129152384.db2.gz YOWJKMFTCGJXMQ-IBGZPJMESA-N 1 0 343.427 3.664 20 5 EHBDRO C[C@H](C[C@H](C)O)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000543063780 1129175237 /nfs/dbraw/zinc/17/52/37/1129175237.db2.gz OZFWUVGHQFHNPH-CABCVRRESA-N 1 0 343.427 3.612 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000734829743 1131283785 /nfs/dbraw/zinc/28/37/85/1131283785.db2.gz XNGLIAYIMMPKDM-UHFFFAOYSA-N 1 0 343.431 3.569 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)[C@H]2CCCO[C@H]21 ZINC000618569918 1125115000 /nfs/dbraw/zinc/11/50/00/1125115000.db2.gz GZYIPTVNKOBTOD-VDHUWJSZSA-N 1 0 330.428 3.765 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000618615627 1125134816 /nfs/dbraw/zinc/13/48/16/1125134816.db2.gz GNAWUGYOVHQUQB-KDOFPFPSSA-N 1 0 340.423 3.769 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000446843445 1125334979 /nfs/dbraw/zinc/33/49/79/1125334979.db2.gz NNLUWKOSCRDPHK-JBXOJTMHSA-N 1 0 340.427 3.611 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccsc1 ZINC000619754105 1125395119 /nfs/dbraw/zinc/39/51/19/1125395119.db2.gz CHUQBCSSMZUQEO-VXGBXAGGSA-N 1 0 333.413 3.724 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c(Cl)c1 ZINC000301263325 1125432718 /nfs/dbraw/zinc/43/27/18/1125432718.db2.gz GXKRVYLIQBXQQR-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO CCOC(=O)CC[C@@H]1CCC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000255687114 1129180691 /nfs/dbraw/zinc/18/06/91/1129180691.db2.gz SBJSPKZBTVGACV-HWYHOQROSA-N 1 0 346.427 3.663 20 5 EHBDRO C[NH+](C)Cc1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000301882052 1129265272 /nfs/dbraw/zinc/26/52/72/1129265272.db2.gz MNGGDTNAYPNTFG-UHFFFAOYSA-N 1 0 339.317 3.686 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(Cl)c2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000079723986 1129289763 /nfs/dbraw/zinc/28/97/63/1129289763.db2.gz HXZJONFXGSFGDQ-NSHDSACASA-N 1 0 348.786 3.870 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C)[C@@H]2c2ccc(Cl)cc2)ncc1[N+](=O)[O-] ZINC000301894154 1129290967 /nfs/dbraw/zinc/29/09/67/1129290967.db2.gz WWEOAMCRNSXCSQ-WMLDXEAASA-N 1 0 346.818 3.809 20 5 EHBDRO CC(C)OCCC[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000265840338 1129363490 /nfs/dbraw/zinc/36/34/90/1129363490.db2.gz GANIEMNYZZGMAJ-UHFFFAOYSA-N 1 0 347.415 3.539 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430328 1129412015 /nfs/dbraw/zinc/41/20/15/1129412015.db2.gz WIDHFSHWPBAXQF-IAGOWNOFSA-N 1 0 349.475 3.594 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)CC1CCCC1 ZINC000466418517 1129438222 /nfs/dbraw/zinc/43/82/22/1129438222.db2.gz YKTBXQYEJCQQQJ-IDGGIGOKSA-N 1 0 332.444 3.777 20 5 EHBDRO CCOc1cccc(NC[C@@H](c2ccccc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000543398087 1129460180 /nfs/dbraw/zinc/46/01/80/1129460180.db2.gz JQHLDPVDBSFRIJ-INIZCTEOSA-N 1 0 329.400 3.708 20 5 EHBDRO O=[N+]([O-])c1ccsc1NC[C@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301974780 1129466041 /nfs/dbraw/zinc/46/60/41/1129466041.db2.gz BBSLKGWBCGOOFQ-OAHLLOKOSA-N 1 0 331.441 3.633 20 5 EHBDRO COc1ccccc1CC[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000154546493 1129568588 /nfs/dbraw/zinc/56/85/88/1129568588.db2.gz OLRKODYXCMCNRT-GOSISDBHSA-N 1 0 340.423 3.757 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)c2ccc(CC)c([N+](=O)[O-])c2)c1 ZINC000124004181 1129573113 /nfs/dbraw/zinc/57/31/13/1129573113.db2.gz YLIALGCKBWVRQI-UHFFFAOYSA-N 1 0 327.384 3.519 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CN(Cc2ccccc2)C[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000389865027 1129593072 /nfs/dbraw/zinc/59/30/72/1129593072.db2.gz KMRRIXCTNHMWSU-GQIGUUNPSA-N 1 0 339.439 3.766 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597657 1129595456 /nfs/dbraw/zinc/59/54/56/1129595456.db2.gz KFJUTCWZINSJEH-KRWDZBQOSA-N 1 0 331.460 3.636 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124766186 1129632099 /nfs/dbraw/zinc/63/20/99/1129632099.db2.gz MJVFNPVQPBLENV-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO CC[NH+](CC)[C@H](CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000393178416 1129737798 /nfs/dbraw/zinc/73/77/98/1129737798.db2.gz SECTUPWONDWFOS-LJQANCHMSA-N 1 0 345.418 3.907 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000126293467 1129743355 /nfs/dbraw/zinc/74/33/55/1129743355.db2.gz FJGRURPMLSFXQJ-KRWDZBQOSA-N 1 0 345.374 3.803 20 5 EHBDRO Cc1cc(N2CC[C@]3(O)CCCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302066814 1129766064 /nfs/dbraw/zinc/76/60/64/1129766064.db2.gz FKQBODPHPLSWKL-AUUYWEPGSA-N 1 0 341.411 3.583 20 5 EHBDRO Cc1cc(N[C@H]2CCN(c3ccccn3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092074 1129767644 /nfs/dbraw/zinc/76/76/44/1129767644.db2.gz QAAYOFWGKYLXGO-AWEZNQCLSA-N 1 0 349.394 3.537 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(Nc2ncc([N+](=O)[O-])cn2)cc1 ZINC000302159533 1129770819 /nfs/dbraw/zinc/77/08/19/1129770819.db2.gz ONNNCLCCSKJVNR-ZDUSSCGKSA-N 1 0 327.388 3.503 20 5 EHBDRO Cc1cc(NCCc2cn3ccccc3n2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302183791 1129771725 /nfs/dbraw/zinc/77/17/25/1129771725.db2.gz OPKPKIRTKGAURN-UHFFFAOYSA-N 1 0 347.378 3.754 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196348 1129805643 /nfs/dbraw/zinc/80/56/43/1129805643.db2.gz NSKJMSZBBOGRFI-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCc1ccc(Br)s1 ZINC000227440172 1129907572 /nfs/dbraw/zinc/90/75/72/1129907572.db2.gz ASCYUFZRVPOXMJ-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO CC[C@@H]([NH2+]CCCCNc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000162899138 1129911058 /nfs/dbraw/zinc/91/10/58/1129911058.db2.gz RJEIKEOGVMMPND-QGZVFWFLSA-N 1 0 328.416 3.923 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN2CCc3sccc3C2)cc1[N+](=O)[O-] ZINC000132855987 1129920812 /nfs/dbraw/zinc/92/08/12/1129920812.db2.gz FNJBOKMRBJJETI-AWEZNQCLSA-N 1 0 345.468 3.674 20 5 EHBDRO COCCC[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000282477046 1129921354 /nfs/dbraw/zinc/92/13/54/1129921354.db2.gz WRVAEMCXVIVORU-QGZVFWFLSA-N 1 0 332.375 3.991 20 5 EHBDRO CC[C@H]([NH2+]CCN1CCc2sccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000132883958 1129921635 /nfs/dbraw/zinc/92/16/35/1129921635.db2.gz ITHWGKBAZYUNRN-KRWDZBQOSA-N 1 0 345.468 3.755 20 5 EHBDRO CC[NH+](CC)Cc1ccccc1CNc1ncc([N+](=O)[O-])cc1C ZINC000076664755 1129975813 /nfs/dbraw/zinc/97/58/13/1129975813.db2.gz ZXNBHLMAIMEUMQ-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO COC[C@@H]1CCCCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)C1 ZINC000466632229 1129993716 /nfs/dbraw/zinc/99/37/16/1129993716.db2.gz DZGUBOPKZJJVNT-CQSZACIVSA-N 1 0 329.400 3.704 20 5 EHBDRO Cc1ccnc(NCc2ccccc2C[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000172277359 1130120149 /nfs/dbraw/zinc/12/01/49/1130120149.db2.gz DGFAYEVNYUEXQG-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)cs1 ZINC000173985025 1130327744 /nfs/dbraw/zinc/32/77/44/1130327744.db2.gz GDADBKFBDACWIW-HNNXBMFYSA-N 1 0 332.425 3.695 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000174200804 1130340708 /nfs/dbraw/zinc/34/07/08/1130340708.db2.gz AXDGODWIZOQRKZ-QGZVFWFLSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2Cc3ccccc3C[C@@H]2c2ccccc2)c1 ZINC000174878150 1130389887 /nfs/dbraw/zinc/38/98/87/1130389887.db2.gz KVFZCBRWCCSRSM-HXUWFJFHSA-N 1 0 348.406 3.591 20 5 EHBDRO C[C@@H](c1ccccc1)N1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000246834627 1130417234 /nfs/dbraw/zinc/41/72/34/1130417234.db2.gz LCHMBGLOCYKIQB-QFBILLFUSA-N 1 0 339.439 3.562 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])cc1F)C1CC[NH+](Cc2ccccc2)CC1 ZINC000733302256 1131019124 /nfs/dbraw/zinc/01/91/24/1131019124.db2.gz KUSATAGNNZMBDJ-UHFFFAOYSA-N 1 0 343.402 3.835 20 5 EHBDRO CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC001168766496 1131037754 /nfs/dbraw/zinc/03/77/54/1131037754.db2.gz SQGXRLJHXKZWRH-LJQANCHMSA-N 1 0 346.402 3.970 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@H]1C ZINC000740881338 1131553199 /nfs/dbraw/zinc/55/31/99/1131553199.db2.gz AJXPUBJYJHEEDN-OCCSQVGLSA-N 1 0 325.840 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cncc(Cl)c1)CC2 ZINC001172899549 1131882318 /nfs/dbraw/zinc/88/23/18/1131882318.db2.gz CNBAHWHYQANMFF-MRXNPFEDSA-N 1 0 331.803 3.680 20 5 EHBDRO Cc1csc([C@@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172898995 1131883023 /nfs/dbraw/zinc/88/30/23/1131883023.db2.gz KJIWLGTUXOCGCO-DOMZBBRYSA-N 1 0 331.441 3.958 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(N)cc1 ZINC001172901394 1131883922 /nfs/dbraw/zinc/88/39/22/1131883922.db2.gz IBDIWNOQBZUCMD-FZKQIMNGSA-N 1 0 325.412 3.775 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1F ZINC001172902555 1131884745 /nfs/dbraw/zinc/88/47/45/1131884745.db2.gz ZTUXPBQFAHNPAB-MRXNPFEDSA-N 1 0 344.386 3.780 20 5 EHBDRO CCOC1CCC([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903760 1131886988 /nfs/dbraw/zinc/88/69/88/1131886988.db2.gz ICUCQASFHASXKB-LRYGQEGESA-N 1 0 332.444 3.780 20 5 EHBDRO COc1ccccc1C[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908358 1131888454 /nfs/dbraw/zinc/88/84/54/1131888454.db2.gz CGTKGFPCPUMYKD-SFHVURJKSA-N 1 0 340.423 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CC(Oc3ccccc3)C1)CC2 ZINC001172914298 1131902451 /nfs/dbraw/zinc/90/24/51/1131902451.db2.gz GNOAZHQGRNBIOF-KRWDZBQOSA-N 1 0 338.407 3.605 20 5 EHBDRO COCC[C@H]1CCCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914776 1131903251 /nfs/dbraw/zinc/90/32/51/1131903251.db2.gz ISFWITFZGABKJF-QZTJIDSGSA-N 1 0 332.444 3.733 20 5 EHBDRO CC1(C)C[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC(C)(C)O1 ZINC001172921914 1131905300 /nfs/dbraw/zinc/90/53/00/1131905300.db2.gz VQELJXGVTBJUDW-MRXNPFEDSA-N 1 0 332.444 3.732 20 5 EHBDRO CCC[N@H+](C1CCOCC1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922587 1131906861 /nfs/dbraw/zinc/90/68/61/1131906861.db2.gz YYFRTNICJWEKKV-QGZVFWFLSA-N 1 0 332.444 3.733 20 5 EHBDRO C[C@H](CN1CCC(C)CC1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913494 1131919086 /nfs/dbraw/zinc/91/90/86/1131919086.db2.gz WJEOTRIREBCRGR-APWZRJJASA-N 1 0 345.487 3.552 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2ccsc2)c1F ZINC001173180887 1131992115 /nfs/dbraw/zinc/99/21/15/1131992115.db2.gz YXDUEFPUGIJDJZ-NSHDSACASA-N 1 0 338.404 3.567 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2cccc(C)n2)c1F ZINC001173188035 1131993424 /nfs/dbraw/zinc/99/34/24/1131993424.db2.gz HYLOYPCRNVIIBO-OLZOCXBDSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1F ZINC001173187393 1131994199 /nfs/dbraw/zinc/99/41/99/1131994199.db2.gz FEJPJSABGBFMBO-GHMZBOCLSA-N 1 0 346.349 3.841 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)[C@@H](O)c1ccc(Cl)cc1 ZINC001173220157 1132003150 /nfs/dbraw/zinc/00/31/50/1132003150.db2.gz VAXNFGMHZZTCCP-FHSNZYRGSA-N 1 0 348.830 3.891 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cnc(Cl)s1 ZINC001173224351 1132005308 /nfs/dbraw/zinc/00/53/08/1132005308.db2.gz DWOVPAMMJBMARF-SNVBAGLBSA-N 1 0 325.821 3.768 20 5 EHBDRO COc1ccc(CC2([NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173226219 1132006430 /nfs/dbraw/zinc/00/64/30/1132006430.db2.gz WDMCVOJBEBTWBV-HNNXBMFYSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-c2ncco2)cc1 ZINC001173231417 1132009104 /nfs/dbraw/zinc/00/91/04/1132009104.db2.gz ZAXVKAUIGKGXRO-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230668 1132009537 /nfs/dbraw/zinc/00/95/37/1132009537.db2.gz TYHPNKMEALALBU-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(C[NH+]3CCCCC3)CC2)c(Cl)c1 ZINC000744171312 1132037235 /nfs/dbraw/zinc/03/72/35/1132037235.db2.gz JRLPOVQJAHTVDW-UHFFFAOYSA-N 1 0 337.851 3.951 20 5 EHBDRO CCC[N@@H+](Cc1ccc(F)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000746034536 1132351341 /nfs/dbraw/zinc/35/13/41/1132351341.db2.gz UHVKJXUNEZNVKZ-UHFFFAOYSA-N 1 0 342.374 3.953 20 5 EHBDRO C[C@@H](C(=O)OCc1cc(Cl)ccc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000746076759 1132360824 /nfs/dbraw/zinc/36/08/24/1132360824.db2.gz PNMGMYFHMMPBDV-UTUOFQBUSA-N 1 0 340.807 3.553 20 5 EHBDRO [NH3+]Cc1cc2cc(Cl)ccc2n1-c1ncc(Cl)cc1[N+](=O)[O-] ZINC001155990313 1132429933 /nfs/dbraw/zinc/42/99/33/1132429933.db2.gz XXGKHXTXBWLGMW-UHFFFAOYSA-N 1 0 337.166 3.699 20 5 EHBDRO CN(c1ccc([N+](=O)[O-])cc1)[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000746391176 1132507123 /nfs/dbraw/zinc/50/71/23/1132507123.db2.gz ZKUBBCOMKVOUQV-LJQANCHMSA-N 1 0 325.412 3.696 20 5 EHBDRO CCC(CC)CCC[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC001174949218 1132515585 /nfs/dbraw/zinc/51/55/85/1132515585.db2.gz WBOYMOOPBHFWCV-UHFFFAOYSA-N 1 0 335.448 3.990 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001168956344 1132620409 /nfs/dbraw/zinc/62/04/09/1132620409.db2.gz AXRQLSSOQZCFCA-JOYOIKCWSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC001168966797 1132621780 /nfs/dbraw/zinc/62/17/80/1132621780.db2.gz LFPZFNHTVUYULP-OALUTQOASA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccnc(F)c3)c(F)c2)C1 ZINC001168970884 1132622814 /nfs/dbraw/zinc/62/28/14/1132622814.db2.gz JDIOQORHVFCEHP-HIFRSBDPSA-N 1 0 347.365 3.562 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccncc2C(F)(F)F)C2CC2)C1 ZINC001168997168 1132627365 /nfs/dbraw/zinc/62/73/65/1132627365.db2.gz BUEUFORJBUVEIR-IFUGULHKSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(Br)cc2Cl)C1 ZINC001169005421 1132630042 /nfs/dbraw/zinc/63/00/42/1132630042.db2.gz UDTMXBXWMDNCKG-JOYOIKCWSA-N 1 0 347.640 3.638 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(OC(F)(F)F)cc1 ZINC001168986674 1132633796 /nfs/dbraw/zinc/63/37/96/1132633796.db2.gz YGHBOMBLAWUNNW-MDZLAQPJSA-N 1 0 332.322 3.681 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168990237 1132634508 /nfs/dbraw/zinc/63/45/08/1132634508.db2.gz YUOIIIBSAMEHOZ-RRFJBIMHSA-N 1 0 330.432 3.700 20 5 EHBDRO CCCC[N@H+](CCn1ccc([N+](=O)[O-])n1)Cc1c(C)oc(C)c1C ZINC001176364866 1132922711 /nfs/dbraw/zinc/92/27/11/1132922711.db2.gz IBOFVOFMXPKANA-UHFFFAOYSA-N 1 0 334.420 3.612 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NCCCC[N@H+]1CCC[C@@H](C)C1 ZINC000804351540 1132985006 /nfs/dbraw/zinc/98/50/06/1132985006.db2.gz BYPNHNBQJLPXNV-CQSZACIVSA-N 1 0 333.432 3.721 20 5 EHBDRO O=[N+]([O-])c1cccc(CN2CC=C(c3ccc(Cl)nc3)CC2)c1 ZINC000773667048 1133064461 /nfs/dbraw/zinc/06/44/61/1133064461.db2.gz KLKZNJZTWWGKMP-UHFFFAOYSA-N 1 0 329.787 3.933 20 5 EHBDRO C[C@@]1(Cc2ccccc2)CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936026 1133072399 /nfs/dbraw/zinc/07/23/99/1133072399.db2.gz OJGMATXFUBRMSZ-UXHICEINSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2cccc(-c3ccccn3)c2)cc1 ZINC001177683666 1133091411 /nfs/dbraw/zinc/09/14/11/1133091411.db2.gz NZNVLSMBRUALEL-UHFFFAOYSA-N 1 0 349.390 3.825 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000769246257 1133250699 /nfs/dbraw/zinc/25/06/99/1133250699.db2.gz YOWMXNWIGUYFLE-UYAOXDASSA-N 1 0 340.423 3.991 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cnc2ccc(Cl)cn12)c1ccccc1[N+](=O)[O-] ZINC001179685347 1133270892 /nfs/dbraw/zinc/27/08/92/1133270892.db2.gz KNQQWNBCXAVWFQ-LBPRGKRZSA-N 1 0 344.802 3.789 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)CC(C)(C)Oc1ccccc1 ZINC001181154981 1133460699 /nfs/dbraw/zinc/46/06/99/1133460699.db2.gz XOKHHUXHTRCHDJ-UHFFFAOYSA-N 1 0 328.412 3.927 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000774160817 1133625487 /nfs/dbraw/zinc/62/54/87/1133625487.db2.gz BNLWCBXRGGXWII-SFHVURJKSA-N 1 0 341.367 3.713 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H]1COC2(CCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000774480627 1133687259 /nfs/dbraw/zinc/68/72/59/1133687259.db2.gz WXGIIFHFKJWFPD-IRXDYDNUSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(NC3CCC([NH+]4CCCCC4)CC3)nc2c1 ZINC000774667028 1133848348 /nfs/dbraw/zinc/84/83/48/1133848348.db2.gz LTSNKALGKXBQBV-UHFFFAOYSA-N 1 0 343.431 3.680 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@](C)(O)c1ccccc1 ZINC000786820176 1133911448 /nfs/dbraw/zinc/91/14/48/1133911448.db2.gz GLCMDCAWWQZLLR-QTXHJTIISA-N 1 0 340.423 3.886 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1C[C@@H]1C1CCCC1 ZINC001184373623 1133932914 /nfs/dbraw/zinc/93/29/14/1133932914.db2.gz BLDGLYGNMBLKDL-QIIPPGSGSA-N 1 0 345.443 3.728 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826211 1134026819 /nfs/dbraw/zinc/02/68/19/1134026819.db2.gz LYFBRKSBJYRBIJ-MRXNPFEDSA-N 1 0 341.367 3.710 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000788077552 1134077359 /nfs/dbraw/zinc/07/73/59/1134077359.db2.gz MMGYJZLMJUFPGY-UHFFFAOYSA-N 1 0 334.445 3.517 20 5 EHBDRO C[C@H]1[C@@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907257 1134115683 /nfs/dbraw/zinc/11/56/83/1134115683.db2.gz GHVBJHIXGZQUFS-GUYCJALGSA-N 1 0 341.367 3.881 20 5 EHBDRO Cc1cccc(CN(CC[NH+](C)C)c2ccc([N+](=O)[O-])cc2F)c1 ZINC001185694070 1134120552 /nfs/dbraw/zinc/12/05/52/1134120552.db2.gz XSIIREHLRKGJMX-UHFFFAOYSA-N 1 0 331.391 3.611 20 5 EHBDRO Cc1cccc2c1OCC[C@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788775626 1134173879 /nfs/dbraw/zinc/17/38/79/1134173879.db2.gz IUZBPMCXAVNRDE-MLGOLLRUSA-N 1 0 327.384 3.660 20 5 EHBDRO C[C@H]([NH2+][C@@H]1Cc2ccc(Cl)cc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788825769 1134178115 /nfs/dbraw/zinc/17/81/15/1134178115.db2.gz ZOKXQCYOEZJEII-ZUZCIYMTSA-N 1 0 331.803 3.648 20 5 EHBDRO C[NH+](C)CC(C)(C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC001186639733 1134241301 /nfs/dbraw/zinc/24/13/01/1134241301.db2.gz NMTZLVXHCTWNJW-UHFFFAOYSA-N 1 0 341.411 3.578 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@@H]4CCCC[C@@H]4C3)nc2c1 ZINC000775180552 1134484009 /nfs/dbraw/zinc/48/40/09/1134484009.db2.gz ZZCMDSVIHPIGPF-BFHYXJOUSA-N 1 0 328.416 3.920 20 5 EHBDRO CC(C)(C)C[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000747077154 1134694347 /nfs/dbraw/zinc/69/43/47/1134694347.db2.gz RVLPNQYTWZXNIE-INIZCTEOSA-N 1 0 343.431 3.711 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001170299276 1134738472 /nfs/dbraw/zinc/73/84/72/1134738472.db2.gz UNPWERXIEAXQPY-MRXNPFEDSA-N 1 0 342.439 3.984 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(C)cn2)c([N+](=O)[O-])c1 ZINC001170306427 1134738938 /nfs/dbraw/zinc/73/89/38/1134738938.db2.gz UWYLLMMTZMRZFI-ZIAGYGMSSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344942 1134758885 /nfs/dbraw/zinc/75/88/85/1134758885.db2.gz FSOCCLMTBDCXFX-DGCLKSJQSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170347091 1134759487 /nfs/dbraw/zinc/75/94/87/1134759487.db2.gz QCDNSUIFYCCBNI-OAHLLOKOSA-N 1 0 340.423 3.983 20 5 EHBDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386073 1134762605 /nfs/dbraw/zinc/76/26/05/1134762605.db2.gz MJQXZTJMKUYTKS-GJZGRUSLSA-N 1 0 326.824 3.930 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[NH2+][C@H](c1ccccc1)C1CCOCC1 ZINC000775437377 1134795875 /nfs/dbraw/zinc/79/58/75/1134795875.db2.gz APMZTOVWVGOFEI-LJQANCHMSA-N 1 0 344.386 3.991 20 5 EHBDRO CO[C@@]1(C)C[C@@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204366 1134815241 /nfs/dbraw/zinc/81/52/41/1134815241.db2.gz SQTXHELUKBAAOM-ZBFHGGJFSA-N 1 0 326.824 3.884 20 5 EHBDRO COC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCCC1 ZINC000775562061 1135091186 /nfs/dbraw/zinc/09/11/86/1135091186.db2.gz BLRUXTDVPWJIPJ-UHFFFAOYSA-N 1 0 347.459 3.503 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000775568707 1135095926 /nfs/dbraw/zinc/09/59/26/1135095926.db2.gz PUHSZCBCSXZTRD-CQSZACIVSA-N 1 0 328.412 3.981 20 5 EHBDRO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC1CCC([NH+]2CCCCC2)CC1 ZINC000804538182 1135116069 /nfs/dbraw/zinc/11/60/69/1135116069.db2.gz LSDJWQJVNJYXKX-UHFFFAOYSA-N 1 0 348.403 3.712 20 5 EHBDRO C[NH+](C)CCc1ccc(CNc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000804645160 1135151059 /nfs/dbraw/zinc/15/10/59/1135151059.db2.gz RFVXFRGYUWJXNQ-UHFFFAOYSA-N 1 0 333.819 3.964 20 5 EHBDRO COCC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@H](C)C1 ZINC001193974791 1135208251 /nfs/dbraw/zinc/20/82/51/1135208251.db2.gz CKHAOLVFLRTEFN-WFASDCNBSA-N 1 0 326.824 3.885 20 5 EHBDRO CC[C@H]1C[N@H+](CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325122 1135257031 /nfs/dbraw/zinc/25/70/31/1135257031.db2.gz QCTLGZVJTYAVNA-ZDUSSCGKSA-N 1 0 345.365 3.530 20 5 EHBDRO CC[C@@H](c1ccccc1OC)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834344 1135332612 /nfs/dbraw/zinc/33/26/12/1135332612.db2.gz FWOAMEDKWYVDSD-ROUUACIJSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@@H](C2CCCC2)C1 ZINC001195305312 1135410191 /nfs/dbraw/zinc/41/01/91/1135410191.db2.gz BOJPSZNUJBIURB-MRXNPFEDSA-N 1 0 345.443 3.744 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@](C)(c2cccc(F)c2)C1 ZINC001195851590 1135475474 /nfs/dbraw/zinc/47/54/74/1135475474.db2.gz LQBBESJWKNJXLI-LJQANCHMSA-N 1 0 344.386 3.906 20 5 EHBDRO CCCC[C@@H](C)[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000810125323 1135923937 /nfs/dbraw/zinc/92/39/37/1135923937.db2.gz UAZLBYOOLZEISB-GFCCVEGCSA-N 1 0 325.384 3.573 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000776173128 1136021328 /nfs/dbraw/zinc/02/13/28/1136021328.db2.gz ZGNNRSXZXZQAAP-IRXDYDNUSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCOCC1CCC1 ZINC000811489416 1136092838 /nfs/dbraw/zinc/09/28/38/1136092838.db2.gz DAUBZGNEYAYPLK-UHFFFAOYSA-N 1 0 333.215 3.808 20 5 EHBDRO CCC(O)(CC)CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811493175 1136093554 /nfs/dbraw/zinc/09/35/54/1136093554.db2.gz FVXFKRJQOZMKOD-UHFFFAOYSA-N 1 0 335.231 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c1 ZINC000776252649 1136101846 /nfs/dbraw/zinc/10/18/46/1136101846.db2.gz VJRKOVPMYLCWCY-NUEKZKHPSA-N 1 0 336.819 3.686 20 5 EHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277950 1136130996 /nfs/dbraw/zinc/13/09/96/1136130996.db2.gz RCXCWRVQXBIEEE-MOPGFXCFSA-N 1 0 326.396 3.774 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(c3ccccc3)CCCC2)cc1 ZINC000776279896 1136134037 /nfs/dbraw/zinc/13/40/37/1136134037.db2.gz YTBWBQRSBMCDGX-IBGZPJMESA-N 1 0 340.423 3.730 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000850385616 1136247049 /nfs/dbraw/zinc/24/70/49/1136247049.db2.gz IOHUZHCFRMLPPH-SJLPKXTDSA-N 1 0 325.412 3.799 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@](C)(O)c1ccccc1 ZINC000850477248 1136266864 /nfs/dbraw/zinc/26/68/64/1136266864.db2.gz RVHFBJJGKQXJLT-NJSLBKSFSA-N 1 0 344.411 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583164 1136441934 /nfs/dbraw/zinc/44/19/34/1136441934.db2.gz YPNOSGWVYQUSKZ-ROUUACIJSA-N 1 0 348.349 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@@H](c3ccc(Cl)cc3)C2)cc1 ZINC000776583102 1136441985 /nfs/dbraw/zinc/44/19/85/1136441985.db2.gz WJNYXEAIAMOZGM-CRAIPNDOSA-N 1 0 346.814 3.771 20 5 EHBDRO CC[C@@H](C)[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579237 1136444159 /nfs/dbraw/zinc/44/41/59/1136444159.db2.gz KAYKLDLKDFZHPI-DNVCBOLYSA-N 1 0 328.412 3.929 20 5 EHBDRO CCC[N@@H+](Cc1ccc(OC)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580010 1136444622 /nfs/dbraw/zinc/44/46/22/1136444622.db2.gz QLDZYKZRYACGCZ-LJQANCHMSA-N 1 0 344.411 3.549 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1cccc(OC)c1 ZINC000776579578 1136444907 /nfs/dbraw/zinc/44/49/07/1136444907.db2.gz NRNUGIQQOYBPDW-AUUYWEPGSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1ccc(C(C)(C)C[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776586920 1136449665 /nfs/dbraw/zinc/44/96/65/1136449665.db2.gz AJAXYPYTNQVEMC-LJQANCHMSA-N 1 0 342.439 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCC[C@@H]2Cc2ccccn2)cc1 ZINC000852567119 1136467336 /nfs/dbraw/zinc/46/73/36/1136467336.db2.gz MPJZVHPROPNRIO-VQIMIIECSA-N 1 0 325.412 3.533 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)OCc2ccccc2)cc1[N+](=O)[O-] ZINC000776606178 1136471358 /nfs/dbraw/zinc/47/13/58/1136471358.db2.gz SVOCKDCWUVLEQO-OAHLLOKOSA-N 1 0 342.395 3.687 20 5 EHBDRO C[N@@H+](Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C[C@H]1CCc2ccccc21 ZINC000852724737 1136480315 /nfs/dbraw/zinc/48/03/15/1136480315.db2.gz KZFRYYPUVZLYCS-CQSZACIVSA-N 1 0 341.367 3.665 20 5 EHBDRO CSc1ccc([C@@H](CNc2ccc(N)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000814961278 1136532479 /nfs/dbraw/zinc/53/24/79/1136532479.db2.gz YXAXAYZMAGTSPD-QGZVFWFLSA-N 1 0 346.456 3.614 20 5 EHBDRO C[C@H](OC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448825 1136596903 /nfs/dbraw/zinc/59/69/03/1136596903.db2.gz VGJNTCBBHHMVRF-KSSFIOAISA-N 1 0 346.427 3.996 20 5 EHBDRO Cc1ccc(SCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815554650 1136610116 /nfs/dbraw/zinc/61/01/16/1136610116.db2.gz FFFLUURWTUWJFZ-CYBMUJFWSA-N 1 0 331.441 3.928 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815582704 1136614611 /nfs/dbraw/zinc/61/46/11/1136614611.db2.gz NNYRFGCZXXBTIF-ZDUSSCGKSA-N 1 0 341.411 3.817 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H]1Oc2ccccc2[C@H]1C ZINC000815596001 1136616457 /nfs/dbraw/zinc/61/64/57/1136616457.db2.gz HWBZHHOMXHHHDF-VWQQLOEOSA-N 1 0 341.411 3.781 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H]1Oc2ccccc2[C@H]1C ZINC000815596000 1136616487 /nfs/dbraw/zinc/61/64/87/1136616487.db2.gz HWBZHHOMXHHHDF-RJAOAUJVSA-N 1 0 341.411 3.781 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCC[C@H](C)[C@@H]1C ZINC000218478249 1136819332 /nfs/dbraw/zinc/81/93/32/1136819332.db2.gz RBZUSPGXTIJVAZ-DUVNUKRYSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(c3cccc(Cl)c3)CC2)cc1 ZINC000819091329 1136907833 /nfs/dbraw/zinc/90/78/33/1136907833.db2.gz FDYAHTGSDJSKIR-KRWDZBQOSA-N 1 0 346.814 3.603 20 5 EHBDRO Cc1ccc(SC[C@@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819239705 1136923841 /nfs/dbraw/zinc/92/38/41/1136923841.db2.gz VKJRWEDNEJFSQC-KDOFPFPSSA-N 1 0 346.452 3.707 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@@H](Cc3ccccc3)C2)c1 ZINC000819251886 1136924274 /nfs/dbraw/zinc/92/42/74/1136924274.db2.gz VWJRAYKADMIHRJ-ILZDJORESA-N 1 0 340.423 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2C[C@H](c3cccc(Cl)c3)C2)c1 ZINC000819284100 1136927884 /nfs/dbraw/zinc/92/78/84/1136927884.db2.gz XXCKNJGJBKKWDY-QGPMSJSTSA-N 1 0 346.814 3.817 20 5 EHBDRO CSC[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339025013 1137099070 /nfs/dbraw/zinc/09/90/70/1137099070.db2.gz YZSJCXOPLOYQKO-GFCCVEGCSA-N 1 0 334.363 3.941 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@@H]2O)ccc1Cl ZINC000824696255 1137148672 /nfs/dbraw/zinc/14/86/72/1137148672.db2.gz JHCMHNHIVMOSIB-UNEWFSDZSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@H](c3ccncc3)C2)cc1Cl ZINC000824952905 1137158900 /nfs/dbraw/zinc/15/89/00/1137158900.db2.gz FNDGMPKHZJDGOL-YOEHRIQHSA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@H]1C[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)Cc2ccccc21 ZINC000844255978 1137208274 /nfs/dbraw/zinc/20/82/74/1137208274.db2.gz UTSJGJGGZPBURE-AWEZNQCLSA-N 1 0 339.395 3.543 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ccc4nc[nH]c4c3[N+](=O)[O-])c2c1 ZINC001171167539 1137278290 /nfs/dbraw/zinc/27/82/90/1137278290.db2.gz HNVZERKCNDKZDX-GFCCVEGCSA-N 1 0 349.394 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)C2)c(C(F)F)c1 ZINC000865449049 1137284884 /nfs/dbraw/zinc/28/48/84/1137284884.db2.gz SCKZBQHMDOSJNT-CYBMUJFWSA-N 1 0 325.359 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CC3CC3)CC2)c(C(F)F)c1 ZINC000865452223 1137285073 /nfs/dbraw/zinc/28/50/73/1137285073.db2.gz FBQWKGNMHZGXFS-UHFFFAOYSA-N 1 0 325.359 3.819 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000865454576 1137285294 /nfs/dbraw/zinc/28/52/94/1137285294.db2.gz CTOCWEWPCYXJIV-GOSISDBHSA-N 1 0 344.411 3.595 20 5 EHBDRO CCC1([NH+](C)C)CCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000866061417 1137327498 /nfs/dbraw/zinc/32/74/98/1137327498.db2.gz RLRHBHATMQOQGM-UHFFFAOYSA-N 1 0 327.375 3.843 20 5 EHBDRO CCC1([NH+](C)C)CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000866059943 1137327566 /nfs/dbraw/zinc/32/75/66/1137327566.db2.gz WZZKLSYRJWGOQC-UHFFFAOYSA-N 1 0 334.445 3.515 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCNc1ccccn1 ZINC000866255898 1137339975 /nfs/dbraw/zinc/33/99/75/1137339975.db2.gz DDNCMLCZHFASSQ-CQSZACIVSA-N 1 0 346.406 3.542 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000866306984 1137344060 /nfs/dbraw/zinc/34/40/60/1137344060.db2.gz PSWXUMZMPCYTSE-CJNGLKHVSA-N 1 0 336.407 3.746 20 5 EHBDRO CCCc1nc(C)c(C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])o1 ZINC000866364866 1137349743 /nfs/dbraw/zinc/34/97/43/1137349743.db2.gz QLIZIXNZVWQIDK-LLVKDONJSA-N 1 0 335.379 3.704 20 5 EHBDRO CCCC[C@](CC)(Nc1cc2c(cc1[N+](=O)[O-])C[NH2+]C2)C(=O)OCC ZINC001171230865 1137355183 /nfs/dbraw/zinc/35/51/83/1137355183.db2.gz IGHOSZCHNXZSHN-SFHVURJKSA-N 1 0 349.431 3.512 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCC13CCOCC3)CCC2 ZINC000866531412 1137361859 /nfs/dbraw/zinc/36/18/59/1137361859.db2.gz QDXRQXZYOCYEJU-CRAIPNDOSA-N 1 0 330.428 3.769 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282758875 1137446042 /nfs/dbraw/zinc/44/60/42/1137446042.db2.gz OEAROGONXBJEIM-MAUKXSAKSA-N 1 0 332.444 3.855 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1 ZINC000773045274 1137461353 /nfs/dbraw/zinc/46/13/53/1137461353.db2.gz YORLBCMPSRFDGN-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H](O)c1cccc(F)c1 ZINC000773044544 1137461745 /nfs/dbraw/zinc/46/17/45/1137461745.db2.gz WKBAXMNDAJPAOD-TYILLQQXSA-N 1 0 346.402 3.767 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@@H]3SCCS[C@H]23)cccc1[N+](=O)[O-] ZINC000773140355 1137468595 /nfs/dbraw/zinc/46/85/95/1137468595.db2.gz VPDZPVOPQHKYKT-RUAUBTSSSA-N 1 0 338.498 3.933 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(c3ccco3)CC2)cc1 ZINC001171835214 1137515455 /nfs/dbraw/zinc/51/54/55/1137515455.db2.gz UWSUVRMWRYMVKF-UHFFFAOYSA-N 1 0 330.384 3.836 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccco1)N1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872017254 1137564794 /nfs/dbraw/zinc/56/47/94/1137564794.db2.gz XROCXGTWDHKWFH-XJKSGUPXSA-N 1 0 347.390 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)N[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000872024722 1137565626 /nfs/dbraw/zinc/56/56/26/1137565626.db2.gz DMSVBAHCYGUJDE-IHRRRGAJSA-N 1 0 335.473 3.594 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(CF)CCOCC1 ZINC000872077135 1137570056 /nfs/dbraw/zinc/57/00/56/1137570056.db2.gz ZKABCLANZQBDGX-GFCCVEGCSA-N 1 0 342.436 3.734 20 5 EHBDRO C[C@H](CC(=O)N(C)c1ccccc1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129788 1137573105 /nfs/dbraw/zinc/57/31/05/1137573105.db2.gz TZLRSULDVHQSIH-HUUCEWRRSA-N 1 0 341.411 3.687 20 5 EHBDRO COCCCOc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000873126907 1137590829 /nfs/dbraw/zinc/59/08/29/1137590829.db2.gz YVMSJVVLQPVCFS-UHFFFAOYSA-N 1 0 344.411 3.608 20 5 EHBDRO Cc1c(CN(Cc2ccco2)C2CC[NH+](C)CC2)cccc1[N+](=O)[O-] ZINC000877532381 1137679933 /nfs/dbraw/zinc/67/99/33/1137679933.db2.gz XDBBAPPGKROJPF-UHFFFAOYSA-N 1 0 343.427 3.593 20 5 EHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878111750 1137703020 /nfs/dbraw/zinc/70/30/20/1137703020.db2.gz CYPDGDZSYOCBNN-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000878447309 1137716293 /nfs/dbraw/zinc/71/62/93/1137716293.db2.gz LKKDUMIJSFZSMP-BZPMIXESSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1cc2cnccc2o1 ZINC000879713681 1137756297 /nfs/dbraw/zinc/75/62/97/1137756297.db2.gz RBFALWHEHNZNFL-CYBMUJFWSA-N 1 0 341.367 3.856 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1ccccc1OC)c1cccc([N+](=O)[O-])c1 ZINC000130535584 1137839090 /nfs/dbraw/zinc/83/90/90/1137839090.db2.gz YSPCJVOLBCMNEU-QZTJIDSGSA-N 1 0 344.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccc(F)cc2)C2CCOCC2)cc1 ZINC000883200686 1137848244 /nfs/dbraw/zinc/84/82/44/1137848244.db2.gz OSHNMPPEZOFPTB-LJQANCHMSA-N 1 0 344.386 3.991 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C2CCC3(COC3)CC2)cc1[N+](=O)[O-] ZINC000883380289 1137858294 /nfs/dbraw/zinc/85/82/94/1137858294.db2.gz HEUXWILOYREJDX-ZDUSSCGKSA-N 1 0 334.416 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](Cn1ccnc1)c1ccccc1 ZINC000883387723 1137859118 /nfs/dbraw/zinc/85/91/18/1137859118.db2.gz CUTYDKJKPWUWIJ-RBUKOAKNSA-N 1 0 348.406 3.810 20 5 EHBDRO CC(C)OCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113313371 1137912519 /nfs/dbraw/zinc/91/25/19/1137912519.db2.gz VHFUTLBQOKTUSJ-UHFFFAOYSA-N 1 0 335.429 3.623 20 5 EHBDRO CC(C)c1csc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000331573835 1137913086 /nfs/dbraw/zinc/91/30/86/1137913086.db2.gz IXJZROJOVMQUDJ-OCCSQVGLSA-N 1 0 349.460 3.645 20 5 EHBDRO C[C@@H](NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708407 1137917885 /nfs/dbraw/zinc/91/78/85/1137917885.db2.gz BWGDENVWHVUCBW-KDOFPFPSSA-N 1 0 345.443 3.569 20 5 EHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000331849598 1137922757 /nfs/dbraw/zinc/92/27/57/1137922757.db2.gz CURAICFXJMVQFA-GBJTYRQASA-N 1 0 338.477 3.539 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)c1ccccc1Cl)C1CC1 ZINC000135226378 1137964782 /nfs/dbraw/zinc/96/47/82/1137964782.db2.gz BIGDOTBFKCLAQQ-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO Cc1[nH]c(C2CCN(c3ccc(Cl)cc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000884706784 1137969570 /nfs/dbraw/zinc/96/95/70/1137969570.db2.gz NVBIGYWXDBFANB-UHFFFAOYSA-N 1 0 334.807 3.972 20 5 EHBDRO Cc1c(NC(=O)NCCCC[N@H+]2CCCC[C@@H]2C)cccc1[N+](=O)[O-] ZINC000045960118 1138041334 /nfs/dbraw/zinc/04/13/34/1138041334.db2.gz ZMNHFHTVCHRTPU-AWEZNQCLSA-N 1 0 348.447 3.679 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000052909534 1138045936 /nfs/dbraw/zinc/04/59/36/1138045936.db2.gz OPWYQVXRDNXCDE-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO CC(C)[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C1CCCC1 ZINC000068449324 1138084738 /nfs/dbraw/zinc/08/47/38/1138084738.db2.gz KINOLPWFJGJEPZ-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)[C@H]2C)O1 ZINC000886772071 1138137623 /nfs/dbraw/zinc/13/76/23/1138137623.db2.gz RVIWMFGTYXILMM-IHRRBPCASA-N 1 0 348.443 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)c1 ZINC000886818104 1138148704 /nfs/dbraw/zinc/14/87/04/1138148704.db2.gz ALHNLERLMDNSSR-NHYWBVRUSA-N 1 0 344.333 3.615 20 5 EHBDRO COc1ccc(C[N@H+](CCC(F)(F)F)CC2CC2)cc1[N+](=O)[O-] ZINC000084138623 1138177688 /nfs/dbraw/zinc/17/76/88/1138177688.db2.gz WIJCCIACDUVTKX-UHFFFAOYSA-N 1 0 332.322 3.768 20 5 EHBDRO CCc1ccccc1NC(=O)C[NH2+][C@@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000089509037 1138200035 /nfs/dbraw/zinc/20/00/35/1138200035.db2.gz SJIWILNWZCGQPL-KRWDZBQOSA-N 1 0 341.411 3.837 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)c2c(C)cc(C)c([N+](=O)[O-])c2C)CC1 ZINC000094126417 1138243899 /nfs/dbraw/zinc/24/38/99/1138243899.db2.gz DBCMOCNWMFGNDI-UHFFFAOYSA-N 1 0 347.459 3.514 20 5 EHBDRO CC(C)Oc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000125516179 1138310928 /nfs/dbraw/zinc/31/09/28/1138310928.db2.gz IQKPIYYNIPLXTH-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@H]1c2ccccc2C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337262709 1138512834 /nfs/dbraw/zinc/51/28/34/1138512834.db2.gz ZCHMTBFKESWUPH-ZDUSSCGKSA-N 1 0 325.368 3.500 20 5 EHBDRO C[C@@H]1c2ccccc2C[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337262704 1138513067 /nfs/dbraw/zinc/51/30/67/1138513067.db2.gz ZCHMTBFKESWUPH-CYBMUJFWSA-N 1 0 325.368 3.500 20 5 EHBDRO Cc1nccn1CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000337946012 1138704228 /nfs/dbraw/zinc/70/42/28/1138704228.db2.gz GMNGJJVVQIZBKF-UHFFFAOYSA-N 1 0 340.383 3.540 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(OC)c(F)c2)cc1[N+](=O)[O-] ZINC000152718431 1139105519 /nfs/dbraw/zinc/10/55/19/1139105519.db2.gz MUXQFHKTRYPHPY-LBPRGKRZSA-N 1 0 348.374 3.992 20 5 EHBDRO C[C@H](c1ccc([S@@](C)=O)cc1)[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000175384752 1139486932 /nfs/dbraw/zinc/48/69/32/1139486932.db2.gz KDLXXJFYCIOTSV-JBEBIEQOSA-N 1 0 346.452 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+]2CCC[C@@H]2C[C@@H](O)c2cccs2)cc1 ZINC000175851006 1139523682 /nfs/dbraw/zinc/52/36/82/1139523682.db2.gz MMMWFNBRIUKGCB-IAGOWNOFSA-N 1 0 346.452 3.787 20 5 EHBDRO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000179139891 1139737774 /nfs/dbraw/zinc/73/77/74/1139737774.db2.gz QSXLGQPTBGGAEI-DDUZABMNSA-N 1 0 342.443 3.699 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000181584872 1139916967 /nfs/dbraw/zinc/91/69/67/1139916967.db2.gz NRQLUSKDHBLKTA-CYBMUJFWSA-N 1 0 342.321 3.588 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004591 1139945096 /nfs/dbraw/zinc/94/50/96/1139945096.db2.gz LVMMPFBQSBWWDZ-QWHCGFSZSA-N 1 0 327.384 3.965 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)C12CCOCC2 ZINC000186417217 1140202361 /nfs/dbraw/zinc/20/23/61/1140202361.db2.gz LJWJOSPUCDWIJR-BMGDILEWSA-N 1 0 348.443 3.528 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+][C@@H](CCO)c1ccco1 ZINC000186543415 1140209273 /nfs/dbraw/zinc/20/92/73/1140209273.db2.gz VWRANQPEIKFCGD-PVAVHDDUSA-N 1 0 344.411 3.612 20 5 EHBDRO CN(CC[N@H+](C)C1CC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000186731236 1140218939 /nfs/dbraw/zinc/21/89/39/1140218939.db2.gz OKTWPIUCCJOMDE-UHFFFAOYSA-N 1 0 333.435 3.554 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH+]2CCC(c3ccsc3)CC2)c1 ZINC000186947525 1140229240 /nfs/dbraw/zinc/22/92/40/1140229240.db2.gz LBYACTQSEWDPAG-QGZVFWFLSA-N 1 0 332.425 3.569 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192724023 1140547249 /nfs/dbraw/zinc/54/72/49/1140547249.db2.gz HMAYABNBDWIFCQ-YJYMSZOUSA-N 1 0 326.396 3.815 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000269111780 1141067719 /nfs/dbraw/zinc/06/77/19/1141067719.db2.gz XWHZYXGWXCPAJD-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000270621352 1141247173 /nfs/dbraw/zinc/24/71/73/1141247173.db2.gz FRGWDYVMUSYYKQ-PBHICJAKSA-N 1 0 336.432 3.677 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667646 1141253514 /nfs/dbraw/zinc/25/35/14/1141253514.db2.gz PUWIRWCJPKVYCF-WFASDCNBSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H]2Cn2cnc3ccccc32)cs1 ZINC000271410729 1141360408 /nfs/dbraw/zinc/36/04/08/1141360408.db2.gz PHGACGZJPLIXPC-CQSZACIVSA-N 1 0 342.424 3.671 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000271563639 1141398660 /nfs/dbraw/zinc/39/86/60/1141398660.db2.gz OVAYCZZXRTYRLV-YFHUEUNASA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H](NC(=O)Nc1cccc(C[NH+](C)C)c1)c1ccccc1[N+](=O)[O-] ZINC000271617043 1141406681 /nfs/dbraw/zinc/40/66/81/1141406681.db2.gz DHUVAVMTZIJLRI-CYBMUJFWSA-N 1 0 342.399 3.539 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(CN2CCC[C@H]2[C@H]2CCCO2)c1 ZINC000339166175 1141516249 /nfs/dbraw/zinc/51/62/49/1141516249.db2.gz CVKREIBEBXZTMJ-LSDHHAIUSA-N 1 0 344.333 3.757 20 5 EHBDRO C[C@@H]1C[N@H+](C)[C@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643635 719205237 /nfs/dbraw/zinc/20/52/37/719205237.db2.gz ZVADVIGMJFPKTK-CHWSQXEVSA-N 1 0 340.858 3.965 20 5 EHBDRO C[NH+](C)CC1CCN(c2cc(Cl)nc3ccc([N+](=O)[O-])cc32)CC1 ZINC001165044486 721949224 /nfs/dbraw/zinc/94/92/24/721949224.db2.gz BJQVEXFAEFBNCP-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CC(C)N(Cc1cn(C)nc1C(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000274502206 1014143746 /nfs/dbraw/zinc/14/37/46/1014143746.db2.gz SAEHOXNARQEHHL-UHFFFAOYSA-N 1 0 338.358 3.677 20 5 EHBDRO CCCN(Cc1c(F)cc([N+](=O)[O-])cc1F)C[C@H]1CCCCO1 ZINC000509341369 1015235339 /nfs/dbraw/zinc/23/53/39/1015235339.db2.gz FMZHXPUYAMQNEX-CYBMUJFWSA-N 1 0 328.359 3.654 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000578252212 1015530121 /nfs/dbraw/zinc/53/01/21/1015530121.db2.gz LODRBORZDQPQRI-FSPWUOQZSA-N 1 0 326.396 3.885 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccc1)[C@H]1CCOC1 ZINC000359872787 1015883231 /nfs/dbraw/zinc/88/32/31/1015883231.db2.gz PRWIPTCMUMLVSI-HKUYNNGSSA-N 1 0 326.396 3.771 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895404 1015910390 /nfs/dbraw/zinc/91/03/90/1015910390.db2.gz GWIYINRSQQWNND-PXNSSMCTSA-N 1 0 348.406 3.554 20 5 EHBDRO CC(C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236608148 1016772063 /nfs/dbraw/zinc/77/20/63/1016772063.db2.gz AMELGBJBKUJLFQ-KRWDZBQOSA-N 1 0 334.441 3.820 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@H]1c1ccccc1 ZINC000340279940 1016849878 /nfs/dbraw/zinc/84/98/78/1016849878.db2.gz RQJIRDKWDPAXNH-HKUYNNGSSA-N 1 0 325.412 3.520 20 5 EHBDRO C[N@@H+]1CC[C@H](NCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283534 1016858237 /nfs/dbraw/zinc/85/82/37/1016858237.db2.gz YTWMDWGSDRCURK-HKUYNNGSSA-N 1 0 325.412 3.520 20 5 EHBDRO C[C@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1cccc(Cl)c1 ZINC000376652497 1016954124 /nfs/dbraw/zinc/95/41/24/1016954124.db2.gz QVFSSXCEHUBPOO-CYBMUJFWSA-N 1 0 348.834 3.885 20 5 EHBDRO COc1cccc([C@@H]2C[C@H]2C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000414554875 1016974939 /nfs/dbraw/zinc/97/49/39/1016974939.db2.gz MATWQHBUYLWOSH-RDJZCZTQSA-N 1 0 342.395 3.505 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1F ZINC000449120978 1032216643 /nfs/dbraw/zinc/21/66/43/1032216643.db2.gz GGYISJAGEGNGPO-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO O=C(CC[NH2+][C@@H]1CC[C@@H]2CCCC[C@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000548825371 1032252271 /nfs/dbraw/zinc/25/22/71/1032252271.db2.gz FRZUKDQNFGMSKJ-HRCADAONSA-N 1 0 345.443 3.872 20 5 EHBDRO COC(=O)c1cccc2c1CCN([C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000459540347 1032258349 /nfs/dbraw/zinc/25/83/49/1032258349.db2.gz DKUMPJNODICKMM-CYBMUJFWSA-N 1 0 340.379 3.501 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])nc21 ZINC000449180089 1032294143 /nfs/dbraw/zinc/29/41/43/1032294143.db2.gz YACASDBFFVGIQQ-AWEZNQCLSA-N 1 0 339.395 3.808 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000449201844 1032327457 /nfs/dbraw/zinc/32/74/57/1032327457.db2.gz HOGPUSUSTRTBSV-XFQXTVEOSA-N 1 0 339.439 3.561 20 5 EHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459620315 1032331902 /nfs/dbraw/zinc/33/19/02/1032331902.db2.gz VORGGMARBNDKMV-ZBEGNZNMSA-N 1 0 339.823 3.745 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(c2ccccn2)CCC1 ZINC000449323031 1032435829 /nfs/dbraw/zinc/43/58/29/1032435829.db2.gz RHSWNGJEXQZJHR-OAHLLOKOSA-N 1 0 325.412 3.632 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459753421 1032447558 /nfs/dbraw/zinc/44/75/58/1032447558.db2.gz MBAJSWIJUAMVNB-RUQNTENUSA-N 1 0 344.455 3.871 20 5 EHBDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449316679 1032448902 /nfs/dbraw/zinc/44/89/02/1032448902.db2.gz ZWWHSAWWOKHUNZ-YVEFUNNKSA-N 1 0 344.386 3.951 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@@H]1OCCc2sccc21 ZINC000449341123 1032457028 /nfs/dbraw/zinc/45/70/28/1032457028.db2.gz RVMABCVOGBMVQO-VBHSOAQHSA-N 1 0 346.452 3.879 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459798478 1032480889 /nfs/dbraw/zinc/48/08/89/1032480889.db2.gz VBLUDXZMHWSGJO-SUMWQHHRSA-N 1 0 338.835 3.621 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CCO1 ZINC000449490898 1032652346 /nfs/dbraw/zinc/65/23/46/1032652346.db2.gz DLSCYYDWQPGERD-GJYPPUQNSA-N 1 0 334.460 3.957 20 5 EHBDRO CC[C@@H]1C[C@H](C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)CCO1 ZINC000449503966 1032687286 /nfs/dbraw/zinc/68/72/86/1032687286.db2.gz VGLPYUHZRPUFTF-SZVBFZGTSA-N 1 0 332.444 3.979 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H]1CC(C)(C)Oc2ccc(N)cc21 ZINC000415029629 1017427963 /nfs/dbraw/zinc/42/79/63/1017427963.db2.gz DZORXKQEHMJVGO-KRWDZBQOSA-N 1 0 341.411 3.877 20 5 EHBDRO C[C@@H](c1ccccc1)N1CC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000176835318 1017480276 /nfs/dbraw/zinc/48/02/76/1017480276.db2.gz LCHMBGLOCYKIQB-LPHOPBHVSA-N 1 0 339.439 3.562 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000290297481 1017886533 /nfs/dbraw/zinc/88/65/33/1017886533.db2.gz NICKZGQAEJBJRQ-IQUTYRLHSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000275678461 1018080058 /nfs/dbraw/zinc/08/00/58/1018080058.db2.gz YPYZXVINCDPESJ-GUDVDZBRSA-N 1 0 326.396 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccnc3)C2)c(Cl)c1 ZINC000449537528 1032751354 /nfs/dbraw/zinc/75/13/54/1032751354.db2.gz ROULNGUMQAKOPG-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]CCc1ccccc1OC(F)F ZINC000471542637 1018667234 /nfs/dbraw/zinc/66/72/34/1018667234.db2.gz ZXUNWNIQXDNPHN-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO C[NH+](C)C(C)(C)CNc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000023745429 1018957476 /nfs/dbraw/zinc/95/74/76/1018957476.db2.gz UVGWREDUWGGOIS-UHFFFAOYSA-N 1 0 341.411 3.578 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)c2c1 ZINC000610420572 1019024178 /nfs/dbraw/zinc/02/41/78/1019024178.db2.gz YEZRLHWLNMHPKS-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)cc1[N+](=O)[O-] ZINC000120626563 1019111333 /nfs/dbraw/zinc/11/13/33/1019111333.db2.gz ODWWHPJCYKWMRK-CJNGLKHVSA-N 1 0 333.457 3.918 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+](CCO)[C@@H]1CCc2ccccc21 ZINC000255495200 1019246926 /nfs/dbraw/zinc/24/69/26/1019246926.db2.gz BIQNSRBUGIDAHR-DASIIQCKSA-N 1 0 338.407 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H]4CC[NH2+][C@H]4C3)s2)cc1 ZINC000592432487 1032838258 /nfs/dbraw/zinc/83/82/58/1032838258.db2.gz LDEJTRDHFIQZND-GUYCJALGSA-N 1 0 343.452 3.507 20 5 EHBDRO C[C@@H]1[C@@H]([NH+](C)C)CCN1C(=O)c1cc2ccccc2c2cccnc12 ZINC000647832265 1019718935 /nfs/dbraw/zinc/71/89/35/1019718935.db2.gz XFTNLRUJKCEODC-KUHUBIRLSA-N 1 0 333.435 3.553 20 5 EHBDRO CC(C)c1ccc(CNC[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000513641967 1019899481 /nfs/dbraw/zinc/89/94/81/1019899481.db2.gz CDTJHQQRWAMGLU-MRXNPFEDSA-N 1 0 333.476 3.930 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(C)c1OC ZINC000513679186 1019941909 /nfs/dbraw/zinc/94/19/09/1019941909.db2.gz VMGFESNFIMIZBN-ZDUSSCGKSA-N 1 0 344.411 3.641 20 5 EHBDRO CC(C)[NH2+][C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000021817895 1020299013 /nfs/dbraw/zinc/29/90/13/1020299013.db2.gz RRKRQPKZDIIRHQ-INIZCTEOSA-N 1 0 347.802 3.926 20 5 EHBDRO CC[C@@H](O)[C@@H](CC)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000449639297 1032942726 /nfs/dbraw/zinc/94/27/26/1032942726.db2.gz OJMZBZVGQPRZAW-NVXWUHKLSA-N 1 0 348.399 3.503 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@H]1c1cccc(C)c1C ZINC001167463747 1020923783 /nfs/dbraw/zinc/92/37/83/1020923783.db2.gz AUGRXSRGPTXHQZ-KRWDZBQOSA-N 1 0 328.416 3.554 20 5 EHBDRO CC[C@@H](O)[C@H](CC)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000449639296 1032942390 /nfs/dbraw/zinc/94/23/90/1032942390.db2.gz OJMZBZVGQPRZAW-DOTOQJQBSA-N 1 0 348.399 3.503 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCCSC3)o2)c([N+](=O)[O-])c1 ZINC000610511657 1021133516 /nfs/dbraw/zinc/13/35/16/1021133516.db2.gz WCGHMIIWBQBEAZ-GFCCVEGCSA-N 1 0 348.424 3.849 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000090843967 1021213132 /nfs/dbraw/zinc/21/31/32/1021213132.db2.gz PXHKHZGMRMXUJL-KDOFPFPSSA-N 1 0 328.412 3.850 20 5 EHBDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837235 1021261779 /nfs/dbraw/zinc/26/17/79/1021261779.db2.gz DXSXNWJGDRJLCH-HZPDHXFCSA-N 1 0 345.399 3.516 20 5 EHBDRO CO[C@H]([C@@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633532 1032966155 /nfs/dbraw/zinc/96/61/55/1032966155.db2.gz ULVVFSATIJVLKE-KZULUSFZSA-N 1 0 330.384 3.758 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)CC1 ZINC000894850770 1021376500 /nfs/dbraw/zinc/37/65/00/1021376500.db2.gz XPRFJPHBMYTLMK-UHFFFAOYSA-N 1 0 340.427 3.577 20 5 EHBDRO [NH3+]CCc1cn(-c2ccc([N+](=O)[O-])c3ccccc32)c2ccc(O)cc12 ZINC001167986720 1021432235 /nfs/dbraw/zinc/43/22/35/1021432235.db2.gz DUISJBGJNFVASA-UHFFFAOYSA-N 1 0 347.374 3.899 20 5 EHBDRO CCS[C@H]1CCC[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567747 1032979037 /nfs/dbraw/zinc/97/90/37/1032979037.db2.gz KUHCFNCHZQNZDN-YPMHNXCESA-N 1 0 335.429 3.890 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1O ZINC000426403202 1021505599 /nfs/dbraw/zinc/50/55/99/1021505599.db2.gz FNOFYLPSKBNPGD-KGLIPLIRSA-N 1 0 344.411 3.981 20 5 EHBDRO COCC1(C)CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602594391 1032991116 /nfs/dbraw/zinc/99/11/16/1032991116.db2.gz AXCIYVCGIKCARP-UHFFFAOYSA-N 1 0 346.349 3.862 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)c(Cl)c1 ZINC000519673846 1021602439 /nfs/dbraw/zinc/60/24/39/1021602439.db2.gz WWWYECZGVHFEKA-IMJJTQAJSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@](O)(C4CC4)C3)s2)cc1 ZINC000426499376 1021743044 /nfs/dbraw/zinc/74/30/44/1021743044.db2.gz QOEQLCUXRBWYOL-SFHVURJKSA-N 1 0 344.436 3.670 20 5 EHBDRO COc1cc(N[C@H]2C[N@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000302157004 1022103155 /nfs/dbraw/zinc/10/31/55/1022103155.db2.gz FJQLFBDRRHYVJO-YOEHRIQHSA-N 1 0 341.411 3.536 20 5 EHBDRO CC(C)[C@@H]1CC[N@@H+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498574 1022107030 /nfs/dbraw/zinc/10/70/30/1022107030.db2.gz YFWBLTLOKRLXGT-TZMCWYRMSA-N 1 0 330.388 3.684 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCC[C@@H]1CCOC1 ZINC000449680397 1033031620 /nfs/dbraw/zinc/03/16/20/1033031620.db2.gz GLEFPZNWSAPRML-SOLBZPMBSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1(C)C ZINC000546267077 1022187834 /nfs/dbraw/zinc/18/78/34/1022187834.db2.gz CCCQOCYYNKHGES-AWEZNQCLSA-N 1 0 342.443 3.863 20 5 EHBDRO C[C@H](CCCC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602634743 1033047252 /nfs/dbraw/zinc/04/72/52/1033047252.db2.gz PDRSSHWEOVTTFR-SECBINFHSA-N 1 0 331.294 3.947 20 5 EHBDRO CC[C@@H]1[C@@H](C)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187580006 1022357255 /nfs/dbraw/zinc/35/72/55/1022357255.db2.gz NTHYTJTUZOGIFI-SUMWQHHRSA-N 1 0 328.416 3.616 20 5 EHBDRO CCN(CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000517551704 1022439535 /nfs/dbraw/zinc/43/95/35/1022439535.db2.gz QBKDAPLWZBNKSH-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1cnc(C2CC2)o1 ZINC000449703166 1033066249 /nfs/dbraw/zinc/06/62/49/1033066249.db2.gz FNCJFKBSKLQGER-WMLDXEAASA-N 1 0 341.411 3.961 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@]2(CCOC2)C1 ZINC000602682751 1033083073 /nfs/dbraw/zinc/08/30/73/1033083073.db2.gz RNNKQQLUYIBZMA-OAHLLOKOSA-N 1 0 344.333 3.616 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)CC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000548389664 1022774315 /nfs/dbraw/zinc/77/43/15/1022774315.db2.gz PRGQDBVPHZLDTL-HNNXBMFYSA-N 1 0 347.459 3.735 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000438571183 1022822001 /nfs/dbraw/zinc/82/20/01/1022822001.db2.gz KSFCLTIMEQABJC-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO CCO[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000602685392 1033084917 /nfs/dbraw/zinc/08/49/17/1033084917.db2.gz NWZHCOYIIBFXBL-NHYWBVRUSA-N 1 0 346.349 3.861 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602722068 1033087217 /nfs/dbraw/zinc/08/72/17/1033087217.db2.gz LTWCDNFTVYJTAX-GFCCVEGCSA-N 1 0 332.322 3.518 20 5 EHBDRO CCOCC(C)(C)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000550256787 1022894863 /nfs/dbraw/zinc/89/48/63/1022894863.db2.gz LJYBPHGXWQFKQT-UHFFFAOYSA-N 1 0 348.399 3.768 20 5 EHBDRO CC[NH2+][C@H](C)CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414950626 1022988218 /nfs/dbraw/zinc/98/82/18/1022988218.db2.gz GEGDFJZFPZFZEF-LLVKDONJSA-N 1 0 337.807 3.596 20 5 EHBDRO O=[N+]([O-])c1cccnc1NCc1cccc(C[NH+]2CCCCCC2)c1 ZINC000060862773 1033095217 /nfs/dbraw/zinc/09/52/17/1033095217.db2.gz IOOGUJQVNCLWBX-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO C[C@@H]([NH2+]CCc1csc(N2CCCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000129533569 1023151676 /nfs/dbraw/zinc/15/16/76/1023151676.db2.gz HEEYMWXZIJZDSR-CYBMUJFWSA-N 1 0 346.456 3.545 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](O)C[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000602729736 1033117942 /nfs/dbraw/zinc/11/79/42/1033117942.db2.gz CAHQMEWWSUYBLG-IEBWSBKVSA-N 1 0 326.396 3.601 20 5 EHBDRO Cn1cc(C[NH+]2CC(c3ccccc3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000602728096 1033118197 /nfs/dbraw/zinc/11/81/97/1033118197.db2.gz IQKBBDJZCLPOOD-UHFFFAOYSA-N 1 0 348.406 3.595 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CC3(C(F)(F)F)CCCC3)nc2c1 ZINC000602731303 1033120709 /nfs/dbraw/zinc/12/07/09/1033120709.db2.gz VKKMLWAHRVQUOZ-UHFFFAOYSA-N 1 0 343.305 3.948 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN1Cc2ccccc2C1 ZINC000610805612 1023693259 /nfs/dbraw/zinc/69/32/59/1023693259.db2.gz YXCRGDAKACQKMH-HNNXBMFYSA-N 1 0 325.412 3.570 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)cc([N+](=O)[O-])c1 ZINC000458296426 1023856746 /nfs/dbraw/zinc/85/67/46/1023856746.db2.gz XQWRPSDEQSDXKD-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)C2CCC(F)(F)CC2)c1[N+](=O)[O-] ZINC000895226024 1024010622 /nfs/dbraw/zinc/01/06/22/1024010622.db2.gz QYDDDBYVVXUNOM-SNVBAGLBSA-N 1 0 344.358 3.613 20 5 EHBDRO CCOC(=O)CCC1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000610997467 1024020187 /nfs/dbraw/zinc/02/01/87/1024020187.db2.gz TTZIOQFXLQUOMW-CQSZACIVSA-N 1 0 334.416 3.711 20 5 EHBDRO COc1cc(C[N@H+](C)C[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000514103226 1024134425 /nfs/dbraw/zinc/13/44/25/1024134425.db2.gz ANBYODPNHVEAQY-CQSZACIVSA-N 1 0 344.411 3.848 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000538488155 1024398480 /nfs/dbraw/zinc/39/84/80/1024398480.db2.gz RJSDUQXHEYPKQK-SFHVURJKSA-N 1 0 344.411 3.742 20 5 EHBDRO CCn1nccc1C1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])CC1 ZINC000434794100 1024429355 /nfs/dbraw/zinc/42/93/55/1024429355.db2.gz NBQPRMVOGIHZLG-UHFFFAOYSA-N 1 0 348.834 3.844 20 5 EHBDRO C[C@@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383927374 1024634529 /nfs/dbraw/zinc/63/45/29/1024634529.db2.gz RZLKOBUNVLYCMS-NVXWUHKLSA-N 1 0 325.412 3.917 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)c(F)c1 ZINC000326792088 1024654357 /nfs/dbraw/zinc/65/43/57/1024654357.db2.gz XTQLEUGSPOEJPM-NXHRZFHOSA-N 1 0 336.407 3.640 20 5 EHBDRO COc1ccc([C@@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065533235 1024662895 /nfs/dbraw/zinc/66/28/95/1024662895.db2.gz DVWJZUWKYALKGN-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO CC(C)[C@H](CO)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000514829353 1024769523 /nfs/dbraw/zinc/76/95/23/1024769523.db2.gz AQCIIMXFNJKWSS-ZDUSSCGKSA-N 1 0 334.441 3.677 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425371667 1024895515 /nfs/dbraw/zinc/89/55/15/1024895515.db2.gz LOIXXGCCCVUSCF-NAASZUNDSA-N 1 0 342.439 3.889 20 5 EHBDRO C[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)c2ccccc21 ZINC000185393575 1024925512 /nfs/dbraw/zinc/92/55/12/1024925512.db2.gz AIGNBTGQOMUEJL-LBPRGKRZSA-N 1 0 344.802 3.949 20 5 EHBDRO COc1ccc([C@@H](C)[C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000474469840 1025001525 /nfs/dbraw/zinc/00/15/25/1025001525.db2.gz IDBSKZNUJIJDNX-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000157714489 1025080354 /nfs/dbraw/zinc/08/03/54/1025080354.db2.gz FLPBSXYHGHUNQB-PNPHSEOMSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000435727030 1025108909 /nfs/dbraw/zinc/10/89/09/1025108909.db2.gz CLIMKHRISDOQNX-KOMQPUFPSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000051454298 1025353727 /nfs/dbraw/zinc/35/37/27/1025353727.db2.gz FZWIWSFYROWLLM-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000438996706 1025380512 /nfs/dbraw/zinc/38/05/12/1025380512.db2.gz PPOLSGIVJKGAMM-MZMPZRCHSA-N 1 0 336.407 3.640 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000611377300 1025385968 /nfs/dbraw/zinc/38/59/68/1025385968.db2.gz IZVZCIFKVHFTJE-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccc(Cn2ccnc2)cc1 ZINC000521460596 1025397601 /nfs/dbraw/zinc/39/76/01/1025397601.db2.gz GJJMWARHYMZHKT-IBGZPJMESA-N 1 0 348.406 3.617 20 5 EHBDRO Cc1cc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433143 1025461097 /nfs/dbraw/zinc/46/10/97/1025461097.db2.gz IARGFXJEXFMPGI-WBVHZDCISA-N 1 0 340.427 3.621 20 5 EHBDRO COCCN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000505779164 1025496913 /nfs/dbraw/zinc/49/69/13/1025496913.db2.gz YNROWMHNXYOIQY-AWEZNQCLSA-N 1 0 332.375 3.944 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCCCN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077307 1025497379 /nfs/dbraw/zinc/49/73/79/1025497379.db2.gz VKAZDDPBVQESRX-DYVFJYSZSA-N 1 0 329.400 3.557 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc(C[NH+](C)C)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000563273444 1025503053 /nfs/dbraw/zinc/50/30/53/1025503053.db2.gz PIWDZMQQEFFBNS-GFCCVEGCSA-N 1 0 345.374 3.538 20 5 EHBDRO C[C@H](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000436349593 1025627394 /nfs/dbraw/zinc/62/73/94/1025627394.db2.gz QTHYOYPPGRFNLA-LLVKDONJSA-N 1 0 346.353 3.685 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)NCc1ccc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000442998382 1025640163 /nfs/dbraw/zinc/64/01/63/1025640163.db2.gz IZQFPNYHRGZZBV-LIRRHRJNSA-N 1 0 345.418 3.823 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ncccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000120007500 1025671570 /nfs/dbraw/zinc/67/15/70/1025671570.db2.gz ONKCJGGXBIPKMK-JSGCOSHPSA-N 1 0 346.818 3.573 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000127077428 1025689513 /nfs/dbraw/zinc/68/95/13/1025689513.db2.gz VTGPNKKCOKUGPG-HNNXBMFYSA-N 1 0 343.427 3.812 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCCO2 ZINC000548722860 1025796954 /nfs/dbraw/zinc/79/69/54/1025796954.db2.gz SWHFWYXNMPHGFD-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO Cc1ccc(C[NH2+]CC2(O)CCC(C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000522062599 1025931596 /nfs/dbraw/zinc/93/15/96/1025931596.db2.gz HCARCGWSNKGFGO-UHFFFAOYSA-N 1 0 334.460 3.960 20 5 EHBDRO CC(C)[N@H+](CCCO[C@@H]1CCCCO1)Cc1ccc([N+](=O)[O-])cc1 ZINC000338234135 1025982441 /nfs/dbraw/zinc/98/24/41/1025982441.db2.gz WECKRRXDQZXXCZ-GOSISDBHSA-N 1 0 336.432 3.739 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ccc(N)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000287739469 1026012234 /nfs/dbraw/zinc/01/22/34/1026012234.db2.gz GEJCOJJTCJLSRE-YOEHRIQHSA-N 1 0 340.427 3.642 20 5 EHBDRO CCO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000451549069 1026099467 /nfs/dbraw/zinc/09/94/67/1026099467.db2.gz VTWDQYHDNCRGML-YOEHRIQHSA-N 1 0 336.432 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CCCOCC(F)(F)F)C2)cc1 ZINC000451547194 1026100578 /nfs/dbraw/zinc/10/05/78/1026100578.db2.gz KNDWHDBWXIXJFZ-AWEZNQCLSA-N 1 0 346.349 3.743 20 5 EHBDRO Cc1ncsc1CC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451554467 1026106984 /nfs/dbraw/zinc/10/69/84/1026106984.db2.gz ZVDUIFPVVULFRA-OAHLLOKOSA-N 1 0 331.441 3.782 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000475141483 1026234279 /nfs/dbraw/zinc/23/42/79/1026234279.db2.gz WCQGTNDXSBZOFG-KEEQEYLASA-N 1 0 340.423 3.798 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N2CCC([NH2+]C3CC3)CC2)c(Cl)c1 ZINC000127689321 1026313506 /nfs/dbraw/zinc/31/35/06/1026313506.db2.gz IINOTPJMUHMEJC-UHFFFAOYSA-N 1 0 330.215 3.622 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000452100933 1026477151 /nfs/dbraw/zinc/47/71/51/1026477151.db2.gz IXZDMZSZVQPOPV-LBPRGKRZSA-N 1 0 346.349 3.862 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000452090389 1026485064 /nfs/dbraw/zinc/48/50/64/1026485064.db2.gz QTZMHRINOQBAJZ-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO COc1cccc(C[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000121278907 1026589742 /nfs/dbraw/zinc/58/97/42/1026589742.db2.gz MWEFURWWZLCKEU-HXUWFJFHSA-N 1 0 340.423 3.757 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1Br ZINC000127894279 1026623490 /nfs/dbraw/zinc/62/34/90/1026623490.db2.gz NHTLEVFGICDLNK-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CCCO)[C@H]1CCCc2ccccc21 ZINC000531164058 1026637023 /nfs/dbraw/zinc/63/70/23/1026637023.db2.gz NHOVJQJFRLQHAR-FQEVSTJZSA-N 1 0 340.423 3.857 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2Cc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000520041893 1026680289 /nfs/dbraw/zinc/68/02/89/1026680289.db2.gz SPEZHJMTPANVMC-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000531202479 1026684501 /nfs/dbraw/zinc/68/45/01/1026684501.db2.gz ZPWOFXDEQVNEJP-YOEHRIQHSA-N 1 0 326.396 3.981 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CCCOC2)cc1[N+](=O)[O-] ZINC000582598514 1026708747 /nfs/dbraw/zinc/70/87/47/1026708747.db2.gz WXRSETZJRJXFCK-INIZCTEOSA-N 1 0 341.411 3.631 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c1 ZINC000340335843 1026982380 /nfs/dbraw/zinc/98/23/80/1026982380.db2.gz KHQZJFDSXIIRAH-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCc3ccc(O)cc3)o2)c1 ZINC000520215024 1027182325 /nfs/dbraw/zinc/18/23/25/1027182325.db2.gz BEOJXOSJYJPUHZ-UHFFFAOYSA-N 1 0 338.363 3.893 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOc1ccccc1)C1CC1 ZINC000531692449 1027191621 /nfs/dbraw/zinc/19/16/21/1027191621.db2.gz WKBLROPUPPXQRY-GOSISDBHSA-N 1 0 326.396 3.585 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+]([C@H](C)c3ccccc3)CC2)n1 ZINC000126399795 1027200709 /nfs/dbraw/zinc/20/07/09/1027200709.db2.gz OYSJODICPAUNRF-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc(N2CCCC2=O)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178644817 1027239709 /nfs/dbraw/zinc/23/97/09/1027239709.db2.gz KPKGFVOQKLJCTH-AWEZNQCLSA-N 1 0 339.395 3.572 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000204663865 1027286370 /nfs/dbraw/zinc/28/63/70/1027286370.db2.gz GTDWPWYXXXSXQC-SFHVURJKSA-N 1 0 328.412 3.929 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000310625639 1027489147 /nfs/dbraw/zinc/48/91/47/1027489147.db2.gz CUTYMFVFNVKSPZ-RZQQEMMASA-N 1 0 339.439 3.908 20 5 EHBDRO Cc1c(C[NH2+]C2CCN(Cc3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000237801591 1027705767 /nfs/dbraw/zinc/70/57/67/1027705767.db2.gz KQRINANKLQOLIS-UHFFFAOYSA-N 1 0 339.439 3.657 20 5 EHBDRO CC[NH+]1CCC(CCNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000078401697 1027773430 /nfs/dbraw/zinc/77/34/30/1027773430.db2.gz MCVWNPGUNMFEDT-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CC[C@](O)(CCC(F)(F)F)C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000897517637 1027893513 /nfs/dbraw/zinc/89/35/13/1027893513.db2.gz BSAOLUWTWXVWDN-HNNXBMFYSA-N 1 0 348.365 3.785 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H](CC(F)(F)F)C2)cc1 ZINC000420955709 1027926141 /nfs/dbraw/zinc/92/61/41/1027926141.db2.gz WZCMMJLKOBGGRV-GFCCVEGCSA-N 1 0 332.322 3.638 20 5 EHBDRO O=C(CCC[NH2+]Cc1cccc([N+](=O)[O-])c1)Nc1ccc(Cl)cc1 ZINC000069833603 1028034365 /nfs/dbraw/zinc/03/43/65/1028034365.db2.gz TVNQZUXZQXYBTM-UHFFFAOYSA-N 1 0 347.802 3.757 20 5 EHBDRO COc1cc(C)c(C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000502402144 1028173967 /nfs/dbraw/zinc/17/39/67/1028173967.db2.gz MFPAIPLZFKLBQE-AWEZNQCLSA-N 1 0 344.411 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)cc1 ZINC000166498554 1028233934 /nfs/dbraw/zinc/23/39/34/1028233934.db2.gz HDXUWVVIEAJWKU-FXAWDEMLSA-N 1 0 340.423 3.895 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc2c1CCCN2 ZINC000423408972 1028424506 /nfs/dbraw/zinc/42/45/06/1028424506.db2.gz BFJZFLOODKYWMD-AWEZNQCLSA-N 1 0 325.412 3.674 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000063482860 1028586482 /nfs/dbraw/zinc/58/64/82/1028586482.db2.gz JMNOHFLUJXLWSN-OAHLLOKOSA-N 1 0 341.411 3.925 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C)nc(C)c2)cc1[N+](=O)[O-] ZINC000421853237 1028844064 /nfs/dbraw/zinc/84/40/64/1028844064.db2.gz IWTFTRAKJCLXAH-AWEZNQCLSA-N 1 0 329.400 3.856 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCSC1 ZINC000504900075 1029028023 /nfs/dbraw/zinc/02/80/23/1029028023.db2.gz QTGAXAVQQNQULG-STQMWFEESA-N 1 0 326.487 3.951 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000504899739 1029042793 /nfs/dbraw/zinc/04/27/93/1029042793.db2.gz LISZDSVWIXGMLD-GDBMZVCRSA-N 1 0 337.464 3.620 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2C[C@@H](OCC)C23CCC3)cc1[N+](=O)[O-] ZINC000504917980 1029044024 /nfs/dbraw/zinc/04/40/24/1029044024.db2.gz FLBQAAJDUXLONC-DOPJRALCSA-N 1 0 348.443 3.992 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@H](C)C[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504906416 1029050280 /nfs/dbraw/zinc/05/02/80/1029050280.db2.gz XSFHVCQTHSZNNN-OAGGEKHMSA-N 1 0 349.475 3.765 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000524294193 1029055807 /nfs/dbraw/zinc/05/58/07/1029055807.db2.gz WUXQMIZEMZGFHH-SCLBCKFNSA-N 1 0 332.400 3.742 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(O)CCCCC1 ZINC000504918787 1029060261 /nfs/dbraw/zinc/06/02/61/1029060261.db2.gz IWJUAGHAECMPPX-AWEZNQCLSA-N 1 0 338.473 3.750 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@H]3CCCO[C@@H]3C2(C)C)cc1[N+](=O)[O-] ZINC000504927511 1029073723 /nfs/dbraw/zinc/07/37/23/1029073723.db2.gz PYEHTHXKGRACLH-GGBBIFEXSA-N 1 0 348.443 3.848 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)(C)Oc2ccccc2)cc1[N+](=O)[O-] ZINC000524460211 1029191413 /nfs/dbraw/zinc/19/14/13/1029191413.db2.gz BRANMUBCWKQLRK-UHFFFAOYSA-N 1 0 330.384 3.551 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000524446157 1029195926 /nfs/dbraw/zinc/19/59/26/1029195926.db2.gz PDBYWVYUVDRYMG-UHFFFAOYSA-N 1 0 336.436 3.537 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCCC2(CCCC2)C1 ZINC000445864898 1029195998 /nfs/dbraw/zinc/19/59/98/1029195998.db2.gz ZVIDRGSUZDLUSB-CQSZACIVSA-N 1 0 331.416 3.578 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@@H]1CCC[C@H]1c1ccccc1 ZINC000446002924 1029318783 /nfs/dbraw/zinc/31/87/83/1029318783.db2.gz OGVJPFSYRMWMMC-DLBZAZTESA-N 1 0 326.396 3.900 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000505290478 1029444303 /nfs/dbraw/zinc/44/43/03/1029444303.db2.gz QMSMXHPALFVKNO-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@H](C)[C@H]2Cc3ccccc3O2)cccc1[N+](=O)[O-] ZINC000441042865 1029660085 /nfs/dbraw/zinc/66/00/85/1029660085.db2.gz GECBPPXFLXQJQY-AUUYWEPGSA-N 1 0 326.396 3.727 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3cccc4ccccc43)nc2c1 ZINC000446835703 1029815302 /nfs/dbraw/zinc/81/53/02/1029815302.db2.gz MXEZTXGHFVAMBT-UHFFFAOYSA-N 1 0 332.363 3.914 20 5 EHBDRO Cc1cccc(CC[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000446845715 1029825959 /nfs/dbraw/zinc/82/59/59/1029825959.db2.gz QDPBZCRRXAULEB-AWEZNQCLSA-N 1 0 338.411 3.890 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCCc2occc21 ZINC000152250479 1029869123 /nfs/dbraw/zinc/86/91/23/1029869123.db2.gz NKGFMOUZDSTNGN-BLLLJJGKSA-N 1 0 343.383 3.572 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000441191440 1029891914 /nfs/dbraw/zinc/89/19/14/1029891914.db2.gz DSPWWNYCGXNPSE-WMZOPIPTSA-N 1 0 330.384 3.902 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])c1ccco1 ZINC000343257842 1029954285 /nfs/dbraw/zinc/95/42/85/1029954285.db2.gz ZMFIFAWYRINOJK-ZYHUDNBSSA-N 1 0 338.795 3.778 20 5 EHBDRO COc1cc2c(cc1OC)[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000453249879 1029977071 /nfs/dbraw/zinc/97/70/71/1029977071.db2.gz VZNKNBVYUKNORW-SJCJKPOMSA-N 1 0 342.395 3.950 20 5 EHBDRO Cc1cc(-c2noc([C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)n2)cc([N+](=O)[O-])c1 ZINC000453299252 1030047565 /nfs/dbraw/zinc/04/75/65/1030047565.db2.gz WZUKBQZBRLIXAJ-AVGNSLFASA-N 1 0 330.388 3.887 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c(Cl)c1 ZINC000447304300 1030102256 /nfs/dbraw/zinc/10/22/56/1030102256.db2.gz IJMARUCNNRCIBM-AWEZNQCLSA-N 1 0 346.818 3.638 20 5 EHBDRO CCC[C@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000525781750 1030116054 /nfs/dbraw/zinc/11/60/54/1030116054.db2.gz VRBSGJMLFPIAOL-GOSISDBHSA-N 1 0 334.416 3.864 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@@H](C)n2ccnc21 ZINC000453345458 1030131622 /nfs/dbraw/zinc/13/16/22/1030131622.db2.gz KAGZHGNDHCAWKS-MGPQQGTHSA-N 1 0 346.456 3.958 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CC[C@@H](c3ccccc3)C2)cc1 ZINC000525868290 1030183793 /nfs/dbraw/zinc/18/37/93/1030183793.db2.gz UBRDIDGMTADPRU-SJORKVTESA-N 1 0 326.396 3.900 20 5 EHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159432602 1030188502 /nfs/dbraw/zinc/18/85/02/1030188502.db2.gz SQJGNNQAJJMTIN-CYBMUJFWSA-N 1 0 327.222 3.978 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncccc1OC ZINC000453374794 1030193940 /nfs/dbraw/zinc/19/39/40/1030193940.db2.gz SXSVOFAPCKINSB-CYBMUJFWSA-N 1 0 347.440 3.659 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCC1 ZINC000583604379 1030266031 /nfs/dbraw/zinc/26/60/31/1030266031.db2.gz MWXQUWDIQZVKFA-OALUTQOASA-N 1 0 331.460 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCCCN1C1CC1)CCC2 ZINC000447595665 1030330839 /nfs/dbraw/zinc/33/08/39/1030330839.db2.gz ALUQELBBIJKYJZ-MJGOQNOKSA-N 1 0 329.444 3.579 20 5 EHBDRO CO[C@H](CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000447598303 1030336074 /nfs/dbraw/zinc/33/60/74/1030336074.db2.gz HOEUVHTWEINCNG-UONOGXRCSA-N 1 0 332.322 3.529 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2CCOc2ccccc2[N+](=O)[O-])n1 ZINC000159856679 1030397497 /nfs/dbraw/zinc/39/74/97/1030397497.db2.gz VATMLYRYLYDUNS-INIZCTEOSA-N 1 0 327.384 3.514 20 5 EHBDRO C[C@@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000161831865 1030488572 /nfs/dbraw/zinc/48/85/72/1030488572.db2.gz FVSCFGWOOWITQI-WBMJQRKESA-N 1 0 349.431 3.549 20 5 EHBDRO COC[C@@H](C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000171051252 1030559813 /nfs/dbraw/zinc/55/98/13/1030559813.db2.gz LLNVSBNIZVDYSM-NSHDSACASA-N 1 0 338.791 3.880 20 5 EHBDRO C[C@H]([NH2+]CCN(C)Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000160138719 1030569421 /nfs/dbraw/zinc/56/94/21/1030569421.db2.gz DPJALRWZBSEQRC-AWEZNQCLSA-N 1 0 331.391 3.517 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483254984 1031068633 /nfs/dbraw/zinc/06/86/33/1031068633.db2.gz IWTQSZFLWAFKHE-ZIAGYGMSSA-N 1 0 333.432 3.680 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@H]1O ZINC000537698512 1031138101 /nfs/dbraw/zinc/13/81/01/1031138101.db2.gz VUCLSPDYJCHPQR-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(Cl)cc1 ZINC000551351981 1031242158 /nfs/dbraw/zinc/24/21/58/1031242158.db2.gz NORXQVIFOHBHHJ-QZTJIDSGSA-N 1 0 345.830 3.783 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000122053555 1031295510 /nfs/dbraw/zinc/29/55/10/1031295510.db2.gz AQQUEVISZCZLKT-ZDUSSCGKSA-N 1 0 349.456 3.994 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2cc3ccccc3o2)n1 ZINC000584033109 1031526349 /nfs/dbraw/zinc/52/63/49/1031526349.db2.gz ARQAGCBXPUKKKM-HZPDHXFCSA-N 1 0 340.383 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CCC[C@H](C(F)(F)F)C3)nc2c1 ZINC000278596235 1031576138 /nfs/dbraw/zinc/57/61/38/1031576138.db2.gz FJYSYNCJOLCNHJ-UWVGGRQHSA-N 1 0 342.321 3.682 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000161502156 1031578262 /nfs/dbraw/zinc/57/82/62/1031578262.db2.gz DGURAIKWTVKJPY-PKOBYXMFSA-N 1 0 328.412 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCO[C@H]2c2ccccc2)c(F)c1 ZINC000484483832 1031634530 /nfs/dbraw/zinc/63/45/30/1031634530.db2.gz CCEXNOOCCULMDU-YJBOKZPZSA-N 1 0 330.359 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[NH+]4CCC3CC4)s2)cc1 ZINC000584119763 1031755802 /nfs/dbraw/zinc/75/58/02/1031755802.db2.gz FIRWMSASMXNIMP-UHFFFAOYSA-N 1 0 343.452 3.603 20 5 EHBDRO Cc1c(-c2noc([C@@H]3CC[C@@H]4CCCC[C@@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000904123204 1031758958 /nfs/dbraw/zinc/75/89/58/1031758958.db2.gz JCLNCDXCTZQWRS-QEJZJMRPSA-N 1 0 342.399 3.937 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cnn(CC2CCC2)c1 ZINC000898181541 1033383149 /nfs/dbraw/zinc/38/31/49/1033383149.db2.gz JQGMGRJTTMZJCV-ACJLOTCBSA-N 1 0 340.427 3.930 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@H+](C3CC3)C3CCCCC3)o2)cc1 ZINC000078534149 1033390738 /nfs/dbraw/zinc/39/07/38/1033390738.db2.gz ZKWJLOXVAMSPJM-UHFFFAOYSA-N 1 0 342.399 3.942 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000594515332 1033423288 /nfs/dbraw/zinc/42/32/88/1033423288.db2.gz NVDXIIWDWBHGQH-GPMSIDNRSA-N 1 0 339.439 3.922 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](OC2CCCC2)C(F)(F)F)cc1 ZINC000594969668 1033576746 /nfs/dbraw/zinc/57/67/46/1033576746.db2.gz YHZCNRMRTOXKIX-CQSZACIVSA-N 1 0 332.322 3.575 20 5 EHBDRO COC[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1cccc(OC)c1 ZINC000594969936 1033578284 /nfs/dbraw/zinc/57/82/84/1033578284.db2.gz UOGVBCCKHWTWQL-KKMIYCERSA-N 1 0 342.395 3.594 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000594936932 1033586715 /nfs/dbraw/zinc/58/67/15/1033586715.db2.gz YCSNGXBBSBXQGJ-YOEHRIQHSA-N 1 0 342.395 3.613 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@@H]1c1ccc(F)cc1 ZINC000059374626 1033592212 /nfs/dbraw/zinc/59/22/12/1033592212.db2.gz AGPUQCSGGSKIPK-MRXNPFEDSA-N 1 0 330.359 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000595015579 1033607036 /nfs/dbraw/zinc/60/70/36/1033607036.db2.gz ZEVMRHQRCAKKKE-OLZOCXBDSA-N 1 0 330.384 3.591 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CC[C@H]3C[C@H]3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000598986588 1033610036 /nfs/dbraw/zinc/61/00/36/1033610036.db2.gz DAZGJIPLMYPHFE-VNQPRFMTSA-N 1 0 340.427 3.521 20 5 EHBDRO CCOCc1ccccc1C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595004950 1033629657 /nfs/dbraw/zinc/62/96/57/1033629657.db2.gz UYSQQPODDPFHIL-AWEZNQCLSA-N 1 0 344.411 3.991 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595008499 1033631245 /nfs/dbraw/zinc/63/12/45/1033631245.db2.gz VBNZCCVUMJLFND-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000063739759 1033642135 /nfs/dbraw/zinc/64/21/35/1033642135.db2.gz VKYMRLMVIKTQKF-UHFFFAOYSA-N 1 0 345.365 3.924 20 5 EHBDRO C[N@@H+]1CCCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994762 1033647589 /nfs/dbraw/zinc/64/75/89/1033647589.db2.gz RGFDQAPAFNDOIE-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCCO[C@H]1C(C)C ZINC000595027542 1033649267 /nfs/dbraw/zinc/64/92/67/1033649267.db2.gz POLMXNIBWHSCIP-DEYYWGMASA-N 1 0 336.432 3.705 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCc3cc(Cl)ccc32)c([N+](=O)[O-])cc1O ZINC000598996622 1033649909 /nfs/dbraw/zinc/64/99/09/1033649909.db2.gz VQAVHWANUSHWIQ-AWEZNQCLSA-N 1 0 348.786 3.740 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000595036173 1033655477 /nfs/dbraw/zinc/65/54/77/1033655477.db2.gz QBDCSNNACBSUJF-KPZWWZAWSA-N 1 0 327.384 3.800 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@@H]3CCCc4scnc43)c2c1 ZINC000599047532 1033676181 /nfs/dbraw/zinc/67/61/81/1033676181.db2.gz ZUFWWIOMGXPOGZ-OAHLLOKOSA-N 1 0 342.424 3.742 20 5 EHBDRO C[C@H](O)[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000595103978 1033692082 /nfs/dbraw/zinc/69/20/82/1033692082.db2.gz PWURQELHDJSDDA-AGRHKRQWSA-N 1 0 326.396 3.684 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](n2cccn2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000599054982 1033691961 /nfs/dbraw/zinc/69/19/61/1033691961.db2.gz DWKBXCUQCFGNHK-RISCZKNCSA-N 1 0 342.321 3.554 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nccn1C ZINC000595108459 1033693290 /nfs/dbraw/zinc/69/32/90/1033693290.db2.gz QBQXWKHEEMIVBY-QWHCGFSZSA-N 1 0 334.445 3.550 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC1(C)C ZINC000595107653 1033693451 /nfs/dbraw/zinc/69/34/51/1033693451.db2.gz PDLOEAFOJRKQID-KGLIPLIRSA-N 1 0 338.473 3.870 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3CO2)cccc1[N+](=O)[O-] ZINC000599060060 1033698952 /nfs/dbraw/zinc/69/89/52/1033698952.db2.gz MCVZZHYQPVEQNH-PBHICJAKSA-N 1 0 326.396 3.695 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000595084703 1033699124 /nfs/dbraw/zinc/69/91/24/1033699124.db2.gz HZJVCVFHWGDSHY-MNEFBYGVSA-N 1 0 342.443 3.780 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)OC)c1 ZINC000599062860 1033703721 /nfs/dbraw/zinc/70/37/21/1033703721.db2.gz VXJYFXQKNTUBLP-AUUYWEPGSA-N 1 0 344.411 3.950 20 5 EHBDRO Cc1c(NC(=O)c2ccc3c(c2)[C@H](C[NH3+])CCC3)cccc1[N+](=O)[O-] ZINC000595252959 1033712556 /nfs/dbraw/zinc/71/25/56/1033712556.db2.gz KJBYOLRYXRULNY-HNNXBMFYSA-N 1 0 339.395 3.534 20 5 EHBDRO CCC[N@H+](Cc1onc(C)c1[N+](=O)[O-])[C@@H]1CCc2ccccc2C1 ZINC000595295168 1033721271 /nfs/dbraw/zinc/72/12/71/1033721271.db2.gz HJPDJXFRESIAMN-MRXNPFEDSA-N 1 0 329.400 3.661 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363641 1033782286 /nfs/dbraw/zinc/78/22/86/1033782286.db2.gz FWYGDDRWLMOICJ-JKIFEVAISA-N 1 0 335.423 3.571 20 5 EHBDRO CC(C)c1ccc(C(=O)NC2CCC(C[NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC000188064828 1033818397 /nfs/dbraw/zinc/81/83/97/1033818397.db2.gz OEJYDDOPSUQAKW-UHFFFAOYSA-N 1 0 347.459 3.568 20 5 EHBDRO CC(C)(COCc1ccccc1)[NH2+]Cc1ccc(F)cc1[N+](=O)[O-] ZINC000595470200 1033822761 /nfs/dbraw/zinc/82/27/61/1033822761.db2.gz NDIQEMWWMXQTEE-UHFFFAOYSA-N 1 0 332.375 3.819 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1 ZINC000593022264 1033840015 /nfs/dbraw/zinc/84/00/15/1033840015.db2.gz XNVIZUQKTDMJFO-UONOGXRCSA-N 1 0 342.395 3.663 20 5 EHBDRO CC(C)C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[NH+](C)C ZINC000608835674 1033908619 /nfs/dbraw/zinc/90/86/19/1033908619.db2.gz IJGRDQFGSHKPHB-QGZVFWFLSA-N 1 0 345.443 3.921 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(Oc3cccc(F)c3)CC2)cc1 ZINC000599504527 1033963907 /nfs/dbraw/zinc/96/39/07/1033963907.db2.gz BEOFRGIKMKQTSQ-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595747221 1033980086 /nfs/dbraw/zinc/98/00/86/1033980086.db2.gz IHYFDYCGZWCNKI-MOXGXCLJSA-N 1 0 340.423 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCCN(Cc1ccc(F)cc1F)C1CC1 ZINC000603855253 1033981191 /nfs/dbraw/zinc/98/11/91/1033981191.db2.gz KKORLIUHROOHKU-UHFFFAOYSA-N 1 0 348.349 3.916 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]([C@H]2CCCCO2)C1 ZINC000595791006 1034002795 /nfs/dbraw/zinc/00/27/95/1034002795.db2.gz SJIJELZLWRGSCJ-CRAIPNDOSA-N 1 0 348.443 3.775 20 5 EHBDRO COc1ccc(C(C)(C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2)cc1F ZINC000599597007 1034034742 /nfs/dbraw/zinc/03/47/42/1034034742.db2.gz HGGPCOCMYWZSQR-UHFFFAOYSA-N 1 0 348.374 3.776 20 5 EHBDRO C[C@@H]1CC[N@H+](CCN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000537610449 1034070418 /nfs/dbraw/zinc/07/04/18/1034070418.db2.gz MAWXHWOMPSNDJR-OXQOHEQNSA-N 1 0 339.439 3.616 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@H](C)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625103 1034072795 /nfs/dbraw/zinc/07/27/95/1034072795.db2.gz FZZHRHYDQOAXFV-LFNDISMMSA-N 1 0 332.322 3.515 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1cc(OC)c([N+](=O)[O-])cc1F ZINC000119076021 1034082166 /nfs/dbraw/zinc/08/21/66/1034082166.db2.gz GBBMRJGQUIGZSC-GFCCVEGCSA-N 1 0 327.400 3.665 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCOc1ccc(F)cc1 ZINC000604012590 1034136345 /nfs/dbraw/zinc/13/63/45/1034136345.db2.gz STTQWZUMNGTSMS-UHFFFAOYSA-N 1 0 348.374 3.514 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000596307371 1034163685 /nfs/dbraw/zinc/16/36/85/1034163685.db2.gz LHXKNXWFJWTTEU-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO CCC(C)(C)[NH2+][C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1NC(C)C ZINC000456157332 1034171716 /nfs/dbraw/zinc/17/17/16/1034171716.db2.gz ARHBYOXUKMXWAI-LBPRGKRZSA-N 1 0 336.436 3.520 20 5 EHBDRO CCn1cc(CN(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)cn1 ZINC000537623276 1034244391 /nfs/dbraw/zinc/24/43/91/1034244391.db2.gz BDUQKYLILBHVDX-UHFFFAOYSA-N 1 0 340.383 3.703 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000456267356 1034266570 /nfs/dbraw/zinc/26/65/70/1034266570.db2.gz IVAUITFOUCTHLV-AWEZNQCLSA-N 1 0 345.424 3.766 20 5 EHBDRO C/C(=C\C(=O)Nc1ccccc1C[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000785216470 1034299643 /nfs/dbraw/zinc/29/96/43/1034299643.db2.gz CTDIWOINISGOGC-WYMLVPIESA-N 1 0 339.395 3.698 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])nc2)[C@H]1c1ccc(Cl)cc1 ZINC000450413161 1034300399 /nfs/dbraw/zinc/30/03/99/1034300399.db2.gz SNTUGSTUYGHHCY-GOEBONIOSA-N 1 0 332.791 3.501 20 5 EHBDRO CCc1ccc([C@H](NCC[C@@H]([NH3+])C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000596653452 1034329405 /nfs/dbraw/zinc/32/94/05/1034329405.db2.gz KLZFWECNQNNRGW-IEBWSBKVSA-N 1 0 345.443 3.803 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C2 ZINC000612194072 1034436881 /nfs/dbraw/zinc/43/68/81/1034436881.db2.gz XAONJTCEBBHYJJ-MJICGBHWSA-N 1 0 338.407 3.764 20 5 EHBDRO CC[C@H](C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000060471645 1034571467 /nfs/dbraw/zinc/57/14/67/1034571467.db2.gz DKYSVARXSWAXGG-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@H](CCF)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597210348 1034593033 /nfs/dbraw/zinc/59/30/33/1034593033.db2.gz GGNKARWBVHLXPE-CQSZACIVSA-N 1 0 346.406 3.567 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@@H](CCF)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000597210345 1034594271 /nfs/dbraw/zinc/59/42/71/1034594271.db2.gz GGNKARWBVHLXPE-AWEZNQCLSA-N 1 0 346.406 3.567 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@H]4COC[C@H]4C3)s2)cc1 ZINC000597229667 1034611471 /nfs/dbraw/zinc/61/14/71/1034611471.db2.gz ICPRMVOVVVCWCA-LSDHHAIUSA-N 1 0 344.436 3.792 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000892479825 1034665137 /nfs/dbraw/zinc/66/51/37/1034665137.db2.gz PUXTUOFNQDQQGX-GFCCVEGCSA-N 1 0 346.383 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4COC[C@@H]4C3)o2)c(Cl)c1 ZINC000601975557 1034856173 /nfs/dbraw/zinc/85/61/73/1034856173.db2.gz LCTJBJAGVLZYFT-TXEJJXNPSA-N 1 0 348.786 3.586 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+](C[C@@H]3CCOC3)C3CC3)o2)c1 ZINC000129993370 1034992742 /nfs/dbraw/zinc/99/27/42/1034992742.db2.gz WBIMACZECRSUEB-AWEZNQCLSA-N 1 0 342.395 3.856 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000548941478 1035066568 /nfs/dbraw/zinc/06/65/68/1035066568.db2.gz UBWMYHJVWIVXFE-UHFFFAOYSA-N 1 0 334.416 3.539 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1C[C@@H](O)C[C@@H]1c1ccccc1 ZINC000411928039 1035077508 /nfs/dbraw/zinc/07/75/08/1035077508.db2.gz UDQKYXPRLWHCSM-SUMWQHHRSA-N 1 0 332.787 3.556 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580215758 1035418940 /nfs/dbraw/zinc/41/89/40/1035418940.db2.gz CPIQFBYNQOHMHA-KBXCAEBGSA-N 1 0 325.412 3.978 20 5 EHBDRO COc1ccccc1[C@@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000580624240 1035444670 /nfs/dbraw/zinc/44/46/70/1035444670.db2.gz PEEQURKBMSAKHA-CYBMUJFWSA-N 1 0 339.395 3.978 20 5 EHBDRO CC1(C)C[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC(C)(C)C1 ZINC000466923364 1035473178 /nfs/dbraw/zinc/47/31/78/1035473178.db2.gz BUNLJSCDABVAPD-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H](N2CCCC2=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000581380757 1035493223 /nfs/dbraw/zinc/49/32/23/1035493223.db2.gz DWRYRLGNDKMKOU-NUJGCVRESA-N 1 0 345.443 3.569 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCNC(=O)CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000089666374 1035522006 /nfs/dbraw/zinc/52/20/06/1035522006.db2.gz KEQGFXVDOFJAJL-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)C2CCCCCC2)cccc1[N+](=O)[O-] ZINC000164355794 1035522315 /nfs/dbraw/zinc/52/23/15/1035522315.db2.gz RXKHKXHYSMKUQB-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@]3(CC[N@H+](Cc4ccccc4)C3)C2)s1 ZINC000588072481 1035700316 /nfs/dbraw/zinc/70/03/16/1035700316.db2.gz LEJOQPKQIDCAGC-SFHVURJKSA-N 1 0 343.452 3.759 20 5 EHBDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000272015257 1035766790 /nfs/dbraw/zinc/76/67/90/1035766790.db2.gz QWTDCRFWHGJNQE-CABCVRRESA-N 1 0 326.824 3.932 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccc3c(c2)OCO3)ccc1[N+](=O)[O-] ZINC000492585518 1036032657 /nfs/dbraw/zinc/03/26/57/1036032657.db2.gz XKNZVVZGKOWCSN-LBPRGKRZSA-N 1 0 344.367 3.573 20 5 EHBDRO Cc1cc(N[C@H]2CCO[C@@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541191200 1036060540 /nfs/dbraw/zinc/06/05/40/1036060540.db2.gz SGXFLCQYBDUSOX-SCLBCKFNSA-N 1 0 343.427 3.879 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1-n1ccnc1 ZINC000152241799 1036204483 /nfs/dbraw/zinc/20/44/83/1036204483.db2.gz LPWIBCFNBDYASN-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCS[C@H]3CCCC[C@@H]32)ccc1[N+](=O)[O-] ZINC000492788765 1036294731 /nfs/dbraw/zinc/29/47/31/1036294731.db2.gz JSJPVKUBHRQZLY-RDJZCZTQSA-N 1 0 336.457 3.854 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+]1CC[C@@H](Cc2ccncc2)C1 ZINC000376366673 1036325261 /nfs/dbraw/zinc/32/52/61/1036325261.db2.gz HYDYLHPFIFUKSZ-AWEZNQCLSA-N 1 0 331.803 3.708 20 5 EHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@@H]1CCOC(C)(C)C1 ZINC000589274675 1036336759 /nfs/dbraw/zinc/33/67/59/1036336759.db2.gz NHYJQYKGXPSECN-MRXNPFEDSA-N 1 0 336.432 3.643 20 5 EHBDRO Cc1ccccc1C[N@H+](C)CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000026224062 1036393892 /nfs/dbraw/zinc/39/38/92/1036393892.db2.gz MKJMKIYMLPRKRU-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CC(C)(C)C1=CC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000535375233 1036414293 /nfs/dbraw/zinc/41/42/93/1036414293.db2.gz VLTBPOPIJJKNSM-UHFFFAOYSA-N 1 0 331.416 3.602 20 5 EHBDRO CCN(Cc1ccc(C)cc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589495152 1036437587 /nfs/dbraw/zinc/43/75/87/1036437587.db2.gz XFQMVKUPDKJJBD-UHFFFAOYSA-N 1 0 342.395 3.712 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2c2ccccc2)c1 ZINC000589494671 1036438005 /nfs/dbraw/zinc/43/80/05/1036438005.db2.gz LCSBPGCLEIJBTL-QGZVFWFLSA-N 1 0 340.379 3.719 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@]2(C1)CCc1ccccc1O2 ZINC000589518865 1036489103 /nfs/dbraw/zinc/48/91/03/1036489103.db2.gz XERZGQCLGKBYTM-FQEVSTJZSA-N 1 0 338.407 3.873 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000175730035 1036521657 /nfs/dbraw/zinc/52/16/57/1036521657.db2.gz GPPJGWVOZIVWPT-SFHVURJKSA-N 1 0 341.411 3.925 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000152750820 1036632471 /nfs/dbraw/zinc/63/24/71/1036632471.db2.gz GGOFEIYYJQXRFE-OLZOCXBDSA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CC3)CC2)c(C(F)(F)F)c1 ZINC000057137249 1036719437 /nfs/dbraw/zinc/71/94/37/1036719437.db2.gz SYKANKGQVKMCNB-UHFFFAOYSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152810043 1036789892 /nfs/dbraw/zinc/78/98/92/1036789892.db2.gz MJKMCMKXFOUPAU-LSDHHAIUSA-N 1 0 343.402 3.911 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NCc1csc([N+](=O)[O-])c1 ZINC000539531022 1036887757 /nfs/dbraw/zinc/88/77/57/1036887757.db2.gz OYEIKQQHERQRTO-HUUCEWRRSA-N 1 0 325.478 3.647 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290620 1036889411 /nfs/dbraw/zinc/88/94/11/1036889411.db2.gz GKIYEJFGJXXJCQ-RISCZKNCSA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@]1(CO)CCC[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237742627 1036902718 /nfs/dbraw/zinc/90/27/18/1036902718.db2.gz QHJPJQVJCUMEGX-ZWKOTPCHSA-N 1 0 346.452 3.964 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@@H](c2ccccc2)C1 ZINC000761511269 1037082979 /nfs/dbraw/zinc/08/29/79/1037082979.db2.gz PSDKBQLULNONRT-GOSISDBHSA-N 1 0 345.830 3.737 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2cc(F)cc(F)c2)cc1Cl ZINC000761521122 1037098595 /nfs/dbraw/zinc/09/85/95/1037098595.db2.gz UIUCSJJOKUPJEI-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542464468 1037117135 /nfs/dbraw/zinc/11/71/35/1037117135.db2.gz JIUSBDKFJXUIAB-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1c(Cc2noc([C@@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211335 1037129453 /nfs/dbraw/zinc/12/94/53/1037129453.db2.gz DNHIBTPKYBEHNG-MBNYWOFBSA-N 1 0 344.415 3.811 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)[C@@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000542185220 1037145594 /nfs/dbraw/zinc/14/55/94/1037145594.db2.gz OCGKOWQRNATKOL-AEGPPILISA-N 1 0 334.416 3.623 20 5 EHBDRO COc1cnccc1[C@H](C)[NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000188769388 1037213445 /nfs/dbraw/zinc/21/34/45/1037213445.db2.gz NOSWATYGOOUMNB-KGLIPLIRSA-N 1 0 329.400 3.670 20 5 EHBDRO C[N@H+](CCOCC1CC1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539862841 1037294200 /nfs/dbraw/zinc/29/42/00/1037294200.db2.gz LHOIYNKLOUTCHH-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO CCOc1cc(N2CCC(C[N@H+](C)C(C)C)CC2)ccc1[N+](=O)[O-] ZINC000539969350 1037426274 /nfs/dbraw/zinc/42/62/74/1037426274.db2.gz UJXSFHGBEYDVHD-UHFFFAOYSA-N 1 0 335.448 3.550 20 5 EHBDRO COc1cc(C[NH2+]C[C@H](C)C(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000493605485 1037509543 /nfs/dbraw/zinc/50/95/43/1037509543.db2.gz ZBJBCJUVBOMLQZ-NSHDSACASA-N 1 0 346.374 3.629 20 5 EHBDRO C[C@@H](NCC[NH2+]C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000591577315 1037514929 /nfs/dbraw/zinc/51/49/29/1037514929.db2.gz OWJJXHWKDXMDEU-GFCCVEGCSA-N 1 0 331.441 3.726 20 5 EHBDRO CCc1ccc([C@H](N[C@@H]2CCC[NH2+]CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578384 1037518414 /nfs/dbraw/zinc/51/84/14/1037518414.db2.gz YIQJZLXTHBPKRW-DNVCBOLYSA-N 1 0 343.427 3.571 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](CCO)c1ccccc1 ZINC000532516529 1037558053 /nfs/dbraw/zinc/55/80/53/1037558053.db2.gz HJNMOSICRZQMDS-RDJZCZTQSA-N 1 0 328.412 3.720 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ccc2c(c1)COC2)C1CC1 ZINC000540161169 1037620138 /nfs/dbraw/zinc/62/01/38/1037620138.db2.gz PQKCAYUQSWDGGG-LJQANCHMSA-N 1 0 338.407 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCSc3ccccc32)cc1 ZINC000540168317 1037637315 /nfs/dbraw/zinc/63/73/15/1037637315.db2.gz IVRUIDAKCQQNMF-INIZCTEOSA-N 1 0 330.409 3.800 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@H]1CCOC1 ZINC000463034344 1037691768 /nfs/dbraw/zinc/69/17/68/1037691768.db2.gz FDAWHMYEHAFEON-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO Cc1ccc(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000493938266 1037733750 /nfs/dbraw/zinc/73/37/50/1037733750.db2.gz XBUPINFCYXHPAB-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000475879281 1037804607 /nfs/dbraw/zinc/80/46/07/1037804607.db2.gz HJBPKGHKZPAFOS-UHFFFAOYSA-N 1 0 330.384 3.507 20 5 EHBDRO Cc1ccccc1C1([NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)CC1 ZINC000592139426 1037858972 /nfs/dbraw/zinc/85/89/72/1037858972.db2.gz GCAHTPJMJBXRQH-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO COc1ccc(C[NH2+]C2(c3cccc(F)c3)CCC2)cc1[N+](=O)[O-] ZINC000592145762 1037874968 /nfs/dbraw/zinc/87/49/68/1037874968.db2.gz ZMJJELPGBMYWDU-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO C[C@@H](C[NH2+]Cc1c(Cl)nc(Cl)n1C)c1ccccc1[N+](=O)[O-] ZINC000897469083 1038055004 /nfs/dbraw/zinc/05/50/04/1038055004.db2.gz CUBWCVGYKXTOIZ-VIFPVBQESA-N 1 0 343.214 3.528 20 5 EHBDRO COCCOc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000897469470 1038091276 /nfs/dbraw/zinc/09/12/76/1038091276.db2.gz KSBWMJVJAXRXGE-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOC1 ZINC000540600139 1038132212 /nfs/dbraw/zinc/13/22/12/1038132212.db2.gz BOOFJNMJLRYCES-QGZVFWFLSA-N 1 0 332.425 3.840 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1(c2ccccc2)CC1 ZINC000538523062 1038342860 /nfs/dbraw/zinc/34/28/60/1038342860.db2.gz DILJFCWOHOLABJ-CQSZACIVSA-N 1 0 339.395 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccccc3)C2)c2cccnc21 ZINC000382056743 1038519426 /nfs/dbraw/zinc/51/94/26/1038519426.db2.gz XNUDLGWSLKSSBJ-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NCc1ccccc1C[NH+]1CCCC1 ZINC000341456439 1038549738 /nfs/dbraw/zinc/54/97/38/1038549738.db2.gz AZQZJFFIXZCQML-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000539069823 1038669376 /nfs/dbraw/zinc/66/93/76/1038669376.db2.gz AAJUQLZFZUXXSL-KRWDZBQOSA-N 1 0 336.338 3.993 20 5 EHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000545458924 1038688075 /nfs/dbraw/zinc/68/80/75/1038688075.db2.gz XDBMFCXZTTYZKY-GHMZBOCLSA-N 1 0 347.337 3.633 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000461962778 1038698254 /nfs/dbraw/zinc/69/82/54/1038698254.db2.gz XNBQVPIGJGCHMY-LBPRGKRZSA-N 1 0 345.365 3.700 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCCCCO)ccc1Oc1ccc(F)cc1 ZINC000584570027 1038704302 /nfs/dbraw/zinc/70/43/02/1038704302.db2.gz QNPCRJBQYMNWBS-UHFFFAOYSA-N 1 0 348.374 3.778 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)C ZINC000479866938 1038845532 /nfs/dbraw/zinc/84/55/32/1038845532.db2.gz SZDJCBCRAVECDX-LNENJAERSA-N 1 0 334.416 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@]2(Cc3ccc(Cl)cc3)CCOC2)cc1 ZINC000500569570 1039000438 /nfs/dbraw/zinc/00/04/38/1039000438.db2.gz YRRZLFUIWCAURA-SFHVURJKSA-N 1 0 346.814 3.740 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512420119 1039084897 /nfs/dbraw/zinc/08/48/97/1039084897.db2.gz HHOQPWSOEWRPPO-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCOC1CCOCC1)CCCC2 ZINC000417311563 1039663725 /nfs/dbraw/zinc/66/37/25/1039663725.db2.gz PFNRGTGYAWCUNB-IBGZPJMESA-N 1 0 348.443 3.538 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2ccccc2[N+](=O)[O-])CC1 ZINC000554854394 1039837906 /nfs/dbraw/zinc/83/79/06/1039837906.db2.gz VRXXXPZNFNCPQT-UHFFFAOYSA-N 1 0 334.416 3.539 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000480722847 1039930458 /nfs/dbraw/zinc/93/04/58/1039930458.db2.gz QJVFVCHFSYWYHF-QGZVFWFLSA-N 1 0 332.400 3.590 20 5 EHBDRO CCOC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCC1 ZINC000573510352 1040137021 /nfs/dbraw/zinc/13/70/21/1040137021.db2.gz AIGKWDPAABRPKX-QGZVFWFLSA-N 1 0 332.444 3.855 20 5 EHBDRO CCOc1ccc(NC(=O)C[N@H+](CC)C2CCCCC2)c([N+](=O)[O-])c1 ZINC000027284698 1040159534 /nfs/dbraw/zinc/15/95/34/1040159534.db2.gz ZCJXGSVTEYWXTJ-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO CCC1CC[NH+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000053377054 1040267445 /nfs/dbraw/zinc/26/74/45/1040267445.db2.gz XJDSEGNWFUZDMC-LBPRGKRZSA-N 1 0 330.388 3.828 20 5 EHBDRO COc1cc(C[NH2+][C@H](c2ncccc2C)C(C)C)ccc1[N+](=O)[O-] ZINC000489981536 1040287966 /nfs/dbraw/zinc/28/79/66/1040287966.db2.gz WBJIBEAGEVOSAJ-KRWDZBQOSA-N 1 0 329.400 3.794 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H](Nc3ccccc3)C2)c1 ZINC000490038757 1040304454 /nfs/dbraw/zinc/30/44/54/1040304454.db2.gz AEFIMTHKCRHYSB-KRWDZBQOSA-N 1 0 341.411 3.550 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769534 1040426008 /nfs/dbraw/zinc/42/60/08/1040426008.db2.gz FFQDXJPJAMMJGN-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000486782288 1040441178 /nfs/dbraw/zinc/44/11/78/1040441178.db2.gz UJBUFUDKSBNXCH-MRXNPFEDSA-N 1 0 333.432 3.602 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CC[C@H](C)C[C@H]1C ZINC000481187500 1040452049 /nfs/dbraw/zinc/45/20/49/1040452049.db2.gz HAOBFCYEESGPKT-WOSRLPQWSA-N 1 0 333.432 3.646 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481190390 1040464314 /nfs/dbraw/zinc/46/43/14/1040464314.db2.gz OJGYEHKBFNFJFB-CQSZACIVSA-N 1 0 339.823 3.745 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CC[C@@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000481194437 1040472081 /nfs/dbraw/zinc/47/20/81/1040472081.db2.gz WALTYDWNKBGNKD-RJZRQDKASA-N 1 0 333.432 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnn(-c2ccccc2)c1 ZINC000129490511 1040505394 /nfs/dbraw/zinc/50/53/94/1040505394.db2.gz QELODEGQEBLWNJ-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@H]([NH2+]CC1(CO)CC(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000433066781 1040621544 /nfs/dbraw/zinc/62/15/44/1040621544.db2.gz KVVDEGGNNBVEOB-IJNIYJAUSA-N 1 0 340.423 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cccc4n[nH]cc43)C2)cc1 ZINC000600167738 1040753094 /nfs/dbraw/zinc/75/30/94/1040753094.db2.gz CEMXOFUBOHXIDC-HNNXBMFYSA-N 1 0 336.395 3.851 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccc(O)cc2)C1 ZINC000600213369 1040850132 /nfs/dbraw/zinc/85/01/32/1040850132.db2.gz CSVDCTNAEJCRGZ-HNNXBMFYSA-N 1 0 342.395 3.689 20 5 EHBDRO CC(C)[C@H](C[NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000433159192 1040930386 /nfs/dbraw/zinc/93/03/86/1040930386.db2.gz DASVAXCYRSVXSP-KRWDZBQOSA-N 1 0 343.383 3.557 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000027906059 1041020431 /nfs/dbraw/zinc/02/04/31/1041020431.db2.gz AXGHYNYUSQEZOY-KRWDZBQOSA-N 1 0 339.395 3.543 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](CO)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000433231747 1041118998 /nfs/dbraw/zinc/11/89/98/1041118998.db2.gz KAKXFBSMEPXLTO-HZPDHXFCSA-N 1 0 332.425 3.702 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854508 1041243647 /nfs/dbraw/zinc/24/36/47/1041243647.db2.gz HVAQPCMSVJZZHV-GJZGRUSLSA-N 1 0 341.411 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc(Cn2nc(C(F)(F)F)c3cnccc32)c(F)c1 ZINC000092918324 1041395897 /nfs/dbraw/zinc/39/58/97/1041395897.db2.gz KISGKRNDVGCCDM-UHFFFAOYSA-N 1 0 340.236 3.546 20 5 EHBDRO CC(C)(C)[C@@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000111057349 1041717937 /nfs/dbraw/zinc/71/79/37/1041717937.db2.gz JLFQBAGJOBBNAN-ZIAGYGMSSA-N 1 0 333.432 3.728 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000107070920 1041814696 /nfs/dbraw/zinc/81/46/96/1041814696.db2.gz UVIVOMFVYMNLDJ-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181782641 1042112784 /nfs/dbraw/zinc/11/27/84/1042112784.db2.gz QSZJEXHPJNUOEZ-ZOCIIQOWSA-N 1 0 325.412 3.691 20 5 EHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CCCC1 ZINC000111221682 1042250696 /nfs/dbraw/zinc/25/06/96/1042250696.db2.gz PLHBTZNMQMXUBD-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCC[C@H]([NH+]4CCCC4)CC3)ccnc21 ZINC000432306708 1042656512 /nfs/dbraw/zinc/65/65/12/1042656512.db2.gz JBPPCHVUXMFJEO-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]1[C@@H]1CCCO1 ZINC000342051340 1042794700 /nfs/dbraw/zinc/79/47/00/1042794700.db2.gz SIZFQDAPMZQEKY-WMZOPIPTSA-N 1 0 334.416 3.525 20 5 EHBDRO C[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC(C)(C)O1 ZINC000511979136 1042830161 /nfs/dbraw/zinc/83/01/61/1042830161.db2.gz RTSDFQUPLIEAJK-ZDUSSCGKSA-N 1 0 330.384 3.854 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c(F)c1 ZINC000568716701 1042838480 /nfs/dbraw/zinc/83/84/80/1042838480.db2.gz CWNGFXUKJKMDKB-SFHVURJKSA-N 1 0 330.359 3.910 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000541999091 1043002137 /nfs/dbraw/zinc/00/21/37/1043002137.db2.gz VGLVYDOGEBNJNV-GFCCVEGCSA-N 1 0 326.824 3.764 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cc(F)cc([N+](=O)[O-])c2)c1 ZINC000344185145 1043383884 /nfs/dbraw/zinc/38/38/84/1043383884.db2.gz CEBBJILLISLZIE-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000183483407 1125575321 /nfs/dbraw/zinc/57/53/21/1125575321.db2.gz AOVMADCQUGKJKQ-ZDUSSCGKSA-N 1 0 330.432 3.537 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000170914138 1126922998 /nfs/dbraw/zinc/92/29/98/1126922998.db2.gz IOZADILFLUJVGL-CQSZACIVSA-N 1 0 329.400 3.914 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000552099327 1127578499 /nfs/dbraw/zinc/57/84/99/1127578499.db2.gz FNOIBEHYGLKEQD-ZTNFWEORSA-N 1 0 340.423 3.946 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CC[C@H](O)C34CCCC4)o2)c1 ZINC000552316938 1127749283 /nfs/dbraw/zinc/74/92/83/1127749283.db2.gz UQFHBRARUIUHOQ-SFHVURJKSA-N 1 0 342.395 3.734 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](C)[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571445 1128105202 /nfs/dbraw/zinc/10/52/02/1128105202.db2.gz REQQJRMIDGTPNJ-MNOVXSKESA-N 1 0 344.358 3.683 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC001168603734 1128288334 /nfs/dbraw/zinc/28/83/34/1128288334.db2.gz IFJPWURNUIRXQG-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@@H](C3CCOCC3)C2)cc1 ZINC001649111934 1128290832 /nfs/dbraw/zinc/29/08/32/1128290832.db2.gz GKXLLPZXJALEKQ-IAGOWNOFSA-N 1 0 348.443 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCC[C@H](C3CCOCC3)C2)cc1 ZINC001649111935 1128291000 /nfs/dbraw/zinc/29/10/00/1128291000.db2.gz GKXLLPZXJALEKQ-IRXDYDNUSA-N 1 0 348.443 3.549 20 5 EHBDRO CCCCCNC(=O)C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000075625952 1128352763 /nfs/dbraw/zinc/35/27/63/1128352763.db2.gz OMFQXZFHNHNWTD-OAHLLOKOSA-N 1 0 347.459 3.674 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@@H+](C)[C@H]1c1cccs1 ZINC000301455309 1128374438 /nfs/dbraw/zinc/37/44/38/1128374438.db2.gz YOQVSVIAXRKXSG-CZUORRHYSA-N 1 0 346.456 3.855 20 5 EHBDRO CC[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@@H]1C ZINC001307703132 1128455780 /nfs/dbraw/zinc/45/57/80/1128455780.db2.gz OMQOOHXQGCZZCN-MNOVXSKESA-N 1 0 327.222 3.978 20 5 EHBDRO Cc1cnc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564044 1128498239 /nfs/dbraw/zinc/49/82/39/1128498239.db2.gz VRNPDEUWRPYHDB-DOTOQJQBSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ncc1[N+](=O)[O-] ZINC000301599731 1128509112 /nfs/dbraw/zinc/50/91/12/1128509112.db2.gz UOTNMZGRCSCEEB-RDJZCZTQSA-N 1 0 340.427 3.621 20 5 EHBDRO CCCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765849374 1128572949 /nfs/dbraw/zinc/57/29/49/1128572949.db2.gz PSXURBSZZYBFME-IFXJQAMLSA-N 1 0 344.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]C1CCC(O)(c2ccccc2)CC1 ZINC000273593095 1128607991 /nfs/dbraw/zinc/60/79/91/1128607991.db2.gz DBGFAKQHRLZLOQ-UHFFFAOYSA-N 1 0 326.396 3.515 20 5 EHBDRO COc1cc(C)c([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000123154822 1128660180 /nfs/dbraw/zinc/66/01/80/1128660180.db2.gz UUBWEQIFSUDUEV-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1cc(Br)ccc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000111388634 1120359007 /nfs/dbraw/zinc/35/90/07/1120359007.db2.gz HYSPEQKERWPOSX-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO Cc1nc(NC2CC[NH+]([C@H](C)c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000301687899 1128922243 /nfs/dbraw/zinc/92/22/43/1128922243.db2.gz XLTWSAGWYOBJTN-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO CC1(C)[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000494484482 1120570549 /nfs/dbraw/zinc/57/05/49/1120570549.db2.gz KLXAPQPBVZFBEU-CVEARBPZSA-N 1 0 332.425 3.572 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000193066644 1120888060 /nfs/dbraw/zinc/88/80/60/1120888060.db2.gz YKEBUXIWSSTDKR-GOSISDBHSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](C[C@H]1CCOC1)c1ccc(F)cc1 ZINC000495045874 1120939880 /nfs/dbraw/zinc/93/98/80/1120939880.db2.gz MPAOHLUTQJDKSN-KDOFPFPSSA-N 1 0 344.386 3.991 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000153332142 1120967286 /nfs/dbraw/zinc/96/72/86/1120967286.db2.gz NSXPQAVQNKGKRI-RDTXWAMCSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N(C)C ZINC000153332036 1120967444 /nfs/dbraw/zinc/96/74/44/1120967444.db2.gz NSXPQAVQNKGKRI-KBXCAEBGSA-N 1 0 343.427 3.557 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)O1 ZINC000495183564 1120981186 /nfs/dbraw/zinc/98/11/86/1120981186.db2.gz YDAUCDOQEMGMCE-CQSZACIVSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H]1C ZINC000193327966 1121113837 /nfs/dbraw/zinc/11/38/37/1121113837.db2.gz AOTOWFIEKIJMBT-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@H]1CC2(CCC2)CN1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138278 1121125893 /nfs/dbraw/zinc/12/58/93/1121125893.db2.gz LJVDFIHJARUPST-NSHDSACASA-N 1 0 334.807 3.820 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000495373678 1121145249 /nfs/dbraw/zinc/14/52/49/1121145249.db2.gz HGVBSARCUBIXLM-HOTGVXAUSA-N 1 0 338.835 3.728 20 5 EHBDRO CC[N@@H+]1CCCC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000303542977 1121159623 /nfs/dbraw/zinc/15/96/23/1121159623.db2.gz YVSGSYCDTFLVIQ-QGZVFWFLSA-N 1 0 347.462 3.992 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CCN(C2CCCC2)C1)C1CC1 ZINC000153682499 1121581760 /nfs/dbraw/zinc/58/17/60/1121581760.db2.gz OPGAJSYCQGAFOS-PKOBYXMFSA-N 1 0 343.471 3.522 20 5 EHBDRO Cc1cc(NCc2ccnc(N3CCCCC3)c2)ccc1[N+](=O)[O-] ZINC000301092752 1121584387 /nfs/dbraw/zinc/58/43/87/1121584387.db2.gz LQJMUXVNDOPZEF-UHFFFAOYSA-N 1 0 326.400 3.901 20 5 EHBDRO CC[N@H+](CC(C)C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000153752574 1121690406 /nfs/dbraw/zinc/69/04/06/1121690406.db2.gz YFIYZZNISMOZAH-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609233216 1121789693 /nfs/dbraw/zinc/78/96/93/1121789693.db2.gz BRPLVNLRKDIJNZ-LJQANCHMSA-N 1 0 342.395 3.567 20 5 EHBDRO CC(=O)c1c(NC[C@@H](c2ccccc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207030 1121875955 /nfs/dbraw/zinc/87/59/55/1121875955.db2.gz OZUNZOXFKHYEIS-KRWDZBQOSA-N 1 0 327.384 3.512 20 5 EHBDRO CC(=O)c1ccc(NCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301111350 1121949044 /nfs/dbraw/zinc/94/90/44/1121949044.db2.gz RMMYBHUUNGWJCV-KBPBESRZSA-N 1 0 333.432 3.577 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)C1 ZINC000301129847 1122041308 /nfs/dbraw/zinc/04/13/08/1122041308.db2.gz ZSUADSXMPRSQKP-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+](CCO)[C@@H]2CCc3ccccc32)ccc1Cl ZINC000153913747 1122106685 /nfs/dbraw/zinc/10/66/85/1122106685.db2.gz XBJZYSKZGRRNQX-QGZVFWFLSA-N 1 0 346.814 3.730 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132038832 1129040529 /nfs/dbraw/zinc/04/05/29/1129040529.db2.gz QYZCHMSROKINJV-HNNXBMFYSA-N 1 0 337.395 3.621 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@H](CCc2ccccc2)C1 ZINC000544530205 1122319972 /nfs/dbraw/zinc/31/99/72/1122319972.db2.gz SGMZOVDWBHBDGJ-OXQOHEQNSA-N 1 0 340.423 3.989 20 5 EHBDRO CC(C)C[C@@H](CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000498281471 1122829943 /nfs/dbraw/zinc/82/99/43/1122829943.db2.gz DRIQHDFKRNFWHX-HNNXBMFYSA-N 1 0 349.475 3.598 20 5 EHBDRO CC(=O)c1ccc(N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c([N+](=O)[O-])c1 ZINC000919722096 1123133561 /nfs/dbraw/zinc/13/35/61/1123133561.db2.gz WSPKVKMDFILQAF-VBQJREDUSA-N 1 0 345.443 3.639 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cnc(-c2ccccc2)nc1 ZINC000556830901 1123141428 /nfs/dbraw/zinc/14/14/28/1123141428.db2.gz KIQDPDSWHZCECJ-UHFFFAOYSA-N 1 0 348.406 3.726 20 5 EHBDRO CN(c1ccccc1)C1CC[NH+](Cc2ccccc2[N+](=O)[O-])CC1 ZINC000065957208 1129115289 /nfs/dbraw/zinc/11/52/89/1129115289.db2.gz OHSDPJIWMJWOBT-UHFFFAOYSA-N 1 0 325.412 3.696 20 5 EHBDRO Cc1cccc(N2CCC(Nc3c(F)cc([N+](=O)[O-])cc3F)CC2)n1 ZINC000301811870 1129126858 /nfs/dbraw/zinc/12/68/58/1129126858.db2.gz YHGZNSXXIZQYIG-UHFFFAOYSA-N 1 0 348.353 3.657 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)c1 ZINC000609916191 1123691877 /nfs/dbraw/zinc/69/18/77/1123691877.db2.gz DQYYQERBFMYTON-INIZCTEOSA-N 1 0 344.386 3.677 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916573 1123692123 /nfs/dbraw/zinc/69/21/23/1123692123.db2.gz YCTABOITTRVVHU-GDBMZVCRSA-N 1 0 344.386 3.991 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000255566045 1129140822 /nfs/dbraw/zinc/14/08/22/1129140822.db2.gz LKZCXIBCKYFRAV-OTIVFRFGSA-N 1 0 329.444 3.558 20 5 EHBDRO Cn1cc(C[NH2+]CCC2CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237910816 1123914867 /nfs/dbraw/zinc/91/48/67/1123914867.db2.gz TYUJCSCKWGNYFU-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccnn1C ZINC000618577758 1125114727 /nfs/dbraw/zinc/11/47/27/1125114727.db2.gz NWIFNOUWGVYOEQ-ROUUACIJSA-N 1 0 342.443 3.735 20 5 EHBDRO CN1Cc2ccccc2[C@@H]([NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)C1 ZINC000618572318 1125114972 /nfs/dbraw/zinc/11/49/72/1125114972.db2.gz TVPRCJXFFRPEMN-PMACEKPBSA-N 1 0 337.423 3.749 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCCc2cccnc21 ZINC000619611521 1125372642 /nfs/dbraw/zinc/37/26/42/1125372642.db2.gz PAWMDMXHZZLXDA-HNNXBMFYSA-N 1 0 331.803 3.853 20 5 EHBDRO CCCN1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])cc3F)c2C1 ZINC000066514073 1129179209 /nfs/dbraw/zinc/17/92/09/1129179209.db2.gz BOOZPYOSZYANAK-UHFFFAOYSA-N 1 0 343.358 3.712 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](CCc1cccc(F)c1)C1CC1 ZINC000078705073 1129185141 /nfs/dbraw/zinc/18/51/41/1129185141.db2.gz MVCXGGIFWCVUQI-UHFFFAOYSA-N 1 0 344.386 3.950 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000078989287 1129220572 /nfs/dbraw/zinc/22/05/72/1129220572.db2.gz CNCWZPNQNDTMET-QWHCGFSZSA-N 1 0 328.368 3.778 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)CC[C@@H]21 ZINC000301901923 1129308583 /nfs/dbraw/zinc/30/85/83/1129308583.db2.gz NUTKGGYHIPRQAZ-HOCLYGCPSA-N 1 0 347.459 3.693 20 5 EHBDRO COc1cc(NC[C@@H](c2ccc(C)cc2)[NH+](C)C)c(F)cc1[N+](=O)[O-] ZINC000301912999 1129347751 /nfs/dbraw/zinc/34/77/51/1129347751.db2.gz CHDGUAVIGKMNMG-KRWDZBQOSA-N 1 0 347.390 3.766 20 5 EHBDRO Cc1nc(Nc2cccc(CC[NH+]3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000301940813 1129402090 /nfs/dbraw/zinc/40/20/90/1129402090.db2.gz UVUIOQFYSMDNSI-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000117343324 1129434874 /nfs/dbraw/zinc/43/48/74/1129434874.db2.gz MXDCOVBUOBUQGU-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@H]1CCC[C@@H]1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000466424984 1129442120 /nfs/dbraw/zinc/44/21/20/1129442120.db2.gz YOQMRELAWLRZEJ-DZGCQCFKSA-N 1 0 328.416 3.521 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1Nc1cccc(C[NH+]2CCSCC2)c1 ZINC000301960915 1129458338 /nfs/dbraw/zinc/45/83/38/1129458338.db2.gz QMEKVRFCKRIUEH-UHFFFAOYSA-N 1 0 344.440 3.591 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](CC(C)C)C2)c1 ZINC000301972795 1129465404 /nfs/dbraw/zinc/46/54/04/1129465404.db2.gz IQIMZINESXNHAG-CYBMUJFWSA-N 1 0 339.411 3.522 20 5 EHBDRO CCC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494521 1129492540 /nfs/dbraw/zinc/49/25/40/1129492540.db2.gz DFTCOBWYXOJIAK-LSDHHAIUSA-N 1 0 333.432 3.742 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)CC(C)(C)O ZINC000093414375 1129587191 /nfs/dbraw/zinc/58/71/91/1129587191.db2.gz MZMPJOSKBSSSQE-UHFFFAOYSA-N 1 0 338.791 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOC3(CCC3)C2)o1 ZINC000093640208 1129597603 /nfs/dbraw/zinc/59/76/03/1129597603.db2.gz PQRGEJJDMKHGSU-UHFFFAOYSA-N 1 0 328.368 3.610 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000154971072 1129602496 /nfs/dbraw/zinc/60/24/96/1129602496.db2.gz IINMUZQPCFBYAV-SCLBCKFNSA-N 1 0 331.391 3.687 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc2c(c(Cl)c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000391136523 1129651628 /nfs/dbraw/zinc/65/16/28/1129651628.db2.gz PXTXYPPTFQLPDO-SNVBAGLBSA-N 1 0 334.759 3.828 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]1C ZINC000163016271 1129915913 /nfs/dbraw/zinc/91/59/13/1129915913.db2.gz JDODQEOSTWJJNY-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000007982544 1129994831 /nfs/dbraw/zinc/99/48/31/1129994831.db2.gz MLBYRBOPKNQJJG-GOSISDBHSA-N 1 0 327.384 3.512 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(C)[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246474264 1130385373 /nfs/dbraw/zinc/38/53/73/1130385373.db2.gz QSZJEXHPJNUOEZ-JVPBZIDWSA-N 1 0 325.412 3.691 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246474282 1130385736 /nfs/dbraw/zinc/38/57/36/1130385736.db2.gz QSZJEXHPJNUOEZ-KYNGSXCRSA-N 1 0 325.412 3.691 20 5 EHBDRO C[N@H+](CCNc1nc2ccc([N+](=O)[O-])cc2s1)C1CCCCC1 ZINC000731209085 1130779443 /nfs/dbraw/zinc/77/94/43/1130779443.db2.gz JJSUBEGANQGPFG-UHFFFAOYSA-N 1 0 334.445 3.881 20 5 EHBDRO C[C@@H]1CO[C@@H](c2ccccc2)[C@@H](C)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892953 1130857963 /nfs/dbraw/zinc/85/79/63/1130857963.db2.gz LDMRXZVQNJNGRD-JXXFODFXSA-N 1 0 340.423 3.988 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](Cn2cccn2)c2ccccc2)cc1[N+](=O)[O-] ZINC000741259382 1131591205 /nfs/dbraw/zinc/59/12/05/1131591205.db2.gz XFNDROUAAUDXRZ-SFHVURJKSA-N 1 0 336.395 3.631 20 5 EHBDRO [NH3+]Cc1c(F)cccc1N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897911 1131881348 /nfs/dbraw/zinc/88/13/48/1131881348.db2.gz DFYZSIBZAYIZAD-AWEZNQCLSA-N 1 0 329.375 3.552 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)nc1 ZINC001172902536 1131884756 /nfs/dbraw/zinc/88/47/56/1131884756.db2.gz ZMBUAWKCVYDDKW-WMLDXEAASA-N 1 0 325.412 3.896 20 5 EHBDRO CC(C)c1cc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)on1 ZINC001172902058 1131884981 /nfs/dbraw/zinc/88/49/81/1131884981.db2.gz UMRUXAKXNUBULY-OAHLLOKOSA-N 1 0 329.400 3.743 20 5 EHBDRO CC(C)(C)CN1CC[C@H]([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903025 1131885452 /nfs/dbraw/zinc/88/54/52/1131885452.db2.gz DCOFKCSMMRVBIO-ROUUACIJSA-N 1 0 345.487 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCc3ccncc31)CC2 ZINC001172908179 1131887336 /nfs/dbraw/zinc/88/73/36/1131887336.db2.gz KZQZIBNJZVRDQT-FXAWDEMLSA-N 1 0 337.423 3.904 20 5 EHBDRO CC(C)(Cc1cccnc1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907266 1131888020 /nfs/dbraw/zinc/88/80/20/1131888020.db2.gz RNSPZYWLXRRAFV-SFHVURJKSA-N 1 0 339.439 3.848 20 5 EHBDRO COC(=O)CCCCCC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895622 1131901147 /nfs/dbraw/zinc/90/11/47/1131901147.db2.gz GNRJHZDMDBGXOU-KRWDZBQOSA-N 1 0 348.443 3.555 20 5 EHBDRO COc1ccc2c(c1)C[N@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)C2 ZINC001172914158 1131903112 /nfs/dbraw/zinc/90/31/12/1131903112.db2.gz DIKQPJCRTVKKOQ-SFHVURJKSA-N 1 0 338.407 3.867 20 5 EHBDRO CC(C)OC1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172915559 1131903149 /nfs/dbraw/zinc/90/31/49/1131903149.db2.gz PATHXMHVLWOYED-KRWDZBQOSA-N 1 0 332.444 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](c3ccccn3)C1)CC2 ZINC001172914249 1131903313 /nfs/dbraw/zinc/90/33/13/1131903313.db2.gz FSYUFEQUSQZVQT-QZTJIDSGSA-N 1 0 337.423 3.727 20 5 EHBDRO Nc1ccc(C2([NH2+][C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)CC2)cc1 ZINC001172909539 1131916568 /nfs/dbraw/zinc/91/65/68/1131916568.db2.gz SJFBBBBGNMBUEE-SFHVURJKSA-N 1 0 337.423 3.703 20 5 EHBDRO Cc1cc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cnc1Cl ZINC001172912716 1131917495 /nfs/dbraw/zinc/91/74/95/1131917495.db2.gz OQFDQFCBERUARQ-INIZCTEOSA-N 1 0 345.830 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCOc1cccc(F)c1)CC2 ZINC001172911956 1131917828 /nfs/dbraw/zinc/91/78/28/1131917828.db2.gz LAUNEQFMEJDFGQ-KRWDZBQOSA-N 1 0 344.386 3.650 20 5 EHBDRO CC[N@H+](Cc1ccccn1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172912538 1131918272 /nfs/dbraw/zinc/91/82/72/1131918272.db2.gz BKWVBLVMJIHTSB-GOSISDBHSA-N 1 0 325.412 3.759 20 5 EHBDRO CCC(CC)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173005316 1131934068 /nfs/dbraw/zinc/93/40/68/1131934068.db2.gz BJGYYWVLHGLWHX-UHFFFAOYSA-N 1 0 327.375 3.620 20 5 EHBDRO C[C@@H]1CCC[N@@H+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173014068 1131936114 /nfs/dbraw/zinc/93/61/14/1131936114.db2.gz JJJVZGPDWFDUDB-GFCCVEGCSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2cc(C)cs2)c1F ZINC001173176106 1131990868 /nfs/dbraw/zinc/99/08/68/1131990868.db2.gz XLVMJCQUUSIBMF-NSHDSACASA-N 1 0 338.404 3.833 20 5 EHBDRO CCOC(=O)C[C@H]1CC[C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173218585 1132003047 /nfs/dbraw/zinc/00/30/47/1132003047.db2.gz KSFZWLWFMICYMR-XIRDDKMYSA-N 1 0 348.443 3.627 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]2[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220643 1132004780 /nfs/dbraw/zinc/00/47/80/1132004780.db2.gz GIFVGNGEZUPMRC-ORAYPTAESA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(Cc2cccnc2)CC1 ZINC001173224717 1132005089 /nfs/dbraw/zinc/00/50/89/1132005089.db2.gz OMAYFQYOXJECFQ-HNNXBMFYSA-N 1 0 325.412 3.533 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cnc(-c2ccc(C[NH3+])cc2)c1 ZINC001173225208 1132005185 /nfs/dbraw/zinc/00/51/85/1132005185.db2.gz IKRMYTLNKJTMOF-AWEZNQCLSA-N 1 0 336.395 3.721 20 5 EHBDRO Cc1ccc(N2CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC001173224336 1132005228 /nfs/dbraw/zinc/00/52/28/1132005228.db2.gz DTBCUJJLDCHKJB-QGZVFWFLSA-N 1 0 339.439 3.656 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173223377 1132005437 /nfs/dbraw/zinc/00/54/37/1132005437.db2.gz IGHHXQRVBYODLE-HNNXBMFYSA-N 1 0 327.428 3.797 20 5 EHBDRO Cc1ccccc1O[C@@H]1CC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226692 1132007005 /nfs/dbraw/zinc/00/70/05/1132007005.db2.gz KWGPDJQXFPUFSZ-QFBILLFUSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1COc2ccc(Cl)cc21 ZINC001173226264 1132007094 /nfs/dbraw/zinc/00/70/94/1132007094.db2.gz WRXLIIRFLWUSLI-BDJLRTHQSA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC001173230941 1132008758 /nfs/dbraw/zinc/00/87/58/1132008758.db2.gz GXZQIZWNHXLRFP-HOCLYGCPSA-N 1 0 348.443 3.580 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173232036 1132009051 /nfs/dbraw/zinc/00/90/51/1132009051.db2.gz CKUCCYLVGBVPKA-AUUYWEPGSA-N 1 0 325.412 3.970 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173213545 1132013740 /nfs/dbraw/zinc/01/37/40/1132013740.db2.gz GFOQYYLZURQKGN-KBXCAEBGSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1ccc(C[N@H+](CCc2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000746118849 1132378461 /nfs/dbraw/zinc/37/84/61/1132378461.db2.gz GWDUORSBJNYFSP-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO Cc1ccc(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000065436735 1132384062 /nfs/dbraw/zinc/38/40/62/1132384062.db2.gz WEAPKKCNNFQZAX-CYBMUJFWSA-N 1 0 348.447 3.535 20 5 EHBDRO [NH3+]Cc1ccc2ncn(-c3cc4cccnc4c4ncccc34)c2c1 ZINC001168847477 1132586512 /nfs/dbraw/zinc/58/65/12/1132586512.db2.gz HKNYHFOGZJLXHX-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccccc1C[NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168968519 1132622065 /nfs/dbraw/zinc/62/20/65/1132622065.db2.gz ZUPTZOUXHROYSM-DZGCQCFKSA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2ccc(O)cc2)C1 ZINC001168989845 1132634621 /nfs/dbraw/zinc/63/46/21/1132634621.db2.gz XBMQGDMXRUARBO-BJZITVGISA-N 1 0 326.396 3.517 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ccccc2)c2ccc(O)cc2)C1 ZINC001168989847 1132634951 /nfs/dbraw/zinc/63/49/51/1132634951.db2.gz XBMQGDMXRUARBO-LJHODMEESA-N 1 0 326.396 3.517 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(Cc3ccc(F)cc3F)CC2)C1 ZINC001169039100 1132638179 /nfs/dbraw/zinc/63/81/79/1132638179.db2.gz NBJRDLMOCQYCNO-YOEHRIQHSA-N 1 0 338.398 3.665 20 5 EHBDRO CC(C)(C)c1ccc(N2CC[NH+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169042070 1132638347 /nfs/dbraw/zinc/63/83/47/1132638347.db2.gz CTPRUWWDCVIAEY-LPHOPBHVSA-N 1 0 345.487 3.552 20 5 EHBDRO C[C@@H]1OC2(CC[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169056994 1132645475 /nfs/dbraw/zinc/64/54/75/1132645475.db2.gz UOWSZWUDNFWHSV-ARFHVFGLSA-N 1 0 330.428 3.514 20 5 EHBDRO CC1(C)C[C@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@@](C)(C[NH3+])C1 ZINC001169142960 1132674335 /nfs/dbraw/zinc/67/43/35/1132674335.db2.gz IPECSGCNNZCWPC-MGPLVRAMSA-N 1 0 349.460 3.555 20 5 EHBDRO CN(CCOc1ccc([N+](=O)[O-])cc1)C(C)(C)C[NH+]1CCCCCC1 ZINC001169506911 1132773781 /nfs/dbraw/zinc/77/37/81/1132773781.db2.gz GPLHRMRELHLOFL-UHFFFAOYSA-N 1 0 349.475 3.560 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CN1CCC[C@H](C)C1 ZINC001177474813 1133066179 /nfs/dbraw/zinc/06/61/79/1133066179.db2.gz HCKJYVKLBDDKOT-QJJARZAOSA-N 1 0 331.460 3.708 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CN1CCC[C@H](C)C1 ZINC001177474811 1133066321 /nfs/dbraw/zinc/06/63/21/1133066321.db2.gz HCKJYVKLBDDKOT-MFPZVIQNSA-N 1 0 331.460 3.708 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H]2C[NH+]2CCCCC2)ccc1Cl ZINC000768542771 1133153971 /nfs/dbraw/zinc/15/39/71/1133153971.db2.gz ZJRMTMYWNGWYLO-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C[C@H]1CCCC1(F)F ZINC001178745999 1133194630 /nfs/dbraw/zinc/19/46/30/1133194630.db2.gz BIVHCWDNRSPHDP-SECBINFHSA-N 1 0 349.175 3.882 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314804 1133243982 /nfs/dbraw/zinc/24/39/82/1133243982.db2.gz FCUVWNXOXZATPU-KRWDZBQOSA-N 1 0 331.460 3.825 20 5 EHBDRO C[C@H]1COC[C@@H]1[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644933 1133265939 /nfs/dbraw/zinc/26/59/39/1133265939.db2.gz AQHBBWLNBTUIFF-HZMBPMFUSA-N 1 0 336.775 3.633 20 5 EHBDRO CC[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@H](O)c1ccc(C)cc1 ZINC000769483388 1133289422 /nfs/dbraw/zinc/28/94/22/1133289422.db2.gz MNSYVIMCBYMZKI-LZVBJTEYSA-N 1 0 340.423 3.972 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+](C)[C@H](CCO)c1ccccc1 ZINC001179950538 1133304471 /nfs/dbraw/zinc/30/44/71/1133304471.db2.gz DXJNCYMNZRBBBL-LJQANCHMSA-N 1 0 328.412 3.767 20 5 EHBDRO C[N@H+](Cc1c2ccccc2c(Cl)c2ccccc21)[C@H]1CCNC1=O ZINC000770378157 1133415900 /nfs/dbraw/zinc/41/59/00/1133415900.db2.gz DPPZPTDFHGZLGY-SFHVURJKSA-N 1 0 338.838 3.967 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000774160815 1133625614 /nfs/dbraw/zinc/62/56/14/1133625614.db2.gz BNLWCBXRGGXWII-GOSISDBHSA-N 1 0 341.367 3.713 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000774480624 1133687391 /nfs/dbraw/zinc/68/73/91/1133687391.db2.gz WXGIIFHFKJWFPD-IAGOWNOFSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H](O)C1CCCC1 ZINC001183427910 1133805061 /nfs/dbraw/zinc/80/50/61/1133805061.db2.gz DGIKHXRVMAPZEJ-QRFRQXIXSA-N 1 0 346.471 3.837 20 5 EHBDRO Cc1ccc([C@@H]2C[C@@H](C)[N@@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126341 1133810382 /nfs/dbraw/zinc/81/03/82/1133810382.db2.gz PLEBESVGBBUXCQ-XFQXTVEOSA-N 1 0 340.423 3.815 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1c(F)cccc1F ZINC000786815390 1133910721 /nfs/dbraw/zinc/91/07/21/1133910721.db2.gz SGBLQLASBDRRBI-SAYIFAPPSA-N 1 0 348.349 3.600 20 5 EHBDRO O=c1[nH]c2ccccc2cc1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001184397286 1133934512 /nfs/dbraw/zinc/93/45/12/1133934512.db2.gz CGBSSJYMTVPTLP-UHFFFAOYSA-N 1 0 343.770 3.792 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc(Cl)s1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788646797 1134151085 /nfs/dbraw/zinc/15/10/85/1134151085.db2.gz CYWWHFOSDGTXAZ-VIFPVBQESA-N 1 0 325.821 3.785 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631774 1134153715 /nfs/dbraw/zinc/15/37/15/1134153715.db2.gz MWZZSBBOSVDGHN-BZNIZROVSA-N 1 0 327.384 3.524 20 5 EHBDRO Cc1cc(N2C[C@H]3CC[N@H+](Cc4ccccc4)[C@H]3C2)c([N+](=O)[O-])s1 ZINC001186773546 1134256589 /nfs/dbraw/zinc/25/65/89/1134256589.db2.gz VXAICZMHCCTJSH-WBVHZDCISA-N 1 0 343.452 3.675 20 5 EHBDRO O=C1C[C@]2(CC[N@H+](Cc3c4ccccc4cc4ccccc43)C2)CN1 ZINC000789770451 1134328883 /nfs/dbraw/zinc/32/88/83/1134328883.db2.gz XTFYLNVWOJBEJT-JOCHJYFZSA-N 1 0 330.431 3.705 20 5 EHBDRO CN(CCCC[NH+]1CCCCC1)c1ccc([N+](=O)[O-])c2cccnc21 ZINC001187430638 1134339477 /nfs/dbraw/zinc/33/94/77/1134339477.db2.gz MPMPNUPTILQPKQ-UHFFFAOYSA-N 1 0 342.443 3.845 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000790693331 1134453647 /nfs/dbraw/zinc/45/36/47/1134453647.db2.gz AXXHKPVEIHZADP-HNNXBMFYSA-N 1 0 328.368 3.525 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170306257 1134736298 /nfs/dbraw/zinc/73/62/98/1134736298.db2.gz TZURYEOLWKHPBX-AWEZNQCLSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1cccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])c1 ZINC001170297794 1134737273 /nfs/dbraw/zinc/73/72/73/1134737273.db2.gz SGXVNXAAYPWVPN-KBPBESRZSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(F)c(C)c2)c([N+](=O)[O-])c1 ZINC001170295771 1134737617 /nfs/dbraw/zinc/73/76/17/1134737617.db2.gz DYZKXRFYEDJJIJ-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170299237 1134737992 /nfs/dbraw/zinc/73/79/92/1134737992.db2.gz SZWJAMOZHIKTQS-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc(C[C@@H](C)n2ccc3cc(C[NH3+])ccc32)c([N+](=O)[O-])c1 ZINC001170298409 1134738011 /nfs/dbraw/zinc/73/80/11/1134738011.db2.gz LCHUHODKDUDERF-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c([N+](=O)[O-])c1 ZINC001170298260 1134738436 /nfs/dbraw/zinc/73/84/36/1134738436.db2.gz HXEQGLRUAHGHEF-CQSZACIVSA-N 1 0 340.423 3.813 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170304460 1134738955 /nfs/dbraw/zinc/73/89/55/1134738955.db2.gz CAXIIDCAKMWZAG-AAEUAGOBSA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(c3ccccc3F)CC2)c([N+](=O)[O-])c1 ZINC001170313507 1134746032 /nfs/dbraw/zinc/74/60/32/1134746032.db2.gz NOPPKRMZLZERTA-CYBMUJFWSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3c2cccc3O)c([N+](=O)[O-])c1 ZINC001170328254 1134749107 /nfs/dbraw/zinc/74/91/07/1134749107.db2.gz IPLPAMYHZXNYEC-SJKOYZFVSA-N 1 0 342.395 3.517 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2ccncc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170329055 1134749141 /nfs/dbraw/zinc/74/91/41/1134749141.db2.gz NQZXFMUVQIUUKS-IFXJQAMLSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@@H]2c2cccnc2)c([N+](=O)[O-])c1 ZINC001170329063 1134749146 /nfs/dbraw/zinc/74/91/46/1134749146.db2.gz NVNNDWBXFAZDSU-RDTXWAMCSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+]2C[C@@H]3CC(F)(F)C[C@@H]3C2)c([N+](=O)[O-])c1 ZINC001170335114 1134751171 /nfs/dbraw/zinc/75/11/71/1134751171.db2.gz KVWXKVKYILGQGQ-BNOWGMLFSA-N 1 0 340.370 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170307460 1134753339 /nfs/dbraw/zinc/75/33/39/1134753339.db2.gz GDMDZPIDSDDJLY-KKXDTOCCSA-N 1 0 326.396 3.680 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC001170343563 1134758610 /nfs/dbraw/zinc/75/86/10/1134758610.db2.gz QPPZNACNPCTFHY-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C(C)(C)C)CC1 ZINC001191021192 1134780276 /nfs/dbraw/zinc/78/02/76/1134780276.db2.gz DAZBLCHIECJCOV-HNNXBMFYSA-N 1 0 347.459 3.990 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000792878185 1134810615 /nfs/dbraw/zinc/81/06/15/1134810615.db2.gz YMZXYCGOYZFCTL-CHWSQXEVSA-N 1 0 329.356 3.785 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000793239066 1134885791 /nfs/dbraw/zinc/88/57/91/1134885791.db2.gz QJWPSNUTAPMPAD-ZWKOTPCHSA-N 1 0 332.375 3.726 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC001192781124 1135054601 /nfs/dbraw/zinc/05/46/01/1135054601.db2.gz RQZQBGOOOFDHST-KRWDZBQOSA-N 1 0 348.834 3.884 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@H](C)C(C)(C)C ZINC001197601740 1135713694 /nfs/dbraw/zinc/71/36/94/1135713694.db2.gz KHLSFVDDEDBNST-AWEZNQCLSA-N 1 0 335.448 3.846 20 5 EHBDRO CC[C@@H](c1cccc(OC)c1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761674 1135729476 /nfs/dbraw/zinc/72/94/76/1135729476.db2.gz QHDLGQJFXNWVHT-RBUKOAKNSA-N 1 0 344.411 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2C[C@@H]3C[C@]3(c3ccccc3)C2)cc1 ZINC001197720230 1135730028 /nfs/dbraw/zinc/73/00/28/1135730028.db2.gz QUZLEYIOOQHJTB-FXAWDEMLSA-N 1 0 338.407 3.637 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@]2(CO)C[C@H]2c2ccccc2)c1 ZINC000810165506 1135929409 /nfs/dbraw/zinc/92/94/09/1135929409.db2.gz URSKPJDDCSLDJD-WMZOPIPTSA-N 1 0 346.814 3.504 20 5 EHBDRO C[NH+](C)Cc1cccc(-n2c3ccccc3cc3c(=O)c(N)ccc2-3)c1 ZINC001201403759 1136012880 /nfs/dbraw/zinc/01/28/80/1136012880.db2.gz UGAOBPCEZRQOAA-UHFFFAOYSA-N 1 0 343.430 3.739 20 5 EHBDRO CC[NH+](CC)C[C@H](C)NCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811478959 1136096828 /nfs/dbraw/zinc/09/68/28/1136096828.db2.gz TXOPDHVBMPQEQU-JTQLQIEISA-N 1 0 334.247 3.722 20 5 EHBDRO CCCC[N@H+](C)CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811480080 1136096900 /nfs/dbraw/zinc/09/69/00/1136096900.db2.gz OSHXNNAMAIJEDX-UHFFFAOYSA-N 1 0 334.247 3.723 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000776253677 1136102188 /nfs/dbraw/zinc/10/21/88/1136102188.db2.gz NTUIXWSWFNSLCP-FUHWJXTLSA-N 1 0 345.830 3.783 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CCC[C@H]1COc1ccccc1 ZINC001170650174 1136158235 /nfs/dbraw/zinc/15/82/35/1136158235.db2.gz GBTYQVHLELJIMK-INIZCTEOSA-N 1 0 330.359 3.777 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000850312277 1136233878 /nfs/dbraw/zinc/23/38/78/1136233878.db2.gz GTRFHDNWSGEFDH-LIRRHRJNSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000850424805 1136256587 /nfs/dbraw/zinc/25/65/87/1136256587.db2.gz HMQWRFRQCMUZLW-CXAGYDPISA-N 1 0 346.431 3.565 20 5 EHBDRO CC[NH+](CC)CC(C)(C)COC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000813151494 1136295681 /nfs/dbraw/zinc/29/56/81/1136295681.db2.gz MIRYOXPXMZPOSS-AWEZNQCLSA-N 1 0 336.432 3.610 20 5 EHBDRO CC(C)C[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579185 1136444016 /nfs/dbraw/zinc/44/40/16/1136444016.db2.gz LKWMDGMXOMIGBJ-LJQANCHMSA-N 1 0 328.412 3.786 20 5 EHBDRO Cc1ccccc1C[C@@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585579 1136448348 /nfs/dbraw/zinc/44/83/48/1136448348.db2.gz XDJNZWMDQFOBOV-VQTJNVASSA-N 1 0 340.423 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776591250 1136451086 /nfs/dbraw/zinc/45/10/86/1136451086.db2.gz IETFKUXXOIPIBY-OALUTQOASA-N 1 0 344.386 3.995 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776591982 1136452875 /nfs/dbraw/zinc/45/28/75/1136452875.db2.gz NPISFMFRSPXBHL-MDASCCDHSA-N 1 0 326.396 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3cccc(F)c3)CC2)cc1 ZINC000776593612 1136454222 /nfs/dbraw/zinc/45/42/22/1136454222.db2.gz YRWYPEIJGNOSGK-IBGZPJMESA-N 1 0 344.386 3.647 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597658 1136459329 /nfs/dbraw/zinc/45/93/29/1136459329.db2.gz JRQSRFKYPXMKRF-NQCMUKECSA-N 1 0 344.386 3.775 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)ccc1[N+](=O)[O-] ZINC000852782791 1136486554 /nfs/dbraw/zinc/48/65/54/1136486554.db2.gz WEVKHNLPUGAFTH-ZDUSSCGKSA-N 1 0 342.395 3.779 20 5 EHBDRO CCc1ccc([C@@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640860 1136487738 /nfs/dbraw/zinc/48/77/38/1136487738.db2.gz VCSRRZJLDAJTLW-UYAOXDASSA-N 1 0 340.423 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)C2)cc1 ZINC000814641823 1136488584 /nfs/dbraw/zinc/48/85/84/1136488584.db2.gz LLGDTLVAUICKSI-HKUYNNGSSA-N 1 0 326.396 3.508 20 5 EHBDRO Cc1ccc(SCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815554651 1136610196 /nfs/dbraw/zinc/61/01/96/1136610196.db2.gz FFFLUURWTUWJFZ-ZDUSSCGKSA-N 1 0 331.441 3.928 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc(C(C)(C)C)cs1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815576992 1136613185 /nfs/dbraw/zinc/61/31/85/1136613185.db2.gz DIFFHBWKHVKTHF-LLVKDONJSA-N 1 0 348.472 3.824 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815593607 1136616459 /nfs/dbraw/zinc/61/64/59/1136616459.db2.gz RQIJRUUJDWAXCO-CYBMUJFWSA-N 1 0 341.411 3.959 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000815572690 1136617960 /nfs/dbraw/zinc/61/79/60/1136617960.db2.gz KPVLUXKNJZNMQF-CYBMUJFWSA-N 1 0 341.411 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN[C@@H]2CCC[C@@H]2[C@@H]2CCCC[NH2+]2)c1 ZINC000817906661 1136845302 /nfs/dbraw/zinc/84/53/02/1136845302.db2.gz AQHNUWHMHALHJT-HYVNUMGLSA-N 1 0 337.851 3.649 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)c1 ZINC000819338987 1136932836 /nfs/dbraw/zinc/93/28/36/1136932836.db2.gz FMUKDXVDKJTRGJ-YSIASYRMSA-N 1 0 340.423 3.802 20 5 EHBDRO C[C@H](C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093523 1137044066 /nfs/dbraw/zinc/04/40/66/1137044066.db2.gz CSSSCTKJTPVJBS-OLZOCXBDSA-N 1 0 337.420 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1Cl ZINC000824696978 1137147074 /nfs/dbraw/zinc/14/70/74/1137147074.db2.gz WUUHAZPOHMBJTC-LXZKKBNFSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCO[C@@H](c3ccncc3)C2)c1 ZINC000824949073 1137159063 /nfs/dbraw/zinc/15/90/63/1137159063.db2.gz XGIRVTLZIPFVQN-WMLDXEAASA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(OCc2ccc3c(c2)C[NH2+]CC3)cc1F ZINC000844301277 1137210277 /nfs/dbraw/zinc/21/02/77/1137210277.db2.gz RRKLRKQAZWXECG-UHFFFAOYSA-N 1 0 336.750 3.612 20 5 EHBDRO CCOc1ccc([C@H](C)NCc2cc([O-])ccc2[N+](=O)[O-])cc1OC ZINC000339065993 1137217368 /nfs/dbraw/zinc/21/73/68/1137217368.db2.gz DIIPLWWPMGGKCH-LBPRGKRZSA-N 1 0 346.383 3.559 20 5 EHBDRO COc1cccc(-n2cc(C[C@@H](C)[NH3+])c3ccc(C)cc32)c1[N+](=O)[O-] ZINC001171169681 1137280157 /nfs/dbraw/zinc/28/01/57/1137280157.db2.gz QYBGLOPSIHKNTP-CYBMUJFWSA-N 1 0 339.395 3.745 20 5 EHBDRO CC(C)Oc1cccc(C[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000120567906 1137286511 /nfs/dbraw/zinc/28/65/11/1137286511.db2.gz XSBASRNQSNHPMO-LJQANCHMSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)ccc1SC ZINC000865786516 1137311583 /nfs/dbraw/zinc/31/15/83/1137311583.db2.gz PERGCVZUACKAKZ-UHFFFAOYSA-N 1 0 332.425 3.924 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](CCCO)c1ccccc1 ZINC000866271742 1137341570 /nfs/dbraw/zinc/34/15/70/1137341570.db2.gz PHLAXYZRGZFYPI-KBXCAEBGSA-N 1 0 346.402 3.768 20 5 EHBDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866326048 1137345713 /nfs/dbraw/zinc/34/57/13/1137345713.db2.gz HUHNBDGDSVHVMI-RRQGHBQHSA-N 1 0 338.423 3.848 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cc(F)cnc1Cl ZINC000866365943 1137349789 /nfs/dbraw/zinc/34/97/89/1137349789.db2.gz JCZMZAAMFFUSDN-VIFPVBQESA-N 1 0 341.745 3.642 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866367174 1137350003 /nfs/dbraw/zinc/35/00/03/1137350003.db2.gz GPGCVQDBJMRZNY-CQSZACIVSA-N 1 0 331.391 3.591 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC(OC(F)F)CC1 ZINC000866370211 1137350120 /nfs/dbraw/zinc/35/01/20/1137350120.db2.gz TZUMVYCWJIKALL-FNBIGBAISA-N 1 0 346.349 3.805 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H]1CC2(CO1)CCOCC2)c1cccc([N+](=O)[O-])c1 ZINC000866532240 1137362141 /nfs/dbraw/zinc/36/21/41/1137362141.db2.gz VNLDBMDUIJSDIJ-QZTJIDSGSA-N 1 0 348.443 3.611 20 5 EHBDRO C[C@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC001171308942 1137408573 /nfs/dbraw/zinc/40/85/73/1137408573.db2.gz VDKSTEAYKZWVOI-ZFWWWQNUSA-N 1 0 334.416 3.537 20 5 EHBDRO Clc1nc2ccc3ccccc3c2nc1NC[C@H]1CCCC[NH2+]1 ZINC001171328957 1137421528 /nfs/dbraw/zinc/42/15/28/1137421528.db2.gz DSBWOVUBUIEOQK-CYBMUJFWSA-N 1 0 326.831 3.990 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC12CCOCC2 ZINC000282758864 1137445916 /nfs/dbraw/zinc/44/59/16/1137445916.db2.gz OEAROGONXBJEIM-CRAIPNDOSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@@H]([NH2+][C@@H](Cn1ccnc1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023185 1137565342 /nfs/dbraw/zinc/56/53/42/1137565342.db2.gz CZOGVNCIGOVAAH-DOMZBBRYSA-N 1 0 334.395 3.696 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000872132551 1137573251 /nfs/dbraw/zinc/57/32/51/1137573251.db2.gz IPLUKQGJPCMHKG-QITLCBANSA-N 1 0 332.375 3.897 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nccnc1C ZINC000872133455 1137573446 /nfs/dbraw/zinc/57/34/46/1137573446.db2.gz MUJNYDNKMCBGII-KGLIPLIRSA-N 1 0 346.456 3.915 20 5 EHBDRO Cc1c(C[NH2+]Cc2cccc(OCC(F)F)c2)cccc1[N+](=O)[O-] ZINC000873046125 1137588860 /nfs/dbraw/zinc/58/88/60/1137588860.db2.gz OKKABLFFFRUKPE-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](CCCO)c1ccccc1 ZINC000873059119 1137589091 /nfs/dbraw/zinc/58/90/91/1137589091.db2.gz NORCEBLIXYUQJH-SFHVURJKSA-N 1 0 328.412 3.815 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000873112160 1137590372 /nfs/dbraw/zinc/59/03/72/1137590372.db2.gz PCXZVOGSSVMLDO-MRXNPFEDSA-N 1 0 330.359 3.964 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(Cl)cc3Cl)C2)c1 ZINC000876887265 1137664595 /nfs/dbraw/zinc/66/45/95/1137664595.db2.gz QESGOWVCWYVMIL-UHFFFAOYSA-N 1 0 341.198 3.591 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CC[C@@H](c4ccc(F)cc4)C3)C2)c1 ZINC000877488234 1137678127 /nfs/dbraw/zinc/67/81/27/1137678127.db2.gz CTLYJBYPWZDEIF-PMRDFSHISA-N 1 0 344.390 3.560 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H](C3CCC3)C3CCCCC3)C2)c1 ZINC000877606614 1137682642 /nfs/dbraw/zinc/68/26/42/1137682642.db2.gz GRHXXHLUFHJJHZ-HTWSVDAQSA-N 1 0 332.448 3.833 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CC=CC[C@H]3C(F)(F)F)nc2c1 ZINC000877760317 1137688437 /nfs/dbraw/zinc/68/84/37/1137688437.db2.gz FDHRNVWODBDCPF-GHMZBOCLSA-N 1 0 341.289 3.723 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878135257 1137703990 /nfs/dbraw/zinc/70/39/90/1137703990.db2.gz VXWHCXYCNFINFV-VNHYZAJKSA-N 1 0 342.399 3.798 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878427999 1137715502 /nfs/dbraw/zinc/71/55/02/1137715502.db2.gz PLTZDNDLXKBKFI-CYBMUJFWSA-N 1 0 330.388 3.799 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878447311 1137716343 /nfs/dbraw/zinc/71/63/43/1137716343.db2.gz LKKDUMIJSFZSMP-MBNYWOFBSA-N 1 0 330.388 3.559 20 5 EHBDRO CC(C)(C)C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878693648 1137725386 /nfs/dbraw/zinc/72/53/86/1137725386.db2.gz XKTYZLHFFWPAHT-CYBMUJFWSA-N 1 0 344.415 3.903 20 5 EHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699154 1137725524 /nfs/dbraw/zinc/72/55/24/1137725524.db2.gz NYOQHZFUAZQRBJ-YVEFUNNKSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879528880 1137750024 /nfs/dbraw/zinc/75/00/24/1137750024.db2.gz DZNLDTQDOFLOIG-YUELXQCFSA-N 1 0 340.383 3.604 20 5 EHBDRO C[C@H]1C[C@@H](C(=O)N(c2cccc([N+](=O)[O-])c2)C2CCCC2)CC[N@@H+]1C ZINC000888867798 1137800275 /nfs/dbraw/zinc/80/02/75/1137800275.db2.gz YUMXDJOMNQJSGE-GJZGRUSLSA-N 1 0 345.443 3.601 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000332128110 1137932591 /nfs/dbraw/zinc/93/25/91/1137932591.db2.gz MYNZGYISBVNNQF-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO CCOc1cccc(N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)c1[N+](=O)[O-] ZINC000884706492 1137969484 /nfs/dbraw/zinc/96/94/84/1137969484.db2.gz DXWOKYAGVRBMAZ-UHFFFAOYSA-N 1 0 344.415 3.717 20 5 EHBDRO COc1cc(N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)c([N+](=O)[O-])cc1C ZINC000884706989 1137969795 /nfs/dbraw/zinc/96/97/95/1137969795.db2.gz UYUQSWXFRCVACK-UHFFFAOYSA-N 1 0 344.415 3.636 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136957082 1138044705 /nfs/dbraw/zinc/04/47/05/1138044705.db2.gz VZOCPIFLSMIVGF-LJQANCHMSA-N 1 0 328.412 3.583 20 5 EHBDRO Cc1ccc(C[N@@H+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)s1 ZINC000136999156 1138045081 /nfs/dbraw/zinc/04/50/81/1138045081.db2.gz DAVAQHMVOUJIIL-QGZVFWFLSA-N 1 0 334.441 3.909 20 5 EHBDRO C[C@@]1(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])CCOC2(CCC2)C1 ZINC000886344754 1138069571 /nfs/dbraw/zinc/06/95/71/1138069571.db2.gz KXQANSUCGAFSQQ-NCRRVARUSA-N 1 0 330.428 3.937 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000127298772 1138352843 /nfs/dbraw/zinc/35/28/43/1138352843.db2.gz WJOPNVDKCULQMF-WBVHZDCISA-N 1 0 332.444 3.997 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@H](C(F)(F)F)C1 ZINC000129721319 1138419409 /nfs/dbraw/zinc/41/94/09/1138419409.db2.gz KVVBBJBNAKBJKK-RYUDHWBXSA-N 1 0 332.322 3.814 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000337348438 1138540485 /nfs/dbraw/zinc/54/04/85/1138540485.db2.gz ZAVGYHWMVLGANT-DOTOQJQBSA-N 1 0 341.411 3.814 20 5 EHBDRO Cc1cc(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])ccc1F ZINC000337353593 1138542090 /nfs/dbraw/zinc/54/20/90/1138542090.db2.gz AEEXMXRVJQNLSL-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3CC[C@@H]2O3)s1 ZINC000152903162 1139113454 /nfs/dbraw/zinc/11/34/54/1139113454.db2.gz UNVPGRZCYLXQPX-XFJVYGCCSA-N 1 0 330.409 3.733 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(COC)c2)cc1[N+](=O)[O-] ZINC000152951539 1139115361 /nfs/dbraw/zinc/11/53/61/1139115361.db2.gz ZWIYVMIRVMRSSO-CQSZACIVSA-N 1 0 344.411 3.991 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178689260 1139711607 /nfs/dbraw/zinc/71/16/07/1139711607.db2.gz JMNYCNNIRYWATC-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H]1C[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H]2CCCC[C@H]12 ZINC000182489644 1139975902 /nfs/dbraw/zinc/97/59/02/1139975902.db2.gz NZSRKSJTHQZOJM-MAZHCROVSA-N 1 0 342.399 3.655 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCS[C@H](C)CC1 ZINC000192175632 1140508157 /nfs/dbraw/zinc/50/81/57/1140508157.db2.gz ZPILTHLLYYXTRN-NEPJUHHUSA-N 1 0 348.428 3.533 20 5 EHBDRO CC1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)OCCCO1 ZINC000192248861 1140514381 /nfs/dbraw/zinc/51/43/81/1140514381.db2.gz WKMQJDVDNRHAOE-UHFFFAOYSA-N 1 0 348.424 3.566 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192945509 1140556642 /nfs/dbraw/zinc/55/66/42/1140556642.db2.gz GCAYHNFEAKBSGW-QGZVFWFLSA-N 1 0 329.400 3.875 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193043646 1140561768 /nfs/dbraw/zinc/56/17/68/1140561768.db2.gz SQWFJQZZYMJHRC-GTNSWQLSSA-N 1 0 329.400 3.970 20 5 EHBDRO Nc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)c1 ZINC000193399560 1140575107 /nfs/dbraw/zinc/57/51/07/1140575107.db2.gz YRWBDWZASPMTBK-CYBMUJFWSA-N 1 0 346.456 3.563 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H]2c2cccc(F)c2)c1 ZINC000269684243 1141135470 /nfs/dbraw/zinc/13/54/70/1141135470.db2.gz SHZCKIMIUIZJOO-ZWKOTPCHSA-N 1 0 330.359 3.604 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000271262812 1141336400 /nfs/dbraw/zinc/33/64/00/1141336400.db2.gz AVOJDITZKHEIDE-ZIAGYGMSSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCc2nccs2)cc1[N+](=O)[O-] ZINC000271483665 1141378901 /nfs/dbraw/zinc/37/89/01/1141378901.db2.gz KQMYZZKMZLUQQM-LBPRGKRZSA-N 1 0 335.429 3.733 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518382 1141385429 /nfs/dbraw/zinc/38/54/29/1141385429.db2.gz PWECTCXBUYORTC-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271525781 1141387916 /nfs/dbraw/zinc/38/79/16/1141387916.db2.gz QELNQHPSGUEEQR-XKQJLSEDSA-N 1 0 340.427 3.696 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000271570751 1141399576 /nfs/dbraw/zinc/39/95/76/1141399576.db2.gz PPVIKYURCIGDQZ-LMMKCTJWSA-N 1 0 332.444 3.709 20 5 EHBDRO Nc1c(F)c(N[C@@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000348727366 1141571482 /nfs/dbraw/zinc/57/14/82/1141571482.db2.gz DRDNBQSUJWSTDQ-HNNXBMFYSA-N 1 0 344.390 3.565 20 5 EHBDRO Cc1ccc2[nH]c(CN(CC[NH3+])c3ccccc3[N+](=O)[O-])cc2c1C ZINC000348891005 1141604841 /nfs/dbraw/zinc/60/48/41/1141604841.db2.gz GGWLLBHYFUJMDV-UHFFFAOYSA-N 1 0 338.411 3.658 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cccc(C)c2[N+](=O)[O-])c1 ZINC000036763402 520758675 /nfs/dbraw/zinc/75/86/75/520758675.db2.gz GRXUJLNRNROHRJ-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2conc2Cc2ccccc2)cc1 ZINC000584304966 1032103469 /nfs/dbraw/zinc/10/34/69/1032103469.db2.gz SOSDFYFZASMUPV-UHFFFAOYSA-N 1 0 337.379 3.506 20 5 EHBDRO CC[C@@](C)(CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000134472174 1015549715 /nfs/dbraw/zinc/54/97/15/1015549715.db2.gz JSTMFGQEXRDGTH-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO CC[C@H](C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680283 1032122420 /nfs/dbraw/zinc/12/24/20/1032122420.db2.gz LMBDJUNXJWBDFN-NVXWUHKLSA-N 1 0 340.427 3.670 20 5 EHBDRO Cc1ccc(C[N@H+](CCO)[C@@H]2CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000536683109 1032146090 /nfs/dbraw/zinc/14/60/90/1032146090.db2.gz JZBNCHCRKCRQKA-LJQANCHMSA-N 1 0 340.423 3.775 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@@H]2CCCO2)CC1 ZINC000189208140 1016482255 /nfs/dbraw/zinc/48/22/55/1016482255.db2.gz LNEQPRWIWIEPIG-SFHVURJKSA-N 1 0 348.443 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2cccc3c2OCCO3)cc1 ZINC000340184284 1016635982 /nfs/dbraw/zinc/63/59/82/1016635982.db2.gz SRTFLQKGOJYZSD-KRWDZBQOSA-N 1 0 340.379 3.703 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(C2CC2)c1 ZINC000340250454 1016787348 /nfs/dbraw/zinc/78/73/48/1016787348.db2.gz GOUJQAUHFKBCRH-CYBMUJFWSA-N 1 0 339.395 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCC13CCOCC3)CCC2 ZINC000376986700 1017237369 /nfs/dbraw/zinc/23/73/69/1017237369.db2.gz TXKGEWDEJGRENK-QZTJIDSGSA-N 1 0 330.428 3.911 20 5 EHBDRO COc1cccc(CCC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449136113 1032229651 /nfs/dbraw/zinc/22/96/51/1032229651.db2.gz UILLVRBFWQWPNO-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](C[C@@H]2CCOC2)c2ccccc2)cc1F ZINC000278746251 1032291114 /nfs/dbraw/zinc/29/11/14/1032291114.db2.gz WTGCZHRXNOOWDM-YJBOKZPZSA-N 1 0 344.386 3.991 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000536829248 1032308657 /nfs/dbraw/zinc/30/86/57/1032308657.db2.gz XFFYDYISCIDNHO-ITQYTPKQSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@H]1CCCC[C@]1(C)[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000459609979 1032325832 /nfs/dbraw/zinc/32/58/32/1032325832.db2.gz KAEMWYLJRDKTIT-SJCJKPOMSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000459633757 1032350423 /nfs/dbraw/zinc/35/04/23/1032350423.db2.gz FBGRFDCVXCGNRY-CYBMUJFWSA-N 1 0 340.383 3.632 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347810 1032464899 /nfs/dbraw/zinc/46/48/99/1032464899.db2.gz JEMLJERUFPXPMY-OLZOCXBDSA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000449335513 1032469528 /nfs/dbraw/zinc/46/95/28/1032469528.db2.gz JEXVFVTXSZMQQL-ZBFHGGJFSA-N 1 0 343.402 3.533 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000449335510 1032471863 /nfs/dbraw/zinc/47/18/63/1032471863.db2.gz JEXVFVTXSZMQQL-GDBMZVCRSA-N 1 0 343.402 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CF)CCOCC3)o2)cc1 ZINC000449487375 1032645544 /nfs/dbraw/zinc/64/55/44/1032645544.db2.gz YMELQHJWLHSEML-UHFFFAOYSA-N 1 0 348.374 3.711 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000181533312 1017119819 /nfs/dbraw/zinc/11/98/19/1017119819.db2.gz BOHNFPCEUCZYCK-HUUCEWRRSA-N 1 0 341.411 3.624 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]([C@@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000449505101 1032690027 /nfs/dbraw/zinc/69/00/27/1032690027.db2.gz JSIUNAXSRPMTGO-PKOBYXMFSA-N 1 0 332.444 3.605 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cc1O ZINC000449506991 1032691254 /nfs/dbraw/zinc/69/12/54/1032691254.db2.gz ZZYMDYKZVKYOMK-INIZCTEOSA-N 1 0 342.395 3.689 20 5 EHBDRO CCN(Cc1cccc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000544894707 1017335006 /nfs/dbraw/zinc/33/50/06/1017335006.db2.gz VZDCTGVJRXFRBE-HXUWFJFHSA-N 1 0 339.439 3.691 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2)c2cc(N)ccc2O1 ZINC000415020481 1017404597 /nfs/dbraw/zinc/40/45/97/1017404597.db2.gz GLOKTVWKJPEAJV-INIZCTEOSA-N 1 0 327.384 3.569 20 5 EHBDRO CCc1ccccc1[C@@H]([NH3+])CNCc1ccc([N+](=O)[O-])cc1Cl ZINC000415061804 1017491493 /nfs/dbraw/zinc/49/14/93/1017491493.db2.gz DOEWSTDRDXOSOI-KRWDZBQOSA-N 1 0 333.819 3.600 20 5 EHBDRO CCC[NH+]1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000109787834 1017713158 /nfs/dbraw/zinc/71/31/58/1017713158.db2.gz UHDLIVDCBVDSMH-UHFFFAOYSA-N 1 0 349.475 3.688 20 5 EHBDRO [NH3+]Cc1cnc2c(ccn2-c2cc3cccnc3c3ncccc23)c1 ZINC001167312946 1017892843 /nfs/dbraw/zinc/89/28/43/1017892843.db2.gz BPTCCCAZYSDFSZ-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CC[C@H](c3cccnc3)C2)c1 ZINC000574204683 1032736860 /nfs/dbraw/zinc/73/68/60/1032736860.db2.gz GCLNTBKBAHQHSJ-ZDUSSCGKSA-N 1 0 349.337 3.581 20 5 EHBDRO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001167341528 1018315230 /nfs/dbraw/zinc/31/52/30/1018315230.db2.gz KHIJRYIDPYTKLL-OAHLLOKOSA-N 1 0 345.443 3.968 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000610345615 1018360013 /nfs/dbraw/zinc/36/00/13/1018360013.db2.gz ICCAWGSJZNPUML-DZGCQCFKSA-N 1 0 332.400 3.742 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371727 1018549134 /nfs/dbraw/zinc/54/91/34/1018549134.db2.gz KNYDTKVMPGRTCO-RDJZCZTQSA-N 1 0 338.473 3.970 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000548066708 1018721152 /nfs/dbraw/zinc/72/11/52/1018721152.db2.gz FRRBELXVNQIJCF-IBGZPJMESA-N 1 0 326.396 3.887 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1C2CCCC1CCC2 ZINC000610395028 1018744915 /nfs/dbraw/zinc/74/49/15/1018744915.db2.gz LQKIBTNWFSURQM-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CCC[C@H]3C3CCC3)c2)cc1 ZINC000728900958 1032786848 /nfs/dbraw/zinc/78/68/48/1032786848.db2.gz YREVQRCTAYXKDK-SFHVURJKSA-N 1 0 326.400 3.680 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182324798 1019061207 /nfs/dbraw/zinc/06/12/07/1019061207.db2.gz YORGVNMUQIDBNN-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)c1ccc(CN2CCC[C@@H]([C@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425503 1032812467 /nfs/dbraw/zinc/81/24/67/1032812467.db2.gz HBDGRRYFCBHDGL-SJLPKXTDSA-N 1 0 331.460 3.682 20 5 EHBDRO Cc1ncc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)n1-c1ccccc1 ZINC000327582827 1019215746 /nfs/dbraw/zinc/21/57/46/1019215746.db2.gz DTKBQFJLOFQCCD-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C[C@H]1CCC[C@@H](CO)C1 ZINC000579628283 1019329056 /nfs/dbraw/zinc/32/90/56/1019329056.db2.gz MLLFPJVMIRFMDO-DODZYUBVSA-N 1 0 346.471 3.694 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H](CO)c1ccsc1 ZINC000471601710 1019734165 /nfs/dbraw/zinc/73/41/65/1019734165.db2.gz KVNLBQGRRHFZNQ-RRQGHBQHSA-N 1 0 346.452 3.691 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H](CO)c1ccsc1 ZINC000471601709 1019735742 /nfs/dbraw/zinc/73/57/42/1019735742.db2.gz KVNLBQGRRHFZNQ-JQFCIGGWSA-N 1 0 346.452 3.691 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000182916190 1019782316 /nfs/dbraw/zinc/78/23/16/1019782316.db2.gz LHMOJWQCRRULKB-RZQQEMMASA-N 1 0 343.471 3.913 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1ccccc1[N+](=O)[O-] ZINC000610451913 1019864966 /nfs/dbraw/zinc/86/49/66/1019864966.db2.gz NWAJOBKVUCKRBY-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2sccc2Br)cc1 ZINC000043675245 1019962418 /nfs/dbraw/zinc/96/24/18/1019962418.db2.gz AKXZLFBQKILDLI-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1cccc(Cl)c1[N+](=O)[O-] ZINC000175972226 1020237982 /nfs/dbraw/zinc/23/79/82/1020237982.db2.gz ZVYRTYFECYPVTG-UHFFFAOYSA-N 1 0 342.742 3.891 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)C2)c1 ZINC000449614564 1032887672 /nfs/dbraw/zinc/88/76/72/1032887672.db2.gz HYHARTXSDXKIJN-QAQDUYKDSA-N 1 0 326.396 3.948 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000280651995 1020566985 /nfs/dbraw/zinc/56/69/85/1020566985.db2.gz ZGZXJYCHAWXCHH-SFHVURJKSA-N 1 0 345.399 3.641 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488556 1032919670 /nfs/dbraw/zinc/91/96/70/1032919670.db2.gz ZHKFHFQPDXPOKO-RYUDHWBXSA-N 1 0 336.823 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)c(F)c1 ZINC000449625261 1032923312 /nfs/dbraw/zinc/92/33/12/1032923312.db2.gz OHGQONVWGGOLNJ-IUODEOHRSA-N 1 0 336.388 3.805 20 5 EHBDRO C[NH2+]Cc1ccc(NC(=O)c2ccc(C(C)(C)C)c([N+](=O)[O-])c2)cc1 ZINC000449626709 1032924319 /nfs/dbraw/zinc/92/43/19/1032924319.db2.gz XIIVVIFEIKSLPN-UHFFFAOYSA-N 1 0 341.411 3.864 20 5 EHBDRO CO[C@H]([C@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000449629114 1032927942 /nfs/dbraw/zinc/92/79/42/1032927942.db2.gz KBUXFAKJJGHEIC-MEDUHNTESA-N 1 0 347.440 3.621 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](n3ncc4ccccc43)C2)cccc1[N+](=O)[O-] ZINC000510417368 1020818907 /nfs/dbraw/zinc/81/89/07/1020818907.db2.gz PSRKECAYOSWZQN-QGZVFWFLSA-N 1 0 336.395 3.700 20 5 EHBDRO Cc1ccc(NC(=O)c2cccc(C[NH+]3CCCC3)c2)cc1[N+](=O)[O-] ZINC000060551350 1020905379 /nfs/dbraw/zinc/90/53/79/1020905379.db2.gz QIWQXZUXYLBEFE-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO CC[NH+](CC)C[C@H](C)N[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581612118 1021150619 /nfs/dbraw/zinc/15/06/19/1021150619.db2.gz CPOFWSYTJAVJBV-SMDDNHRTSA-N 1 0 333.354 3.518 20 5 EHBDRO C[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)Cc1cccs1 ZINC000602561033 1032972380 /nfs/dbraw/zinc/97/23/80/1032972380.db2.gz PPYSTWHLKCFFGX-LLVKDONJSA-N 1 0 331.397 3.766 20 5 EHBDRO CC(C)[N@H+](C)CCCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000516383816 1021373463 /nfs/dbraw/zinc/37/34/63/1021373463.db2.gz SEFRYFLMRJXKCT-UHFFFAOYSA-N 1 0 335.451 3.848 20 5 EHBDRO Cc1c(C[N@H+](C)CCCOCc2ccccc2)cccc1[N+](=O)[O-] ZINC000439465123 1021458467 /nfs/dbraw/zinc/45/84/67/1021458467.db2.gz DZSUAWWCGNMPEN-UHFFFAOYSA-N 1 0 328.412 3.942 20 5 EHBDRO C[N@H+](CCCOCc1ccccc1)CCc1ccc([N+](=O)[O-])cc1 ZINC000439482805 1021489927 /nfs/dbraw/zinc/48/99/27/1021489927.db2.gz YJNTVPZSYCCMLJ-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453582 1021624097 /nfs/dbraw/zinc/62/40/97/1021624097.db2.gz HQKURWMNINJHKO-JQWIXIFHSA-N 1 0 342.342 3.579 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453583 1021624174 /nfs/dbraw/zinc/62/41/74/1021624174.db2.gz HQKURWMNINJHKO-PWSUYJOCSA-N 1 0 342.342 3.579 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)n1 ZINC000441173630 1022032458 /nfs/dbraw/zinc/03/24/58/1022032458.db2.gz CNLLEDBNAKUUBN-DOJUMQAQSA-N 1 0 340.427 3.749 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120777130 1022150886 /nfs/dbraw/zinc/15/08/86/1022150886.db2.gz WGQQNTBSFAUFHA-PXAZEXFGSA-N 1 0 349.381 3.827 20 5 EHBDRO CO[C@H](C)[C@@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517265024 1022196330 /nfs/dbraw/zinc/19/63/30/1022196330.db2.gz HTKMHPUDVUPJDZ-HUUCEWRRSA-N 1 0 343.427 3.876 20 5 EHBDRO O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894449753 1022287825 /nfs/dbraw/zinc/28/78/25/1022287825.db2.gz PIZOFESKNDMEST-CYBMUJFWSA-N 1 0 333.775 3.516 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](Oc2ccc(Cl)cc2)C1 ZINC000550391278 1022410497 /nfs/dbraw/zinc/41/04/97/1022410497.db2.gz CIJAALFGGKVAKW-MRXNPFEDSA-N 1 0 332.787 3.902 20 5 EHBDRO C[C@@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968575 1022521853 /nfs/dbraw/zinc/52/18/53/1022521853.db2.gz SNCIJFJQJCVWMF-OLZOCXBDSA-N 1 0 332.425 3.526 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC/C=C/c1ccccc1[N+](=O)[O-] ZINC000438347240 1022584844 /nfs/dbraw/zinc/58/48/44/1022584844.db2.gz FTTFIWJOJVWKBU-JXMROGBWSA-N 1 0 325.412 3.824 20 5 EHBDRO CC[C@H]1C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602697136 1033075665 /nfs/dbraw/zinc/07/56/65/1033075665.db2.gz IARDJUUJYNZTCL-OLZOCXBDSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719612 1022791395 /nfs/dbraw/zinc/79/13/95/1022791395.db2.gz PEHRBYNKUVQWSP-QGZVFWFLSA-N 1 0 340.427 3.896 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@H]2CO)s1 ZINC000449708915 1033081711 /nfs/dbraw/zinc/08/17/11/1033081711.db2.gz WYDBTQIZYUCPTO-WFASDCNBSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCC[C@H]1CCOC1 ZINC000602683277 1033082695 /nfs/dbraw/zinc/08/26/95/1033082695.db2.gz WDRYVTDVNZZDKL-NSHDSACASA-N 1 0 332.322 3.520 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000310150836 1022911881 /nfs/dbraw/zinc/91/18/81/1022911881.db2.gz FSYIJOOXLWQPLW-QAPCUYQASA-N 1 0 325.412 3.520 20 5 EHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000518065272 1022967702 /nfs/dbraw/zinc/96/77/02/1022967702.db2.gz AWPZETYCBSEWTL-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@H+](Cc1ccccc1)[C@H]1CCCC1(C)C ZINC000426809713 1023059410 /nfs/dbraw/zinc/05/94/10/1023059410.db2.gz FRBKJEPUGVGQFY-KRWDZBQOSA-N 1 0 342.443 3.909 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000510792467 1023168782 /nfs/dbraw/zinc/16/87/82/1023168782.db2.gz RQZZLBLFAKBXHR-GFCCVEGCSA-N 1 0 326.265 3.940 20 5 EHBDRO CCOc1cc(C[N@H+](C)[C@@H](CC)c2ccncc2)ccc1[N+](=O)[O-] ZINC000276919127 1023364720 /nfs/dbraw/zinc/36/47/20/1023364720.db2.gz OTSMUFOWEABRRF-INIZCTEOSA-N 1 0 329.400 3.972 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)Cc1ccc(Cl)c(Cl)c1 ZINC000610782632 1023508553 /nfs/dbraw/zinc/50/85/53/1023508553.db2.gz ZVPQCGUZXOVDIO-UHFFFAOYSA-N 1 0 343.214 3.539 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000477926283 1023582289 /nfs/dbraw/zinc/58/22/89/1023582289.db2.gz GXDIQUBSRSUABF-OAHLLOKOSA-N 1 0 349.475 3.766 20 5 EHBDRO C[C@@H]1C[C@H](C)CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000535799469 1023646581 /nfs/dbraw/zinc/64/65/81/1023646581.db2.gz QDNHRWUFFNRLCY-HUUCEWRRSA-N 1 0 342.443 3.863 20 5 EHBDRO CC(C)C[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000341900077 1023670002 /nfs/dbraw/zinc/67/00/02/1023670002.db2.gz XHQADEOJNJNRAU-HNNXBMFYSA-N 1 0 336.823 3.822 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000610809813 1023701019 /nfs/dbraw/zinc/70/10/19/1023701019.db2.gz LUZCWPXXQLFFGF-BBRMVZONSA-N 1 0 342.395 3.566 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+][C@@H]3CCC[C@@H]3Cc3ccccc3[N+](=O)[O-])C2)CO1 ZINC000897779288 1033172108 /nfs/dbraw/zinc/17/21/08/1033172108.db2.gz OXWFYWMPZCJWDB-AKCNFOTBSA-N 1 0 344.455 3.853 20 5 EHBDRO CC[C@@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000602804759 1033177770 /nfs/dbraw/zinc/17/77/70/1033177770.db2.gz JURGVHNOUWPYIG-SNVBAGLBSA-N 1 0 328.825 3.556 20 5 EHBDRO Cn1cc(C[NH2+][C@@H]2CC(C)(C)CCc3ccccc32)c([N+](=O)[O-])n1 ZINC000602823306 1033190218 /nfs/dbraw/zinc/19/02/18/1033190218.db2.gz CFKHCNPCSDBOMI-MRXNPFEDSA-N 1 0 328.416 3.522 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCC1 ZINC000434615030 1024198185 /nfs/dbraw/zinc/19/81/85/1024198185.db2.gz LKFQVJQIIPILTA-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@H](C1CCCCC1)[NH+](C)C ZINC000509622834 1024204612 /nfs/dbraw/zinc/20/46/12/1024204612.db2.gz WUAYAVGELRPGGX-SFHVURJKSA-N 1 0 349.475 3.594 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4O[C@H]3[C@H]3C[C@H]34)s2)cc1 ZINC000897823029 1033194866 /nfs/dbraw/zinc/19/48/66/1033194866.db2.gz QSBOJXGTPPQBKT-OCABDXPQSA-N 1 0 342.420 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](CC3(O)CCCCCC3)CC2)cc1 ZINC001167500133 1024236816 /nfs/dbraw/zinc/23/68/16/1024236816.db2.gz RXIHAUUPIORSNK-UHFFFAOYSA-N 1 0 348.443 3.523 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1ccc(F)c2ccccc21 ZINC000602834157 1033196987 /nfs/dbraw/zinc/19/69/87/1033196987.db2.gz RRMVHVISCUWHBM-LBPRGKRZSA-N 1 0 342.374 3.743 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC2(CCCC2)[C@H]1c1ccccc1 ZINC000602838730 1033199915 /nfs/dbraw/zinc/19/99/15/1033199915.db2.gz BPCPRJVHMYXZSY-GOSISDBHSA-N 1 0 340.427 3.717 20 5 EHBDRO CCC[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1COc2ccccc2O1 ZINC000071809504 1024441871 /nfs/dbraw/zinc/44/18/71/1024441871.db2.gz WBZKUHYBJCNKNS-KRWDZBQOSA-N 1 0 342.395 3.647 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC1=CCCCC1 ZINC000237296779 1024481873 /nfs/dbraw/zinc/48/18/73/1024481873.db2.gz QPVZULDCVSZYIV-AWEZNQCLSA-N 1 0 331.416 3.792 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC1CC[NH+]([C@H](C)c2ccncc2)CC1 ZINC000425236344 1024488385 /nfs/dbraw/zinc/48/83/85/1024488385.db2.gz JUSFOBATSWYLCF-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO Cc1cccc(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000425239294 1024497031 /nfs/dbraw/zinc/49/70/31/1024497031.db2.gz NSCOVPKNPXUDKD-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO C[N@H+](CCCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000435048715 1024577172 /nfs/dbraw/zinc/57/71/72/1024577172.db2.gz BSAZZNIREVZQNF-UHFFFAOYSA-N 1 0 334.441 3.918 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOc1ccc(Cl)cn1 ZINC000539061483 1024729587 /nfs/dbraw/zinc/72/95/87/1024729587.db2.gz MVFGYCWSXLNJCM-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCCOc1ccc(F)cc1 ZINC000507914772 1024761731 /nfs/dbraw/zinc/76/17/31/1024761731.db2.gz QBGVVVQVDLHNMA-UHFFFAOYSA-N 1 0 348.374 3.691 20 5 EHBDRO COc1cc(CN[C@H](C)c2ccccc2OC)c([N+](=O)[O-])cc1F ZINC000274360930 1024895686 /nfs/dbraw/zinc/89/56/86/1024895686.db2.gz ZQBOSLYGJAZPEI-LLVKDONJSA-N 1 0 334.347 3.602 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C1CC2(C1)COC(C)(C)C2 ZINC000897973553 1033248385 /nfs/dbraw/zinc/24/83/85/1033248385.db2.gz VLQNURQCZFLQEH-ASFAAARLSA-N 1 0 332.444 3.853 20 5 EHBDRO COCC[NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000237353995 1025057761 /nfs/dbraw/zinc/05/77/61/1025057761.db2.gz KQXSPKOCGDQTMM-UHFFFAOYSA-N 1 0 332.425 3.790 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)C(C)C ZINC000120985915 1025071482 /nfs/dbraw/zinc/07/14/82/1025071482.db2.gz WACXHJCNIMVTQJ-KRWDZBQOSA-N 1 0 329.400 3.664 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3C[C@@H]4CCC[C@@H]34)cs2)c1 ZINC000897952465 1033258423 /nfs/dbraw/zinc/25/84/23/1033258423.db2.gz GRIRILLYCPDBSO-IUIKQTSFSA-N 1 0 329.425 3.997 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@@H](F)C3)o2)c([N+](=O)[O-])c1 ZINC000520879951 1025100860 /nfs/dbraw/zinc/10/08/60/1025100860.db2.gz ZPDJRGGKDXJBJS-NEPJUHHUSA-N 1 0 334.347 3.844 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2C[C@@H]3CCC[C@H]23)cc1Br ZINC000897958706 1033258992 /nfs/dbraw/zinc/25/89/92/1033258992.db2.gz MHSGWLQUHKNQQL-OVYXKVPISA-N 1 0 331.235 3.697 20 5 EHBDRO Cn1cc(C[N@H+](C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)cn1 ZINC000119672306 1025162342 /nfs/dbraw/zinc/16/23/42/1025162342.db2.gz PIJLNMUIZGDNAD-UHFFFAOYSA-N 1 0 342.424 3.689 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(CC(F)(F)F)CC1 ZINC000551406408 1025290335 /nfs/dbraw/zinc/29/03/35/1025290335.db2.gz GYTIMPVNPIWCPG-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057565 1025482409 /nfs/dbraw/zinc/48/24/09/1025482409.db2.gz UBQJIRRJWXGPFN-RDTXWAMCSA-N 1 0 328.412 3.584 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC2(CCC(O)CC2)CC1 ZINC000451156294 1025608963 /nfs/dbraw/zinc/60/89/63/1025608963.db2.gz SKEIVWHKOSXCEU-OAHLLOKOSA-N 1 0 332.444 3.981 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1)N(C)C ZINC000442997118 1025640320 /nfs/dbraw/zinc/64/03/20/1025640320.db2.gz YZNSVQYINLHLBN-BEFAXECRSA-N 1 0 327.428 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H](COc3ccccc3)C2)cc1 ZINC000505818685 1025719663 /nfs/dbraw/zinc/71/96/63/1025719663.db2.gz KDSWHZGGDOHJEX-KRWDZBQOSA-N 1 0 326.396 3.538 20 5 EHBDRO [NH3+]CC[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000281950001 1025769239 /nfs/dbraw/zinc/76/92/39/1025769239.db2.gz LYTNMUKMQCPZSP-HNNXBMFYSA-N 1 0 333.435 3.589 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000522106657 1025976186 /nfs/dbraw/zinc/97/61/86/1025976186.db2.gz BKGBXNFHEBZTHM-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO CCOc1cccc(N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)c1[N+](=O)[O-] ZINC000516124721 1026015097 /nfs/dbraw/zinc/01/50/97/1026015097.db2.gz WAQVJFVLUFAXMC-OAGGEKHMSA-N 1 0 347.459 3.835 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000158286286 1026223751 /nfs/dbraw/zinc/22/37/51/1026223751.db2.gz FSPHGIZCNUXKPP-MJGOQNOKSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718832 1026365193 /nfs/dbraw/zinc/36/51/93/1026365193.db2.gz PXQYOAHJBFLIAI-DZGCQCFKSA-N 1 0 330.384 3.590 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@]3(CCSC3)C2)ccc1[N+](=O)[O-] ZINC000451961647 1026399168 /nfs/dbraw/zinc/39/91/68/1026399168.db2.gz DUUZEKKEGVTDSL-QGZVFWFLSA-N 1 0 336.457 3.713 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1 ZINC000452066945 1026461260 /nfs/dbraw/zinc/46/12/60/1026461260.db2.gz LYTJTMFRMMBTGV-VHDGCEQUSA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)(C[NH+]1CCCC1)NCc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000452100428 1026476354 /nfs/dbraw/zinc/47/63/54/1026476354.db2.gz ZWZQZCNKDBBRLT-UHFFFAOYSA-N 1 0 345.365 3.578 20 5 EHBDRO COc1cc(C[NH2+]C[C@]2(C)C[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000339445876 1026565406 /nfs/dbraw/zinc/56/54/06/1026565406.db2.gz SOUWWHOEGVXOIB-BEFAXECRSA-N 1 0 342.395 3.592 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](C)[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318094 1026580878 /nfs/dbraw/zinc/58/08/78/1026580878.db2.gz RKXZWMLXMKUJCN-AWEZNQCLSA-N 1 0 341.411 3.730 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000531202478 1026684106 /nfs/dbraw/zinc/68/41/06/1026684106.db2.gz ZPWOFXDEQVNEJP-WMLDXEAASA-N 1 0 326.396 3.981 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000520042851 1026702744 /nfs/dbraw/zinc/70/27/44/1026702744.db2.gz IVBQWBKFHIFTHL-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)c(F)c1 ZINC000384257721 1026794890 /nfs/dbraw/zinc/79/48/90/1026794890.db2.gz BYZMHUIVZYGEIL-MRXNPFEDSA-N 1 0 344.386 3.773 20 5 EHBDRO O=C(CC[NH2+][C@H](c1ccccc1)C1CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000128026149 1026837660 /nfs/dbraw/zinc/83/76/60/1026837660.db2.gz KELJRUUZBJKPQI-LJQANCHMSA-N 1 0 339.395 3.664 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2(CO)CCCCC2)o1 ZINC000611461706 1027011911 /nfs/dbraw/zinc/01/19/11/1027011911.db2.gz MHEBZKKWDLFUJI-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCN(Cc2ccccc2)C1 ZINC000531692627 1027190368 /nfs/dbraw/zinc/19/03/68/1027190368.db2.gz REIQFWMWJYFPSN-FUHWJXTLSA-N 1 0 339.439 3.828 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000501576381 1027377357 /nfs/dbraw/zinc/37/73/57/1027377357.db2.gz FSOFORQSDLXMLP-UHFFFAOYSA-N 1 0 348.447 3.679 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000310625638 1027490064 /nfs/dbraw/zinc/49/00/64/1027490064.db2.gz CUTYMFVFNVKSPZ-FTRWYGJKSA-N 1 0 339.439 3.908 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCC3)CC2)c2cccnc21 ZINC000413310551 1027495248 /nfs/dbraw/zinc/49/52/48/1027495248.db2.gz CHKZPYDMJPIHMI-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@H](C[NH+]1CCCCC1)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000097489800 1027563471 /nfs/dbraw/zinc/56/34/71/1027563471.db2.gz VVLJVIBZPVFWFL-MRXNPFEDSA-N 1 0 347.462 3.992 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2C[C@@H](C)N(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663383 1027579581 /nfs/dbraw/zinc/57/95/81/1027579581.db2.gz FKFXORYIULODQB-DNVCBOLYSA-N 1 0 339.439 3.656 20 5 EHBDRO CC(C)[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CC1 ZINC000532665310 1027586706 /nfs/dbraw/zinc/58/67/06/1027586706.db2.gz GXHAVDWONLJWFR-UHFFFAOYSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000475556002 1027597917 /nfs/dbraw/zinc/59/79/17/1027597917.db2.gz ZRJJDNKSXBPNMV-CABCVRRESA-N 1 0 348.447 3.596 20 5 EHBDRO COc1cccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178659591 1027619608 /nfs/dbraw/zinc/61/96/08/1027619608.db2.gz AXRQXVDJDMDHOC-UONOGXRCSA-N 1 0 330.384 3.722 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178659912 1027619907 /nfs/dbraw/zinc/61/99/07/1027619907.db2.gz OPSPQHGBLUQKJB-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000420625140 1027652386 /nfs/dbraw/zinc/65/23/86/1027652386.db2.gz KHPXVLIVFGDWQL-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000909602777 1027802829 /nfs/dbraw/zinc/80/28/29/1027802829.db2.gz ZYXWBMUPHLPARZ-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(O)cc1 ZINC000513790219 1027839392 /nfs/dbraw/zinc/83/93/92/1027839392.db2.gz UIZNZUCXDAKBPF-QFBILLFUSA-N 1 0 340.423 3.844 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420951916 1027916769 /nfs/dbraw/zinc/91/67/69/1027916769.db2.gz RIZWGNORHYERGG-LBPRGKRZSA-N 1 0 332.322 3.768 20 5 EHBDRO CC(C)CC[N@H+](C)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000053361043 1027962772 /nfs/dbraw/zinc/96/27/72/1027962772.db2.gz NNITTZVHQGQIRV-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](CC(F)F)c2ccccc2)cc1 ZINC000421001441 1027980436 /nfs/dbraw/zinc/98/04/36/1027980436.db2.gz WUXNZTOWQRTZRH-INIZCTEOSA-N 1 0 336.338 3.960 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCO3)o2)c(Cl)c1 ZINC000237816151 1028067422 /nfs/dbraw/zinc/06/74/22/1028067422.db2.gz GNWYAQUDWJKXAO-LBPRGKRZSA-N 1 0 336.775 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](CC(F)(F)F)C2)cc1 ZINC000444698571 1028172401 /nfs/dbraw/zinc/17/24/01/1028172401.db2.gz MFTJUKRWGFZRFA-LBPRGKRZSA-N 1 0 332.322 3.638 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000444764380 1028251857 /nfs/dbraw/zinc/25/18/57/1028251857.db2.gz BCZFQVPXPINLHX-AWEZNQCLSA-N 1 0 330.388 3.513 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@@H](C[NH3+])C2CCCCC2)cc1[N+](=O)[O-] ZINC000423263495 1028301380 /nfs/dbraw/zinc/30/13/80/1028301380.db2.gz ONIYCTQSCNLKDS-CJNGLKHVSA-N 1 0 335.448 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]34CCOC4)s2)cc1 ZINC000421400055 1028347787 /nfs/dbraw/zinc/34/77/87/1028347787.db2.gz QZJQAQUODNXOMI-QGZVFWFLSA-N 1 0 330.409 3.688 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](CCO)CC3)o2)cc1 ZINC000421401229 1028349322 /nfs/dbraw/zinc/34/93/22/1028349322.db2.gz TYVYPLRRDKZHGC-OAHLLOKOSA-N 1 0 344.411 3.839 20 5 EHBDRO COCC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccccc1 ZINC000519917881 1028379983 /nfs/dbraw/zinc/37/99/83/1028379983.db2.gz OREATMPERFCALH-INIZCTEOSA-N 1 0 344.411 3.683 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CC[C@@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513802 1028489942 /nfs/dbraw/zinc/48/99/42/1028489942.db2.gz RNQSIBIAACHOPK-FRIZHTMISA-N 1 0 343.427 3.557 20 5 EHBDRO Cn1cc(-c2ccccc2C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000366985643 1028532636 /nfs/dbraw/zinc/53/26/36/1028532636.db2.gz CEOUGHJMFZYLHG-RMKNXTFCSA-N 1 0 348.406 3.798 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCSC[C@@H]2c2ccccc2)cc1 ZINC000523790736 1028606142 /nfs/dbraw/zinc/60/61/42/1028606142.db2.gz XHMRWTWFJFHRRD-GOSISDBHSA-N 1 0 344.436 3.764 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCN(Cc2cccc(F)c2)CC1 ZINC000502771752 1028655976 /nfs/dbraw/zinc/65/59/76/1028655976.db2.gz YSQSWBFZLIOXRQ-HNNXBMFYSA-N 1 0 343.402 3.613 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000523856121 1028684001 /nfs/dbraw/zinc/68/40/01/1028684001.db2.gz DCJWUEZWCYOGJS-UHFFFAOYSA-N 1 0 339.867 3.800 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000324831818 1028693285 /nfs/dbraw/zinc/69/32/85/1028693285.db2.gz CGGCNELQSNNSOE-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO CC[C@@H](C)[C@@](C)(O)C[NH2+][C@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504911790 1029053366 /nfs/dbraw/zinc/05/33/66/1029053366.db2.gz LJLHYGMALQYNQY-CPUCHLNUSA-N 1 0 340.489 3.852 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(O)c1 ZINC000504912491 1029055130 /nfs/dbraw/zinc/05/51/30/1029055130.db2.gz WVZRRVQDRPXUMJ-CQSZACIVSA-N 1 0 332.425 3.961 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cscn1 ZINC000504912358 1029055863 /nfs/dbraw/zinc/05/58/63/1029055863.db2.gz VDQLCGVXBCPUQO-LBPRGKRZSA-N 1 0 337.470 3.754 20 5 EHBDRO CO[C@@]1(C(F)(F)F)CCCN([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925022 1029109752 /nfs/dbraw/zinc/10/97/52/1029109752.db2.gz RSHIXXWFPALGIU-RISCZKNCSA-N 1 0 332.322 3.699 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1C(C)(C)C ZINC000532969602 1029116484 /nfs/dbraw/zinc/11/64/84/1029116484.db2.gz JZHTZHYUPDNGPH-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000324882771 1029358742 /nfs/dbraw/zinc/35/87/42/1029358742.db2.gz QRRLXVIMQJPTJJ-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513823526 1029524047 /nfs/dbraw/zinc/52/40/47/1029524047.db2.gz VZMSUWKWWHHDTI-BURFUSLBSA-N 1 0 334.460 3.693 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513825676 1029524544 /nfs/dbraw/zinc/52/45/44/1029524544.db2.gz HPNKTRREZDITDW-SUMDDJOVSA-N 1 0 339.439 3.922 20 5 EHBDRO CC[C@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000533299915 1029602637 /nfs/dbraw/zinc/60/26/37/1029602637.db2.gz QZJWCCHTONFXCT-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO CN(C)c1cccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000525271930 1029768062 /nfs/dbraw/zinc/76/80/62/1029768062.db2.gz VNGKAPBOZWYRSO-LJQANCHMSA-N 1 0 325.412 3.998 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc(F)cc1[N+](=O)[O-] ZINC000525357040 1029808907 /nfs/dbraw/zinc/80/89/07/1029808907.db2.gz CVDDRSUYKHGXJL-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCC[C@H]1O ZINC000428458060 1029861304 /nfs/dbraw/zinc/86/13/04/1029861304.db2.gz BQWYIFKVJIUPOX-IAGOWNOFSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(F)c1 ZINC000728567591 1029890678 /nfs/dbraw/zinc/89/06/78/1029890678.db2.gz VWRBULONQDHPBT-HNNXBMFYSA-N 1 0 335.423 3.826 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000441190318 1029900423 /nfs/dbraw/zinc/90/04/23/1029900423.db2.gz RKPGYEMODUMNJM-OAHLLOKOSA-N 1 0 348.424 3.881 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272874 1030039664 /nfs/dbraw/zinc/03/96/64/1030039664.db2.gz VXJHWFBFDQRZTJ-GWCFXTLKSA-N 1 0 338.795 3.778 20 5 EHBDRO C[C@H]1C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCN1C ZINC000525709361 1030049486 /nfs/dbraw/zinc/04/94/86/1030049486.db2.gz VNFCZCWSPMQWII-DZGCQCFKSA-N 1 0 345.468 3.896 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1c(F)cccc1F)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120777279 1030092195 /nfs/dbraw/zinc/09/21/95/1030092195.db2.gz WGQQNTBSFAUFHA-YVEFUNNKSA-N 1 0 349.381 3.827 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000481956221 1030133997 /nfs/dbraw/zinc/13/39/97/1030133997.db2.gz CBDLHGSNLVKVCV-DNVCBOLYSA-N 1 0 327.428 3.857 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC(C)CC1 ZINC000481971124 1030141169 /nfs/dbraw/zinc/14/11/69/1030141169.db2.gz FZJNZOJECPVUPP-VQIMIIECSA-N 1 0 345.487 3.626 20 5 EHBDRO COc1ccc(C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000525821509 1030147564 /nfs/dbraw/zinc/14/75/64/1030147564.db2.gz ZXKMZGZKHQDKOE-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453363890 1030177705 /nfs/dbraw/zinc/17/77/05/1030177705.db2.gz ROEMIINLBHECRJ-OWQGQXMQSA-N 1 0 327.384 3.561 20 5 EHBDRO CCOc1ccc([C@@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365347 1030181190 /nfs/dbraw/zinc/18/11/90/1030181190.db2.gz LVARIAAIFKWXAN-RDTXWAMCSA-N 1 0 334.416 3.557 20 5 EHBDRO CC(C)(C)OC(=O)CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447526806 1030247613 /nfs/dbraw/zinc/24/76/13/1030247613.db2.gz DGIMMAUSTLZWKO-INIZCTEOSA-N 1 0 334.416 3.684 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C/C=C\c2ccccc2)n1 ZINC000447530368 1030252035 /nfs/dbraw/zinc/25/20/35/1030252035.db2.gz MLEHNONCUYVXRM-HYHHROLSSA-N 1 0 326.400 3.578 20 5 EHBDRO C[C@@H]([NH2+]CCCc1ccc2c(c1)CCO2)c1cccc([N+](=O)[O-])c1 ZINC000482233359 1030275300 /nfs/dbraw/zinc/27/53/00/1030275300.db2.gz XEUUHHXIKAWVKB-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@@H](CC(C)(C)C)[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453430010 1030286356 /nfs/dbraw/zinc/28/63/56/1030286356.db2.gz QCYWCWJAUHGVON-XJKSGUPXSA-N 1 0 330.432 3.832 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCCCN2C2CC2)cc1[N+](=O)[O-] ZINC000447594501 1030330111 /nfs/dbraw/zinc/33/01/11/1030330111.db2.gz ZHZQKXUOYBHFRW-PBHICJAKSA-N 1 0 347.459 3.661 20 5 EHBDRO Cc1cc(F)ccc1CC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447578227 1030341827 /nfs/dbraw/zinc/34/18/27/1030341827.db2.gz DMKLSNIXGROQJU-DLBZAZTESA-N 1 0 346.406 3.555 20 5 EHBDRO COc1ccccc1CCN(C)Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509657618 1030378227 /nfs/dbraw/zinc/37/82/27/1030378227.db2.gz KXIHLKCDGOOOCG-UHFFFAOYSA-N 1 0 336.338 3.556 20 5 EHBDRO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@@H+]1C1CC1 ZINC000583666503 1030392901 /nfs/dbraw/zinc/39/29/01/1030392901.db2.gz BXUPSIHINWMCBK-JSGCOSHPSA-N 1 0 333.432 3.809 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CCCC2)cc1 ZINC000453609603 1030399931 /nfs/dbraw/zinc/39/99/31/1030399931.db2.gz GIYMBUOBPMZENW-IBGZPJMESA-N 1 0 340.423 3.978 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192601683 1030426000 /nfs/dbraw/zinc/42/60/00/1030426000.db2.gz ANUCPAJYLYVJGA-IAGOWNOFSA-N 1 0 345.468 3.926 20 5 EHBDRO CC[C@@H](C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1)[NH+](C)C ZINC000532220601 1030488784 /nfs/dbraw/zinc/48/87/84/1030488784.db2.gz QMXVRQWOWOWKJZ-KRWDZBQOSA-N 1 0 343.383 3.666 20 5 EHBDRO C[C@@H]([NH2+]CCN(C)Cc1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000160138833 1030556846 /nfs/dbraw/zinc/55/68/46/1030556846.db2.gz DPJALRWZBSEQRC-CQSZACIVSA-N 1 0 331.391 3.517 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001168147752 1030926684 /nfs/dbraw/zinc/92/66/84/1030926684.db2.gz XGVHKKZJMOUKEW-MRXNPFEDSA-N 1 0 347.459 3.990 20 5 EHBDRO COc1ccccc1[C@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000007979194 1031287416 /nfs/dbraw/zinc/28/74/16/1031287416.db2.gz SDGBNIFAVWOLPO-INIZCTEOSA-N 1 0 349.818 3.972 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCC2(O)CCC2)c2ccccc2)c1 ZINC000551570959 1031463118 /nfs/dbraw/zinc/46/31/18/1031463118.db2.gz JWKSXWPGXWLIDN-SFHVURJKSA-N 1 0 326.396 3.579 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2cc3ccccc3o2)n1 ZINC000584033107 1031524719 /nfs/dbraw/zinc/52/47/19/1031524719.db2.gz ARQAGCBXPUKKKM-CVEARBPZSA-N 1 0 340.383 3.811 20 5 EHBDRO Cc1nn(C)cc1[C@@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278597155 1031581954 /nfs/dbraw/zinc/58/19/54/1031581954.db2.gz AIWYYLKEJZULCT-PIGZYNQJSA-N 1 0 328.416 3.710 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278597153 1031583958 /nfs/dbraw/zinc/58/39/58/1031583958.db2.gz AIWYYLKEJZULCT-GTNSWQLSSA-N 1 0 328.416 3.710 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC2(COC)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000594511869 1033415327 /nfs/dbraw/zinc/41/53/27/1033415327.db2.gz RSJYSPMHKHPADK-GOSISDBHSA-N 1 0 344.411 3.856 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)[C@@H]1CCCCO1 ZINC000594510175 1033415939 /nfs/dbraw/zinc/41/59/39/1033415939.db2.gz HYIYBPVVVGLGRP-MDASCCDHSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1cc(C)cc(C[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000061019838 1033442204 /nfs/dbraw/zinc/44/22/04/1033442204.db2.gz SOICBELYKFDITC-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO Cc1nn(C[N@H+](C)CCc2ccccc2F)c2cc([N+](=O)[O-])ccc12 ZINC000761289710 1033471965 /nfs/dbraw/zinc/47/19/65/1033471965.db2.gz ARGHDNBWCOHIDY-UHFFFAOYSA-N 1 0 342.374 3.524 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@H]1c1ccc(F)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000594716278 1033500939 /nfs/dbraw/zinc/50/09/39/1033500939.db2.gz NYDMNLVVRNHBDY-INIZCTEOSA-N 1 0 343.358 3.510 20 5 EHBDRO [NH3+]C1(CNCc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCC1 ZINC000594739221 1033509735 /nfs/dbraw/zinc/50/97/35/1033509735.db2.gz OLILRALHWCKJQM-UHFFFAOYSA-N 1 0 331.441 3.684 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350128 1033530861 /nfs/dbraw/zinc/53/08/61/1033530861.db2.gz UWKZVLKNBSREBN-JKSUJKDBSA-N 1 0 344.415 3.949 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011469 1033605197 /nfs/dbraw/zinc/60/51/97/1033605197.db2.gz HOQPSTJSHXREKQ-HOCLYGCPSA-N 1 0 344.411 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC[C@H]1CCCC[C@@H]1O ZINC000595022311 1033615027 /nfs/dbraw/zinc/61/50/27/1033615027.db2.gz LAISMINQSWSRHQ-VBQJREDUSA-N 1 0 336.432 3.585 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000598974652 1033624141 /nfs/dbraw/zinc/62/41/41/1033624141.db2.gz SJLVCABVAAZCSC-LBPRGKRZSA-N 1 0 345.399 3.567 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000595000223 1033626394 /nfs/dbraw/zinc/62/63/94/1033626394.db2.gz HWDXZNAIIIXRLV-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000595000224 1033626637 /nfs/dbraw/zinc/62/66/37/1033626637.db2.gz HWDXZNAIIIXRLV-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](c1ccsc1)N(C)C ZINC000595002982 1033628101 /nfs/dbraw/zinc/62/81/01/1033628101.db2.gz AMTRFQWLQNIGDN-MLGOLLRUSA-N 1 0 349.456 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CCCOC3)o2)cc1 ZINC000598985342 1033632382 /nfs/dbraw/zinc/63/23/82/1033632382.db2.gz OLHQWOGMYFGIAT-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC000595039540 1033658798 /nfs/dbraw/zinc/65/87/98/1033658798.db2.gz QBDIEIWMOKOOHK-MCIONIFRSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](Cc1ccccc1)OC ZINC000595043244 1033663097 /nfs/dbraw/zinc/66/30/97/1033663097.db2.gz VNZOECWUPMQWSG-PBHICJAKSA-N 1 0 344.411 3.512 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C1CC1)C1CCOCC1 ZINC000593665400 1033666361 /nfs/dbraw/zinc/66/63/61/1033666361.db2.gz BYHTWSNQICSVJQ-AUUYWEPGSA-N 1 0 332.444 3.711 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595109150 1033693967 /nfs/dbraw/zinc/69/39/67/1033693967.db2.gz UQKOCTCUHKMDDT-USXIJHARSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000595083760 1033698361 /nfs/dbraw/zinc/69/83/61/1033698361.db2.gz CAMGBAPOOJLOKC-WBAXXEDZSA-N 1 0 342.443 3.699 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1Cc2ccccc2NC1=O)c1cccc([N+](=O)[O-])c1 ZINC000599075094 1033717760 /nfs/dbraw/zinc/71/77/60/1033717760.db2.gz SRYRARNGRWQEQA-AEFFLSMTSA-N 1 0 339.395 3.589 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000595330987 1033729485 /nfs/dbraw/zinc/72/94/85/1033729485.db2.gz GXUWIPXFDQODRF-GDBMZVCRSA-N 1 0 329.400 3.907 20 5 EHBDRO C[C@@H](CO)C1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000593676899 1033733214 /nfs/dbraw/zinc/73/32/14/1033733214.db2.gz OYOJVMRYKAZSCD-AWEZNQCLSA-N 1 0 344.411 3.695 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCC(C)(C)[NH2+][C@H](C)c1ccccc1 ZINC000192563429 1033743892 /nfs/dbraw/zinc/74/38/92/1033743892.db2.gz XNJYCNISEVXECZ-CYBMUJFWSA-N 1 0 345.447 3.661 20 5 EHBDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000603841253 1033964589 /nfs/dbraw/zinc/96/45/89/1033964589.db2.gz ZRQVWDSMAGYQGP-LBPRGKRZSA-N 1 0 336.338 3.945 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(c2ccccc2)CC1 ZINC000603841090 1033964991 /nfs/dbraw/zinc/96/49/91/1033964991.db2.gz WPFSTNXLXQZWEO-UHFFFAOYSA-N 1 0 326.396 3.853 20 5 EHBDRO O=[N+]([O-])c1c(NCCC[NH2+]C2CCCCC2)ccc2ncccc21 ZINC000603847781 1033972687 /nfs/dbraw/zinc/97/26/87/1033972687.db2.gz SMVRZQRNLRFOHT-UHFFFAOYSA-N 1 0 328.416 3.867 20 5 EHBDRO Cc1cc(NCC2([NH+]3CCSCC3)CCCC2)ccc1[N+](=O)[O-] ZINC000603853557 1033975869 /nfs/dbraw/zinc/97/58/69/1033975869.db2.gz FKYIIPRUTVNGKR-UHFFFAOYSA-N 1 0 335.473 3.677 20 5 EHBDRO COc1cccc(C2([NH2+]Cc3ccc([N+](=O)[O-])cc3OC)CCC2)c1 ZINC000595854493 1034008541 /nfs/dbraw/zinc/00/85/41/1034008541.db2.gz UUXWPDLNKWXFDW-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO CC(C)(C)OC(=O)[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)C1CCC1 ZINC000596064348 1034065720 /nfs/dbraw/zinc/06/57/20/1034065720.db2.gz WNXNLIFQLGEXIL-ZDUSSCGKSA-N 1 0 340.445 3.504 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC2)CC1 ZINC000599672175 1034081165 /nfs/dbraw/zinc/08/11/65/1034081165.db2.gz BXCKGCQLPWALNM-CYBMUJFWSA-N 1 0 342.399 3.972 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N2CCC([NH2+]Cc3ccccc3)CC2)c1 ZINC000596252035 1034135911 /nfs/dbraw/zinc/13/59/11/1034135911.db2.gz DQYLZPFGYUKRBM-UHFFFAOYSA-N 1 0 325.412 3.662 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000450349312 1034162049 /nfs/dbraw/zinc/16/20/49/1034162049.db2.gz UTMXCQDIMHGFSA-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO CCOc1cccc(NC[C@@H]2CCC[N@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596570813 1034292901 /nfs/dbraw/zinc/29/29/01/1034292901.db2.gz OHDDICJRCOIQQN-HNNXBMFYSA-N 1 0 333.432 3.527 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1(CO)CCC1 ZINC000597254363 1034627611 /nfs/dbraw/zinc/62/76/11/1034627611.db2.gz KEERIOLQSATZCT-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000597257603 1034629712 /nfs/dbraw/zinc/62/97/12/1034629712.db2.gz HDWQWBINSMRLQQ-AUWJEWJLSA-N 1 0 340.427 3.806 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](c2ccccc2)C2CC2)c1[N+](=O)[O-] ZINC000892485665 1034783769 /nfs/dbraw/zinc/78/37/69/1034783769.db2.gz LLNSHMHXXPBYLJ-MRXNPFEDSA-N 1 0 328.368 3.550 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000167501150 1034938259 /nfs/dbraw/zinc/93/82/59/1034938259.db2.gz KGDZGDHGYZQDTE-GXTWGEPZSA-N 1 0 347.365 3.803 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000472441864 1035055651 /nfs/dbraw/zinc/05/56/51/1035055651.db2.gz DFCFNHRSQZVJJL-UHFFFAOYSA-N 1 0 343.374 3.508 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)C2 ZINC000612582092 1035071109 /nfs/dbraw/zinc/07/11/09/1035071109.db2.gz VQOJDSFSVNPRBT-KRWDZBQOSA-N 1 0 326.396 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593290 1035084477 /nfs/dbraw/zinc/08/44/77/1035084477.db2.gz ZMXSRVXWQQCWNQ-MAUKXSAKSA-N 1 0 348.349 3.883 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](NCCC[NH+]2CCCC2)c2ccccc2)c1 ZINC000180017258 1035193526 /nfs/dbraw/zinc/19/35/26/1035193526.db2.gz NYKVTYUEDHFRPR-FQEVSTJZSA-N 1 0 339.439 3.760 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2cnn(C(C)C)c2)ccc1[N+](=O)[O-] ZINC000580268427 1035425291 /nfs/dbraw/zinc/42/52/91/1035425291.db2.gz ILEAVEZECMXWGG-ZDUSSCGKSA-N 1 0 332.404 3.622 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000511460751 1035472327 /nfs/dbraw/zinc/47/23/27/1035472327.db2.gz MUDQTTOAUDYIRC-TWGQIWQCSA-N 1 0 337.423 3.820 20 5 EHBDRO C[C@@H]1C[C@@H](c2cccnc2)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204722 1035822560 /nfs/dbraw/zinc/82/25/60/1035822560.db2.gz ASUXXYDDVNSMKR-BEFAXECRSA-N 1 0 341.411 3.842 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000588232657 1035832468 /nfs/dbraw/zinc/83/24/68/1035832468.db2.gz VBGFLRNHXHGODM-DZGCQCFKSA-N 1 0 348.830 3.983 20 5 EHBDRO C[C@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000588232722 1035832596 /nfs/dbraw/zinc/83/25/96/1035832596.db2.gz YYWYVAXISQSRRE-SWLSCSKDSA-N 1 0 334.803 3.675 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000588311571 1035898391 /nfs/dbraw/zinc/89/83/91/1035898391.db2.gz BFMAXWCDNYGRRB-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO COC1CCC([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000414191596 1035976528 /nfs/dbraw/zinc/97/65/28/1035976528.db2.gz UJXRXDHENSJHAZ-KUQKPQIMSA-N 1 0 332.444 3.853 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000414193265 1035990711 /nfs/dbraw/zinc/99/07/11/1035990711.db2.gz SVXLLASZUISAHV-BBRMVZONSA-N 1 0 326.396 3.730 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@H]1C ZINC000463951742 1035994518 /nfs/dbraw/zinc/99/45/18/1035994518.db2.gz BVQRSDNXQODSDR-CABCVRRESA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000492555366 1035999160 /nfs/dbraw/zinc/99/91/60/1035999160.db2.gz AVMOJMJFHPKYAX-QGZVFWFLSA-N 1 0 329.375 3.983 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1N[C@@H](C)[C@H](c1ccccc1C)[NH+](C)C ZINC000340918894 1036057526 /nfs/dbraw/zinc/05/75/26/1036057526.db2.gz OXJKDMBPJNLDIN-XJKSGUPXSA-N 1 0 345.447 3.531 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000582630728 1036061330 /nfs/dbraw/zinc/06/13/30/1036061330.db2.gz DNYIMVCWWHBMAJ-OCCSQVGLSA-N 1 0 346.818 3.891 20 5 EHBDRO CCOc1cc(CN(C)Cc2cc(Cl)cn2C)ccc1[N+](=O)[O-] ZINC000492654934 1036115148 /nfs/dbraw/zinc/11/51/48/1036115148.db2.gz OSJQFJLTWSADJP-UHFFFAOYSA-N 1 0 337.807 3.617 20 5 EHBDRO CCOc1cc(C[N@H+](C)Cc2cccc(N(C)C)c2)ccc1[N+](=O)[O-] ZINC000492751135 1036247623 /nfs/dbraw/zinc/24/76/23/1036247623.db2.gz RTDWTFQLJCREKM-UHFFFAOYSA-N 1 0 343.427 3.692 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC2(CCC2)[C@H]1[C@H]1CCCO1 ZINC000572804025 1036501329 /nfs/dbraw/zinc/50/13/29/1036501329.db2.gz MXCOGPZLTQRZQP-HZPDHXFCSA-N 1 0 336.819 3.782 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1C)Cc1ccc(OC)cc1OC ZINC000541773687 1036643571 /nfs/dbraw/zinc/64/35/71/1036643571.db2.gz IEEYIYODOFYWCM-UHFFFAOYSA-N 1 0 344.411 3.943 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000464774909 1036764448 /nfs/dbraw/zinc/76/44/48/1036764448.db2.gz LPKBJSMZQDEVLM-GOSISDBHSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1cc(Cl)cc([N+](=O)[O-])c1C(=O)OCC[C@@H]1CCCC[N@H+]1C ZINC000760792870 1037072275 /nfs/dbraw/zinc/07/22/75/1037072275.db2.gz LYRFKZYGNIRCQX-ZDUSSCGKSA-N 1 0 340.807 3.588 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2COc3ccccc3C2)cc1Cl ZINC000761515419 1037093275 /nfs/dbraw/zinc/09/32/75/1037093275.db2.gz KWDMNULKXPFMQK-CYBMUJFWSA-N 1 0 332.787 3.589 20 5 EHBDRO Cc1ccc([C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)N(C)C)cc1 ZINC000761520631 1037099129 /nfs/dbraw/zinc/09/91/29/1037099129.db2.gz CSRUJHROJRASIS-SFHVURJKSA-N 1 0 347.846 3.949 20 5 EHBDRO C[C@H](CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+]1CCCCC1 ZINC000542272524 1037252052 /nfs/dbraw/zinc/25/20/52/1037252052.db2.gz XMLXVGUHFLHYMJ-GFCCVEGCSA-N 1 0 343.374 3.873 20 5 EHBDRO CC[C@H]1C[C@H](C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000539829593 1037256209 /nfs/dbraw/zinc/25/62/09/1037256209.db2.gz REKKBSJDDNWHES-BBRMVZONSA-N 1 0 328.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@@H]3COCC[C@H]32)o1 ZINC000539891717 1037314340 /nfs/dbraw/zinc/31/43/40/1037314340.db2.gz ZJAGFPLPTUJVIX-RHSMWYFYSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000591282639 1037319284 /nfs/dbraw/zinc/31/92/84/1037319284.db2.gz ITXFLOFHSNEOMK-HNNXBMFYSA-N 1 0 341.411 3.619 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)Oc1ccc(C)cc1 ZINC000462733793 1037335077 /nfs/dbraw/zinc/33/50/77/1037335077.db2.gz KLNYEVJAVQIMNF-OAHLLOKOSA-N 1 0 344.411 3.859 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H]([C@@H]3CCOC3)C2)cc1[N+](=O)[O-] ZINC000539899994 1037341717 /nfs/dbraw/zinc/34/17/17/1037341717.db2.gz MFHWOCCRKNSHRX-DLBZAZTESA-N 1 0 332.444 3.967 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCCC1 ZINC000129724370 1037425656 /nfs/dbraw/zinc/42/56/56/1037425656.db2.gz AYAIZAPNWOAWFB-GFCCVEGCSA-N 1 0 337.395 3.621 20 5 EHBDRO COc1cccc(NC2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000181211667 1037440210 /nfs/dbraw/zinc/44/02/10/1037440210.db2.gz ZVZJIMANJNCGMD-UHFFFAOYSA-N 1 0 341.411 3.680 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000532476519 1037515116 /nfs/dbraw/zinc/51/51/16/1037515116.db2.gz LPGMTLNGKDPTAY-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462921743 1037562919 /nfs/dbraw/zinc/56/29/19/1037562919.db2.gz JERSJMKSUIRRMG-LBPRGKRZSA-N 1 0 343.374 3.873 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538077 1037566582 /nfs/dbraw/zinc/56/65/82/1037566582.db2.gz XLAUKQLNFHMHDJ-GJZGRUSLSA-N 1 0 328.416 3.636 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1F ZINC000181354308 1037571179 /nfs/dbraw/zinc/57/11/79/1037571179.db2.gz XLAKIJPWANOCSL-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO CC(C)(C)C[C@H](CO)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540148116 1037602396 /nfs/dbraw/zinc/60/23/96/1037602396.db2.gz HGEWAIGDILBKCE-DJIMGWMZSA-N 1 0 334.460 3.693 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cn(C)nc1C(F)(F)F ZINC000540148648 1037606904 /nfs/dbraw/zinc/60/69/04/1037606904.db2.gz XOUXVLAURLIKEV-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO C[C@@H](C[NH2+][C@@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1[N+](=O)[O-] ZINC000897465279 1037871994 /nfs/dbraw/zinc/87/19/94/1037871994.db2.gz VDQWEGONPSYVIE-KBPBESRZSA-N 1 0 335.407 3.937 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC([NH+]2CCCCC2)CC1 ZINC000494205427 1037899815 /nfs/dbraw/zinc/89/98/15/1037899815.db2.gz PUUZSPJGMKHPLC-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592177099 1037907943 /nfs/dbraw/zinc/90/79/43/1037907943.db2.gz ATAQAWGLKKZVSB-MRXNPFEDSA-N 1 0 338.835 3.691 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540397875 1037910533 /nfs/dbraw/zinc/91/05/33/1037910533.db2.gz JZZMGCHSWVCINY-VYCZESIESA-N 1 0 332.444 3.711 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)(C)C ZINC000463379447 1038100188 /nfs/dbraw/zinc/10/01/88/1038100188.db2.gz STAAJUXTXIEGDP-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO C[C@H]1C[C@@H](C(=O)Nc2cc([N+](=O)[O-])ccc2C(C)(C)C)CC[N@@H+]1C ZINC000893168248 1038129842 /nfs/dbraw/zinc/12/98/42/1038129842.db2.gz BADWDSAZCGGFAP-STQMWFEESA-N 1 0 333.432 3.561 20 5 EHBDRO COc1cccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c1OC ZINC000897470018 1038218949 /nfs/dbraw/zinc/21/89/49/1038218949.db2.gz WHXDPMFGGGLZSR-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@H]1C[C@H](C)C[NH+](CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC001167735153 1038444450 /nfs/dbraw/zinc/44/44/50/1038444450.db2.gz STRPKPGKSOEWCM-HOTGVXAUSA-N 1 0 331.460 3.537 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721973 1038490967 /nfs/dbraw/zinc/49/09/67/1038490967.db2.gz QIJMBFDBRUZRJO-KRWDZBQOSA-N 1 0 333.476 3.882 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000538721974 1038491099 /nfs/dbraw/zinc/49/10/99/1038491099.db2.gz QIJMBFDBRUZRJO-QGZVFWFLSA-N 1 0 333.476 3.882 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)c2cccnc21 ZINC000382056748 1038520150 /nfs/dbraw/zinc/52/01/50/1038520150.db2.gz XNUDLGWSLKSSBJ-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959428 1038697302 /nfs/dbraw/zinc/69/73/02/1038697302.db2.gz PLTVMAQXRFUFKC-QAPCUYQASA-N 1 0 329.375 3.900 20 5 EHBDRO CC(C)[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(C)(C)O ZINC000477864385 1038975992 /nfs/dbraw/zinc/97/59/92/1038975992.db2.gz ZMYMEEDRUSSHMM-HFTRVMKXSA-N 1 0 334.460 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCCNc1ccccn1)CCC2 ZINC000192812499 1039030551 /nfs/dbraw/zinc/03/05/51/1039030551.db2.gz OWLRLZGOJFCMJZ-GOSISDBHSA-N 1 0 340.427 3.849 20 5 EHBDRO CCC(=O)c1ccc(NCC2(C[NH+](C)C)CCCC2)c([N+](=O)[O-])c1 ZINC000480111067 1039156749 /nfs/dbraw/zinc/15/67/49/1039156749.db2.gz CROATFHHYZIXKY-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO Cc1cccc(C[NH+]2CCN([C@H](C)c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000026852636 1039177964 /nfs/dbraw/zinc/17/79/64/1039177964.db2.gz LIMZRJKNTHDIEC-QGZVFWFLSA-N 1 0 339.439 3.782 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCN2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000480225472 1039322321 /nfs/dbraw/zinc/32/23/21/1039322321.db2.gz KRBJRADTIVGWIP-INIZCTEOSA-N 1 0 339.439 3.612 20 5 EHBDRO CC(C)[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)C1CCCC1 ZINC000129043566 1039324652 /nfs/dbraw/zinc/32/46/52/1039324652.db2.gz SLEFWJZCDKIWIM-UHFFFAOYSA-N 1 0 337.395 3.716 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)n1 ZINC000552582539 1039375501 /nfs/dbraw/zinc/37/55/01/1039375501.db2.gz OUKOTLNFIIGNGD-GRTSSRMGSA-N 1 0 344.415 3.972 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@H]1CO ZINC000249068151 1039381061 /nfs/dbraw/zinc/38/10/61/1039381061.db2.gz JEGGOZVALSRULW-WBMJQRKESA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1cc(Cl)ccc1C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000488803306 1039406967 /nfs/dbraw/zinc/40/69/67/1039406967.db2.gz YHCUJZFWDWMXQO-UHFFFAOYSA-N 1 0 334.807 3.590 20 5 EHBDRO Cn1cc(C[NH2+]CCSC(C)(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000237785936 1039430172 /nfs/dbraw/zinc/43/01/72/1039430172.db2.gz UQKJKOQOKGENPY-UHFFFAOYSA-N 1 0 348.472 3.617 20 5 EHBDRO C[C@@H](NCc1ccc(Br)c([N+](=O)[O-])c1)c1cscn1 ZINC000697869596 1039620003 /nfs/dbraw/zinc/62/00/03/1039620003.db2.gz AJZGVUZBDYZDDM-MRVPVSSYSA-N 1 0 342.218 3.665 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1COCc2ccccc21)C1CC1 ZINC000417364465 1039730779 /nfs/dbraw/zinc/73/07/79/1039730779.db2.gz MVUHVKZPWQPQJD-OALUTQOASA-N 1 0 338.407 3.777 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000489298580 1039814775 /nfs/dbraw/zinc/81/47/75/1039814775.db2.gz WZEQYKDAVIBUKV-NWDGAFQWSA-N 1 0 341.839 3.943 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(F)F ZINC000428731540 1040118356 /nfs/dbraw/zinc/11/83/56/1040118356.db2.gz YLQDEJMMVNEEAL-CVEARBPZSA-N 1 0 340.370 3.859 20 5 EHBDRO COc1cccc(C2CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000512590313 1040216208 /nfs/dbraw/zinc/21/62/08/1040216208.db2.gz LKORVDAEQBGHTL-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(C)n1)[NH+](C)C ZINC000553706710 1040347257 /nfs/dbraw/zinc/34/72/57/1040347257.db2.gz YVCRVVBTKWNSQI-KBXCAEBGSA-N 1 0 328.416 3.710 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@@H](O)Cc1ccc(F)cc1 ZINC000555314484 1040412271 /nfs/dbraw/zinc/41/22/71/1040412271.db2.gz AXSMHBWNIZCHQG-IBGZPJMESA-N 1 0 346.402 3.548 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486769535 1040425087 /nfs/dbraw/zinc/42/50/87/1040425087.db2.gz FFQDXJPJAMMJGN-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070431 1040435246 /nfs/dbraw/zinc/43/52/46/1040435246.db2.gz BJRNXKRCHVMLRM-OAHLLOKOSA-N 1 0 333.432 3.968 20 5 EHBDRO C[C@@H](CCCCO)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453288607 1040637559 /nfs/dbraw/zinc/63/75/59/1040637559.db2.gz POEICHMGSDUQRY-KXBFYZLASA-N 1 0 328.412 3.825 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1CCOC2(CCC2)C1)C1CC1 ZINC000453318485 1040693858 /nfs/dbraw/zinc/69/38/58/1040693858.db2.gz MCOGOHWWWBFYPK-MAUKXSAKSA-N 1 0 344.455 3.855 20 5 EHBDRO CC[C@H]([NH2+]CCn1c(C)nc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000120287859 1040719014 /nfs/dbraw/zinc/71/90/14/1040719014.db2.gz RXUIKORIXRKJHJ-KRWDZBQOSA-N 1 0 338.411 3.994 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCCn2cnc3ccccc32)cc1[N+](=O)[O-] ZINC000120487131 1040733664 /nfs/dbraw/zinc/73/36/64/1040733664.db2.gz FTGISPFLHXVHHT-HNNXBMFYSA-N 1 0 338.411 3.994 20 5 EHBDRO O=C(N[C@H]1CC[N@@H+]2CCCC[C@H]12)c1cc2ccccc2c2cccnc12 ZINC000481355742 1040768636 /nfs/dbraw/zinc/76/86/36/1040768636.db2.gz WCDDTPNNRMXCRJ-VQTJNVASSA-N 1 0 345.446 3.745 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C/C=C/c2ccncc2)cc(C(F)(F)F)c1 ZINC000487182173 1040770820 /nfs/dbraw/zinc/77/08/20/1040770820.db2.gz ANSBIAUKUYWCLP-OWOJBTEDSA-N 1 0 337.301 3.812 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC3(C2)CCCO3)s1 ZINC000600189484 1040799442 /nfs/dbraw/zinc/79/94/42/1040799442.db2.gz KGOLLWCSFNFUHW-UHFFFAOYSA-N 1 0 330.409 3.688 20 5 EHBDRO O=[N+]([O-])c1ccc(S[C@@H]2CCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000425289232 1041096128 /nfs/dbraw/zinc/09/61/28/1041096128.db2.gz ZCYUOCBMWBBVOP-MRXNPFEDSA-N 1 0 329.425 3.747 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000249363856 1041130815 /nfs/dbraw/zinc/13/08/15/1041130815.db2.gz VIVDZQFUMHBLJW-PXAZEXFGSA-N 1 0 346.456 3.734 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@]2(C)CCCC[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000433305201 1041247414 /nfs/dbraw/zinc/24/74/14/1041247414.db2.gz PDLXVBIACBOBTL-LNLFQRSKSA-N 1 0 332.444 3.848 20 5 EHBDRO C[C@H](NC(=O)Nc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000047505612 1041682482 /nfs/dbraw/zinc/68/24/82/1041682482.db2.gz SZXQKYQCQQGDLZ-ZDUSSCGKSA-N 1 0 342.399 3.539 20 5 EHBDRO CCCn1ccnc1CCCN(C)c1c(Cl)cccc1[N+](=O)[O-] ZINC000432177625 1041694861 /nfs/dbraw/zinc/69/48/61/1041694861.db2.gz JTQPALKYSWQTQP-UHFFFAOYSA-N 1 0 336.823 3.924 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cc1F ZINC000291235459 1042787915 /nfs/dbraw/zinc/78/79/15/1042787915.db2.gz UMBLVXLIQURAOC-KYJSFNMBSA-N 1 0 336.407 3.640 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000342291901 1042849889 /nfs/dbraw/zinc/84/98/89/1042849889.db2.gz JGTRVXZCUXFPLL-INIZCTEOSA-N 1 0 347.802 3.928 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122134960 1042864811 /nfs/dbraw/zinc/86/48/11/1042864811.db2.gz CNMRHKJZMPPCFJ-YOEHRIQHSA-N 1 0 329.400 3.676 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(NC(C)=O)nc1)c1cccc([N+](=O)[O-])c1 ZINC000279006139 1043172894 /nfs/dbraw/zinc/17/28/94/1043172894.db2.gz GICORJDXSPNMFQ-KRWDZBQOSA-N 1 0 342.399 3.579 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000344086298 1043226110 /nfs/dbraw/zinc/22/61/10/1043226110.db2.gz GKKVHGXXPRVOFU-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000279132145 1043401048 /nfs/dbraw/zinc/40/10/48/1043401048.db2.gz RCKHGSWUZVNISL-JKSUJKDBSA-N 1 0 332.425 3.702 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C2CCN(C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129142 1043404312 /nfs/dbraw/zinc/40/43/12/1043404312.db2.gz QWJWOJXXEZIRKJ-GOSISDBHSA-N 1 0 329.444 3.534 20 5 EHBDRO CN(C)c1ccc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000279139615 1043434313 /nfs/dbraw/zinc/43/43/13/1043434313.db2.gz RSYVWMCCXYESRB-KRWDZBQOSA-N 1 0 340.427 3.568 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728900055 1043812846 /nfs/dbraw/zinc/81/28/46/1043812846.db2.gz BBYLZYDCFCLLQK-GOSISDBHSA-N 1 0 328.416 3.926 20 5 EHBDRO CO[C@H](CC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000344799254 1044433875 /nfs/dbraw/zinc/43/38/75/1044433875.db2.gz SNXMOYNUZFBUHQ-KOTGUFOOSA-N 1 0 332.322 3.555 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@H]1CC(C)C ZINC000500465832 1044879539 /nfs/dbraw/zinc/87/95/39/1044879539.db2.gz KHZCEINGVSCTNK-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(Cc1ccco1)C[C@@H]1CCCO1 ZINC000183295522 1125517279 /nfs/dbraw/zinc/51/72/79/1125517279.db2.gz YQTFYDOLXLXBQX-SFHVURJKSA-N 1 0 330.384 3.677 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(-n2ccnc2)cc1 ZINC000765357700 1127601054 /nfs/dbraw/zinc/60/10/54/1127601054.db2.gz CEGHVNWIDSGYDN-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000765335160 1127599359 /nfs/dbraw/zinc/59/93/59/1127599359.db2.gz RFXOLMYAGWNUEQ-HUUCEWRRSA-N 1 0 326.396 3.805 20 5 EHBDRO C[C@H]1C[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000301398461 1127740846 /nfs/dbraw/zinc/74/08/46/1127740846.db2.gz ARWFIRQVVHLYJM-JQWIXIFHSA-N 1 0 331.338 3.533 20 5 EHBDRO CC(C)(C)C[C@H](O)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000172269371 1127865371 /nfs/dbraw/zinc/86/53/71/1127865371.db2.gz VGWJLXZGJVGUIZ-HNNXBMFYSA-N 1 0 349.456 3.605 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000347571540 1128106006 /nfs/dbraw/zinc/10/60/06/1128106006.db2.gz XPIIQPVFOKPQBR-LBPRGKRZSA-N 1 0 347.440 3.953 20 5 EHBDRO COC1CC[NH+](C2(CNc3cccc(C)c3[N+](=O)[O-])CCCC2)CC1 ZINC000338664630 1128303453 /nfs/dbraw/zinc/30/34/53/1128303453.db2.gz AUXGBZZQOJDHPS-UHFFFAOYSA-N 1 0 347.459 3.739 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765844774 1128547074 /nfs/dbraw/zinc/54/70/74/1128547074.db2.gz JIFDQOJVDGGCCS-DPMMWBKBSA-N 1 0 344.386 3.681 20 5 EHBDRO C[C@H](C[N@H+](Cc1cccc([N+](=O)[O-])c1)[C@@H](C)CO)c1ccccc1 ZINC000554279119 1128633511 /nfs/dbraw/zinc/63/35/11/1128633511.db2.gz FELCITXMSFYHBP-CVEARBPZSA-N 1 0 328.412 3.581 20 5 EHBDRO COc1ccc(C2(C[NH2+]Cc3ccc([N+](=O)[O-])cc3)CCC2)cc1 ZINC000554752137 1128673103 /nfs/dbraw/zinc/67/31/03/1128673103.db2.gz IFEWYGIOTNEJHA-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO C[C@@H]1C[C@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000172619116 1128736621 /nfs/dbraw/zinc/73/66/21/1128736621.db2.gz JHKLFYKYDKZEEI-NVXWUHKLSA-N 1 0 347.462 3.943 20 5 EHBDRO C[NH+](C)Cc1ccc(NC(=O)C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000265746387 1128755295 /nfs/dbraw/zinc/75/52/95/1128755295.db2.gz DBLAQFMNMREWOJ-UHFFFAOYSA-N 1 0 341.411 3.573 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000193066661 1120887773 /nfs/dbraw/zinc/88/77/73/1120887773.db2.gz YKEBUXIWSSTDKR-SFHVURJKSA-N 1 0 330.359 3.910 20 5 EHBDRO CC(C)C[C@@H](CNc1ccc([N+](=O)[O-])cn1)[NH2+][C@H](C)c1ccccc1 ZINC000495320175 1121073767 /nfs/dbraw/zinc/07/37/67/1121073767.db2.gz YSVQTOKDVFMIEL-WBVHZDCISA-N 1 0 342.443 3.589 20 5 EHBDRO CN(Cc1ccc(F)c(Cl)c1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000762104440 1121109347 /nfs/dbraw/zinc/10/93/47/1121109347.db2.gz DGKLELQWJYWYAN-UHFFFAOYSA-N 1 0 348.765 3.827 20 5 EHBDRO CC(C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[NH+]1CCCC1 ZINC000301080866 1121471743 /nfs/dbraw/zinc/47/17/43/1121471743.db2.gz POQREJJVMGRELG-KRWDZBQOSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@H]1CCC[N@H+](CCCCNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301729235 1128998591 /nfs/dbraw/zinc/99/85/91/1128998591.db2.gz CHCIVCUCPJIDPD-LBPRGKRZSA-N 1 0 326.828 3.567 20 5 EHBDRO Cc1cc2ncc([C@H](C)[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)c(C)n2n1 ZINC000193903210 1121727076 /nfs/dbraw/zinc/72/70/76/1121727076.db2.gz HSLJZSXPKWQIBO-STQMWFEESA-N 1 0 339.399 3.666 20 5 EHBDRO COc1ccc(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000609233214 1121789853 /nfs/dbraw/zinc/78/98/53/1121789853.db2.gz BRPLVNLRKDIJNZ-IBGZPJMESA-N 1 0 342.395 3.567 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301106792 1121922378 /nfs/dbraw/zinc/92/23/78/1121922378.db2.gz QOTAYMILIYXEMD-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090801271 1122229929 /nfs/dbraw/zinc/22/99/29/1122229929.db2.gz CBMLIIQJNYBVLZ-AEFFLSMTSA-N 1 0 340.427 3.700 20 5 EHBDRO Cc1noc(C)c1CCNc1cc(C)[nH+]c2ccc([N+](=O)[O-])cc12 ZINC000272786583 1122231908 /nfs/dbraw/zinc/23/19/08/1122231908.db2.gz BJSAWJCZHKRBRA-UHFFFAOYSA-N 1 0 326.356 3.711 20 5 EHBDRO CC(=O)c1ccc(Nc2ccc(CC[NH+](C)C)cc2)c([N+](=O)[O-])c1 ZINC000301212324 1122845310 /nfs/dbraw/zinc/84/53/10/1122845310.db2.gz XOUNJGSLWNVTTH-UHFFFAOYSA-N 1 0 327.384 3.645 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H](C2CC2)C2CCOCC2)cc1 ZINC000925463943 1123033566 /nfs/dbraw/zinc/03/35/66/1123033566.db2.gz CBTZWESHUPRWAP-LJQANCHMSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)[N@@H+](Cc1cccc(F)c1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000919950524 1123243249 /nfs/dbraw/zinc/24/32/49/1123243249.db2.gz JZVTVMFBAZLQPR-UHFFFAOYSA-N 1 0 342.374 3.952 20 5 EHBDRO C[N@@H+]1CCC[C@@H]1CNc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000920486194 1123374717 /nfs/dbraw/zinc/37/47/17/1123374717.db2.gz SGADYMTWMPUJBV-MRVPVSSYSA-N 1 0 337.729 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)C2)c(C(F)(F)F)c1 ZINC000301226290 1123380315 /nfs/dbraw/zinc/38/03/15/1123380315.db2.gz BVHILHXZIAKTMI-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO CC(C)(C)OCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000609598568 1123625362 /nfs/dbraw/zinc/62/53/62/1123625362.db2.gz AENLPZNQQOTQFD-UHFFFAOYSA-N 1 0 335.429 3.623 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000609631910 1123635110 /nfs/dbraw/zinc/63/51/10/1123635110.db2.gz MUMZMQFNIXYZOR-CQSZACIVSA-N 1 0 334.416 3.719 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000609705171 1123647959 /nfs/dbraw/zinc/64/79/59/1123647959.db2.gz ZJRIKGSRNXOGEV-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCS[C@@H](c3ccccc3)C2)cc1 ZINC000609800456 1123664446 /nfs/dbraw/zinc/66/44/46/1123664446.db2.gz IAUKTFPEVYRCJR-GOSISDBHSA-N 1 0 344.436 3.764 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000609916176 1123691944 /nfs/dbraw/zinc/69/19/44/1123691944.db2.gz DAXPKVNPBPKQIV-MRXNPFEDSA-N 1 0 344.386 3.807 20 5 EHBDRO C[C@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@@H+]1C1CC1 ZINC000301820951 1129144172 /nfs/dbraw/zinc/14/41/72/1129144172.db2.gz JRTZWJMBDCHHID-ONGXEEELSA-N 1 0 329.322 3.651 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnn(C)c2C(F)(F)F)cc1[N+](=O)[O-] ZINC000181842302 1125058250 /nfs/dbraw/zinc/05/82/50/1125058250.db2.gz FIKMGIJLALGOEA-SNVBAGLBSA-N 1 0 342.321 3.506 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569438 1125363679 /nfs/dbraw/zinc/36/36/79/1125363679.db2.gz CKBYRUPCGACMKL-OAOYMFHYSA-N 1 0 332.444 3.746 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(c2nccs2)CC1 ZINC000619611767 1125369875 /nfs/dbraw/zinc/36/98/75/1125369875.db2.gz AZVAHYRBHJVSEA-CYBMUJFWSA-N 1 0 346.456 3.679 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccsc1 ZINC000619754103 1125395438 /nfs/dbraw/zinc/39/54/38/1125395438.db2.gz CHUQBCSSMZUQEO-NWDGAFQWSA-N 1 0 333.413 3.724 20 5 EHBDRO CC[C@@H](C)[C@H](C)[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000183074192 1125432459 /nfs/dbraw/zinc/43/24/59/1125432459.db2.gz PQJTYNUMOXYZAB-MNOVXSKESA-N 1 0 346.374 3.772 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000114729157 1129187393 /nfs/dbraw/zinc/18/73/93/1129187393.db2.gz UOPMUACJAMYWAQ-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255958937 1129237833 /nfs/dbraw/zinc/23/78/33/1129237833.db2.gz JNCDXEFWSBVTQP-CXAGYDPISA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(-c2ccccc2)n1)[N@H+](C)C1CC1 ZINC000301883779 1129259212 /nfs/dbraw/zinc/25/92/12/1129259212.db2.gz YGTOFLGYYAISGN-CYBMUJFWSA-N 1 0 326.400 3.551 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000079724071 1129289696 /nfs/dbraw/zinc/28/96/96/1129289696.db2.gz KXGBNCQBUTUPKU-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000131027492 1129376219 /nfs/dbraw/zinc/37/62/19/1129376219.db2.gz YSYQPZBNUGZPQI-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C)C2)cc1[N+](=O)[O-] ZINC000092043387 1129531357 /nfs/dbraw/zinc/53/13/57/1129531357.db2.gz SWPGCFRYHJZMBF-SJLPKXTDSA-N 1 0 331.460 3.634 20 5 EHBDRO C[C@H](O)CC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000093481053 1129590580 /nfs/dbraw/zinc/59/05/80/1129590580.db2.gz ZDFLICLIUBYECU-NSHDSACASA-N 1 0 338.791 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1 ZINC000922694031 1129625807 /nfs/dbraw/zinc/62/58/07/1129625807.db2.gz IZUJNGHRKJBAFU-VLLIJTNSSA-N 1 0 344.333 3.698 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H](C(=O)NC(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000124831563 1129637315 /nfs/dbraw/zinc/63/73/15/1129637315.db2.gz OMVNQVAIQKBOSP-JZXOWHBKSA-N 1 0 347.459 3.719 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCOC1CCCC1)C1CC1 ZINC000125232148 1129672121 /nfs/dbraw/zinc/67/21/21/1129672121.db2.gz PTGKEDSMRNYDGU-SFHVURJKSA-N 1 0 332.444 3.855 20 5 EHBDRO Cc1ccccc1C(C)(C)[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000555611994 1129715427 /nfs/dbraw/zinc/71/54/27/1129715427.db2.gz PANXSOGQZWQNFE-UHFFFAOYSA-N 1 0 341.411 3.675 20 5 EHBDRO COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])cc2)[NH+]2CCCC2)cc1 ZINC000022342867 1129754921 /nfs/dbraw/zinc/75/49/21/1129754921.db2.gz GMHFVJTVRKLQAD-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1cc(N[C@@H]2c3ccccc3C[C@H]2O)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302140664 1129770103 /nfs/dbraw/zinc/77/01/03/1129770103.db2.gz FGXSZLZJZSLTOV-RTBURBONSA-N 1 0 335.363 3.522 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(Cc3c(F)cccc3[N+](=O)[O-])C2)CC1 ZINC000509125797 1129788307 /nfs/dbraw/zinc/78/83/07/1129788307.db2.gz LQFWQFZIPYHSPX-MRXNPFEDSA-N 1 0 349.450 3.678 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1 ZINC000056197311 1129805806 /nfs/dbraw/zinc/80/58/06/1129805806.db2.gz HPESGXKJIMDFPN-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000132246396 1129885872 /nfs/dbraw/zinc/88/58/72/1129885872.db2.gz OVQKRFRSVILQDJ-IBGZPJMESA-N 1 0 340.423 3.757 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccs1 ZINC000132368223 1129894901 /nfs/dbraw/zinc/89/49/01/1129894901.db2.gz FYAPEYMHNQGOBL-UHFFFAOYSA-N 1 0 333.413 3.507 20 5 EHBDRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000305148326 1129912845 /nfs/dbraw/zinc/91/28/45/1129912845.db2.gz OACHXSSPPBXHFS-MPGHIAIKSA-N 1 0 328.412 3.800 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]1C ZINC000163022244 1129916204 /nfs/dbraw/zinc/91/62/04/1129916204.db2.gz DSWMIKYBYNOFEG-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO CCOc1ccc(OCC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000429241366 1130205631 /nfs/dbraw/zinc/20/56/31/1130205631.db2.gz ZQUCLCWPRPWERU-UHFFFAOYSA-N 1 0 344.411 3.897 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518112 1130228248 /nfs/dbraw/zinc/22/82/48/1130228248.db2.gz HJXJVCGQFUZNQS-ZIAGYGMSSA-N 1 0 334.416 3.628 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH2+][C@@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000174146372 1130337455 /nfs/dbraw/zinc/33/74/55/1130337455.db2.gz BVEBATMNHSYBEI-UONOGXRCSA-N 1 0 333.432 3.789 20 5 EHBDRO O=c1ccc2c([nH]1)CCC[C@H]2[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000731451199 1130797905 /nfs/dbraw/zinc/79/79/05/1130797905.db2.gz BYQUYSJFKLJCLP-CQSZACIVSA-N 1 0 333.775 3.516 20 5 EHBDRO CC[C@@H]1CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000738253927 1131464992 /nfs/dbraw/zinc/46/49/92/1131464992.db2.gz JGKOCTGGKYHMCV-OAHLLOKOSA-N 1 0 328.416 3.928 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000740881335 1131552719 /nfs/dbraw/zinc/55/27/19/1131552719.db2.gz AJXPUBJYJHEEDN-GXTWGEPZSA-N 1 0 325.840 3.553 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742152848 1131693720 /nfs/dbraw/zinc/69/37/20/1131693720.db2.gz KGKYNIYGTJBVMI-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO C[C@H]1CCN(c2ccc([N+](=O)[O-])cc2)CC[N@@H+]1Cc1ccccc1 ZINC000742430425 1131729674 /nfs/dbraw/zinc/72/96/74/1131729674.db2.gz QNNYZRNDWAFIOH-INIZCTEOSA-N 1 0 325.412 3.696 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H](O)c1c(F)cccc1F ZINC000742715069 1131784967 /nfs/dbraw/zinc/78/49/67/1131784967.db2.gz RAYZFNPIKSSNKM-WFASDCNBSA-N 1 0 342.367 3.536 20 5 EHBDRO C[NH2+]Cc1ccc(N[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172909125 1131881576 /nfs/dbraw/zinc/88/15/76/1131881576.db2.gz GKJAXNICKBIIQZ-GOSISDBHSA-N 1 0 325.412 3.674 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOCc1ccccc1)CC2 ZINC001172900472 1131883355 /nfs/dbraw/zinc/88/33/55/1131883355.db2.gz UDBDGHCRRRUAFG-LJQANCHMSA-N 1 0 340.423 3.649 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172901172 1131883966 /nfs/dbraw/zinc/88/39/66/1131883966.db2.gz KIZOVSIVXMSBFK-SJLPKXTDSA-N 1 0 325.412 3.978 20 5 EHBDRO [NH2+]=C(N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cc(F)cc(F)c1 ZINC001172900657 1131884069 /nfs/dbraw/zinc/88/40/69/1131884069.db2.gz XQHLOINGTJXYPD-INIZCTEOSA-N 1 0 345.349 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCC(F)(F)[C@H](F)C1)CC2 ZINC001172902664 1131884714 /nfs/dbraw/zinc/88/47/14/1131884714.db2.gz BNIHHPWTUTVLRW-DZGCQCFKSA-N 1 0 328.334 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC[C@H](O)c1ccccc1)CC2 ZINC001172901876 1131885649 /nfs/dbraw/zinc/88/56/49/1131885649.db2.gz QOLPDNAGAJYPET-ICSRJNTNSA-N 1 0 340.423 3.556 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c(F)c1 ZINC001172903595 1131886382 /nfs/dbraw/zinc/88/63/82/1131886382.db2.gz RUCYVZIUMBJMLT-INIZCTEOSA-N 1 0 344.386 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(CC3CC3)CCOCC1)CC2 ZINC001172906531 1131887478 /nfs/dbraw/zinc/88/74/78/1131887478.db2.gz XVVMSOUUNHVKGH-GOSISDBHSA-N 1 0 344.455 3.781 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)ccn1 ZINC001172905777 1131887698 /nfs/dbraw/zinc/88/76/98/1131887698.db2.gz KQMJHXYKYVKUFQ-SUMWQHHRSA-N 1 0 341.411 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@@H]3CC3(Cl)Cl)CC2)cc1 ZINC000743862453 1131989388 /nfs/dbraw/zinc/98/93/88/1131989388.db2.gz DEMKCYQEUKGLHB-NSHDSACASA-N 1 0 345.226 3.632 20 5 EHBDRO COC(=O)c1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173216537 1132001663 /nfs/dbraw/zinc/00/16/63/1132001663.db2.gz CPKYOPAXZRMSSS-UONOGXRCSA-N 1 0 342.395 3.663 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2ccc(F)cc21 ZINC001173217818 1132001743 /nfs/dbraw/zinc/00/17/43/1132001743.db2.gz MNVCXSVIUAKQTJ-ZDUSSCGKSA-N 1 0 341.386 3.994 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173215794 1132001768 /nfs/dbraw/zinc/00/17/68/1132001768.db2.gz ZUSGWNKVKYRVIJ-LSDHHAIUSA-N 1 0 344.411 3.592 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173218471 1132003419 /nfs/dbraw/zinc/00/34/19/1132003419.db2.gz KAGLIASRGBKWOG-RDTXWAMCSA-N 1 0 340.423 3.682 20 5 EHBDRO COCCc1cccc(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173218421 1132003603 /nfs/dbraw/zinc/00/36/03/1132003603.db2.gz JRZLTYDYRYSMIU-HNNXBMFYSA-N 1 0 328.412 3.505 20 5 EHBDRO Cc1cccc(C2(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC001173226928 1132007172 /nfs/dbraw/zinc/00/71/72/1132007172.db2.gz DQELTBJTLGMMFS-HNNXBMFYSA-N 1 0 325.412 3.551 20 5 EHBDRO Cc1ccccc1N1CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173230378 1132007994 /nfs/dbraw/zinc/00/79/94/1132007994.db2.gz XTSDBGREKOJVSV-QGZVFWFLSA-N 1 0 339.439 3.656 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001173228224 1132008274 /nfs/dbraw/zinc/00/82/74/1132008274.db2.gz UQFRABYZHQUGCF-HOCLYGCPSA-N 1 0 348.443 3.580 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233502 1132010292 /nfs/dbraw/zinc/01/02/92/1132010292.db2.gz JJTNOVRPHXUVGK-ACJLOTCBSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccccc1CC[N@H+](C)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173232824 1132010593 /nfs/dbraw/zinc/01/05/93/1132010593.db2.gz IEGDTODFCYJTRE-HNNXBMFYSA-N 1 0 328.412 3.709 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(OC(F)F)c1 ZINC001173211541 1132013829 /nfs/dbraw/zinc/01/38/29/1132013829.db2.gz SNBHOUDNIQQILN-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO COc1ccc(Cl)cc1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173212563 1132013923 /nfs/dbraw/zinc/01/39/23/1132013923.db2.gz AXFDKOYZYNMILE-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cnccc1C ZINC001174118356 1132233392 /nfs/dbraw/zinc/23/33/92/1132233392.db2.gz ZNIPJDGIFBGPSB-UHFFFAOYSA-N 1 0 344.418 3.947 20 5 EHBDRO COc1cccc(C2([NH2+]CCOc3cccc([N+](=O)[O-])c3)CCC2)c1 ZINC001174828467 1132473657 /nfs/dbraw/zinc/47/36/57/1132473657.db2.gz ZVXVUKYLSMBXLZ-UHFFFAOYSA-N 1 0 342.395 3.651 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1 ZINC001168972684 1132623888 /nfs/dbraw/zinc/62/38/88/1132623888.db2.gz ASNOPXWTWRJFRY-RISCZKNCSA-N 1 0 331.243 3.961 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2cccnc2C(F)(F)F)C2CC2)C1 ZINC001169009760 1132631414 /nfs/dbraw/zinc/63/14/14/1132631414.db2.gz XYEDGPZWIFABBB-QKCSRTOESA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(Cc3ccc(F)cc3F)CC2)C1 ZINC001169039094 1132638190 /nfs/dbraw/zinc/63/81/90/1132638190.db2.gz NBJRDLMOCQYCNO-PBHICJAKSA-N 1 0 338.398 3.665 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040151 1132638610 /nfs/dbraw/zinc/63/86/10/1132638610.db2.gz YHTQTDVZJKYHRM-KMFMINBZSA-N 1 0 338.835 3.629 20 5 EHBDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169055410 1132644405 /nfs/dbraw/zinc/64/44/05/1132644405.db2.gz PXDFNMORLFYEOR-YWPYICTPSA-N 1 0 341.249 3.887 20 5 EHBDRO CC1(C)C[C@@H](Nc2ncnc3sc([N+](=O)[O-])cc32)C[C@](C)(C[NH3+])C1 ZINC001169142959 1132674066 /nfs/dbraw/zinc/67/40/66/1132674066.db2.gz IPECSGCNNZCWPC-HWPZZCPQSA-N 1 0 349.460 3.555 20 5 EHBDRO Cc1cc(N2CC[NH+](C)CC2)ccc1Nc1cc([N+](=O)[O-])ccc1F ZINC001175737109 1132749085 /nfs/dbraw/zinc/74/90/85/1132749085.db2.gz ULOXZIOSNYUSCL-UHFFFAOYSA-N 1 0 344.390 3.538 20 5 EHBDRO C[C@H]1CC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539512 1132780913 /nfs/dbraw/zinc/78/09/13/1132780913.db2.gz OLJXNAQUIOADKG-MAUKXSAKSA-N 1 0 332.444 3.921 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C(=O)Nc1ccc(F)cc1F ZINC001176037133 1132826834 /nfs/dbraw/zinc/82/68/34/1132826834.db2.gz RFYBHTHBJAUJLH-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1CNCc1ccc(F)cc1 ZINC001177093890 1133031360 /nfs/dbraw/zinc/03/13/60/1133031360.db2.gz VEDUDOXWNTZSRY-UHFFFAOYSA-N 1 0 339.164 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC=C(c3ccc(Cl)nc3)CC2)cc1 ZINC000773665538 1133062246 /nfs/dbraw/zinc/06/22/46/1133062246.db2.gz MAPQQNADQWLJKR-UHFFFAOYSA-N 1 0 329.787 3.933 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)(C)c2ccccc2OC)cc1[N+](=O)[O-] ZINC001177566360 1133081512 /nfs/dbraw/zinc/08/15/12/1133081512.db2.gz UCYYLUPRGXGIHI-UHFFFAOYSA-N 1 0 344.411 3.679 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)c1ccccc1 ZINC000768087351 1133090286 /nfs/dbraw/zinc/09/02/86/1133090286.db2.gz PNEFPZULJLEIFB-NVXWUHKLSA-N 1 0 346.452 3.789 20 5 EHBDRO OCCC[N@H+](CCO)Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000769387796 1133274173 /nfs/dbraw/zinc/27/41/73/1133274173.db2.gz BJIHZCBNAUOWKI-UHFFFAOYSA-N 1 0 343.854 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CCC4(CC4)CC3)CC2)cc1 ZINC000774381358 1133667722 /nfs/dbraw/zinc/66/77/22/1133667722.db2.gz MLLQDOKSEAUWCE-UHFFFAOYSA-N 1 0 329.444 3.876 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000774411523 1133673412 /nfs/dbraw/zinc/67/34/12/1133673412.db2.gz PYCAKLJFAKDCLH-MOPGFXCFSA-N 1 0 326.396 3.678 20 5 EHBDRO Cc1ccc([C@@H]2C[C@@H](C)[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126345 1133810604 /nfs/dbraw/zinc/81/06/04/1133810604.db2.gz PLEBESVGBBUXCQ-ZTNFWEORSA-N 1 0 340.423 3.815 20 5 EHBDRO Cc1ccc([C@@H]2C[C@H](C)[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126795 1133810989 /nfs/dbraw/zinc/81/09/89/1133810989.db2.gz UHWRNXWMLPYYCO-QKYXUNIQSA-N 1 0 340.423 3.815 20 5 EHBDRO Cc1cc(CC[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])cc(C)c1O ZINC000786827814 1133904747 /nfs/dbraw/zinc/90/47/47/1133904747.db2.gz RMHHLANUJSUWTL-UHFFFAOYSA-N 1 0 334.803 3.903 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccccc1Cl ZINC000786810830 1133909666 /nfs/dbraw/zinc/90/96/66/1133909666.db2.gz BFNJSSBJNYOEKH-GWCFYCIZSA-N 1 0 346.814 3.975 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCNC(=O)OC(C)(C)C ZINC000786814358 1133910159 /nfs/dbraw/zinc/91/01/59/1133910159.db2.gz VOXBHHZRGWEQET-SDNWHVSQSA-N 1 0 349.431 3.503 20 5 EHBDRO CC(C)C[C@H](CNc1c([N+](=O)[O-])cnn1C)[NH2+][C@H](C)c1ccccc1 ZINC001185338503 1134074527 /nfs/dbraw/zinc/07/45/27/1134074527.db2.gz LCONPRYTIGJKIE-GDBMZVCRSA-N 1 0 345.447 3.506 20 5 EHBDRO C[C@@H]([NH2+]CCCc1c[nH]c2ccccc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788594462 1134148649 /nfs/dbraw/zinc/14/86/49/1134148649.db2.gz MULLPGJXRVEBKJ-CYBMUJFWSA-N 1 0 338.411 3.942 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2cccc(F)c2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788600989 1134149591 /nfs/dbraw/zinc/14/95/91/1134149591.db2.gz GULFYXSYRDFLAG-GFCCVEGCSA-N 1 0 329.375 3.699 20 5 EHBDRO COc1cc2c(cc1F)CC[C@@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788815717 1134176670 /nfs/dbraw/zinc/17/66/70/1134176670.db2.gz DPAYQIPTXJRSAC-HWPZZCPQSA-N 1 0 345.374 3.663 20 5 EHBDRO CC[NH+]1CCN(c2cccc(Nc3c(F)cccc3[N+](=O)[O-])c2)CC1 ZINC001186195932 1134180622 /nfs/dbraw/zinc/18/06/22/1134180622.db2.gz UPYWSBBWOCXRNE-UHFFFAOYSA-N 1 0 344.390 3.619 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCCC1 ZINC000789389573 1134260923 /nfs/dbraw/zinc/26/09/23/1134260923.db2.gz VCOOSIADBIKXCQ-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO Cc1cc(N2CC[C@H]([N@H+](C)CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC001186963688 1134277964 /nfs/dbraw/zinc/27/79/64/1134277964.db2.gz DQYVNQJKYWONNP-IBGZPJMESA-N 1 0 339.439 3.656 20 5 EHBDRO C[NH+](C)[C@H]1C[C@H](Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])C12CCC2 ZINC001187025879 1134284154 /nfs/dbraw/zinc/28/41/54/1134284154.db2.gz UFUHEDJEEXWDJU-STQMWFEESA-N 1 0 343.349 3.898 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC001187371222 1134327551 /nfs/dbraw/zinc/32/75/51/1134327551.db2.gz IEDJKSPEUJDFSM-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO Cn1nccc1[C@@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000790494801 1134426222 /nfs/dbraw/zinc/42/62/22/1134426222.db2.gz HJECLEMEGDFZPL-TZMCWYRMSA-N 1 0 348.834 3.798 20 5 EHBDRO CCOC(=O)NC1CCC([NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)CC1 ZINC000790747733 1134461470 /nfs/dbraw/zinc/46/14/70/1134461470.db2.gz QJJMJIDQWNEXOU-DQPZFDDXSA-N 1 0 349.431 3.693 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170294586 1134736730 /nfs/dbraw/zinc/73/67/30/1134736730.db2.gz BNCQYDXVDORTMH-NSHDSACASA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCc2ccc(C)s2)c([N+](=O)[O-])c1 ZINC001170297573 1134737584 /nfs/dbraw/zinc/73/75/84/1134737584.db2.gz PZNYLKJNYGMSHY-GFCCVEGCSA-N 1 0 334.441 3.737 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297543 1134737678 /nfs/dbraw/zinc/73/76/78/1134737678.db2.gz PAYOJINMWRFRQQ-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297890 1134738424 /nfs/dbraw/zinc/73/84/24/1134738424.db2.gz VEELMRHKECXYDN-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCc3ncccc32)c([N+](=O)[O-])c1 ZINC001170304669 1134738753 /nfs/dbraw/zinc/73/87/53/1134738753.db2.gz DSXIZLGAOUYCMH-UGSOOPFHSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CC2CCC(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170306699 1134752043 /nfs/dbraw/zinc/75/20/43/1134752043.db2.gz AFOGWRGOGNFNRJ-GFCCVEGCSA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC[C@H]2c2ccccn2)c([N+](=O)[O-])c1 ZINC001170346411 1134759503 /nfs/dbraw/zinc/75/95/03/1134759503.db2.gz NMMLDMXVCYYKEB-KDOFPFPSSA-N 1 0 341.411 3.767 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CCC(C(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170351666 1134760817 /nfs/dbraw/zinc/76/08/17/1134760817.db2.gz HAZSDBYGYQNYIT-NSHDSACASA-N 1 0 328.359 3.512 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CCC[C@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001192199960 1134979310 /nfs/dbraw/zinc/97/93/10/1134979310.db2.gz PXVCSAZDSWHBLK-JKSUJKDBSA-N 1 0 347.459 3.988 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H](c2ccc(F)cc2)CC1 ZINC001192514934 1135025512 /nfs/dbraw/zinc/02/55/12/1135025512.db2.gz JTOYFZANLUKDTF-OAHLLOKOSA-N 1 0 346.406 3.509 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2nc3c(cc2[N+](=O)[O-])CCCC3)CC1(C)C ZINC001170450897 1135069304 /nfs/dbraw/zinc/06/93/04/1135069304.db2.gz NBTPSZWLXYZJFR-UHFFFAOYSA-N 1 0 346.475 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000804564497 1135121682 /nfs/dbraw/zinc/12/16/82/1135121682.db2.gz WWXZAOGNVYCPLP-WFASDCNBSA-N 1 0 335.835 3.701 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C1(CC)CC ZINC001193663288 1135168856 /nfs/dbraw/zinc/16/88/56/1135168856.db2.gz RMMREZWMSDCPOK-IRXDYDNUSA-N 1 0 336.432 3.547 20 5 EHBDRO COCC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@@H](C)C1 ZINC001193974789 1135208306 /nfs/dbraw/zinc/20/83/06/1135208306.db2.gz CKHAOLVFLRTEFN-IUODEOHRSA-N 1 0 326.824 3.885 20 5 EHBDRO CCC1(CC)[C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1OC ZINC001194090212 1135231000 /nfs/dbraw/zinc/23/10/00/1135231000.db2.gz DWAGFCSWPOEFHT-GJZGRUSLSA-N 1 0 326.824 3.932 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@]2(C)Cc2cccc(Cl)c2)c([N+](=O)[O-])n1 ZINC001195758876 1135461216 /nfs/dbraw/zinc/46/12/16/1135461216.db2.gz WWDQJCRDEOLTOE-QGZVFWFLSA-N 1 0 348.834 3.579 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@@H](c1cccs1)[NH+](C)C ZINC000807916365 1135588624 /nfs/dbraw/zinc/58/86/24/1135588624.db2.gz SAPLZVUDEXTIPQ-HNNXBMFYSA-N 1 0 333.413 3.574 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)cc1 ZINC001198563989 1135831099 /nfs/dbraw/zinc/83/10/99/1135831099.db2.gz VBIRAVMITANSFI-DLBZAZTESA-N 1 0 348.443 3.502 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@H]3CCCC[C@H]3C2)c([N+](=O)[O-])cc1O ZINC001199053508 1135876471 /nfs/dbraw/zinc/87/64/71/1135876471.db2.gz ZZWVRQRXCPJPNJ-VNHYZAJKSA-N 1 0 334.416 3.758 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843917 1135931859 /nfs/dbraw/zinc/93/18/59/1135931859.db2.gz SJBVADALIZUJQA-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C2 ZINC000810178225 1135934602 /nfs/dbraw/zinc/93/46/02/1135934602.db2.gz LTEJPMXLVLYWDG-HNNXBMFYSA-N 1 0 332.787 3.650 20 5 EHBDRO C[C@@H](CCO)C1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000776257306 1136113731 /nfs/dbraw/zinc/11/37/31/1136113731.db2.gz KSRAXUFBAHQIRR-LBPRGKRZSA-N 1 0 326.824 3.527 20 5 EHBDRO CC(C)[N@@H+](Cc1cccc(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277990 1136126053 /nfs/dbraw/zinc/12/60/53/1136126053.db2.gz RZBKEVLKAMIXNQ-SFHVURJKSA-N 1 0 332.375 3.678 20 5 EHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277952 1136131087 /nfs/dbraw/zinc/13/10/87/1136131087.db2.gz RCXCWRVQXBIEEE-RBUKOAKNSA-N 1 0 326.396 3.774 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H]2CCc2ccccc2)cc1 ZINC000776279054 1136133862 /nfs/dbraw/zinc/13/38/62/1136133862.db2.gz WYKOBLSYIXTKMK-ICSRJNTNSA-N 1 0 340.423 3.725 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2C[C@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850371579 1136243615 /nfs/dbraw/zinc/24/36/15/1136243615.db2.gz KWOOMYAXINGONG-HKUYNNGSSA-N 1 0 326.396 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000850408733 1136252102 /nfs/dbraw/zinc/25/21/02/1136252102.db2.gz DKDUECWWROSBLJ-USXIJHARSA-N 1 0 332.762 3.815 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000850472520 1136265784 /nfs/dbraw/zinc/26/57/84/1136265784.db2.gz JCLSFXVHPCWKSN-RNCFNFMXSA-N 1 0 333.215 3.838 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850525554 1136278050 /nfs/dbraw/zinc/27/80/50/1136278050.db2.gz OMWHNYKOJJDJSC-KGLIPLIRSA-N 1 0 336.457 3.767 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000216719486 1136378270 /nfs/dbraw/zinc/37/82/70/1136378270.db2.gz XKOPXSPGDSVWOT-ZDUSSCGKSA-N 1 0 328.368 3.907 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1(CO)CCC1 ZINC000814170734 1136415040 /nfs/dbraw/zinc/41/50/40/1136415040.db2.gz CRLXGIMEMSCOGY-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000814299021 1136437500 /nfs/dbraw/zinc/43/75/00/1136437500.db2.gz BNXUUDURFRDSOB-IVZVJUQRSA-N 1 0 332.787 3.585 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccc(F)cc2)CC2CC2)cc1 ZINC000776585584 1136448305 /nfs/dbraw/zinc/44/83/05/1136448305.db2.gz XGDVTUKERJCZNV-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H](c2ccccc2)C2CCC2)cc1 ZINC000776591786 1136453070 /nfs/dbraw/zinc/45/30/70/1136453070.db2.gz HDXLLIQWLBYVTD-RBUKOAKNSA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@H]2c2ccc(Cl)cc2)cc1 ZINC000776593023 1136453710 /nfs/dbraw/zinc/45/37/10/1136453710.db2.gz TUKXPSXDBHFJJB-IRXDYDNUSA-N 1 0 332.787 3.729 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)cc1 ZINC000852427126 1136455273 /nfs/dbraw/zinc/45/52/73/1136455273.db2.gz STCNJWMFCBFGOL-SJLPKXTDSA-N 1 0 342.395 3.839 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC[C@H](C2CC[NH2+]CC2)C1 ZINC000853016140 1136498490 /nfs/dbraw/zinc/49/84/90/1136498490.db2.gz PKFDNZAROHOFGD-AWEZNQCLSA-N 1 0 339.386 3.748 20 5 EHBDRO C[C@H]([NH2+]CCOc1cccc(Cl)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815568039 1136611615 /nfs/dbraw/zinc/61/16/15/1136611615.db2.gz SUTLBLULXWHDEV-NSHDSACASA-N 1 0 335.791 3.560 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000815584964 1136614725 /nfs/dbraw/zinc/61/47/25/1136614725.db2.gz UANRRLXVYMJSSA-MNOVXSKESA-N 1 0 335.354 3.910 20 5 EHBDRO Cc1nc2c(s1)[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614990 1136618974 /nfs/dbraw/zinc/61/89/74/1136618974.db2.gz FZLIGKXWBWCEJI-NOZJJQNGSA-N 1 0 332.429 3.670 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000776816423 1136707193 /nfs/dbraw/zinc/70/71/93/1136707193.db2.gz RRZVSGOMBMMOPG-ZBEGNZNMSA-N 1 0 343.408 3.589 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@H]1CC1(Cl)Cl ZINC000857080576 1136842535 /nfs/dbraw/zinc/84/25/35/1136842535.db2.gz IHIZPOOUYKEXPR-ZJUUUORDSA-N 1 0 333.215 3.838 20 5 EHBDRO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819013550 1136902942 /nfs/dbraw/zinc/90/29/42/1136902942.db2.gz WEMVDLBGFPPGNJ-PKOBYXMFSA-N 1 0 328.412 3.629 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000819177129 1136919816 /nfs/dbraw/zinc/91/98/16/1136919816.db2.gz APHVAWIGOBKMGI-ROUUACIJSA-N 1 0 326.396 3.640 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@H](c3ccc(F)cc3)C2)c1 ZINC000819274214 1136930602 /nfs/dbraw/zinc/93/06/02/1136930602.db2.gz FSGBDJAFJODHSH-POZUXBRTSA-N 1 0 344.386 3.693 20 5 EHBDRO Cc1ccc(C2(C[NH2+]C[C@@H](O)c3cccc([N+](=O)[O-])c3)CC2)c(C)c1 ZINC000819339054 1136932594 /nfs/dbraw/zinc/93/25/94/1136932594.db2.gz KIHNDWWKCBGCDI-LJQANCHMSA-N 1 0 340.423 3.566 20 5 EHBDRO CC[C@@H](CCc1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000858363327 1136961844 /nfs/dbraw/zinc/96/18/44/1136961844.db2.gz SOENBGMELSHLOS-PKOBYXMFSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@H](C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000780764767 1137017375 /nfs/dbraw/zinc/01/73/75/1137017375.db2.gz QLBRYPXKDTYYPJ-CZUORRHYSA-N 1 0 330.432 3.690 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccccc1CC[NH+](C)C ZINC000822301016 1137056091 /nfs/dbraw/zinc/05/60/91/1137056091.db2.gz JLUPAWRWHSMTME-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO CC[C@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000824661328 1137147215 /nfs/dbraw/zinc/14/72/15/1137147215.db2.gz VTKZQMWBGXLCCE-WKTRQSJXSA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000824953803 1137159122 /nfs/dbraw/zinc/15/91/22/1137159122.db2.gz LSXITLZXNIKTQD-WBVHZDCISA-N 1 0 347.802 3.653 20 5 EHBDRO Cc1c([N+](=O)[O-])cc(F)cc1-n1c2ccccc2c2c1C[C@H]([NH3+])CC2 ZINC001171096437 1137189684 /nfs/dbraw/zinc/18/96/84/1137189684.db2.gz WHEVSOOJBFBAOD-CYBMUJFWSA-N 1 0 339.370 3.802 20 5 EHBDRO C[C@@H]([NH2+]CCCN(C)C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000120286177 1137252876 /nfs/dbraw/zinc/25/28/76/1137252876.db2.gz LRFGZLUKZBKPRX-CYBMUJFWSA-N 1 0 337.420 3.502 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3nc(Cl)ccc3[N+](=O)[O-])c2c1 ZINC001171168154 1137278638 /nfs/dbraw/zinc/27/86/38/1137278638.db2.gz KJVWOKRGMLLQOM-LLVKDONJSA-N 1 0 344.802 3.785 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCc2c1cccc2O ZINC000866260869 1137340352 /nfs/dbraw/zinc/34/03/52/1137340352.db2.gz OBXAZRBNPQTUBR-BZNIZROVSA-N 1 0 330.359 3.648 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H](C)C[C@@H](O)c1ccccc1 ZINC000866288085 1137342959 /nfs/dbraw/zinc/34/29/59/1137342959.db2.gz UCKIRUNZBFNGSQ-PJIJBLCYSA-N 1 0 346.402 3.767 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1COCc2ccccc21 ZINC000866377093 1137350315 /nfs/dbraw/zinc/35/03/15/1137350315.db2.gz SEAVQSCHZHYFFR-SJCJKPOMSA-N 1 0 330.359 3.526 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000866389980 1137351086 /nfs/dbraw/zinc/35/10/86/1137351086.db2.gz JWYHTPMCZFBKIY-GTNSWQLSSA-N 1 0 330.359 3.648 20 5 EHBDRO COCCOc1ccc([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000866538543 1137362817 /nfs/dbraw/zinc/36/28/17/1137362817.db2.gz BYSCENTUAWEWIH-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H]1C1CCOCC1 ZINC000866538812 1137362843 /nfs/dbraw/zinc/36/28/43/1137362843.db2.gz WABIINUIDFLFJC-WBAXXEDZSA-N 1 0 332.444 3.568 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cc2c([nH]c1=O)CCCC2 ZINC000866641388 1137372080 /nfs/dbraw/zinc/37/20/80/1137372080.db2.gz SWNJOJLLTBUPBO-ZDUSSCGKSA-N 1 0 341.411 3.733 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cc3c([nH]c2=O)CCCC3)cc1[N+](=O)[O-] ZINC000866640796 1137372122 /nfs/dbraw/zinc/37/21/22/1137372122.db2.gz MQZTVLOZSPPGGV-CYBMUJFWSA-N 1 0 341.411 3.733 20 5 EHBDRO CC(C)CSCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000773105935 1137465688 /nfs/dbraw/zinc/46/56/88/1137465688.db2.gz JAQLCEVEUCNHJY-UHFFFAOYSA-N 1 0 337.489 3.542 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@](C)(O)c1ccc(F)cc1 ZINC000773120155 1137466732 /nfs/dbraw/zinc/46/67/32/1137466732.db2.gz RBNLHBDNJBBYQM-UGSOOPFHSA-N 1 0 332.375 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3CCC(F)(F)CC3)CC2)cc1 ZINC000773121481 1137466740 /nfs/dbraw/zinc/46/67/40/1137466740.db2.gz ZNHDQUJPHSZSGE-UHFFFAOYSA-N 1 0 339.386 3.731 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1csc(C)n1 ZINC000872020010 1137565040 /nfs/dbraw/zinc/56/50/40/1137565040.db2.gz BXHCORWZPWCFFY-JTQLQIEISA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](O)c1ccc(F)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872033254 1137566686 /nfs/dbraw/zinc/56/66/86/1137566686.db2.gz CAQLAQNRBJFWHW-PSVSLLHZSA-N 1 0 336.338 3.646 20 5 EHBDRO C[C@@H](NC1CC[NH+](C2CCCC2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038886 1137566963 /nfs/dbraw/zinc/56/69/63/1137566963.db2.gz ATSZUPOHPIZXIN-CYBMUJFWSA-N 1 0 335.423 3.792 20 5 EHBDRO C[C@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052594 1137568171 /nfs/dbraw/zinc/56/81/71/1137568171.db2.gz PJFCIJCSPRBKJE-UGSOOPFHSA-N 1 0 344.386 3.898 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000872128317 1137572974 /nfs/dbraw/zinc/57/29/74/1137572974.db2.gz KNPALFQYKYCGHW-LXTVHRRPSA-N 1 0 334.416 3.613 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@@H]([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C[C@@H]1C ZINC000872129535 1137573160 /nfs/dbraw/zinc/57/31/60/1137573160.db2.gz KNPALFQYKYCGHW-GBJTYRQASA-N 1 0 334.416 3.613 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279227 1137577645 /nfs/dbraw/zinc/57/76/45/1137577645.db2.gz CXBDOVCVHGONNY-KRWDZBQOSA-N 1 0 348.443 3.917 20 5 EHBDRO CCC[N@@H+](Cc1ccc(Br)c([N+](=O)[O-])c1)CC1CC1 ZINC000124831768 1137610510 /nfs/dbraw/zinc/61/05/10/1137610510.db2.gz VURWMMAQZPSOAO-UHFFFAOYSA-N 1 0 327.222 3.979 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842445 1137624559 /nfs/dbraw/zinc/62/45/59/1137624559.db2.gz HMSGIULCUUKMML-VQTJNVASSA-N 1 0 345.446 3.697 20 5 EHBDRO CC(C)(C)[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876928189 1137665420 /nfs/dbraw/zinc/66/54/20/1137665420.db2.gz WJPJXEOLKZASLC-VMBOVVBDSA-N 1 0 328.416 3.872 20 5 EHBDRO CC[C@@H](Cc1ccc(Cl)cc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877036498 1137668345 /nfs/dbraw/zinc/66/83/45/1137668345.db2.gz SQGOQJBNQUXHPF-FHERZECASA-N 1 0 348.834 3.759 20 5 EHBDRO CSc1ccccc1[C@@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877497777 1137678723 /nfs/dbraw/zinc/67/87/23/1137678723.db2.gz AVJQXBFBQLACKK-PNESKVBLSA-N 1 0 332.429 3.568 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128344 1137703645 /nfs/dbraw/zinc/70/36/45/1137703645.db2.gz CNZLIJAJKLBCMY-OLZOCXBDSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)[C@H]1C ZINC000878165124 1137705374 /nfs/dbraw/zinc/70/53/74/1137705374.db2.gz RPXACHOXKHZGFK-ZJUUUORDSA-N 1 0 336.779 3.529 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878476032 1137717351 /nfs/dbraw/zinc/71/73/51/1137717351.db2.gz VJXRXJWQEBZFJR-JSGCOSHPSA-N 1 0 330.388 3.655 20 5 EHBDRO CC[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CC1(C)C ZINC000878717754 1137726183 /nfs/dbraw/zinc/72/61/83/1137726183.db2.gz HMOVDFAQZNHOBT-STQMWFEESA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cc1[N+](=O)[O-] ZINC000878904335 1137731639 /nfs/dbraw/zinc/73/16/39/1137731639.db2.gz LJALWGDTVZAHQZ-QGZVFWFLSA-N 1 0 348.406 3.836 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1Cc2cccnc2N2CCC[C@@H]2C1 ZINC000879499529 1137749355 /nfs/dbraw/zinc/74/93/55/1137749355.db2.gz XVTKUSFISZLCQM-GDBMZVCRSA-N 1 0 338.411 3.535 20 5 EHBDRO COc1cc(CN2CCC[C@@H]2c2cncc(C)c2)c([N+](=O)[O-])cc1F ZINC000879750536 1137757874 /nfs/dbraw/zinc/75/78/74/1137757874.db2.gz WNYDAHLOQPRDAK-MRXNPFEDSA-N 1 0 345.374 3.783 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000130625488 1137840094 /nfs/dbraw/zinc/84/00/94/1137840094.db2.gz WVUODFOSEWKOBK-AZUAARDMSA-N 1 0 340.423 3.548 20 5 EHBDRO COc1ccc(C2CC2)cc1C[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000883257790 1137850891 /nfs/dbraw/zinc/85/08/91/1137850891.db2.gz KRBYDPXQPIDFOS-UHFFFAOYSA-N 1 0 342.395 3.779 20 5 EHBDRO CO[C@H]1C[C@H](C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883271093 1137851762 /nfs/dbraw/zinc/85/17/62/1137851762.db2.gz FMTYHWCHZUYXLP-NIKGAXFTSA-N 1 0 326.396 3.699 20 5 EHBDRO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824705 1137922099 /nfs/dbraw/zinc/92/20/99/1137922099.db2.gz QAKPTFDMNZWLRR-GUYCJALGSA-N 1 0 328.416 3.843 20 5 EHBDRO CC[C@@H]1C[C@H](C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCO1 ZINC000332116789 1137932303 /nfs/dbraw/zinc/93/23/03/1137932303.db2.gz KIYKYZDVUBZFPB-NVXWUHKLSA-N 1 0 348.443 3.643 20 5 EHBDRO CC(C)n1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000118861035 1137936115 /nfs/dbraw/zinc/93/61/15/1137936115.db2.gz UBSOWEIZGBFNTQ-GOEBONIOSA-N 1 0 343.431 3.708 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)ccc1Cl ZINC000134892071 1137961489 /nfs/dbraw/zinc/96/14/89/1137961489.db2.gz JOBLPSPGMZNVMU-PBHICJAKSA-N 1 0 349.862 3.697 20 5 EHBDRO CO[C@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886116915 1138048350 /nfs/dbraw/zinc/04/83/50/1138048350.db2.gz VLEWLHJSIRRXRH-ABAIWWIYSA-N 1 0 335.791 3.509 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H](c2ncccn2)C1 ZINC000886685948 1138115144 /nfs/dbraw/zinc/11/51/44/1138115144.db2.gz HGJWUBWRTKQUAU-GJZGRUSLSA-N 1 0 326.400 3.634 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)cc1 ZINC000075863914 1138128934 /nfs/dbraw/zinc/12/89/34/1138128934.db2.gz QTXAKXKAMYCKCZ-SFHVURJKSA-N 1 0 326.396 3.634 20 5 EHBDRO CN(Cc1csc([N+](=O)[O-])c1)C[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000076110089 1138129864 /nfs/dbraw/zinc/12/98/64/1138129864.db2.gz GYVUIPKWNISAAR-MRXNPFEDSA-N 1 0 345.468 3.610 20 5 EHBDRO C[C@@H]([NH2+]C[C@@]1(C)CCOC2(CCC2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000886776999 1138138787 /nfs/dbraw/zinc/13/87/87/1138138787.db2.gz VNSYUSWOIUSDMU-DYVFJYSZSA-N 1 0 333.432 3.567 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000089512646 1138200796 /nfs/dbraw/zinc/20/07/96/1138200796.db2.gz RTQCWPMBPQRZLC-YJBOKZPZSA-N 1 0 326.396 3.852 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2c(cccc2F)n1C)c1ccc([N+](=O)[O-])cc1 ZINC000089674591 1138203216 /nfs/dbraw/zinc/20/32/16/1138203216.db2.gz IDDJSRCPHQNTGS-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO CSC[C@@H]1CCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000089910190 1138207227 /nfs/dbraw/zinc/20/72/27/1138207227.db2.gz GZFNVPIVINWNGS-HNNXBMFYSA-N 1 0 333.413 3.577 20 5 EHBDRO CC[C@@H](CSC)[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000091099425 1138215866 /nfs/dbraw/zinc/21/58/66/1138215866.db2.gz INYPQYYTFFJMNE-AWEZNQCLSA-N 1 0 349.456 3.866 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCc1ccc(Cl)nc1)C1CC1 ZINC000122688753 1138261014 /nfs/dbraw/zinc/26/10/14/1138261014.db2.gz BHOLBHKFHXTDKN-MRXNPFEDSA-N 1 0 345.830 3.797 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C=C[C@H](CO)C3)o2)c(Cl)c1 ZINC000129730000 1138419955 /nfs/dbraw/zinc/41/99/55/1138419955.db2.gz MYHUDKKUNFHDID-NWDGAFQWSA-N 1 0 348.786 3.535 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCCCCn2cccn2)C2CC2)cc1 ZINC000130576425 1138463235 /nfs/dbraw/zinc/46/32/35/1138463235.db2.gz RWIDHVOGKOHREE-UHFFFAOYSA-N 1 0 328.416 3.626 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)O1 ZINC000132497457 1138584961 /nfs/dbraw/zinc/58/49/61/1138584961.db2.gz ISDPDJVGTHOEQL-OAHLLOKOSA-N 1 0 345.399 3.686 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134922576 1138713418 /nfs/dbraw/zinc/71/34/18/1138713418.db2.gz UGWKHLIUPLNLSS-ZSZQSSIHSA-N 1 0 329.444 3.605 20 5 EHBDRO CSC[C@H]1CCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000135450847 1138752228 /nfs/dbraw/zinc/75/22/28/1138752228.db2.gz ZBABXGVGHUVFGC-OAHLLOKOSA-N 1 0 347.440 3.620 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H](Cc1ccccn1)c1cccnc1 ZINC000338168622 1138772766 /nfs/dbraw/zinc/77/27/66/1138772766.db2.gz CHIYGNCVXMNHDW-LJQANCHMSA-N 1 0 348.406 3.501 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000152548665 1139097782 /nfs/dbraw/zinc/09/77/82/1139097782.db2.gz YUAZSTFBXLDNTQ-GFCCVEGCSA-N 1 0 344.367 3.573 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570274 1139098221 /nfs/dbraw/zinc/09/82/21/1139098221.db2.gz DLYYNJPGUGGIDL-XJKSGUPXSA-N 1 0 347.415 3.540 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2nc(C)sc21 ZINC000178730084 1139715060 /nfs/dbraw/zinc/71/50/60/1139715060.db2.gz NVLVOIWKDNJKRF-ZDUSSCGKSA-N 1 0 333.413 3.536 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)N[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181551172 1139915012 /nfs/dbraw/zinc/91/50/12/1139915012.db2.gz NHDBNDFEALAWAJ-KBXCAEBGSA-N 1 0 341.411 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CC[C@@H](O)C2)s1 ZINC000188843259 1140310664 /nfs/dbraw/zinc/31/06/64/1140310664.db2.gz BFANAEYBYIIMHF-QWHCGFSZSA-N 1 0 332.425 3.574 20 5 EHBDRO CCN(CCC[NH+](C)C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000188913418 1140313120 /nfs/dbraw/zinc/31/31/20/1140313120.db2.gz GLPUQEKTBZHWIU-UHFFFAOYSA-N 1 0 335.451 3.802 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCC2CC(OCC)C2)cc1[N+](=O)[O-] ZINC000189257224 1140330083 /nfs/dbraw/zinc/33/00/83/1140330083.db2.gz RZPADQRVMXRSOU-HLIUYOAVSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCS2 ZINC000191528760 1140470080 /nfs/dbraw/zinc/47/00/80/1140470080.db2.gz LSGWOMNKBXTSEK-HNNXBMFYSA-N 1 0 330.409 3.930 20 5 EHBDRO COc1cccc(N2CC[C@@H]([NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000266851048 1140730058 /nfs/dbraw/zinc/73/00/58/1140730058.db2.gz IWGLTNNEVBNLQB-GOEBONIOSA-N 1 0 341.411 3.533 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460857 1140794344 /nfs/dbraw/zinc/79/43/44/1140794344.db2.gz VBFIZNNVCDHYPJ-CHWSQXEVSA-N 1 0 339.395 3.526 20 5 EHBDRO CO[C@H](C)c1nc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000269125241 1141068391 /nfs/dbraw/zinc/06/83/91/1141068391.db2.gz YINIHRZEEZQEFJ-CHWSQXEVSA-N 1 0 349.456 3.870 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000270602492 1141243795 /nfs/dbraw/zinc/24/37/95/1141243795.db2.gz FXZIRXJVUHLMSG-SNUQEOBHSA-N 1 0 332.375 3.897 20 5 EHBDRO COc1ccc([C@H](OC)[C@H](C)[NH2+]Cc2csc([N+](=O)[O-])c2)cc1 ZINC000271485010 1141378617 /nfs/dbraw/zinc/37/86/17/1141378617.db2.gz IQMJEVTXGXXHPD-MEDUHNTESA-N 1 0 336.413 3.531 20 5 EHBDRO CC1(C)OCc2cc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)ccc2O1 ZINC000274352639 1141501607 /nfs/dbraw/zinc/50/16/07/1141501607.db2.gz IJCJHLJQNQNDCD-UHFFFAOYSA-N 1 0 342.395 3.572 20 5 EHBDRO C[C@H]1CC[C@@H]([N@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123759 1141503012 /nfs/dbraw/zinc/50/30/12/1141503012.db2.gz JOZUNRCOLRYLMO-WCQYABFASA-N 1 0 346.349 3.597 20 5 EHBDRO CC(C)C[NH+]1CCN(c2cc3ccc(Cl)nc3cc2[N+](=O)[O-])CC1 ZINC001164663157 719340246 /nfs/dbraw/zinc/34/02/46/719340246.db2.gz VHBOBDDCJSKWOH-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000536667703 1032065618 /nfs/dbraw/zinc/06/56/18/1032065618.db2.gz LUIADKGRZAHMBF-LBPRGKRZSA-N 1 0 336.775 3.729 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)ccc1Cl ZINC000153995825 1014764034 /nfs/dbraw/zinc/76/40/34/1014764034.db2.gz OXECSCTYHBGQMS-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO COCCOc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000154079331 1014968493 /nfs/dbraw/zinc/96/84/93/1014968493.db2.gz LLYHVQFODBKKIK-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000430226726 1015124084 /nfs/dbraw/zinc/12/40/84/1015124084.db2.gz NQMFNJVEKFLXMX-CGTJXYLNSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000579868705 1015576916 /nfs/dbraw/zinc/57/69/16/1015576916.db2.gz HAESZOZHJYCHOQ-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1cccc(OCC[NH+](C)C)c1 ZINC000449049136 1032122221 /nfs/dbraw/zinc/12/22/21/1032122221.db2.gz YHDBZHQTDSUHJS-HNNXBMFYSA-N 1 0 343.427 3.578 20 5 EHBDRO CCC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCOCC1 ZINC000535618799 1015707735 /nfs/dbraw/zinc/70/77/35/1015707735.db2.gz VMSWXNVSTWBQBY-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO CCOC[C@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000233778156 1015771545 /nfs/dbraw/zinc/77/15/45/1015771545.db2.gz DHTSDAMBZSUIDT-ZDUSSCGKSA-N 1 0 345.237 3.508 20 5 EHBDRO C[C@@H](CSCCF)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000595044138 1033662036 /nfs/dbraw/zinc/66/20/36/1033662036.db2.gz LBRBBQFFXDGMSZ-VIFPVBQESA-N 1 0 340.342 3.794 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc(OC(F)F)cc1 ZINC000511072050 1016386823 /nfs/dbraw/zinc/38/68/23/1016386823.db2.gz DDUQXHXCKUNNAQ-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO O=[N+]([O-])c1cccc(Nc2ccc(OCC[NH+]3CCCC3)cc2)c1 ZINC001204457143 1016490154 /nfs/dbraw/zinc/49/01/54/1016490154.db2.gz TTXOXBXWRJAOOE-UHFFFAOYSA-N 1 0 327.384 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]3CCO)s2)cc1 ZINC000189930281 1016779655 /nfs/dbraw/zinc/77/96/55/1016779655.db2.gz TYNAQHVGLPAPHP-CXAGYDPISA-N 1 0 346.452 3.964 20 5 EHBDRO C[N@@H+]1CC[C@@H](NCc2ccccc2[N+](=O)[O-])C[C@H]1c1ccccc1 ZINC000340283536 1016859190 /nfs/dbraw/zinc/85/91/90/1016859190.db2.gz YTWMDWGSDRCURK-MJGOQNOKSA-N 1 0 325.412 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CCC(C(F)(F)F)CC3)nc2c1 ZINC000278808588 1016907135 /nfs/dbraw/zinc/90/71/35/1016907135.db2.gz YJZHRLMBHSWYAZ-UHFFFAOYSA-N 1 0 342.321 3.682 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(F)cn1 ZINC000349207503 1016925079 /nfs/dbraw/zinc/92/50/79/1016925079.db2.gz HUXNSPYEGDJWIM-CYBMUJFWSA-N 1 0 335.404 3.789 20 5 EHBDRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449192679 1032289451 /nfs/dbraw/zinc/28/94/51/1032289451.db2.gz UUQNPOFUQJFAGA-TXPKVOOTSA-N 1 0 342.439 3.670 20 5 EHBDRO CCCN(CC[NH+](CC)CC)C(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000461167605 1032302937 /nfs/dbraw/zinc/30/29/37/1032302937.db2.gz WBIPMIPIQJOUJB-UHFFFAOYSA-N 1 0 347.415 3.535 20 5 EHBDRO CCCCn1cc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])c(C)n1 ZINC000538455943 1032383507 /nfs/dbraw/zinc/38/35/07/1032383507.db2.gz ZNTBQHUAVNJPED-VQHVLOKHSA-N 1 0 328.416 3.703 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](O)[C@H](C2CCCC2)C1 ZINC000459792967 1032477319 /nfs/dbraw/zinc/47/73/19/1032477319.db2.gz KJYBPYFXGWNXQW-ZOCIIQOWSA-N 1 0 332.444 3.837 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000537115610 1032527438 /nfs/dbraw/zinc/52/74/38/1032527438.db2.gz JJLYBMYQDDQGJM-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO COC[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449478655 1032604355 /nfs/dbraw/zinc/60/43/55/1032604355.db2.gz KMSOWZKSNIHJNU-HNNXBMFYSA-N 1 0 334.803 3.768 20 5 EHBDRO CC(C)CC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)(C)C ZINC000537288846 1032616664 /nfs/dbraw/zinc/61/66/64/1032616664.db2.gz AAJWZIJVQBKART-INIZCTEOSA-N 1 0 335.448 3.634 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC(C)(C)C1CCC1)c1cccc([N+](=O)[O-])c1 ZINC000449486757 1032639843 /nfs/dbraw/zinc/63/98/43/1032639843.db2.gz VFIJMKGDIPZMIA-QGZVFWFLSA-N 1 0 342.443 3.834 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449488618 1032647919 /nfs/dbraw/zinc/64/79/19/1032647919.db2.gz JFKKNABNVAFHEA-LPHOPBHVSA-N 1 0 339.439 3.842 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC[C@@H]2CSc3ccccc3O2)cs1 ZINC000592372658 1032673321 /nfs/dbraw/zinc/67/33/21/1032673321.db2.gz IGLQXLFWTSOMDW-GFCCVEGCSA-N 1 0 336.438 3.689 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@]1(CO)C[C@@H]1c1ccccc1 ZINC000289927272 1032675784 /nfs/dbraw/zinc/67/57/84/1032675784.db2.gz SRCUMVJZGINAQJ-AEFFLSMTSA-N 1 0 346.814 3.504 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414656692 1017107762 /nfs/dbraw/zinc/10/77/62/1017107762.db2.gz IZXJBBZCULKIES-KBPBESRZSA-N 1 0 345.468 3.883 20 5 EHBDRO CC[NH+]1CCC(CNc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000087834384 1032683825 /nfs/dbraw/zinc/68/38/25/1032683825.db2.gz DFIDLLGVIULZOW-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cn4ccccc4n3)C2)cc1 ZINC000449506667 1032689657 /nfs/dbraw/zinc/68/96/57/1032689657.db2.gz ZHOSJJLLWJDMSK-MRXNPFEDSA-N 1 0 336.395 3.622 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])c1 ZINC000892757368 1017336238 /nfs/dbraw/zinc/33/62/38/1017336238.db2.gz HNCMGAKZMCRMAX-GFCCVEGCSA-N 1 0 346.383 3.559 20 5 EHBDRO CCCC[C@H](C)[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000564495768 1017341531 /nfs/dbraw/zinc/34/15/31/1017341531.db2.gz JITIONCWBMWPLZ-NSHDSACASA-N 1 0 327.812 3.697 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@H]4CCOC4)C3)o2)c1 ZINC000377237777 1017514387 /nfs/dbraw/zinc/51/43/87/1017514387.db2.gz JJAAWQQJODIPTA-CVEARBPZSA-N 1 0 342.395 3.713 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000449517454 1032708786 /nfs/dbraw/zinc/70/87/86/1032708786.db2.gz KFUMKZKARGBSIE-VSNBLRCJSA-N 1 0 342.439 3.889 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccccc1-n1cccn1 ZINC000177298022 1017610538 /nfs/dbraw/zinc/61/05/38/1017610538.db2.gz PZTVVQVDOBQIKN-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1ccncc1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449527131 1032728180 /nfs/dbraw/zinc/72/81/80/1032728180.db2.gz ZRIOXFGTMBTBKR-YJBOKZPZSA-N 1 0 325.412 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cccc(-c3ccncc3)c2)cc1 ZINC000610346581 1018366898 /nfs/dbraw/zinc/36/68/98/1018366898.db2.gz XPPOWHMICVHKAV-UHFFFAOYSA-N 1 0 333.391 3.989 20 5 EHBDRO CCCn1ccnc1CCC[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000290353387 1018440781 /nfs/dbraw/zinc/44/07/81/1018440781.db2.gz GGZPMVZWEZNXJH-UHFFFAOYSA-N 1 0 330.432 3.574 20 5 EHBDRO COCC[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC(C)C ZINC000549366013 1018529994 /nfs/dbraw/zinc/52/99/94/1018529994.db2.gz BWWOJZUELQFZRD-UHFFFAOYSA-N 1 0 334.338 3.718 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000341094353 1018530523 /nfs/dbraw/zinc/53/05/23/1018530523.db2.gz FNGORMOTMNCYLE-OKILXGFUSA-N 1 0 328.416 3.818 20 5 EHBDRO CCC[NH+]1CCC(N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000275769647 1018580644 /nfs/dbraw/zinc/58/06/44/1018580644.db2.gz AJRJKXSYEDFYAM-UHFFFAOYSA-N 1 0 347.459 3.665 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580215761 1018808491 /nfs/dbraw/zinc/80/84/91/1018808491.db2.gz CPIQFBYNQOHMHA-RDTXWAMCSA-N 1 0 325.412 3.978 20 5 EHBDRO C[C@]1(CNCc2csc([N+](=O)[O-])c2)CCC[N@@H+]1Cc1ccccc1 ZINC000397985402 1018946342 /nfs/dbraw/zinc/94/63/42/1018946342.db2.gz NWFNCCJADAFZNU-GOSISDBHSA-N 1 0 345.468 3.801 20 5 EHBDRO CN(Cc1ccccc1)CC(C)(C)[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000379660977 1019052168 /nfs/dbraw/zinc/05/21/68/1019052168.db2.gz BBNHRURAZHLBAC-UHFFFAOYSA-N 1 0 341.455 3.638 20 5 EHBDRO CC(C)c1ccc(CN2CCC[C@H]([C@@H]3CCC[NH2+]3)C2)cc1[N+](=O)[O-] ZINC000592425504 1032811729 /nfs/dbraw/zinc/81/17/29/1032811729.db2.gz HBDGRRYFCBHDGL-WMZOPIPTSA-N 1 0 331.460 3.682 20 5 EHBDRO COc1cccc(C[C@@H]([NH2+]CCc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000513363802 1019572108 /nfs/dbraw/zinc/57/21/08/1019572108.db2.gz DYHUKQARIINVAA-LJQANCHMSA-N 1 0 340.423 3.757 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN[C@H]3CC[NH2+]C34CCCC4)o2)c1 ZINC000592437320 1032841797 /nfs/dbraw/zinc/84/17/97/1032841797.db2.gz HDQZMWMPNRWERT-SFHVURJKSA-N 1 0 341.411 3.619 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1csc([N+](=O)[O-])c1 ZINC000610451453 1019806498 /nfs/dbraw/zinc/80/64/98/1019806498.db2.gz ASZBTRRAQCIFJD-HNNXBMFYSA-N 1 0 345.468 3.753 20 5 EHBDRO COc1cc(C[NH+](C(C)C)C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000183019908 1019920183 /nfs/dbraw/zinc/92/01/83/1019920183.db2.gz UHEKNEGTBCKGAK-UHFFFAOYSA-N 1 0 332.347 3.824 20 5 EHBDRO C[C@@]1(O)CCC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000280181136 1020170828 /nfs/dbraw/zinc/17/08/28/1020170828.db2.gz SWFLTCBTFGBSMI-OAQYLSRUSA-N 1 0 337.419 3.683 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000255959091 1020404634 /nfs/dbraw/zinc/40/46/34/1020404634.db2.gz SXGIJDZJSXCZNN-CJNGLKHVSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000280577326 1020480411 /nfs/dbraw/zinc/48/04/11/1020480411.db2.gz SMIFVZKJEVKUKJ-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO C[C@@H]([NH2+]CCCCNC(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000183177093 1020513377 /nfs/dbraw/zinc/51/33/77/1020513377.db2.gz WJFNETQQMYPJNE-CYBMUJFWSA-N 1 0 337.420 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH+]3CCCCC3)CC2)c2cccnc21 ZINC000413086878 1020665096 /nfs/dbraw/zinc/66/50/96/1020665096.db2.gz YKHVHEFODRICNB-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC(C)(C)[C@@H]1OCCC[C@H]1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549543 1032959104 /nfs/dbraw/zinc/95/91/04/1032959104.db2.gz DKFQMDQCTKHNJU-YVEFUNNKSA-N 1 0 347.415 3.667 20 5 EHBDRO CC(C)c1nnc(CC[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000426307504 1021237560 /nfs/dbraw/zinc/23/75/60/1021237560.db2.gz RLPYDCNOTJOWGX-ZDUSSCGKSA-N 1 0 348.472 3.723 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000516478909 1021474809 /nfs/dbraw/zinc/47/48/09/1021474809.db2.gz QABLFUNTZPCWHH-UHFFFAOYSA-N 1 0 346.408 3.509 20 5 EHBDRO CCC(=O)c1ccc(N2CC[C@H]3CC[C@@H](C2)[N@@H+]3C(C)C)c([N+](=O)[O-])c1 ZINC000280794780 1021492218 /nfs/dbraw/zinc/49/22/18/1021492218.db2.gz VCXKFBIWFITNIS-CVEARBPZSA-N 1 0 345.443 3.639 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437108297 1021562738 /nfs/dbraw/zinc/56/27/38/1021562738.db2.gz NBLCBAVJGFWJHL-HNAYVOBHSA-N 1 0 339.439 3.944 20 5 EHBDRO Cn1cc(-c2ccccc2C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cn1 ZINC000516784302 1021728259 /nfs/dbraw/zinc/72/82/59/1021728259.db2.gz KOZCXDBKSCSEPO-LJQANCHMSA-N 1 0 348.406 3.772 20 5 EHBDRO Cc1ccnc(Nc2cccc(CC[N@@H+](C)C3CC3)c2)c1[N+](=O)[O-] ZINC000302012167 1021769300 /nfs/dbraw/zinc/76/93/00/1021769300.db2.gz ZGHHFBVEHYPLDR-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO COc1ccc([C@H](OC)[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602583746 1033003540 /nfs/dbraw/zinc/00/35/40/1033003540.db2.gz SJSNCDYUZHHKAK-AUUYWEPGSA-N 1 0 344.411 3.512 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CC[C@H](c2c(F)cccc2F)C1 ZINC000469462383 1021800189 /nfs/dbraw/zinc/80/01/89/1021800189.db2.gz HNAJGVQLKKNFDX-ZDUSSCGKSA-N 1 0 348.349 3.741 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2nc3ccccc3n2C2CC2)cc1 ZINC000602619279 1033013822 /nfs/dbraw/zinc/01/38/22/1033013822.db2.gz WTFWIKPMPHCIBG-UHFFFAOYSA-N 1 0 336.395 3.612 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000602641396 1033030733 /nfs/dbraw/zinc/03/07/33/1033030733.db2.gz QWDQNUCXKIRLJX-AWEZNQCLSA-N 1 0 332.322 3.518 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccc3c(c2)CCO3)cccc1[N+](=O)[O-] ZINC000178233732 1022247632 /nfs/dbraw/zinc/24/76/32/1022247632.db2.gz OJLAYNQWQNDLBI-CQSZACIVSA-N 1 0 326.396 3.731 20 5 EHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000546268343 1022306227 /nfs/dbraw/zinc/30/62/27/1022306227.db2.gz WPDJZFDDLKTYFX-WDEREUQCSA-N 1 0 347.337 3.633 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562067 1022343819 /nfs/dbraw/zinc/34/38/19/1022343819.db2.gz SEEODPMZTORROK-UKINESCASA-N 1 0 340.379 3.730 20 5 EHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187580022 1022356564 /nfs/dbraw/zinc/35/65/64/1022356564.db2.gz NTHYTJTUZOGIFI-GUYCJALGSA-N 1 0 328.416 3.616 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CC2CC(F)(F)C2)cc1Br ZINC000602670104 1033048792 /nfs/dbraw/zinc/04/87/92/1033048792.db2.gz AJUCQJUMIQQAPM-UHFFFAOYSA-N 1 0 341.177 3.554 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCC2CCOCC2)cc(C(F)(F)F)c1 ZINC000602639407 1033049489 /nfs/dbraw/zinc/04/94/89/1033049489.db2.gz IGUDQVVYVQOBEO-UHFFFAOYSA-N 1 0 332.322 3.520 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000602658927 1033059090 /nfs/dbraw/zinc/05/90/90/1033059090.db2.gz ZHVCTQMCDFRJND-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000477727135 1022720081 /nfs/dbraw/zinc/72/00/81/1022720081.db2.gz WSAQRPMUIXZKJY-CQSZACIVSA-N 1 0 341.411 3.719 20 5 EHBDRO Cn1ncc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720599 1022792209 /nfs/dbraw/zinc/79/22/09/1022792209.db2.gz WKFBELZSPMPLEY-MRXNPFEDSA-N 1 0 340.427 3.585 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[NH+](CCc2cccs2)CC1 ZINC000141433458 1022885901 /nfs/dbraw/zinc/88/59/01/1022885901.db2.gz UMLJVGSVNPXWHR-OAHLLOKOSA-N 1 0 345.468 3.578 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(Cc2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000310150837 1022910919 /nfs/dbraw/zinc/91/09/19/1022910919.db2.gz FSYIJOOXLWQPLW-YJBOKZPZSA-N 1 0 325.412 3.520 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C1CCC(C)(C)CC1 ZINC000127578714 1022934811 /nfs/dbraw/zinc/93/48/11/1022934811.db2.gz GZMAAAAOMRJULW-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(Cc2ccccc2)CCOCC1 ZINC000449718003 1033093851 /nfs/dbraw/zinc/09/38/51/1033093851.db2.gz OFVCOHWJRZOCAC-UHFFFAOYSA-N 1 0 340.423 3.785 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@H+](CCCO)CC(C)(C)C ZINC000518058054 1022963441 /nfs/dbraw/zinc/96/34/41/1022963441.db2.gz AXJGCKGYOBXQQJ-UHFFFAOYSA-N 1 0 338.448 3.613 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CC[C@@H]2CC2(F)F)cc1Br ZINC000602714376 1033099541 /nfs/dbraw/zinc/09/95/41/1033099541.db2.gz HVIIPFDFIZDSAV-ZCFIWIBFSA-N 1 0 341.177 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C3CCC4(CC4(F)F)CC3)nc2c1 ZINC000602718975 1033104923 /nfs/dbraw/zinc/10/49/23/1033104923.db2.gz MIZRHZGHTOVJLP-UHFFFAOYSA-N 1 0 337.326 3.794 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@@H]1C1CC1 ZINC000543242500 1023156032 /nfs/dbraw/zinc/15/60/32/1023156032.db2.gz QWYHRVXJECBNQF-MOPGFXCFSA-N 1 0 342.395 3.902 20 5 EHBDRO CCC1(C)CC[NH+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000507197564 1023175283 /nfs/dbraw/zinc/17/52/83/1023175283.db2.gz QUXVXSDZSSBQNQ-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@@H](C[C@H]1CCOC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740641 1023403622 /nfs/dbraw/zinc/40/36/22/1023403622.db2.gz XERKNQOIYCNJKG-QWHCGFSZSA-N 1 0 347.440 3.623 20 5 EHBDRO CCc1cc(C[NH2+][C@H](CC)CSc2ccccc2[N+](=O)[O-])on1 ZINC000535777806 1023628295 /nfs/dbraw/zinc/62/82/95/1023628295.db2.gz WMVFOPLUYKKWHW-CYBMUJFWSA-N 1 0 335.429 3.806 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000610809663 1023695169 /nfs/dbraw/zinc/69/51/69/1023695169.db2.gz LYGFUOHVPVCPQX-AWEZNQCLSA-N 1 0 329.400 3.774 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccccc2OC)C1 ZINC000157922556 1033164866 /nfs/dbraw/zinc/16/48/66/1033164866.db2.gz UNBPSGMSOBISAB-CQSZACIVSA-N 1 0 342.395 3.602 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NCCC[N@H+](C)C1CCCCC1 ZINC000474144817 1024400936 /nfs/dbraw/zinc/40/09/36/1024400936.db2.gz MLZMVSNUDHLYPE-UHFFFAOYSA-N 1 0 335.448 3.808 20 5 EHBDRO CCOc1ccccc1[C@H](CC(C)C)[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC000342246461 1024544472 /nfs/dbraw/zinc/54/44/72/1024544472.db2.gz RNLIXXPZDCGKNL-KRWDZBQOSA-N 1 0 346.431 3.567 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(O)c1 ZINC000514628270 1024616700 /nfs/dbraw/zinc/61/67/00/1024616700.db2.gz MMIZZLXSRFZAIC-LBPRGKRZSA-N 1 0 325.368 3.675 20 5 EHBDRO CC[C@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H]1CCCO1 ZINC000119656588 1024659033 /nfs/dbraw/zinc/65/90/33/1024659033.db2.gz WYAVDWSOZGHXDA-HOTGVXAUSA-N 1 0 347.440 3.766 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C2(c3ccccc3C)CCC2)c1[N+](=O)[O-] ZINC000895135896 1024858786 /nfs/dbraw/zinc/85/87/86/1024858786.db2.gz BQOBMXJJFXTBSK-UHFFFAOYSA-N 1 0 342.395 3.786 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]([C@H]4CCCO4)C3)o2)c1 ZINC000895842261 1024888372 /nfs/dbraw/zinc/88/83/72/1024888372.db2.gz CXSNEHVLSPXVNY-MAUKXSAKSA-N 1 0 342.395 3.856 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N(C)C2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000342329057 1024898144 /nfs/dbraw/zinc/89/81/44/1024898144.db2.gz VRXRQDRAQZXXQX-GNHJJJEISA-N 1 0 347.459 3.591 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ccc(F)cn2)CC1 ZINC000602904842 1033254402 /nfs/dbraw/zinc/25/44/02/1033254402.db2.gz PFVVEHPVHSEVLY-UHFFFAOYSA-N 1 0 345.374 3.517 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000611314550 1025021473 /nfs/dbraw/zinc/02/14/73/1025021473.db2.gz FBNNQHBIZOYHCG-RUQDQRPJSA-N 1 0 338.407 3.975 20 5 EHBDRO CC[N@@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@@H]1C ZINC000346782355 1025092562 /nfs/dbraw/zinc/09/25/62/1025092562.db2.gz YFRBDNSSSVLVKL-HOTGVXAUSA-N 1 0 347.462 3.943 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC2(C(F)(F)F)CCC2)n1 ZINC000353963558 1025339993 /nfs/dbraw/zinc/33/99/93/1025339993.db2.gz XQFIHNZWAOLFDI-NWDGAFQWSA-N 1 0 346.353 3.597 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000551790140 1025458130 /nfs/dbraw/zinc/45/81/30/1025458130.db2.gz WOSUYTYSTFCTCM-MJXNMMHHSA-N 1 0 326.396 3.885 20 5 EHBDRO C[C@H]([NH2+]Cc1cncc(C(F)(F)F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000451103379 1025565502 /nfs/dbraw/zinc/56/55/02/1025565502.db2.gz NDKHECXZJHVHCF-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000436311836 1025575514 /nfs/dbraw/zinc/57/55/14/1025575514.db2.gz XVIUJYGWTNQQBW-MNOVXSKESA-N 1 0 346.353 3.683 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318942 1025582791 /nfs/dbraw/zinc/58/27/91/1025582791.db2.gz PXQAMXQWYDQGOR-QWRGUYRKSA-N 1 0 346.353 3.541 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000443005340 1025656085 /nfs/dbraw/zinc/65/60/85/1025656085.db2.gz XMUFFMCHDLEWCR-LEXSJLIMSA-N 1 0 328.343 3.861 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1ccc([N+](=O)[O-])cc1 ZINC000120007180 1025670552 /nfs/dbraw/zinc/67/05/52/1025670552.db2.gz ONKCJGGXBIPKMK-GXTWGEPZSA-N 1 0 346.818 3.573 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000277525709 1025676413 /nfs/dbraw/zinc/67/64/13/1025676413.db2.gz PNHNFEHRJNCMCX-MRXNPFEDSA-N 1 0 343.427 3.771 20 5 EHBDRO Cc1cn2cc(Nc3cc(C(F)(F)F)ncc3[N+](=O)[O-])ccc2n1 ZINC000436400438 1025679191 /nfs/dbraw/zinc/67/91/91/1025679191.db2.gz KBKAUPDSIOJNOE-UHFFFAOYSA-N 1 0 337.261 3.708 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000530503573 1025962815 /nfs/dbraw/zinc/96/28/15/1025962815.db2.gz CBZWBSAUUAJUGA-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO CCO[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000451549066 1026100182 /nfs/dbraw/zinc/10/01/82/1026100182.db2.gz VTWDQYHDNCRGML-PBHICJAKSA-N 1 0 336.432 3.629 20 5 EHBDRO CSc1cccc(C(=O)Nc2c(C)cc(C)nc2C)c1[N+](=O)[O-] ZINC000186052054 1026192335 /nfs/dbraw/zinc/19/23/35/1026192335.db2.gz ROXSUCVKCDDHMO-UHFFFAOYSA-N 1 0 331.397 3.889 20 5 EHBDRO C[C@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704375 1026354834 /nfs/dbraw/zinc/35/48/34/1026354834.db2.gz XSIABJYVBMFKRT-BBRMVZONSA-N 1 0 330.384 3.590 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000530940750 1026421423 /nfs/dbraw/zinc/42/14/23/1026421423.db2.gz QYERFQMHFCFSMU-MRXNPFEDSA-N 1 0 347.459 3.696 20 5 EHBDRO Cc1c(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)cccc1[N+](=O)[O-] ZINC000452063512 1026458202 /nfs/dbraw/zinc/45/82/02/1026458202.db2.gz WRAKPRLZWBALLD-KRWDZBQOSA-N 1 0 346.452 3.958 20 5 EHBDRO C[C@H](C[NH+]1CCCCCC1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479616976 1026734269 /nfs/dbraw/zinc/73/42/69/1026734269.db2.gz PCNSSSFSHGMTBM-CYBMUJFWSA-N 1 0 325.840 3.602 20 5 EHBDRO C[C@@]1(CNC(=O)c2cc3ccccc3c3cccnc23)CCC[NH2+]C1 ZINC000342705291 1026785085 /nfs/dbraw/zinc/78/50/85/1026785085.db2.gz FRVQPMLPRYATNN-OAQYLSRUSA-N 1 0 333.435 3.508 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cnc3n1CCCC3)CCCC2 ZINC000520203575 1027101602 /nfs/dbraw/zinc/10/16/02/1027101602.db2.gz QYICRIZCLXCAJS-GOSISDBHSA-N 1 0 340.427 3.685 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000075676541 1027194500 /nfs/dbraw/zinc/19/45/00/1027194500.db2.gz AHCIWVCVONQCCL-JYJNAYRXSA-N 1 0 347.459 3.673 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413217854 1027298326 /nfs/dbraw/zinc/29/83/26/1027298326.db2.gz FDZDLCUPCXRRSG-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718607 1027347103 /nfs/dbraw/zinc/34/71/03/1027347103.db2.gz PXQYOAHJBFLIAI-HIFRSBDPSA-N 1 0 330.384 3.590 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1c(C)cccc1[N+](=O)[O-] ZINC000909600973 1027700726 /nfs/dbraw/zinc/70/07/26/1027700726.db2.gz CSAGRHNPMUMEFO-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(C1)CCCCC2 ZINC000533426699 1027855285 /nfs/dbraw/zinc/85/52/85/1027855285.db2.gz GJQCLZLIMIRAFS-CQSZACIVSA-N 1 0 331.416 3.578 20 5 EHBDRO CO[C@H](C)C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000533432418 1027870553 /nfs/dbraw/zinc/87/05/53/1027870553.db2.gz XOCYSZSDMPEFNO-CQSZACIVSA-N 1 0 347.415 3.538 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1cc2cccnc2c([N+](=O)[O-])c1 ZINC001167624728 1027916211 /nfs/dbraw/zinc/91/62/11/1027916211.db2.gz FMYFBXPQMWEGRY-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000609425630 1027942657 /nfs/dbraw/zinc/94/26/57/1027942657.db2.gz NMKIQEZANOCVQH-HNNXBMFYSA-N 1 0 348.447 3.679 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cc(F)cc(C)c1[N+](=O)[O-] ZINC000909606104 1028059008 /nfs/dbraw/zinc/05/90/08/1028059008.db2.gz LRTLPEIZDNFVJY-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO Cc1ccc(C[C@@H](C)[N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000444636459 1028089417 /nfs/dbraw/zinc/08/94/17/1028089417.db2.gz DIKBJSFOCJYLQY-CQSZACIVSA-N 1 0 338.411 3.843 20 5 EHBDRO CC[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@H](C)Cc1ccsc1 ZINC000444670187 1028142104 /nfs/dbraw/zinc/14/21/04/1028142104.db2.gz AFHWLRPSWITDCB-GFCCVEGCSA-N 1 0 344.440 3.986 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cnn(C2CCCC2)c1 ZINC000502421990 1028208378 /nfs/dbraw/zinc/20/83/78/1028208378.db2.gz ZSNIZWXMKMCAJZ-CQSZACIVSA-N 1 0 328.416 3.800 20 5 EHBDRO C[C@@H](N[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178620 1028246693 /nfs/dbraw/zinc/24/66/93/1028246693.db2.gz CEWQDLKJGBPAFE-OLZOCXBDSA-N 1 0 331.441 3.726 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](O)CC23CCC3)o1 ZINC000421374435 1028335668 /nfs/dbraw/zinc/33/56/68/1028335668.db2.gz OVIMUFAWPGFSMK-CQSZACIVSA-N 1 0 342.395 3.734 20 5 EHBDRO C[C@]1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338928 1028372087 /nfs/dbraw/zinc/37/20/87/1028372087.db2.gz LFFWKPYINQUKJN-PMACEKPBSA-N 1 0 339.439 3.664 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@]1(Cc2ccc(Cl)cc2)CCOC1 ZINC000502601892 1028421725 /nfs/dbraw/zinc/42/17/25/1028421725.db2.gz RKMPLWBIGKFKMM-GOSISDBHSA-N 1 0 346.814 3.740 20 5 EHBDRO C[C@@H]1CN(CC[NH2+]Cc2c3ccccc3cc3ccccc32)CCO1 ZINC000729682827 1028446924 /nfs/dbraw/zinc/44/69/24/1028446924.db2.gz AYZRSMBRBMSEKA-QGZVFWFLSA-N 1 0 334.463 3.803 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000423487876 1028476606 /nfs/dbraw/zinc/47/66/06/1028476606.db2.gz YAIRJCYASZRPIT-GOSISDBHSA-N 1 0 325.412 3.998 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCC1(O)CCC1 ZINC000421861042 1028854868 /nfs/dbraw/zinc/85/48/68/1028854868.db2.gz SXEASWMHUIDMMU-AWEZNQCLSA-N 1 0 338.473 3.750 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCN1CC ZINC000504911344 1029052207 /nfs/dbraw/zinc/05/22/07/1029052207.db2.gz FAPHGSDDOWPEJR-CABCVRRESA-N 1 0 337.489 3.539 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000504912066 1029055657 /nfs/dbraw/zinc/05/56/57/1029055657.db2.gz PNJSOECPCMCVJD-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532918389 1029067813 /nfs/dbraw/zinc/06/78/13/1029067813.db2.gz TVWJNQJALFDRQG-OWQGQXMQSA-N 1 0 345.443 3.742 20 5 EHBDRO Cc1ccc(CNC[C@@H]2CC[N@@H+]2C2CCCCCC2)cc1[N+](=O)[O-] ZINC001203409449 1029068881 /nfs/dbraw/zinc/06/88/81/1029068881.db2.gz YLPAHORNASLSPR-SFHVURJKSA-N 1 0 331.460 3.790 20 5 EHBDRO CCC(CC)C[N@H+](CC)CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21 ZINC000532918343 1029070121 /nfs/dbraw/zinc/07/01/21/1029070121.db2.gz OBIFIKRARVBXJD-UHFFFAOYSA-N 1 0 349.431 3.651 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000504926339 1029072083 /nfs/dbraw/zinc/07/20/83/1029072083.db2.gz IFXOJFJNEITEKA-OAGGEKHMSA-N 1 0 349.475 3.765 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000191850709 1029082746 /nfs/dbraw/zinc/08/27/46/1029082746.db2.gz PHEQYYDZBHDNQV-QMTHXVAHSA-N 1 0 339.823 3.744 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])[C@H](C)C(C)C ZINC000532935224 1029099887 /nfs/dbraw/zinc/09/98/87/1029099887.db2.gz WYSUJZKEKIQDEX-LLVKDONJSA-N 1 0 327.812 3.553 20 5 EHBDRO CCC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(C)cc1 ZINC000533223866 1029491893 /nfs/dbraw/zinc/49/18/93/1029491893.db2.gz UGJOSCIVWJNCQH-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H](C)SC)o2)c([N+](=O)[O-])c1 ZINC000128126516 1029689179 /nfs/dbraw/zinc/68/91/79/1029689179.db2.gz IFWGDZDLPOJBJG-NSHDSACASA-N 1 0 336.413 3.705 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])[nH]2)cc1 ZINC000343224598 1029810174 /nfs/dbraw/zinc/81/01/74/1029810174.db2.gz YRXOKEUVWOVAEF-CYBMUJFWSA-N 1 0 342.399 3.550 20 5 EHBDRO C[C@@H]1[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1c1ccccc1 ZINC000446848000 1029816869 /nfs/dbraw/zinc/81/68/69/1029816869.db2.gz CVZLEWACHFLIHZ-NUTKFTJISA-N 1 0 336.395 3.753 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000441174193 1029876582 /nfs/dbraw/zinc/87/65/82/1029876582.db2.gz DGCYMIVJYLVTLN-HNNXBMFYSA-N 1 0 344.411 3.984 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@H+]2C[C@@H]3CCCC[C@@H]3C2)c1 ZINC000537626335 1029905546 /nfs/dbraw/zinc/90/55/46/1029905546.db2.gz OPSCNWFAEBIZTO-TXEJJXNPSA-N 1 0 326.343 3.818 20 5 EHBDRO CCc1ncc(C[NH2+][C@H](CC)CSc2ccccc2[N+](=O)[O-])o1 ZINC000453389202 1030157609 /nfs/dbraw/zinc/15/76/09/1030157609.db2.gz PQRGBVXJSCGUJG-GFCCVEGCSA-N 1 0 335.429 3.806 20 5 EHBDRO CC1(C)C[C@H]([N@@H+]2CCC[C@@]3(CCOC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000453381846 1030162451 /nfs/dbraw/zinc/16/24/51/1030162451.db2.gz RIGNCQNQXOEKMD-PKOBYXMFSA-N 1 0 330.428 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CC[C@H](c3ccccc3)C2)cc1 ZINC000525868289 1030183862 /nfs/dbraw/zinc/18/38/62/1030183862.db2.gz UBRDIDGMTADPRU-IRXDYDNUSA-N 1 0 326.396 3.900 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2ccc(Cl)cc2)n1 ZINC000447518589 1030242354 /nfs/dbraw/zinc/24/23/54/1030242354.db2.gz OBXPBFHSRWQPSL-CVEARBPZSA-N 1 0 348.834 3.761 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOc1ccc(F)cc1F ZINC000531994083 1030244411 /nfs/dbraw/zinc/24/44/11/1030244411.db2.gz LCMMRQRKBBBXAV-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327136 1030265674 /nfs/dbraw/zinc/26/56/74/1030265674.db2.gz XWTWASJTLPYNLB-RDTXWAMCSA-N 1 0 342.443 3.823 20 5 EHBDRO CCc1ccccc1C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447540989 1030276167 /nfs/dbraw/zinc/27/61/67/1030276167.db2.gz LCALGUCJVOYPCC-SJORKVTESA-N 1 0 328.416 3.627 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)C12CCC2 ZINC000447546695 1030280723 /nfs/dbraw/zinc/28/07/23/1030280723.db2.gz YBEXPMUXMSEHIK-KZNAEPCWSA-N 1 0 330.428 3.910 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1CCCCN1C1CC1)C1CC1 ZINC000447592411 1030329540 /nfs/dbraw/zinc/32/95/40/1030329540.db2.gz LJEWLIJSKMNBDD-MOPGFXCFSA-N 1 0 343.471 3.522 20 5 EHBDRO Cc1cc(F)ccc1CC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447578229 1030342275 /nfs/dbraw/zinc/34/22/75/1030342275.db2.gz DMKLSNIXGROQJU-IRXDYDNUSA-N 1 0 346.406 3.555 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2CCCOc2ccc([N+](=O)[O-])cc2)n1 ZINC000159857545 1030396124 /nfs/dbraw/zinc/39/61/24/1030396124.db2.gz FTMJYEYWXIIASL-LJQANCHMSA-N 1 0 341.411 3.904 20 5 EHBDRO Cc1cccc([C@@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)n1 ZINC000159870278 1030418342 /nfs/dbraw/zinc/41/83/42/1030418342.db2.gz JNXQIBNMAWEEAN-SFHVURJKSA-N 1 0 327.384 3.514 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267980 1030515235 /nfs/dbraw/zinc/51/52/35/1030515235.db2.gz PLWBTDCXRCYIBG-GUYCJALGSA-N 1 0 334.416 3.862 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@H](CC)c2cccc([N+](=O)[O-])c2)c1 ZINC000160190924 1030587488 /nfs/dbraw/zinc/58/74/88/1030587488.db2.gz YOEPJQQGDAYZKM-GOSISDBHSA-N 1 0 341.411 3.585 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000550894735 1030773612 /nfs/dbraw/zinc/77/36/12/1030773612.db2.gz GOMVSSDVNMRYBR-MOPGFXCFSA-N 1 0 326.396 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406823 1030825735 /nfs/dbraw/zinc/82/57/35/1030825735.db2.gz LUEIYBIKKWIFHM-KBPBESRZSA-N 1 0 344.411 3.898 20 5 EHBDRO CCc1nnc(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)[nH]1 ZINC000190680100 1030913328 /nfs/dbraw/zinc/91/33/28/1030913328.db2.gz QNHYSRFMYKFVGO-CYBMUJFWSA-N 1 0 343.431 3.524 20 5 EHBDRO C[N@H+](Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@@H]1CCC(C)(C)C1 ZINC000483103398 1030960929 /nfs/dbraw/zinc/96/09/29/1030960929.db2.gz GIEDQIGYJQUDSH-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360663 1030983611 /nfs/dbraw/zinc/98/36/11/1030983611.db2.gz CORVCHKFCXLNDS-WMLDXEAASA-N 1 0 344.411 3.980 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000448366172 1031018849 /nfs/dbraw/zinc/01/88/49/1031018849.db2.gz KPCZKMFZAOUKIJ-INIZCTEOSA-N 1 0 332.425 3.526 20 5 EHBDRO COC1(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CCCCC1 ZINC000483259242 1031070132 /nfs/dbraw/zinc/07/01/32/1031070132.db2.gz WQIOFQCZOXJJBP-UHFFFAOYSA-N 1 0 348.443 3.787 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCN(C)[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000551177394 1031078406 /nfs/dbraw/zinc/07/84/06/1031078406.db2.gz YKLAVQXVDLWFLU-UYAOXDASSA-N 1 0 339.439 3.828 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](CO)C1CCCCC1)CCC2 ZINC000551271970 1031183419 /nfs/dbraw/zinc/18/34/19/1031183419.db2.gz HIFPNVMUXLIUGC-QFBILLFUSA-N 1 0 332.444 3.751 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@]1(C)CCCO1 ZINC000340496912 1031293968 /nfs/dbraw/zinc/29/39/68/1031293968.db2.gz HFHRTTWFLCBQSQ-QMTHXVAHSA-N 1 0 332.322 3.661 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)Cc1cccc(F)c1 ZINC000343593267 1031534300 /nfs/dbraw/zinc/53/43/00/1031534300.db2.gz WITMDFTYPJUPDY-UHFFFAOYSA-N 1 0 345.374 3.585 20 5 EHBDRO C[C@@H]1C[C@@H](C)[C@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000475737965 1031704945 /nfs/dbraw/zinc/70/49/45/1031704945.db2.gz HERGFMCDWSRMQA-UPJWGTAASA-N 1 0 330.388 3.511 20 5 EHBDRO Cn1cccc1[C@H]1CCCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000472312499 1031771080 /nfs/dbraw/zinc/77/10/80/1031771080.db2.gz DXUSMCVFXVQFBC-GOSISDBHSA-N 1 0 329.400 3.539 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@@H](C)[C@H]1C ZINC000475744893 1031789787 /nfs/dbraw/zinc/78/97/87/1031789787.db2.gz DFHCTBQZBXBXAU-UMVBOHGHSA-N 1 0 333.432 3.598 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c(C)o1 ZINC000537887531 1031990738 /nfs/dbraw/zinc/99/07/38/1031990738.db2.gz WLZWAQKBORMIFO-QAPCUYQASA-N 1 0 343.427 3.743 20 5 EHBDRO C[C@@]1([NH2+]CCOc2cccc([N+](=O)[O-])c2)CCCc2ccccc21 ZINC001168423593 1033384421 /nfs/dbraw/zinc/38/44/21/1033384421.db2.gz MYRZIPZFYZPJNA-LJQANCHMSA-N 1 0 326.396 3.815 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000594514500 1033419889 /nfs/dbraw/zinc/41/98/89/1033419889.db2.gz JUSVPOIPIBIWSU-KDOFPFPSSA-N 1 0 325.412 3.532 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCCN3CCCC[C@H]13)CCC2 ZINC000594518575 1033425511 /nfs/dbraw/zinc/42/55/11/1033425511.db2.gz IDLAHZAROJBWGZ-GUDVDZBRSA-N 1 0 329.444 3.579 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](CC1CCCCC1)C1CC1 ZINC000063525640 1033435405 /nfs/dbraw/zinc/43/54/05/1033435405.db2.gz QVIRFLSPTBFGIW-UHFFFAOYSA-N 1 0 345.443 3.886 20 5 EHBDRO Cc1nn(C[N@@H+]2CC3C[C@@H]4CC2C[C@H](C3)C4)c2cc([N+](=O)[O-])ccc12 ZINC000761290279 1033521393 /nfs/dbraw/zinc/52/13/93/1033521393.db2.gz NOXUXMYDLKUPSZ-KWOWKCNFSA-N 1 0 340.427 3.721 20 5 EHBDRO CC(C)c1ncc2c(n1)CC[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000598935425 1033591521 /nfs/dbraw/zinc/59/15/21/1033591521.db2.gz GNROCAQUEBZDOB-ALCCZGGFSA-N 1 0 338.411 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCN(c3ccccc3Cl)C2)cc1 ZINC000594954391 1033596323 /nfs/dbraw/zinc/59/63/23/1033596323.db2.gz LACXGICJCVDBKE-HNNXBMFYSA-N 1 0 345.830 3.864 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCCNc1ccccc1 ZINC000595011084 1033607940 /nfs/dbraw/zinc/60/79/40/1033607940.db2.gz WUZGMUPPLJYXKI-CQSZACIVSA-N 1 0 329.400 3.756 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000595021340 1033614895 /nfs/dbraw/zinc/61/48/95/1033614895.db2.gz CGIPJXJLLIWKQT-KBPBESRZSA-N 1 0 334.416 3.746 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1c(C2CCC2)cnn1C ZINC000594984274 1033619430 /nfs/dbraw/zinc/61/94/30/1033619430.db2.gz QPIIBPYWRFSQFW-NTEUORMPSA-N 1 0 340.427 3.789 20 5 EHBDRO C[C@]1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1(F)F ZINC000594988102 1033622455 /nfs/dbraw/zinc/62/24/55/1033622455.db2.gz YVZFLTTZVMEFIB-CQSZACIVSA-N 1 0 339.367 3.853 20 5 EHBDRO CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[NH+](C)C ZINC000603438483 1033630443 /nfs/dbraw/zinc/63/04/43/1033630443.db2.gz QVRYYSWTNBDHLZ-QGZVFWFLSA-N 1 0 330.432 3.921 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCc1ccnc2ccccc12 ZINC000595074682 1033644603 /nfs/dbraw/zinc/64/46/03/1033644603.db2.gz TVHQRUGRCORRME-LJQANCHMSA-N 1 0 333.391 3.963 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)[C@@H](C)c1ccccc1 ZINC000595099546 1033688932 /nfs/dbraw/zinc/68/89/32/1033688932.db2.gz NPYHBOICVYYVDS-YZVOILCLSA-N 1 0 328.412 3.718 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081023 1033695835 /nfs/dbraw/zinc/69/58/35/1033695835.db2.gz PIOLWKHWNACIJD-KBXCAEBGSA-N 1 0 329.444 3.579 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@H]1CC[N@@H+](C2CCCCC2)C1 ZINC000595081588 1033695933 /nfs/dbraw/zinc/69/59/33/1033695933.db2.gz SMNLMMRBTQRECB-CABCVRRESA-N 1 0 347.459 3.661 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)OC)c1 ZINC000599061120 1033701208 /nfs/dbraw/zinc/70/12/08/1033701208.db2.gz KQZXMMOYKMVNSH-LIRRHRJNSA-N 1 0 344.411 3.950 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccccc1 ZINC000892415130 1033756149 /nfs/dbraw/zinc/75/61/49/1033756149.db2.gz BCKPKEHYFSJWJY-HNNXBMFYSA-N 1 0 330.384 3.940 20 5 EHBDRO CCCC[N@H+](CCCO)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000575028055 1033763943 /nfs/dbraw/zinc/76/39/43/1033763943.db2.gz PNVFALLLWVSRSK-UHFFFAOYSA-N 1 0 332.400 3.839 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595414494 1033788973 /nfs/dbraw/zinc/78/89/73/1033788973.db2.gz KQQHEKPPDHSGOR-LSDHHAIUSA-N 1 0 347.459 3.530 20 5 EHBDRO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000472354640 1033806972 /nfs/dbraw/zinc/80/69/72/1033806972.db2.gz VDHLDGNPSYODML-MRXNPFEDSA-N 1 0 346.402 3.814 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000593724143 1033862323 /nfs/dbraw/zinc/86/23/23/1033862323.db2.gz XDWNEPZUUGPPOV-QGPMSJSTSA-N 1 0 332.444 3.711 20 5 EHBDRO O=C(CC[NH+]1CCC2(CCCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000608833474 1033908884 /nfs/dbraw/zinc/90/88/84/1033908884.db2.gz HGPJMLBRLAHHIP-UHFFFAOYSA-N 1 0 345.443 3.970 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cccnc1C(F)(F)F ZINC000599405450 1033919920 /nfs/dbraw/zinc/91/99/20/1033919920.db2.gz UNBNHHKJOWUHJO-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)[C@H]1CCO ZINC000595696269 1033948736 /nfs/dbraw/zinc/94/87/36/1033948736.db2.gz KAVRNQYCQWUPBP-ABAIWWIYSA-N 1 0 346.349 3.597 20 5 EHBDRO COc1cc(C[NH2+][C@@H](c2ccccn2)C2CCC2)ccc1[N+](=O)[O-] ZINC000599573937 1034017410 /nfs/dbraw/zinc/01/74/10/1034017410.db2.gz LBZSOHUMHIBZLM-GOSISDBHSA-N 1 0 327.384 3.629 20 5 EHBDRO COCC1([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)CCCCC1 ZINC000595908334 1034027178 /nfs/dbraw/zinc/02/71/78/1034027178.db2.gz HQRIJQUZLQKNBD-UHFFFAOYSA-N 1 0 345.399 3.689 20 5 EHBDRO CC1(C)C[NH2+]C[C@@H]1c1nc(-c2ccc3ccc4cccnc4c3n2)no1 ZINC001212181522 1034036247 /nfs/dbraw/zinc/03/62/47/1034036247.db2.gz KZUMMEOOCBQILQ-CQSZACIVSA-N 1 0 345.406 3.546 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000596097821 1034062562 /nfs/dbraw/zinc/06/25/62/1034062562.db2.gz GTCHGERUKSMBBS-LLVKDONJSA-N 1 0 331.338 3.580 20 5 EHBDRO C[NH2+]C[C@@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000596106333 1034063756 /nfs/dbraw/zinc/06/37/56/1034063756.db2.gz OKYVHILNUZGHOW-GFCCVEGCSA-N 1 0 349.818 3.738 20 5 EHBDRO O=[N+]([O-])c1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1C(F)(F)F ZINC000596082049 1034073355 /nfs/dbraw/zinc/07/33/55/1034073355.db2.gz FIWGYAYUNMGDTK-NWDGAFQWSA-N 1 0 329.322 3.652 20 5 EHBDRO COc1cc(NC2CC[NH+](C3CCC3)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596258539 1034153237 /nfs/dbraw/zinc/15/32/37/1034153237.db2.gz KGVBDJYSXIOFTI-UHFFFAOYSA-N 1 0 339.823 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+](CC2CC2)CC2CC2)c1 ZINC000537624638 1034249618 /nfs/dbraw/zinc/24/96/18/1034249618.db2.gz OXJGAXUURZEWRT-UHFFFAOYSA-N 1 0 326.343 3.818 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000310496138 1034527259 /nfs/dbraw/zinc/52/72/59/1034527259.db2.gz GIQUYUQGCDHJDN-HUUCEWRRSA-N 1 0 349.431 3.520 20 5 EHBDRO CC(C)(C)OC(=O)N[C@@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000310496140 1034527773 /nfs/dbraw/zinc/52/77/73/1034527773.db2.gz GIQUYUQGCDHJDN-LSDHHAIUSA-N 1 0 349.431 3.520 20 5 EHBDRO C[NH2+]Cc1ccccc1C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000593321990 1034646000 /nfs/dbraw/zinc/64/60/00/1034646000.db2.gz KPZWVGCZLJMXNR-IBGZPJMESA-N 1 0 339.439 3.826 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)[C@@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000450675298 1034701828 /nfs/dbraw/zinc/70/18/28/1034701828.db2.gz CRZRAQQPLWHZBE-YZVOILCLSA-N 1 0 328.412 3.718 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000179873067 1034877697 /nfs/dbraw/zinc/87/76/97/1034877697.db2.gz WYQNWTWZCQTWCC-NSHDSACASA-N 1 0 344.358 3.622 20 5 EHBDRO COCCCOC1CC[NH+](C/C(C)=C\c2cccc([N+](=O)[O-])c2)CC1 ZINC000347354745 1034881465 /nfs/dbraw/zinc/88/14/65/1034881465.db2.gz IJCOPRVQEOXXIT-SSZFMOIBSA-N 1 0 348.443 3.516 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CCCN(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407729 1034889726 /nfs/dbraw/zinc/88/97/26/1034889726.db2.gz ZFDRGSCLYMENOR-HNAYVOBHSA-N 1 0 343.427 3.523 20 5 EHBDRO C[C@@H](CC[NH+](C)C)Nc1ccc(C(=O)c2ccccc2)cc1[N+](=O)[O-] ZINC000065945418 1034978402 /nfs/dbraw/zinc/97/84/02/1034978402.db2.gz YMJZLUCKZPOCQP-AWEZNQCLSA-N 1 0 341.411 3.578 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](NCCC[NH+]2CCCC2)c2ccccc2)c1 ZINC000180017274 1035193731 /nfs/dbraw/zinc/19/37/31/1035193731.db2.gz NYKVTYUEDHFRPR-HXUWFJFHSA-N 1 0 339.439 3.760 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000588232602 1035831364 /nfs/dbraw/zinc/83/13/64/1035831364.db2.gz QGZIJLHCIKBWSB-ZFWWWQNUSA-N 1 0 348.830 3.983 20 5 EHBDRO CC[N@@H+]1CC[C@@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180155431 1035920412 /nfs/dbraw/zinc/92/04/12/1035920412.db2.gz FJFVBIMQLOFCHF-JXFKEZNVSA-N 1 0 339.439 3.616 20 5 EHBDRO Cc1sc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)cc1[N+](=O)[O-] ZINC000045143956 1035951179 /nfs/dbraw/zinc/95/11/79/1035951179.db2.gz DUXJVUWPUUVXHS-UHFFFAOYSA-N 1 0 345.424 3.813 20 5 EHBDRO COC(=O)CC1([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCCCC1 ZINC000541072704 1035951867 /nfs/dbraw/zinc/95/18/67/1035951867.db2.gz WRJOUSAOOKRCLK-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO CC[C@@H](C)[N@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047255 1035957666 /nfs/dbraw/zinc/95/76/66/1035957666.db2.gz YTZPWSOFVASMBX-BXUZGUMPSA-N 1 0 333.354 3.518 20 5 EHBDRO Cc1cc(C[NH3+])cc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000457367209 1036008389 /nfs/dbraw/zinc/00/83/89/1036008389.db2.gz DZODNJPQRBMICO-UHFFFAOYSA-N 1 0 327.384 3.738 20 5 EHBDRO CC[C@](C)(CO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000152177053 1036037568 /nfs/dbraw/zinc/03/75/68/1036037568.db2.gz QTKYNHGAWUXAJQ-GOSISDBHSA-N 1 0 348.374 3.777 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H]2CCCOC2)c2ccccc2)c1 ZINC000180182371 1036050299 /nfs/dbraw/zinc/05/02/99/1036050299.db2.gz KKBXUPMMQIBPMO-HNAYVOBHSA-N 1 0 326.396 3.700 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201742 1036139418 /nfs/dbraw/zinc/13/94/18/1036139418.db2.gz YEWDODNKXBSBLW-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCC(=O)Nc1ccccc1 ZINC000164985520 1036180778 /nfs/dbraw/zinc/18/07/78/1036180778.db2.gz WWWAZKIOKYDYQX-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])[C@@H](c1ccccc1)N(C)C ZINC000582677781 1036191297 /nfs/dbraw/zinc/19/12/97/1036191297.db2.gz VHXOZDGXHQHBGM-DCPHZVHLSA-N 1 0 339.439 3.863 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CC[C@H](C(C)(C)C)C1 ZINC000541391392 1036278125 /nfs/dbraw/zinc/27/81/25/1036278125.db2.gz VVQGTKYOYNPXSA-AWEZNQCLSA-N 1 0 333.432 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@H](C3CC3)C2)c1 ZINC000589209856 1036312174 /nfs/dbraw/zinc/31/21/74/1036312174.db2.gz UXBLHMJHNNYWDG-LBPRGKRZSA-N 1 0 326.343 3.818 20 5 EHBDRO Cc1n[nH]c(C)c1[C@H]1CCC[N@@H+]1C/C=C\c1ccccc1[N+](=O)[O-] ZINC000589207298 1036312899 /nfs/dbraw/zinc/31/28/99/1036312899.db2.gz JZAHVOFTHNCDGG-CTEOGUNLSA-N 1 0 326.400 3.785 20 5 EHBDRO CCO[C@@H]1CCCC[C@H]1[NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000452035456 1036398460 /nfs/dbraw/zinc/39/84/60/1036398460.db2.gz OLCITWDITSXHJW-IAGOWNOFSA-N 1 0 345.399 3.687 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)CCCc2cccnc2)ccc1[N+](=O)[O-] ZINC000459630953 1036602727 /nfs/dbraw/zinc/60/27/27/1036602727.db2.gz BXACHXNRDUJODO-HNNXBMFYSA-N 1 0 343.427 3.890 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939096 1036686750 /nfs/dbraw/zinc/68/67/50/1036686750.db2.gz OYGPWPWDVJOFMA-IUODEOHRSA-N 1 0 346.349 3.654 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000464781905 1036776278 /nfs/dbraw/zinc/77/62/78/1036776278.db2.gz WTFMTTYNPMRUFN-GOSISDBHSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000180469579 1036872610 /nfs/dbraw/zinc/87/26/10/1036872610.db2.gz MWVWBTBHKHNSBR-FOIQADDNSA-N 1 0 339.439 3.757 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)ccc1Cl ZINC000590662311 1036994181 /nfs/dbraw/zinc/99/41/81/1036994181.db2.gz RHRXPLOCBVGLNJ-UHFFFAOYSA-N 1 0 336.775 3.555 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)CN2CCCCC2)cc1[N+](=O)[O-] ZINC000152857341 1037000797 /nfs/dbraw/zinc/00/07/97/1037000797.db2.gz OXMLZPNPKKFNHV-LSDHHAIUSA-N 1 0 335.448 3.519 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCOC1 ZINC000539710726 1037102425 /nfs/dbraw/zinc/10/24/25/1037102425.db2.gz YOJBYGHFQWNCDF-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000324752185 1037157781 /nfs/dbraw/zinc/15/77/81/1037157781.db2.gz TYXUJTILFKCSSM-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc(OC)cc1 ZINC000180771943 1037179879 /nfs/dbraw/zinc/17/98/79/1037179879.db2.gz PHHFTGSTPLUPFN-KRWDZBQOSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2C[C@@H]3CCC[NH2+][C@@H]3C2)s1 ZINC000539834899 1037265573 /nfs/dbraw/zinc/26/55/73/1037265573.db2.gz QYPULONLGVFTKV-XJKSGUPXSA-N 1 0 343.452 3.507 20 5 EHBDRO CC(C)C1CC[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000539836140 1037266046 /nfs/dbraw/zinc/26/60/46/1037266046.db2.gz UXKSVPVRPLFQNA-UHFFFAOYSA-N 1 0 342.443 3.863 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN1CCc2ccccc2C1 ZINC000532455724 1037331561 /nfs/dbraw/zinc/33/15/61/1037331561.db2.gz HTADSNPNBKWUKU-MRXNPFEDSA-N 1 0 339.439 3.612 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCN2CCCCC2)c2ccccc2)c1 ZINC000491383416 1037437491 /nfs/dbraw/zinc/43/74/91/1037437491.db2.gz RKUXIADBPDDEFC-FQEVSTJZSA-N 1 0 339.439 3.760 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(c3ccccc3)CCC2)c2c(c1)COCO2 ZINC000171129240 1037467400 /nfs/dbraw/zinc/46/74/00/1037467400.db2.gz OUKZMSYOOQYXSX-UHFFFAOYSA-N 1 0 340.379 3.630 20 5 EHBDRO COc1cc(C[N@H+](CCc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1O ZINC000089974928 1037514584 /nfs/dbraw/zinc/51/45/84/1037514584.db2.gz AAGCTIUSRJXNBK-UHFFFAOYSA-N 1 0 342.395 3.516 20 5 EHBDRO CCC[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC(C)C ZINC000532490393 1037527776 /nfs/dbraw/zinc/52/77/76/1037527776.db2.gz VJBFKZMTOHXYOW-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H](CCO)C1CCCCC1 ZINC000760862917 1037534753 /nfs/dbraw/zinc/53/47/53/1037534753.db2.gz DAXBQHRQYOILKJ-OAHLLOKOSA-N 1 0 326.824 3.669 20 5 EHBDRO C[C@@H](O)[C@](C)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000188904460 1037556276 /nfs/dbraw/zinc/55/62/76/1037556276.db2.gz BOHZMKUVXSHKGZ-YRNRMSPPSA-N 1 0 342.439 3.875 20 5 EHBDRO CC[N@H+](CCNc1c(F)cc([N+](=O)[O-])cc1F)CCC(F)(F)F ZINC000491581354 1037557972 /nfs/dbraw/zinc/55/79/72/1037557972.db2.gz LPHDYZJRQFBQBJ-UHFFFAOYSA-N 1 0 341.280 3.559 20 5 EHBDRO C[C@@H](O)[C@](C)(C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000188910193 1037558019 /nfs/dbraw/zinc/55/80/19/1037558019.db2.gz BCXDKHVPXRUYSK-YRNRMSPPSA-N 1 0 342.439 3.875 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3C[C@@H]4CCCC[C@H]4C3)o2)c1 ZINC000177529951 1037577047 /nfs/dbraw/zinc/57/70/47/1037577047.db2.gz ZKEDRILMUOVMMF-HOTGVXAUSA-N 1 0 341.411 3.914 20 5 EHBDRO COc1cc(C[NH2+]C[C@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1O ZINC000491599204 1037578275 /nfs/dbraw/zinc/57/82/75/1037578275.db2.gz PAPHHIBAQDNBLO-NSHDSACASA-N 1 0 344.358 3.614 20 5 EHBDRO CN(Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@H]1COc2ccccc2O1 ZINC000341175019 1037674861 /nfs/dbraw/zinc/67/48/61/1037674861.db2.gz DXAYNTJGGYELTE-AWEZNQCLSA-N 1 0 348.786 3.520 20 5 EHBDRO C[C@@H]1CCN(c2ccccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000463070790 1037734581 /nfs/dbraw/zinc/73/45/81/1037734581.db2.gz PDDLTDAQBYCWOS-MRXNPFEDSA-N 1 0 325.412 3.696 20 5 EHBDRO CC(C)C[C@@H](CO)[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000290515045 1037828542 /nfs/dbraw/zinc/82/85/42/1037828542.db2.gz PUUPRLWNQGZQES-INIZCTEOSA-N 1 0 349.456 3.557 20 5 EHBDRO CC(C)C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000540341426 1037847897 /nfs/dbraw/zinc/84/78/97/1037847897.db2.gz KLJOLBAEGRXLNR-QGZVFWFLSA-N 1 0 341.411 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC[C@@H]3C3CCC3)o2)cc1 ZINC000592198766 1037944101 /nfs/dbraw/zinc/94/41/01/1037944101.db2.gz SGJFKDBSDBHXHL-MRXNPFEDSA-N 1 0 342.399 3.799 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)[C@H]2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000540479660 1037990380 /nfs/dbraw/zinc/99/03/80/1037990380.db2.gz SLDORBLCEAGQJY-QRTARXTBSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000481086644 1038040850 /nfs/dbraw/zinc/04/08/50/1038040850.db2.gz DNUXTIPTLKYEBG-ZFWWWQNUSA-N 1 0 333.432 3.646 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)C(C)(C)C[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000416104935 1038129064 /nfs/dbraw/zinc/12/90/64/1038129064.db2.gz KFUKNZWLFZVLOJ-UHFFFAOYSA-N 1 0 347.459 3.665 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000541392882 1038549524 /nfs/dbraw/zinc/54/95/24/1038549524.db2.gz MECIXZPWURARCD-AWEZNQCLSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1-n1cccn1 ZINC000539040339 1038649639 /nfs/dbraw/zinc/64/96/39/1038649639.db2.gz OQJHAZKVUJWXQT-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCNC(=O)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000539088787 1038677647 /nfs/dbraw/zinc/67/76/47/1038677647.db2.gz ZIEZUOCBXLDHJY-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1ccc2c(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3F)c[nH]c2c1 ZINC000479985161 1038972545 /nfs/dbraw/zinc/97/25/45/1038972545.db2.gz ANAAPKULDRWZCY-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000552097448 1038985093 /nfs/dbraw/zinc/98/50/93/1038985093.db2.gz BXECPSGUEMJHER-CYGHRXIMSA-N 1 0 332.444 3.568 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C[C@@H]1CC=CCC1 ZINC000544114218 1039020192 /nfs/dbraw/zinc/02/01/92/1039020192.db2.gz GKERCERRWXDMJF-OAHLLOKOSA-N 1 0 331.416 3.520 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000341478597 1039141075 /nfs/dbraw/zinc/14/10/75/1039141075.db2.gz DMYGTWOVFUENHL-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO C[C@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H](C)CO)c1ccccc1 ZINC000554283188 1039157779 /nfs/dbraw/zinc/15/77/79/1039157779.db2.gz LTWQNZYKMSEIJD-CABCVRRESA-N 1 0 346.402 3.720 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2ccsc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480229739 1039311947 /nfs/dbraw/zinc/31/19/47/1039311947.db2.gz LZASLLIUCBINTP-GUYCJALGSA-N 1 0 333.457 3.918 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H](c2ccnn2C)C1)c1cccc([N+](=O)[O-])c1 ZINC000366071904 1039344925 /nfs/dbraw/zinc/34/49/25/1039344925.db2.gz GIAJHDZAIJJKRB-CWRNSKLLSA-N 1 0 328.416 3.705 20 5 EHBDRO NC(=O)c1ccc(C[N@@H+]2CCC[C@H]2CC2CCCCC2)c([N+](=O)[O-])c1 ZINC000488738238 1039366415 /nfs/dbraw/zinc/36/64/15/1039366415.db2.gz JCKAOHHSQNBFOO-KRWDZBQOSA-N 1 0 345.443 3.629 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000480527914 1039666668 /nfs/dbraw/zinc/66/66/68/1039666668.db2.gz PKSSLRCHZYSYQU-GOSISDBHSA-N 1 0 340.427 3.621 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H]([NH+]2CCCC2)[C@H]1C ZINC000554874910 1039875118 /nfs/dbraw/zinc/87/51/18/1039875118.db2.gz OIXQBOQELHDBFT-ODZJZLKASA-N 1 0 329.444 3.557 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000481041934 1040291038 /nfs/dbraw/zinc/29/10/38/1040291038.db2.gz BJVBEMKIBHFFBP-MRXNPFEDSA-N 1 0 327.428 3.686 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)Cc1ccc(F)cc1 ZINC000555314487 1040411637 /nfs/dbraw/zinc/41/16/37/1040411637.db2.gz AXSMHBWNIZCHQG-LJQANCHMSA-N 1 0 346.402 3.548 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481168575 1040422671 /nfs/dbraw/zinc/42/26/71/1040422671.db2.gz MOGMJKQNBMWHFU-WMLDXEAASA-N 1 0 333.432 3.790 20 5 EHBDRO CC(C)CC[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070902 1040425566 /nfs/dbraw/zinc/42/55/66/1040425566.db2.gz SHXDMCSZTJPNKH-OAHLLOKOSA-N 1 0 333.432 3.824 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CC[C@H](C)C[C@@H]2C)cccc1[N+](=O)[O-] ZINC000481194431 1040471110 /nfs/dbraw/zinc/47/11/10/1040471110.db2.gz WALTYDWNKBGNKD-NZBPQXDJSA-N 1 0 333.432 3.645 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCOCc1ccccc1 ZINC000468749110 1040617132 /nfs/dbraw/zinc/61/71/32/1040617132.db2.gz IIRFDIGJLGZFBW-VBKFSLOCSA-N 1 0 326.396 3.805 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1N1CCCC1 ZINC000512749919 1040756831 /nfs/dbraw/zinc/75/68/31/1040756831.db2.gz OTSAFHWWWXHCAP-UHFFFAOYSA-N 1 0 339.439 3.870 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(C)(C)O ZINC000555627797 1040941637 /nfs/dbraw/zinc/94/16/37/1040941637.db2.gz OBMUDTYTKKCNKQ-QGZVFWFLSA-N 1 0 348.399 3.503 20 5 EHBDRO C[C@@H](O)CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000433172495 1040970766 /nfs/dbraw/zinc/97/07/66/1040970766.db2.gz CPNHHBKDQNZQRE-OAHLLOKOSA-N 1 0 343.427 3.613 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2[nH]c(=O)oc2c1)c1cccc([N+](=O)[O-])c1 ZINC000586789276 1041021158 /nfs/dbraw/zinc/02/11/58/1041021158.db2.gz LTMFBCMQBGTTJL-MNOVXSKESA-N 1 0 327.340 3.853 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2[nH]c(=O)oc2c1 ZINC000586789278 1041021872 /nfs/dbraw/zinc/02/18/72/1041021872.db2.gz LTMFBCMQBGTTJL-WDEREUQCSA-N 1 0 327.340 3.853 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc2[nH]c(=O)oc2c1 ZINC000586791498 1041024492 /nfs/dbraw/zinc/02/44/92/1041024492.db2.gz PKAVCJAOUKCECH-GHMZBOCLSA-N 1 0 327.340 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@@H+](C3CCCC3)CC2)c2ncccc12 ZINC000077994959 1041179422 /nfs/dbraw/zinc/17/94/22/1041179422.db2.gz BCQRUVIADVENHB-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C2)C1 ZINC000549572814 1042350069 /nfs/dbraw/zinc/35/00/69/1042350069.db2.gz UCSRZJBJFFXOOY-IBGZPJMESA-N 1 0 347.459 3.694 20 5 EHBDRO CC1CC[NH+](CCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000049844143 1042487886 /nfs/dbraw/zinc/48/78/86/1042487886.db2.gz PWIFBXFJOVPZMU-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO CCC1([NH3+])CCN([C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC1 ZINC000925757188 1042604275 /nfs/dbraw/zinc/60/42/75/1042604275.db2.gz FAPPVARLDJNABB-LJQANCHMSA-N 1 0 339.439 3.888 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000482006764 1042885980 /nfs/dbraw/zinc/88/59/80/1042885980.db2.gz IFLIZCUYCPOTIM-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1cc(NCCc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302103618 1042896434 /nfs/dbraw/zinc/89/64/34/1042896434.db2.gz WEISVOMQXUICPQ-UHFFFAOYSA-N 1 0 337.379 3.598 20 5 EHBDRO COCCCOc1cccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000125892126 1042936044 /nfs/dbraw/zinc/93/60/44/1042936044.db2.gz JZOGUDJZODRPHC-UHFFFAOYSA-N 1 0 344.411 3.608 20 5 EHBDRO CCCN(CC[NH+]1CCCC1)C(=O)Nc1cc(C)c([N+](=O)[O-])cc1C ZINC000482136958 1042947354 /nfs/dbraw/zinc/94/73/54/1042947354.db2.gz DDEHRLWEFVZUKP-UHFFFAOYSA-N 1 0 348.447 3.551 20 5 EHBDRO COCCN(Cc1cccs1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541995013 1043002706 /nfs/dbraw/zinc/00/27/06/1043002706.db2.gz BWEGQXDYVFKCHP-UHFFFAOYSA-N 1 0 340.832 3.958 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@@H](O)c3ccccc3)CC2)cc1 ZINC000041840391 1043015195 /nfs/dbraw/zinc/01/51/95/1043015195.db2.gz QFAIBFRKTCBSQB-IBGZPJMESA-N 1 0 326.396 3.540 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCCCC[C@@H]3CCO)o2)cc1 ZINC000585767883 1043030110 /nfs/dbraw/zinc/03/01/10/1043030110.db2.gz VVYKHCNOJQGCML-MRXNPFEDSA-N 1 0 344.411 3.982 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@H]2CC[C@@H](CO)CC2)c2ccccc2)c1 ZINC000585794323 1043039567 /nfs/dbraw/zinc/03/95/67/1043039567.db2.gz MKXATHSMUHLFEJ-CVAIRZPRSA-N 1 0 340.423 3.825 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CC=CCC1 ZINC000344030517 1043124283 /nfs/dbraw/zinc/12/42/83/1043124283.db2.gz BUJRFLLTAWBUPM-KBPBESRZSA-N 1 0 342.399 3.994 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000072727549 1126870623 /nfs/dbraw/zinc/87/06/23/1126870623.db2.gz POUAEWBQNWYCFR-UHFFFAOYSA-N 1 0 327.409 3.845 20 5 EHBDRO Cc1nn(C[N@H+](C)CCc2ccc(F)cc2)c2ccc([N+](=O)[O-])cc12 ZINC000764910006 1127550684 /nfs/dbraw/zinc/55/06/84/1127550684.db2.gz RMMAGBGRHMGTMD-UHFFFAOYSA-N 1 0 342.374 3.524 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000765252148 1127589262 /nfs/dbraw/zinc/58/92/62/1127589262.db2.gz RFQBMHXEUQVFIR-WMLDXEAASA-N 1 0 330.432 3.865 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000765252150 1127589270 /nfs/dbraw/zinc/58/92/70/1127589270.db2.gz RFQBMHXEUQVFIR-YOEHRIQHSA-N 1 0 330.432 3.865 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1COc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000765330373 1127598473 /nfs/dbraw/zinc/59/84/73/1127598473.db2.gz BEFIWOWWFRYWPU-KDOFPFPSSA-N 1 0 326.396 3.887 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2COc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000765333905 1127599353 /nfs/dbraw/zinc/59/93/53/1127599353.db2.gz NAEMEIGYMGQGHH-LSDHHAIUSA-N 1 0 326.396 3.805 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@@H]1C ZINC001168541729 1127623590 /nfs/dbraw/zinc/62/35/90/1127623590.db2.gz JWXZKDVVZARPHF-UXEPBGEESA-N 1 0 348.834 3.740 20 5 EHBDRO CCOc1cc([N+](=O)[O-])ccc1N1C[C@H](CC[NH3+])c2ccccc21 ZINC001168547865 1127700912 /nfs/dbraw/zinc/70/09/12/1127700912.db2.gz ASHXPRRZIIPBNX-ZDUSSCGKSA-N 1 0 327.384 3.578 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCC[C@H](C)C1 ZINC000301382740 1127740912 /nfs/dbraw/zinc/74/09/12/1127740912.db2.gz VGTHVIIEVNFOKO-NWDGAFQWSA-N 1 0 343.374 3.729 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCCC2)c1 ZINC000338642682 1127967591 /nfs/dbraw/zinc/96/75/91/1127967591.db2.gz UBSAVEBMSUWQGI-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508528 1128484278 /nfs/dbraw/zinc/48/42/78/1128484278.db2.gz AQIKWZGFWHYRPZ-NVXWUHKLSA-N 1 0 340.427 3.763 20 5 EHBDRO COc1cc(NC[C@H](c2cccs2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301527961 1128487191 /nfs/dbraw/zinc/48/71/91/1128487191.db2.gz ODTQIFYEGRFMPP-OAHLLOKOSA-N 1 0 347.440 3.914 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000301526046 1128487574 /nfs/dbraw/zinc/48/75/74/1128487574.db2.gz NHJULEPDKWJKBE-UHFFFAOYSA-N 1 0 343.374 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NC3CC[NH+](C4CCCC4)CC3)ccc2c1 ZINC000301575255 1128497766 /nfs/dbraw/zinc/49/77/66/1128497766.db2.gz YKPPJNBATXIBFS-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000301590277 1128504147 /nfs/dbraw/zinc/50/41/47/1128504147.db2.gz CSRFPFDYMLKVSO-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CCC[N@H+](Cc2ccccc2)CC1 ZINC000542698634 1128543669 /nfs/dbraw/zinc/54/36/69/1128543669.db2.gz ZDXDGDXGILNUAU-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCCCCC3)C2)n1 ZINC000542864957 1128711982 /nfs/dbraw/zinc/71/19/82/1128711982.db2.gz PNEKATWFCSQPKE-QGZVFWFLSA-N 1 0 346.475 3.699 20 5 EHBDRO Cc1nc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301647188 1128819112 /nfs/dbraw/zinc/81/91/12/1128819112.db2.gz OIXMYCMRDPCOMS-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCN2Cc3ccccc3C2)cc1[N+](=O)[O-] ZINC001648935238 1120237586 /nfs/dbraw/zinc/23/75/86/1120237586.db2.gz ACPYCTBOPAVQDE-UHFFFAOYSA-N 1 0 339.439 3.824 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CCC([NH+]2CCCCC2)CC1 ZINC000485740061 1120355676 /nfs/dbraw/zinc/35/56/76/1120355676.db2.gz VMSYUUVBOATKIT-MRXNPFEDSA-N 1 0 331.460 3.915 20 5 EHBDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486179 1120609618 /nfs/dbraw/zinc/60/96/18/1120609618.db2.gz YPVMKENUQWEDPL-HIFRSBDPSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000310302291 1128933392 /nfs/dbraw/zinc/93/33/92/1128933392.db2.gz QRHLCXDCNNNIIC-QGZVFWFLSA-N 1 0 325.412 3.919 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)O1 ZINC000495165379 1120973493 /nfs/dbraw/zinc/97/34/93/1120973493.db2.gz DTVMSKXWZPOMJG-MRXNPFEDSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1nc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)ccc1[N+](=O)[O-] ZINC000301692004 1128956635 /nfs/dbraw/zinc/95/66/35/1128956635.db2.gz XYGKZANBBDIXJU-OAHLLOKOSA-N 1 0 346.475 3.779 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@@H]1CCCN(C(=O)OC)C1)c1cccc([N+](=O)[O-])c1 ZINC000495562547 1121274219 /nfs/dbraw/zinc/27/42/19/1121274219.db2.gz ZJKADZAATMBGLS-LXZKKBNFSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCCC[C@H]2c2ccccc2)c1 ZINC000762634430 1121390608 /nfs/dbraw/zinc/39/06/08/1121390608.db2.gz PBBUJTREURDSHB-RBUKOAKNSA-N 1 0 326.396 3.855 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C3CCSCC3)o2)c([N+](=O)[O-])c1 ZINC000609223624 1121556108 /nfs/dbraw/zinc/55/61/08/1121556108.db2.gz QNQDWPCXVUEOEX-UHFFFAOYSA-N 1 0 348.424 3.849 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)CC2 ZINC000326034514 1121724232 /nfs/dbraw/zinc/72/42/32/1121724232.db2.gz ASRUPILRKGTVOT-KRWDZBQOSA-N 1 0 326.396 3.559 20 5 EHBDRO Cc1cc2ncc([C@@H](C)[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)c(C)n2n1 ZINC000193903199 1121727462 /nfs/dbraw/zinc/72/74/62/1121727462.db2.gz HSLJZSXPKWQIBO-QWHCGFSZSA-N 1 0 339.399 3.666 20 5 EHBDRO Cc1c(C[N@@H+]2CCCO[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609233631 1121825510 /nfs/dbraw/zinc/82/55/10/1121825510.db2.gz FMCLMZOGDWGEHI-IBGZPJMESA-N 1 0 326.396 3.867 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCCO[C@H](c3ccccc3)C2)cc1 ZINC000609234515 1121859919 /nfs/dbraw/zinc/85/99/19/1121859919.db2.gz TXCICFYAXWBQJH-IBGZPJMESA-N 1 0 326.396 3.601 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301115174 1121971713 /nfs/dbraw/zinc/97/17/13/1121971713.db2.gz XAWOMUIFCISKOT-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO CC(C)(CCc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153953688 1122132690 /nfs/dbraw/zinc/13/26/90/1122132690.db2.gz XJIXHKJQYORKPI-SFHVURJKSA-N 1 0 328.412 3.629 20 5 EHBDRO C[NH+](C)CCc1ccc(Nc2ccc([N+](=O)[O-])c3cnccc23)cc1 ZINC000301168024 1122219860 /nfs/dbraw/zinc/21/98/60/1122219860.db2.gz CWEBORMBEXYZAM-UHFFFAOYSA-N 1 0 336.395 3.991 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCC[C@@H]1O ZINC000497264041 1122428522 /nfs/dbraw/zinc/42/85/22/1122428522.db2.gz VZSCOOCIXQXDGY-KSSFIOAISA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)c1 ZINC000154493542 1122667115 /nfs/dbraw/zinc/66/71/15/1122667115.db2.gz POTZCJZWMPUMGU-UXHICEINSA-N 1 0 338.407 3.780 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000556198610 1122866586 /nfs/dbraw/zinc/86/65/86/1122866586.db2.gz GXYYCAVHNGCFOZ-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]C[C@@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000556251720 1122898400 /nfs/dbraw/zinc/89/84/00/1122898400.db2.gz DYGZFADFHLFCOO-RDJZCZTQSA-N 1 0 342.443 3.834 20 5 EHBDRO CCCC1(C[NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000556886847 1123167455 /nfs/dbraw/zinc/16/74/55/1123167455.db2.gz PINGDFUPKKBIBI-QGZVFWFLSA-N 1 0 342.443 3.978 20 5 EHBDRO CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000609571502 1123611057 /nfs/dbraw/zinc/61/10/57/1123611057.db2.gz LDZCTCPXXYGANF-ACJLOTCBSA-N 1 0 332.400 3.742 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCCCCC[NH+]1CCCCC1 ZINC000609553539 1123612292 /nfs/dbraw/zinc/61/22/92/1123612292.db2.gz YNTMGQXJTWPKPX-UHFFFAOYSA-N 1 0 348.447 3.681 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000610140409 1123734689 /nfs/dbraw/zinc/73/46/89/1123734689.db2.gz WGARNWADZXNQSL-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249651 1123752565 /nfs/dbraw/zinc/75/25/65/1123752565.db2.gz CTPDUXWRMYUOHR-HUUCEWRRSA-N 1 0 335.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H](c2ccco2)N2CCCC2)c1 ZINC000237828081 1123875707 /nfs/dbraw/zinc/87/57/07/1123875707.db2.gz KPZRSKPZOMWIEY-INIZCTEOSA-N 1 0 349.818 3.768 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([C@H]2CCOC2)CC1 ZINC000615837664 1123884844 /nfs/dbraw/zinc/88/48/44/1123884844.db2.gz UPZHNPPLYLOFAU-RXBGNRNISA-N 1 0 330.428 3.747 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H](C)[C@@H]1OC ZINC000617549836 1124648856 /nfs/dbraw/zinc/64/88/56/1124648856.db2.gz NKVAACKMBDSRIP-LQAWEQHXSA-N 1 0 347.415 3.665 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000734828963 1131282982 /nfs/dbraw/zinc/28/29/82/1131282982.db2.gz AENJLPJDKRVNLH-UHFFFAOYSA-N 1 0 343.431 3.569 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccccc3C3CC3)CC2)n1 ZINC000618821805 1125205666 /nfs/dbraw/zinc/20/56/66/1125205666.db2.gz KDEGTUXVCNEESE-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC([NH+]3CCC(C(F)(F)F)CC3)C2)s1 ZINC000619501092 1125356039 /nfs/dbraw/zinc/35/60/39/1125356039.db2.gz IYETYMACZTYFHQ-UHFFFAOYSA-N 1 0 349.378 3.874 20 5 EHBDRO C[C@@H]1CC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000619798688 1125407951 /nfs/dbraw/zinc/40/79/51/1125407951.db2.gz SROYOQCGLGXZSU-VXGBXAGGSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCCC[C@@H]([NH+]3CCCC3)C2)c1 ZINC000735493387 1131353177 /nfs/dbraw/zinc/35/31/77/1131353177.db2.gz PCQLBJJCLGIDPF-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CCC[C@H](C)[C@H]1C ZINC000255954959 1129237655 /nfs/dbraw/zinc/23/76/55/1129237655.db2.gz RBZUSPGXTIJVAZ-JGGQBBKZSA-N 1 0 333.432 3.646 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCO[C@@H]1CCCCO1 ZINC000922232194 1129383180 /nfs/dbraw/zinc/38/31/80/1129383180.db2.gz KLNAEDLTTPYUSR-NKAIQICCSA-N 1 0 334.416 3.521 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCC(C)(C)[NH2+][C@@H](C)c1ccccc1 ZINC000301950044 1129394728 /nfs/dbraw/zinc/39/47/28/1129394728.db2.gz GHBTVVFWCMLLOS-AWEZNQCLSA-N 1 0 328.416 3.840 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H](C)c1ccco1 ZINC000069070376 1129420675 /nfs/dbraw/zinc/42/06/75/1129420675.db2.gz HACRBZABMGNPOG-ZDUSSCGKSA-N 1 0 331.372 3.518 20 5 EHBDRO CC[C@H](c1ccncc1)[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC000092223841 1129537046 /nfs/dbraw/zinc/53/70/46/1129537046.db2.gz OUJFOOCZLVWJMX-GOSISDBHSA-N 1 0 329.400 3.842 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@@H]2C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092780763 1129561086 /nfs/dbraw/zinc/56/10/86/1129561086.db2.gz HJCBCZLAMHUJHV-GOSISDBHSA-N 1 0 340.427 3.760 20 5 EHBDRO CC(C)n1ncc2cc(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)cnc21 ZINC000922537520 1129565321 /nfs/dbraw/zinc/56/53/21/1129565321.db2.gz HUAPQRKJOAOSPW-CYBMUJFWSA-N 1 0 339.399 3.771 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccccc3)C2)c2ncccc12 ZINC000389446737 1129574953 /nfs/dbraw/zinc/57/49/53/1129574953.db2.gz VBBZXPNYBONRHB-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000922680886 1129621879 /nfs/dbraw/zinc/62/18/79/1129621879.db2.gz ZICBUZAPNBDVJD-YQRAZLAVSA-N 1 0 344.333 3.698 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ncccc1[N+](=O)[O-] ZINC000390863201 1129638948 /nfs/dbraw/zinc/63/89/48/1129638948.db2.gz NIFQJZBDHCSKTK-QGZVFWFLSA-N 1 0 340.427 3.702 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000124853523 1129640391 /nfs/dbraw/zinc/64/03/91/1129640391.db2.gz IKGCIRFRFDBAEG-FZKQIMNGSA-N 1 0 331.391 3.687 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)c1ccccc1[N+](=O)[O-] ZINC000509023722 1129661911 /nfs/dbraw/zinc/66/19/11/1129661911.db2.gz XXBAOINNRBRDJQ-JTQLQIEISA-N 1 0 336.294 3.767 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125433618 1129691814 /nfs/dbraw/zinc/69/18/14/1129691814.db2.gz FOXKSGOKCFWXCY-OLZOCXBDSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCCc3ccccc3)CC2)cc1 ZINC000125697502 1129710928 /nfs/dbraw/zinc/71/09/28/1129710928.db2.gz AYSNWUABGARISN-UHFFFAOYSA-N 1 0 340.423 3.819 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000056196390 1129805821 /nfs/dbraw/zinc/80/58/21/1129805821.db2.gz QFQBOBCLDYJMOH-STQMWFEESA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000056196389 1129805870 /nfs/dbraw/zinc/80/58/70/1129805870.db2.gz QFQBOBCLDYJMOH-QWHCGFSZSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1oc2ccccc2c1C ZINC000602810627 1129904114 /nfs/dbraw/zinc/90/41/14/1129904114.db2.gz NELRYIGNPOPTOY-GFCCVEGCSA-N 1 0 328.372 3.505 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCc2nc(C)ncc21 ZINC000766045806 1129935735 /nfs/dbraw/zinc/93/57/35/1129935735.db2.gz VXBJXQCNXVMYRN-SJCJKPOMSA-N 1 0 326.400 3.730 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000766046223 1129940074 /nfs/dbraw/zinc/94/00/74/1129940074.db2.gz WQGBMMOFDUYDOM-BLLLJJGKSA-N 1 0 326.400 3.730 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Cn2ccnc2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000173316607 1130205303 /nfs/dbraw/zinc/20/53/03/1130205303.db2.gz YJUXMNCGNUFARK-OAHLLOKOSA-N 1 0 336.395 3.690 20 5 EHBDRO COc1ccc(CCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173353710 1130216997 /nfs/dbraw/zinc/21/69/97/1130216997.db2.gz ZWBNTJWEWXXSLS-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1cnn([C@@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)c1 ZINC000245514987 1130228290 /nfs/dbraw/zinc/22/82/90/1130228290.db2.gz CXSDBPBANURGEM-NVXWUHKLSA-N 1 0 328.416 3.806 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000173455532 1130233899 /nfs/dbraw/zinc/23/38/99/1130233899.db2.gz JWXDANVZGVWJKS-CQSZACIVSA-N 1 0 348.424 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2csc(Br)c2)cc1 ZINC000040675973 1130242689 /nfs/dbraw/zinc/24/26/89/1130242689.db2.gz IEOWJMTWPZQPNS-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCC2)c1cccc([N+](=O)[O-])c1 ZINC000245900134 1130328816 /nfs/dbraw/zinc/32/88/16/1130328816.db2.gz RYFVWQPMPRDWLG-WNRNVDISSA-N 1 0 330.428 3.983 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCC[C@@H]3C[C@@H]32)ccc1Br ZINC000694622225 1130533278 /nfs/dbraw/zinc/53/32/78/1130533278.db2.gz KXEAUTODRGAGGU-NTZNESFSSA-N 1 0 325.206 3.636 20 5 EHBDRO C[C@H](C(=O)Nc1ccc(C[NH+](C)C)cc1)c1ccc([N+](=O)[O-])cc1F ZINC000347990818 1131112125 /nfs/dbraw/zinc/11/21/25/1131112125.db2.gz DCCHGHBRKAFMPR-LBPRGKRZSA-N 1 0 345.374 3.538 20 5 EHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059324 1131461886 /nfs/dbraw/zinc/46/18/86/1131461886.db2.gz XKSQBTZGXBOLFE-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCOC2CCC2)s1 ZINC000742386414 1131714202 /nfs/dbraw/zinc/71/42/02/1131714202.db2.gz DTTKIZLRTHEHMF-UHFFFAOYSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(O)c1 ZINC001172897982 1131882048 /nfs/dbraw/zinc/88/20/48/1131882048.db2.gz FQOJMQWHRDHWKY-GUYCJALGSA-N 1 0 326.396 3.899 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1cccc(O)c1 ZINC001172897983 1131882916 /nfs/dbraw/zinc/88/29/16/1131882916.db2.gz FQOJMQWHRDHWKY-SUMWQHHRSA-N 1 0 326.396 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H](CCO)c1ccccc1)CC2 ZINC001172898653 1131883042 /nfs/dbraw/zinc/88/30/42/1131883042.db2.gz IHXFKMXGFJWDDN-UYAOXDASSA-N 1 0 340.423 3.556 20 5 EHBDRO CC(C)(Cc1ccccn1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899875 1131884293 /nfs/dbraw/zinc/88/42/93/1131884293.db2.gz AANBZIONOLGOAR-KRWDZBQOSA-N 1 0 339.439 3.848 20 5 EHBDRO CCCCN(CC)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172900623 1131884301 /nfs/dbraw/zinc/88/43/01/1131884301.db2.gz WXALFGKAFPQYPN-GOSISDBHSA-N 1 0 333.476 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H](c1cccnc1)C1CC1)CC2 ZINC001172903229 1131886275 /nfs/dbraw/zinc/88/62/75/1131886275.db2.gz POXDQXFTCGMXHT-AZUAARDMSA-N 1 0 337.423 3.978 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172895645 1131902024 /nfs/dbraw/zinc/90/20/24/1131902024.db2.gz GTVVHRXQBXDHFE-GOSISDBHSA-N 1 0 339.439 3.768 20 5 EHBDRO C[N@H+](CCc1cccs1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000743383259 1131907381 /nfs/dbraw/zinc/90/73/81/1131907381.db2.gz AIONUQUJWDUJLB-UHFFFAOYSA-N 1 0 342.424 3.652 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1Cc3cnc(Cl)cc3C1)CC2 ZINC001172912794 1131917704 /nfs/dbraw/zinc/91/77/04/1131917704.db2.gz MHUCWHPRULWBNT-MRXNPFEDSA-N 1 0 343.814 3.906 20 5 EHBDRO [NH3+][C@H]1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc21 ZINC001172911021 1131917760 /nfs/dbraw/zinc/91/77/60/1131917760.db2.gz GTMXFBDMWFGDAS-LPHOPBHVSA-N 1 0 337.423 3.752 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CC(=O)N2C ZINC000743475670 1131928695 /nfs/dbraw/zinc/92/86/95/1131928695.db2.gz WKYLVXQHAZOLKY-STQMWFEESA-N 1 0 339.395 3.526 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCc3ccccc32)c1F ZINC001173179821 1131992610 /nfs/dbraw/zinc/99/26/10/1131992610.db2.gz QBMMMXOQZZLWAF-MLGOLLRUSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(F)c(F)c1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218556 1132003104 /nfs/dbraw/zinc/00/31/04/1132003104.db2.gz QBEBLBWYMFXLQM-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(F)c(F)c1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173218554 1132003430 /nfs/dbraw/zinc/00/34/30/1132003430.db2.gz QBEBLBWYMFXLQM-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2cccc(Cl)c2)COC1 ZINC001173219234 1132003455 /nfs/dbraw/zinc/00/34/55/1132003455.db2.gz ZKMIVWYYJNDVRM-CYBMUJFWSA-N 1 0 346.814 3.695 20 5 EHBDRO COc1ncccc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223625 1132005366 /nfs/dbraw/zinc/00/53/66/1132005366.db2.gz JGGABDJOCLZPRY-FZKQIMNGSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1cncc(F)c1)C1CC1 ZINC001173224926 1132005445 /nfs/dbraw/zinc/00/54/45/1132005445.db2.gz PGIKUXPQWHFQPA-SGTLLEGYSA-N 1 0 329.375 3.801 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(OC2CCC2)ccn1 ZINC001173225550 1132006247 /nfs/dbraw/zinc/00/62/47/1132006247.db2.gz RQICRFDYDUIESF-AWEZNQCLSA-N 1 0 341.411 3.642 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)C(C)(C)O ZINC001173225636 1132006484 /nfs/dbraw/zinc/00/64/84/1132006484.db2.gz UALBIAKTFKIDJG-KDOFPFPSSA-N 1 0 328.412 3.628 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](Oc2ccccc2)C1 ZINC001173226387 1132006727 /nfs/dbraw/zinc/00/67/27/1132006727.db2.gz JIWICESRZUYSAP-BEFAXECRSA-N 1 0 326.396 3.679 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCCOc1ccccc1 ZINC001173231207 1132009484 /nfs/dbraw/zinc/00/94/84/1132009484.db2.gz YNSYDERATORIIC-INIZCTEOSA-N 1 0 328.412 3.975 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCOC2(C)C)CC1 ZINC001173231474 1132009620 /nfs/dbraw/zinc/00/96/20/1132009620.db2.gz LKVFIAFTYONITM-OAHLLOKOSA-N 1 0 332.444 3.807 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCc2cc(F)ccc2C1 ZINC001173230957 1132009709 /nfs/dbraw/zinc/00/97/09/1132009709.db2.gz WSRNGQJXCAMGPY-UGSOOPFHSA-N 1 0 328.387 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C2CCCCC2)[C@@H](C)C1 ZINC001173237122 1132026559 /nfs/dbraw/zinc/02/65/59/1132026559.db2.gz HXYIFULWVDTYFY-SJORKVTESA-N 1 0 345.487 3.865 20 5 EHBDRO CC[C@]1(C)CCCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419587 1132086737 /nfs/dbraw/zinc/08/67/37/1132086737.db2.gz KONSKMUVQJYCFE-MRXNPFEDSA-N 1 0 339.823 3.699 20 5 EHBDRO CC[C@@H]1C[N@H+](Cn2nc(C)c([N+](=O)[O-])c2C)CC[C@H]1c1ccccc1 ZINC000746382292 1132504051 /nfs/dbraw/zinc/50/40/51/1132504051.db2.gz LLHYMIIRJVZQLA-SJLPKXTDSA-N 1 0 342.443 3.881 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054561 1132551707 /nfs/dbraw/zinc/55/17/07/1132551707.db2.gz SRISFMQUXGQWFE-LRPXVYOUSA-N 1 0 331.416 3.600 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H](C)c2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001168925818 1132598191 /nfs/dbraw/zinc/59/81/91/1132598191.db2.gz UVLHMFVILTXJLF-HNNXBMFYSA-N 1 0 344.411 3.950 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001168956347 1132620161 /nfs/dbraw/zinc/62/01/61/1132620161.db2.gz AXRQLSSOQZCFCA-SKDRFNHKSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccncc2C(F)(F)F)C2CC2)C1 ZINC001168997170 1132627779 /nfs/dbraw/zinc/62/77/79/1132627779.db2.gz BUEUFORJBUVEIR-IXPVHAAZSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2CCOc3cc(C(F)(F)F)ccc32)C1 ZINC001168999473 1132627839 /nfs/dbraw/zinc/62/78/39/1132627839.db2.gz UFTUXQRBLLOFSD-OSMZGAPFSA-N 1 0 344.333 3.564 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC3(CCCc4ccccc43)CC2)C1 ZINC001169010055 1132631868 /nfs/dbraw/zinc/63/18/68/1132631868.db2.gz AOABSPZCUPCVTO-WMZOPIPTSA-N 1 0 328.456 3.802 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccccc2)c2ccc(O)cc2)C1 ZINC001168989848 1132634711 /nfs/dbraw/zinc/63/47/11/1132634711.db2.gz XBMQGDMXRUARBO-LSBZLQRGSA-N 1 0 326.396 3.517 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040266 1132637818 /nfs/dbraw/zinc/63/78/18/1132637818.db2.gz ZFYBVASWXCFSPX-NHYWBVRUSA-N 1 0 328.334 3.509 20 5 EHBDRO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169046719 1132641949 /nfs/dbraw/zinc/64/19/49/1132641949.db2.gz MGIQHAOMOMFCIQ-DZGCQCFKSA-N 1 0 330.350 3.973 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](N2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052019 1132643017 /nfs/dbraw/zinc/64/30/17/1132643017.db2.gz FOHUXDDFXMMXCI-OCCSQVGLSA-N 1 0 329.425 3.571 20 5 EHBDRO Cc1csc(C[C@@H]2CCC[N@H+](Cc3cc(F)ccc3[N+](=O)[O-])C2)n1 ZINC001176218352 1132878721 /nfs/dbraw/zinc/87/87/21/1132878721.db2.gz PLICJFFFZYCHNO-ZDUSSCGKSA-N 1 0 349.431 3.954 20 5 EHBDRO COc1ccc(Nc2cccc3c2OCC[C@@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC001176362067 1132920492 /nfs/dbraw/zinc/92/04/92/1132920492.db2.gz RSNKWOCLYJCATA-HNNXBMFYSA-N 1 0 343.383 3.732 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767766839 1133050202 /nfs/dbraw/zinc/05/02/02/1133050202.db2.gz XXEMFNDEPUFUHT-RHSMWYFYSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2ccc(C(F)F)c(F)c2)cc1 ZINC001177683648 1133091080 /nfs/dbraw/zinc/09/10/80/1133091080.db2.gz NKRFQLRUFBGHGE-UHFFFAOYSA-N 1 0 340.301 3.840 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)CCc1ccccc1 ZINC001178295832 1133154509 /nfs/dbraw/zinc/15/45/09/1133154509.db2.gz WYRVQWIYGRGQQM-OAHLLOKOSA-N 1 0 328.412 3.962 20 5 EHBDRO Cc1c(C[NH2+]C[C@@](C)(Cc2ccccc2)[C@H](C)O)cccc1[N+](=O)[O-] ZINC001178648214 1133187869 /nfs/dbraw/zinc/18/78/69/1133187869.db2.gz VDEOJRCWOKKVHA-OXJNMPFZSA-N 1 0 342.439 3.623 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC[C@@H]1COc2ccccc2O1 ZINC001178978722 1133213989 /nfs/dbraw/zinc/21/39/89/1133213989.db2.gz ZSQYVVOIXPXVIG-OAHLLOKOSA-N 1 0 342.395 3.531 20 5 EHBDRO CC1(C)C[C@]1(C)C[NH2+]Cc1c(Br)cccc1[N+](=O)[O-] ZINC001179468525 1133253373 /nfs/dbraw/zinc/25/33/73/1133253373.db2.gz GIPPFGVQGNJSQN-CQSZACIVSA-N 1 0 327.222 3.883 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC001180359934 1133360813 /nfs/dbraw/zinc/36/08/13/1133360813.db2.gz YRNGTNPMYZQQEK-UHFFFAOYSA-N 1 0 342.395 3.615 20 5 EHBDRO Cc1cc(Cl)cc(C)c1CN(CC[NH3+])c1ccc([N+](=O)[O-])cc1 ZINC001181465034 1133490390 /nfs/dbraw/zinc/49/03/90/1133490390.db2.gz SXRPURMFMOZCMA-UHFFFAOYSA-N 1 0 333.819 3.830 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cc([N+](=O)[O-])c(C)cc1C ZINC000817544621 1133533670 /nfs/dbraw/zinc/53/36/70/1133533670.db2.gz CDMLATGMIVSRKS-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001181880664 1133546684 /nfs/dbraw/zinc/54/66/84/1133546684.db2.gz YETXRPVHPOQYFK-BLLLJJGKSA-N 1 0 326.824 3.789 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000774411881 1133673193 /nfs/dbraw/zinc/67/31/93/1133673193.db2.gz SMRTXRYOIYWLMX-RBUKOAKNSA-N 1 0 328.412 3.924 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CNC(=O)OC(C)(C)C ZINC000786821920 1133912157 /nfs/dbraw/zinc/91/21/57/1133912157.db2.gz WOGQWPQWVIXIDB-KADHNRKRSA-N 1 0 349.431 3.501 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](O)C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000746663143 1133974500 /nfs/dbraw/zinc/97/45/00/1133974500.db2.gz OHWXUJJTGLIRPD-IBGZPJMESA-N 1 0 346.402 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000774826207 1134026443 /nfs/dbraw/zinc/02/64/43/1134026443.db2.gz LYFBRKSBJYRBIJ-INIZCTEOSA-N 1 0 341.367 3.710 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000774844130 1134053294 /nfs/dbraw/zinc/05/32/94/1134053294.db2.gz RWSYVJYEXZKYFZ-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H]2COCc3cccc(Cl)c32)cc1 ZINC000788590158 1134148707 /nfs/dbraw/zinc/14/87/07/1134148707.db2.gz UTAFRRSNYUFLSB-INIZCTEOSA-N 1 0 332.787 3.652 20 5 EHBDRO CCO[C@@H](CC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788606738 1134150356 /nfs/dbraw/zinc/15/03/56/1134150356.db2.gz ADYLULQYJHAFOB-ACJLOTCBSA-N 1 0 335.448 3.813 20 5 EHBDRO CCO[C@@H](CC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788606744 1134150405 /nfs/dbraw/zinc/15/04/05/1134150405.db2.gz ADYLULQYJHAFOB-UGSOOPFHSA-N 1 0 335.448 3.813 20 5 EHBDRO COc1ccc(C(C)(C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788642014 1134155081 /nfs/dbraw/zinc/15/50/81/1134155081.db2.gz BWLNDIGTAVYNNE-CYBMUJFWSA-N 1 0 343.427 3.814 20 5 EHBDRO C[C@@H](NC[C@H]1CCC[N@@H+]1C1CCCCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788804147 1134171344 /nfs/dbraw/zinc/17/13/44/1134171344.db2.gz VBTXNANVUQWXDV-RHSMWYFYSA-N 1 0 346.475 3.625 20 5 EHBDRO CCN(CCC[NH+](CC)CC)c1nc2ccccc2cc1[N+](=O)[O-] ZINC001186155493 1134176028 /nfs/dbraw/zinc/17/60/28/1134176028.db2.gz AOLXJFBUWZJHBE-UHFFFAOYSA-N 1 0 330.432 3.701 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N2CC[NH+]([C@@H](C)c3ccccc3)CC2)c1 ZINC001187463075 1134337740 /nfs/dbraw/zinc/33/77/40/1134337740.db2.gz OEQAILYPZTZUEJ-INIZCTEOSA-N 1 0 325.412 3.786 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1F ZINC001190597235 1134725019 /nfs/dbraw/zinc/72/50/19/1134725019.db2.gz KXABDFKOJAHTDH-MRXNPFEDSA-N 1 0 344.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC001170295186 1134736019 /nfs/dbraw/zinc/73/60/19/1134736019.db2.gz APEWVENHRMQNFU-OAHLLOKOSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccc(C)s2)c([N+](=O)[O-])c1 ZINC001170297574 1134737605 /nfs/dbraw/zinc/73/76/05/1134737605.db2.gz PZNYLKJNYGMSHY-LBPRGKRZSA-N 1 0 334.441 3.737 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc3c(c2)CCC3)c([N+](=O)[O-])c1 ZINC001170298259 1134737908 /nfs/dbraw/zinc/73/79/08/1134737908.db2.gz HXEQGLRUAHGHEF-AWEZNQCLSA-N 1 0 340.423 3.813 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc(C)cn2)c([N+](=O)[O-])c1 ZINC001170306426 1134738633 /nfs/dbraw/zinc/73/86/33/1134738633.db2.gz UWYLLMMTZMRZFI-UONOGXRCSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170304251 1134739092 /nfs/dbraw/zinc/73/90/92/1134739092.db2.gz ALHFHCZLPDLGJO-KGLIPLIRSA-N 1 0 344.411 3.633 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC001170334318 1134751185 /nfs/dbraw/zinc/75/11/85/1134751185.db2.gz CAOBFZNSMDAYQN-GFCCVEGCSA-N 1 0 332.425 3.654 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC(F)(F)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170335492 1134752338 /nfs/dbraw/zinc/75/23/38/1134752338.db2.gz OOKZWXWHLAQASX-GFCCVEGCSA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2Cc3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170353122 1134754351 /nfs/dbraw/zinc/75/43/51/1134754351.db2.gz WGZOCBFUQGLFNY-LSDHHAIUSA-N 1 0 340.423 3.981 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H](CC2CC2)c2ccccc2)c1 ZINC000775422878 1134769653 /nfs/dbraw/zinc/76/96/53/1134769653.db2.gz LWNJUQXRFFWMJB-RTBURBONSA-N 1 0 326.396 3.759 20 5 EHBDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879227 1134810997 /nfs/dbraw/zinc/81/09/97/1134810997.db2.gz GPKSEPOWJBUJNU-HIFRSBDPSA-N 1 0 339.417 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCS[C@H]3CCCC[C@@H]32)cc1 ZINC001191368240 1134858378 /nfs/dbraw/zinc/85/83/78/1134858378.db2.gz YYKXFLVXSSLJKS-IRXDYDNUSA-N 1 0 336.457 3.724 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000793238149 1134886385 /nfs/dbraw/zinc/88/63/85/1134886385.db2.gz OAQYAIVUXXLFTE-MJGOQNOKSA-N 1 0 328.412 3.895 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789197 1134923042 /nfs/dbraw/zinc/92/30/42/1134923042.db2.gz GKABKYFLPKOGBC-YOEHRIQHSA-N 1 0 333.432 3.742 20 5 EHBDRO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)CC1(c2ccccc2)CC1 ZINC001193421238 1135138376 /nfs/dbraw/zinc/13/83/76/1135138376.db2.gz CIQYIEIQCIOEBV-UHFFFAOYSA-N 1 0 326.396 3.637 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[NH2+]C[C@@H]2CCCO2)o1 ZINC000078968757 1135141013 /nfs/dbraw/zinc/14/10/13/1135141013.db2.gz OFYCTSJKFFWJHS-LBPRGKRZSA-N 1 0 336.775 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](CCO)c2ccc(Cl)cc2)cc1F ZINC000805821392 1135337269 /nfs/dbraw/zinc/33/72/69/1135337269.db2.gz JPWXJJSAFIXZFD-OAHLLOKOSA-N 1 0 338.766 3.601 20 5 EHBDRO Cc1ccc(C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC2CC2)cn1 ZINC001195463131 1135427046 /nfs/dbraw/zinc/42/70/46/1135427046.db2.gz HDLCCGPQSONDBH-UHFFFAOYSA-N 1 0 341.411 3.589 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCCC[C@H]1C1CCC1 ZINC001195825508 1135477815 /nfs/dbraw/zinc/47/78/15/1135477815.db2.gz KKSXDCRYMKXAHS-SFHVURJKSA-N 1 0 345.443 3.886 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@]1(C)Cc1ccc(C)cc1 ZINC001196595338 1135582061 /nfs/dbraw/zinc/58/20/61/1135582061.db2.gz SBTSZDVGSYZOQJ-LJQANCHMSA-N 1 0 342.443 3.505 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1ccccc1)[NH+](C)C ZINC000807916420 1135588669 /nfs/dbraw/zinc/58/86/69/1135588669.db2.gz SXGLPDJVBLOVAC-GOSISDBHSA-N 1 0 327.384 3.512 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC[C@H](c1cccc(F)c1)[NH+](C)C ZINC000807917037 1135589406 /nfs/dbraw/zinc/58/94/06/1135589406.db2.gz IOZYZUOLFFDLPO-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CNCCC[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC001199329618 1135898047 /nfs/dbraw/zinc/89/80/47/1135898047.db2.gz XFHLEPUDEJFXGD-GASCZTMLSA-N 1 0 333.476 3.669 20 5 EHBDRO CC[C@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809964506 1135904455 /nfs/dbraw/zinc/90/44/55/1135904455.db2.gz MKKSOCQKNFWGBI-CQSZACIVSA-N 1 0 349.214 3.723 20 5 EHBDRO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCC[C@@H]1O ZINC000809973116 1135907293 /nfs/dbraw/zinc/90/72/93/1135907293.db2.gz ITOOKFSZXQFMKL-HZMBPMFUSA-N 1 0 347.242 3.885 20 5 EHBDRO CO[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[C@H]1C ZINC000809984857 1135908573 /nfs/dbraw/zinc/90/85/73/1135908573.db2.gz AYXNAZUUHMNPBW-RNCFNFMXSA-N 1 0 333.215 3.758 20 5 EHBDRO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])CC1([NH+](C)C)CCC1 ZINC000809985988 1135909198 /nfs/dbraw/zinc/90/91/98/1135909198.db2.gz WCFCUNXJDBVSTQ-UHFFFAOYSA-N 1 0 346.258 3.818 20 5 EHBDRO CC(C)[C@@H](C(=O)OCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+](C)C ZINC000811085628 1136047707 /nfs/dbraw/zinc/04/77/07/1136047707.db2.gz UUTHDROXLMFSII-LBPRGKRZSA-N 1 0 349.214 3.531 20 5 EHBDRO CN(C)c1cc[nH+]c(NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])c1 ZINC000811488934 1136092922 /nfs/dbraw/zinc/09/29/22/1136092922.db2.gz QGDVRKYFSTVPLA-UHFFFAOYSA-N 1 0 341.198 3.975 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCOCC(F)(F)F ZINC000811472362 1136095025 /nfs/dbraw/zinc/09/50/25/1136095025.db2.gz CAFDWFUDZFZXHP-UHFFFAOYSA-N 1 0 347.120 3.570 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479550 1136097483 /nfs/dbraw/zinc/09/74/83/1136097483.db2.gz HVRXDBQZIDHSQR-LKFCYVNXSA-N 1 0 335.231 3.788 20 5 EHBDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274363 1136129948 /nfs/dbraw/zinc/12/99/48/1136129948.db2.gz HFTLOTDYQPDFFQ-APPDUMDISA-N 1 0 336.338 3.599 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1SCC[NH+]1CCCC1 ZINC000776433594 1136188284 /nfs/dbraw/zinc/18/82/84/1136188284.db2.gz XFMRJERVBIQMMR-UHFFFAOYSA-N 1 0 331.235 3.545 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1SCCS1 ZINC000850560946 1136286024 /nfs/dbraw/zinc/28/60/24/1136286024.db2.gz PMIYEERPANCOIN-LLVKDONJSA-N 1 0 344.527 3.861 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCN(c3ccccc3F)C2)cc1Cl ZINC000814178679 1136411988 /nfs/dbraw/zinc/41/19/88/1136411988.db2.gz ZHWLJEPMPXZVIH-ZDUSSCGKSA-N 1 0 349.793 3.756 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589398 1136450548 /nfs/dbraw/zinc/45/05/48/1136450548.db2.gz RXSUDWBTYMYSEA-PKOBYXMFSA-N 1 0 328.412 3.581 20 5 EHBDRO C[N@@H+](Cc1ccc(Cl)c(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597183 1136457672 /nfs/dbraw/zinc/45/76/72/1136457672.db2.gz HUDNGQVMXAIFMK-INIZCTEOSA-N 1 0 338.766 3.553 20 5 EHBDRO CC(C)[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCC1 ZINC000110788970 1136477824 /nfs/dbraw/zinc/47/78/24/1136477824.db2.gz FMXDXKYNGYCHPH-UHFFFAOYSA-N 1 0 339.823 3.840 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CCCO2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000853240422 1136521599 /nfs/dbraw/zinc/52/15/99/1136521599.db2.gz GZWASNNHGHUPCA-QWHCGFSZSA-N 1 0 341.411 3.914 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@@H]([NH+]2CCCCC2)C1 ZINC000853299851 1136524851 /nfs/dbraw/zinc/52/48/51/1136524851.db2.gz UXGGIWNNPBPOFW-CYBMUJFWSA-N 1 0 325.359 3.597 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1ccccc1 ZINC000338956757 1136552879 /nfs/dbraw/zinc/55/28/79/1136552879.db2.gz VNOXLXBSSZBTIQ-UHFFFAOYSA-N 1 0 336.395 3.659 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(C3CCC3)cc2)cc1 ZINC000815124451 1136553907 /nfs/dbraw/zinc/55/39/07/1136553907.db2.gz YUFYJKYFCFLGTF-IBGZPJMESA-N 1 0 326.396 3.686 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2nc3ccc([N+](=O)[O-])cc3s2)C1 ZINC000853746950 1136560306 /nfs/dbraw/zinc/56/03/06/1136560306.db2.gz MSOIGERZHJOVEY-LLVKDONJSA-N 1 0 334.445 3.737 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NC[C@H]3CCC[N@H+](CC4CC4)C3)sc2c1 ZINC000853999654 1136579231 /nfs/dbraw/zinc/57/92/31/1136579231.db2.gz NPXBWHOOSIQRKT-CYBMUJFWSA-N 1 0 346.456 3.738 20 5 EHBDRO C[C@@H](OC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445441 1136596586 /nfs/dbraw/zinc/59/65/86/1136596586.db2.gz YSCJKCLJXBIIKR-KDOFPFPSSA-N 1 0 346.427 3.996 20 5 EHBDRO C[C@@H](Nc1ccc(C[NH+](C)C)c(F)c1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815613473 1136618910 /nfs/dbraw/zinc/61/89/10/1136618910.db2.gz OFHDIQQSMRLIDH-LLVKDONJSA-N 1 0 332.379 3.551 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)CC2)c1 ZINC000815626846 1136621347 /nfs/dbraw/zinc/62/13/47/1136621347.db2.gz NNWGDAOTYRUFTF-CYBMUJFWSA-N 1 0 341.411 3.568 20 5 EHBDRO C[C@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818979451 1136895987 /nfs/dbraw/zinc/89/59/87/1136895987.db2.gz MPHGTZHUYQACBY-DNVCBOLYSA-N 1 0 342.439 3.974 20 5 EHBDRO CC(C)(C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000819013686 1136902700 /nfs/dbraw/zinc/90/27/00/1136902700.db2.gz XYTJDFOXIBQISB-QGZVFWFLSA-N 1 0 348.830 3.849 20 5 EHBDRO Cc1cc(F)ccc1[C@@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819149701 1136914023 /nfs/dbraw/zinc/91/40/23/1136914023.db2.gz LASAEICWEWLGCA-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO CCCN(CCC[NH+](C)C)C(=O)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000861240572 1137098678 /nfs/dbraw/zinc/09/86/78/1137098678.db2.gz ZXLGGJYMOLYMSX-UHFFFAOYSA-N 1 0 343.427 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cc1F ZINC000823659936 1137108361 /nfs/dbraw/zinc/10/83/61/1137108361.db2.gz AFCHYEZJBOCGSD-QGZVFWFLSA-N 1 0 334.391 3.515 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@]2(CC2(F)F)C1 ZINC000844436975 1137222736 /nfs/dbraw/zinc/22/27/36/1137222736.db2.gz JXOIIJQSHFYJTJ-OAHLLOKOSA-N 1 0 326.343 3.615 20 5 EHBDRO CC(C)Oc1cccc(C[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000120567736 1137286558 /nfs/dbraw/zinc/28/65/58/1137286558.db2.gz XSBASRNQSNHPMO-IBGZPJMESA-N 1 0 344.411 3.547 20 5 EHBDRO Cc1nc(C)c(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866262911 1137340338 /nfs/dbraw/zinc/34/03/38/1137340338.db2.gz ILBREAIQASKRNC-JTQLQIEISA-N 1 0 337.420 3.571 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000846185661 1137340554 /nfs/dbraw/zinc/34/05/54/1137340554.db2.gz CENYXRQJMSFMIH-YZVOILCLSA-N 1 0 328.412 3.850 20 5 EHBDRO CC(C)n1cc([C@H](C)[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cn1 ZINC000866265577 1137340658 /nfs/dbraw/zinc/34/06/58/1137340658.db2.gz NVRRDDJOGDEPRN-OLZOCXBDSA-N 1 0 334.395 3.793 20 5 EHBDRO Cc1cnc([C@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866338782 1137347387 /nfs/dbraw/zinc/34/73/87/1137347387.db2.gz XOZQOLJNKQZMAK-GHMZBOCLSA-N 1 0 337.420 3.823 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@@H]1CCC12CCOCC2)C1CC1 ZINC000866529750 1137361721 /nfs/dbraw/zinc/36/17/21/1137361721.db2.gz SABPYSWBBKYHBH-ROUUACIJSA-N 1 0 344.455 3.712 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cc2c([nH]c1=O)CCCC2 ZINC000866641387 1137371906 /nfs/dbraw/zinc/37/19/06/1137371906.db2.gz SWNJOJLLTBUPBO-CYBMUJFWSA-N 1 0 341.411 3.733 20 5 EHBDRO Cn1cc([C@H]2C[N@H+](Cc3cc([N+](=O)[O-])ccc3Cl)CC2(C)C)cn1 ZINC000846929737 1137375988 /nfs/dbraw/zinc/37/59/88/1137375988.db2.gz YNANJUZRYFUKFU-OAHLLOKOSA-N 1 0 348.834 3.607 20 5 EHBDRO Cc1ccnc([C@@H]2CC[N@H+](Cc3ccc(Cl)c([N+](=O)[O-])c3)C2)c1 ZINC000846972735 1137377750 /nfs/dbraw/zinc/37/77/50/1137377750.db2.gz YJESTWKNCXGEEW-CQSZACIVSA-N 1 0 331.803 3.941 20 5 EHBDRO CC(C)(C)c1cnc(-n2c(CC[NH3+])cc3ccccc32)c([N+](=O)[O-])c1 ZINC001171300564 1137402620 /nfs/dbraw/zinc/40/26/20/1137402620.db2.gz BRQSWKGDVHCDCA-UHFFFAOYSA-N 1 0 338.411 3.732 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCO2 ZINC000122413612 1137436601 /nfs/dbraw/zinc/43/66/01/1137436601.db2.gz HKKQSUQFJDSJPR-KRWDZBQOSA-N 1 0 342.395 3.779 20 5 EHBDRO [NH3+]C[C@@H]1COc2ccccc2N1c1cc2cccnc2c2ncccc12 ZINC001171395353 1137469983 /nfs/dbraw/zinc/46/99/83/1137469983.db2.gz ZRLSDZQXWSKDEN-OAHLLOKOSA-N 1 0 342.402 3.641 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1c(C)nn(C)c1C ZINC000872032244 1137566523 /nfs/dbraw/zinc/56/65/23/1137566523.db2.gz YUTMNCISBOHYAJ-JTQLQIEISA-N 1 0 334.445 3.518 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038693 1137566884 /nfs/dbraw/zinc/56/68/84/1137566884.db2.gz OZMBRPKQGUDYRT-DZGCQCFKSA-N 1 0 332.375 3.551 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1ccc(C)o1 ZINC000872038450 1137566899 /nfs/dbraw/zinc/56/68/99/1137566899.db2.gz NQLHLVJMWZTTFF-RISCZKNCSA-N 1 0 336.413 3.602 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cnc(C)s1 ZINC000872050886 1137567927 /nfs/dbraw/zinc/56/79/27/1137567927.db2.gz DIQHSWFMJXOSBM-SNVBAGLBSA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872053526 1137568236 /nfs/dbraw/zinc/56/82/36/1137568236.db2.gz YFPRTTAYSBWWCF-LLVKDONJSA-N 1 0 333.319 3.535 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872060489 1137568841 /nfs/dbraw/zinc/56/88/41/1137568841.db2.gz QNSLLYCXFQRXLY-OLZOCXBDSA-N 1 0 336.363 3.625 20 5 EHBDRO COc1ccc(OC)c(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873007953 1137587924 /nfs/dbraw/zinc/58/79/24/1137587924.db2.gz AYTQOUVUWBRCQI-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000873184097 1137592913 /nfs/dbraw/zinc/59/29/13/1137592913.db2.gz BRWLVYKUOJPECC-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(N)cc(F)c2)cc1[N+](=O)[O-] ZINC000873289806 1137596647 /nfs/dbraw/zinc/59/66/47/1137596647.db2.gz ZAYRJIWPBQTSPE-LLVKDONJSA-N 1 0 333.363 3.566 20 5 EHBDRO C[N@@H+]1CCC[C@H]2[C@@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842443 1137624454 /nfs/dbraw/zinc/62/44/54/1137624454.db2.gz HMSGIULCUUKMML-PMACEKPBSA-N 1 0 345.446 3.697 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000876945378 1137665953 /nfs/dbraw/zinc/66/59/53/1137665953.db2.gz BNQCNJQYZJWGEL-MZFXBISCSA-N 1 0 328.349 3.968 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@]2(C1)OCc1ccccc12 ZINC000877399189 1137675432 /nfs/dbraw/zinc/67/54/32/1137675432.db2.gz LSGHKIAYAUQZBO-FQEVSTJZSA-N 1 0 338.407 3.843 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C3CCC4(CCCCC4)CC3)C2)c1 ZINC000877466350 1137677139 /nfs/dbraw/zinc/67/71/39/1137677139.db2.gz IHUCKOYCRVLJBC-UHFFFAOYSA-N 1 0 332.448 3.978 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000877690934 1137685949 /nfs/dbraw/zinc/68/59/49/1137685949.db2.gz WUFPQNZHMVEKOU-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000877730294 1137687118 /nfs/dbraw/zinc/68/71/18/1137687118.db2.gz USMMKZLNCUGPNI-XMHCIUCPSA-N 1 0 328.349 3.716 20 5 EHBDRO CC[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000877963274 1137697206 /nfs/dbraw/zinc/69/72/06/1137697206.db2.gz CMIOSTCLQGCWRT-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO C[C@@H]1C[C@@H](C)[N@H+](Cc2nnc(-c3ccc(Cl)cc3[N+](=O)[O-])o2)C1 ZINC000878127040 1137703555 /nfs/dbraw/zinc/70/35/55/1137703555.db2.gz XFIXYFZREWFYDK-NXEZZACHSA-N 1 0 336.779 3.529 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878128343 1137703599 /nfs/dbraw/zinc/70/35/99/1137703599.db2.gz CNZLIJAJKLBCMY-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]1CC[C@H](C)[NH+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878188208 1137706367 /nfs/dbraw/zinc/70/63/67/1137706367.db2.gz MBQNFXHBVWSJNH-UWVGGRQHSA-N 1 0 336.779 3.671 20 5 EHBDRO C[C@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)C1 ZINC000878403667 1137714568 /nfs/dbraw/zinc/71/45/68/1137714568.db2.gz DSGFYWZZABGBCX-GFCCVEGCSA-N 1 0 330.388 3.513 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878446570 1137716291 /nfs/dbraw/zinc/71/62/91/1137716291.db2.gz PDLUDBCLAGWANT-CQSZACIVSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CCC(C)([NH+](C)C)CC1 ZINC000878899226 1137731552 /nfs/dbraw/zinc/73/15/52/1137731552.db2.gz GKFDZNJESANPEG-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(F)CC1 ZINC000878989309 1137734453 /nfs/dbraw/zinc/73/44/53/1137734453.db2.gz ITTCYPOFGMFCBZ-HIFPTAJRSA-N 1 0 348.378 3.651 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@]12C[C@H]1CCCC2 ZINC000879263092 1137742828 /nfs/dbraw/zinc/74/28/28/1137742828.db2.gz KVNWKXWACKOATH-WRSAYESZSA-N 1 0 342.399 3.703 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879688729 1137755345 /nfs/dbraw/zinc/75/53/45/1137755345.db2.gz CSCUYTHNNQNJOS-KDOFPFPSSA-N 1 0 338.411 3.535 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000879964641 1137763606 /nfs/dbraw/zinc/76/36/06/1137763606.db2.gz MCVAZSJUWHJWBE-LBPRGKRZSA-N 1 0 346.349 3.597 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CCCCO2)CC1 ZINC000880455628 1137778908 /nfs/dbraw/zinc/77/89/08/1137778908.db2.gz AIGUBAFJJZAXCO-UHFFFAOYSA-N 1 0 334.416 3.529 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCCOC1 ZINC000880469016 1137779556 /nfs/dbraw/zinc/77/95/56/1137779556.db2.gz HOPXTISAXDIUCI-NHYWBVRUSA-N 1 0 346.349 3.908 20 5 EHBDRO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCOC1 ZINC000880469360 1137779610 /nfs/dbraw/zinc/77/96/10/1137779610.db2.gz KEDDAQTURDFCBJ-PBHICJAKSA-N 1 0 345.399 3.545 20 5 EHBDRO C[C@](CO)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000348253310 1137881197 /nfs/dbraw/zinc/88/11/97/1137881197.db2.gz DMQLSIHOZRZCDP-VQTJNVASSA-N 1 0 340.423 3.512 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC001202637625 1137903429 /nfs/dbraw/zinc/90/34/29/1137903429.db2.gz FKOYBFFXVCRVHU-OAHLLOKOSA-N 1 0 343.402 3.719 20 5 EHBDRO CN(Cc1ccccc1[N+](=O)[O-])C1CC[NH+](Cc2ccccc2)CC1 ZINC000114200264 1137916423 /nfs/dbraw/zinc/91/64/23/1137916423.db2.gz CWCVPSAQVVLTGN-UHFFFAOYSA-N 1 0 339.439 3.691 20 5 EHBDRO C[C@@H]1[C@H](C)SCC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000118417380 1137933700 /nfs/dbraw/zinc/93/37/00/1137933700.db2.gz XCGZTMJVADXCBW-OLZOCXBDSA-N 1 0 347.440 3.618 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000332487288 1137945214 /nfs/dbraw/zinc/94/52/14/1137945214.db2.gz YIGSWDHPALKSFE-LBPRGKRZSA-N 1 0 334.807 3.843 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](CCO)c1ccc(OC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000120282627 1137948035 /nfs/dbraw/zinc/94/80/35/1137948035.db2.gz RQHRFURZEFBQPP-MOPGFXCFSA-N 1 0 344.411 3.768 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C(C)C ZINC000120847575 1137952937 /nfs/dbraw/zinc/95/29/37/1137952937.db2.gz AGKYCBMVSUNIHB-QGZVFWFLSA-N 1 0 329.400 3.664 20 5 EHBDRO CO[C@@H](c1ccccc1Cl)[C@@H](C)[NH2+]Cc1cccnc1[N+](=O)[O-] ZINC000886116916 1138048507 /nfs/dbraw/zinc/04/85/07/1138048507.db2.gz VLEWLHJSIRRXRH-IAQYHMDHSA-N 1 0 335.791 3.509 20 5 EHBDRO CC1=Nc2ccccc2C12CC[NH+](Cc1cccnc1[N+](=O)[O-])CC2 ZINC000886267896 1138063029 /nfs/dbraw/zinc/06/30/29/1138063029.db2.gz WUIWLPWYGQEKCP-UHFFFAOYSA-N 1 0 336.395 3.630 20 5 EHBDRO Cc1[nH]c(C2CCN(Cc3ccc(Cl)cc3[N+](=O)[O-])CC2)[nH+]c1C ZINC000886659477 1138109870 /nfs/dbraw/zinc/10/98/70/1138109870.db2.gz NJPKUZUAFUPNJC-UHFFFAOYSA-N 1 0 348.834 3.968 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000074994518 1138125519 /nfs/dbraw/zinc/12/55/19/1138125519.db2.gz WHOXWNJRDKBCFS-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@@H](C)[C@H]3C)O2)cccc1[N+](=O)[O-] ZINC000886772362 1138137611 /nfs/dbraw/zinc/13/76/11/1138137611.db2.gz XGUVRZFXZGMNAX-XZLOLGPPSA-N 1 0 348.443 3.526 20 5 EHBDRO CCOC[C@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000081520230 1138169679 /nfs/dbraw/zinc/16/96/79/1138169679.db2.gz MLZRMVIIYBZNSA-HNNXBMFYSA-N 1 0 337.419 3.805 20 5 EHBDRO CCOC[C@@H]1CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000081520228 1138169838 /nfs/dbraw/zinc/16/98/38/1138169838.db2.gz MLZRMVIIYBZNSA-OAHLLOKOSA-N 1 0 337.419 3.805 20 5 EHBDRO CCOC[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093838972 1138241950 /nfs/dbraw/zinc/24/19/50/1138241950.db2.gz MTYZMJDLRAKORV-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000124746237 1138293758 /nfs/dbraw/zinc/29/37/58/1138293758.db2.gz ROLZCRWYFALSJK-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO C[C@@H](c1ccc(F)cc1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000336973207 1138438652 /nfs/dbraw/zinc/43/86/52/1138438652.db2.gz RRNYTIZUPFYTIA-ZDUSSCGKSA-N 1 0 345.374 3.756 20 5 EHBDRO COCc1ccc([C@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000130898908 1138483133 /nfs/dbraw/zinc/48/31/33/1138483133.db2.gz AWNOACVAGCRKQM-QGZVFWFLSA-N 1 0 330.384 3.714 20 5 EHBDRO COc1cc2c(cc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)O[C@H](C)C2 ZINC000132100412 1138561914 /nfs/dbraw/zinc/56/19/14/1138561914.db2.gz XVXCKEPGDHDXSJ-CHWSQXEVSA-N 1 0 342.395 3.778 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2csc([N+](=O)[O-])c2)CC1 ZINC000338379738 1138874590 /nfs/dbraw/zinc/87/45/90/1138874590.db2.gz ODNXEBJGRCJAGZ-UHFFFAOYSA-N 1 0 340.445 3.600 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743664 1139106502 /nfs/dbraw/zinc/10/65/02/1139106502.db2.gz NXZPLSONPVDFBG-SJCJKPOMSA-N 1 0 348.374 3.517 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(OC[C@H]2CCCCO2)CC1 ZINC000177606005 1139628515 /nfs/dbraw/zinc/62/85/15/1139628515.db2.gz CAYWDCYTRFLJKZ-HNAYVOBHSA-N 1 0 348.443 3.706 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000178331915 1139688286 /nfs/dbraw/zinc/68/82/86/1139688286.db2.gz PKXXTRZGILAMGH-CYWJYZIPSA-N 1 0 338.473 3.715 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000181563983 1139915797 /nfs/dbraw/zinc/91/57/97/1139915797.db2.gz KOKKMOKIJPSVSY-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO CC[C@H]([NH2+]Cc1cn(C)nc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000181584716 1139917571 /nfs/dbraw/zinc/91/75/71/1139917571.db2.gz NRQLUSKDHBLKTA-ZDUSSCGKSA-N 1 0 342.321 3.588 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@H](C)[C@H](n2ccnc2)C1 ZINC000182911799 1140000528 /nfs/dbraw/zinc/00/05/28/1140000528.db2.gz DJQBSAGIKSFGQZ-HDMKZQKVSA-N 1 0 328.416 3.744 20 5 EHBDRO CC(C)(O)c1ccc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cc1 ZINC000187498108 1140257771 /nfs/dbraw/zinc/25/77/71/1140257771.db2.gz WURVZWDJHNQLQL-FNORWQNLSA-N 1 0 326.396 3.625 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2ccccc2OC(F)F)cs1 ZINC000190883165 1140422365 /nfs/dbraw/zinc/42/23/65/1140422365.db2.gz IWDXRYLNCYXZEK-UHFFFAOYSA-N 1 0 328.340 3.590 20 5 EHBDRO Cc1noc(C)c1C[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192883085 1140553751 /nfs/dbraw/zinc/55/37/51/1140553751.db2.gz QLRMHLYFSGBNGL-ADLMAVQZSA-N 1 0 329.400 3.798 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]CCCC(F)(F)F)c1 ZINC000266634897 1140710369 /nfs/dbraw/zinc/71/03/69/1140710369.db2.gz SUOQIGLFUWPLQA-UHFFFAOYSA-N 1 0 328.237 3.628 20 5 EHBDRO CC(C)n1cnnc1[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924394 1140738574 /nfs/dbraw/zinc/73/85/74/1140738574.db2.gz MUKRJPMPPQTOKN-HUUCEWRRSA-N 1 0 343.431 3.708 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C[C@H](C)O)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000268983096 1141039156 /nfs/dbraw/zinc/03/91/56/1141039156.db2.gz DDKSWCOQGHMCDN-HDMKZQKVSA-N 1 0 328.412 3.800 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000269038367 1141052747 /nfs/dbraw/zinc/05/27/47/1141052747.db2.gz SVCCKDVZLWGODC-CJNGLKHVSA-N 1 0 341.411 3.684 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625586 1141128374 /nfs/dbraw/zinc/12/83/74/1141128374.db2.gz CJVFZWRAJVFQOA-SWLSCSKDSA-N 1 0 349.456 3.649 20 5 EHBDRO Cc1ccc(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000269928375 1141158782 /nfs/dbraw/zinc/15/87/82/1141158782.db2.gz MMGFFCICUKZIMP-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C)noc1C ZINC000271202081 1141323410 /nfs/dbraw/zinc/32/34/10/1141323410.db2.gz ZMRQFEVSIXCTMA-CYBMUJFWSA-N 1 0 335.429 3.860 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1ccc([N+](=O)[O-])cc1 ZINC000271518374 1141386084 /nfs/dbraw/zinc/38/60/84/1141386084.db2.gz PWECTCXBUYORTC-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCCc2[nH]c(=O)ccc21 ZINC000348933318 1141611140 /nfs/dbraw/zinc/61/11/40/1141611140.db2.gz IJHKYDYNXBETFK-RTGRKSDTSA-N 1 0 339.395 3.766 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000067743355 215200248 /nfs/dbraw/zinc/20/02/48/215200248.db2.gz OGMBXRWKKRAVRL-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cn2ccccc2n1 ZINC000568304507 370704100 /nfs/dbraw/zinc/70/41/00/370704100.db2.gz RXGYUNJTMCFDQT-HNNXBMFYSA-N 1 0 338.411 3.916 20 5 EHBDRO COc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2)[NH+]2CCCC2)cc1 ZINC000022342871 212292286 /nfs/dbraw/zinc/29/22/86/212292286.db2.gz GMHFVJTVRKLQAD-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO O=C(Nc1ccsc1Cl)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000186954171 1014627182 /nfs/dbraw/zinc/62/71/82/1014627182.db2.gz VWKXZOMNUSKMIK-UHFFFAOYSA-N 1 0 348.771 3.748 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ccc(C)nc2)CC1 ZINC000430209932 1014985970 /nfs/dbraw/zinc/98/59/70/1014985970.db2.gz ZQRUAHXKHUFDTF-UHFFFAOYSA-N 1 0 341.411 3.686 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@H]1Oc2ccccc2[C@@H]1C ZINC000430219830 1015086793 /nfs/dbraw/zinc/08/67/93/1015086793.db2.gz NWZFVASZVGGNBO-QUJCMNEKSA-N 1 0 342.395 3.646 20 5 EHBDRO COc1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1OC ZINC000126979184 1015149285 /nfs/dbraw/zinc/14/92/85/1015149285.db2.gz CFRCYHSVMCMYMJ-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CCC[C@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000154258357 1015320657 /nfs/dbraw/zinc/32/06/57/1015320657.db2.gz RSEYKXYFKWIAKM-JJAZEVLHSA-N 1 0 334.416 3.602 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](CC2CC2)C1 ZINC000339670819 1015491909 /nfs/dbraw/zinc/49/19/09/1015491909.db2.gz FUFRMWBBMHGYDF-GXTWGEPZSA-N 1 0 342.399 3.828 20 5 EHBDRO C[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CCOCC1 ZINC000134478549 1015557695 /nfs/dbraw/zinc/55/76/95/1015557695.db2.gz NLJIGBQCHHVBLV-GFCCVEGCSA-N 1 0 347.440 3.623 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCC1 ZINC000339729729 1015612957 /nfs/dbraw/zinc/61/29/57/1015612957.db2.gz OFGOQSGTIANXQI-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC([C@H]2CCCO2)CC1 ZINC000189208162 1016482663 /nfs/dbraw/zinc/48/26/63/1016482663.db2.gz LNEQPRWIWIEPIG-GOSISDBHSA-N 1 0 348.443 3.773 20 5 EHBDRO CCC[N@H+](CC(C)C)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC001167256269 1016783977 /nfs/dbraw/zinc/78/39/77/1016783977.db2.gz UTBAJTVJUIFGCI-GFCCVEGCSA-N 1 0 341.839 3.943 20 5 EHBDRO CC(C)(CO)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000136093556 1016803859 /nfs/dbraw/zinc/80/38/59/1016803859.db2.gz FTSVPXQVLVKJFI-UHFFFAOYSA-N 1 0 348.374 3.634 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000190002209 1016845409 /nfs/dbraw/zinc/84/54/09/1016845409.db2.gz DVCRRPGAIDUNFI-DOMZBBRYSA-N 1 0 337.420 3.549 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000247187978 1016918605 /nfs/dbraw/zinc/91/86/05/1016918605.db2.gz UHDQDNICDCNOQF-RTYDYXAVSA-N 1 0 338.473 3.634 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)O1 ZINC000414523197 1016950940 /nfs/dbraw/zinc/95/09/40/1016950940.db2.gz YAYBXJLDQCPTRX-RDBSUJKOSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000340334871 1016959914 /nfs/dbraw/zinc/95/99/14/1016959914.db2.gz VDCLWSTVWHQJIG-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1ccc2c(c1OC)CCN([C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000340978232 1017237002 /nfs/dbraw/zinc/23/70/02/1017237002.db2.gz UNRCCNJTKZAQSX-CYBMUJFWSA-N 1 0 342.395 3.731 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)c1 ZINC000538205854 1032202777 /nfs/dbraw/zinc/20/27/77/1032202777.db2.gz ZVXJKLXUCDMLSD-KRWDZBQOSA-N 1 0 348.834 3.966 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc2c(s1)CCCC2 ZINC000449138271 1032239557 /nfs/dbraw/zinc/23/95/57/1032239557.db2.gz HQSAVJVPFXNKPJ-ZDUSSCGKSA-N 1 0 345.468 3.693 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCO[C@H]1C(C)(C)C ZINC000449146226 1032247765 /nfs/dbraw/zinc/24/77/65/1032247765.db2.gz BJCKMUYYTHITTR-UWWQBHOKSA-N 1 0 334.460 3.957 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449188190 1032282360 /nfs/dbraw/zinc/28/23/60/1032282360.db2.gz NOXGTUICMSMXSI-SUMWQHHRSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000459622520 1032333987 /nfs/dbraw/zinc/33/39/87/1032333987.db2.gz YKHNGMOLPDLXTB-SJKOYZFVSA-N 1 0 330.388 3.703 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000459691621 1032418602 /nfs/dbraw/zinc/41/86/02/1032418602.db2.gz GKOPOHHWGWPRAH-YOEHRIQHSA-N 1 0 340.423 3.682 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CC3(CCCCC3)[C@H]2c2ccccc2)c1 ZINC000459757707 1032449796 /nfs/dbraw/zinc/44/97/96/1032449796.db2.gz UQQJQBYNTVDGBI-GOSISDBHSA-N 1 0 340.427 3.799 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H]2CSc3ccccc32)cc1[N+](=O)[O-] ZINC000449363876 1032478604 /nfs/dbraw/zinc/47/86/04/1032478604.db2.gz MRHVCUQHFHMCEF-ZDUSSCGKSA-N 1 0 330.409 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2=CCOCC2)s1 ZINC000449400162 1032524706 /nfs/dbraw/zinc/52/47/06/1032524706.db2.gz ADNMZILRLNSMAF-UHFFFAOYSA-N 1 0 330.409 3.760 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@H](CO)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000449446091 1032563451 /nfs/dbraw/zinc/56/34/51/1032563451.db2.gz OEPCUQWCBJLGPA-QGZVFWFLSA-N 1 0 334.803 3.722 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@H+]1CCCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000449453419 1032569879 /nfs/dbraw/zinc/56/98/79/1032569879.db2.gz MVZABNRCWVNIBJ-QILJAFDGSA-N 1 0 330.428 3.624 20 5 EHBDRO C[C@@H](CC(C)(C)O)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449454186 1032571546 /nfs/dbraw/zinc/57/15/46/1032571546.db2.gz YPAHKULBONQDBQ-LBPRGKRZSA-N 1 0 334.441 3.962 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC000449438675 1032582205 /nfs/dbraw/zinc/58/22/05/1032582205.db2.gz RIFJZEKVGUORFY-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H](CO)c1ccccc1 ZINC000449460830 1032577390 /nfs/dbraw/zinc/57/73/90/1032577390.db2.gz ZYNGXDJNWKVRJB-LSSBLYJVSA-N 1 0 326.396 3.664 20 5 EHBDRO COc1cccc(COCC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090806472 1032597811 /nfs/dbraw/zinc/59/78/11/1032597811.db2.gz BQDHJNHQLPMIRZ-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CCc1ncc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495978 1032665561 /nfs/dbraw/zinc/66/55/61/1032665561.db2.gz FRTSOAGWFZMLTM-AWEZNQCLSA-N 1 0 331.441 3.993 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]C[C@@]1(CO)C[C@H]1c1ccccc1 ZINC000289927273 1032676653 /nfs/dbraw/zinc/67/66/53/1032676653.db2.gz SRCUMVJZGINAQJ-FUHWJXTLSA-N 1 0 346.814 3.504 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2c1CCCC2 ZINC000290245940 1017173265 /nfs/dbraw/zinc/17/32/65/1017173265.db2.gz VEQOGESLZHNJCB-ZDUSSCGKSA-N 1 0 329.400 3.573 20 5 EHBDRO C[C@@H]1CC[NH2+]C[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414910386 1017302248 /nfs/dbraw/zinc/30/22/48/1017302248.db2.gz COSOXRMXUBGYDE-BDJLRTHQSA-N 1 0 349.818 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+]C2CC(C(F)(F)F)C2)c1 ZINC000574074634 1032692007 /nfs/dbraw/zinc/69/20/07/1032692007.db2.gz YEVZXOZZSACPSP-UHFFFAOYSA-N 1 0 340.248 3.627 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[NH2+]1 ZINC000414947341 1017347920 /nfs/dbraw/zinc/34/79/20/1017347920.db2.gz KSHWCMUUFSKSCW-OLZOCXBDSA-N 1 0 331.441 3.553 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)N1C[C@H](C)C[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000181541364 1017425176 /nfs/dbraw/zinc/42/51/76/1017425176.db2.gz ACOMFFROJININW-KRXQYRFLSA-N 1 0 347.459 3.529 20 5 EHBDRO CC1(C)[NH2+]CC[C@@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415030530 1017429495 /nfs/dbraw/zinc/42/94/95/1017429495.db2.gz COXYKCGXUIHCRH-INIZCTEOSA-N 1 0 331.441 3.553 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000377237780 1017513590 /nfs/dbraw/zinc/51/35/90/1017513590.db2.gz JJAAWQQJODIPTA-HZPDHXFCSA-N 1 0 342.395 3.713 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2cccnc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000610281281 1017608268 /nfs/dbraw/zinc/60/82/68/1017608268.db2.gz AHSLAZZDVOFQIO-WFASDCNBSA-N 1 0 332.429 3.546 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3C[C@H]4CCCC[C@@H]4C3)o2)c1 ZINC000177528985 1017688159 /nfs/dbraw/zinc/68/81/59/1017688159.db2.gz ZKEDRILMUOVMMF-HZPDHXFCSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H]1C[C@H]2CCCC[C@@H]2[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000118850289 1017992699 /nfs/dbraw/zinc/99/26/99/1017992699.db2.gz DOGKNZKQZLWAKG-IOASZLSFSA-N 1 0 342.399 3.798 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)c(Cl)c1 ZINC000449544019 1032736617 /nfs/dbraw/zinc/73/66/17/1032736617.db2.gz VAWJUWVJTBOIIH-PBHICJAKSA-N 1 0 347.802 3.653 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1c(C)nn(C)c1C ZINC000468622634 1018405250 /nfs/dbraw/zinc/40/52/50/1018405250.db2.gz QCYJSNTUBZBGFO-KAMYIIQDSA-N 1 0 342.443 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCn3ccnc3)s2)cc1 ZINC000102419170 1018524398 /nfs/dbraw/zinc/52/43/98/1018524398.db2.gz RDXSIMCJLQSGHC-UHFFFAOYSA-N 1 0 342.424 3.700 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(Cc1ccco1)C1CC[NH+](C)CC1 ZINC000290387270 1018570980 /nfs/dbraw/zinc/57/09/80/1018570980.db2.gz IMSRDXZONIIECI-UHFFFAOYSA-N 1 0 343.427 3.593 20 5 EHBDRO Cc1cnc(NC2CC[NH+]([C@H](C)c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000078664435 1018855223 /nfs/dbraw/zinc/85/52/23/1018855223.db2.gz QDQGPOWCQOPNPX-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000182314099 1018965188 /nfs/dbraw/zinc/96/51/88/1018965188.db2.gz GJOSTEKFVXNILK-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000548075195 1018999027 /nfs/dbraw/zinc/99/90/27/1018999027.db2.gz XGALUINHRBIZIA-FZMZJTMJSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120589944 1019074023 /nfs/dbraw/zinc/07/40/23/1019074023.db2.gz LJOUMRRAWKOZFI-QWHCGFSZSA-N 1 0 330.432 3.535 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CSc2ccccc2O1)c1ccc([N+](=O)[O-])cc1 ZINC000579711998 1019598392 /nfs/dbraw/zinc/59/83/92/1019598392.db2.gz LNTPFDMAMBXQGY-IUODEOHRSA-N 1 0 330.409 3.799 20 5 EHBDRO O=C1OCCN1CCC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000728300957 1019600823 /nfs/dbraw/zinc/60/08/23/1019600823.db2.gz FRNNLBBZWDKYFP-UHFFFAOYSA-N 1 0 334.419 3.925 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000513455769 1019690197 /nfs/dbraw/zinc/69/01/97/1019690197.db2.gz NOKGISOKMQSRGP-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO CC(C)[C@@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000175863140 1020067291 /nfs/dbraw/zinc/06/72/91/1020067291.db2.gz BYHHMMGUNVKKSN-OAHLLOKOSA-N 1 0 338.791 3.615 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@@H]1CC[N@@H+](C2CC2)C1 ZINC000320050007 1020078191 /nfs/dbraw/zinc/07/81/91/1020078191.db2.gz SHMCJOCBPBAGGL-JTQLQIEISA-N 1 0 329.322 3.510 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC[C@H]1CC[N@@H+](C2CC2)C1 ZINC000320050014 1020079136 /nfs/dbraw/zinc/07/91/36/1020079136.db2.gz SHMCJOCBPBAGGL-SNVBAGLBSA-N 1 0 329.322 3.510 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1N1CCN(Cc2ccccc2)CC1 ZINC000309714708 1020862035 /nfs/dbraw/zinc/86/20/35/1020862035.db2.gz KJMRMGPWYAEEDD-UHFFFAOYSA-N 1 0 331.803 3.570 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602511487 1032946090 /nfs/dbraw/zinc/94/60/90/1032946090.db2.gz SYENWQFOTKZEIP-RHSMWYFYSA-N 1 0 332.448 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@@H]2CCc3ccccc32)cc1F ZINC000276270536 1020983889 /nfs/dbraw/zinc/98/38/89/1020983889.db2.gz CSXDPFDLTXTHKC-GOSISDBHSA-N 1 0 344.386 3.606 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc(F)cc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000187419811 1021090638 /nfs/dbraw/zinc/09/06/38/1021090638.db2.gz VKNPKYQIIMLSQJ-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@H](CO)CC3)s2)cc1 ZINC000581599303 1021132242 /nfs/dbraw/zinc/13/22/42/1021132242.db2.gz ZUTQKCNKURPPEE-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1)c1ccccc1 ZINC000602524596 1032958657 /nfs/dbraw/zinc/95/86/57/1032958657.db2.gz MYLZYHOSVQRQMS-GOSISDBHSA-N 1 0 340.427 3.700 20 5 EHBDRO CC(C)(C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1cccs1 ZINC000602557286 1032970056 /nfs/dbraw/zinc/97/00/56/1032970056.db2.gz NNCGYPDCVBFTIM-UHFFFAOYSA-N 1 0 331.397 3.865 20 5 EHBDRO CCS[C@@H]1CCC[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000602567745 1032978681 /nfs/dbraw/zinc/97/86/81/1032978681.db2.gz KUHCFNCHZQNZDN-DGCLKSJQSA-N 1 0 335.429 3.890 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](CO)Cc1cccc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000467410715 1021455406 /nfs/dbraw/zinc/45/54/06/1021455406.db2.gz JUKADGWYVKSDLC-QUCCMNQESA-N 1 0 342.439 3.938 20 5 EHBDRO CCC(CC)[C@@H]1C[C@@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCO1 ZINC000602590254 1032988539 /nfs/dbraw/zinc/98/85/39/1032988539.db2.gz YGCNKDOCWISTEA-GUYCJALGSA-N 1 0 347.415 3.809 20 5 EHBDRO COc1cccc(C[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000090909951 1021685102 /nfs/dbraw/zinc/68/51/02/1021685102.db2.gz NPOJTPSDHSLWQG-HXUWFJFHSA-N 1 0 340.423 3.757 20 5 EHBDRO CC(C)C[C@H](CO)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000519847312 1021722729 /nfs/dbraw/zinc/72/27/29/1021722729.db2.gz KMIYZZZEVSHFLP-MRXNPFEDSA-N 1 0 332.400 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@](O)(C4CC4)C3)s2)cc1 ZINC000426499375 1021743510 /nfs/dbraw/zinc/74/35/10/1021743510.db2.gz QOEQLCUXRBWYOL-GOSISDBHSA-N 1 0 344.436 3.670 20 5 EHBDRO CC(C)[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000438489440 1022042923 /nfs/dbraw/zinc/04/29/23/1022042923.db2.gz JIQFGKRFHAJVPN-OAHLLOKOSA-N 1 0 329.400 3.770 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCC[C@H]3CCOC3)o2)c1 ZINC000449678283 1033026664 /nfs/dbraw/zinc/02/66/64/1033026664.db2.gz AGKBTDDUFFIMLB-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO C[NH2+]C1C[C@H]2CC[C@@H](C1)N2C(=O)c1c2ccccc2nc2ccccc21 ZINC001270260900 1022116062 /nfs/dbraw/zinc/11/60/62/1022116062.db2.gz IGOOCVBDAFBAFD-MQVJKMGUSA-N 1 0 345.446 3.743 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCC(F)(F)CC1 ZINC000602663830 1033061055 /nfs/dbraw/zinc/06/10/55/1033061055.db2.gz WHPHDZPMCDWBFE-UHFFFAOYSA-N 1 0 325.315 3.746 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c1[N+](=O)[O-] ZINC000894579723 1022582442 /nfs/dbraw/zinc/58/24/42/1022582442.db2.gz AGUQYGUFNBXVDA-LLVKDONJSA-N 1 0 344.358 3.614 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226142 1022587445 /nfs/dbraw/zinc/58/74/45/1022587445.db2.gz WFRQDXZGIGODBT-OLZOCXBDSA-N 1 0 342.436 3.849 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000894737635 1022818464 /nfs/dbraw/zinc/81/84/64/1022818464.db2.gz AYOCSIRDIZWTCN-DOTOQJQBSA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@@H]1C[NH2+]CC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942851 1022928073 /nfs/dbraw/zinc/92/80/73/1022928073.db2.gz NCOKEUMGQYQKJU-BZNIZROVSA-N 1 0 349.818 3.596 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@]23C[C@H]2CCCC3)cc1Br ZINC000602733064 1033124542 /nfs/dbraw/zinc/12/45/42/1033124542.db2.gz SGWAVFMKAJCLRP-PRHODGIISA-N 1 0 331.235 3.841 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCC[C@H]2O)s1 ZINC000449734291 1033130094 /nfs/dbraw/zinc/13/00/94/1033130094.db2.gz BDCLSDPTMGLJOF-BLLLJJGKSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H](O)C3CCC3)s2)cc1 ZINC000449738903 1033139369 /nfs/dbraw/zinc/13/93/69/1033139369.db2.gz GTNKVUKGOLFXLK-MRXNPFEDSA-N 1 0 332.425 3.574 20 5 EHBDRO CCc1ccc([C@H]2CCCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259672 1023945155 /nfs/dbraw/zinc/94/51/55/1023945155.db2.gz WJVMGTDWXNOLEJ-OAHLLOKOSA-N 1 0 332.404 3.564 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NCc1ccc(OCCC[NH+](C)C)cc1 ZINC000474143101 1024386998 /nfs/dbraw/zinc/38/69/98/1024386998.db2.gz RVUUURQZNSJRMR-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C2(c3cccc(C)c3)CCC2)c1[N+](=O)[O-] ZINC000895103906 1024406187 /nfs/dbraw/zinc/40/61/87/1024406187.db2.gz DDNXYKACGKWDAI-UHFFFAOYSA-N 1 0 342.395 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCCN(Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842109 1033219530 /nfs/dbraw/zinc/21/95/30/1033219530.db2.gz QCBRTOIAYXFLBG-HNNXBMFYSA-N 1 0 342.399 3.625 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](CC(C)C)CC(C)(C)C ZINC000474206887 1024578366 /nfs/dbraw/zinc/57/83/66/1024578366.db2.gz HLGYJVPBUOLCPO-UHFFFAOYSA-N 1 0 335.448 3.846 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)C[C@H]1C ZINC000538937426 1024624802 /nfs/dbraw/zinc/62/48/02/1024624802.db2.gz RXEDLIPLELGNDY-YPMHNXCESA-N 1 0 343.374 3.505 20 5 EHBDRO C[C@H](O)C(C)(C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000536496808 1024690899 /nfs/dbraw/zinc/69/08/99/1024690899.db2.gz HQJTVZAWROXJAH-AWEZNQCLSA-N 1 0 343.427 3.612 20 5 EHBDRO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC[C@H]1[NH3+] ZINC000435395022 1024881872 /nfs/dbraw/zinc/88/18/72/1024881872.db2.gz NUSAJONQPWLZPL-MEDUHNTESA-N 1 0 349.818 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(CNC3CC(F)(F)C3)cs2)c1 ZINC000277399355 1024925223 /nfs/dbraw/zinc/92/52/23/1024925223.db2.gz DXNXGCKRDZTJPS-UHFFFAOYSA-N 1 0 325.340 3.606 20 5 EHBDRO CCN(CC[NH+]1CCCCCC1)C(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000514959735 1024932515 /nfs/dbraw/zinc/93/25/15/1024932515.db2.gz OXCLPPOWDFGDER-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539224492 1024968925 /nfs/dbraw/zinc/96/89/25/1024968925.db2.gz AAFVTUXCPWNJQP-GUYCJALGSA-N 1 0 330.384 3.760 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000508330764 1025028901 /nfs/dbraw/zinc/02/89/01/1025028901.db2.gz IETUPDJSDNIBFT-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO COC1(OC)CC2(C[N@H+](Cc3cccc([N+](=O)[O-])c3C)[C@H]2C(C)C)C1 ZINC000895987852 1025044485 /nfs/dbraw/zinc/04/44/85/1025044485.db2.gz JJVFVQXOQDVVSG-KRWDZBQOSA-N 1 0 348.443 3.513 20 5 EHBDRO COc1ccccc1N1CC[C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000119617069 1025079369 /nfs/dbraw/zinc/07/93/69/1025079369.db2.gz QPKHYCVZTDYLAN-GDBMZVCRSA-N 1 0 341.411 3.533 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000521099628 1025203501 /nfs/dbraw/zinc/20/35/01/1025203501.db2.gz IARIESXULSDYSK-INIZCTEOSA-N 1 0 348.447 3.679 20 5 EHBDRO COCC[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@H](C)c1ccccc1 ZINC000521221373 1025280169 /nfs/dbraw/zinc/28/01/69/1025280169.db2.gz AQSBFJCMRHZKGP-MRXNPFEDSA-N 1 0 344.411 3.683 20 5 EHBDRO COc1ccc(OCC[NH+]2CCC(C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC001167548598 1025301412 /nfs/dbraw/zinc/30/14/12/1025301412.db2.gz CIQRUNPGKVXBLA-UHFFFAOYSA-N 1 0 348.443 3.884 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2ccn(C)n2)C1 ZINC000896493847 1025495821 /nfs/dbraw/zinc/49/58/21/1025495821.db2.gz WOBMZGKROULLQA-HKBKRHGFSA-N 1 0 340.427 3.611 20 5 EHBDRO CCc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000451097309 1025514511 /nfs/dbraw/zinc/51/45/11/1025514511.db2.gz DHNPWABZZBELGT-KBPBESRZSA-N 1 0 341.411 3.835 20 5 EHBDRO O=C(CC[NH2+]CCC1=CCCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000521614288 1025527923 /nfs/dbraw/zinc/52/79/23/1025527923.db2.gz GMEOLPZDHANAKI-UHFFFAOYSA-N 1 0 331.416 3.794 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H](c3ncc4n3CCCC4)C2)c1 ZINC000281881085 1025633349 /nfs/dbraw/zinc/63/33/49/1025633349.db2.gz AJDVYKRUQGYTBW-INIZCTEOSA-N 1 0 340.427 3.507 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443001280 1025642316 /nfs/dbraw/zinc/64/23/16/1025642316.db2.gz PSIQZXDWDHEONN-OXQOHEQNSA-N 1 0 341.455 3.993 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213763 1025679915 /nfs/dbraw/zinc/67/99/15/1025679915.db2.gz WFIMYFNFGPIAOV-KBXCAEBGSA-N 1 0 341.411 3.972 20 5 EHBDRO CCCOc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000521829770 1025695016 /nfs/dbraw/zinc/69/50/16/1025695016.db2.gz SBEWYPSXQDDNSS-UHFFFAOYSA-N 1 0 344.411 3.725 20 5 EHBDRO Cc1c(C[N@@H+]2CC3(CCC3)[C@H]2C2CCOCC2)cccc1[N+](=O)[O-] ZINC000425547187 1025722317 /nfs/dbraw/zinc/72/23/17/1025722317.db2.gz FNZVVYYCLFFIPU-GOSISDBHSA-N 1 0 330.428 3.684 20 5 EHBDRO COC[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000540617150 1025812827 /nfs/dbraw/zinc/81/28/27/1025812827.db2.gz BMQZDPYYMXNTSS-AATOQMJSSA-N 1 0 330.359 3.724 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NCc1ccccc1C[NH+]1CCCC1 ZINC000014673092 1025865290 /nfs/dbraw/zinc/86/52/90/1025865290.db2.gz MSAKENBIONQYMC-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccccc2OCc2ccncc2)cc1 ZINC000338171716 1025951209 /nfs/dbraw/zinc/95/12/09/1025951209.db2.gz BETXJNXRMIBESF-UHFFFAOYSA-N 1 0 349.390 3.859 20 5 EHBDRO C[C@H](CC[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)OCc1ccccc1 ZINC000530548277 1026031968 /nfs/dbraw/zinc/03/19/68/1026031968.db2.gz JPZSILILHRIFNF-MRXNPFEDSA-N 1 0 340.423 3.948 20 5 EHBDRO CCN(CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC(F)(F)F ZINC000475154829 1026251557 /nfs/dbraw/zinc/25/15/57/1026251557.db2.gz GZEQYCNDZZFICX-LBPRGKRZSA-N 1 0 333.354 3.520 20 5 EHBDRO COc1cc(C[NH+]2CCC(C)(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000339257505 1026464790 /nfs/dbraw/zinc/46/47/90/1026464790.db2.gz VVYPOZIIECGWEF-UHFFFAOYSA-N 1 0 344.358 3.827 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000452124254 1026492613 /nfs/dbraw/zinc/49/26/13/1026492613.db2.gz WFOCLNLHSFQEQU-AWEZNQCLSA-N 1 0 345.365 3.528 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC(C[NH+]3CCCCCC3)CC2)n1 ZINC000611615795 1026539125 /nfs/dbraw/zinc/53/91/25/1026539125.db2.gz FVVGELJJYMJSTE-UHFFFAOYSA-N 1 0 346.475 3.699 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](OCCCc2ccccc2)C1 ZINC000531209317 1026688411 /nfs/dbraw/zinc/68/84/11/1026688411.db2.gz WASWVBNSVJZHDP-LJQANCHMSA-N 1 0 340.423 3.819 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCCOc1ccc(F)cc1 ZINC000520041087 1026689049 /nfs/dbraw/zinc/68/90/49/1026689049.db2.gz KIQFULQULLKNFL-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000121298800 1026756969 /nfs/dbraw/zinc/75/69/69/1026756969.db2.gz OEWUNTVKAPVBLR-GFCCVEGCSA-N 1 0 347.802 3.562 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NCc1ccc(OC)c([N+](=O)[O-])c1 ZINC000531430327 1026901708 /nfs/dbraw/zinc/90/17/08/1026901708.db2.gz WIDHFSHWPBAXQF-DLBZAZTESA-N 1 0 349.475 3.594 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N1CCc2sccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000178643298 1027197487 /nfs/dbraw/zinc/19/74/87/1027197487.db2.gz ZEOSKRPJNDLEFX-UONOGXRCSA-N 1 0 345.468 3.754 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 ZINC000178643284 1027197884 /nfs/dbraw/zinc/19/78/84/1027197884.db2.gz ZEOSKRPJNDLEFX-KGLIPLIRSA-N 1 0 345.468 3.754 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(c3ccccn3)CC2)cc1[N+](=O)[O-] ZINC000121344420 1027212162 /nfs/dbraw/zinc/21/21/62/1027212162.db2.gz MYITZVFQDUVVPG-OAHLLOKOSA-N 1 0 340.427 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CSCCc3ccccc32)cc1 ZINC000531704292 1027227920 /nfs/dbraw/zinc/22/79/20/1027227920.db2.gz UAFKAYORKGZBBO-GOSISDBHSA-N 1 0 328.437 3.758 20 5 EHBDRO COCCC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCC1 ZINC000475489675 1027409601 /nfs/dbraw/zinc/40/96/01/1027409601.db2.gz YEBIFYFSHKJHKO-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c(Cl)c1 ZINC000611797335 1027433892 /nfs/dbraw/zinc/43/38/92/1027433892.db2.gz UZYDNWKXJSGFCJ-UONOGXRCSA-N 1 0 338.835 3.887 20 5 EHBDRO Cc1cc(N2CCC([C@@H]3CCOC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000612099215 1027835375 /nfs/dbraw/zinc/83/53/75/1027835375.db2.gz UJFFAOSUQJDSPQ-OAHLLOKOSA-N 1 0 341.411 3.704 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H](CC(F)(F)F)C2)c1 ZINC000420945039 1027905874 /nfs/dbraw/zinc/90/58/74/1027905874.db2.gz KEZDZFBYOUDFNJ-GFCCVEGCSA-N 1 0 332.322 3.638 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000178687237 1027970474 /nfs/dbraw/zinc/97/04/74/1027970474.db2.gz JABCKJXFUBVLMC-QWHCGFSZSA-N 1 0 345.374 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](Cc4ccccc4)C3)nc2c1 ZINC000444653931 1028116783 /nfs/dbraw/zinc/11/67/83/1028116783.db2.gz VUAYNUXDIAOCQX-HNNXBMFYSA-N 1 0 336.395 3.536 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1C)[C@H]1CCCC[C@@H]1C ZINC000444679069 1028148800 /nfs/dbraw/zinc/14/88/00/1028148800.db2.gz SYBJJNCKUPWGIM-GUYCJALGSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)CC1(c2ccccc2)CC1 ZINC000444681729 1028150914 /nfs/dbraw/zinc/15/09/14/1028150914.db2.gz WGNQAONDWNHJPB-UHFFFAOYSA-N 1 0 326.396 3.767 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](C[C@H]2CCOC2)c2ccccc2)cc1 ZINC000166498854 1028234195 /nfs/dbraw/zinc/23/41/95/1028234195.db2.gz HDXUWVVIEAJWKU-XLIONFOSSA-N 1 0 340.423 3.895 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](N)c1ccccc1 ZINC000423231336 1028296135 /nfs/dbraw/zinc/29/61/35/1028296135.db2.gz ATJJXOJRWLWFCJ-CVEARBPZSA-N 1 0 345.468 3.755 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2cc(N)ccc21 ZINC000423376550 1028398762 /nfs/dbraw/zinc/39/87/62/1028398762.db2.gz YFRBKQRDPVDEGO-SCLBCKFNSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCCC(F)(F)C2)n1 ZINC000502593273 1028410647 /nfs/dbraw/zinc/41/06/47/1028410647.db2.gz BVXHXZCGFCPGRB-MELADBBJSA-N 1 0 342.390 3.690 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1NCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437953 1028447023 /nfs/dbraw/zinc/44/70/23/1028447023.db2.gz URCVDPDIFXEXQY-RBUKOAKNSA-N 1 0 325.412 3.523 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000518934491 1028457600 /nfs/dbraw/zinc/45/76/00/1028457600.db2.gz ZFLXEEKDGIIYBQ-HNNXBMFYSA-N 1 0 347.459 3.534 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(Br)o1 ZINC000523701636 1028553700 /nfs/dbraw/zinc/55/37/00/1028553700.db2.gz VLHBLMKOQPJUCS-UHFFFAOYSA-N 1 0 339.189 3.625 20 5 EHBDRO COc1ccc(C[N@H+](C[C@@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000075843661 1028798594 /nfs/dbraw/zinc/79/85/94/1028798594.db2.gz GACXHYSQPWCTEE-INIZCTEOSA-N 1 0 334.416 3.527 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3C[C@H]3C3CCC3)cs2)c1 ZINC000424189881 1028878113 /nfs/dbraw/zinc/87/81/13/1028878113.db2.gz FDBRXYJEPQUGBW-JKSUJKDBSA-N 1 0 329.425 3.997 20 5 EHBDRO [NH3+]C1(c2noc(-c3cc4cc([N+](=O)[O-])ccc4o3)n2)CCCCC1 ZINC000424340729 1029018371 /nfs/dbraw/zinc/01/83/71/1029018371.db2.gz HGUOTWKREJQTKZ-UHFFFAOYSA-N 1 0 328.328 3.509 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+](CCCO)C2CC2)s1 ZINC000611271589 1029036784 /nfs/dbraw/zinc/03/67/84/1029036784.db2.gz GVUMTOFBZJJZPC-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CC)C2CCOCC2)cc1[N+](=O)[O-] ZINC000504918771 1029041269 /nfs/dbraw/zinc/04/12/69/1029041269.db2.gz IPDWGOHTSZZCIF-CJNGLKHVSA-N 1 0 336.432 3.849 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOc2cccc(F)c2)cc1[N+](=O)[O-] ZINC000504920412 1029044307 /nfs/dbraw/zinc/04/43/07/1029044307.db2.gz OPQFEIWPMLFPRP-ZDUSSCGKSA-N 1 0 348.374 3.862 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c1 ZINC000179171900 1029063731 /nfs/dbraw/zinc/06/37/31/1029063731.db2.gz AYOKBNABWFIYSE-FZKQIMNGSA-N 1 0 349.862 3.697 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000532966849 1029112079 /nfs/dbraw/zinc/11/20/79/1029112079.db2.gz XCABTIZWRCEVMX-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO Cc1cc(-n2ccnc2)ccc1C[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000191889347 1029114624 /nfs/dbraw/zinc/11/46/24/1029114624.db2.gz WELMNJHMHDPTSB-UHFFFAOYSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnn1C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000152172266 1029290703 /nfs/dbraw/zinc/29/07/03/1029290703.db2.gz MSTGUUIQCVKAJR-GFCCVEGCSA-N 1 0 342.424 3.908 20 5 EHBDRO Cc1nccn1CCCC[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000130307976 1029359483 /nfs/dbraw/zinc/35/94/83/1029359483.db2.gz OGQWYZAVJRLONJ-UHFFFAOYSA-N 1 0 328.416 3.545 20 5 EHBDRO CC(C)C[NH+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)CC(C)C ZINC000533236430 1029519525 /nfs/dbraw/zinc/51/95/25/1029519525.db2.gz KOTZXLLTQYRRKY-UHFFFAOYSA-N 1 0 349.431 3.507 20 5 EHBDRO C[C@@H]1C[N@@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988779 1029575147 /nfs/dbraw/zinc/57/51/47/1029575147.db2.gz JSICUHZRMWEXML-NOZJJQNGSA-N 1 0 329.322 3.508 20 5 EHBDRO C[C@H](CCc1ccccc1)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835395 1029816151 /nfs/dbraw/zinc/81/61/51/1029816151.db2.gz OMJMIIJOLPCDEQ-CQSZACIVSA-N 1 0 338.411 3.830 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H]1CCCc2occc21 ZINC000152250566 1029868685 /nfs/dbraw/zinc/86/86/85/1029868685.db2.gz NKGFMOUZDSTNGN-MLGOLLRUSA-N 1 0 343.383 3.572 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000533853481 1029918137 /nfs/dbraw/zinc/91/81/37/1029918137.db2.gz IICJQSJENWMHLU-LJQANCHMSA-N 1 0 339.439 3.995 20 5 EHBDRO Cc1ncsc1CC[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000453305599 1030071329 /nfs/dbraw/zinc/07/13/29/1030071329.db2.gz JIWKXJUPPFXGFB-HNNXBMFYSA-N 1 0 331.441 3.914 20 5 EHBDRO COc1ccc(OCC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000441247968 1030142082 /nfs/dbraw/zinc/14/20/82/1030142082.db2.gz UHXJEGJAEXCFNI-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCC[C@H]1n1cccn1 ZINC000531980802 1030198600 /nfs/dbraw/zinc/19/86/00/1030198600.db2.gz PTMUYALCELTAAG-BMGDILEWSA-N 1 0 328.416 3.934 20 5 EHBDRO C[C@@H]1CC[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)O1 ZINC000453408796 1030220684 /nfs/dbraw/zinc/22/06/84/1030220684.db2.gz NRHMTGORQABIAK-ZMYBRWDISA-N 1 0 326.396 3.841 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2ccc(Cl)cc2)n1 ZINC000447518590 1030240881 /nfs/dbraw/zinc/24/08/81/1030240881.db2.gz OBXPBFHSRWQPSL-HOTGVXAUSA-N 1 0 348.834 3.761 20 5 EHBDRO CCCc1ncc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)o1 ZINC000453393421 1030242086 /nfs/dbraw/zinc/24/20/86/1030242086.db2.gz RQDFVYMYYWWJLX-MRXNPFEDSA-N 1 0 329.400 3.646 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447507439 1030254257 /nfs/dbraw/zinc/25/42/57/1030254257.db2.gz HUDCPBKXAHSIMJ-VQTJNVASSA-N 1 0 339.439 3.865 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447545105 1030279894 /nfs/dbraw/zinc/27/98/94/1030279894.db2.gz XCOUAKWQQFUJQN-DLBZAZTESA-N 1 0 328.416 3.682 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H](c2ccco2)N2CCCCC2)cs1 ZINC000237974395 1030506781 /nfs/dbraw/zinc/50/67/81/1030506781.db2.gz QDBSTNVSTQSMAQ-CQSZACIVSA-N 1 0 335.429 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccc3c(c2)OCCO3)C2CC2)cc1 ZINC000237998390 1030807888 /nfs/dbraw/zinc/80/78/88/1030807888.db2.gz RAYICCUTZMGKKD-LJQANCHMSA-N 1 0 340.379 3.607 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@@H](CNC(=O)C(C)(C)C)C1 ZINC000247146927 1030916371 /nfs/dbraw/zinc/91/63/71/1030916371.db2.gz YFBZPXXNOAJOIW-GJZGRUSLSA-N 1 0 347.459 3.530 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H]1O ZINC000537695045 1031081491 /nfs/dbraw/zinc/08/14/91/1031081491.db2.gz WKPYBIAGIZHFQK-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000483340551 1031127668 /nfs/dbraw/zinc/12/76/68/1031127668.db2.gz KVHQGZVPPYLDNM-BEFAXECRSA-N 1 0 348.443 3.624 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1)c1cccc([N+](=O)[O-])c1 ZINC000926916306 1031271873 /nfs/dbraw/zinc/27/18/73/1031271873.db2.gz PGQBFGOODABKHJ-LEWSCRJBSA-N 1 0 332.322 3.745 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H](C)C1CCCCC1 ZINC000483739116 1031311246 /nfs/dbraw/zinc/31/12/46/1031311246.db2.gz CNJNKXBZSYVKRX-KGLIPLIRSA-N 1 0 333.432 3.870 20 5 EHBDRO CC[N@H+](CCc1cccs1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000343567910 1031415212 /nfs/dbraw/zinc/41/52/12/1031415212.db2.gz NUEGBVJTQPOUFB-ZDUSSCGKSA-N 1 0 347.440 3.548 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(O)CCCC[C@H]2C1 ZINC000248136824 1031423424 /nfs/dbraw/zinc/42/34/24/1031423424.db2.gz PDQXHOAEAXOKNL-QFBILLFUSA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477441001 1031553176 /nfs/dbraw/zinc/55/31/76/1031553176.db2.gz UECRGPUSHLTDGJ-KRWDZBQOSA-N 1 0 340.379 3.703 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071954 1033324177 /nfs/dbraw/zinc/32/41/77/1033324177.db2.gz VNRSXUGSAJGJDY-PKXJPQMGSA-N 1 0 329.425 3.629 20 5 EHBDRO COc1cccc(C[C@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594503619 1033403920 /nfs/dbraw/zinc/40/39/20/1033403920.db2.gz ZZMHXTOUZJNEDE-SCLBCKFNSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCc2ccccc2NC1=O ZINC000594511438 1033415749 /nfs/dbraw/zinc/41/57/49/1033415749.db2.gz NHIABZZVCMTQBF-FZKQIMNGSA-N 1 0 339.395 3.507 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)C(=O)OC(C)(C)C ZINC000594513101 1033417799 /nfs/dbraw/zinc/41/77/99/1033417799.db2.gz BDPQCLYWJIJMJC-SSUFTNFISA-N 1 0 334.416 3.566 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCCN3CCCC[C@@H]23)cc1[N+](=O)[O-] ZINC000594518719 1033424491 /nfs/dbraw/zinc/42/44/91/1033424491.db2.gz JHEYIISXIRJLLL-XIRDDKMYSA-N 1 0 347.459 3.661 20 5 EHBDRO Cc1nn(C[N@@H+](C)C[C@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291543 1033539647 /nfs/dbraw/zinc/53/96/47/1033539647.db2.gz UTPPTUHRNUMZQV-AWEZNQCLSA-N 1 0 338.411 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CC[C@@H](C[NH+]3CCCCC3)C2)c1 ZINC000173867160 1033563303 /nfs/dbraw/zinc/56/33/03/1033563303.db2.gz ZWSDQTUINFBHCV-AWEZNQCLSA-N 1 0 337.851 3.556 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccco1 ZINC000574822459 1033572024 /nfs/dbraw/zinc/57/20/24/1033572024.db2.gz HXLNCAWDZTWNGQ-SJLPKXTDSA-N 1 0 343.427 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC[C@H]1CCC[N@H+](CC(C)C)C1 ZINC000595023876 1033615707 /nfs/dbraw/zinc/61/57/07/1033615707.db2.gz ZDYMKGXOENHQBS-HZPDHXFCSA-N 1 0 349.475 3.622 20 5 EHBDRO C[C@H]1CCC[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000594986224 1033619085 /nfs/dbraw/zinc/61/90/85/1033619085.db2.gz UMEVLBBIXNOVHE-BLLLJJGKSA-N 1 0 347.440 3.766 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC1CC1 ZINC000598975204 1033623606 /nfs/dbraw/zinc/62/36/06/1033623606.db2.gz TWJBIRPZBBHJNP-ZDUSSCGKSA-N 1 0 342.395 3.995 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000594997151 1033624317 /nfs/dbraw/zinc/62/43/17/1033624317.db2.gz YPKFBZNZWIHCGI-CYBMUJFWSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2C[C@H](O)C2)ccc1Oc1ccccc1Cl ZINC000594998955 1033626274 /nfs/dbraw/zinc/62/62/74/1033626274.db2.gz MNJBPMKMGDJLNX-JOCQHMNTSA-N 1 0 348.786 3.653 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CO[C@H](C3CC3)C2)o1 ZINC000599006857 1033643448 /nfs/dbraw/zinc/64/34/48/1033643448.db2.gz LNXHIIRFKQMHOX-UGSOOPFHSA-N 1 0 328.368 3.512 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)nn(C)c1C ZINC000595027278 1033648798 /nfs/dbraw/zinc/64/87/98/1033648798.db2.gz RCFNLXUZXYPLGE-BDJLRTHQSA-N 1 0 346.431 3.756 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CC12CCSCC2 ZINC000595046446 1033662404 /nfs/dbraw/zinc/66/24/04/1033662404.db2.gz ZNDPIRPPDUHMIX-QWHCGFSZSA-N 1 0 336.457 3.787 20 5 EHBDRO Cn1cc(C[NH2+]C[C@H]2CCCC23CC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599016051 1033665255 /nfs/dbraw/zinc/66/52/55/1033665255.db2.gz IQAVMISMYJAZCR-MRXNPFEDSA-N 1 0 340.427 3.665 20 5 EHBDRO CO[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000599017930 1033667738 /nfs/dbraw/zinc/66/77/38/1033667738.db2.gz RFJYHUFZDPHWJE-BETUJISGSA-N 1 0 332.425 3.838 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC1(C)C ZINC000595107654 1033694210 /nfs/dbraw/zinc/69/42/10/1033694210.db2.gz PDLOEAFOJRKQID-UONOGXRCSA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@H]1CCCOC1 ZINC000599059610 1033698128 /nfs/dbraw/zinc/69/81/28/1033698128.db2.gz ZOGNPTJMJLEFMK-RYRKJORJSA-N 1 0 332.444 3.712 20 5 EHBDRO CC[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595093988 1033700444 /nfs/dbraw/zinc/70/04/44/1033700444.db2.gz RLXASLKVSCVVNU-AWEZNQCLSA-N 1 0 328.359 3.576 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000595290295 1033718711 /nfs/dbraw/zinc/71/87/11/1033718711.db2.gz VAPWTWSRCMHKCK-UHFFFAOYSA-N 1 0 330.359 3.819 20 5 EHBDRO CCC[C@H]([NH2+]CC(C)(C)C(=O)N1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000599085159 1033723507 /nfs/dbraw/zinc/72/35/07/1033723507.db2.gz VRNRFWUKGGPAPA-KRWDZBQOSA-N 1 0 347.459 3.674 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@@H]1c1ccccc1 ZINC000595330990 1033730296 /nfs/dbraw/zinc/73/02/96/1033730296.db2.gz GXUWIPXFDQODRF-ZBFHGGJFSA-N 1 0 329.400 3.907 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327731 1033730626 /nfs/dbraw/zinc/73/06/26/1033730626.db2.gz RHQZDZMLUCNZRI-HZPDHXFCSA-N 1 0 329.400 3.968 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1CN1CCC[C@@H](Nc2ccccc2)C1 ZINC000595383844 1033784592 /nfs/dbraw/zinc/78/45/92/1033784592.db2.gz PFRMYFXSEIGNHP-QGZVFWFLSA-N 1 0 329.375 3.810 20 5 EHBDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccc(F)cc2[N+](=O)[O-])cc1OC ZINC000595415719 1033789432 /nfs/dbraw/zinc/78/94/32/1033789432.db2.gz NGYIGOWSFDIYQK-LBPRGKRZSA-N 1 0 348.374 3.910 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1 ZINC000595418031 1033793306 /nfs/dbraw/zinc/79/33/06/1033793306.db2.gz NHOLPJJANCZFDK-QAPCUYQASA-N 1 0 330.359 3.601 20 5 EHBDRO CC(C)(C)c1cccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000595483528 1033808239 /nfs/dbraw/zinc/80/82/39/1033808239.db2.gz WAPAYBQJEWZLCW-UHFFFAOYSA-N 1 0 342.443 3.926 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000603629038 1033815202 /nfs/dbraw/zinc/81/52/02/1033815202.db2.gz LMLWAFXUHIJCEF-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO CC[N@H+](CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C(C)C ZINC000593705194 1033816577 /nfs/dbraw/zinc/81/65/77/1033816577.db2.gz QWBZAWUNNFAVHP-CQSZACIVSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000603661739 1033833072 /nfs/dbraw/zinc/83/30/72/1033833072.db2.gz UWXKOPZKECUZHN-UHFFFAOYSA-N 1 0 342.370 3.902 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@]2(C)Cc2ccc(F)cc2)c1[N+](=O)[O-] ZINC000595552527 1033859542 /nfs/dbraw/zinc/85/95/42/1033859542.db2.gz MKHKUVMUYIXOSW-QGZVFWFLSA-N 1 0 333.363 3.628 20 5 EHBDRO O=[N+]([O-])c1ncccc1NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000603838591 1033949715 /nfs/dbraw/zinc/94/97/15/1033949715.db2.gz VLWKTEMURFKHOM-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO CC1(C)CC(Nc2nccc3c2cccc3[N+](=O)[O-])CC(C)(C)[NH2+]1 ZINC000450238552 1033959974 /nfs/dbraw/zinc/95/99/74/1033959974.db2.gz BOISTMZPKJXPNW-UHFFFAOYSA-N 1 0 328.416 3.864 20 5 EHBDRO Cc1nccc([C@@H]2CCC[N@@H+]([C@@H](C)c3cccc([N+](=O)[O-])c3)C2)n1 ZINC000603834322 1033960477 /nfs/dbraw/zinc/96/04/77/1033960477.db2.gz QNUWPUOEJHIVET-XJKSGUPXSA-N 1 0 326.400 3.634 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc2ncccc2c1[N+](=O)[O-])c1ccccc1 ZINC000603837505 1033962363 /nfs/dbraw/zinc/96/23/63/1033962363.db2.gz NLFRODRIFCEGDZ-SFHVURJKSA-N 1 0 336.395 3.858 20 5 EHBDRO C[NH+](C)CCOc1ccc(CNc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000603866271 1033992641 /nfs/dbraw/zinc/99/26/41/1033992641.db2.gz SZKMVDZCVHDWFL-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO C[N@H+](CC1=CCSC1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595890199 1034020300 /nfs/dbraw/zinc/02/03/00/1034020300.db2.gz ZRRWYPFYCPVAEM-UHFFFAOYSA-N 1 0 332.347 3.719 20 5 EHBDRO O=[N+]([O-])c1cccnc1Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000603942752 1034059250 /nfs/dbraw/zinc/05/92/50/1034059250.db2.gz WERVLHOJYOXSGK-UHFFFAOYSA-N 1 0 326.400 3.762 20 5 EHBDRO CC(C)c1cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)on1 ZINC000169212574 1034150630 /nfs/dbraw/zinc/15/06/30/1034150630.db2.gz UREIRAXHOQAOSX-QGZVFWFLSA-N 1 0 329.400 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC1CC[NH+](C2CCCC2)CC1 ZINC000450368842 1034223332 /nfs/dbraw/zinc/22/33/32/1034223332.db2.gz KJNOXWDKMSPQKT-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])nc2)[C@H]1c1ccc(Cl)cc1 ZINC000450413160 1034300207 /nfs/dbraw/zinc/30/02/07/1034300207.db2.gz SNTUGSTUYGHHCY-GDBMZVCRSA-N 1 0 332.791 3.501 20 5 EHBDRO C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@H](c2ccccc2)C1 ZINC000534270984 1034332912 /nfs/dbraw/zinc/33/29/12/1034332912.db2.gz KHFSMFYMFUGRCN-IBGZPJMESA-N 1 0 348.406 3.636 20 5 EHBDRO CC[C@H]([NH2+][C@@H](COC)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000347353246 1034349366 /nfs/dbraw/zinc/34/93/66/1034349366.db2.gz OYFWCZGCFJEYFH-MJGOQNOKSA-N 1 0 328.412 3.893 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@@H]3OCCC[C@H]23)c2ccccc2)c1 ZINC000251436079 1034646845 /nfs/dbraw/zinc/64/68/45/1034646845.db2.gz AVFBLVKAOMQSFP-YSTOQKLRSA-N 1 0 338.407 3.841 20 5 EHBDRO CC(C)c1ccc([C@H]2CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000534665855 1034791134 /nfs/dbraw/zinc/79/11/34/1034791134.db2.gz OBDZWWVZYXQTHK-QGZVFWFLSA-N 1 0 328.416 3.752 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H]2CCCN(C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407730 1034890696 /nfs/dbraw/zinc/89/06/96/1034890696.db2.gz ZFDRGSCLYMENOR-KXBFYZLASA-N 1 0 343.427 3.523 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC([C@@H]3CCOC3)CC2)cc1[N+](=O)[O-] ZINC000612402091 1034893549 /nfs/dbraw/zinc/89/35/49/1034893549.db2.gz HQIRUXLSTNPBFL-QGZVFWFLSA-N 1 0 332.444 3.967 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])OCCc2ccccc21 ZINC000584498734 1035207055 /nfs/dbraw/zinc/20/70/55/1035207055.db2.gz CTXWLLOZSAYRQE-LJQANCHMSA-N 1 0 326.396 3.563 20 5 EHBDRO Cn1ccnc1[C@@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000580844561 1035458420 /nfs/dbraw/zinc/45/84/20/1035458420.db2.gz QNPJRONRJCKDQF-HKUYNNGSSA-N 1 0 348.406 3.695 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000581936040 1035673711 /nfs/dbraw/zinc/67/37/11/1035673711.db2.gz VDSZQKCASXEWDV-DOTOQJQBSA-N 1 0 326.396 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@@]3(CC[N@H+](Cc4ccccc4)C3)C2)s1 ZINC000588072480 1035699819 /nfs/dbraw/zinc/69/98/19/1035699819.db2.gz LEJOQPKQIDCAGC-GOSISDBHSA-N 1 0 343.452 3.759 20 5 EHBDRO O=C(CC[N@@H+](Cc1cccc([N+](=O)[O-])c1)C1CC1)c1ccc(F)cc1 ZINC000540819795 1035709689 /nfs/dbraw/zinc/70/96/89/1035709689.db2.gz KGWOVTRNOVCCQB-UHFFFAOYSA-N 1 0 342.370 3.971 20 5 EHBDRO C[C@H]1C[C@@H](c2cccnc2)[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000588204725 1035823678 /nfs/dbraw/zinc/82/36/78/1035823678.db2.gz ASUXXYDDVNSMKR-KXBFYZLASA-N 1 0 341.411 3.842 20 5 EHBDRO CC(C)[C@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347100 1035923520 /nfs/dbraw/zinc/92/35/20/1035923520.db2.gz IKFXEFGSWKAAAK-CVEARBPZSA-N 1 0 344.415 3.949 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000414193267 1035989425 /nfs/dbraw/zinc/98/94/25/1035989425.db2.gz SVXLLASZUISAHV-CZUORRHYSA-N 1 0 326.396 3.730 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000780396959 1035995612 /nfs/dbraw/zinc/99/56/12/1035995612.db2.gz GRGGMFHENBNMTN-YZMSFBEDSA-N 1 0 338.407 3.806 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)NCCC1=CCCCC1 ZINC000056196795 1036139114 /nfs/dbraw/zinc/13/91/14/1036139114.db2.gz MWZQCSAKVFBDGL-LSDHHAIUSA-N 1 0 345.443 3.641 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000056201444 1036139378 /nfs/dbraw/zinc/13/93/78/1036139378.db2.gz YIDIYSPAUDJCND-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc(C(F)F)cc1[N+](=O)[O-])c1ccco1 ZINC000589103913 1036251483 /nfs/dbraw/zinc/25/14/83/1036251483.db2.gz QBVBSXAWOKHCMK-CYBMUJFWSA-N 1 0 325.315 3.840 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@@H](Nc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000535265759 1036260367 /nfs/dbraw/zinc/26/03/67/1036260367.db2.gz MNYRACFVDWVAGF-KRWDZBQOSA-N 1 0 334.379 3.742 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCO1 ZINC000511505770 1036272934 /nfs/dbraw/zinc/27/29/34/1036272934.db2.gz FZRMAPSMYZQSHX-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)[C@H]1CCOC(C)(C)C1 ZINC000589274674 1036338235 /nfs/dbraw/zinc/33/82/35/1036338235.db2.gz NHYJQYKGXPSECN-INIZCTEOSA-N 1 0 336.432 3.643 20 5 EHBDRO CCOc1ccc(NC(=O)C[N@H+](C(CC)CC)C2CC2)c([N+](=O)[O-])c1 ZINC000165332616 1036414571 /nfs/dbraw/zinc/41/45/71/1036414571.db2.gz JMWAFORUFSWPJL-UHFFFAOYSA-N 1 0 349.431 3.585 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000541545022 1036424193 /nfs/dbraw/zinc/42/41/93/1036424193.db2.gz HIBLNSCQMPDPIF-MOPGFXCFSA-N 1 0 346.427 3.980 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@@H](C)C1CCCCC1 ZINC000541601538 1036484287 /nfs/dbraw/zinc/48/42/87/1036484287.db2.gz GXIXZHYCGXMERE-HUUCEWRRSA-N 1 0 347.459 3.752 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414301784 1036551205 /nfs/dbraw/zinc/55/12/05/1036551205.db2.gz BVOUCRRGJZDEMZ-VQIMIIECSA-N 1 0 346.402 3.941 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])[C@H]1Oc2ccccc2[C@H]1C ZINC000541688174 1036560462 /nfs/dbraw/zinc/56/04/62/1036560462.db2.gz TYVXZHQKDIUGHO-TYILLQQXSA-N 1 0 342.395 3.516 20 5 EHBDRO CCCCCn1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)c(C)n1 ZINC000541776000 1036628838 /nfs/dbraw/zinc/62/88/38/1036628838.db2.gz GUIQOGSTGILRCY-UHFFFAOYSA-N 1 0 330.432 3.888 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)Nc1ccc(C)c([N+](=O)[O-])c1 ZINC000609084124 1036679331 /nfs/dbraw/zinc/67/93/31/1036679331.db2.gz CDGPLOMOASDWIM-UHFFFAOYSA-N 1 0 336.436 3.537 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180399653 1036775539 /nfs/dbraw/zinc/77/55/39/1036775539.db2.gz LPJCEUUHWPFWAF-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590165662 1036782336 /nfs/dbraw/zinc/78/23/36/1036782336.db2.gz BPVYMZOTHZVFBN-ZDUSSCGKSA-N 1 0 345.365 3.576 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152810137 1036789221 /nfs/dbraw/zinc/78/92/21/1036789221.db2.gz MJKMCMKXFOUPAU-HUUCEWRRSA-N 1 0 343.402 3.911 20 5 EHBDRO COc1cccc(OCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)c1 ZINC000443620243 1036790976 /nfs/dbraw/zinc/79/09/76/1036790976.db2.gz SEELRJCAHADGKH-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCCC(F)(F)C2)c1 ZINC000539526595 1036868139 /nfs/dbraw/zinc/86/81/39/1036868139.db2.gz ZNKLLXJIYOBBOL-SNVBAGLBSA-N 1 0 336.285 3.864 20 5 EHBDRO Cc1ccccc1C[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000237742971 1036901343 /nfs/dbraw/zinc/90/13/43/1036901343.db2.gz JXMDPZOFCGOYCN-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccc(C)cc2)[NH+](C)C)c1 ZINC000462374383 1036905646 /nfs/dbraw/zinc/90/56/46/1036905646.db2.gz GMLSORJYRDWDSK-SFHVURJKSA-N 1 0 329.400 3.627 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCO[C@H](CC(C)C)C1 ZINC000539615750 1036982069 /nfs/dbraw/zinc/98/20/69/1036982069.db2.gz JEUVXCKRADOIPW-NVXWUHKLSA-N 1 0 336.432 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H]2CCC[C@H](O)C2)c2ccccc2)c1 ZINC000180621693 1037017485 /nfs/dbraw/zinc/01/74/85/1037017485.db2.gz LMXDYXDCLQPVJV-RYGJVYDSSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4CC[C@@H]3O4)o2)c(Cl)c1 ZINC000152863025 1037034226 /nfs/dbraw/zinc/03/42/26/1037034226.db2.gz DNAPBPBYPQCDOM-JGFGOQIWSA-N 1 0 348.786 3.918 20 5 EHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000539826869 1037253380 /nfs/dbraw/zinc/25/33/80/1037253380.db2.gz CTVPUZGPAFOGBW-VTSXBNNFSA-N 1 0 326.396 3.664 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc3nsnc32)cc1[N+](=O)[O-] ZINC000271782319 1037287561 /nfs/dbraw/zinc/28/75/61/1037287561.db2.gz LBZOHPZCQKLURF-NSHDSACASA-N 1 0 328.397 3.759 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)Oc1cccc(F)c1 ZINC000462733817 1037333070 /nfs/dbraw/zinc/33/30/70/1037333070.db2.gz KSHFJFHQKUYORD-ZDUSSCGKSA-N 1 0 348.374 3.690 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000532461476 1037363570 /nfs/dbraw/zinc/36/35/70/1037363570.db2.gz RRGNFUPLTQWUDM-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](CO)Cc1ccc(F)cc1 ZINC000532470082 1037405145 /nfs/dbraw/zinc/40/51/45/1037405145.db2.gz VGVSRXJLZACGDT-ZBFHGGJFSA-N 1 0 346.402 3.544 20 5 EHBDRO Cc1cc(N2CCC[C@@]3(CC[NH2+]C3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000591440631 1037406815 /nfs/dbraw/zinc/40/68/15/1037406815.db2.gz AQCPZOVJUAATIB-HNNXBMFYSA-N 1 0 343.349 3.502 20 5 EHBDRO C[C@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@@H+]1C1CC1 ZINC000177185132 1037409540 /nfs/dbraw/zinc/40/95/40/1037409540.db2.gz CRTWYUFDTRZXTO-HOCLYGCPSA-N 1 0 345.446 3.743 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@](C)(OC)C1CC1 ZINC000462807043 1037425800 /nfs/dbraw/zinc/42/58/00/1037425800.db2.gz KZVGYELDVYRAKT-RHSMWYFYSA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH2+]C2CCCCC2)cc1OC(F)F ZINC000539991906 1037431158 /nfs/dbraw/zinc/43/11/58/1037431158.db2.gz ZPGHJVAGZZADEY-UHFFFAOYSA-N 1 0 343.374 3.921 20 5 EHBDRO CC1(C)[C@@H](O)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000462868194 1037493395 /nfs/dbraw/zinc/49/33/95/1037493395.db2.gz AJQJXRJHPOVMNK-INIZCTEOSA-N 1 0 332.425 3.669 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H](C(=O)NC(C)C)C1 ZINC000532501264 1037527501 /nfs/dbraw/zinc/52/75/01/1037527501.db2.gz QKLBSMLQPMEVSY-ARFHVFGLSA-N 1 0 347.459 3.637 20 5 EHBDRO CO[C@H](C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000468637349 1037591257 /nfs/dbraw/zinc/59/12/57/1037591257.db2.gz IIJDCOIJJRNRNK-ILCZHQDMSA-N 1 0 326.396 3.975 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCOc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000532550077 1037592435 /nfs/dbraw/zinc/59/24/35/1037592435.db2.gz QOYPDBNTNGTYEW-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@]2(CCSC2)C1 ZINC000540164172 1037649940 /nfs/dbraw/zinc/64/99/40/1037649940.db2.gz KFTIKCRJWJZAAZ-JJRVBVJISA-N 1 0 336.457 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2cccc(C[NH+]3CCCCCC3)c2)cn1 ZINC000573826909 1037762280 /nfs/dbraw/zinc/76/22/80/1037762280.db2.gz DVHXPEBBGUIENZ-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO Cc1cc(N2CC3(C[C@@H]2C)CCOCC3)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000591992607 1037779747 /nfs/dbraw/zinc/77/97/47/1037779747.db2.gz QUUBITAUBWTMBB-AWEZNQCLSA-N 1 0 341.411 3.847 20 5 EHBDRO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cccc2[nH]ccc21 ZINC000494045534 1037793179 /nfs/dbraw/zinc/79/31/79/1037793179.db2.gz AWZWVUNHQTYDRZ-UHFFFAOYSA-N 1 0 325.368 3.587 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1cccc2[nH]ccc21 ZINC000494081310 1037828222 /nfs/dbraw/zinc/82/82/22/1037828222.db2.gz YFXZFVAIFPGCAJ-UHFFFAOYSA-N 1 0 325.368 3.587 20 5 EHBDRO C[C@@H]1CCN(Cc2c(Cl)cccc2[N+](=O)[O-])C[C@H]1n1ccnc1 ZINC000492001226 1037853510 /nfs/dbraw/zinc/85/35/10/1037853510.db2.gz QDUSPZLMJZAXGZ-MLGOLLRUSA-N 1 0 334.807 3.528 20 5 EHBDRO C[C@H](C[NH2+]Cc1cnc([C@@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000897466204 1037879156 /nfs/dbraw/zinc/87/91/56/1037879156.db2.gz PRAYJKVXJYJGAT-WBMJQRKESA-N 1 0 347.440 3.796 20 5 EHBDRO C[C@@H]1SCC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592380673 1037951355 /nfs/dbraw/zinc/95/13/55/1037951355.db2.gz PAUVZNUEVRNFBN-HZMBPMFUSA-N 1 0 335.454 3.702 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N(C(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000540476005 1037983834 /nfs/dbraw/zinc/98/38/34/1037983834.db2.gz GZQQXFVZHUTTCS-OAHLLOKOSA-N 1 0 347.459 3.733 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180723 1038149957 /nfs/dbraw/zinc/14/99/57/1038149957.db2.gz AHQOCJHQLSNDQH-LSDHHAIUSA-N 1 0 328.416 3.636 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])o1 ZINC000897470139 1038241389 /nfs/dbraw/zinc/24/13/89/1038241389.db2.gz YVZOJWSVHCCXPZ-LBPRGKRZSA-N 1 0 340.383 3.780 20 5 EHBDRO CS[C@H]1CCCCN(Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1 ZINC000538796206 1038532206 /nfs/dbraw/zinc/53/22/06/1038532206.db2.gz USEJVXAYWWIOKS-ZDUSSCGKSA-N 1 0 346.399 3.914 20 5 EHBDRO CC[N@H+](CCC1CCN(c2nc(C)ccc2[N+](=O)[O-])CC1)CC1CC1 ZINC000538926491 1038607270 /nfs/dbraw/zinc/60/72/70/1038607270.db2.gz HXNBIBYSMAOUKA-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO Cc1cc(NCc2ccc(C[NH+](C)C)c(F)c2)c(F)cc1[N+](=O)[O-] ZINC000461963718 1038699613 /nfs/dbraw/zinc/69/96/13/1038699613.db2.gz IPRAIHPOUFPARU-UHFFFAOYSA-N 1 0 335.354 3.855 20 5 EHBDRO CC[C@H](C)[C@H](C)[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CC1 ZINC000104967828 1038769336 /nfs/dbraw/zinc/76/93/36/1038769336.db2.gz FHEJZPQPHJFNCB-STQMWFEESA-N 1 0 334.416 3.860 20 5 EHBDRO CC[C@@H](C)[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000539317354 1038770581 /nfs/dbraw/zinc/77/05/81/1038770581.db2.gz WFQPXCLKLUPCGT-MLGOLLRUSA-N 1 0 336.823 3.822 20 5 EHBDRO CC[C@@H](C)[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000539317355 1038770593 /nfs/dbraw/zinc/77/05/93/1038770593.db2.gz WFQPXCLKLUPCGT-WBMJQRKESA-N 1 0 336.823 3.822 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H]2CC(C)C)cccc1[N+](=O)[O-] ZINC000500472091 1038783828 /nfs/dbraw/zinc/78/38/28/1038783828.db2.gz WFEDEZURFOXBCL-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN(CC[NH+](C)C)Cc1ccco1 ZINC000569969330 1038833013 /nfs/dbraw/zinc/83/30/13/1038833013.db2.gz ZAZQNSCHUDKDFK-VBKFSLOCSA-N 1 0 343.427 3.655 20 5 EHBDRO C[C@@H](C[C@H](O)c1cccs1)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000893268734 1038910005 /nfs/dbraw/zinc/91/00/05/1038910005.db2.gz YMZXDHSOBBCZGY-HZMBPMFUSA-N 1 0 340.832 3.912 20 5 EHBDRO CC(C)[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(C)(C)O ZINC000477864386 1038975978 /nfs/dbraw/zinc/97/59/78/1038975978.db2.gz ZMYMEEDRUSSHMM-KYJSFNMBSA-N 1 0 334.460 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCCNc1ccccn1)CCC2 ZINC000192812515 1039031226 /nfs/dbraw/zinc/03/12/26/1039031226.db2.gz OWLRLZGOJFCMJZ-SFHVURJKSA-N 1 0 340.427 3.849 20 5 EHBDRO Cc1cccc([C@@H]2CCCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)c1 ZINC000478008173 1039112193 /nfs/dbraw/zinc/11/21/93/1039112193.db2.gz CVADXDOSTQAOSJ-KRWDZBQOSA-N 1 0 328.416 3.717 20 5 EHBDRO COc1ccc([C@@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1 ZINC000485763340 1039536318 /nfs/dbraw/zinc/53/63/18/1039536318.db2.gz BRNDNGKXKZWRDI-CYBMUJFWSA-N 1 0 330.384 3.805 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCSC1 ZINC000279934495 1039603474 /nfs/dbraw/zinc/60/34/74/1039603474.db2.gz JAMUPYSOECYOKJ-QWHCGFSZSA-N 1 0 326.487 3.808 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CC[C@H](c2ccccc2)O1 ZINC000554722946 1039648806 /nfs/dbraw/zinc/64/88/06/1039648806.db2.gz IZTMQROKQBPGDC-RTBURBONSA-N 1 0 326.396 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cnn3ccccc13)CCCC2 ZINC000417331189 1039688265 /nfs/dbraw/zinc/68/82/65/1039688265.db2.gz LYBKEGWBNPFQSW-GOSISDBHSA-N 1 0 336.395 3.800 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COCc2ccccc21 ZINC000417355435 1039713873 /nfs/dbraw/zinc/71/38/73/1039713873.db2.gz DJCIIKRFWDSVQR-KBXCAEBGSA-N 1 0 326.396 3.777 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC[C@@H](C)C1 ZINC000480613162 1039755411 /nfs/dbraw/zinc/75/54/11/1039755411.db2.gz MMCWZXDCVREWJW-GJYPPUQNSA-N 1 0 345.487 3.626 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC[C@@H](C)C1 ZINC000480613164 1039756442 /nfs/dbraw/zinc/75/64/42/1039756442.db2.gz MMCWZXDCVREWJW-GPMSIDNRSA-N 1 0 345.487 3.626 20 5 EHBDRO CCCC[N@H+](CCOC)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000549845176 1040032041 /nfs/dbraw/zinc/03/20/41/1040032041.db2.gz HAABAWMOYNTDSL-UHFFFAOYSA-N 1 0 334.338 3.862 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(Nc3ncc([N+](=O)[O-])cc3Cl)cccc21 ZINC000432945412 1040227682 /nfs/dbraw/zinc/22/76/82/1040227682.db2.gz RCMBTDWUZOOKIF-AWEZNQCLSA-N 1 0 348.790 3.772 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@H]1C ZINC000481094856 1040348740 /nfs/dbraw/zinc/34/87/40/1040348740.db2.gz XIHJLGZDBIJIHL-ZIAGYGMSSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](CCc2ccc3c(c2)CCO3)C2CC2)c1 ZINC000490157598 1040375485 /nfs/dbraw/zinc/37/54/85/1040375485.db2.gz ILPBCOAEHXSMRP-UHFFFAOYSA-N 1 0 338.407 3.737 20 5 EHBDRO C[C@@H](C[NH+]1CCCCCC1)NCc1ccc([N+](=O)[O-])cc1Cl ZINC000479616980 1040448218 /nfs/dbraw/zinc/44/82/18/1040448218.db2.gz PCNSSSFSHGMTBM-ZDUSSCGKSA-N 1 0 325.840 3.602 20 5 EHBDRO CCC[NH+]1CCC(N(C)c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000092629839 1040487043 /nfs/dbraw/zinc/48/70/43/1040487043.db2.gz JUHKOZHNOQBRFS-UHFFFAOYSA-N 1 0 343.374 3.507 20 5 EHBDRO CC1(C)CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[NH2+]1 ZINC000512676657 1040489988 /nfs/dbraw/zinc/48/99/88/1040489988.db2.gz CWKAUHGOYIHROI-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO CCN(C)CC[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481245375 1040544461 /nfs/dbraw/zinc/54/44/61/1040544461.db2.gz IHYVTQOTWFBEHF-CYBMUJFWSA-N 1 0 333.457 3.926 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C1CCOCC1 ZINC000555422199 1040558374 /nfs/dbraw/zinc/55/83/74/1040558374.db2.gz MTRLNXRDZOBRCK-OAHLLOKOSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1nccc2c1cccc2[N+](=O)[O-] ZINC001167751006 1040795342 /nfs/dbraw/zinc/79/53/42/1040795342.db2.gz GRNGCSPCCQSQSD-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO COC(=O)[C@H](C)C[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000509782843 1040816129 /nfs/dbraw/zinc/81/61/29/1040816129.db2.gz OCLPGSSZLRYUAC-GFCCVEGCSA-N 1 0 348.424 3.564 20 5 EHBDRO O=[N+]([O-])c1cccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059242 1040896599 /nfs/dbraw/zinc/89/65/99/1040896599.db2.gz RYJXJSZQTRMDQP-SFHVURJKSA-N 1 0 331.460 3.683 20 5 EHBDRO COc1ccc(OCCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000481531283 1041040888 /nfs/dbraw/zinc/04/08/88/1041040888.db2.gz GAQKONCSEFHOSI-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000433295135 1041247592 /nfs/dbraw/zinc/24/75/92/1041247592.db2.gz OLGKNYIOVYBMPK-SNUQEOBHSA-N 1 0 329.444 3.532 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@](C)(CO)Cc1ccccc1 ZINC000566713241 1041260914 /nfs/dbraw/zinc/26/09/14/1041260914.db2.gz HELRLUDLAIMHAW-UZLBHIALSA-N 1 0 342.439 3.795 20 5 EHBDRO CCn1nccc1C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000278837759 1041573629 /nfs/dbraw/zinc/57/36/29/1041573629.db2.gz IZAYSLZUGVSQPH-AWEZNQCLSA-N 1 0 328.416 3.752 20 5 EHBDRO CC[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)O1 ZINC000511837885 1041684614 /nfs/dbraw/zinc/68/46/14/1041684614.db2.gz JZMPEAWVCHWUJS-XJKSGUPXSA-N 1 0 330.384 3.854 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CCO)CCC3)s2)cc1 ZINC000136535256 1041853823 /nfs/dbraw/zinc/85/38/23/1041853823.db2.gz UTKHSBCEZALPBX-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO CC(C)[C@H](CO)N(Cc1ccccc1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000112657831 1042416764 /nfs/dbraw/zinc/41/67/64/1042416764.db2.gz KOKVQFXXWPPEQB-IBGZPJMESA-N 1 0 346.402 3.753 20 5 EHBDRO COc1cc(C[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000291644915 1042900342 /nfs/dbraw/zinc/90/03/42/1042900342.db2.gz CASQAEJWOQJLIR-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)cc1F ZINC000568911345 1042910039 /nfs/dbraw/zinc/91/00/39/1042910039.db2.gz MZDCPWDZSUPMGR-UHFFFAOYSA-N 1 0 343.358 3.556 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@H]3CCc4c3cccc4[N+](=O)[O-])nc21 ZINC000570060655 1043021649 /nfs/dbraw/zinc/02/16/49/1043021649.db2.gz YWJORJLVAPTJJF-HNNXBMFYSA-N 1 0 337.379 3.864 20 5 EHBDRO CC(C)[NH+]1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000049657024 1043086252 /nfs/dbraw/zinc/08/62/52/1043086252.db2.gz ZKCKTVFYQRIJNQ-UHFFFAOYSA-N 1 0 333.435 3.554 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)cc1 ZINC000344086299 1043225569 /nfs/dbraw/zinc/22/55/69/1043225569.db2.gz GKKVHGXXPRVOFU-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N1CCC(c2ncc3n2CCCC3)CC1 ZINC000279034759 1043233265 /nfs/dbraw/zinc/23/32/65/1043233265.db2.gz ITIKKVOLRRRGKE-UHFFFAOYSA-N 1 0 344.390 3.651 20 5 EHBDRO Cc1cc(C[C@@H](C)[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000279114932 1043373393 /nfs/dbraw/zinc/37/33/93/1043373393.db2.gz PMSDKPHVTNPSSR-DIFFPNOSSA-N 1 0 328.416 3.570 20 5 EHBDRO CN(C)c1ccc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000279139619 1043434221 /nfs/dbraw/zinc/43/42/21/1043434221.db2.gz RSYVWMCCXYESRB-QGZVFWFLSA-N 1 0 340.427 3.568 20 5 EHBDRO COc1cc(C[NH2+]C2CC(C)(c3ccccc3)C2)c([N+](=O)[O-])cc1O ZINC000344221975 1043468760 /nfs/dbraw/zinc/46/87/60/1043468760.db2.gz QTMYTKZTIHYWET-UHFFFAOYSA-N 1 0 342.395 3.519 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2c3ccccc3C[C@@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000279211181 1043576416 /nfs/dbraw/zinc/57/64/16/1043576416.db2.gz YGIUYBGAWFPMRI-GBESFXJTSA-N 1 0 338.407 3.565 20 5 EHBDRO C[C@@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000344740944 1044359569 /nfs/dbraw/zinc/35/95/69/1044359569.db2.gz MUMHIYRDYNEYHB-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCCn2cc(C)nc21 ZINC000344857149 1044526445 /nfs/dbraw/zinc/52/64/45/1044526445.db2.gz LQMJXTKGTXCPDI-CRPZLVSXSA-N 1 0 340.427 3.670 20 5 EHBDRO Cc1ccc(C[C@@H](CO)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000466917929 1126094478 /nfs/dbraw/zinc/09/44/78/1126094478.db2.gz HNJOUDWIAWKLCW-SFHVURJKSA-N 1 0 342.439 3.720 20 5 EHBDRO CC[C@@H]1C[C@@H](C)C[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000072697752 1126856347 /nfs/dbraw/zinc/85/63/47/1126856347.db2.gz SIPRZQUQFUHMJU-UKRRQHHQSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000552106065 1127581119 /nfs/dbraw/zinc/58/11/19/1127581119.db2.gz VFHXGPGPVQRASW-UHFFFAOYSA-N 1 0 347.459 3.514 20 5 EHBDRO C[C@H]1CCCC[C@@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765341984 1127600083 /nfs/dbraw/zinc/60/00/83/1127600083.db2.gz AYCUWCGGIHXYGD-JKSUJKDBSA-N 1 0 331.460 3.980 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1[N+](=O)[O-] ZINC000765421463 1127609762 /nfs/dbraw/zinc/60/97/62/1127609762.db2.gz SPJGWSSQPITCQF-GFCCVEGCSA-N 1 0 345.355 3.671 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000301356078 1127738868 /nfs/dbraw/zinc/73/88/68/1127738868.db2.gz MBGYTFSOJVZCEQ-UHFFFAOYSA-N 1 0 343.374 3.729 20 5 EHBDRO COc1cc(NC[C@@H](c2ccc(C)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000301351472 1127739294 /nfs/dbraw/zinc/73/92/94/1127739294.db2.gz IZHYBZHJRHHGLU-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ncc(F)c2cc([N+](=O)[O-])ccc21 ZINC001168596571 1128241974 /nfs/dbraw/zinc/24/19/74/1128241974.db2.gz MGJDPHQBRMIAKF-HOTGVXAUSA-N 1 0 332.379 3.567 20 5 EHBDRO C[C@H]1CCN(c2cccc(F)c2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000301467679 1128444127 /nfs/dbraw/zinc/44/41/27/1128444127.db2.gz YLKQJZHBRWPDSK-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO Cc1cnc(NCC(C)(C)[NH2+][C@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000301468202 1128457560 /nfs/dbraw/zinc/45/75/60/1128457560.db2.gz YZAQFXIVXIQNEU-CQSZACIVSA-N 1 0 328.416 3.840 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CC[C@@]2(CC[N@H+](Cc3ccccc3)C2)C1 ZINC000553679284 1128497012 /nfs/dbraw/zinc/49/70/12/1128497012.db2.gz ZFLZVMPLQROSIK-HXUWFJFHSA-N 1 0 337.423 3.697 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848106 1128559964 /nfs/dbraw/zinc/55/99/64/1128559964.db2.gz FOXNBIITMGOLLW-BLLLJJGKSA-N 1 0 326.352 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]2c2ccncc2)cc1 ZINC000153854217 1128776279 /nfs/dbraw/zinc/77/62/79/1128776279.db2.gz PKBPIBWZFMSCIR-SFHVURJKSA-N 1 0 327.384 3.596 20 5 EHBDRO Cc1nc(N[C@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301657773 1128849290 /nfs/dbraw/zinc/84/92/90/1128849290.db2.gz SNPDLFASDHJCJY-MRXNPFEDSA-N 1 0 326.400 3.547 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C/C=C/c3ccccc3)CC2)cc1 ZINC000765952229 1128890928 /nfs/dbraw/zinc/89/09/28/1128890928.db2.gz SXMFJCHHWLLUTC-QPJJXVBHSA-N 1 0 337.423 3.867 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])N1CCC[C@@H](Oc2ncccc2F)C1 ZINC000488988976 1128917090 /nfs/dbraw/zinc/91/70/90/1128917090.db2.gz WEDXLGORCGBLBB-UONOGXRCSA-N 1 0 345.374 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000609196219 1120543707 /nfs/dbraw/zinc/54/37/07/1120543707.db2.gz HBVXKTCUJRYNNT-INIZCTEOSA-N 1 0 344.386 3.992 20 5 EHBDRO CC1(C)[C@H](O)C[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000494484484 1120570458 /nfs/dbraw/zinc/57/04/58/1120570458.db2.gz KLXAPQPBVZFBEU-HZPDHXFCSA-N 1 0 332.425 3.572 20 5 EHBDRO CCCC[C@@H](COC)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494508913 1120583599 /nfs/dbraw/zinc/58/35/99/1120583599.db2.gz CKKGKPHEIQMHTL-ZDUSSCGKSA-N 1 0 334.338 3.908 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1c2cc(F)ccc2C[C@H]1C ZINC000542497101 1120789062 /nfs/dbraw/zinc/78/90/62/1120789062.db2.gz XDWMAVAVIXEWNJ-ZMZPIMSZSA-N 1 0 330.359 3.766 20 5 EHBDRO Cc1cc(N2CC[C@@H](C(C)(C)C)[C@@H](O)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000542508632 1120855308 /nfs/dbraw/zinc/85/53/08/1120855308.db2.gz LUNDWWWSTQQVIK-QAPCUYQASA-N 1 0 343.427 3.685 20 5 EHBDRO CCCC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CCC1 ZINC000542523847 1120904517 /nfs/dbraw/zinc/90/45/17/1120904517.db2.gz WPYJWKNKPDGGPC-HNNXBMFYSA-N 1 0 333.432 3.790 20 5 EHBDRO COC(=O)C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000542533852 1120932948 /nfs/dbraw/zinc/93/29/48/1120932948.db2.gz XSIKUJSWJATBAR-CZUORRHYSA-N 1 0 334.416 3.757 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2nc(C)cc(C)c2[N+](=O)[O-])CC1 ZINC000542967854 1128962975 /nfs/dbraw/zinc/96/29/75/1128962975.db2.gz FQQCYTUDGIPGMQ-UHFFFAOYSA-N 1 0 348.491 3.945 20 5 EHBDRO C[C@H](NCc1csc([N+](=O)[O-])c1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272245303 1121128207 /nfs/dbraw/zinc/12/82/07/1121128207.db2.gz XDIIOAJLVWRAAS-WMLDXEAASA-N 1 0 345.468 3.657 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cnn(C2CCC2)c1 ZINC000921976061 1128988372 /nfs/dbraw/zinc/98/83/72/1128988372.db2.gz KUMVGILXVFILRD-UHFFFAOYSA-N 1 0 334.807 3.502 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000282119433 1121798122 /nfs/dbraw/zinc/79/81/22/1121798122.db2.gz ARLBJMHYTCUNRL-BBRMVZONSA-N 1 0 330.384 3.854 20 5 EHBDRO C[C@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722558 1121963603 /nfs/dbraw/zinc/96/36/03/1121963603.db2.gz XSTVDMBNNZSCNK-HRCADAONSA-N 1 0 331.460 3.898 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000130650941 1122145009 /nfs/dbraw/zinc/14/50/09/1122145009.db2.gz PHGHZZWSUFLRDJ-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc([S@@](C)=O)cc1 ZINC000154466766 1122653548 /nfs/dbraw/zinc/65/35/48/1122653548.db2.gz GSJDLZVOTHLGTA-DEOSSOPVSA-N 1 0 346.452 3.743 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1N(C)CC1CCN(c2cc[nH+]cc2)CC1 ZINC000497755921 1122657293 /nfs/dbraw/zinc/65/72/93/1122657293.db2.gz BFIYITMAUOPWFT-UHFFFAOYSA-N 1 0 340.427 3.651 20 5 EHBDRO Cc1cc(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301217129 1122715779 /nfs/dbraw/zinc/71/57/79/1122715779.db2.gz ZNWJOWLTXHKQCZ-GOSISDBHSA-N 1 0 339.439 3.880 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1(C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000556886831 1123167354 /nfs/dbraw/zinc/16/73/54/1123167354.db2.gz WOMQWMNSCYRYDT-QGZVFWFLSA-N 1 0 342.443 3.978 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2cccc(F)c2)C1 ZINC000557022406 1123268470 /nfs/dbraw/zinc/26/84/70/1123268470.db2.gz LDFOWTBAUHFVEU-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO CC1CCC([N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000921207821 1123483405 /nfs/dbraw/zinc/48/34/05/1123483405.db2.gz FSUPMACQVXAOCP-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(CNc3ncc([N+](=O)[O-])s3)cc2)C1 ZINC000195508838 1123494614 /nfs/dbraw/zinc/49/46/14/1123494614.db2.gz AFGQTDSTUBNPGS-ZDUSSCGKSA-N 1 0 346.456 3.895 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncc([N+](=O)[O-])s2)[NH+]2CCCC2)cc1 ZINC000195511783 1123504413 /nfs/dbraw/zinc/50/44/13/1123504413.db2.gz ZBDDSHOPXCWZRE-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CCc3ccccc3)CC2)cc1 ZINC000195566207 1123591614 /nfs/dbraw/zinc/59/16/14/1123591614.db2.gz OAGMBDGKWIITRA-UHFFFAOYSA-N 1 0 325.412 3.714 20 5 EHBDRO O=[N+]([O-])c1sccc1NCc1ccc(OCC[NH+]2CCCC2)cc1 ZINC000609513789 1123597372 /nfs/dbraw/zinc/59/73/72/1123597372.db2.gz NTOWRCOSOJLDLY-UHFFFAOYSA-N 1 0 347.440 3.743 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000090810269 1123792970 /nfs/dbraw/zinc/79/29/70/1123792970.db2.gz ZEKQJEUXODOYLG-DYVFJYSZSA-N 1 0 338.448 3.687 20 5 EHBDRO C[C@H](CNC(=O)c1cc2ccccc2c2cccnc12)[NH+]1CCCC1 ZINC000068064749 1123821986 /nfs/dbraw/zinc/82/19/86/1123821986.db2.gz YPWCSRFUTFFHIW-OAHLLOKOSA-N 1 0 333.435 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1OCCc3ccccc31)CCC2 ZINC000618571750 1125120666 /nfs/dbraw/zinc/12/06/66/1125120666.db2.gz VZQSWZPHMWSYOJ-VQTJNVASSA-N 1 0 338.407 3.876 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000618615628 1125134497 /nfs/dbraw/zinc/13/44/97/1125134497.db2.gz GNAWUGYOVHQUQB-KSSFIOAISA-N 1 0 340.423 3.769 20 5 EHBDRO Cc1csc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000618984007 1125257382 /nfs/dbraw/zinc/25/73/82/1125257382.db2.gz NZNXMCYMUCUUNT-HNNXBMFYSA-N 1 0 331.441 3.914 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccccc1Nc1cc[nH+]cc1 ZINC000619581561 1125367743 /nfs/dbraw/zinc/36/77/43/1125367743.db2.gz IPGWIHLZDQNGEE-UHFFFAOYSA-N 1 0 348.362 3.716 20 5 EHBDRO COc1cccc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c1F ZINC000619715352 1125387899 /nfs/dbraw/zinc/38/78/99/1125387899.db2.gz QGHXJUYPOQNLHY-UHFFFAOYSA-N 1 0 332.375 3.855 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@@H](C)c1ccsc1 ZINC000619754271 1125395057 /nfs/dbraw/zinc/39/50/57/1125395057.db2.gz FJORAUWNBPPQAM-RYUDHWBXSA-N 1 0 333.413 3.724 20 5 EHBDRO CC(=O)c1ccc(NCc2ccc(C[NH+](C)C)c(F)c2)c([N+](=O)[O-])c1 ZINC000301853257 1129212335 /nfs/dbraw/zinc/21/23/35/1129212335.db2.gz BYKQUTSTRIZYCZ-UHFFFAOYSA-N 1 0 345.374 3.610 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000078989323 1129220751 /nfs/dbraw/zinc/22/07/51/1129220751.db2.gz YFZSZBYULWLLHS-STQMWFEESA-N 1 0 328.368 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1C(F)(F)F ZINC000369968320 1129224822 /nfs/dbraw/zinc/22/48/22/1129224822.db2.gz YUEBOHNZJPHRLF-NWDGAFQWSA-N 1 0 329.322 3.652 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000079724039 1129289907 /nfs/dbraw/zinc/28/99/07/1129289907.db2.gz RVOMXTMDYCXGOE-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000079924159 1129307172 /nfs/dbraw/zinc/30/71/72/1129307172.db2.gz SXHPVHUTPYKPBU-IBGZPJMESA-N 1 0 340.379 3.607 20 5 EHBDRO CCN(CC)c1ncc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)s1 ZINC000080347115 1129347963 /nfs/dbraw/zinc/34/79/63/1129347963.db2.gz PCGYVRCSRQIIMC-UHFFFAOYSA-N 1 0 348.472 3.922 20 5 EHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247691 1129371152 /nfs/dbraw/zinc/37/11/52/1129371152.db2.gz VPOOKZFNUWFWFB-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)[C@H](C)C1 ZINC000081096508 1129399874 /nfs/dbraw/zinc/39/98/74/1129399874.db2.gz XUPBLFHDHOYJRW-QAPCUYQASA-N 1 0 349.475 3.544 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301975764 1129465449 /nfs/dbraw/zinc/46/54/49/1129465449.db2.gz CZDZOVGKMUDGAQ-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ncc(CC)s2)cc1[N+](=O)[O-] ZINC000154050784 1129530303 /nfs/dbraw/zinc/53/03/03/1129530303.db2.gz VRLBVURSAKKOIQ-GFCCVEGCSA-N 1 0 349.456 3.906 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000123655122 1129540967 /nfs/dbraw/zinc/54/09/67/1129540967.db2.gz ZRTHQOKLWVRXEZ-MRXNPFEDSA-N 1 0 342.395 3.949 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000922562139 1129570810 /nfs/dbraw/zinc/57/08/10/1129570810.db2.gz VNPXTPYDPOXTGL-UHFFFAOYSA-N 1 0 334.803 3.647 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH+]3C[C@H]4CCC[C@@H]4C3)cs2)c1 ZINC000093442936 1129588211 /nfs/dbraw/zinc/58/82/11/1129588211.db2.gz XLQLIOQXVGIDJG-ZIAGYGMSSA-N 1 0 329.425 3.950 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N(C)Cc1ccccc1 ZINC000390557281 1129623125 /nfs/dbraw/zinc/62/31/25/1129623125.db2.gz IRQRZBLFGBWBLE-CVEARBPZSA-N 1 0 327.428 3.766 20 5 EHBDRO CC(C)C[NH+]1CCC([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000131161242 1129772260 /nfs/dbraw/zinc/77/22/60/1129772260.db2.gz PQOMULFKNAERLX-IBGZPJMESA-N 1 0 345.487 3.626 20 5 EHBDRO CCc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000056197491 1129805601 /nfs/dbraw/zinc/80/56/01/1129805601.db2.gz ZJTMPGSPXXTJMJ-KGLIPLIRSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000056196918 1129806067 /nfs/dbraw/zinc/80/60/67/1129806067.db2.gz VNCSBLGHKWVGPV-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO CC(C)C[N@@H+]1Cc2cccc(NC(=O)c3ccc([N+](=O)[O-])s3)c2C1 ZINC000162197704 1129812973 /nfs/dbraw/zinc/81/29/73/1129812973.db2.gz GBSHZPRAILYBMT-UHFFFAOYSA-N 1 0 345.424 3.880 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000162242566 1129819086 /nfs/dbraw/zinc/81/90/86/1129819086.db2.gz XMAYITZNQMEZJP-CQSZACIVSA-N 1 0 338.411 3.912 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000303471967 1129848182 /nfs/dbraw/zinc/84/81/82/1129848182.db2.gz QWWWSXWTASTBIP-QGZVFWFLSA-N 1 0 338.473 3.971 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC([C@H](O)c3ccc(F)cc3)CC2)cc1 ZINC000303989039 1129874701 /nfs/dbraw/zinc/87/47/01/1129874701.db2.gz KHHYBARTZFCMAB-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CCN(Cc2cccc(Cl)c2)CC1 ZINC000057450258 1129902661 /nfs/dbraw/zinc/90/26/61/1129902661.db2.gz QJKPWBIVXDZNIK-UHFFFAOYSA-N 1 0 331.803 3.570 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000245519298 1130228101 /nfs/dbraw/zinc/22/81/01/1130228101.db2.gz BEWGPCRDPQMALN-QILLFSRXSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2(CCCC2)C1 ZINC000173825374 1130319942 /nfs/dbraw/zinc/31/99/42/1130319942.db2.gz OMOHTTBJPXFIHG-ZDUSSCGKSA-N 1 0 342.399 3.972 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000246398439 1130378355 /nfs/dbraw/zinc/37/83/55/1130378355.db2.gz LNVVYNVYKYFIAO-USXIJHARSA-N 1 0 332.444 3.853 20 5 EHBDRO Cn1cccc1[C@H]1CCCC[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000175119287 1130408320 /nfs/dbraw/zinc/40/83/20/1130408320.db2.gz WIISSNNKKXXUSZ-MRXNPFEDSA-N 1 0 329.400 3.539 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C(=O)Nc1ccccc1 ZINC000731041778 1130762738 /nfs/dbraw/zinc/76/27/38/1130762738.db2.gz VSDDVRYREBAAPB-UHFFFAOYSA-N 1 0 347.802 3.755 20 5 EHBDRO Cc1ccc(N2CCC[C@H]([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000742381254 1131713105 /nfs/dbraw/zinc/71/31/05/1131713105.db2.gz XNOSJWNKLJMYHV-SFHVURJKSA-N 1 0 339.439 3.970 20 5 EHBDRO C[C@H]1CCCN1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000742388058 1131713838 /nfs/dbraw/zinc/71/38/38/1131713838.db2.gz QQCPLLFDPFWQKI-AWEZNQCLSA-N 1 0 345.468 3.897 20 5 EHBDRO [NH3+]Cc1ccc2nn([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)cc2c1 ZINC001172897851 1131880576 /nfs/dbraw/zinc/88/05/76/1131880576.db2.gz CIFVIJXGAAFJQC-QGZVFWFLSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1COCc3ccccc31)CC2 ZINC001172899701 1131882060 /nfs/dbraw/zinc/88/20/60/1131882060.db2.gz FABOIONZOMNHMT-XLIONFOSSA-N 1 0 338.407 3.703 20 5 EHBDRO [NH2+]=C(N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)c(F)c1 ZINC001172900421 1131883466 /nfs/dbraw/zinc/88/34/66/1131883466.db2.gz TVXAJDNGYXFYIY-CQSZACIVSA-N 1 0 345.349 3.736 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172901577 1131885507 /nfs/dbraw/zinc/88/55/07/1131885507.db2.gz NUHZTLSCWHORRW-PKOBYXMFSA-N 1 0 325.412 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH+]1CCC(OC3CCC3)CC1)CC2 ZINC001172904444 1131886953 /nfs/dbraw/zinc/88/69/53/1131886953.db2.gz NIQFQGCPRNVIQM-KRWDZBQOSA-N 1 0 344.455 3.876 20 5 EHBDRO CCOC(=O)CCCCC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913685 1131903074 /nfs/dbraw/zinc/90/30/74/1131903074.db2.gz YPYFHBKRRJDPQA-QGZVFWFLSA-N 1 0 348.443 3.555 20 5 EHBDRO COCC[C@@H]1CCCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914777 1131903160 /nfs/dbraw/zinc/90/31/60/1131903160.db2.gz ISFWITFZGABKJF-ROUUACIJSA-N 1 0 332.444 3.733 20 5 EHBDRO CCN(CC)CC[N@H+](CC)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918190 1131904229 /nfs/dbraw/zinc/90/42/29/1131904229.db2.gz YPBTWOIGPFTQJH-SFHVURJKSA-N 1 0 333.476 3.506 20 5 EHBDRO CCN(CC)CC[N@H+](CC)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172918187 1131904596 /nfs/dbraw/zinc/90/45/96/1131904596.db2.gz YPBTWOIGPFTQJH-GOSISDBHSA-N 1 0 333.476 3.506 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CC23CCCCC3)c1F ZINC001173184168 1131993718 /nfs/dbraw/zinc/99/37/18/1131993718.db2.gz OQBITZFOZKNJLO-BLLLJJGKSA-N 1 0 336.407 3.986 20 5 EHBDRO CCOc1cccc(CC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173214858 1132001331 /nfs/dbraw/zinc/00/13/31/1132001331.db2.gz QWZUHMCXYOFIHJ-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173216235 1132002316 /nfs/dbraw/zinc/00/23/16/1132002316.db2.gz HKGUCVVXPCZFDO-PBHICJAKSA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1ncccc1[C@@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173218379 1132003215 /nfs/dbraw/zinc/00/32/15/1132003215.db2.gz ANOMXACYSIRVLM-YJYMSZOUSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccc(Cl)cc2)COC1 ZINC001173219071 1132003293 /nfs/dbraw/zinc/00/32/93/1132003293.db2.gz WPDFTRPKJXXVPB-CYBMUJFWSA-N 1 0 346.814 3.695 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCO)c1cccc(Cl)c1 ZINC001173220894 1132003889 /nfs/dbraw/zinc/00/38/89/1132003889.db2.gz HTQAOEORQKRUSR-UGSOOPFHSA-N 1 0 348.830 3.893 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]2[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220634 1132004741 /nfs/dbraw/zinc/00/47/41/1132004741.db2.gz GIFVGNGEZUPMRC-BFUOFWGJSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ncccc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173223626 1132005102 /nfs/dbraw/zinc/00/51/02/1132005102.db2.gz JGGABDJOCLZPRY-SCLBCKFNSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1([C@@H]2CCOC(C)(C)C2)CC1 ZINC001173224920 1132005253 /nfs/dbraw/zinc/00/52/53/1132005253.db2.gz IFVWBDPKMRAYDH-GOEBONIOSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1cnc(Cl)s1 ZINC001173224339 1132005758 /nfs/dbraw/zinc/00/57/58/1132005758.db2.gz DWOVPAMMJBMARF-JTQLQIEISA-N 1 0 325.821 3.768 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCN(C)[C@@H](c2ccccc2)C1 ZINC001173227933 1132008234 /nfs/dbraw/zinc/00/82/34/1132008234.db2.gz SPMVACWSVHGVDQ-OXQOHEQNSA-N 1 0 339.439 3.515 20 5 EHBDRO COc1cnccc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173230355 1132008458 /nfs/dbraw/zinc/00/84/58/1132008458.db2.gz XOUWXJMIVNBHGU-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO CC(=O)c1ccc2c(c1)C[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173231867 1132008825 /nfs/dbraw/zinc/00/88/25/1132008825.db2.gz OGESFUWMELSUMT-AWEZNQCLSA-N 1 0 338.407 3.787 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCN(C)Cc1ccccc1 ZINC001173232607 1132009997 /nfs/dbraw/zinc/00/99/97/1132009997.db2.gz RWYLIRAVAFJXKM-KRWDZBQOSA-N 1 0 341.455 3.590 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(-c2ccccc2)on1 ZINC001173235875 1132010352 /nfs/dbraw/zinc/01/03/52/1132010352.db2.gz VPUDHQHHXQQIGS-AWEZNQCLSA-N 1 0 337.379 3.971 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2cc(F)ccc21 ZINC001173213526 1132013765 /nfs/dbraw/zinc/01/37/65/1132013765.db2.gz IGXMMTOQUDRDFI-CYBMUJFWSA-N 1 0 341.386 3.994 20 5 EHBDRO [NH3+]CCc1cnn(-c2cnc3c4ccccc4c4ccccc4c3n2)c1 ZINC001168946730 1132612647 /nfs/dbraw/zinc/61/26/47/1132612647.db2.gz MFBYYGXYUHFNOC-UHFFFAOYSA-N 1 0 339.402 3.623 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ncccc2C(F)(F)F)C2CC2)C1 ZINC001168997006 1132627534 /nfs/dbraw/zinc/62/75/34/1132627534.db2.gz AYSWGBJOOQIPNQ-MPKXVKKWSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001168986683 1132633481 /nfs/dbraw/zinc/63/34/81/1132633481.db2.gz YHODWRZUVLNGSN-FZMZJTMJSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001168986684 1132633644 /nfs/dbraw/zinc/63/36/44/1132633644.db2.gz YHODWRZUVLNGSN-RISCZKNCSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001168986783 1132634843 /nfs/dbraw/zinc/63/48/43/1132634843.db2.gz ZLANGDHMMZOHRH-FZMZJTMJSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035322 1132636514 /nfs/dbraw/zinc/63/65/14/1132636514.db2.gz KGZRHNQMIXRWNC-IAQYHMDHSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@@H+]2CCc3cc(C(F)(F)F)ccc3C2)C1 ZINC001169040268 1132638391 /nfs/dbraw/zinc/63/83/91/1132638391.db2.gz ZFYBVASWXCFSPX-XHDPSFHLSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3c2cccc3F)C1 ZINC001169042046 1132638648 /nfs/dbraw/zinc/63/86/48/1132638648.db2.gz CQNGNDFPYPTFBP-ZFWWWQNUSA-N 1 0 345.418 3.865 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2cccc(F)c2[N+](=O)[O-])cc1 ZINC000103135175 1132705330 /nfs/dbraw/zinc/70/53/30/1132705330.db2.gz UEJNHKUKQWHOCD-UHFFFAOYSA-N 1 0 347.390 3.677 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@@H](C2CCOCC2)C1 ZINC001175697581 1132729984 /nfs/dbraw/zinc/72/99/84/1132729984.db2.gz DYGUSEVLEQARDW-MRXNPFEDSA-N 1 0 348.443 3.632 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC(C)(C)N1CCC[C@H](C)C1 ZINC001177483321 1133068305 /nfs/dbraw/zinc/06/83/05/1133068305.db2.gz MPGXRJRTTMWBIX-AWEZNQCLSA-N 1 0 333.476 3.812 20 5 EHBDRO Cc1c(CNc2cccc(OCCC[NH+](C)C)c2)cccc1[N+](=O)[O-] ZINC001178099065 1133131574 /nfs/dbraw/zinc/13/15/74/1133131574.db2.gz YOINPJVZYGYZSF-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@H]2CCCCO2)o1 ZINC001178295483 1133153985 /nfs/dbraw/zinc/15/39/85/1133153985.db2.gz RDMNVTMMZVNLHJ-CQSZACIVSA-N 1 0 330.384 3.904 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@](C)(O)c1ccccc1Cl ZINC001178431783 1133163301 /nfs/dbraw/zinc/16/33/01/1133163301.db2.gz UYOIKQXRRJUOKB-GOSISDBHSA-N 1 0 348.830 3.862 20 5 EHBDRO Cc1c(C[NH2+]C[C@](C)(Cc2ccccc2)[C@@H](C)O)cccc1[N+](=O)[O-] ZINC001178648216 1133188244 /nfs/dbraw/zinc/18/82/44/1133188244.db2.gz VDEOJRCWOKKVHA-UZLBHIALSA-N 1 0 342.439 3.623 20 5 EHBDRO Cc1cc(C)c(C[NH2+][C@](C)(CO)c2cccc([N+](=O)[O-])c2)cc1C ZINC001179353373 1133243399 /nfs/dbraw/zinc/24/33/99/1133243399.db2.gz QDGQPELOCKKVJN-LJQANCHMSA-N 1 0 328.412 3.517 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@]1(C)CCOC2(CCC2)C1 ZINC001179622642 1133268271 /nfs/dbraw/zinc/26/82/71/1133268271.db2.gz ZIAKQERWRHKINK-SFHVURJKSA-N 1 0 348.443 3.823 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@@H](C)[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954226 1133365504 /nfs/dbraw/zinc/36/55/04/1133365504.db2.gz QJRIHCWEQBEFPK-VPZZIHKRSA-N 1 0 344.386 3.775 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccc(F)c1 ZINC000774146905 1133622498 /nfs/dbraw/zinc/62/24/98/1133622498.db2.gz JPAKVNZKPKFYBM-KBRIMQKVSA-N 1 0 346.406 3.807 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001184053646 1133891525 /nfs/dbraw/zinc/89/15/25/1133891525.db2.gz BZNMYUWNMXDZJB-CAIZAGQASA-N 1 0 344.455 3.853 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1c(C)noc1C ZINC000786813039 1133910179 /nfs/dbraw/zinc/91/01/79/1133910179.db2.gz BFVCJGSRQZHMMQ-RAXLEYEMSA-N 1 0 329.400 3.825 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774839609 1134046411 /nfs/dbraw/zinc/04/64/11/1134046411.db2.gz NAJXSBYNJOFQCR-UHFFFAOYSA-N 1 0 335.385 3.629 20 5 EHBDRO Cc1cc(NC[C@H](C)[N@@H+]2CCc3ccccc3C2)c(F)cc1[N+](=O)[O-] ZINC001185148876 1134047307 /nfs/dbraw/zinc/04/73/07/1134047307.db2.gz IOIYOSFDCHOFQC-AWEZNQCLSA-N 1 0 343.402 3.901 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000788578534 1134147316 /nfs/dbraw/zinc/14/73/16/1134147316.db2.gz BAUJLTYBDKJIQD-RTBURBONSA-N 1 0 340.423 3.949 20 5 EHBDRO Cc1ncc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000788591621 1134148993 /nfs/dbraw/zinc/14/89/93/1134148993.db2.gz IUIMGNCEUGPBBZ-INIZCTEOSA-N 1 0 331.441 3.914 20 5 EHBDRO CC[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1F ZINC000788629345 1134153781 /nfs/dbraw/zinc/15/37/81/1134153781.db2.gz TULYRBPZKLWEJO-OCCSQVGLSA-N 1 0 347.390 3.824 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Oc1ccccc1Cl ZINC000788665094 1134159089 /nfs/dbraw/zinc/15/90/89/1134159089.db2.gz MJYXBUJODXXPNT-NEPJUHHUSA-N 1 0 349.818 3.949 20 5 EHBDRO CCCC[N@H+](C)C[C@@H](C)Nc1cccc(Br)c1[N+](=O)[O-] ZINC001186610697 1134236155 /nfs/dbraw/zinc/23/61/55/1134236155.db2.gz AGBCHQBPXOWELD-LLVKDONJSA-N 1 0 344.253 3.890 20 5 EHBDRO C[NH+](C)[C@H]1C[C@@H](Nc2cccc(C(F)(F)F)c2[N+](=O)[O-])C12CCC2 ZINC001187025870 1134284043 /nfs/dbraw/zinc/28/40/43/1134284043.db2.gz UFUHEDJEEXWDJU-OLZOCXBDSA-N 1 0 343.349 3.898 20 5 EHBDRO Cc1ccccc1OCCC[N@@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001190417066 1134696558 /nfs/dbraw/zinc/69/65/58/1134696558.db2.gz GLUJPELFIZOESB-UHFFFAOYSA-N 1 0 344.411 3.683 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC001170293035 1134735745 /nfs/dbraw/zinc/73/57/45/1134735745.db2.gz JIRUDYIVBZBGDT-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001170295175 1134736644 /nfs/dbraw/zinc/73/66/44/1134736644.db2.gz AGEVQMUBDSKOGW-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170298278 1134737853 /nfs/dbraw/zinc/73/78/53/1134737853.db2.gz IATDUYSJHOJEAP-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2CC3(C2)CC(F)(F)C3)c([N+](=O)[O-])c1 ZINC001170317267 1134746368 /nfs/dbraw/zinc/74/63/68/1134746368.db2.gz DIWVFLOUJLTVJX-NSHDSACASA-N 1 0 340.370 3.702 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCc3cnccc32)c([N+](=O)[O-])c1 ZINC001170328084 1134749723 /nfs/dbraw/zinc/74/97/23/1134749723.db2.gz UUCHCGKMXLGXSJ-UGSOOPFHSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+]2C[C@H]3CC[C@@H](C2)C3(F)F)c([N+](=O)[O-])c1 ZINC001170335422 1134752159 /nfs/dbraw/zinc/75/21/59/1134752159.db2.gz NJLDVJRMBWOYMQ-BNOWGMLFSA-N 1 0 340.370 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCCc3cccnc32)c([N+](=O)[O-])c1 ZINC001170306559 1134752190 /nfs/dbraw/zinc/75/21/90/1134752190.db2.gz XLUXCPQRLRANMU-SUMWQHHRSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[NH+]2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170336117 1134752594 /nfs/dbraw/zinc/75/25/94/1134752594.db2.gz UFXGWFJKWHELBF-NSHDSACASA-N 1 0 346.349 3.809 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C2CCC2)C2CCOCC2)c([N+](=O)[O-])c1 ZINC001170355518 1134754329 /nfs/dbraw/zinc/75/43/29/1134754329.db2.gz IBVVXTUZBBSREM-AWEZNQCLSA-N 1 0 348.443 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2cccs2)C2CC2)c([N+](=O)[O-])c1 ZINC000792877649 1134809394 /nfs/dbraw/zinc/80/93/94/1134809394.db2.gz UTRKTQWYYFFOOL-HNNXBMFYSA-N 1 0 333.369 3.805 20 5 EHBDRO C[C@H](CCNC(=O)OC(C)(C)C)[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000793598711 1134966397 /nfs/dbraw/zinc/96/63/97/1134966397.db2.gz BFWBNGSOPYSBCP-IUCKJTJTSA-N 1 0 349.431 3.501 20 5 EHBDRO CN(C)c1ccc(NC2CC(C)(C)[NH+](C)C(C)(C)C2)c([N+](=O)[O-])c1 ZINC001170452046 1135091717 /nfs/dbraw/zinc/09/17/17/1135091717.db2.gz UOXMXSLWCGOUNS-UHFFFAOYSA-N 1 0 334.464 3.724 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)C2CCCCCC2)c1 ZINC001193261538 1135118979 /nfs/dbraw/zinc/11/89/79/1135118979.db2.gz QJWKRFYQITUNQP-ZDUSSCGKSA-N 1 0 334.416 3.830 20 5 EHBDRO C[C@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804814197 1135203168 /nfs/dbraw/zinc/20/31/68/1135203168.db2.gz ZYCKENUMWVHASF-WCQYABFASA-N 1 0 343.349 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CCO)c2ccc(Cl)cc2)cc1F ZINC000805821391 1135336376 /nfs/dbraw/zinc/33/63/76/1135336376.db2.gz JPWXJJSAFIXZFD-HNNXBMFYSA-N 1 0 338.766 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@@H](Oc3ccccc3)C2)cc1 ZINC001196294464 1135544827 /nfs/dbraw/zinc/54/48/27/1135544827.db2.gz XWQNMVNUBUYDGN-LJQANCHMSA-N 1 0 342.395 3.517 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])C1 ZINC000809355130 1135823976 /nfs/dbraw/zinc/82/39/76/1135823976.db2.gz MADISZRGULTFSH-LBPRGKRZSA-N 1 0 327.375 3.701 20 5 EHBDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809733364 1135873933 /nfs/dbraw/zinc/87/39/33/1135873933.db2.gz UBKKECQRTMXIME-HNAYVOBHSA-N 1 0 342.439 3.974 20 5 EHBDRO CC[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCOC1 ZINC000809935404 1135902313 /nfs/dbraw/zinc/90/23/13/1135902313.db2.gz HDSFDUCTZHTNTG-JTQLQIEISA-N 1 0 333.215 3.760 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]C[C@H]1CCOc2ccccc21 ZINC001201692888 1136057439 /nfs/dbraw/zinc/05/74/39/1136057439.db2.gz IOCMLJIMQGVWQB-CQSZACIVSA-N 1 0 346.814 3.947 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH+]2CCC3(CCCC3)CC2)c1 ZINC000811461295 1136089641 /nfs/dbraw/zinc/08/96/41/1136089641.db2.gz KJKKXAHFFLBROS-UHFFFAOYSA-N 1 0 332.400 3.538 20 5 EHBDRO CC[N@H+](CCNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C(C)C ZINC000811477035 1136096193 /nfs/dbraw/zinc/09/61/93/1136096193.db2.gz BSONXYILIRBSGZ-UHFFFAOYSA-N 1 0 334.247 3.722 20 5 EHBDRO C[N@@H+](Cc1ccc2ccccc2c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271502 1136122523 /nfs/dbraw/zinc/12/25/23/1136122523.db2.gz LQTHGYVYBRJBAR-HXUWFJFHSA-N 1 0 336.391 3.913 20 5 EHBDRO C[C@@H]1C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000776278076 1136130831 /nfs/dbraw/zinc/13/08/31/1136130831.db2.gz RPDXKWXPEPXDDR-XPGWFJOJSA-N 1 0 340.423 3.754 20 5 EHBDRO Cc1ccc([C@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278192 1136133193 /nfs/dbraw/zinc/13/31/93/1136133193.db2.gz SNIKGPBPMFXYHI-MOPGFXCFSA-N 1 0 326.396 3.774 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000813793845 1136363385 /nfs/dbraw/zinc/36/33/85/1136363385.db2.gz BNXUUDURFRDSOB-MAVJXHJTSA-N 1 0 332.787 3.585 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C)Cc1ccccc1 ZINC001202482981 1136399848 /nfs/dbraw/zinc/39/98/48/1136399848.db2.gz BJVHANHDJVWANW-QGZVFWFLSA-N 1 0 328.412 3.559 20 5 EHBDRO CCC[N@H+](CCc1cccc(F)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585581 1136448202 /nfs/dbraw/zinc/44/82/02/1136448202.db2.gz XDVCVSYQFOTDKI-IBGZPJMESA-N 1 0 346.402 3.722 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)s1 ZINC000776585599 1136448538 /nfs/dbraw/zinc/44/85/38/1136448538.db2.gz XLQDYMPCSRELSD-WFASDCNBSA-N 1 0 349.456 3.649 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H](c2ccco2)C1 ZINC000776589717 1136452856 /nfs/dbraw/zinc/45/28/56/1136452856.db2.gz VUPNDISZUILLIL-XYPHTWIQSA-N 1 0 330.384 3.694 20 5 EHBDRO CCc1ccc([C@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640969 1136487814 /nfs/dbraw/zinc/48/78/14/1136487814.db2.gz ZHQBTRJMNPRNFW-AZUAARDMSA-N 1 0 340.423 3.680 20 5 EHBDRO C[NH+](C)[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1ccccc1 ZINC000111195312 1136520531 /nfs/dbraw/zinc/52/05/31/1136520531.db2.gz XIQZUXGNAUJIBI-OAHLLOKOSA-N 1 0 342.424 3.919 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1c[nH]nc1-c1cccs1 ZINC000338958864 1136588702 /nfs/dbraw/zinc/58/87/02/1136588702.db2.gz UIYGJYPJYZTESO-UHFFFAOYSA-N 1 0 342.424 3.721 20 5 EHBDRO CCOCCC1(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCCC1 ZINC000815589590 1136615873 /nfs/dbraw/zinc/61/58/73/1136615873.db2.gz YAEMOCKQNIJNAA-AWEZNQCLSA-N 1 0 335.448 3.815 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CC[C@H](c2ccccc2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815627391 1136620784 /nfs/dbraw/zinc/62/07/84/1136620784.db2.gz ZTPPGAJJNSBHIO-VVFCZOMOSA-N 1 0 341.411 3.748 20 5 EHBDRO C[C@H]1CCC[C@]1(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000816660471 1136745679 /nfs/dbraw/zinc/74/56/79/1136745679.db2.gz FURJEYKQAJZKCY-XPTSAGLGSA-N 1 0 333.215 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC23CCSCC3)cc1Cl ZINC000817409693 1136805439 /nfs/dbraw/zinc/80/54/39/1136805439.db2.gz DUXUXKIKSGNFHI-LBPRGKRZSA-N 1 0 326.849 3.871 20 5 EHBDRO Cc1ccccc1C(C)(C)C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818995386 1136898416 /nfs/dbraw/zinc/89/84/16/1136898416.db2.gz RTLVWGOFJPSNCO-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1ccccc1C(C)(C)C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818994600 1136898502 /nfs/dbraw/zinc/89/85/02/1136898502.db2.gz HKWHDIXRNWGTFZ-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO CC[C@H](CSc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819187750 1136921253 /nfs/dbraw/zinc/92/12/53/1136921253.db2.gz RXHVSROKYUESTF-QAPCUYQASA-N 1 0 346.452 3.789 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C2CC2)cn1 ZINC000858341947 1136959750 /nfs/dbraw/zinc/95/97/50/1136959750.db2.gz IDTAYPVBTRBXLM-KRWDZBQOSA-N 1 0 347.802 3.893 20 5 EHBDRO C[C@@H](C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000780764765 1137017355 /nfs/dbraw/zinc/01/73/55/1137017355.db2.gz QLBRYPXKDTYYPJ-BBRMVZONSA-N 1 0 330.432 3.690 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(F)c3)C2)cc1F ZINC000860104071 1137044462 /nfs/dbraw/zinc/04/44/62/1137044462.db2.gz GJEOFTLXMCNVKW-CQSZACIVSA-N 1 0 348.349 3.871 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000824799035 1137152837 /nfs/dbraw/zinc/15/28/37/1137152837.db2.gz JKIXDWQAUKMERW-WBMJQRKESA-N 1 0 326.824 3.789 20 5 EHBDRO [NH3+][C@H]1CCc2c3ccccc3n(-c3cc(F)cc(F)c3[N+](=O)[O-])c2C1 ZINC001171092792 1137182826 /nfs/dbraw/zinc/18/28/26/1137182826.db2.gz GWJFXGXYPJMPQI-NSHDSACASA-N 1 0 343.333 3.633 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)c1ccccc1 ZINC000119969511 1137221295 /nfs/dbraw/zinc/22/12/95/1137221295.db2.gz PMDWQFCEGBLBMJ-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)C2)c(C(F)F)c1 ZINC000865449050 1137284877 /nfs/dbraw/zinc/28/48/77/1137284877.db2.gz SCKZBQHMDOSJNT-ZDUSSCGKSA-N 1 0 325.359 3.597 20 5 EHBDRO CS[C@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000865734120 1137307517 /nfs/dbraw/zinc/30/75/17/1137307517.db2.gz JKWZLXSSXFQWOZ-YEORSEQZSA-N 1 0 335.454 3.702 20 5 EHBDRO COc1cc2c(c(C[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)c1)O[C@H](C)C2 ZINC000865786798 1137312026 /nfs/dbraw/zinc/31/20/26/1137312026.db2.gz CLTHABRQAOGROS-CYBMUJFWSA-N 1 0 342.395 3.525 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@]34CCC[C@H]3OCC4)o2)cc1 ZINC000865859776 1137317311 /nfs/dbraw/zinc/31/73/11/1137317311.db2.gz QCFJXSVDPGAYET-MSOLQXFVSA-N 1 0 328.368 3.656 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C[C@H](O)c1ccco1 ZINC000120777671 1137317554 /nfs/dbraw/zinc/31/75/54/1137317554.db2.gz ZVMPEDBWMGVUKR-KEYYUXOJSA-N 1 0 332.400 3.611 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC000866022585 1137324971 /nfs/dbraw/zinc/32/49/71/1137324971.db2.gz DGJZQQRYMIVOPE-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO COc1cccc2c1OCCC[C@@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000866250412 1137339308 /nfs/dbraw/zinc/33/93/08/1137339308.db2.gz ZYNBIRPEJKWCCO-INIZCTEOSA-N 1 0 328.368 3.607 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866326047 1137345718 /nfs/dbraw/zinc/34/57/18/1137345718.db2.gz HUHNBDGDSVHVMI-KBRIMQKVSA-N 1 0 338.423 3.848 20 5 EHBDRO Cc1csc([C@@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866336679 1137347016 /nfs/dbraw/zinc/34/70/16/1137347016.db2.gz GMDWAQRNAJYBBW-QWRGUYRKSA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)[C@](C)(O)c1ccccc1 ZINC000866383417 1137350613 /nfs/dbraw/zinc/35/06/13/1137350613.db2.gz LSPDJWYXQBNCKO-TYILLQQXSA-N 1 0 346.402 3.551 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000866394346 1137351455 /nfs/dbraw/zinc/35/14/55/1137351455.db2.gz VWMIESWRAOCHIV-MWLCHTKSSA-N 1 0 335.206 3.838 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)C(C)(F)F ZINC000866544690 1137363723 /nfs/dbraw/zinc/36/37/23/1137363723.db2.gz ZGWJKJRWDATRKB-NWDGAFQWSA-N 1 0 330.379 3.546 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)CC1(Br)CC1 ZINC000846783517 1137365635 /nfs/dbraw/zinc/36/56/35/1137365635.db2.gz PIYHRIUCBDELAQ-UHFFFAOYSA-N 1 0 327.222 3.733 20 5 EHBDRO CC[C@H]([NH2+]CCc1cn(C)c2ncccc12)c1cccc([N+](=O)[O-])c1 ZINC000866569869 1137365776 /nfs/dbraw/zinc/36/57/76/1137365776.db2.gz AGSBGNBMYKNIOD-SFHVURJKSA-N 1 0 338.411 3.765 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](O)c1ccccc1Cl ZINC000773011002 1137459144 /nfs/dbraw/zinc/45/91/44/1137459144.db2.gz QQJVHGFYNSZALU-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCCc3cccs3)CC2)cc1 ZINC000773146265 1137469976 /nfs/dbraw/zinc/46/99/76/1137469976.db2.gz PKFZCMFLJJOGJK-UHFFFAOYSA-N 1 0 345.468 3.848 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@H](NC(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000715138464 1137476293 /nfs/dbraw/zinc/47/62/93/1137476293.db2.gz UVAGRAGAKPIUBG-UMVBOHGHSA-N 1 0 349.431 3.549 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2ccccc2[C@H](C)C1 ZINC001171740831 1137511106 /nfs/dbraw/zinc/51/11/06/1137511106.db2.gz IIMQJDBWPTYHSA-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO C[C@@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023186 1137565456 /nfs/dbraw/zinc/56/54/56/1137565456.db2.gz CZOGVNCIGOVAAH-IUODEOHRSA-N 1 0 334.395 3.696 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])c1OC ZINC000872026176 1137565821 /nfs/dbraw/zinc/56/58/21/1137565821.db2.gz YPZYCQWNRVXLAT-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccc(C)nc1 ZINC000872033634 1137566625 /nfs/dbraw/zinc/56/66/25/1137566625.db2.gz CVIVDNYXMRLRMF-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)CCCO ZINC000872046206 1137567580 /nfs/dbraw/zinc/56/75/80/1137567580.db2.gz FUCSAZOXAYYPIB-GFCCVEGCSA-N 1 0 326.462 3.766 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872047160 1137567668 /nfs/dbraw/zinc/56/76/68/1137567668.db2.gz BUGFPBIJGPNMFO-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000872073169 1137569715 /nfs/dbraw/zinc/56/97/15/1137569715.db2.gz NXKSKFXTDNQELK-KDOFPFPSSA-N 1 0 345.443 3.802 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)C(C)(C)O ZINC000872077345 1137570073 /nfs/dbraw/zinc/57/00/73/1137570073.db2.gz GVGWNVDMRJWNHQ-LLVKDONJSA-N 1 0 326.462 3.764 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(CO)cc1 ZINC000872082231 1137570345 /nfs/dbraw/zinc/57/03/45/1137570345.db2.gz SMDLRSWCSJCEIG-GFCCVEGCSA-N 1 0 332.425 3.660 20 5 EHBDRO C[C@@H]([NH2+]CCc1cn(C)c2ncccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872090805 1137570809 /nfs/dbraw/zinc/57/08/09/1137570809.db2.gz DMXBJKOBDBNACL-GFCCVEGCSA-N 1 0 342.374 3.514 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]3CCC[C@@H]3O2)cc1[N+](=O)[O-] ZINC000872109780 1137571756 /nfs/dbraw/zinc/57/17/56/1137571756.db2.gz RFQMPAKGIWVDKY-GUSZCTEKSA-N 1 0 334.416 3.602 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000872128115 1137572997 /nfs/dbraw/zinc/57/29/97/1137572997.db2.gz FLWYICUGCOJWNH-HEWAKGLMSA-N 1 0 332.425 3.744 20 5 EHBDRO COc1ccc2c(c1)OCC[C@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873061737 1137589185 /nfs/dbraw/zinc/58/91/85/1137589185.db2.gz LBAWTASMTFUMNS-MRXNPFEDSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)c1ccc([S@](C)=O)cc1 ZINC000873097793 1137590222 /nfs/dbraw/zinc/59/02/22/1137590222.db2.gz FZHGVGQKFVNBHC-SHACYNPGSA-N 1 0 346.452 3.800 20 5 EHBDRO CC(C)n1ncc2cc(C[NH2+][C@H](C)c3ccccc3[N+](=O)[O-])cnc21 ZINC000873184775 1137593036 /nfs/dbraw/zinc/59/30/36/1137593036.db2.gz XZOWJMWDIICQNA-CYBMUJFWSA-N 1 0 339.399 3.771 20 5 EHBDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876989824 1137667115 /nfs/dbraw/zinc/66/71/15/1137667115.db2.gz HJDHZZKDHPJNIF-OOHWJJMZSA-N 1 0 342.443 3.841 20 5 EHBDRO CC(C)(C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1Cl ZINC000877003384 1137667398 /nfs/dbraw/zinc/66/73/98/1137667398.db2.gz SRHVOBAUZOMGFE-UHFFFAOYSA-N 1 0 348.834 3.716 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CCC[C@@H]2C2CC2)o1 ZINC000878050629 1137700866 /nfs/dbraw/zinc/70/08/66/1137700866.db2.gz ZLZALHDQRGKBCE-CYBMUJFWSA-N 1 0 348.790 3.673 20 5 EHBDRO C[C@@H]1C[C@H](C)[C@@H](C)[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878497111 1137717973 /nfs/dbraw/zinc/71/79/73/1137717973.db2.gz QTVGNSHLRMFMIN-FRRDWIJNSA-N 1 0 330.388 3.511 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000880096910 1137767998 /nfs/dbraw/zinc/76/79/98/1137767998.db2.gz XGHKSLYIZSCCLF-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO CC[C@@H](c1ccncc1)[N@H+](CC)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000131487121 1137854437 /nfs/dbraw/zinc/85/44/37/1137854437.db2.gz XCNBFEJZWROOSV-KRWDZBQOSA-N 1 0 339.399 3.770 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000332095518 1137931488 /nfs/dbraw/zinc/93/14/88/1137931488.db2.gz DRABEGRCYVSHEI-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO Cn1cc(C[NH2+]CCC2=CCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000120145431 1137946848 /nfs/dbraw/zinc/94/68/48/1137946848.db2.gz JFWDFWNZHAEVOP-UHFFFAOYSA-N 1 0 326.400 3.585 20 5 EHBDRO COc1cc(C)cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1OC ZINC000886087469 1138039216 /nfs/dbraw/zinc/03/92/16/1138039216.db2.gz UMGPASLROUKJOO-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO CC(C)[N@H+](Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCCC1 ZINC000072824101 1138108254 /nfs/dbraw/zinc/10/82/54/1138108254.db2.gz GFLGZUNMFMZABY-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO Cc1ccc(NC(=O)CCc2cccc([N+](=O)[O-])c2)c(C[NH+](C)C)c1 ZINC000087363416 1138190659 /nfs/dbraw/zinc/19/06/59/1138190659.db2.gz YSNJKSAKGDVOEZ-UHFFFAOYSA-N 1 0 341.411 3.536 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000093337388 1138236230 /nfs/dbraw/zinc/23/62/30/1138236230.db2.gz LNPXNYORBZLKJI-ZDUSSCGKSA-N 1 0 347.440 3.577 20 5 EHBDRO COc1ccc(C[NH2+]CCc2ccc(Cl)s2)cc1[N+](=O)[O-] ZINC000223448900 1138510947 /nfs/dbraw/zinc/51/09/47/1138510947.db2.gz CYPJWMKIWNUKAW-UHFFFAOYSA-N 1 0 326.805 3.651 20 5 EHBDRO CC[C@@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000302092479 1138711351 /nfs/dbraw/zinc/71/13/51/1138711351.db2.gz FEKLVSBBTSXTAX-JSGCOSHPSA-N 1 0 337.420 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC[C@H]([NH+]4CCCC4)CC3)ccc2c1 ZINC000150885660 1138989546 /nfs/dbraw/zinc/98/95/46/1138989546.db2.gz BBRCQKZKRCPGDK-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO O=c1cc(C[NH2+][C@H]2CCC[C@H]3OCC[C@@H]32)c2c(ccc3ccccc32)o1 ZINC000151136347 1139011556 /nfs/dbraw/zinc/01/15/56/1139011556.db2.gz UQYFHDQTWLIEMA-CEXWTWQISA-N 1 0 349.430 3.993 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000178781324 1139717302 /nfs/dbraw/zinc/71/73/02/1139717302.db2.gz PQOFUFXXMVVXJM-AWEZNQCLSA-N 1 0 330.384 3.902 20 5 EHBDRO CCOc1ccc([C@@H](C)NC2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000179403394 1139754899 /nfs/dbraw/zinc/75/48/99/1139754899.db2.gz CFUWTVMBURUROH-CQSZACIVSA-N 1 0 347.459 3.519 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180042849 1139803836 /nfs/dbraw/zinc/80/38/36/1139803836.db2.gz XSOQRNNBTUSBAQ-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO C[C@@H](O)[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867739 1139870287 /nfs/dbraw/zinc/87/02/87/1139870287.db2.gz XWODQLCQXLMUMB-OCCSQVGLSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@@H]1CCCCO1)C1CC1 ZINC000183998821 1140073310 /nfs/dbraw/zinc/07/33/10/1140073310.db2.gz ZQJMVYYHFJEWMM-ROUUACIJSA-N 1 0 332.444 3.855 20 5 EHBDRO CCCO[C@H]1CCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])CC1 ZINC000184212070 1140087581 /nfs/dbraw/zinc/08/75/81/1140087581.db2.gz ISEQKVCMBONILZ-AWEZNQCLSA-N 1 0 340.395 3.524 20 5 EHBDRO C[C@](O)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192887856 1140554041 /nfs/dbraw/zinc/55/40/41/1140554041.db2.gz PHTJRSFCLMEBOC-RDJZCZTQSA-N 1 0 332.425 3.531 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccsc1)[NH+](C)C ZINC000266973710 1140745486 /nfs/dbraw/zinc/74/54/86/1140745486.db2.gz MUDFIWMOCZYOAH-MRXNPFEDSA-N 1 0 335.429 3.518 20 5 EHBDRO COc1ccc(OC)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000268748626 1140982687 /nfs/dbraw/zinc/98/26/87/1140982687.db2.gz ISYYUOUAJLEHGG-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000269672664 1141134474 /nfs/dbraw/zinc/13/44/74/1141134474.db2.gz RKPNDQBAFOYLGJ-RKVPGOIHSA-N 1 0 329.444 3.605 20 5 EHBDRO C[C@H](C[C@H](O)c1ccc(F)cc1)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000270602496 1141243612 /nfs/dbraw/zinc/24/36/12/1141243612.db2.gz FXZIRXJVUHLMSG-VFVRVIDISA-N 1 0 332.375 3.897 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cn(C)nc1C ZINC000271131397 1141312097 /nfs/dbraw/zinc/31/20/97/1141312097.db2.gz MBAAYTPCXXODTN-TZMCWYRMSA-N 1 0 348.472 3.858 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cnn(C)c1 ZINC000271185879 1141320490 /nfs/dbraw/zinc/32/04/90/1141320490.db2.gz WPHJDEPBYPZAKI-JSGCOSHPSA-N 1 0 334.445 3.550 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCO1 ZINC000271258084 1141335373 /nfs/dbraw/zinc/33/53/73/1141335373.db2.gz ACNPFXXMGUQUQT-CHWSQXEVSA-N 1 0 347.440 3.623 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@H](C(C)C)C2)cc1[N+](=O)[O-] ZINC000271372704 1141353378 /nfs/dbraw/zinc/35/33/78/1141353378.db2.gz GYWIGXLFIAWLKY-DHSIGJKJSA-N 1 0 336.432 3.848 20 5 EHBDRO CC(C)(CCCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000271441043 1141367351 /nfs/dbraw/zinc/36/73/51/1141367351.db2.gz CMTPWQDYDAOWQM-UHFFFAOYSA-N 1 0 332.400 3.743 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CCOC2(CCC2)C1)C1CC1 ZINC000271450923 1141370274 /nfs/dbraw/zinc/37/02/74/1141370274.db2.gz DOOFBAJWBPHQJA-IAGOWNOFSA-N 1 0 330.428 3.607 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000271455146 1141371475 /nfs/dbraw/zinc/37/14/75/1141371475.db2.gz GNLKVLYAMACJPU-JCGVRSQUSA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000271455151 1141371742 /nfs/dbraw/zinc/37/17/42/1141371742.db2.gz GNLKVLYAMACJPU-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO COc1cc([C@@H](C)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000348753144 1141575559 /nfs/dbraw/zinc/57/55/59/1141575559.db2.gz HXBNLKXPGRVFAN-SJKOYZFVSA-N 1 0 327.384 3.727 20 5 EHBDRO [NH3+]CCN(Cc1ccccc1C(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000348924948 1141609740 /nfs/dbraw/zinc/60/97/40/1141609740.db2.gz XBMWJIRSPUZZAL-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1OC)c1ccc(OC)cc1 ZINC000430223206 1015100173 /nfs/dbraw/zinc/10/01/73/1015100173.db2.gz UOUBPTZXQLGUTQ-KRWDZBQOSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228996 1015127482 /nfs/dbraw/zinc/12/74/82/1015127482.db2.gz SOCLOLZJZBCBLB-OAHLLOKOSA-N 1 0 342.395 3.602 20 5 EHBDRO CC(=O)c1ccc2c(c1)CCN(Cc1c(F)cccc1[N+](=O)[O-])CC2 ZINC000339622313 1015397059 /nfs/dbraw/zinc/39/70/59/1015397059.db2.gz GZVIMPTZPJFTTB-UHFFFAOYSA-N 1 0 342.370 3.537 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NC[C@@H](c1ccccc1)[NH+](CC)CC ZINC000327560418 1015446759 /nfs/dbraw/zinc/44/67/59/1015446759.db2.gz LETVZJYLPZWURJ-INIZCTEOSA-N 1 0 345.447 3.615 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000120614918 1015708769 /nfs/dbraw/zinc/70/87/69/1015708769.db2.gz RDNIXPKNXFWRFW-CHWSQXEVSA-N 1 0 330.432 3.535 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000066854381 1015778657 /nfs/dbraw/zinc/77/86/57/1015778657.db2.gz RFQIALBWLPNDKF-OAHLLOKOSA-N 1 0 341.411 3.577 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000247116386 1016532617 /nfs/dbraw/zinc/53/26/17/1016532617.db2.gz PKXXTRZGILAMGH-JPXDGAFASA-N 1 0 338.473 3.715 20 5 EHBDRO COCC[N@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC001167205911 1016582617 /nfs/dbraw/zinc/58/26/17/1016582617.db2.gz KFIIPQYEEQNHFL-UHFFFAOYSA-N 1 0 348.830 3.939 20 5 EHBDRO C[N@H+](CCCCCO)Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000278808753 1016912210 /nfs/dbraw/zinc/91/22/10/1016912210.db2.gz GKLJXLZYSPEEKX-UHFFFAOYSA-N 1 0 325.408 3.541 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1nn(C)c2ccccc12 ZINC000547832182 1016998738 /nfs/dbraw/zinc/99/87/38/1016998738.db2.gz UJFBBXBNZMNLKL-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000538160757 1032180531 /nfs/dbraw/zinc/18/05/31/1032180531.db2.gz POQNLLVTQWPWCN-MRXNPFEDSA-N 1 0 341.411 3.891 20 5 EHBDRO C[C@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449129752 1032226130 /nfs/dbraw/zinc/22/61/30/1032226130.db2.gz WIRISMSYGUVHBJ-CABCVRRESA-N 1 0 328.412 3.842 20 5 EHBDRO COc1cc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])ccc1C ZINC000449162981 1032279161 /nfs/dbraw/zinc/27/91/61/1032279161.db2.gz KXNTYZGJQYVBSL-OAHLLOKOSA-N 1 0 328.412 3.675 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)n1 ZINC000449179179 1032291846 /nfs/dbraw/zinc/29/18/46/1032291846.db2.gz ZEKFRZKSUDQAMF-XEBKBJJBSA-N 1 0 344.415 3.533 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000536838864 1032332670 /nfs/dbraw/zinc/33/26/70/1032332670.db2.gz LJCSEWKRVJAMCH-HNAYVOBHSA-N 1 0 339.439 3.692 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](c2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000538391397 1032336374 /nfs/dbraw/zinc/33/63/74/1032336374.db2.gz AHNARZJVLSHOMS-LJQANCHMSA-N 1 0 342.395 3.723 20 5 EHBDRO Cc1cc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc(C)c1O ZINC000449270988 1032391363 /nfs/dbraw/zinc/39/13/63/1032391363.db2.gz DVBPCKRKQDXUKV-OAHLLOKOSA-N 1 0 328.412 3.681 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C1(C2CCC2)CCC1 ZINC000459755334 1032448530 /nfs/dbraw/zinc/44/85/30/1032448530.db2.gz FEDAKBZBMUNKBT-UHFFFAOYSA-N 1 0 331.416 3.544 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccnn1C1CCCC1 ZINC000449316897 1032449886 /nfs/dbraw/zinc/44/98/86/1032449886.db2.gz QZSVWCNJJFHQDZ-UHFFFAOYSA-N 1 0 328.416 3.581 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(C[NH+](C)C)c(C)c1 ZINC000459737244 1032453466 /nfs/dbraw/zinc/45/34/66/1032453466.db2.gz HZPFYYLLUSTRFE-UHFFFAOYSA-N 1 0 343.427 3.976 20 5 EHBDRO CC[C@@H]1CCC[C@@H]1C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000449432964 1032549637 /nfs/dbraw/zinc/54/96/37/1032549637.db2.gz KEGVHMDELQWCKD-QGPMSJSTSA-N 1 0 342.443 3.834 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cc1 ZINC000537307750 1032613513 /nfs/dbraw/zinc/61/35/13/1032613513.db2.gz QTDCFDCAGRSBST-OTWHNJEPSA-N 1 0 344.455 3.855 20 5 EHBDRO Cc1cccnc1CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449488617 1032646960 /nfs/dbraw/zinc/64/69/60/1032646960.db2.gz JFKKNABNVAFHEA-APWZRJJASA-N 1 0 339.439 3.842 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CCO1 ZINC000449490900 1032653305 /nfs/dbraw/zinc/65/33/05/1032653305.db2.gz DLSCYYDWQPGERD-JTDSTZFVSA-N 1 0 334.460 3.957 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1F ZINC000593063206 1032663672 /nfs/dbraw/zinc/66/36/72/1032663672.db2.gz GLUILJNWCSXNHH-HNNXBMFYSA-N 1 0 345.374 3.803 20 5 EHBDRO CCc1ncc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)s1 ZINC000449495979 1032664373 /nfs/dbraw/zinc/66/43/73/1032664373.db2.gz FRTSOAGWFZMLTM-CQSZACIVSA-N 1 0 331.441 3.993 20 5 EHBDRO Cc1ccccc1C1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)CCC1 ZINC000593038762 1032675879 /nfs/dbraw/zinc/67/58/79/1032675879.db2.gz HLFHMBLEDWEFCP-UHFFFAOYSA-N 1 0 336.395 3.949 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000537383793 1032680783 /nfs/dbraw/zinc/68/07/83/1032680783.db2.gz NXQAHEKGGSTRBM-SFHVURJKSA-N 1 0 344.411 3.742 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)c2cc(N)ccc2O1 ZINC000415025402 1017414422 /nfs/dbraw/zinc/41/44/22/1017414422.db2.gz PVYVPJOONQOXFT-INIZCTEOSA-N 1 0 327.384 3.569 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000177340780 1017624725 /nfs/dbraw/zinc/62/47/25/1017624725.db2.gz IJWTYPOMGWYMES-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[N@H+](CCc1ccc(F)cc1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083169221 1017751390 /nfs/dbraw/zinc/75/13/90/1017751390.db2.gz GWPFDRUQHDQYIY-UHFFFAOYSA-N 1 0 329.331 3.550 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000597861018 1032720574 /nfs/dbraw/zinc/72/05/74/1032720574.db2.gz RHLCKHJOSGNXCB-CQSZACIVSA-N 1 0 347.459 3.568 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3cccnc3)CC2)c(Cl)c1 ZINC000377602708 1018042934 /nfs/dbraw/zinc/04/29/34/1018042934.db2.gz PZUWQECYQOVZMB-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO CC(C)[C@@H](O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000236777523 1018115073 /nfs/dbraw/zinc/11/50/73/1018115073.db2.gz CVFCEURSFKNSAT-HNNXBMFYSA-N 1 0 338.791 3.615 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H]2C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000091958145 1032745126 /nfs/dbraw/zinc/74/51/26/1032745126.db2.gz AMLZDCNJGAVITK-WBVHZDCISA-N 1 0 330.384 3.584 20 5 EHBDRO CC[N@H+](Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1)[C@@H](C)CO ZINC000560608343 1018173451 /nfs/dbraw/zinc/17/34/51/1018173451.db2.gz LSYIIJYESZMDEM-HNNXBMFYSA-N 1 0 343.427 3.565 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000091958146 1032746959 /nfs/dbraw/zinc/74/69/59/1032746959.db2.gz AMLZDCNJGAVITK-RDJZCZTQSA-N 1 0 330.384 3.584 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000449535686 1032749977 /nfs/dbraw/zinc/74/99/77/1032749977.db2.gz HWYZFFACQNTKML-TUOCYHOTSA-N 1 0 339.395 3.513 20 5 EHBDRO CC[C@H](C[C@@H](C)CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345672 1018359469 /nfs/dbraw/zinc/35/94/69/1018359469.db2.gz YGLVEXOWMUJLCN-TZMCWYRMSA-N 1 0 349.456 3.605 20 5 EHBDRO C[C@H](CCCC[NH3+])NC(=O)Nc1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000415701367 1018412823 /nfs/dbraw/zinc/41/28/23/1018412823.db2.gz OCSZKIRGTOSCSV-GFCCVEGCSA-N 1 0 336.436 3.531 20 5 EHBDRO CC(C)C[C@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486255 1018739081 /nfs/dbraw/zinc/73/90/81/1018739081.db2.gz YPVMKENUQWEDPL-ZFWWWQNUSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[NH+]3C4CCCC3CCC4)n2)cc1 ZINC000610395039 1018745243 /nfs/dbraw/zinc/74/52/43/1018745243.db2.gz PSRQIALHUKJLDN-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1 ZINC000397867098 1018913087 /nfs/dbraw/zinc/91/30/87/1018913087.db2.gz GOSPQKBDQRLDBQ-HXUWFJFHSA-N 1 0 339.439 3.739 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@H](C)[C@@H]1C ZINC000419373611 1018951289 /nfs/dbraw/zinc/95/12/89/1018951289.db2.gz OLWWMVHRXZQMFB-MROQNXINSA-N 1 0 330.388 3.682 20 5 EHBDRO C[C@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(C)(C)C[NH+](C)C ZINC000175802134 1019007035 /nfs/dbraw/zinc/00/70/35/1019007035.db2.gz RSOZSPPAXMJEKD-NSHDSACASA-N 1 0 349.456 3.516 20 5 EHBDRO COc1ccc(-c2ccc(C[NH+]3C4CCC3CC4)o2)c([N+](=O)[O-])c1 ZINC000536628171 1019206945 /nfs/dbraw/zinc/20/69/45/1019206945.db2.gz QCPIXWGFLKHFJS-UHFFFAOYSA-N 1 0 328.368 3.990 20 5 EHBDRO CC(C)C1(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000175802706 1019275040 /nfs/dbraw/zinc/27/50/40/1019275040.db2.gz MQFHMILRLTVNJY-UHFFFAOYSA-N 1 0 328.416 3.521 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2(c3ccc(Cl)cc3)CCC2)c1 ZINC000178869044 1019319316 /nfs/dbraw/zinc/31/93/16/1019319316.db2.gz CUNTVCPTAMIOQG-QGZVFWFLSA-N 1 0 346.814 3.951 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@@H]1CCCC[C@@H]1O)C1CC1 ZINC000090544253 1019381089 /nfs/dbraw/zinc/38/10/89/1019381089.db2.gz ALEURVDILDGAKT-QRFRQXIXSA-N 1 0 346.471 3.837 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)CCc1ccccc1OC ZINC000513452107 1019700667 /nfs/dbraw/zinc/70/06/67/1019700667.db2.gz WFVONTMQWMUDRZ-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000513486569 1019745966 /nfs/dbraw/zinc/74/59/66/1019745966.db2.gz ZQRWAQYCXTXZIM-OAHLLOKOSA-N 1 0 328.412 3.975 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@]3(CC[NH2+]C3)C2)s1 ZINC000261959387 1019768786 /nfs/dbraw/zinc/76/87/86/1019768786.db2.gz HBFHICHXRIAYMB-SFHVURJKSA-N 1 0 343.452 3.509 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC1 ZINC000280316297 1020283276 /nfs/dbraw/zinc/28/32/76/1020283276.db2.gz PZEQFBGTNMNZFL-INIZCTEOSA-N 1 0 344.358 3.587 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000513698240 1020488073 /nfs/dbraw/zinc/48/80/73/1020488073.db2.gz YCIDRNROHROWBT-FRFSOERESA-N 1 0 328.416 3.586 20 5 EHBDRO CO[C@@H]([C@@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000449629111 1032929462 /nfs/dbraw/zinc/92/94/62/1032929462.db2.gz KBUXFAKJJGHEIC-BZNIZROVSA-N 1 0 347.440 3.621 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCc1ccccc1O ZINC000602525065 1032958741 /nfs/dbraw/zinc/95/87/41/1032958741.db2.gz DTKHXCXHSCBJAK-UHFFFAOYSA-N 1 0 340.301 3.652 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2nnc(C(C)C)s2)cccc1[N+](=O)[O-] ZINC000426295054 1021197772 /nfs/dbraw/zinc/19/77/72/1021197772.db2.gz LPLBUQPJDMEPKF-LBPRGKRZSA-N 1 0 334.445 3.771 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1O ZINC000438347717 1021313129 /nfs/dbraw/zinc/31/31/29/1021313129.db2.gz PIYUAIIPERJEMF-QGZVFWFLSA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1ccc(O[C@H](C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602560097 1032972303 /nfs/dbraw/zinc/97/23/03/1032972303.db2.gz IEUCDKWFYNBKKB-CYBMUJFWSA-N 1 0 341.367 3.602 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN1CCOC[C@H]1Cc1ccccc1 ZINC000507685693 1021434102 /nfs/dbraw/zinc/43/41/02/1021434102.db2.gz ULEVWCKOYIUJQE-ZAOIQFLMSA-N 1 0 338.407 3.552 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2Cc3ccccc3N(C)C2)cccc1[N+](=O)[O-] ZINC000437080627 1021532306 /nfs/dbraw/zinc/53/23/06/1021532306.db2.gz UGFPQWMDSSMTDG-HOTGVXAUSA-N 1 0 339.439 3.863 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc3[nH]c(C)c(C)c3c2)cc1[N+](=O)[O-] ZINC000518781989 1021568700 /nfs/dbraw/zinc/56/87/00/1021568700.db2.gz HAGCYJAYGSPYOC-UHFFFAOYSA-N 1 0 339.395 3.991 20 5 EHBDRO Cc1cccc2c1CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)C2 ZINC000729479702 1021667797 /nfs/dbraw/zinc/66/77/97/1021667797.db2.gz CBWPXNFWCWSYEX-UHFFFAOYSA-N 1 0 326.396 3.730 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000510460226 1021668082 /nfs/dbraw/zinc/66/80/82/1021668082.db2.gz WIEMZZUXFZYIKD-JKWKAKRGSA-N 1 0 343.471 3.945 20 5 EHBDRO COc1ccc(C[N@H+](C)C/C=C\c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000506771382 1021984883 /nfs/dbraw/zinc/98/48/83/1021984883.db2.gz DSJQZFIHRQDWHS-VURMDHGXSA-N 1 0 342.395 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@]4(CCOC4)C3)o2)cc1 ZINC000449679606 1033028848 /nfs/dbraw/zinc/02/88/48/1033028848.db2.gz AJSMRDGJCLZCRK-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CC[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471788851 1022206036 /nfs/dbraw/zinc/20/60/36/1022206036.db2.gz QSPZOHFOXBKDMY-UCLAIMLFSA-N 1 0 344.411 3.997 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000341552051 1022292154 /nfs/dbraw/zinc/29/21/54/1022292154.db2.gz LKBBZEXXRYBOIJ-QGZVFWFLSA-N 1 0 328.368 3.525 20 5 EHBDRO CCO[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)c1ccccc1 ZINC000602637157 1033047060 /nfs/dbraw/zinc/04/70/60/1033047060.db2.gz LDGQOVPKKBIANW-KRWDZBQOSA-N 1 0 341.367 3.603 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000441419993 1022375589 /nfs/dbraw/zinc/37/55/89/1022375589.db2.gz KYJSXNHDOIWLOC-HNNXBMFYSA-N 1 0 344.411 3.545 20 5 EHBDRO COc1ccc2c(c1)OC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000090964610 1022405039 /nfs/dbraw/zinc/40/50/39/1022405039.db2.gz BGPLKZHYDPNMBN-UKRRQHHQSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@H]2/C=C/c2ccccc2)c1 ZINC000438563099 1022792883 /nfs/dbraw/zinc/79/28/83/1022792883.db2.gz SAFXHYSZZXACHI-ZGKFYVQTSA-N 1 0 340.427 3.749 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602681757 1033082463 /nfs/dbraw/zinc/08/24/63/1033082463.db2.gz LXGWQAQUUIYXFZ-UHFFFAOYSA-N 1 0 334.338 3.500 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(Cc3ccccc3)CCOCC2)cs1 ZINC000449712053 1033086774 /nfs/dbraw/zinc/08/67/74/1033086774.db2.gz GELHEYBUIBHZKR-UHFFFAOYSA-N 1 0 332.425 3.538 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1O ZINC000249967911 1033098251 /nfs/dbraw/zinc/09/82/51/1033098251.db2.gz KEKKBGWERSCMSZ-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(C(=O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000184074281 1023059061 /nfs/dbraw/zinc/05/90/61/1023059061.db2.gz LUWPYYSUDCVWGE-UHFFFAOYSA-N 1 0 347.459 3.569 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@]1([NH+](C)C)CCC[C@H](C)C1 ZINC000509572849 1023069321 /nfs/dbraw/zinc/06/93/21/1023069321.db2.gz RTKPSLLWLUBUHV-KXBFYZLASA-N 1 0 349.475 3.594 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](CCOc1ccc(OC)cc1[N+](=O)[O-])C1CC1 ZINC000441488998 1023208928 /nfs/dbraw/zinc/20/89/28/1023208928.db2.gz INDGGQUCWCADKQ-KGLIPLIRSA-N 1 0 336.432 3.881 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471015 1023232778 /nfs/dbraw/zinc/23/27/78/1023232778.db2.gz OVPOHBGFOKIVKP-PKOBYXMFSA-N 1 0 345.487 3.724 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1COc2c1cccc2Cl ZINC000610707620 1023280880 /nfs/dbraw/zinc/28/08/80/1023280880.db2.gz OKBMJADMTFFZCD-DRDHIDPGSA-N 1 0 330.771 3.985 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383496982 1023285119 /nfs/dbraw/zinc/28/51/19/1023285119.db2.gz XLPYTXDNYJDTMB-OAHLLOKOSA-N 1 0 329.375 3.668 20 5 EHBDRO CC1=NO[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000895312172 1024272154 /nfs/dbraw/zinc/27/21/54/1024272154.db2.gz VDBVZNGLUGGZAV-CYBMUJFWSA-N 1 0 349.774 3.763 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCOCC1 ZINC000538323343 1024297027 /nfs/dbraw/zinc/29/70/27/1024297027.db2.gz LAUTULRWFDOUNT-KRWDZBQOSA-N 1 0 336.432 3.677 20 5 EHBDRO Cn1cccc1[C@H]1CCCC[N@@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000472328655 1033208219 /nfs/dbraw/zinc/20/82/19/1033208219.db2.gz OJUDZPUOKTVGOI-GOSISDBHSA-N 1 0 329.400 3.539 20 5 EHBDRO CO[C@@H](c1ccccc1F)[C@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488090 1024398440 /nfs/dbraw/zinc/39/84/40/1024398440.db2.gz OGJSXJXIYMCCTE-SCLBCKFNSA-N 1 0 332.375 3.908 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185218923 1024651131 /nfs/dbraw/zinc/65/11/31/1024651131.db2.gz PXTLHDISBLRQBS-KRWDZBQOSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425371668 1024895574 /nfs/dbraw/zinc/89/55/74/1024895574.db2.gz LOIXXGCCCVUSCF-ORUDLHBZSA-N 1 0 342.439 3.889 20 5 EHBDRO CC(C)c1ccc([C@@H]([NH2+]CCn2ccc([N+](=O)[O-])n2)C(C)C)cc1 ZINC000539244595 1024996491 /nfs/dbraw/zinc/99/64/91/1024996491.db2.gz ZCKDHMQXRYJRJL-SFHVURJKSA-N 1 0 330.432 3.902 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1cccs1 ZINC000346695436 1025019325 /nfs/dbraw/zinc/01/93/25/1025019325.db2.gz BPNAAHQFPVMOMR-HNNXBMFYSA-N 1 0 342.424 3.919 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C[S@@](C)=O)c1ccccc1 ZINC000248617732 1025050242 /nfs/dbraw/zinc/05/02/42/1025050242.db2.gz ZLAKVNTXIXQVGM-NDGOPHNLSA-N 1 0 346.452 3.674 20 5 EHBDRO C[N@H+](CCCOc1ccc(F)cc1)CCOc1ccc([N+](=O)[O-])cc1 ZINC000520843911 1025080356 /nfs/dbraw/zinc/08/03/56/1025080356.db2.gz VBVDSHJDKRCGSX-UHFFFAOYSA-N 1 0 348.374 3.514 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)c(F)c1 ZINC000491206685 1033261527 /nfs/dbraw/zinc/26/15/27/1033261527.db2.gz UIVWZSCTEZVLAC-INIZCTEOSA-N 1 0 349.450 3.822 20 5 EHBDRO CC(C)(CNc1ccc2ncccc2c1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000478037067 1025160810 /nfs/dbraw/zinc/16/08/10/1025160810.db2.gz XLAISVQFAZBXIF-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO C[C@H](CO)[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1CCC1 ZINC000515332139 1025174171 /nfs/dbraw/zinc/17/41/71/1025174171.db2.gz RMUFPAPFPVZNOB-CQSZACIVSA-N 1 0 344.411 3.838 20 5 EHBDRO Cc1ccccc1[C@H](O)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000163184932 1025196245 /nfs/dbraw/zinc/19/62/45/1025196245.db2.gz ZWHLUTOXWQKDPT-AZUAARDMSA-N 1 0 340.423 3.548 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)N(C)CCCC[NH+]1CCCCC1 ZINC000602958036 1033278571 /nfs/dbraw/zinc/27/85/71/1033278571.db2.gz CXEGVMLEVCWKDL-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000119920204 1025422994 /nfs/dbraw/zinc/42/29/94/1025422994.db2.gz JXAUIRWWCNOUFT-CQSZACIVSA-N 1 0 339.395 3.572 20 5 EHBDRO Cc1cc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433140 1025459860 /nfs/dbraw/zinc/45/98/60/1025459860.db2.gz IARGFXJEXFMPGI-RDJZCZTQSA-N 1 0 340.427 3.621 20 5 EHBDRO Cn1cc(CN2Cc3ccccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000119943298 1025475744 /nfs/dbraw/zinc/47/57/44/1025475744.db2.gz HQQBJJVSMRMAJC-UHFFFAOYSA-N 1 0 334.379 3.511 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](Cc3nccs3)C2)ccc1[N+](=O)[O-] ZINC000934333232 1025495353 /nfs/dbraw/zinc/49/53/53/1025495353.db2.gz OIFQTJGVNQHCSH-CQSZACIVSA-N 1 0 347.440 3.515 20 5 EHBDRO CCc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000451097311 1025516071 /nfs/dbraw/zinc/51/60/71/1025516071.db2.gz DHNPWABZZBELGT-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000451107859 1025542686 /nfs/dbraw/zinc/54/26/86/1025542686.db2.gz UDHOANRKZUIKGW-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO CCN(CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC(F)(F)F ZINC000451101654 1025563485 /nfs/dbraw/zinc/56/34/85/1025563485.db2.gz DZOPRJRBXRCPPN-LBPRGKRZSA-N 1 0 333.354 3.520 20 5 EHBDRO COc1cc(C[NH2+]CC[C@@H]2CCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000898018665 1033290964 /nfs/dbraw/zinc/29/09/64/1033290964.db2.gz CYYXGQJWUAGVQS-NSHDSACASA-N 1 0 344.358 3.527 20 5 EHBDRO C[C@@H]1CCN(c2ccc(F)cc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000463070372 1025579449 /nfs/dbraw/zinc/57/94/49/1025579449.db2.gz NMCWHAFFEAAEDL-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000530361393 1025705889 /nfs/dbraw/zinc/70/58/89/1025705889.db2.gz GPODVMNEQOTDRF-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000474888981 1025756814 /nfs/dbraw/zinc/75/68/14/1025756814.db2.gz QQWUFRKNQUABRV-WRSVWVKZSA-N 1 0 334.416 3.757 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCCCO2 ZINC000548722859 1025795140 /nfs/dbraw/zinc/79/51/40/1025795140.db2.gz SWHFWYXNMPHGFD-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540617676 1025814193 /nfs/dbraw/zinc/81/41/93/1025814193.db2.gz YDMKOOGMWOJDRA-ZFWWWQNUSA-N 1 0 332.400 3.742 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CO1 ZINC000516063411 1025948651 /nfs/dbraw/zinc/94/86/51/1025948651.db2.gz SXSUOJOGLYPKTA-GHMZBOCLSA-N 1 0 336.775 3.775 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000129714169 1026042859 /nfs/dbraw/zinc/04/28/59/1026042859.db2.gz MMSPPFCQERBYBC-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO CO[C@@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478328263 1026064728 /nfs/dbraw/zinc/06/47/28/1026064728.db2.gz PCWOAYNCGHODCG-PIGZYNQJSA-N 1 0 336.338 3.739 20 5 EHBDRO CCc1cc(CCC[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)on1 ZINC000451543207 1026091304 /nfs/dbraw/zinc/09/13/04/1026091304.db2.gz BIEBIXJSJRVTDP-INIZCTEOSA-N 1 0 343.427 3.957 20 5 EHBDRO Cc1ccccc1[C@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178575977 1026259986 /nfs/dbraw/zinc/25/99/86/1026259986.db2.gz DWWMWJREWDUYDD-MOPGFXCFSA-N 1 0 326.396 3.774 20 5 EHBDRO Cc1cccc(CC[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000475284234 1026441625 /nfs/dbraw/zinc/44/16/25/1026441625.db2.gz WEKCWWGMHXPTLX-LPHOPBHVSA-N 1 0 339.439 3.842 20 5 EHBDRO COCCC[C@@H](Cc1ccccc1)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000475335353 1026488270 /nfs/dbraw/zinc/48/82/70/1026488270.db2.gz RDMJZHQXYSOBNL-KRWDZBQOSA-N 1 0 346.402 3.861 20 5 EHBDRO COc1cccc(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354946 1026510101 /nfs/dbraw/zinc/51/01/01/1026510101.db2.gz SYEYGSMTLNSUBY-HOCLYGCPSA-N 1 0 341.411 3.851 20 5 EHBDRO C[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000277719206 1026670092 /nfs/dbraw/zinc/67/00/92/1026670092.db2.gz JBELWOVLZPWBLU-IUODEOHRSA-N 1 0 332.425 3.838 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C(C)C ZINC000479876782 1026869719 /nfs/dbraw/zinc/86/97/19/1026869719.db2.gz VESDMVWWPDPTJI-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000531443671 1026926174 /nfs/dbraw/zinc/92/61/74/1026926174.db2.gz IGGZLBLMOAQKAK-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000531700317 1027221836 /nfs/dbraw/zinc/22/18/36/1027221836.db2.gz IAWUYNNCYSMQSD-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO COCCOc1ccccc1C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531701072 1027223398 /nfs/dbraw/zinc/22/33/98/1027223398.db2.gz GWMCGQWHBGQDAU-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413188175 1027234435 /nfs/dbraw/zinc/23/44/35/1027234435.db2.gz TXPJIMTWDAPQGC-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000204663883 1027287886 /nfs/dbraw/zinc/28/78/86/1027287886.db2.gz GTDWPWYXXXSXQC-GOSISDBHSA-N 1 0 328.412 3.929 20 5 EHBDRO CC[NH2+]CC1CCN(c2cc(C)c([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000420200128 1027385974 /nfs/dbraw/zinc/38/59/74/1027385974.db2.gz DOFVROVRLSTUTC-UHFFFAOYSA-N 1 0 345.365 3.748 20 5 EHBDRO C[N@H+](CCCCNc1ccc([N+](=O)[O-])cc1Br)C1CC1 ZINC000413349869 1027572880 /nfs/dbraw/zinc/57/28/80/1027572880.db2.gz UITSHQQHNUSREC-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCC[NH+]2CCCCC2)cc1C(F)(F)F ZINC000501868849 1027610250 /nfs/dbraw/zinc/61/02/50/1027610250.db2.gz UNHIDUSCJXVFBY-UHFFFAOYSA-N 1 0 331.338 3.902 20 5 EHBDRO CCCCCn1cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c(C)n1 ZINC000503270045 1027696010 /nfs/dbraw/zinc/69/60/10/1027696010.db2.gz QMMGKEVGRBMXRF-UHFFFAOYSA-N 1 0 330.432 3.888 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CN(C)Cc3ccccc32)cccc1[N+](=O)[O-] ZINC000366701811 1027757059 /nfs/dbraw/zinc/75/70/59/1027757059.db2.gz ZLTCBUYUWHETKZ-KDOFPFPSSA-N 1 0 325.412 3.741 20 5 EHBDRO Cc1c(CN2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)cccc1[N+](=O)[O-] ZINC000533512142 1027996892 /nfs/dbraw/zinc/99/68/92/1027996892.db2.gz MNPPQENNCPBYRU-MPGHIAIKSA-N 1 0 331.460 3.740 20 5 EHBDRO C[C@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495057 1028089321 /nfs/dbraw/zinc/08/93/21/1028089321.db2.gz NZIJVPZOMSCUAQ-CHWSQXEVSA-N 1 0 346.818 3.891 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCCC[C@H]1C ZINC000444676935 1028146176 /nfs/dbraw/zinc/14/61/76/1028146176.db2.gz OUDUGSSSDXMYDO-CXAGYDPISA-N 1 0 334.416 3.862 20 5 EHBDRO CC[C@](O)(CCC(F)(F)F)C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000897522292 1028221902 /nfs/dbraw/zinc/22/19/02/1028221902.db2.gz LGVUPMFRAJGOJA-ZKKXHLJNSA-N 1 0 346.349 3.681 20 5 EHBDRO CCC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC(C)(C)O ZINC000513745984 1028249500 /nfs/dbraw/zinc/24/95/00/1028249500.db2.gz LNFLYLCCNGOVFD-UHFFFAOYSA-N 1 0 332.400 3.838 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](N)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000423232348 1028299342 /nfs/dbraw/zinc/29/93/42/1028299342.db2.gz BYTXJAFFSWWZLW-MSOLQXFVSA-N 1 0 325.412 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ccccc2)c2ccncc2)cc1 ZINC000327304233 1028432221 /nfs/dbraw/zinc/43/22/21/1028432221.db2.gz RQLDVTDVFKGWNB-HXUWFJFHSA-N 1 0 333.391 3.912 20 5 EHBDRO CN(Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCC[N@H+](C)C1 ZINC000508516249 1028483503 /nfs/dbraw/zinc/48/35/03/1028483503.db2.gz KUVIPTPUAPDCEP-HNNXBMFYSA-N 1 0 343.427 3.628 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](c1ccccc1)C1CCOCC1 ZINC000367723823 1028514079 /nfs/dbraw/zinc/51/40/79/1028514079.db2.gz NBZKSNSABWXOBX-LJQANCHMSA-N 1 0 326.396 3.852 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cccc([N+](=O)[O-])c1C)Cc1cccs1 ZINC000063482992 1028585980 /nfs/dbraw/zinc/58/59/80/1028585980.db2.gz XBESQNNDMDMVPF-UHFFFAOYSA-N 1 0 347.440 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCN(C3CCCC3)C1)CCC2 ZINC000583064228 1028714615 /nfs/dbraw/zinc/71/46/15/1028714615.db2.gz ISPNGHAGZNTJAO-HNAYVOBHSA-N 1 0 329.444 3.579 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cc(C)nc(C)c2)cc1[N+](=O)[O-] ZINC000421853241 1028844536 /nfs/dbraw/zinc/84/45/36/1028844536.db2.gz IWTFTRAKJCLXAH-CQSZACIVSA-N 1 0 329.400 3.856 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](C)C1CCCCCC1 ZINC000026341734 1028851453 /nfs/dbraw/zinc/85/14/53/1028851453.db2.gz AHFVHMZAMPBJGA-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CCc3cccnc3CC2)cc1 ZINC000421841283 1028862342 /nfs/dbraw/zinc/86/23/42/1028862342.db2.gz INAIGAUBSRNURU-GOSISDBHSA-N 1 0 339.439 3.850 20 5 EHBDRO COc1ccc(NC(=O)CC[C@@H]([NH3+])CC2CCCCC2)cc1[N+](=O)[O-] ZINC000424200411 1028886703 /nfs/dbraw/zinc/88/67/03/1028886703.db2.gz ZLCPOKZUMVHGJZ-CQSZACIVSA-N 1 0 349.431 3.620 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000504900448 1029027101 /nfs/dbraw/zinc/02/71/01/1029027101.db2.gz YDVQJCLQMRLQPN-PMPSAXMXSA-N 1 0 349.500 3.682 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOC2CCCCC2)cc1[N+](=O)[O-] ZINC000504911088 1029053546 /nfs/dbraw/zinc/05/35/46/1029053546.db2.gz AIQDUIBUTADNOJ-AWEZNQCLSA-N 1 0 336.432 3.993 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(C)(C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000504929040 1029073543 /nfs/dbraw/zinc/07/35/43/1029073543.db2.gz GAQNXWDHYTZGFI-OAHLLOKOSA-N 1 0 349.475 3.909 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(CNc3ccc([N+](=O)[O-])cn3)cc2)C1 ZINC000052158067 1029129037 /nfs/dbraw/zinc/12/90/37/1029129037.db2.gz BWJKUASILJYURE-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000272015261 1029274729 /nfs/dbraw/zinc/27/47/29/1029274729.db2.gz QWTDCRFWHGJNQE-HUUCEWRRSA-N 1 0 326.824 3.932 20 5 EHBDRO O=C(NCCC[NH+]1CCCC1)c1cc2ccccc2c2cccnc12 ZINC000078799637 1029473124 /nfs/dbraw/zinc/47/31/24/1029473124.db2.gz AFOHDQZCYJDCCK-UHFFFAOYSA-N 1 0 333.435 3.604 20 5 EHBDRO C[C@]1(c2ccccc2)CC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000446715753 1029769802 /nfs/dbraw/zinc/76/98/02/1029769802.db2.gz FDWDGULNQNHVQD-IBGZPJMESA-N 1 0 337.379 3.900 20 5 EHBDRO CC(C)(C)[C@@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000446764805 1029785784 /nfs/dbraw/zinc/78/57/84/1029785784.db2.gz LIEJAJIRYNGYJO-MRXNPFEDSA-N 1 0 334.441 3.820 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cccc1[N+](=O)[O-] ZINC000152241973 1029833726 /nfs/dbraw/zinc/83/37/26/1029833726.db2.gz VFNZTLKEVVUTHF-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868873 1029946078 /nfs/dbraw/zinc/94/60/78/1029946078.db2.gz NZYANAJHMQPGEZ-MRXNPFEDSA-N 1 0 348.443 3.581 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000453253342 1029982934 /nfs/dbraw/zinc/98/29/34/1029982934.db2.gz HZAQQAWQDJWRGB-NWDGAFQWSA-N 1 0 334.338 3.911 20 5 EHBDRO CC(C)[C@@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000525697779 1030031267 /nfs/dbraw/zinc/03/12/67/1030031267.db2.gz TXVGTAUZTSNWON-INIZCTEOSA-N 1 0 334.441 3.820 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2ccco2)N2CCCC2)cccc1[N+](=O)[O-] ZINC000152277505 1030075711 /nfs/dbraw/zinc/07/57/11/1030075711.db2.gz CLTOJRGWZOFTBU-CRAIPNDOSA-N 1 0 343.427 3.984 20 5 EHBDRO [NH3+][C@H]1CCC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000567847677 1030142750 /nfs/dbraw/zinc/14/27/50/1030142750.db2.gz WMPDRKJYUUDALF-HOCLYGCPSA-N 1 0 333.435 3.635 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447522392 1030244512 /nfs/dbraw/zinc/24/45/12/1030244512.db2.gz YMNAMIWPKCAPCU-LJQANCHMSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CCCc2cccc(F)c2)n1 ZINC000447530822 1030252184 /nfs/dbraw/zinc/25/21/84/1030252184.db2.gz PCEDBCZDZICGNQ-IAGOWNOFSA-N 1 0 346.406 3.637 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447537334 1030274407 /nfs/dbraw/zinc/27/44/07/1030274407.db2.gz VANHMOLEEKTGSM-ROUUACIJSA-N 1 0 342.443 3.724 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000447540878 1030275116 /nfs/dbraw/zinc/27/51/16/1030275116.db2.gz DVYMACUCCSGRDF-MSOLQXFVSA-N 1 0 345.468 3.926 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000447540880 1030275169 /nfs/dbraw/zinc/27/51/69/1030275169.db2.gz DVYMACUCCSGRDF-QZTJIDSGSA-N 1 0 345.468 3.926 20 5 EHBDRO C[C@@H](CC(=O)OC(C)(C)C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447588972 1030323567 /nfs/dbraw/zinc/32/35/67/1030323567.db2.gz WCAZTBOLUDPQGN-BLLLJJGKSA-N 1 0 334.416 3.682 20 5 EHBDRO Cc1cc(F)ccc1CC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447578230 1030342129 /nfs/dbraw/zinc/34/21/29/1030342129.db2.gz DMKLSNIXGROQJU-SJORKVTESA-N 1 0 346.406 3.555 20 5 EHBDRO C[NH+](C)CC1(CN[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CCCC1 ZINC000447601872 1030355490 /nfs/dbraw/zinc/35/54/90/1030355490.db2.gz ROHATBQVAPKILK-GOSISDBHSA-N 1 0 331.460 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC3(CC2)OCCc2ccccc23)cc1 ZINC000453572731 1030361912 /nfs/dbraw/zinc/36/19/12/1030361912.db2.gz HMSDZEONDYYRAH-UHFFFAOYSA-N 1 0 338.407 3.659 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448123 1030504567 /nfs/dbraw/zinc/50/45/67/1030504567.db2.gz GDUPUWUVPYTMNF-RYUDHWBXSA-N 1 0 331.372 3.506 20 5 EHBDRO Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccccc1[N+](=O)[O-] ZINC000163428225 1030556948 /nfs/dbraw/zinc/55/69/48/1030556948.db2.gz CMJJABDHXYETNL-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccnn2-c2ccccc2)cc1[N+](=O)[O-] ZINC000447937663 1030613698 /nfs/dbraw/zinc/61/36/98/1030613698.db2.gz BOTZOZFLDKFIOY-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1cccc2c1CC[C@@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000583748103 1030622376 /nfs/dbraw/zinc/62/23/76/1030622376.db2.gz QLJOJOVXBYMKGO-INIZCTEOSA-N 1 0 339.395 3.509 20 5 EHBDRO CN(C)C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776185 1030703285 /nfs/dbraw/zinc/70/32/85/1030703285.db2.gz TXLRGRAJRBHTFZ-FZMUQLTDSA-N 1 0 343.402 3.640 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)cc1[N+](=O)[O-] ZINC000527243072 1030731404 /nfs/dbraw/zinc/73/14/04/1030731404.db2.gz MTEQUISHTPKSTK-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3ccc4ccccc4c3)C2)nc1 ZINC000237998779 1030806470 /nfs/dbraw/zinc/80/64/70/1030806470.db2.gz DYSAPZMXKCHHBR-GOSISDBHSA-N 1 0 348.406 3.829 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(CN3CC[C@H](c4ccc(F)cc4)C3)nc2c1 ZINC000483117187 1030977619 /nfs/dbraw/zinc/97/76/19/1030977619.db2.gz OUIHPDHDRBPAJK-ZDUSSCGKSA-N 1 0 340.358 3.600 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(OCC2CC2)nc1)c1ccc([N+](=O)[O-])cc1 ZINC000131392016 1031040831 /nfs/dbraw/zinc/04/08/31/1031040831.db2.gz YGNNDRSILASFPD-CYBMUJFWSA-N 1 0 327.384 3.629 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872090942 1031322262 /nfs/dbraw/zinc/32/22/62/1031322262.db2.gz GCKGMQDGBRQKRP-DWQUBVKVSA-N 1 0 330.359 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@H](C(F)(F)F)C3)nc2c1 ZINC000278596239 1031576781 /nfs/dbraw/zinc/57/67/81/1031576781.db2.gz FJYSYNCJOLCNHJ-VHSXEESVSA-N 1 0 342.321 3.682 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](CC)CCc1nccs1 ZINC000179038954 1031612355 /nfs/dbraw/zinc/61/23/55/1031612355.db2.gz VOWROPOJXUHROD-UHFFFAOYSA-N 1 0 335.429 3.515 20 5 EHBDRO O=[N+]([O-])c1ccccc1Cc1noc([C@@H]2CC[C@H]3CCCC[C@H]3[NH2+]2)n1 ZINC000904080170 1031711924 /nfs/dbraw/zinc/71/19/24/1031711924.db2.gz YPIAASJUTOYSIB-YUELXQCFSA-N 1 0 342.399 3.552 20 5 EHBDRO CC[NH+]1CCC(CCNc2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000484584431 1031749368 /nfs/dbraw/zinc/74/93/68/1031749368.db2.gz PSKQRBHYDNBCLO-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO Cc1ccc([C@@H](C)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950665 1032037523 /nfs/dbraw/zinc/03/75/23/1032037523.db2.gz HTEWZVLQVWMNJN-SJORKVTESA-N 1 0 333.476 3.922 20 5 EHBDRO CCOc1cncc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000598679505 1033380176 /nfs/dbraw/zinc/38/01/76/1033380176.db2.gz VTLNHOGLQBYOEJ-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO Cn1cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000594500561 1033401677 /nfs/dbraw/zinc/40/16/77/1033401677.db2.gz OXXNOEHMTCGJIZ-SFHVURJKSA-N 1 0 348.406 3.772 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3NC2=O)cccc1[N+](=O)[O-] ZINC000594511760 1033415735 /nfs/dbraw/zinc/41/57/35/1033415735.db2.gz OHMDYVIFFFRNFH-CXAGYDPISA-N 1 0 339.395 3.507 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000594514502 1033420463 /nfs/dbraw/zinc/42/04/63/1033420463.db2.gz JUSVPOIPIBIWSU-RDTXWAMCSA-N 1 0 325.412 3.532 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000594514910 1033420582 /nfs/dbraw/zinc/42/05/82/1033420582.db2.gz MDILYZXCSPBCNZ-KUHUBIRLSA-N 1 0 325.412 3.978 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCN2CCCC[C@@H]12 ZINC000594520387 1033429205 /nfs/dbraw/zinc/42/92/05/1033429205.db2.gz OCCPLGCGJVBRNV-AYBZRNKSSA-N 1 0 331.460 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c2ccncc21 ZINC000594596694 1033444389 /nfs/dbraw/zinc/44/43/89/1033444389.db2.gz BEDQPNFWQPHNQO-SJLPKXTDSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ncccc12 ZINC000594596663 1033444642 /nfs/dbraw/zinc/44/46/42/1033444642.db2.gz BAYAFLHWZJROQO-PBHICJAKSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000594603457 1033448466 /nfs/dbraw/zinc/44/84/66/1033448466.db2.gz VJSZVSRQCIOUKG-WBVHZDCISA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccsc1[N+](=O)[O-] ZINC000708580857 1033571592 /nfs/dbraw/zinc/57/15/92/1033571592.db2.gz XCLZTCPNWBWQJB-UKRRQHHQSA-N 1 0 331.441 3.836 20 5 EHBDRO COC[C@@H](C)Oc1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000594936896 1033586338 /nfs/dbraw/zinc/58/63/38/1033586338.db2.gz XRQOPGSSNIUTFX-CABCVRRESA-N 1 0 344.411 3.859 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC1(CCO)CCCCC1 ZINC000595018400 1033611814 /nfs/dbraw/zinc/61/18/14/1033611814.db2.gz NNOUWQYEZUTNAH-CQSZACIVSA-N 1 0 336.432 3.587 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595064816 1033641979 /nfs/dbraw/zinc/64/19/79/1033641979.db2.gz BOLKJAHABDUSTA-ACJLOTCBSA-N 1 0 330.384 3.642 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595064819 1033642331 /nfs/dbraw/zinc/64/23/31/1033642331.db2.gz BOLKJAHABDUSTA-SCLBCKFNSA-N 1 0 330.384 3.642 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CO[C@@H](C4CC4)C3)s2)cc1 ZINC000599008175 1033642785 /nfs/dbraw/zinc/64/27/85/1033642785.db2.gz VMZUXMUAUUOHMO-RHSMWYFYSA-N 1 0 344.436 3.980 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCO[C@@H](CC(C)C)C1 ZINC000595027086 1033648602 /nfs/dbraw/zinc/64/86/02/1033648602.db2.gz MJGPWYFPHIQCCX-LZWOXQAQSA-N 1 0 336.432 3.848 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCCNc1ccccn1 ZINC000595040892 1033660544 /nfs/dbraw/zinc/66/05/44/1033660544.db2.gz PKFUEUXXZDMLKC-AWEZNQCLSA-N 1 0 344.415 3.541 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](Cc1ccccc1)OC ZINC000595043248 1033662298 /nfs/dbraw/zinc/66/22/98/1033662298.db2.gz VNZOECWUPMQWSG-YOEHRIQHSA-N 1 0 344.411 3.512 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595049776 1033667389 /nfs/dbraw/zinc/66/73/89/1033667389.db2.gz OOKIDOZVLLJRFO-UONOGXRCSA-N 1 0 329.400 3.843 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](c1ccccc1)[C@H](C)O ZINC000595104750 1033691082 /nfs/dbraw/zinc/69/10/82/1033691082.db2.gz TXJDBQJMSZTFPB-VCBZYWHSSA-N 1 0 328.412 3.628 20 5 EHBDRO C[C@H](O)[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000595103979 1033692360 /nfs/dbraw/zinc/69/23/60/1033692360.db2.gz PWURQELHDJSDDA-BKTGTZMESA-N 1 0 326.396 3.684 20 5 EHBDRO CNC(=O)CC1(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000595107347 1033693145 /nfs/dbraw/zinc/69/31/45/1033693145.db2.gz XQHALRXPDFYOHM-OAHLLOKOSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H]2Cc2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000595084075 1033698968 /nfs/dbraw/zinc/69/89/68/1033698968.db2.gz FHNVKHGAXWHFHT-QILLFSRXSA-N 1 0 342.443 3.699 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)OC)c1 ZINC000599061119 1033701687 /nfs/dbraw/zinc/70/16/87/1033701687.db2.gz KQZXMMOYKMVNSH-KUHUBIRLSA-N 1 0 344.411 3.950 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@@H](Cc3ccc(C)cc3)C2)c1[N+](=O)[O-] ZINC000595297390 1033720122 /nfs/dbraw/zinc/72/01/22/1033720122.db2.gz FCHMUUYWGIAZSB-INIZCTEOSA-N 1 0 329.400 3.654 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000599083289 1033720817 /nfs/dbraw/zinc/72/08/17/1033720817.db2.gz XIWGPWMQKZDHDE-UPJWGTAASA-N 1 0 332.425 3.745 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NC[C@@H]1CC[N@@H+]1C1CCCC1 ZINC000599163641 1033780402 /nfs/dbraw/zinc/78/04/02/1033780402.db2.gz GEZCCEDGVMLISK-ZDUSSCGKSA-N 1 0 325.359 3.961 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000595419952 1033792119 /nfs/dbraw/zinc/79/21/19/1033792119.db2.gz BGYPHHUKHVUSMR-HUUCEWRRSA-N 1 0 347.459 3.530 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@H](c3ccc(F)cc3)CC2)c1[N+](=O)[O-] ZINC000595429696 1033798798 /nfs/dbraw/zinc/79/87/98/1033798798.db2.gz TZEDJLSPMLLNFE-ZDUSSCGKSA-N 1 0 333.363 3.800 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC2(CO)CCC2)s1 ZINC000593693898 1033801530 /nfs/dbraw/zinc/80/15/30/1033801530.db2.gz SUHLBIFPFOBQGT-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@]1(CO)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000593714898 1033822138 /nfs/dbraw/zinc/82/21/38/1033822138.db2.gz GBKGSKTWQIAMQW-WOJBJXKFSA-N 1 0 340.423 3.512 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCOc1ccc(C)cc1C ZINC000608782095 1033887748 /nfs/dbraw/zinc/88/77/48/1033887748.db2.gz GKWZOXJKAPVFIN-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@@H](Cn1cccn1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000608836351 1033907853 /nfs/dbraw/zinc/90/78/53/1033907853.db2.gz NNKGVQGPAFWUBP-ZDUSSCGKSA-N 1 0 342.424 3.698 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@@H]1c1ccc(F)cc1)Nc1ccc([N+](=O)[O-])cc1 ZINC000595705744 1033955399 /nfs/dbraw/zinc/95/53/99/1033955399.db2.gz VUBJVJSDQZMPEV-QGZVFWFLSA-N 1 0 343.358 3.510 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2nccc3cc([N+](=O)[O-])ccc32)CC1 ZINC000450254355 1033970497 /nfs/dbraw/zinc/97/04/97/1033970497.db2.gz TXFXVIOMLJMLMD-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO COc1ccccc1[C@@H]1CCC[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609040697 1033991845 /nfs/dbraw/zinc/99/18/45/1033991845.db2.gz KHHBTPGEDQCPMW-SFHVURJKSA-N 1 0 342.395 3.819 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000595791007 1034000822 /nfs/dbraw/zinc/00/08/22/1034000822.db2.gz SJIJELZLWRGSCJ-MAUKXSAKSA-N 1 0 348.443 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NC[C@@H]1CCC[N@H+](CC2CC2)C1 ZINC000596097531 1034062248 /nfs/dbraw/zinc/06/22/48/1034062248.db2.gz YSLCWDCUIXHZLA-WBVHZDCISA-N 1 0 331.460 3.676 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000599662221 1034072852 /nfs/dbraw/zinc/07/28/52/1034072852.db2.gz ZQICGQYPNKITIH-UHFFFAOYSA-N 1 0 345.418 3.818 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596210529 1034120629 /nfs/dbraw/zinc/12/06/29/1034120629.db2.gz ZRMAODLDIPBNPV-LLVKDONJSA-N 1 0 331.338 3.534 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCOc1ccccc1F ZINC000604012562 1034136619 /nfs/dbraw/zinc/13/66/19/1034136619.db2.gz PRBKBPKZRIRVDY-UHFFFAOYSA-N 1 0 348.374 3.514 20 5 EHBDRO CC[NH+]1CCC(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000060061446 1034144674 /nfs/dbraw/zinc/14/46/74/1034144674.db2.gz CTPIBUSOEGFLOW-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)Nc1ccc2c(c1)CC[C@@H]2[NH+](C)C ZINC000456262579 1034261273 /nfs/dbraw/zinc/26/12/73/1034261273.db2.gz GIYGUPZWPBJTNJ-SFHVURJKSA-N 1 0 339.395 3.704 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CCC[N@H+](CC3CC3)C2)ccc2ncccc21 ZINC000596571586 1034293196 /nfs/dbraw/zinc/29/31/96/1034293196.db2.gz XADIJVOQMCIRRA-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@@H](c1ccc(-c2cc([N+](=O)[O-])ccc2CCO)cc1)[NH+]1CCCC1 ZINC000596647484 1034347168 /nfs/dbraw/zinc/34/71/68/1034347168.db2.gz MWIPUMNGKRVIAV-HNNXBMFYSA-N 1 0 340.423 3.953 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174578 1034379089 /nfs/dbraw/zinc/37/90/89/1034379089.db2.gz IUNWSAUQCFZRMA-XJKSGUPXSA-N 1 0 330.359 3.948 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CCCCO1 ZINC000612186121 1034431522 /nfs/dbraw/zinc/43/15/22/1034431522.db2.gz QLIUHENGZNCEIT-OAHLLOKOSA-N 1 0 326.824 3.933 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CNc3ccccc3C2)cc1[N+](=O)[O-] ZINC000593319497 1034656648 /nfs/dbraw/zinc/65/66/48/1034656648.db2.gz LTJVFEFTKAISQI-XJKSGUPXSA-N 1 0 341.411 3.681 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000162242302 1034791148 /nfs/dbraw/zinc/79/11/48/1034791148.db2.gz WUCVMDIFLDIMQQ-CQSZACIVSA-N 1 0 338.411 3.912 20 5 EHBDRO CC(C)CC[C@@H](O)C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000572632486 1034820329 /nfs/dbraw/zinc/82/03/29/1034820329.db2.gz HBRCAMYDLGJHNQ-CQSZACIVSA-N 1 0 334.338 3.500 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NC1CC[NH+](C2CCC2)CC1 ZINC000450871561 1034889433 /nfs/dbraw/zinc/88/94/33/1034889433.db2.gz AFQFQJANWUSMFK-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCC3)CC2)c(OC(F)F)c1 ZINC000450878077 1034905155 /nfs/dbraw/zinc/90/51/55/1034905155.db2.gz MAROWHNHQBHYHP-UHFFFAOYSA-N 1 0 341.358 3.625 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000548929603 1034911598 /nfs/dbraw/zinc/91/15/98/1034911598.db2.gz APTDDDVUKPPNNC-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236693255 1035065243 /nfs/dbraw/zinc/06/52/43/1035065243.db2.gz RVTJBDNRIHBSBG-QGZVFWFLSA-N 1 0 334.441 3.820 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000411886788 1035069001 /nfs/dbraw/zinc/06/90/01/1035069001.db2.gz BDLURSFEXOPNIQ-WBVHZDCISA-N 1 0 332.787 3.650 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CC1)OCc1ccccc12 ZINC000612578848 1035075026 /nfs/dbraw/zinc/07/50/26/1035075026.db2.gz VRPWTUNBFOGIKU-UHFFFAOYSA-N 1 0 338.407 3.925 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc3c(c2)CCC(=O)N3)cccc1[N+](=O)[O-] ZINC000180004615 1035173807 /nfs/dbraw/zinc/17/38/07/1035173807.db2.gz JUKALHRMVIQIBC-ZDUSSCGKSA-N 1 0 339.395 3.639 20 5 EHBDRO COc1cc(CN(C)CCOc2cccc(C)c2)c([N+](=O)[O-])cc1F ZINC000463471583 1035539695 /nfs/dbraw/zinc/53/96/95/1035539695.db2.gz YGIBSOMGJXYNGV-UHFFFAOYSA-N 1 0 348.374 3.562 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)C1CC1 ZINC000271988929 1035638196 /nfs/dbraw/zinc/63/81/96/1035638196.db2.gz FWHBJLUDBDXCLB-OALUTQOASA-N 1 0 326.396 3.678 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000613389355 1035718893 /nfs/dbraw/zinc/71/88/93/1035718893.db2.gz IQQQROXKKQNDTB-MLGOLLRUSA-N 1 0 334.803 3.502 20 5 EHBDRO CC(C)(C)Oc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000443422985 1035795793 /nfs/dbraw/zinc/79/57/93/1035795793.db2.gz AIPVKCZTZVDCHD-CABCVRRESA-N 1 0 333.432 3.811 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccn(C)n1 ZINC000414170111 1035868382 /nfs/dbraw/zinc/86/83/82/1035868382.db2.gz BQRLWLJNMSYBOQ-OLZOCXBDSA-N 1 0 334.445 3.550 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@H]1C ZINC000463951744 1035993618 /nfs/dbraw/zinc/99/36/18/1035993618.db2.gz BVQRSDNXQODSDR-HUUCEWRRSA-N 1 0 348.447 3.596 20 5 EHBDRO CC[C@H](c1ccc(F)cc1)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000365510512 1036028297 /nfs/dbraw/zinc/02/82/97/1036028297.db2.gz KEGVQTULRLDXJI-MRXNPFEDSA-N 1 0 332.379 3.719 20 5 EHBDRO COCC[C@@H](C)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000414213298 1036092628 /nfs/dbraw/zinc/09/26/28/1036092628.db2.gz XXFWZPAZKPUZFZ-DNVCBOLYSA-N 1 0 328.412 3.946 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](O)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000541386669 1036267228 /nfs/dbraw/zinc/26/72/28/1036267228.db2.gz QWFMCPPTISHCRI-GOSISDBHSA-N 1 0 342.439 3.802 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC=C(c2ccnn2C)CC1 ZINC000589185032 1036297960 /nfs/dbraw/zinc/29/79/60/1036297960.db2.gz QPQWYNXMDLEZPX-NTCAYCPXSA-N 1 0 338.411 3.521 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000609073544 1036320352 /nfs/dbraw/zinc/32/03/52/1036320352.db2.gz VWDYYWPBQCGZLF-UHFFFAOYSA-N 1 0 347.415 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](Oc2cccc(Cl)c2)C1 ZINC000535375718 1036416017 /nfs/dbraw/zinc/41/60/17/1036416017.db2.gz XAKGACSZGAXOAT-MRXNPFEDSA-N 1 0 332.787 3.902 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](C)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541547137 1036426979 /nfs/dbraw/zinc/42/69/79/1036426979.db2.gz AKOHSWOOTBSXPU-FZKQIMNGSA-N 1 0 332.400 3.712 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCOCC3CCC3)cs2)c1 ZINC000582819089 1036469568 /nfs/dbraw/zinc/46/95/68/1036469568.db2.gz KCTUFNCADFJBOE-UHFFFAOYSA-N 1 0 347.440 3.625 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)C1 ZINC000589742950 1036599791 /nfs/dbraw/zinc/59/97/91/1036599791.db2.gz KHVSPHNMVGDLFF-OJLVUWQFSA-N 1 0 338.473 3.808 20 5 EHBDRO COc1ccc(-c2ccc(C[NH+]3CC(C4CC4)C3)o2)c([N+](=O)[O-])c1 ZINC000589736794 1036609517 /nfs/dbraw/zinc/60/95/17/1036609517.db2.gz OLJNAHDHDNCXHU-UHFFFAOYSA-N 1 0 328.368 3.705 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CCC(COC)CC2)cc1[N+](=O)[O-] ZINC000414315736 1036628736 /nfs/dbraw/zinc/62/87/36/1036628736.db2.gz SLJFWDXCCSPLLE-VQCLRJIVSA-N 1 0 336.432 3.849 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000464681203 1036656284 /nfs/dbraw/zinc/65/62/84/1036656284.db2.gz ZNLMJFWDZZBWSE-CYBMUJFWSA-N 1 0 348.349 3.871 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)[C@@H]1CO ZINC000191179471 1036697804 /nfs/dbraw/zinc/69/78/04/1036697804.db2.gz JEGGOZVALSRULW-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO CC(C)[N@H+](C)CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180394261 1036771534 /nfs/dbraw/zinc/77/15/34/1036771534.db2.gz MVMNGRUFWJNPHU-IBGZPJMESA-N 1 0 327.428 3.614 20 5 EHBDRO COc1cccc(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1OC ZINC000165959959 1036816764 /nfs/dbraw/zinc/81/67/64/1036816764.db2.gz KFOFSIKJMZVUKA-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000122256523 1036831355 /nfs/dbraw/zinc/83/13/55/1036831355.db2.gz YNABCQQLDNQWQL-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)n1 ZINC000541935856 1036860451 /nfs/dbraw/zinc/86/04/51/1036860451.db2.gz NAETWWQEKLWUHA-NVXWUHKLSA-N 1 0 340.427 3.854 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[N@@H+]1CCCC[C@H]1CCCc1ccccc1 ZINC000443646913 1036945162 /nfs/dbraw/zinc/94/51/62/1036945162.db2.gz KGEDJHMOYGRJGT-KRWDZBQOSA-N 1 0 342.443 3.706 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](c2nccn2C)C1 ZINC000365678140 1036968004 /nfs/dbraw/zinc/96/80/04/1036968004.db2.gz ZVIPPTOPMHGJMQ-HUUCEWRRSA-N 1 0 328.416 3.577 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CCCc4ccccc4C3)nc2c1 ZINC000590652460 1036992173 /nfs/dbraw/zinc/99/21/73/1036992173.db2.gz BDTUKVRNXWLADA-OAHLLOKOSA-N 1 0 336.395 3.508 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000590687366 1037009142 /nfs/dbraw/zinc/00/91/42/1037009142.db2.gz HASMQINBZOAREA-AWEZNQCLSA-N 1 0 346.456 3.685 20 5 EHBDRO C[N@H+](CCNCc1ccc([N+](=O)[O-])c(Cl)c1)C1CCCCC1 ZINC000761523093 1037089549 /nfs/dbraw/zinc/08/95/49/1037089549.db2.gz RSZJOBHIQNNOQH-UHFFFAOYSA-N 1 0 325.840 3.602 20 5 EHBDRO C[C@]1(C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCCO1 ZINC000180740673 1037135291 /nfs/dbraw/zinc/13/52/91/1037135291.db2.gz CCZXNUSHEVDOAS-RBUKOAKNSA-N 1 0 326.396 3.843 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1cc(F)ccc1F ZINC000271769561 1037168308 /nfs/dbraw/zinc/16/83/08/1037168308.db2.gz XBMRNMHBUNKGDR-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](C2CCC2)C1 ZINC000591061789 1037222267 /nfs/dbraw/zinc/22/22/67/1037222267.db2.gz IJRZIFUAFMCBLT-SWLSCSKDSA-N 1 0 342.399 3.828 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccc3nsnc32)cc1[N+](=O)[O-] ZINC000271782318 1037271497 /nfs/dbraw/zinc/27/14/97/1037271497.db2.gz LBZOHPZCQKLURF-LLVKDONJSA-N 1 0 328.397 3.759 20 5 EHBDRO CC(C)([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccccc1 ZINC000508660379 1037273729 /nfs/dbraw/zinc/27/37/29/1037273729.db2.gz ZFDXUBCYOZPWCX-UHFFFAOYSA-N 1 0 347.802 3.712 20 5 EHBDRO C[C@H](O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867686 1037274130 /nfs/dbraw/zinc/27/41/30/1037274130.db2.gz XWODQLCQXLMUMB-GXTWGEPZSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO[C@H]1C1CC1 ZINC000542316382 1037282432 /nfs/dbraw/zinc/28/24/32/1037282432.db2.gz UHBSMFFDGTYYBX-OALUTQOASA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@H]2CC[NH2+]C3(CCC3)C2)o1 ZINC000591282896 1037318800 /nfs/dbraw/zinc/31/88/00/1037318800.db2.gz YGURXKOCVBFYOV-AWEZNQCLSA-N 1 0 341.411 3.619 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](CCO)c1ccccc1 ZINC000532516528 1037556411 /nfs/dbraw/zinc/55/64/11/1037556411.db2.gz HJNMOSICRZQMDS-NVXWUHKLSA-N 1 0 328.412 3.720 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCOCC1 ZINC000897443218 1037731223 /nfs/dbraw/zinc/73/12/23/1037731223.db2.gz UMUIALAPJYEHGE-UHFFFAOYSA-N 1 0 326.824 3.791 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccc([N+](=O)[O-])cc2)cc1 ZINC000103135230 1037765856 /nfs/dbraw/zinc/76/58/56/1037765856.db2.gz RVZNCKKPOUFTRM-UHFFFAOYSA-N 1 0 329.400 3.537 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1ccc2c(c1)[C@H](C[NH3+])CCC2 ZINC000595254346 1037776292 /nfs/dbraw/zinc/77/62/92/1037776292.db2.gz MXFUUTNSQDSHPU-HNNXBMFYSA-N 1 0 339.395 3.534 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220571 1037784010 /nfs/dbraw/zinc/78/40/10/1037784010.db2.gz NVGNGAFCBIGPCG-SUMWQHHRSA-N 1 0 327.384 3.663 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)N(C)C(C)(C)C[NH+]1CCCCCC1 ZINC000494051173 1037796077 /nfs/dbraw/zinc/79/60/77/1037796077.db2.gz UFTXWQPMNIXPAN-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC000540386801 1037878302 /nfs/dbraw/zinc/87/83/02/1037878302.db2.gz ZWRYDRZNOZLUHN-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](CC(=O)Nc1ccccc1)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897466232 1037878746 /nfs/dbraw/zinc/87/87/46/1037878746.db2.gz PYTDCEWVGOFHAB-LSDHHAIUSA-N 1 0 341.411 3.705 20 5 EHBDRO CC[C@@H](C)C[C@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375089 1037923591 /nfs/dbraw/zinc/92/35/91/1037923591.db2.gz QAYJXFDGLQVHIT-TZMCWYRMSA-N 1 0 349.456 3.605 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]C[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000592393133 1037934804 /nfs/dbraw/zinc/93/48/04/1037934804.db2.gz FKBQORGHIHZAQX-BDXSIMOUSA-N 1 0 340.427 3.668 20 5 EHBDRO COCc1ccc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)cc1 ZINC000468645255 1038013974 /nfs/dbraw/zinc/01/39/74/1038013974.db2.gz LXTINLWQLGROGW-XNTDXEJSSA-N 1 0 326.396 3.934 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@@H+](CCN(Cc2cccc([N+](=O)[O-])c2)C2CC2)C1 ZINC001167735155 1038444367 /nfs/dbraw/zinc/44/43/67/1038444367.db2.gz STRPKPGKSOEWCM-IYBDPMFKSA-N 1 0 331.460 3.537 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788565 1038611074 /nfs/dbraw/zinc/61/10/74/1038611074.db2.gz XRQODSBVBBMGEA-NEPJUHHUSA-N 1 0 343.349 3.961 20 5 EHBDRO CC(C)(C)[C@@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893255214 1038737853 /nfs/dbraw/zinc/73/78/53/1038737853.db2.gz HHUKGPZNYMDYDI-HIFRSBDPSA-N 1 0 326.824 3.932 20 5 EHBDRO CC(C)([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000539338913 1038787674 /nfs/dbraw/zinc/78/76/74/1038787674.db2.gz UJWYQUKWTIABCK-UHFFFAOYSA-N 1 0 336.338 3.777 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2cccc(F)c2)N(C)C)cccc1[N+](=O)[O-] ZINC000479847018 1038804044 /nfs/dbraw/zinc/80/40/44/1038804044.db2.gz AHMUPHWJWZGIAD-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000500504007 1038856134 /nfs/dbraw/zinc/85/61/34/1038856134.db2.gz QRSNLCWSDGMFIK-BBUPELFUSA-N 1 0 326.343 3.748 20 5 EHBDRO CC[NH+](CC)[C@@H](CNCc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000236850060 1039037569 /nfs/dbraw/zinc/03/75/69/1039037569.db2.gz BGBNBSNFEKEVOL-IBGZPJMESA-N 1 0 327.428 3.768 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)CC1CCC1 ZINC000478004935 1039131063 /nfs/dbraw/zinc/13/10/63/1039131063.db2.gz UEETVYMKUQUGST-HNNXBMFYSA-N 1 0 328.416 3.655 20 5 EHBDRO CC[N@H+](CCn1ccc([N+](=O)[O-])n1)[C@H](Cc1ccc(F)cc1)C(C)C ZINC000478049293 1039168943 /nfs/dbraw/zinc/16/89/43/1039168943.db2.gz WFZNUDOBLIHASS-QGZVFWFLSA-N 1 0 348.422 3.520 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000480492420 1039600909 /nfs/dbraw/zinc/60/09/09/1039600909.db2.gz BIWXWBSAOJSIAI-UHFFFAOYSA-N 1 0 336.395 3.892 20 5 EHBDRO Cc1n[nH]cc1CCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417333778 1039690350 /nfs/dbraw/zinc/69/03/50/1039690350.db2.gz ZCWLUDRIAOPXGP-SFHVURJKSA-N 1 0 328.416 3.616 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])c(OC)c3)C2)cc1 ZINC000489177921 1039700397 /nfs/dbraw/zinc/70/03/97/1039700397.db2.gz UFNRFKHHGYNPEY-MRXNPFEDSA-N 1 0 342.395 3.602 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340924 1039705673 /nfs/dbraw/zinc/70/56/73/1039705673.db2.gz AXNCEQHAGFIKLE-SUMWQHHRSA-N 1 0 342.395 3.916 20 5 EHBDRO Cc1ncsc1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417352191 1039726873 /nfs/dbraw/zinc/72/68/73/1039726873.db2.gz URBVEBISKLJOPG-INIZCTEOSA-N 1 0 331.441 3.960 20 5 EHBDRO COC1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCCCC1 ZINC000480659864 1039849847 /nfs/dbraw/zinc/84/98/47/1039849847.db2.gz NNVLPZUPPFSOGJ-QGZVFWFLSA-N 1 0 332.444 3.855 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000486390274 1040103267 /nfs/dbraw/zinc/10/32/67/1040103267.db2.gz VASNSTUMXLSMFL-NSHDSACASA-N 1 0 342.237 3.501 20 5 EHBDRO COc1cc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000192952395 1040159021 /nfs/dbraw/zinc/15/90/21/1040159021.db2.gz LEUQFGFEZOVMIV-INIZCTEOSA-N 1 0 341.411 3.537 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@H]34)s2)cc1 ZINC000190331547 1040329709 /nfs/dbraw/zinc/32/97/09/1040329709.db2.gz ZUNOSBVKTMFHBL-BRWVUGGUSA-N 1 0 344.436 3.980 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H]1CCC(C)(C)C[C@@H]1C ZINC000481086641 1040341951 /nfs/dbraw/zinc/34/19/51/1040341951.db2.gz DNUXTIPTLKYEBG-DZGCQCFKSA-N 1 0 333.432 3.646 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000490822363 1040751243 /nfs/dbraw/zinc/75/12/43/1040751243.db2.gz QFSCTGLZLVKFGI-UHFFFAOYSA-N 1 0 325.412 3.825 20 5 EHBDRO CCC1(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCOCC1 ZINC000487187599 1040758918 /nfs/dbraw/zinc/75/89/18/1040758918.db2.gz PEPRFDVYOGOQTD-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO Cc1nccn1C[C@H](C)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433115161 1040777799 /nfs/dbraw/zinc/77/77/99/1040777799.db2.gz HVUCDKTWRGWGNW-FZKQIMNGSA-N 1 0 342.443 3.748 20 5 EHBDRO COc1cc(N[C@H](C)[C@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000569775645 1040821059 /nfs/dbraw/zinc/82/10/59/1040821059.db2.gz CSOANMCTILDFHS-FZKQIMNGSA-N 1 0 329.400 3.707 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000491057613 1040896420 /nfs/dbraw/zinc/89/64/20/1040896420.db2.gz DTARVUOLCHBQOH-QGZVFWFLSA-N 1 0 331.460 3.683 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@@H](N[C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282945 1041232307 /nfs/dbraw/zinc/23/23/07/1041232307.db2.gz NJYOOWYMVBWBLW-HBUWYVDXSA-N 1 0 331.460 3.780 20 5 EHBDRO CC[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC1(C)C ZINC000419315165 1041277310 /nfs/dbraw/zinc/27/73/10/1041277310.db2.gz JIDMINXPSNGAFP-KGLIPLIRSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@H]([NH2+]CC(C)(C)c1ccc2c(c1)OCO2)c1ccc([N+](=O)[O-])cc1 ZINC000481718385 1041284210 /nfs/dbraw/zinc/28/42/10/1041284210.db2.gz ACVIEDFGIYNSHN-ZDUSSCGKSA-N 1 0 342.395 3.952 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ccccc2)C2(CO)CCC2)cc1 ZINC000433316142 1041288732 /nfs/dbraw/zinc/28/87/32/1041288732.db2.gz DPUZPUPTAFDDIF-LJQANCHMSA-N 1 0 340.423 3.631 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000511745224 1041548424 /nfs/dbraw/zinc/54/84/24/1041548424.db2.gz ZCDPCMKDRABFBB-NSHDSACASA-N 1 0 331.338 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](N[C@H](CO)c1c(F)cccc1F)CCC2 ZINC000278877598 1042810085 /nfs/dbraw/zinc/81/00/85/1042810085.db2.gz XMRMGWIFYRBOLW-DLBZAZTESA-N 1 0 348.349 3.574 20 5 EHBDRO C[C@H]([NH2+]CCc1ccn(-c2ccccc2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000482006763 1042885340 /nfs/dbraw/zinc/88/53/40/1042885340.db2.gz IFLIZCUYCPOTIM-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1cccnc1C(C)(C)C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000569137890 1042946557 /nfs/dbraw/zinc/94/65/57/1042946557.db2.gz ILBRXVSRBSEQMT-MRXNPFEDSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H]1COc3ccc(F)cc3C1)CCC2 ZINC000343962664 1042957720 /nfs/dbraw/zinc/95/77/20/1042957720.db2.gz AXWQDNHAXKVHCU-QAPCUYQASA-N 1 0 342.370 3.705 20 5 EHBDRO Cn1ncc2c1CCC[C@H]2[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000279105192 1043356151 /nfs/dbraw/zinc/35/61/51/1043356151.db2.gz OTHDYAPVPSNGAP-IAGOWNOFSA-N 1 0 340.427 3.718 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCCc3sccc32)c1[N+](=O)[O-] ZINC000893641315 1043388132 /nfs/dbraw/zinc/38/81/32/1043388132.db2.gz UQQIWRNCIQKDKG-GFCCVEGCSA-N 1 0 334.397 3.538 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000344780038 1044412294 /nfs/dbraw/zinc/41/22/94/1044412294.db2.gz UPLDWFMHOALSDE-CQSZACIVSA-N 1 0 337.379 3.971 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCSC(F)(F)F)C1CC1 ZINC000765240512 1127587604 /nfs/dbraw/zinc/58/76/04/1127587604.db2.gz SZACGLMXPCAVJF-LBPRGKRZSA-N 1 0 334.363 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)CC2)c2ncccc12 ZINC000265553864 1127690548 /nfs/dbraw/zinc/69/05/48/1127690548.db2.gz HMPUCLUTFCBNEP-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(C[S@@](C)=O)cc1 ZINC000552317876 1127748991 /nfs/dbraw/zinc/74/89/91/1127748991.db2.gz JWEQKVYLLIKZAQ-JBEBIEQOSA-N 1 0 346.452 3.633 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000301435199 1127889889 /nfs/dbraw/zinc/88/98/89/1127889889.db2.gz KDMKXLRTHHVLHO-KRWDZBQOSA-N 1 0 325.412 3.553 20 5 EHBDRO C[C@@H]1[C@@H]([NH+]2CCCC2)CCN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553359187 1128414253 /nfs/dbraw/zinc/41/42/53/1128414253.db2.gz WGLIGYZKEBPAQG-RISCZKNCSA-N 1 0 343.349 3.677 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC[C@H]2CCO[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000273291613 1128476088 /nfs/dbraw/zinc/47/60/88/1128476088.db2.gz SINBBXJGHXTPLJ-KKUMJFAQSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](Cc2ccccc2)[C@H](C)C1 ZINC000301572543 1128497613 /nfs/dbraw/zinc/49/76/13/1128497613.db2.gz YSJKTOHZIMEZHZ-NVXWUHKLSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@H+](Cc2ccccc2)[C@@H](C)C1 ZINC000301572542 1128499260 /nfs/dbraw/zinc/49/92/60/1128499260.db2.gz YSJKTOHZIMEZHZ-DOTOQJQBSA-N 1 0 340.427 3.763 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[N@H+](C)C2CCCC2)cc1[N+](=O)[O-] ZINC000153631338 1128528762 /nfs/dbraw/zinc/52/87/62/1128528762.db2.gz PQIBGQQOGIZAOX-AWEZNQCLSA-N 1 0 335.448 3.519 20 5 EHBDRO CC(C)[C@@H](Cc1ccc(F)cc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765848598 1128559533 /nfs/dbraw/zinc/55/95/33/1128559533.db2.gz ICAUTYRTXMLRHE-RTBURBONSA-N 1 0 346.402 3.624 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc2ccccc2o1 ZINC000765848108 1128559949 /nfs/dbraw/zinc/55/99/49/1128559949.db2.gz FOXNBIITMGOLLW-LRDDRELGSA-N 1 0 326.352 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2CC[C@H]3COCC[C@@H]3C2)cc1 ZINC000921781164 1128756448 /nfs/dbraw/zinc/75/64/48/1128756448.db2.gz XIGZRTQREOANFF-FGTMMUONSA-N 1 0 332.444 3.712 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H](Oc2ncccc2F)C1 ZINC000488988973 1128917247 /nfs/dbraw/zinc/91/72/47/1128917247.db2.gz WEDXLGORCGBLBB-KGLIPLIRSA-N 1 0 345.374 3.733 20 5 EHBDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000542486175 1120609338 /nfs/dbraw/zinc/60/93/38/1120609338.db2.gz YPVMKENUQWEDPL-DZGCQCFKSA-N 1 0 326.824 3.932 20 5 EHBDRO COC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000494592453 1120686253 /nfs/dbraw/zinc/68/62/53/1120686253.db2.gz RMCIKFRSWPCOES-KRWDZBQOSA-N 1 0 334.803 3.768 20 5 EHBDRO COc1cc(C[NH2+][C@@H](Cc2ccccc2)C2CC2)ccc1[N+](=O)[O-] ZINC000542541361 1120974332 /nfs/dbraw/zinc/97/43/32/1120974332.db2.gz OCWMNSBLDNNJLK-KRWDZBQOSA-N 1 0 326.396 3.714 20 5 EHBDRO CC1(C)CC[C@@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)O1 ZINC000495167819 1120976296 /nfs/dbraw/zinc/97/62/96/1120976296.db2.gz NTSGOUBOIUAGIW-INIZCTEOSA-N 1 0 330.384 3.902 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000495368606 1121134897 /nfs/dbraw/zinc/13/48/97/1121134897.db2.gz IUMHAUZVQICHPV-KRWDZBQOSA-N 1 0 348.830 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@H]3SCCS[C@@H]23)c1 ZINC000762613013 1121382304 /nfs/dbraw/zinc/38/23/04/1121382304.db2.gz GPJVEMOVJVUEEB-MCIONIFRSA-N 1 0 344.889 3.717 20 5 EHBDRO C[C@@H](C[C@H]1CCCO1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333107 1129002700 /nfs/dbraw/zinc/00/27/00/1129002700.db2.gz WGRUHMROZABVMO-BLLLJJGKSA-N 1 0 347.440 3.766 20 5 EHBDRO Cc1cc2ncc([C@@H](C)[NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)c(C)n2n1 ZINC000193903226 1121727105 /nfs/dbraw/zinc/72/71/05/1121727105.db2.gz HSLJZSXPKWQIBO-CHWSQXEVSA-N 1 0 339.399 3.666 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132036083 1129040584 /nfs/dbraw/zinc/04/05/84/1129040584.db2.gz KQXUYHGOIJCSDT-WFASDCNBSA-N 1 0 337.395 3.621 20 5 EHBDRO Cc1c(C[NH2+]CCc2ccc(OC(F)F)cc2)cccc1[N+](=O)[O-] ZINC000917134210 1122528926 /nfs/dbraw/zinc/52/89/26/1122528926.db2.gz MMIZLVGRNGDTDK-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@H]3C3CCCCC3)c2c1 ZINC000917478188 1122613358 /nfs/dbraw/zinc/61/33/58/1122613358.db2.gz LHFDFGWSUPYAPC-KRWDZBQOSA-N 1 0 328.416 3.947 20 5 EHBDRO C[C@@H]1[C@H](c2ccccc2)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154427556 1122624459 /nfs/dbraw/zinc/62/44/59/1122624459.db2.gz ZWPJTEUBXXIFQJ-ZMYBRWDISA-N 1 0 326.396 3.506 20 5 EHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cn2c(n1)CCCC2 ZINC000925467422 1123076617 /nfs/dbraw/zinc/07/66/17/1123076617.db2.gz SVGIBHCJEHODJI-OAHLLOKOSA-N 1 0 342.443 3.801 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000072840312 1123166916 /nfs/dbraw/zinc/16/69/16/1123166916.db2.gz CEIGICFEIDUEAA-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000609545274 1123608289 /nfs/dbraw/zinc/60/82/89/1123608289.db2.gz KXAMFFXYCHGJMJ-CQSZACIVSA-N 1 0 348.447 3.617 20 5 EHBDRO O=[N+]([O-])c1sccc1NCC1([NH+]2CCSCC2)CCCCC1 ZINC000609564173 1123609589 /nfs/dbraw/zinc/60/95/89/1123609589.db2.gz POSJNKCKDPBXMN-UHFFFAOYSA-N 1 0 341.502 3.820 20 5 EHBDRO Cc1ccc([C@H](CNc2nccc(C)c2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000609669844 1123639460 /nfs/dbraw/zinc/63/94/60/1123639460.db2.gz TUEWPXUQBRRYEM-KRWDZBQOSA-N 1 0 340.427 3.856 20 5 EHBDRO Cc1ccc([C@@H](CNc2nccc(C)c2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000609669845 1123639605 /nfs/dbraw/zinc/63/96/05/1123639605.db2.gz TUEWPXUQBRRYEM-QGZVFWFLSA-N 1 0 340.427 3.856 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([S@](C)=O)cc1 ZINC000615724352 1123864543 /nfs/dbraw/zinc/86/45/43/1123864543.db2.gz XNSDEQWQBHETKT-ZXFWNXIDSA-N 1 0 344.436 3.525 20 5 EHBDRO CC[C@@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCOC1 ZINC000616487686 1124011652 /nfs/dbraw/zinc/01/16/52/1124011652.db2.gz BJEGEOUXDNKVHI-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO CC[NH+](CC)[C@@H](CNC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000617727990 1124753186 /nfs/dbraw/zinc/75/31/86/1124753186.db2.gz QOEGEVASXWYMSV-MAUKXSAKSA-N 1 0 349.475 3.571 20 5 EHBDRO CC[NH+](CC)[C@@H](CNC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000617727978 1124754005 /nfs/dbraw/zinc/75/40/05/1124754005.db2.gz QOEGEVASXWYMSV-CRAIPNDOSA-N 1 0 349.475 3.571 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCCCc2ccccc2)n1 ZINC000618562228 1125113025 /nfs/dbraw/zinc/11/30/25/1125113025.db2.gz SNWGVVJJTGOPKS-ROUUACIJSA-N 1 0 342.443 3.888 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ncccc1C(F)(F)F ZINC000619785410 1125403967 /nfs/dbraw/zinc/40/39/67/1125403967.db2.gz ICVHMKBAMSKWBW-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1c1cccc(F)c1[N+](=O)[O-] ZINC000301860638 1129226194 /nfs/dbraw/zinc/22/61/94/1129226194.db2.gz CEZUCYITICJFCC-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@@H]1c1ccc(F)cc1 ZINC000301880077 1129252908 /nfs/dbraw/zinc/25/29/08/1129252908.db2.gz ZPLFHHVYMVASKC-SJORKVTESA-N 1 0 333.338 3.730 20 5 EHBDRO COc1cc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)c([N+](=O)[O-])cc1O ZINC000466385711 1129415327 /nfs/dbraw/zinc/41/53/27/1129415327.db2.gz JAABATAVAHXACG-CTYIDZIISA-N 1 0 342.395 3.653 20 5 EHBDRO Cc1nn(C)c(Nc2ccc(C[N@H+]3CCCC[C@@H]3C)cc2)c1[N+](=O)[O-] ZINC000301986043 1129470928 /nfs/dbraw/zinc/47/09/28/1129470928.db2.gz JVGQTNLMHQHSLD-ZDUSSCGKSA-N 1 0 343.431 3.755 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@@H](O)[C@H]4C3)s2)cc1 ZINC000543413225 1129473390 /nfs/dbraw/zinc/47/33/90/1129473390.db2.gz ZUKMGJDZOAPXOS-RRQGHBQHSA-N 1 0 344.436 3.526 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)CCO1 ZINC000466474249 1129477717 /nfs/dbraw/zinc/47/77/17/1129477717.db2.gz NYDMXKXUPSXYKC-LRDDRELGSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(OCc3ccc(F)cc3)CC2)c1 ZINC000091887312 1129526771 /nfs/dbraw/zinc/52/67/71/1129526771.db2.gz PYYVLJLRDWMNQP-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000154108465 1129532963 /nfs/dbraw/zinc/53/29/63/1129532963.db2.gz UWYIQTSPHZSTGJ-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N[C@H]3CC[N@H+](Cc4ccccc4)C3)ccnc21 ZINC000389197214 1129561632 /nfs/dbraw/zinc/56/16/32/1129561632.db2.gz QIKPNDPQLXWVGY-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO C[C@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093482609 1129590366 /nfs/dbraw/zinc/59/03/66/1129590366.db2.gz IJKAJLKDYVRGLE-KBPBESRZSA-N 1 0 330.384 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000429033016 1129714373 /nfs/dbraw/zinc/71/43/73/1129714373.db2.gz YZWPIRXXCCQZSJ-FVQSIRDASA-N 1 0 331.460 3.626 20 5 EHBDRO CCc1nc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000156405063 1129714893 /nfs/dbraw/zinc/71/48/93/1129714893.db2.gz NNQZUFALMJJXNO-HNNXBMFYSA-N 1 0 331.441 3.725 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1Nc1cccc(CC[N@@H+](C)C2CC2)c1 ZINC000302005383 1129763047 /nfs/dbraw/zinc/76/30/47/1129763047.db2.gz UMYGEOXYRYHZHV-UHFFFAOYSA-N 1 0 326.400 3.679 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])cc1Cl ZINC000302035780 1129764569 /nfs/dbraw/zinc/76/45/69/1129764569.db2.gz UQLGDNNLCQVDQC-GFCCVEGCSA-N 1 0 334.807 3.576 20 5 EHBDRO Cc1cc(N2CCO[C@H](c3ccco3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302097870 1129767794 /nfs/dbraw/zinc/76/77/94/1129767794.db2.gz TVCXVJNRYULLDX-SFHVURJKSA-N 1 0 339.351 3.622 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000056196227 1129805562 /nfs/dbraw/zinc/80/55/62/1129805562.db2.gz ZMCQIYUTEXXKSS-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000056196533 1129805784 /nfs/dbraw/zinc/80/57/84/1129805784.db2.gz SFRHNZAVTFYKIL-STQMWFEESA-N 1 0 345.374 3.720 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN(C)Cc1cc(C)c(OC)c(C)c1 ZINC000303126062 1129818728 /nfs/dbraw/zinc/81/87/28/1129818728.db2.gz NFPLXSYQWGJNCI-UHFFFAOYSA-N 1 0 344.411 3.861 20 5 EHBDRO CC(C)(CCO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000305846710 1129928459 /nfs/dbraw/zinc/92/84/59/1129928459.db2.gz SUMXIMBWKWYLKE-GOSISDBHSA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CN1C[C@H](C)[C@H]1c1ccccc1 ZINC000245443390 1130208911 /nfs/dbraw/zinc/20/89/11/1130208911.db2.gz XCOIRLPZFSWKNE-LIRRHRJNSA-N 1 0 339.395 3.535 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc(Cn2cccn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173340981 1130211233 /nfs/dbraw/zinc/21/12/33/1130211233.db2.gz NFJFQLXKXROLEO-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000246107245 1130345563 /nfs/dbraw/zinc/34/55/63/1130345563.db2.gz DOGKNZKQZLWAKG-DVOMOZLQSA-N 1 0 342.399 3.798 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1C[C@@H]2CCCC[C@H]2C1 ZINC000246150108 1130349841 /nfs/dbraw/zinc/34/98/41/1130349841.db2.gz HONQGCBRCMILFQ-SNPRPXQTSA-N 1 0 342.399 3.828 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000041776002 1130353510 /nfs/dbraw/zinc/35/35/10/1130353510.db2.gz WFASWGVVKATXPF-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCC[C@H]2c2cccc3ccccc32)c1 ZINC000174833009 1130387186 /nfs/dbraw/zinc/38/71/86/1130387186.db2.gz DUOMBLPKKHZNSN-IBGZPJMESA-N 1 0 336.395 3.782 20 5 EHBDRO CCOC(=O)CC[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000246532341 1130390893 /nfs/dbraw/zinc/39/08/93/1130390893.db2.gz CNUYOTNLQMSFMT-HUUCEWRRSA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CCC(C[NH+]4CCCC4)CC3)sc2c1 ZINC000731206525 1130779534 /nfs/dbraw/zinc/77/95/34/1130779534.db2.gz KOYLKPFGHBKESM-UHFFFAOYSA-N 1 0 346.456 3.517 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000738237609 1131465681 /nfs/dbraw/zinc/46/56/81/1131465681.db2.gz ANAAIQWZGNLNFJ-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO CC(C)OCCCN(C)Cn1c2cc([N+](=O)[O-])ccc2oc1=S ZINC000740858393 1131549886 /nfs/dbraw/zinc/54/98/86/1131549886.db2.gz WWYXPRPMLHPGRZ-UHFFFAOYSA-N 1 0 339.417 3.576 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)ccc1F ZINC001172899555 1131882806 /nfs/dbraw/zinc/88/28/06/1131882806.db2.gz CNJQAJPYDLMWPF-MRXNPFEDSA-N 1 0 344.386 3.780 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172901574 1131885169 /nfs/dbraw/zinc/88/51/69/1131885169.db2.gz NUHZTLSCWHORRW-HKUYNNGSSA-N 1 0 325.412 3.978 20 5 EHBDRO Cc1cc2c(cn1)[C@@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172903766 1131885916 /nfs/dbraw/zinc/88/59/16/1131885916.db2.gz IEQQJRXLHRKYNX-XLIONFOSSA-N 1 0 337.423 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(F)c(F)c1)CC2 ZINC001172895680 1131901940 /nfs/dbraw/zinc/90/19/40/1131901940.db2.gz HHIHSROTHVKXET-HNNXBMFYSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+](C1CCC1)C1CCOCC1)CC2 ZINC001172914071 1131903224 /nfs/dbraw/zinc/90/32/24/1131903224.db2.gz YUEKXQNUXRVOMN-SFHVURJKSA-N 1 0 344.455 3.876 20 5 EHBDRO C[C@@H](C(=O)OC(C)(C)C)[N@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172922644 1131906964 /nfs/dbraw/zinc/90/69/64/1131906964.db2.gz ZWOMGAINXXJFRZ-BBRMVZONSA-N 1 0 348.443 3.504 20 5 EHBDRO C[N@H+](Cc1cccc(O)c1)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172910429 1131916110 /nfs/dbraw/zinc/91/61/10/1131916110.db2.gz ZPKCJBFYEUZENQ-QGZVFWFLSA-N 1 0 326.396 3.680 20 5 EHBDRO C[N@H+](CCOc1ccccc1)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911055 1131918187 /nfs/dbraw/zinc/91/81/87/1131918187.db2.gz QUTATJCOBUZRAS-SFHVURJKSA-N 1 0 340.423 3.853 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2ccccc2C)c1F ZINC001173175473 1131991459 /nfs/dbraw/zinc/99/14/59/1131991459.db2.gz OAUPBDRNJHSEHQ-AWEZNQCLSA-N 1 0 346.402 3.814 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCC3(CCCC3)C2)c1F ZINC001173188471 1131993792 /nfs/dbraw/zinc/99/37/92/1131993792.db2.gz FOUJUQWVBKJNIS-CYBMUJFWSA-N 1 0 336.407 3.940 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccncc1 ZINC001173190025 1131995523 /nfs/dbraw/zinc/99/55/23/1131995523.db2.gz UCNQCELXDBVGHT-SWLSCSKDSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1c(F)cc(F)cc1C[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216550 1132002060 /nfs/dbraw/zinc/00/20/60/1132002060.db2.gz LWMQYOAHBIACSY-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)[C@@H](O)c1ccc(Cl)cc1 ZINC001173220158 1132003038 /nfs/dbraw/zinc/00/30/38/1132003038.db2.gz VAXNFGMHZZTCCP-SNUQEOBHSA-N 1 0 348.830 3.891 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2cc(F)ccc21 ZINC001173220327 1132004481 /nfs/dbraw/zinc/00/44/81/1132004481.db2.gz YKVCCFYUSBNFOJ-PXAZEXFGSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N(C(N)=[NH2+])c1ccc(Cl)cc1 ZINC001173224238 1132005788 /nfs/dbraw/zinc/00/57/88/1132005788.db2.gz MTOASXPFDFUOGB-NSHDSACASA-N 1 0 332.791 3.579 20 5 EHBDRO COc1ccc2c(c1)CC[N@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173224434 1132006005 /nfs/dbraw/zinc/00/60/05/1132006005.db2.gz FTZBDHPIQANQQO-AWEZNQCLSA-N 1 0 326.396 3.593 20 5 EHBDRO Cc1ccc([C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173231102 1132009454 /nfs/dbraw/zinc/00/94/54/1132009454.db2.gz XKKTXKVBQRCSSF-IFXJQAMLSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1CCN(c2ccccc2)CC1 ZINC001173231972 1132009528 /nfs/dbraw/zinc/00/95/28/1132009528.db2.gz BQUJILQXXWZLOY-INIZCTEOSA-N 1 0 339.439 3.784 20 5 EHBDRO CCOc1ccccc1OCC[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173235489 1132010448 /nfs/dbraw/zinc/01/04/48/1132010448.db2.gz UBYZOSTWXGKAKW-HNNXBMFYSA-N 1 0 344.411 3.593 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(C(F)(F)F)ccn1 ZINC001173235410 1132010798 /nfs/dbraw/zinc/01/07/98/1132010798.db2.gz SPBUUJBMBTVSLK-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173212994 1132013674 /nfs/dbraw/zinc/01/36/74/1132013674.db2.gz FBNWQUPRDVACSR-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c2cc(Cl)ccc2nc1C[NH3+] ZINC001173214511 1132015735 /nfs/dbraw/zinc/01/57/35/1132015735.db2.gz OJISQYDYCKHJFO-NSHDSACASA-N 1 0 344.802 3.860 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+](CCc2ccccc2)C2CC2)c1 ZINC000746118816 1132376842 /nfs/dbraw/zinc/37/68/42/1132376842.db2.gz FDBGAHVYWWUGGK-UHFFFAOYSA-N 1 0 326.396 3.681 20 5 EHBDRO CCC[N@@H+]1CCc2c(N)sc(Nc3ccc([N+](=O)[O-])cc3)c2C1 ZINC001174477287 1132381004 /nfs/dbraw/zinc/38/10/04/1132381004.db2.gz JBRJZBSBEOKXSL-UHFFFAOYSA-N 1 0 332.429 3.750 20 5 EHBDRO CC1(C)C[C@]1([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC001174907462 1132500656 /nfs/dbraw/zinc/50/06/56/1132500656.db2.gz NRWOADMOADFLSP-IBGZPJMESA-N 1 0 326.396 3.889 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1[N+](=O)[O-] ZINC000749298168 1132515338 /nfs/dbraw/zinc/51/53/38/1132515338.db2.gz ZJPHKMKLQFFGBG-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCOc2ccc(-c3ccccc3)cc2)C1 ZINC001168977453 1132617156 /nfs/dbraw/zinc/61/71/56/1132617156.db2.gz JXMBIHGTYVZNSF-VQIMIIECSA-N 1 0 340.423 3.767 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1F ZINC001168986230 1132620019 /nfs/dbraw/zinc/62/00/19/1132620019.db2.gz XGQMLEIAQVXUFH-CKYFFXLPSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@H](OCc3ccccc3)CC2)C1 ZINC001168959980 1132620330 /nfs/dbraw/zinc/62/03/30/1132620330.db2.gz YLPXHEQNOYECPN-OKYOBFRVSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](c2ccncc2C(F)(F)F)C2CC2)C1 ZINC001168997165 1132627348 /nfs/dbraw/zinc/62/73/48/1132627348.db2.gz BUEUFORJBUVEIR-HCKVZZMMSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@@H+]2CCc3ccc(C(F)(F)F)cc3C2)C1 ZINC001169035324 1132636772 /nfs/dbraw/zinc/63/67/72/1132636772.db2.gz KGZRHNQMIXRWNC-NHYWBVRUSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038403 1132638234 /nfs/dbraw/zinc/63/82/34/1132638234.db2.gz YLFGDRTXIUVSHS-XPKDYRNWSA-N 1 0 342.361 3.940 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CC[C@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025937 1132640396 /nfs/dbraw/zinc/64/03/96/1132640396.db2.gz KCLKROIDROIISD-INWMFGNUSA-N 1 0 342.361 3.940 20 5 EHBDRO C[C@@H]1OC2(CC[NH+]([C@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169057011 1132645132 /nfs/dbraw/zinc/64/51/32/1132645132.db2.gz UOWSZWUDNFWHSV-JYJNAYRXSA-N 1 0 330.428 3.514 20 5 EHBDRO CN(C)c1ccc(N[C@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)c([N+](=O)[O-])c1 ZINC001169153781 1132680854 /nfs/dbraw/zinc/68/08/54/1132680854.db2.gz UDZIWIWSKNTQST-SCLBCKFNSA-N 1 0 334.464 3.616 20 5 EHBDRO C[C@H]1CC[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC12CCCCC2 ZINC001169539514 1132781332 /nfs/dbraw/zinc/78/13/32/1132781332.db2.gz OLJXNAQUIOADKG-YJBOKZPZSA-N 1 0 332.444 3.921 20 5 EHBDRO C[NH+](C)CCOc1cc(N[C@@H]2C[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC001169813195 1132866060 /nfs/dbraw/zinc/86/60/60/1132866060.db2.gz UCNKJRUTXVICAC-DLBZAZTESA-N 1 0 341.411 3.503 20 5 EHBDRO COCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(C)c(C)c1 ZINC001176202827 1132870939 /nfs/dbraw/zinc/87/09/39/1132870939.db2.gz PNLZGWFQMGOCEA-UHFFFAOYSA-N 1 0 342.439 3.903 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767765743 1133050215 /nfs/dbraw/zinc/05/02/15/1133050215.db2.gz RWZYZTWFGXRRHN-MRXNPFEDSA-N 1 0 343.431 3.856 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)c1ccccc1 ZINC000768087353 1133090208 /nfs/dbraw/zinc/09/02/08/1133090208.db2.gz PNEFPZULJLEIFB-WBVHZDCISA-N 1 0 346.452 3.789 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCCCO1 ZINC001179700037 1133272057 /nfs/dbraw/zinc/27/20/57/1133272057.db2.gz MLQHPUCZGNUKTB-GOSISDBHSA-N 1 0 330.384 3.904 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@H]1CC1(C)C ZINC001181298339 1133476922 /nfs/dbraw/zinc/47/69/22/1133476922.db2.gz DFJIWDIIKVDURT-MRXNPFEDSA-N 1 0 349.434 3.941 20 5 EHBDRO CSCCCCCC[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774355228 1133669729 /nfs/dbraw/zinc/66/97/29/1133669729.db2.gz PVRFQPUTIJDYQL-GJZGRUSLSA-N 1 0 340.493 3.788 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774519271 1133703114 /nfs/dbraw/zinc/70/31/14/1133703114.db2.gz WLRZXSHHTDXFCL-ZFWWWQNUSA-N 1 0 329.375 3.981 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCc1c(C)noc1C ZINC000786813037 1133910662 /nfs/dbraw/zinc/91/06/62/1133910662.db2.gz BFVCJGSRQZHMMQ-JLHYYAGUSA-N 1 0 329.400 3.825 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1nc2c(cc1[N+](=O)[O-])CCCC2 ZINC001184598667 1133963933 /nfs/dbraw/zinc/96/39/33/1133963933.db2.gz QKHVZPUQQUDYLF-AWEZNQCLSA-N 1 0 334.464 3.791 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774841944 1134051763 /nfs/dbraw/zinc/05/17/63/1134051763.db2.gz ZXIXVYLXTALZDV-UHFFFAOYSA-N 1 0 343.383 3.958 20 5 EHBDRO C[C@H]1C[C@@H](Nc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC001185775485 1134131566 /nfs/dbraw/zinc/13/15/66/1134131566.db2.gz QERDDIRMVBMERO-GXSJLCMTSA-N 1 0 329.322 3.651 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C(C)C)[C@H](O)c1ccccc1 ZINC000788540206 1134139685 /nfs/dbraw/zinc/13/96/85/1134139685.db2.gz RMFXHKWUXRRDPH-RTBURBONSA-N 1 0 328.412 3.751 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc21 ZINC000788590080 1134147845 /nfs/dbraw/zinc/14/78/45/1134147845.db2.gz RYGOUWHXOOPSEX-WMLDXEAASA-N 1 0 346.427 3.593 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788602148 1134149384 /nfs/dbraw/zinc/14/93/84/1134149384.db2.gz LYSUSBHBEYNQCT-JDFRZJQESA-N 1 0 335.448 3.669 20 5 EHBDRO C[C@H]([NH2+]CC1(Cc2ccccc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788669013 1134159611 /nfs/dbraw/zinc/15/96/11/1134159611.db2.gz CEZAFXOTGLJQGD-AWEZNQCLSA-N 1 0 325.412 3.851 20 5 EHBDRO CCC[N@H+](CC)C[C@H](C)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC001186632992 1134240288 /nfs/dbraw/zinc/24/02/88/1134240288.db2.gz LISRYAMKOWWYIP-NSHDSACASA-N 1 0 344.253 3.890 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(F)(c3ccccc3)CC2)cc1 ZINC000789311716 1134252388 /nfs/dbraw/zinc/25/23/88/1134252388.db2.gz UAJQAIRKZVAPKX-SFHVURJKSA-N 1 0 344.386 3.589 20 5 EHBDRO C[NH2+]C1(CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])CCCCC1 ZINC001187429501 1134338153 /nfs/dbraw/zinc/33/81/53/1134338153.db2.gz BNXVNFZZEOOVAX-UHFFFAOYSA-N 1 0 331.338 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3cc(O)ccc3C2)cc1Cl ZINC000775171095 1134475009 /nfs/dbraw/zinc/47/50/09/1134475009.db2.gz GIDLKWRQWCVXPU-CQSZACIVSA-N 1 0 332.787 3.601 20 5 EHBDRO CC(C)OCC[NH+]1CCC(Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000791413457 1134547501 /nfs/dbraw/zinc/54/75/01/1134547501.db2.gz OICYBUUYPSWQOR-UHFFFAOYSA-N 1 0 341.839 3.550 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](c2ccncc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170313838 1134745595 /nfs/dbraw/zinc/74/55/95/1134745595.db2.gz RZCRPNDLGYMNMS-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170306570 1134752300 /nfs/dbraw/zinc/75/23/00/1134752300.db2.gz XRQKWBSCTSNVDU-KBXCAEBGSA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000792877048 1134810598 /nfs/dbraw/zinc/81/05/98/1134810598.db2.gz PSUFYWYTFZYHGQ-ZDUSSCGKSA-N 1 0 343.383 3.959 20 5 EHBDRO CC[NH+](CC)CCN(CCC(F)(F)F)Cc1ccccc1[N+](=O)[O-] ZINC001191358207 1134848226 /nfs/dbraw/zinc/84/82/26/1134848226.db2.gz GMNFAFJRHSPEMP-UHFFFAOYSA-N 1 0 347.381 3.691 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(F)c1 ZINC001192565345 1135030539 /nfs/dbraw/zinc/03/05/39/1135030539.db2.gz LUHAFTKAYWYDLA-QZTJIDSGSA-N 1 0 332.375 3.817 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1cc(C)cc(C)c1)c1cccc([N+](=O)[O-])c1 ZINC000775539435 1135038637 /nfs/dbraw/zinc/03/86/37/1135038637.db2.gz LOCBASNONYCRCQ-MOPGFXCFSA-N 1 0 328.412 3.986 20 5 EHBDRO CCC(CC)[C@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccccc1 ZINC001192652459 1135039872 /nfs/dbraw/zinc/03/98/72/1135039872.db2.gz CBIJHWWDCZKPEX-SFHVURJKSA-N 1 0 330.432 3.867 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)c(F)c1 ZINC001192880466 1135074441 /nfs/dbraw/zinc/07/44/41/1135074441.db2.gz BQLDSKFDQIEDIG-ROUUACIJSA-N 1 0 332.375 3.817 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2c(Cl)nccc2[N+](=O)[O-])CC1(C)C ZINC001170453017 1135086873 /nfs/dbraw/zinc/08/68/73/1135086873.db2.gz GDYPASRMHDRQAI-UHFFFAOYSA-N 1 0 326.828 3.707 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCCC1 ZINC001193261941 1135118759 /nfs/dbraw/zinc/11/87/59/1135118759.db2.gz VBYKGSMWWYPXCX-CQSZACIVSA-N 1 0 333.432 3.872 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCC[NH+]2CCC(C)CC2)c1 ZINC000747208107 1135171304 /nfs/dbraw/zinc/17/13/04/1135171304.db2.gz UIFDQPVGVSMQGB-UHFFFAOYSA-N 1 0 339.411 3.667 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784282 1135199409 /nfs/dbraw/zinc/19/94/09/1135199409.db2.gz ZMCVOHGOQVPRDR-FZMZJTMJSA-N 1 0 348.359 3.637 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@@H]1OC ZINC001194091439 1135231390 /nfs/dbraw/zinc/23/13/90/1135231390.db2.gz MOPADTJBXWQUQK-CABCVRRESA-N 1 0 326.824 3.932 20 5 EHBDRO CCCCO[C@H]1C[C@H]([NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)C1(C)C ZINC001194190026 1135241182 /nfs/dbraw/zinc/24/11/82/1135241182.db2.gz JDDQCCXHHOTNDL-IRXDYDNUSA-N 1 0 336.432 3.677 20 5 EHBDRO CC1(C)CCC[C@@H]1[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424186 1135428089 /nfs/dbraw/zinc/42/80/89/1135428089.db2.gz HXMKKWKEOXIZGJ-NXHRZFHOSA-N 1 0 332.444 3.776 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+]C(C2CCCCC2)C2CCCCC2)n1 ZINC001197263862 1135667304 /nfs/dbraw/zinc/66/73/04/1135667304.db2.gz DRSKHRDHWJSZLZ-UHFFFAOYSA-N 1 0 334.464 3.910 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@H](O)c1ccccc1 ZINC000808720500 1135720933 /nfs/dbraw/zinc/72/09/33/1135720933.db2.gz AASSFSBNYBCCNO-BKTGTZMESA-N 1 0 326.396 3.684 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+]C1(C2CCCCC2)CC1 ZINC001198543054 1135834234 /nfs/dbraw/zinc/83/42/34/1135834234.db2.gz VCFWHLURVZTWEX-UHFFFAOYSA-N 1 0 345.443 3.934 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C2CCCC2)C1 ZINC001198707221 1135851728 /nfs/dbraw/zinc/85/17/28/1135851728.db2.gz SRNCGIFDTBMSOU-ZBFHGGJFSA-N 1 0 345.443 3.824 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000810093372 1135920405 /nfs/dbraw/zinc/92/04/05/1135920405.db2.gz NHOHCOODRRVCHO-HOTGVXAUSA-N 1 0 336.819 3.782 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H](CO)C1CCCC1 ZINC000810116151 1135927986 /nfs/dbraw/zinc/92/79/86/1135927986.db2.gz VCHGTXTXCHKCEB-ZDUSSCGKSA-N 1 0 333.215 3.542 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1COC2(CCCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000776173126 1136021053 /nfs/dbraw/zinc/02/10/53/1136021053.db2.gz ZGNNRSXZXZQAAP-DLBZAZTESA-N 1 0 334.416 3.711 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCOC1CCCC1 ZINC000811476293 1136096434 /nfs/dbraw/zinc/09/64/34/1136096434.db2.gz ICMYGKDUUNVCKP-UHFFFAOYSA-N 1 0 333.215 3.950 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@H]1c1ccccc1 ZINC000776253678 1136102417 /nfs/dbraw/zinc/10/24/17/1136102417.db2.gz NTUIXWSWFNSLCP-SJLPKXTDSA-N 1 0 345.830 3.783 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275757 1136129940 /nfs/dbraw/zinc/12/99/40/1136129940.db2.gz HPFAIAFKYMBXLO-IBGZPJMESA-N 1 0 328.412 3.583 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3COC4(CCC4)C3)cs2)c1 ZINC000850367438 1136241859 /nfs/dbraw/zinc/24/18/59/1136241859.db2.gz IVOPHMOMJAMKGF-ZDUSSCGKSA-N 1 0 345.424 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3COC4(CCC4)C3)o2)cc1 ZINC000850367552 1136242525 /nfs/dbraw/zinc/24/25/25/1136242525.db2.gz MSKUGQXXJPZVOM-CQSZACIVSA-N 1 0 328.368 3.656 20 5 EHBDRO CC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812851222 1136261330 /nfs/dbraw/zinc/26/13/30/1136261330.db2.gz QOSAXEJOFLIJFB-KXBFYZLASA-N 1 0 328.412 3.847 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2COC3(CCC3)C2)c2ccccc2)c1 ZINC000850523827 1136277671 /nfs/dbraw/zinc/27/76/71/1136277671.db2.gz DCNYGJDPJQFVHV-PKOBYXMFSA-N 1 0 338.407 3.985 20 5 EHBDRO CC(C)[C@@H](O)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553739 1136284315 /nfs/dbraw/zinc/28/43/15/1136284315.db2.gz CACWDPNOHAMSAL-MJXNMMHHSA-N 1 0 343.427 3.586 20 5 EHBDRO Cc1cc(OCc2ccc(Br)c([N+](=O)[O-])c2)cc(C)[nH+]1 ZINC000814265938 1136429741 /nfs/dbraw/zinc/42/97/41/1136429741.db2.gz ZVAAEONTBCYCLC-UHFFFAOYSA-N 1 0 337.173 3.948 20 5 EHBDRO CC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@H](C)[C@H](O)c1ccccc1 ZINC000852066242 1136430811 /nfs/dbraw/zinc/43/08/11/1136430811.db2.gz MXBDBMKSLIXGSA-ACJLOTCBSA-N 1 0 332.375 3.678 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[N@H+](C1CC1)C1(CO)CCC1 ZINC000852159981 1136437957 /nfs/dbraw/zinc/43/79/57/1136437957.db2.gz VYEAIWZJVABWFW-UHFFFAOYSA-N 1 0 345.226 3.781 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)CC2)cc1 ZINC000776582454 1136442337 /nfs/dbraw/zinc/44/23/37/1136442337.db2.gz UQSAUXLICLMWSP-PXNSSMCTSA-N 1 0 340.423 3.898 20 5 EHBDRO CCC[N@@H+](Cc1ccccc1F)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580682 1136444925 /nfs/dbraw/zinc/44/49/25/1136444925.db2.gz YXEQQHWIAUNLAR-SFHVURJKSA-N 1 0 332.375 3.680 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccsc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000852310939 1136447372 /nfs/dbraw/zinc/44/73/72/1136447372.db2.gz BNWJBOBNIGQLQI-INIZCTEOSA-N 1 0 334.441 3.990 20 5 EHBDRO CC(C)CC1([NH2+][C@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000852683081 1136477383 /nfs/dbraw/zinc/47/73/83/1136477383.db2.gz RQAIUGXCLIBGTR-LLVKDONJSA-N 1 0 339.823 3.744 20 5 EHBDRO CCc1ccc([C@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640857 1136487572 /nfs/dbraw/zinc/48/75/72/1136487572.db2.gz VCSRRZJLDAJTLW-AZUAARDMSA-N 1 0 340.423 3.680 20 5 EHBDRO CCc1ccc([C@H]2CC[N@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000814640858 1136487622 /nfs/dbraw/zinc/48/76/22/1136487622.db2.gz VCSRRZJLDAJTLW-ICSRJNTNSA-N 1 0 340.423 3.680 20 5 EHBDRO CSc1ccc([C@H](CNc2ccc(N)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000814961276 1136532526 /nfs/dbraw/zinc/53/25/26/1136532526.db2.gz YXAXAYZMAGTSPD-KRWDZBQOSA-N 1 0 346.456 3.614 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CC2(Cc3ccccc3)CCC2)cc1 ZINC000819152406 1136914420 /nfs/dbraw/zinc/91/44/20/1136914420.db2.gz SPCZIUOBCKZGRH-IBGZPJMESA-N 1 0 340.423 3.631 20 5 EHBDRO C[C@H]([NH2+]Cc1cccnc1C(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000859320099 1137011461 /nfs/dbraw/zinc/01/14/61/1137011461.db2.gz VHRCQPSHIKYJID-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000860203951 1137049444 /nfs/dbraw/zinc/04/94/44/1137049444.db2.gz UUTPVGKOVVFSDG-MRXNPFEDSA-N 1 0 348.349 3.575 20 5 EHBDRO O=C(O[C@@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738636 1137075945 /nfs/dbraw/zinc/07/59/45/1137075945.db2.gz CGGKGMVJLWTJDV-GDBMZVCRSA-N 1 0 340.379 3.532 20 5 EHBDRO CO[C@@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])Cc1ccccc1 ZINC000824589486 1137144196 /nfs/dbraw/zinc/14/41/96/1137144196.db2.gz FIFMVMVVUPZMBU-MRXNPFEDSA-N 1 0 334.803 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@H+]1CC[C@@H](c2ccc(O)cc2)C1 ZINC000862541563 1137149263 /nfs/dbraw/zinc/14/92/63/1137149263.db2.gz WIKLBYKXPVPKCK-CYBMUJFWSA-N 1 0 332.787 3.943 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C2CC2)cn1 ZINC000862552232 1137149727 /nfs/dbraw/zinc/14/97/27/1137149727.db2.gz ZPIXIXGWOYXSEO-QGZVFWFLSA-N 1 0 347.802 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000824953801 1137159129 /nfs/dbraw/zinc/15/91/29/1137159129.db2.gz LSXITLZXNIKTQD-RDJZCZTQSA-N 1 0 347.802 3.653 20 5 EHBDRO COC[C@@]1(CO)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000825158616 1137168364 /nfs/dbraw/zinc/16/83/64/1137168364.db2.gz SJFWREVGVCQZDS-QFIPXVFZSA-N 1 0 335.447 3.824 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000825202817 1137168907 /nfs/dbraw/zinc/16/89/07/1137168907.db2.gz WAWFTUOMVRAMEO-UHFFFAOYSA-N 1 0 335.231 3.788 20 5 EHBDRO CC(C)(C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1(O)CCCC1 ZINC000825232027 1137170153 /nfs/dbraw/zinc/17/01/53/1137170153.db2.gz KRSAZIAGMPPQRD-UHFFFAOYSA-N 1 0 326.824 3.669 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000863591455 1137193137 /nfs/dbraw/zinc/19/31/37/1137193137.db2.gz ZBWHYIORTOGUJC-QZTJIDSGSA-N 1 0 346.814 3.949 20 5 EHBDRO CC[C@@](C)([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000844312869 1137208801 /nfs/dbraw/zinc/20/88/01/1137208801.db2.gz OMWJNZRYFCWKAS-LJQANCHMSA-N 1 0 342.395 3.796 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3c(Cl)cncc3[N+](=O)[O-])c2c1 ZINC001171167501 1137278200 /nfs/dbraw/zinc/27/82/00/1137278200.db2.gz GIYXYGDDRLTFAW-LLVKDONJSA-N 1 0 344.802 3.785 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@](C)(O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000846185658 1137340465 /nfs/dbraw/zinc/34/04/65/1137340465.db2.gz CENYXRQJMSFMIH-KHYOSLBOSA-N 1 0 328.412 3.850 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@@](C)(O)c1ccccc1 ZINC000846191807 1137340921 /nfs/dbraw/zinc/34/09/21/1137340921.db2.gz ZGZPNLMXKPDQDD-YZVOILCLSA-N 1 0 328.412 3.850 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CC12CCSCC2 ZINC000866375602 1137350341 /nfs/dbraw/zinc/35/03/41/1137350341.db2.gz DGWGVHVNFKQPKE-TZMCWYRMSA-N 1 0 338.448 3.788 20 5 EHBDRO Cc1cnc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])c(C)c1 ZINC000866384271 1137350977 /nfs/dbraw/zinc/35/09/77/1137350977.db2.gz JHMRAIMNCFINOT-CQSZACIVSA-N 1 0 331.391 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)CCC2 ZINC000866539123 1137362925 /nfs/dbraw/zinc/36/29/25/1137362925.db2.gz GTJIVTZRBXIDLS-VDZJLULYSA-N 1 0 330.428 3.625 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)CCCO2 ZINC000866541323 1137363163 /nfs/dbraw/zinc/36/31/63/1137363163.db2.gz YKQKFCZXSDTFMK-KRWDZBQOSA-N 1 0 342.395 3.915 20 5 EHBDRO [NH3+]C[C@H]1COc2ccccc2N1c1ncnc2cc3ccccc3cc21 ZINC001171392462 1137469367 /nfs/dbraw/zinc/46/93/67/1137469367.db2.gz KUOICAJADJCRMU-INIZCTEOSA-N 1 0 342.402 3.641 20 5 EHBDRO [NH3+]C[C@@H]1COc2ccccc2N1c1ccc([N+](=O)[O-])c2ccccc21 ZINC001171398997 1137470709 /nfs/dbraw/zinc/47/07/09/1137470709.db2.gz YQPPUOXNRKMMFY-CYBMUJFWSA-N 1 0 335.363 3.606 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000511021223 1137471406 /nfs/dbraw/zinc/47/14/06/1137471406.db2.gz ZDYNKNUJWPPMKH-CRAIPNDOSA-N 1 0 340.423 3.899 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC[NH+](C2CC2)CC1 ZINC000872018664 1137564963 /nfs/dbraw/zinc/56/49/63/1137564963.db2.gz OGQFIDCFFDMDCM-GFCCVEGCSA-N 1 0 335.473 3.594 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057569 1137568636 /nfs/dbraw/zinc/56/86/36/1137568636.db2.gz GBQFDZKXLMIHHJ-NQERCMRGSA-N 1 0 334.391 3.732 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000872061538 1137568908 /nfs/dbraw/zinc/56/89/08/1137568908.db2.gz YUEWGYNYYAYFRN-HIFRSBDPSA-N 1 0 326.824 3.586 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000872134412 1137573559 /nfs/dbraw/zinc/57/35/59/1137573559.db2.gz WBPWOYKQZUJVTH-JENIJYKNSA-N 1 0 326.396 3.684 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCO[C@H](c2ccncc2)C1 ZINC000873131390 1137590904 /nfs/dbraw/zinc/59/09/04/1137590904.db2.gz OZTZCKPWFBRXCU-LPHOPBHVSA-N 1 0 341.411 3.617 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3cccc(Cl)c3Cl)C2)c1 ZINC000876987977 1137666930 /nfs/dbraw/zinc/66/69/30/1137666930.db2.gz PDDYPOXWAAIGOJ-UHFFFAOYSA-N 1 0 341.198 3.591 20 5 EHBDRO Cc1cccc(C2([NH2+]C3CC(n4cc([N+](=O)[O-])cn4)C3)CCCC2)c1 ZINC000877147633 1137671598 /nfs/dbraw/zinc/67/15/98/1137671598.db2.gz IVTCTEYPMUKUEH-UHFFFAOYSA-N 1 0 340.427 3.862 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CCCC[C@H]3CC(F)(F)F)C2)c1 ZINC000877562142 1137681317 /nfs/dbraw/zinc/68/13/17/1137681317.db2.gz QCLLCEWWUVDCEV-BBCYWQGDSA-N 1 0 346.353 3.596 20 5 EHBDRO CC(C)(O)C1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000877754226 1137688032 /nfs/dbraw/zinc/68/80/32/1137688032.db2.gz XYNNMCYIWQHUAD-UHFFFAOYSA-N 1 0 344.411 3.838 20 5 EHBDRO CC(C)(O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000877835863 1137692898 /nfs/dbraw/zinc/69/28/98/1137692898.db2.gz YLCJAFORLBXBSI-CYBMUJFWSA-N 1 0 346.452 3.916 20 5 EHBDRO CC[N@H+](Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CCC1 ZINC000878116053 1137703145 /nfs/dbraw/zinc/70/31/45/1137703145.db2.gz JDJLRHCQRUCUID-UHFFFAOYSA-N 1 0 336.779 3.673 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000878348054 1137711823 /nfs/dbraw/zinc/71/18/23/1137711823.db2.gz CLPABRHPCWBNFA-LBPRGKRZSA-N 1 0 330.388 3.703 20 5 EHBDRO CC1(C)CC[C@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878673010 1137724572 /nfs/dbraw/zinc/72/45/72/1137724572.db2.gz MAORULDMKDDPSQ-GFCCVEGCSA-N 1 0 336.779 3.576 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H](C3CCC3)C2)o1 ZINC000878994659 1137734544 /nfs/dbraw/zinc/73/45/44/1137734544.db2.gz XBLPMTXCKMZSDF-CQSZACIVSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@@H]2CC=CC[C@@H]2C1 ZINC000879528879 1137749921 /nfs/dbraw/zinc/74/99/21/1137749921.db2.gz DZNLDTQDOFLOIG-AEGPPILISA-N 1 0 340.383 3.604 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3[C@@H](C)c2ccccc2[N+](=O)[O-])no1 ZINC000879681207 1137754983 /nfs/dbraw/zinc/75/49/83/1137754983.db2.gz MLLAQDDASMJZCY-PRTUASRFSA-N 1 0 342.399 3.758 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2ccnc(F)c2[N+](=O)[O-])CC1 ZINC000881818570 1137816077 /nfs/dbraw/zinc/81/60/77/1137816077.db2.gz OXXWVMZBQCRUGT-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO CC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000882964942 1137840001 /nfs/dbraw/zinc/84/00/01/1137840001.db2.gz SARQCZYSVJDQIB-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2c(C)c([N+](=O)[O-])ccc2F)o1 ZINC000800144388 1137899375 /nfs/dbraw/zinc/89/93/75/1137899375.db2.gz XZRKZLVCNLCFOD-UHFFFAOYSA-N 1 0 349.362 3.729 20 5 EHBDRO CC(C)c1csc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)n1 ZINC000331573837 1137913058 /nfs/dbraw/zinc/91/30/58/1137913058.db2.gz IXJZROJOVMQUDJ-TZMCWYRMSA-N 1 0 349.460 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](c2ccnn2C)C1 ZINC000332323342 1137939907 /nfs/dbraw/zinc/93/99/07/1137939907.db2.gz NYZKVZSQMMVONP-HUUCEWRRSA-N 1 0 328.416 3.577 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC1 ZINC000884718219 1137970793 /nfs/dbraw/zinc/97/07/93/1137970793.db2.gz XVQVXSLLEQPFIS-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO Cc1c(NC(=O)NCCCC[N@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000045960117 1138041338 /nfs/dbraw/zinc/04/13/38/1138041338.db2.gz FYJRAFOHKAXQOD-CQSZACIVSA-N 1 0 348.447 3.537 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cn(C)nc2C(F)(F)F)cc1[N+](=O)[O-] ZINC000090666169 1138212728 /nfs/dbraw/zinc/21/27/28/1138212728.db2.gz VLAUDBPEESMKJN-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO C[C@@H]([NH2+]C1(C2CC2)CCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000887147358 1138222868 /nfs/dbraw/zinc/22/28/68/1138222868.db2.gz JIBLCAMKWADOMT-LLVKDONJSA-N 1 0 328.372 3.628 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[NH+]2CCC(c3ccccc3)CC2)c1 ZINC000887559354 1138428122 /nfs/dbraw/zinc/42/81/22/1138428122.db2.gz PHZDQDHBBJPCFQ-UHFFFAOYSA-N 1 0 336.395 3.782 20 5 EHBDRO CC(C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccs1 ZINC000337191192 1138490671 /nfs/dbraw/zinc/49/06/71/1138490671.db2.gz WZORCJIHBQRNQW-UHFFFAOYSA-N 1 0 347.440 3.896 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H]2CCC[C@@H](c3cccnc3)C2)c1 ZINC000337321994 1138532149 /nfs/dbraw/zinc/53/21/49/1138532149.db2.gz ZRBRWGUDXPGIQE-AEFFLSMTSA-N 1 0 325.412 3.848 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c(-c2ccnn2C)c1 ZINC000338422273 1138907557 /nfs/dbraw/zinc/90/75/57/1138907557.db2.gz GPUGLARSZRRRMR-UHFFFAOYSA-N 1 0 336.395 3.594 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000152521689 1139097064 /nfs/dbraw/zinc/09/70/64/1139097064.db2.gz RMDDDLCJDYHJDD-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000152619137 1139100393 /nfs/dbraw/zinc/10/03/93/1139100393.db2.gz USHMVXQUTAWYJS-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3C[C@@H]4CCC[C@H]4C3)o2)c1 ZINC000153288638 1139130753 /nfs/dbraw/zinc/13/07/53/1139130753.db2.gz QSONWKMQLUSOQA-GJZGRUSLSA-N 1 0 327.384 3.524 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1cccc(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000178195781 1139678652 /nfs/dbraw/zinc/67/86/52/1139678652.db2.gz UXJVIEUYKKNBIQ-KRWDZBQOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000179627632 1139769216 /nfs/dbraw/zinc/76/92/16/1139769216.db2.gz QCOJKNZTCZWMNS-IAGOWNOFSA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000181808240 1139932974 /nfs/dbraw/zinc/93/29/74/1139932974.db2.gz XDMOGQKPSULJJP-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000182022442 1139946305 /nfs/dbraw/zinc/94/63/05/1139946305.db2.gz JPKDIWXYFGARRG-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000182351099 1139967436 /nfs/dbraw/zinc/96/74/36/1139967436.db2.gz NBEFUMCQYOYQBW-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000187769667 1140270386 /nfs/dbraw/zinc/27/03/86/1140270386.db2.gz STHCQQPZNJQXQX-RHSMWYFYSA-N 1 0 347.459 3.521 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccsc1 ZINC000192891072 1140554123 /nfs/dbraw/zinc/55/41/23/1140554123.db2.gz GUWNVZMLPILSBB-DLBZAZTESA-N 1 0 332.425 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC[NH+](C3CCCC3)CC1)CCC2 ZINC000192932078 1140556048 /nfs/dbraw/zinc/55/60/48/1140556048.db2.gz RSJZRXZNEMUOLK-FQEVSTJZSA-N 1 0 343.471 3.969 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccc2c(c1)CCO2 ZINC000268867215 1141011844 /nfs/dbraw/zinc/01/18/44/1141011844.db2.gz WWAFSPCDWPYGAU-INIZCTEOSA-N 1 0 342.395 3.779 20 5 EHBDRO CCC(CC)(CCO)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268884823 1141017955 /nfs/dbraw/zinc/01/79/55/1141017955.db2.gz BQWOOPZFLMGVKQ-KRWDZBQOSA-N 1 0 334.460 3.694 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)c1 ZINC000269684237 1141135126 /nfs/dbraw/zinc/13/51/26/1141135126.db2.gz SHZCKIMIUIZJOO-MSOLQXFVSA-N 1 0 330.359 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH+]3CCC(CO)CC3)s2)cc1 ZINC000271021466 1141295458 /nfs/dbraw/zinc/29/54/58/1141295458.db2.gz AZUFOLJZSLARKC-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1nc2c(s1)CCCC2 ZINC000271600145 1141404672 /nfs/dbraw/zinc/40/46/72/1141404672.db2.gz VGADSUFTUPDDNO-LBPRGKRZSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526349 1141545278 /nfs/dbraw/zinc/54/52/78/1141545278.db2.gz UTVBSTPPPOPEMM-SFHVURJKSA-N 1 0 339.395 3.679 20 5 EHBDRO [NH3+]CCN(Cc1cc2ccccc2s1)c1ccccc1[N+](=O)[O-] ZINC000348894269 1141605462 /nfs/dbraw/zinc/60/54/62/1141605462.db2.gz OKCNOJGXUJZHBK-UHFFFAOYSA-N 1 0 327.409 3.775 20 5 EHBDRO C[C@H](c1ccco1)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000283371419 1141611426 /nfs/dbraw/zinc/61/14/26/1141611426.db2.gz SJDKNNVGLIHXBB-CYBMUJFWSA-N 1 0 343.383 3.742 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccccc1CNc1ccc([N+](=O)[O-])cn1 ZINC000052245059 214124207 /nfs/dbraw/zinc/12/42/07/214124207.db2.gz SGTUHCHDERHDBF-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO COc1ccc2c(c1)CCC[C@H]2[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000537967069 1032069173 /nfs/dbraw/zinc/06/91/73/1032069173.db2.gz RXQPZTJLBCHVHJ-LJQANCHMSA-N 1 0 342.395 3.649 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2N(C)C)cc1[N+](=O)[O-] ZINC000537971318 1032071436 /nfs/dbraw/zinc/07/14/36/1032071436.db2.gz ISTIYZWBSNLZOD-AWEZNQCLSA-N 1 0 343.427 3.910 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nc(C(F)(F)F)cs1 ZINC000274633388 1014375683 /nfs/dbraw/zinc/37/56/83/1014375683.db2.gz RVLSXPIWRHCPEB-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO COc1cc(C[NH2+]Cc2cc3ccccc3s2)c([N+](=O)[O-])cc1O ZINC000339416616 1014380447 /nfs/dbraw/zinc/38/04/47/1014380447.db2.gz NEEOFGDCHWQZGY-UHFFFAOYSA-N 1 0 344.392 3.814 20 5 EHBDRO CCCC[N@H+](C)C[C@H](C)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000579755589 1014387869 /nfs/dbraw/zinc/38/78/69/1014387869.db2.gz GURTZHJZPIBFGR-JTQLQIEISA-N 1 0 334.342 3.541 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@@H](Nc2ccccc2)C1 ZINC000430204541 1014893767 /nfs/dbraw/zinc/89/37/67/1014893767.db2.gz ROEGBBYGOODGJC-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](c2ccc(F)cc2)C1 ZINC000430211394 1014992077 /nfs/dbraw/zinc/99/20/77/1014992077.db2.gz IXSFNSREXVINNZ-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO CSc1ccc([C@@H](C[NH2+]Cc2ccccc2[N+](=O)[O-])N(C)C)cc1 ZINC000339591222 1015091090 /nfs/dbraw/zinc/09/10/90/1015091090.db2.gz ZBLLICCHTYDZMI-GOSISDBHSA-N 1 0 345.468 3.709 20 5 EHBDRO CSc1ccc([C@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2)N(C)C)cc1 ZINC000339590666 1015091675 /nfs/dbraw/zinc/09/16/75/1015091675.db2.gz OHLNWYHBLCBGNU-SFHVURJKSA-N 1 0 345.468 3.709 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000120480961 1015266855 /nfs/dbraw/zinc/26/68/55/1015266855.db2.gz YPXZMERCPGVOHX-SJKOYZFVSA-N 1 0 334.803 3.941 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339737682 1015611230 /nfs/dbraw/zinc/61/12/30/1015611230.db2.gz MWNBJOQNAIHOPC-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C[C@@H](C)C1 ZINC000246941335 1016160182 /nfs/dbraw/zinc/16/01/82/1016160182.db2.gz ZFYSHGAABDHQLO-STQMWFEESA-N 1 0 330.388 3.513 20 5 EHBDRO CCC[C@](C)([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430387349 1016604177 /nfs/dbraw/zinc/60/41/77/1016604177.db2.gz UVMREVOWDPUAPY-SFHVURJKSA-N 1 0 343.383 3.843 20 5 EHBDRO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCC1CCCCC1 ZINC001167273380 1016915024 /nfs/dbraw/zinc/91/50/24/1016915024.db2.gz DREQRKKVHBAMDP-CQSZACIVSA-N 1 0 333.432 3.824 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@H](CO)C3)s2)cc1 ZINC000414565737 1016978669 /nfs/dbraw/zinc/97/86/69/1016978669.db2.gz FJIDHPSXMYAOHN-ZFWWWQNUSA-N 1 0 346.452 3.964 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])cn1 ZINC000449079624 1032171241 /nfs/dbraw/zinc/17/12/41/1032171241.db2.gz PGYAGNIEYRGLIN-HNNXBMFYSA-N 1 0 342.443 3.557 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1C ZINC000538187591 1032207780 /nfs/dbraw/zinc/20/77/80/1032207780.db2.gz KDKSGVLZMARFNB-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000461090179 1032246779 /nfs/dbraw/zinc/24/67/79/1032246779.db2.gz RZTUJVKREQTYDO-HUUCEWRRSA-N 1 0 343.402 3.911 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccc(F)c(F)c1F ZINC000449232190 1032350342 /nfs/dbraw/zinc/35/03/42/1032350342.db2.gz HFECUDVUGQHVGX-NSHDSACASA-N 1 0 338.329 3.775 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2c(O)cccc21 ZINC000449278350 1032396661 /nfs/dbraw/zinc/39/66/61/1032396661.db2.gz IVJDHZWCXYZDNY-SUMWQHHRSA-N 1 0 326.396 3.899 20 5 EHBDRO CC[C@@H]1OCC[C@H]1[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000459733735 1032438353 /nfs/dbraw/zinc/43/83/53/1032438353.db2.gz BSGCDXHXTFXZGU-WBVHZDCISA-N 1 0 346.383 3.521 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537173941 1032547842 /nfs/dbraw/zinc/54/78/42/1032547842.db2.gz POFZTQJOPBDIPY-GJZGRUSLSA-N 1 0 347.459 3.639 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+](C)[C@H](CO)c1ccc(Cl)cc1 ZINC000449452049 1032569960 /nfs/dbraw/zinc/56/99/60/1032569960.db2.gz JRIZISPRDFTQIU-QGZVFWFLSA-N 1 0 334.803 3.722 20 5 EHBDRO COc1cccc(COCC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000090806471 1032596710 /nfs/dbraw/zinc/59/67/10/1032596710.db2.gz BQDHJNHQLPMIRZ-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO CO[C@@](C)(C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000449483165 1032635658 /nfs/dbraw/zinc/63/56/58/1032635658.db2.gz GVEIBNBAKOXNGG-BEFAXECRSA-N 1 0 328.412 3.677 20 5 EHBDRO COC(=O)c1cc([N+](=O)[O-])cc(-c2ccc(C[NH+](C)C)c(F)c2)c1C ZINC000592986392 1032658939 /nfs/dbraw/zinc/65/89/39/1032658939.db2.gz HCRFWMHNQAVTRO-UHFFFAOYSA-N 1 0 346.358 3.558 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000472649753 1017202252 /nfs/dbraw/zinc/20/22/52/1017202252.db2.gz VEJONHNFBAZHSC-IMJJTQAJSA-N 1 0 348.472 3.805 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccccc2)CC1 ZINC000537419567 1032700304 /nfs/dbraw/zinc/70/03/04/1032700304.db2.gz CSIJEFDQLFSAJL-CQSZACIVSA-N 1 0 339.395 3.591 20 5 EHBDRO CC(C)(CCc1ccccc1)[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000177186653 1017593691 /nfs/dbraw/zinc/59/36/91/1017593691.db2.gz ONPXLGQIICVFBJ-UHFFFAOYSA-N 1 0 341.411 3.534 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000290297479 1017898084 /nfs/dbraw/zinc/89/80/84/1017898084.db2.gz NICKZGQAEJBJRQ-CKFHNAJUSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1ccnc(NCC2CC[NH+](Cc3ccccc3)CC2)c1[N+](=O)[O-] ZINC000360279030 1018071240 /nfs/dbraw/zinc/07/12/40/1018071240.db2.gz MVNPDLGPMZKXFN-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1nn(C[N@@H+]2CCC[C@@H](c3ccccc3)CC2)c(C)c1[N+](=O)[O-] ZINC000066796075 1018174284 /nfs/dbraw/zinc/17/42/84/1018174284.db2.gz FTCDEIKYYZJRFQ-QGZVFWFLSA-N 1 0 328.416 3.635 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc(OC)cc1 ZINC000341065892 1018407336 /nfs/dbraw/zinc/40/73/36/1018407336.db2.gz VKUZGRDBGNLKTG-GOSISDBHSA-N 1 0 330.384 3.723 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)N(CCC[NH3+])CC1CCCC1 ZINC000415762268 1018491731 /nfs/dbraw/zinc/49/17/31/1018491731.db2.gz MMNGZCIFHSXLFI-UHFFFAOYSA-N 1 0 348.447 3.530 20 5 EHBDRO COc1ccc(CC[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)cc1F ZINC000468632094 1018564928 /nfs/dbraw/zinc/56/49/28/1018564928.db2.gz VQOAMACTOGWODZ-UVTDQMKNSA-N 1 0 344.386 3.978 20 5 EHBDRO COc1cccc([N+](=O)[O-])c1NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000580242723 1018845933 /nfs/dbraw/zinc/84/59/33/1018845933.db2.gz OFDIAYQIXQXMHN-AWEZNQCLSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190852 1018988866 /nfs/dbraw/zinc/98/88/66/1018988866.db2.gz MNHFIYNNJLNKRB-QFBILLFUSA-N 1 0 339.439 3.595 20 5 EHBDRO C[C@@H](NC(=O)c1cc2cc([N+](=O)[O-])ccc2s1)C(C)(C)C[NH+](C)C ZINC000175802153 1019005868 /nfs/dbraw/zinc/00/58/68/1019005868.db2.gz RSOZSPPAXMJEKD-LLVKDONJSA-N 1 0 349.456 3.516 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610420389 1019008211 /nfs/dbraw/zinc/00/82/11/1019008211.db2.gz FMJCYKJSXTZWAZ-HOTGVXAUSA-N 1 0 325.412 3.772 20 5 EHBDRO CCn1ccnc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449562768 1032810266 /nfs/dbraw/zinc/81/02/66/1032810266.db2.gz NXKZAYSKBLCKSC-ZMSDIMECSA-N 1 0 342.443 3.873 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)C[C@H]1CNc1ccc([N+](=O)[O-])cc1F ZINC000708556406 1032819538 /nfs/dbraw/zinc/81/95/38/1032819538.db2.gz NVGITNDEMYXRMG-GOEBONIOSA-N 1 0 343.402 3.914 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000120656253 1019303412 /nfs/dbraw/zinc/30/34/12/1019303412.db2.gz XTXOYRZPGWPVOB-CQSZACIVSA-N 1 0 338.411 3.912 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)cc1 ZINC000182345462 1019456559 /nfs/dbraw/zinc/45/65/59/1019456559.db2.gz NZPIHVYVCZBBOD-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)[C@H]1[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC12CC=CC2 ZINC000592446791 1032834842 /nfs/dbraw/zinc/83/48/42/1032834842.db2.gz ZKGBVFXRNPFDMG-GOSISDBHSA-N 1 0 343.427 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@@H+]2C2CC2)c2ncccc12 ZINC000433809157 1019634454 /nfs/dbraw/zinc/63/44/54/1019634454.db2.gz IEMMBBMKPRKZGA-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440161 1032849370 /nfs/dbraw/zinc/84/93/70/1032849370.db2.gz AIJXJZIAWXBZLI-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000068836505 1019917896 /nfs/dbraw/zinc/91/78/96/1019917896.db2.gz PMGTTWMIHKBRTG-GOSISDBHSA-N 1 0 341.411 3.852 20 5 EHBDRO CCc1ncc(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000449608820 1032874509 /nfs/dbraw/zinc/87/45/09/1032874509.db2.gz KJYUADHZLBLXGR-XJKSGUPXSA-N 1 0 329.400 3.646 20 5 EHBDRO CC[C@@H](CO)[NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000237005549 1020591728 /nfs/dbraw/zinc/59/17/28/1020591728.db2.gz LVKDISHKAWRZAJ-HNNXBMFYSA-N 1 0 346.452 3.915 20 5 EHBDRO CC(C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000501006127 1020643117 /nfs/dbraw/zinc/64/31/17/1020643117.db2.gz FPUFUTJCCOBQNX-UHFFFAOYSA-N 1 0 333.432 3.967 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)CNc1ncc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000413117165 1020700744 /nfs/dbraw/zinc/70/07/44/1020700744.db2.gz IMFPPPKNNHNPQJ-GFCCVEGCSA-N 1 0 332.379 3.670 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510403171 1020768354 /nfs/dbraw/zinc/76/83/54/1020768354.db2.gz UDIOURXSBPUGRQ-KDOFPFPSSA-N 1 0 336.395 3.953 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CC1(CCO)CCCCC1)C1CC1 ZINC000165604613 1020778087 /nfs/dbraw/zinc/77/80/87/1020778087.db2.gz RWOPHBVWXBZNKU-GOSISDBHSA-N 1 0 346.471 3.838 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCN(c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000426289916 1021196643 /nfs/dbraw/zinc/19/66/43/1021196643.db2.gz NSCVCXLRLBNMJK-HUUCEWRRSA-N 1 0 343.402 3.972 20 5 EHBDRO Cc1cnc(N2CCC(CC[N@H+]3CCCC[C@@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000477169455 1021220519 /nfs/dbraw/zinc/22/05/19/1021220519.db2.gz JRBHEIVLXXTWDH-INIZCTEOSA-N 1 0 346.475 3.779 20 5 EHBDRO CC[C@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000439256661 1021299409 /nfs/dbraw/zinc/29/94/09/1021299409.db2.gz HUYSAMRJZWCPLI-IBGZPJMESA-N 1 0 346.402 3.897 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000322943098 1021476595 /nfs/dbraw/zinc/47/65/95/1021476595.db2.gz MUOVGBZQCTTXOG-VMGRFDJRSA-N 1 0 338.835 3.764 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2Cc3ccccc3N(C)C2)cccc1[N+](=O)[O-] ZINC000437080629 1021532553 /nfs/dbraw/zinc/53/25/53/1021532553.db2.gz UGFPQWMDSSMTDG-HZPDHXFCSA-N 1 0 339.439 3.863 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H]3CCC[C@H]32)c([N+](=O)[O-])cc1OC(F)F ZINC000426453584 1021624506 /nfs/dbraw/zinc/62/45/06/1021624506.db2.gz HQKURWMNINJHKO-ZYHUDNBSSA-N 1 0 342.342 3.579 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000602577342 1032996789 /nfs/dbraw/zinc/99/67/89/1032996789.db2.gz HKGUFJXFTNUBME-DDFAGTSDSA-N 1 0 332.322 3.659 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000510460228 1021668533 /nfs/dbraw/zinc/66/85/33/1021668533.db2.gz WIEMZZUXFZYIKD-XTFWMQFUSA-N 1 0 343.471 3.945 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c1 ZINC000090910081 1021688966 /nfs/dbraw/zinc/68/89/66/1021688966.db2.gz CVDYBCLHXPIPCW-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](CCO)C3CCC3)s2)cc1 ZINC000439777729 1021702813 /nfs/dbraw/zinc/70/28/13/1021702813.db2.gz BXHKJSIZWAPSFZ-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO C[N@@H+]1C[C@H]2C[C@@H](C1)N(C(=O)c1cccc3cc4ccccc4cc31)C2 ZINC001270532020 1021714332 /nfs/dbraw/zinc/71/43/32/1021714332.db2.gz VTKKYBOYPSUNBB-BEFAXECRSA-N 1 0 330.431 3.769 20 5 EHBDRO COc1ccc([C@@H](OC)[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602583749 1033004536 /nfs/dbraw/zinc/00/45/36/1033004536.db2.gz SJSNCDYUZHHKAK-LIRRHRJNSA-N 1 0 344.411 3.512 20 5 EHBDRO Cc1ccc(C)n1C1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000337683873 1021861707 /nfs/dbraw/zinc/86/17/07/1021861707.db2.gz OVZXATZZJVXRHN-UHFFFAOYSA-N 1 0 343.427 3.729 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000178205650 1022141059 /nfs/dbraw/zinc/14/10/59/1022141059.db2.gz BUPCDQVQJGKZEH-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](O)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000543416598 1022143964 /nfs/dbraw/zinc/14/39/64/1022143964.db2.gz PORGCHPBPDBBLC-RDJZCZTQSA-N 1 0 328.412 3.548 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000441353160 1022171107 /nfs/dbraw/zinc/17/11/07/1022171107.db2.gz GKKYYPSNKGKUJH-HNNXBMFYSA-N 1 0 325.840 3.554 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000441386258 1022205269 /nfs/dbraw/zinc/20/52/69/1022205269.db2.gz UJSBQYMMADZMEE-LJQANCHMSA-N 1 0 346.427 3.805 20 5 EHBDRO COc1ccc(OCC[NH+]2CCC3(CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000441396219 1022212419 /nfs/dbraw/zinc/21/24/19/1022212419.db2.gz BXBVRIOFXURZDU-UHFFFAOYSA-N 1 0 334.416 3.638 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000341542790 1022220292 /nfs/dbraw/zinc/22/02/92/1022220292.db2.gz FFARSGHQFQPSPP-GFCCVEGCSA-N 1 0 349.460 3.666 20 5 EHBDRO CCC[C@H]([NH2+][C@H](CO)Cc1ccc(C)cc1)c1cccc([N+](=O)[O-])c1 ZINC000467419042 1022257623 /nfs/dbraw/zinc/25/76/23/1022257623.db2.gz MMVZFCDTYPYKQE-ICSRJNTNSA-N 1 0 342.439 3.938 20 5 EHBDRO C[C@@]1(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)C[C@H]1c1ccccc1 ZINC000602638069 1033050257 /nfs/dbraw/zinc/05/02/57/1033050257.db2.gz BSJIRHMVXIDKOP-HKUYNNGSSA-N 1 0 340.427 3.622 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1)c1cccc(O)c1 ZINC000126657561 1022388334 /nfs/dbraw/zinc/38/83/34/1022388334.db2.gz BHKAXBSZIVPEOO-CQSZACIVSA-N 1 0 341.411 3.620 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1CCCSC1 ZINC000602661319 1033058973 /nfs/dbraw/zinc/05/89/73/1033058973.db2.gz CXKLNPQKXJCWQG-JTQLQIEISA-N 1 0 334.363 3.846 20 5 EHBDRO COc1ccccc1C[C@H](C)[N@H+](C)CCOc1ccccc1[N+](=O)[O-] ZINC000441427410 1022532260 /nfs/dbraw/zinc/53/22/60/1022532260.db2.gz GTCFVGNKSXSCRP-HNNXBMFYSA-N 1 0 344.411 3.545 20 5 EHBDRO CCS[C@H]1CC[C@H]([N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226108 1022587259 /nfs/dbraw/zinc/58/72/59/1022587259.db2.gz WFRQDXZGIGODBT-STQMWFEESA-N 1 0 342.436 3.849 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000430819337 1022723737 /nfs/dbraw/zinc/72/37/37/1022723737.db2.gz BJFMVZSJXAONIX-QAPCUYQASA-N 1 0 347.459 3.534 20 5 EHBDRO Cn1ncc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C1CC1 ZINC000894720598 1022792996 /nfs/dbraw/zinc/79/29/96/1022792996.db2.gz WKFBELZSPMPLEY-INIZCTEOSA-N 1 0 340.427 3.585 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H](C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000438541928 1022795843 /nfs/dbraw/zinc/79/58/43/1022795843.db2.gz RZRCXGISBNDTCE-ZYHUDNBSSA-N 1 0 344.358 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCO[C@@H]3C3CC3)s2)cc1 ZINC000536339174 1022900938 /nfs/dbraw/zinc/90/09/38/1022900938.db2.gz ZMGUFBNMRGCZHY-FUHWJXTLSA-N 1 0 344.436 3.980 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000506420899 1023101901 /nfs/dbraw/zinc/10/19/01/1023101901.db2.gz HKMSYBIOGUFCIA-HNNXBMFYSA-N 1 0 343.427 3.771 20 5 EHBDRO Cc1ccccc1[C@@H]1CC[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000507185288 1023170156 /nfs/dbraw/zinc/17/01/56/1023170156.db2.gz WOXCPBXOSKVRPM-MRXNPFEDSA-N 1 0 326.396 3.772 20 5 EHBDRO CCOc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)nc1 ZINC000610675405 1023172852 /nfs/dbraw/zinc/17/28/52/1023172852.db2.gz MYMAJYCAQNJEJO-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH+]3CCC4(CCSCC4)CC3)nc2c1 ZINC000602734315 1033124627 /nfs/dbraw/zinc/12/46/27/1033124627.db2.gz GKDZOBISRDKOCB-UHFFFAOYSA-N 1 0 347.440 3.845 20 5 EHBDRO CCc1ccc([C@@H]2CCCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)o1 ZINC000176259661 1023944710 /nfs/dbraw/zinc/94/47/10/1023944710.db2.gz WJVMGTDWXNOLEJ-HNNXBMFYSA-N 1 0 332.404 3.564 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+]Cc3ccc(-c4cccc([N+](=O)[O-])c4)o3)C2)CO1 ZINC000897781158 1033175256 /nfs/dbraw/zinc/17/52/56/1033175256.db2.gz RDVLHKFZIJJJMK-VZDIAYEVSA-N 1 0 342.395 3.902 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCC[C@@H](C)C1 ZINC000449769107 1033184807 /nfs/dbraw/zinc/18/48/07/1033184807.db2.gz UKYAOSKGIQBICY-HZSPNIEDSA-N 1 0 334.416 3.766 20 5 EHBDRO CC1=NO[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000895312173 1024271219 /nfs/dbraw/zinc/27/12/19/1024271219.db2.gz VDBVZNGLUGGZAV-ZDUSSCGKSA-N 1 0 349.774 3.763 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000119475682 1024298129 /nfs/dbraw/zinc/29/81/29/1024298129.db2.gz JLWZGJKDJNFVGR-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H](C)C1 ZINC000119475423 1024299247 /nfs/dbraw/zinc/29/92/47/1024299247.db2.gz JLWZGJKDJNFVGR-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CC[C@@H](C)C[C@@H](C)C1 ZINC000443663764 1024364457 /nfs/dbraw/zinc/36/44/57/1024364457.db2.gz YVLVVXCRERNYMZ-ZIAGYGMSSA-N 1 0 333.432 3.600 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@@H](C)C1 ZINC000430112700 1024380422 /nfs/dbraw/zinc/38/04/22/1024380422.db2.gz DZMVXDRVKUWYJT-HTHKKOALSA-N 1 0 343.471 3.660 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857294 1033210910 /nfs/dbraw/zinc/21/09/10/1033210910.db2.gz UGKWJRSKOPWQEH-QGZVFWFLSA-N 1 0 341.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000342293443 1024740030 /nfs/dbraw/zinc/74/00/30/1024740030.db2.gz GLMLJIDRUSTZEU-NJELEJDNSA-N 1 0 346.814 3.975 20 5 EHBDRO C[C@@H]([NH2+]CC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000187717014 1024753992 /nfs/dbraw/zinc/75/39/92/1024753992.db2.gz OEUQIXTYRCODQO-GFCCVEGCSA-N 1 0 345.365 3.520 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H]([C@@H]2CCCO2)C1 ZINC000895844052 1024891531 /nfs/dbraw/zinc/89/15/31/1024891531.db2.gz LOBOKPPTPOVYLV-WFASDCNBSA-N 1 0 344.333 3.615 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CCc4cccc5cccc3c54)C2)c1 ZINC000895935112 1024992431 /nfs/dbraw/zinc/99/24/31/1024992431.db2.gz OICTXRJLNAXUMB-RJYAGPCLSA-N 1 0 348.406 3.925 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@H](C3CC3)C2)cc1[N+](=O)[O-] ZINC000157714331 1025081624 /nfs/dbraw/zinc/08/16/24/1025081624.db2.gz FLPBSXYHGHUNQB-DWQUBVKVSA-N 1 0 334.416 3.602 20 5 EHBDRO Cc1ccnc([C@H]2CC[N@H+](Cc3ccc(Cl)cc3[N+](=O)[O-])C2)c1 ZINC000521063260 1025192463 /nfs/dbraw/zinc/19/24/63/1025192463.db2.gz NTXOIVBDEVOQGU-ZDUSSCGKSA-N 1 0 331.803 3.941 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435994649 1025281455 /nfs/dbraw/zinc/28/14/55/1025281455.db2.gz OTUUPMSRXARGMS-CABCVRRESA-N 1 0 325.412 3.554 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000442807783 1025485096 /nfs/dbraw/zinc/48/50/96/1025485096.db2.gz FQBZTOVTQMRKOZ-WMEZAQDKSA-N 1 0 332.444 3.853 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000934334245 1025505807 /nfs/dbraw/zinc/50/58/07/1025505807.db2.gz UIYFFZSXAPYMGB-UONOGXRCSA-N 1 0 331.441 3.985 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436274933 1025546725 /nfs/dbraw/zinc/54/67/25/1025546725.db2.gz NQMHOHYWMHXWAS-UHFFFAOYSA-N 1 0 346.353 3.541 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])ccc1F ZINC000451166624 1025627655 /nfs/dbraw/zinc/62/76/55/1025627655.db2.gz XRTDMUSZZCSFQZ-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN1CC[C@@H](O)[C@H]1c1ccc(Cl)cc1 ZINC000425546126 1025717424 /nfs/dbraw/zinc/71/74/24/1025717424.db2.gz GSGIUTLQYSQFTQ-IAGOWNOFSA-N 1 0 332.787 3.556 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000358092632 1025943969 /nfs/dbraw/zinc/94/39/69/1025943969.db2.gz WOHOHIADDQOPPO-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@@H](CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C[NH+]1CCCC1 ZINC000516073908 1025951086 /nfs/dbraw/zinc/95/10/86/1025951086.db2.gz FLROKKYAUOMTCZ-SWLSCSKDSA-N 1 0 345.365 3.520 20 5 EHBDRO CCOc1cc(N2CCC[C@@H]2c2nc(C)c(C)[nH]2)ccc1[N+](=O)[O-] ZINC000895192172 1026083379 /nfs/dbraw/zinc/08/33/79/1026083379.db2.gz FXYDCKIBNCZOCM-OAHLLOKOSA-N 1 0 330.388 3.675 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc(F)cc2N(C)C)cccc1[N+](=O)[O-] ZINC000478497195 1026140686 /nfs/dbraw/zinc/14/06/86/1026140686.db2.gz ZPWJHMQGMDWMGM-CYBMUJFWSA-N 1 0 331.391 3.959 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CCCc1cccnc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840775540 1026148052 /nfs/dbraw/zinc/14/80/52/1026148052.db2.gz QGPSJWAUCZXWGE-UONOGXRCSA-N 1 0 328.416 3.634 20 5 EHBDRO CC[C@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000475127548 1026221955 /nfs/dbraw/zinc/22/19/55/1026221955.db2.gz IXGDLWOALZFNEE-GOSISDBHSA-N 1 0 330.384 3.592 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000475141484 1026234658 /nfs/dbraw/zinc/23/46/58/1026234658.db2.gz WCQGTNDXSBZOFG-YRVHBARZSA-N 1 0 340.423 3.798 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCCC[C@@H]1C ZINC000530855960 1026355271 /nfs/dbraw/zinc/35/52/71/1026355271.db2.gz XNTOVWNKPHESMM-UONOGXRCSA-N 1 0 328.416 3.818 20 5 EHBDRO CC(C)c1ccc(CN2CCC([NH+]3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000127737987 1026391989 /nfs/dbraw/zinc/39/19/89/1026391989.db2.gz HSTXJTKHKZRAHW-UHFFFAOYSA-N 1 0 331.460 3.778 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)n1 ZINC000611616117 1026532011 /nfs/dbraw/zinc/53/20/11/1026532011.db2.gz PUZOGMYMBRBXCM-KRWDZBQOSA-N 1 0 346.475 3.555 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1ccc(F)cc1 ZINC000065596729 1026917040 /nfs/dbraw/zinc/91/70/40/1026917040.db2.gz MVSQGLRAISKOAW-UHFFFAOYSA-N 1 0 332.375 3.677 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H](Nc1cnn(-c2cc[nH+]cc2)c1)C1CC1 ZINC000611480837 1027015809 /nfs/dbraw/zinc/01/58/09/1027015809.db2.gz GFLYEJPVZIWEHV-GOSISDBHSA-N 1 0 349.394 3.609 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](CO)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000531696813 1027217348 /nfs/dbraw/zinc/21/73/48/1027217348.db2.gz GWFGURLWGGXKER-HOCLYGCPSA-N 1 0 346.402 3.544 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000076581346 1027302972 /nfs/dbraw/zinc/30/29/72/1027302972.db2.gz WZKGOKUTIVNQFF-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1C[C@@H](c2cccc(F)c2)[C@H]([NH3+])C1 ZINC000420381473 1027502362 /nfs/dbraw/zinc/50/23/62/1027502362.db2.gz CVBBMYXUNSXZKC-ZNZDAUKMSA-N 1 0 343.402 3.530 20 5 EHBDRO Cc1c(C[NH2+][C@H]2C[C@H](C)N(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663385 1027580070 /nfs/dbraw/zinc/58/00/70/1027580070.db2.gz FKFXORYIULODQB-KXBFYZLASA-N 1 0 339.439 3.656 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N[C@@H](C)C[NH+]1CCCCCC1 ZINC000475575013 1027682086 /nfs/dbraw/zinc/68/20/86/1027682086.db2.gz YPKXFYHGJLCIKC-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN2CCCC[C@H]12 ZINC000513784979 1027704576 /nfs/dbraw/zinc/70/45/76/1027704576.db2.gz COOFMJXOOVPDLL-WOGUSJMUSA-N 1 0 343.471 3.522 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CN(C)Cc3ccccc32)cc1[N+](=O)[O-] ZINC000366690871 1027742728 /nfs/dbraw/zinc/74/27/28/1027742728.db2.gz BDGZKTYHLCPECG-KBXCAEBGSA-N 1 0 325.412 3.741 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435391 1027873466 /nfs/dbraw/zinc/87/34/66/1027873466.db2.gz WJKGYXCQRINMJF-LSDHHAIUSA-N 1 0 333.432 3.742 20 5 EHBDRO COCCC(C)(C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000546054990 1027962020 /nfs/dbraw/zinc/96/20/20/1027962020.db2.gz CFORIZVIKJQVOR-UHFFFAOYSA-N 1 0 335.429 3.623 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000523332953 1028180807 /nfs/dbraw/zinc/18/08/07/1028180807.db2.gz VHCRJFHGPLOASP-INIZCTEOSA-N 1 0 347.462 3.848 20 5 EHBDRO Cc1cccc(C)c1[C@@H](C)[NH2+][C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000546225918 1028365212 /nfs/dbraw/zinc/36/52/12/1028365212.db2.gz SBMQXEJLMYSIHE-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@]1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC[NH2+]C1 ZINC000423338929 1028373956 /nfs/dbraw/zinc/37/39/56/1028373956.db2.gz LFFWKPYINQUKJN-UXHICEINSA-N 1 0 339.439 3.664 20 5 EHBDRO CC(C)c1nc(CC[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cs1 ZINC000582974697 1028418353 /nfs/dbraw/zinc/41/83/53/1028418353.db2.gz GUZSGZABJCCWKY-HNNXBMFYSA-N 1 0 331.441 3.994 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(O)CCC1 ZINC000546255807 1028425376 /nfs/dbraw/zinc/42/53/76/1028425376.db2.gz AAOQJQYLAPQYLJ-UHFFFAOYSA-N 1 0 332.425 3.670 20 5 EHBDRO COCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000523702111 1028555650 /nfs/dbraw/zinc/55/56/50/1028555650.db2.gz FERTZQIZYRXNEQ-MRXNPFEDSA-N 1 0 328.412 3.847 20 5 EHBDRO COc1ccc(C[NH2+]CC(C)C)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000237236880 1028558337 /nfs/dbraw/zinc/55/83/37/1028558337.db2.gz IPTPKEDLDWZNAI-UHFFFAOYSA-N 1 0 344.411 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc(C(F)F)cc3)C2)nc1 ZINC000183968687 1028589459 /nfs/dbraw/zinc/58/94/59/1028589459.db2.gz ZJHBSVBAMYGEFM-AWEZNQCLSA-N 1 0 348.353 3.614 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H](CO)c1ccccc1 ZINC000130208784 1028778192 /nfs/dbraw/zinc/77/81/92/1028778192.db2.gz QVVRQNNWCZEGAY-QXAKKESOSA-N 1 0 340.423 3.629 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000237490436 1028843597 /nfs/dbraw/zinc/84/35/97/1028843597.db2.gz VVZZEJIKQGNTTH-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO Cc1c([C@H](C)[N@@H+]2CCC[C@@H](CC(C)(C)C(N)=O)C2)cccc1[N+](=O)[O-] ZINC000296407322 1028924854 /nfs/dbraw/zinc/92/48/54/1028924854.db2.gz KSQCGCUWOVRWQC-GJZGRUSLSA-N 1 0 347.459 3.578 20 5 EHBDRO CC[NH+](CC)CCN(CCC(F)(F)F)c1ccccc1[N+](=O)[O-] ZINC000532853345 1028936724 /nfs/dbraw/zinc/93/67/24/1028936724.db2.gz DODORMGNKKFVES-UHFFFAOYSA-N 1 0 333.354 3.695 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@@]2(F)c2ccccc2)n1 ZINC000424333964 1028982957 /nfs/dbraw/zinc/98/29/57/1028982957.db2.gz YCQYQWIRDJHKLF-UIBIWLFHSA-N 1 0 344.390 3.502 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)CC(C)(C)C ZINC000504894965 1029039363 /nfs/dbraw/zinc/03/93/63/1029039363.db2.gz PMBYNFDDXYRCPV-UONOGXRCSA-N 1 0 340.489 3.852 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504906415 1029050908 /nfs/dbraw/zinc/05/09/08/1029050908.db2.gz XSFHVCQTHSZNNN-JYJNAYRXSA-N 1 0 349.475 3.765 20 5 EHBDRO COc1ccc(Cl)cc1C[N@H+](C)CCc1ccc([N+](=O)[O-])cc1 ZINC000524426353 1029181758 /nfs/dbraw/zinc/18/17/58/1029181758.db2.gz KXWUUMVWUQXZNL-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO COc1ccc(OCC[N@H+](C)C2CCC(C)(C)CC2)c([N+](=O)[O-])c1 ZINC001167658469 1029191553 /nfs/dbraw/zinc/19/15/53/1029191553.db2.gz HWFOKUMXNAOKGV-UHFFFAOYSA-N 1 0 336.432 3.883 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCCC3(CCCC3)C2)cccc1[N+](=O)[O-] ZINC000445871368 1029202361 /nfs/dbraw/zinc/20/23/61/1029202361.db2.gz KWGMEUHSWZNVTM-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288262 1029582204 /nfs/dbraw/zinc/58/22/04/1029582204.db2.gz WUFPQVPSYZPABD-TZMCWYRMSA-N 1 0 333.432 3.741 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CC[C@H](c4ccccc4)C3)nc2c1 ZINC000446843948 1029824829 /nfs/dbraw/zinc/82/48/29/1029824829.db2.gz CZQQWEVGXWGGLT-GJZGRUSLSA-N 1 0 336.395 3.897 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c(Br)cc1[N+](=O)[O-] ZINC000235689451 1029831070 /nfs/dbraw/zinc/83/10/70/1029831070.db2.gz FAUQPZUEACTAGG-WDEREUQCSA-N 1 0 342.237 3.560 20 5 EHBDRO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2ccccc2[N+](=O)[O-])C1 ZINC000531868641 1029942796 /nfs/dbraw/zinc/94/27/96/1029942796.db2.gz SESRZOQVTBCNDA-CQSZACIVSA-N 1 0 334.416 3.539 20 5 EHBDRO C[NH+]1CCC(C)(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000324502573 1030028796 /nfs/dbraw/zinc/02/87/96/1030028796.db2.gz LMBHLZKIBCBJRF-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc2c(c1)OCO2)c1cccc([N+](=O)[O-])c1 ZINC000531944476 1030064990 /nfs/dbraw/zinc/06/49/90/1030064990.db2.gz SHBGRMNTOMCRLV-INIZCTEOSA-N 1 0 328.368 3.607 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@H](C)CC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453309404 1030080161 /nfs/dbraw/zinc/08/01/61/1030080161.db2.gz DUXWJMBWUJKUBT-ACJLOTCBSA-N 1 0 346.427 3.979 20 5 EHBDRO Cc1noc([C@@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000245529479 1030120183 /nfs/dbraw/zinc/12/01/83/1030120183.db2.gz RLFWDKNBSQVDCM-GXTWGEPZSA-N 1 0 330.388 3.535 20 5 EHBDRO COc1ccc(CC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000441271834 1030212001 /nfs/dbraw/zinc/21/20/01/1030212001.db2.gz YWTDFSYWNXZVGZ-UHFFFAOYSA-N 1 0 326.396 3.811 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000453410614 1030221807 /nfs/dbraw/zinc/22/18/07/1030221807.db2.gz PYLWBFGBPQFZMJ-UXIGCNINSA-N 1 0 332.425 3.887 20 5 EHBDRO CO[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447559613 1030302531 /nfs/dbraw/zinc/30/25/31/1030302531.db2.gz AEQFEGGEJQQCTL-OALUTQOASA-N 1 0 326.396 3.950 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CC1CCCC1 ZINC000064020993 1030394850 /nfs/dbraw/zinc/39/48/50/1030394850.db2.gz FDZYFZNTDBLJDT-GFCCVEGCSA-N 1 0 330.388 3.828 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000482445318 1030425149 /nfs/dbraw/zinc/42/51/49/1030425149.db2.gz JASZHMCRXFRUCJ-IBGZPJMESA-N 1 0 339.439 3.772 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1ccc2c(c1)OCO2 ZINC000532200099 1030472697 /nfs/dbraw/zinc/47/26/97/1030472697.db2.gz IBBICUCTQGKIKZ-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@H](C)[N@H+]2[C@H](C)CC[C@@H]2C)n1 ZINC000526954271 1030502747 /nfs/dbraw/zinc/50/27/47/1030502747.db2.gz DPUKKFPPBRUGII-XQQFMLRXSA-N 1 0 330.388 3.887 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000568107730 1030782078 /nfs/dbraw/zinc/78/20/78/1030782078.db2.gz WXWCNBORYZVMKW-GZBFAFLISA-N 1 0 326.343 3.722 20 5 EHBDRO COC(=O)C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)C1CCCCC1 ZINC000544420837 1030806255 /nfs/dbraw/zinc/80/62/55/1030806255.db2.gz DQNVEPWUFAOKCQ-MRXNPFEDSA-N 1 0 334.416 3.505 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@H]1CCC(C)(C)C1 ZINC000483101037 1030954396 /nfs/dbraw/zinc/95/43/96/1030954396.db2.gz OWRUPAWTHTURGU-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483246056 1031055462 /nfs/dbraw/zinc/05/54/62/1031055462.db2.gz RWIOYWUCQRFFFF-AWEZNQCLSA-N 1 0 333.432 3.600 20 5 EHBDRO CC[N@H+](CCc1cccs1)[C@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000343567909 1031415487 /nfs/dbraw/zinc/41/54/87/1031415487.db2.gz NUEGBVJTQPOUFB-CYBMUJFWSA-N 1 0 347.440 3.548 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)C(F)F)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000484468946 1031588463 /nfs/dbraw/zinc/58/84/63/1031588463.db2.gz BWONYPJNWXYMHT-SKDRFNHKSA-N 1 0 342.367 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCCCC34CC[NH2+]CC4)n2)cc1 ZINC000904080162 1031713190 /nfs/dbraw/zinc/71/31/90/1031713190.db2.gz XUBTXIKFZGZRPX-OAHLLOKOSA-N 1 0 342.399 3.672 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1noc([C@@H]2CC[C@H]3CCCC[C@@H]3[NH2+]2)n1 ZINC000904092978 1031741747 /nfs/dbraw/zinc/74/17/47/1031741747.db2.gz FVGYLUZJHAMCKA-KCXAZCMYSA-N 1 0 342.399 3.937 20 5 EHBDRO Cc1c(-c2noc([C@@H]3CC[C@H]4CCCC[C@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000904123206 1031760130 /nfs/dbraw/zinc/76/01/30/1031760130.db2.gz JCLNCDXCTZQWRS-YUELXQCFSA-N 1 0 342.399 3.937 20 5 EHBDRO CC[C@@H]([NH2+]CC[C@H](N(C)C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000926959793 1031979973 /nfs/dbraw/zinc/97/99/73/1031979973.db2.gz CWRSFOZZUPZUEL-KGLIPLIRSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](Cc3nccs3)C2)cc1Cl ZINC000898071742 1033324854 /nfs/dbraw/zinc/32/48/54/1033324854.db2.gz RNYMPCPEUXLUNI-GFCCVEGCSA-N 1 0 337.832 3.769 20 5 EHBDRO COc1ccccc1OCCC[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594495039 1033395169 /nfs/dbraw/zinc/39/51/69/1033395169.db2.gz NHLBGMCDBOKOIB-INIZCTEOSA-N 1 0 342.395 3.649 20 5 EHBDRO Cc1nc2ccccn2c1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000898275264 1033421660 /nfs/dbraw/zinc/42/16/60/1033421660.db2.gz ZOMURONCWQCQLA-AWEZNQCLSA-N 1 0 338.411 3.662 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN[C@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000611935372 1033440138 /nfs/dbraw/zinc/44/01/38/1033440138.db2.gz UMHINXNIGJJJFX-LJQANCHMSA-N 1 0 339.439 3.912 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCCO[C@@H]1C(C)C ZINC000595027544 1033648695 /nfs/dbraw/zinc/64/86/95/1033648695.db2.gz POLMXNIBWHSCIP-PMUMKWKESA-N 1 0 336.432 3.705 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000595046634 1033663326 /nfs/dbraw/zinc/66/33/26/1033663326.db2.gz LWBSDNQSYONQCE-HIFRSBDPSA-N 1 0 334.416 3.746 20 5 EHBDRO COCc1csc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000595075952 1033694429 /nfs/dbraw/zinc/69/44/29/1033694429.db2.gz CGSXPDWEEVFPKA-KRWDZBQOSA-N 1 0 332.425 3.970 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc3occc3c2)n1 ZINC000595075810 1033694657 /nfs/dbraw/zinc/69/46/57/1033694657.db2.gz YZXFZNLAQKAOTO-HOTGVXAUSA-N 1 0 340.383 3.811 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1cnn(C)c1 ZINC000595086692 1033698858 /nfs/dbraw/zinc/69/88/58/1033698858.db2.gz OFBJBPZCDDYDJV-ZSZQSSIHSA-N 1 0 342.443 3.699 20 5 EHBDRO CCC[C@H]([NH2+]CC1(O)CCC(F)(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000595093985 1033701524 /nfs/dbraw/zinc/70/15/24/1033701524.db2.gz RHBDRQHWFQVOGA-HNNXBMFYSA-N 1 0 342.386 3.966 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)OC)c1 ZINC000599060974 1033701725 /nfs/dbraw/zinc/70/17/25/1033701725.db2.gz ICONOWLMTAMBHD-UGSOOPFHSA-N 1 0 330.384 3.642 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@H]1CCN1C1CCCCC1 ZINC000599064273 1033702474 /nfs/dbraw/zinc/70/24/74/1033702474.db2.gz LXEGXCNRDGFZFE-QAPCUYQASA-N 1 0 329.444 3.579 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC000595304129 1033738594 /nfs/dbraw/zinc/73/85/94/1033738594.db2.gz NUUAWWUZWAIALO-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCCO2 ZINC000089513456 1033741874 /nfs/dbraw/zinc/74/18/74/1033741874.db2.gz VCUINMOLBDVKMS-KRWDZBQOSA-N 1 0 328.368 3.607 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCSc3ccccc32)c1[N+](=O)[O-] ZINC000892415217 1033754716 /nfs/dbraw/zinc/75/47/16/1033754716.db2.gz DHHLLUJZKLTVKJ-CYBMUJFWSA-N 1 0 346.408 3.636 20 5 EHBDRO CCN(Cc1c(F)cccc1[N+](=O)[O-])[C@H](COC)Cc1ccccc1 ZINC000472354638 1033807333 /nfs/dbraw/zinc/80/73/33/1033807333.db2.gz VDHLDGNPSYODML-INIZCTEOSA-N 1 0 346.402 3.814 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](CC[C@@H]3CCc4ccccc43)CC2)n1 ZINC000595484242 1033808127 /nfs/dbraw/zinc/80/81/27/1033808127.db2.gz YVTOMYGDHVIYTD-INIZCTEOSA-N 1 0 340.427 3.548 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000593721360 1033847553 /nfs/dbraw/zinc/84/75/53/1033847553.db2.gz HTONLBSJZHMMRX-QRQLOZEOSA-N 1 0 341.411 3.951 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2cccnc2[N+](=O)[O-])c2cccs2)CC1 ZINC000603839148 1033953649 /nfs/dbraw/zinc/95/36/49/1033953649.db2.gz YALBIQKYPHTVRO-HNNXBMFYSA-N 1 0 346.456 3.936 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@H]1CCCc2ccccc21 ZINC000603837174 1033962786 /nfs/dbraw/zinc/96/27/86/1033962786.db2.gz AJHYNQWJRCGOLA-KRWDZBQOSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])[N@@H+]1CCCC[C@H]1C ZINC000603853713 1033976932 /nfs/dbraw/zinc/97/69/32/1033976932.db2.gz KHPXTNFVBKJDLO-ZIAGYGMSSA-N 1 0 328.416 3.818 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595747222 1033980660 /nfs/dbraw/zinc/98/06/60/1033980660.db2.gz IHYFDYCGZWCNKI-ZAAXVRCTSA-N 1 0 340.423 3.754 20 5 EHBDRO C[C@H]1C[C@H](C)C[NH+](CCCNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000603859571 1033985803 /nfs/dbraw/zinc/98/58/03/1033985803.db2.gz CHFJCKHRSGXOMX-GJZGRUSLSA-N 1 0 342.443 3.923 20 5 EHBDRO CC(C)CC1([NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000595831689 1034014714 /nfs/dbraw/zinc/01/47/14/1034014714.db2.gz PLDJCPNIRNSLTJ-LLVKDONJSA-N 1 0 339.823 3.744 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)c(F)c1 ZINC000604012343 1034137950 /nfs/dbraw/zinc/13/79/50/1034137950.db2.gz YLCUENQSOOYYFV-UHFFFAOYSA-N 1 0 336.338 3.774 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000450349311 1034161889 /nfs/dbraw/zinc/16/18/89/1034161889.db2.gz UTMXCQDIMHGFSA-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2ccc(Cl)cc2)c1[N+](=O)[O-] ZINC000892431875 1034188478 /nfs/dbraw/zinc/18/84/78/1034188478.db2.gz YSOYDKAUMCPCOW-SNVBAGLBSA-N 1 0 336.775 3.813 20 5 EHBDRO Cc1ccc(NCC2CC[NH+](Cc3ccncc3)CC2)c([N+](=O)[O-])c1 ZINC000596441814 1034244173 /nfs/dbraw/zinc/24/41/73/1034244173.db2.gz RAFWSRIPFWBMGL-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1Cc2c[nH]nc2CC(C)(C)C1 ZINC000596596799 1034312360 /nfs/dbraw/zinc/31/23/60/1034312360.db2.gz FYHNXRIRSBHVBR-CYBMUJFWSA-N 1 0 328.416 3.772 20 5 EHBDRO Cc1c([C@@H](C)N[C@@H]2C[NH2+]CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000596647960 1034345869 /nfs/dbraw/zinc/34/58/69/1034345869.db2.gz DRSVVTVXLIDBSI-ATZDWAIDSA-N 1 0 339.439 3.700 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@H]2CCCn3nccc32)c2cc([N+](=O)[O-])ccc21 ZINC000601320381 1034451706 /nfs/dbraw/zinc/45/17/06/1034451706.db2.gz GDPSCIGVRYUYMV-HOTGVXAUSA-N 1 0 326.400 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC/C=C/c3ccccc3)C2)nc1 ZINC000450556367 1034520372 /nfs/dbraw/zinc/52/03/72/1034520372.db2.gz AVTHHOJQMCSCAH-IOMDMTNGSA-N 1 0 338.411 3.580 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600320 1034551049 /nfs/dbraw/zinc/55/10/49/1034551049.db2.gz NGSUKYRUVHZTSN-QRWLVFNGSA-N 1 0 340.423 3.724 20 5 EHBDRO C[C@@H]1C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@@H](C)C1O ZINC000597207650 1034591921 /nfs/dbraw/zinc/59/19/21/1034591921.db2.gz ZUQOUALIVUGADK-CHWSQXEVSA-N 1 0 346.452 3.772 20 5 EHBDRO C[C@@H](O)C1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000597233843 1034613026 /nfs/dbraw/zinc/61/30/26/1034613026.db2.gz AWPJQNJHRGUXBV-SNVBAGLBSA-N 1 0 336.775 3.511 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](c1ccccc1)[C@H](C)O ZINC000597249326 1034641231 /nfs/dbraw/zinc/64/12/31/1034641231.db2.gz QAVZZQKVXUXAJO-KWWMIRDASA-N 1 0 326.396 3.710 20 5 EHBDRO CC[C@H](C)C[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000171948229 1034730472 /nfs/dbraw/zinc/73/04/72/1034730472.db2.gz UADYPSSSQNFBNO-QWRGUYRKSA-N 1 0 327.812 3.553 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000411128054 1034796187 /nfs/dbraw/zinc/79/61/87/1034796187.db2.gz DEHZBRSGBVCJEW-AWEZNQCLSA-N 1 0 327.384 3.616 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNCc1ccc([N+](=O)[O-])cc1Cl ZINC000237505955 1034853302 /nfs/dbraw/zinc/85/33/02/1034853302.db2.gz VBXYIYBWMWBLBH-ZDUSSCGKSA-N 1 0 325.840 3.602 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC[C@H](C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612408349 1034890258 /nfs/dbraw/zinc/89/02/58/1034890258.db2.gz WXOBGLJJXKKGCJ-SCLBCKFNSA-N 1 0 332.400 3.854 20 5 EHBDRO CN(c1ccccc1)C1CCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000065956252 1035008967 /nfs/dbraw/zinc/00/89/67/1035008967.db2.gz WLZUONQRISHJAV-UHFFFAOYSA-N 1 0 331.441 3.757 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCO[C@H](c2ccccc2)C1 ZINC000612577377 1035072355 /nfs/dbraw/zinc/07/23/55/1035072355.db2.gz BZDOYKPCWPCTSW-IBGZPJMESA-N 1 0 326.396 3.867 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(Cl)nc1 ZINC000177628314 1035282535 /nfs/dbraw/zinc/28/25/35/1035282535.db2.gz TUWIKBQPZWUUBQ-UHFFFAOYSA-N 1 0 335.791 3.544 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H](O)c1ccccc1F ZINC000066434477 1035457725 /nfs/dbraw/zinc/45/77/25/1035457725.db2.gz ULCAZPCTBDPLJK-SFHVURJKSA-N 1 0 332.375 3.678 20 5 EHBDRO CN(C(=O)C[NH2+][C@@H]1CCCCC12CCCC2)c1ccc([N+](=O)[O-])cc1 ZINC000463449469 1035515703 /nfs/dbraw/zinc/51/57/03/1035515703.db2.gz PPDKAAYCWVNRCU-QGZVFWFLSA-N 1 0 345.443 3.650 20 5 EHBDRO Cc1c(CNCc2[nH+]c(C(C)C)n3ccccc23)cccc1[N+](=O)[O-] ZINC000581730453 1035536016 /nfs/dbraw/zinc/53/60/16/1035536016.db2.gz HZPGHNNULDVEFD-UHFFFAOYSA-N 1 0 338.411 3.964 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000463527852 1035586100 /nfs/dbraw/zinc/58/61/00/1035586100.db2.gz UGLBIQOEGGZCQJ-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(CNc3ccsc3[N+](=O)[O-])cc2)CC1 ZINC000588050468 1035681043 /nfs/dbraw/zinc/68/10/43/1035681043.db2.gz UJWZCNDCPNQNHJ-UHFFFAOYSA-N 1 0 347.440 3.741 20 5 EHBDRO Cc1nccn1CCC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000271997907 1035701278 /nfs/dbraw/zinc/70/12/78/1035701278.db2.gz HQUNPNDEVOSELN-UHFFFAOYSA-N 1 0 340.383 3.540 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000460347103 1035925880 /nfs/dbraw/zinc/92/58/80/1035925880.db2.gz IKFXEFGSWKAAAK-JKSUJKDBSA-N 1 0 344.415 3.949 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000460361950 1036036435 /nfs/dbraw/zinc/03/64/35/1036036435.db2.gz JCMTYGUMJAHMCV-HOTGVXAUSA-N 1 0 344.415 3.949 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@](C)(O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000156968568 1036114958 /nfs/dbraw/zinc/11/49/58/1036114958.db2.gz ILJVOLLIARSDEQ-DOTOQJQBSA-N 1 0 334.441 3.995 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)[C@@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000492814352 1036333675 /nfs/dbraw/zinc/33/36/75/1036333675.db2.gz AOFHCMASMMHQGR-BBRMVZONSA-N 1 0 342.395 3.648 20 5 EHBDRO CCCC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCC1 ZINC000541594111 1036478957 /nfs/dbraw/zinc/47/89/57/1036478957.db2.gz QAZWFMSPZWXOAG-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1C[C@H](C)CC[C@@H]1C(C)C ZINC000541614932 1036500960 /nfs/dbraw/zinc/50/09/60/1036500960.db2.gz VYBCEWCALQCCKE-FVQBIDKESA-N 1 0 347.459 3.892 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC([C@H]3CCCCO3)CC2)cc1 ZINC000595788405 1036639262 /nfs/dbraw/zinc/63/92/62/1036639262.db2.gz NHTZZAKHQPAASM-LJQANCHMSA-N 1 0 348.443 3.645 20 5 EHBDRO COc1ccc(CNc2cc(C(C)C)nc(C(C)C)n2)cc1[N+](=O)[O-] ZINC000535592254 1036695088 /nfs/dbraw/zinc/69/50/88/1036695088.db2.gz GHRYIOQQKFBDCK-UHFFFAOYSA-N 1 0 344.415 3.674 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@H]3F)o2)c([N+](=O)[O-])c1 ZINC000590196066 1036795049 /nfs/dbraw/zinc/79/50/49/1036795049.db2.gz AKEURVHZTJSYMZ-CABCVRRESA-N 1 0 334.347 3.844 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2cc(F)cc(F)c2)c(Cl)c1 ZINC000237709261 1036885890 /nfs/dbraw/zinc/88/58/90/1036885890.db2.gz YJDOGRUXNDWSKE-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO C[C@]1(CO)CCC[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237743945 1036901623 /nfs/dbraw/zinc/90/16/23/1036901623.db2.gz YKUBOZWVUIBTKS-QZTJIDSGSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCN(C2CCCCC2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000443079940 1036912076 /nfs/dbraw/zinc/91/20/76/1036912076.db2.gz POGBIIRXJQUZNM-KBXCAEBGSA-N 1 0 345.443 3.569 20 5 EHBDRO CCN(Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)Cc1ccccn1 ZINC000089909496 1036971800 /nfs/dbraw/zinc/97/18/00/1036971800.db2.gz BLXUGMUEOOZWDP-UHFFFAOYSA-N 1 0 338.367 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC=C(c3cccnc3)C2)cc1 ZINC000590741971 1037041011 /nfs/dbraw/zinc/04/10/11/1037041011.db2.gz QGXYGHUBDLBBPJ-UHFFFAOYSA-N 1 0 339.395 3.548 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccc2c(c1)OCCO2 ZINC000180639442 1037041851 /nfs/dbraw/zinc/04/18/51/1037041851.db2.gz WKGOQLKFZLDBFQ-INIZCTEOSA-N 1 0 342.395 3.915 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000163395943 1037097482 /nfs/dbraw/zinc/09/74/82/1037097482.db2.gz OIDDBNWMHYVZHX-WFASDCNBSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)N(C)C)cc1 ZINC000761520628 1037098645 /nfs/dbraw/zinc/09/86/45/1037098645.db2.gz CSRUJHROJRASIS-GOSISDBHSA-N 1 0 347.846 3.949 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cc(F)ccc2F)cc1[N+](=O)[O-] ZINC000271800017 1037313423 /nfs/dbraw/zinc/31/34/23/1037313423.db2.gz PESJYSWBMYYIKQ-APPDUMDISA-N 1 0 336.338 3.566 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCCN(CC(C)(C)C)C2=O)cc1[N+](=O)[O-] ZINC000460674035 1037362340 /nfs/dbraw/zinc/36/23/40/1037362340.db2.gz RJZMWUJXIRWDQV-ZBFHGGJFSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1ccnc(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311171154 1037536100 /nfs/dbraw/zinc/53/61/00/1037536100.db2.gz SUQSETMRCZAANT-QGZVFWFLSA-N 1 0 340.427 3.622 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCCC[C@H]1C ZINC000462925659 1037554313 /nfs/dbraw/zinc/55/43/13/1037554313.db2.gz CMUKFZHEYVCLEP-VXGBXAGGSA-N 1 0 343.374 3.871 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[N@@H+]1CCCC[C@H]1C ZINC000462925656 1037554463 /nfs/dbraw/zinc/55/44/63/1037554463.db2.gz CMUKFZHEYVCLEP-NEPJUHHUSA-N 1 0 343.374 3.871 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)CC1(CO)CC1 ZINC000188952645 1037575036 /nfs/dbraw/zinc/57/50/36/1037575036.db2.gz SGBWQGWDEWKOJU-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccncc2CC)ccc1[N+](=O)[O-] ZINC000491597675 1037578524 /nfs/dbraw/zinc/57/85/24/1037578524.db2.gz XZNGANVRGROYEY-ZDUSSCGKSA-N 1 0 329.400 3.802 20 5 EHBDRO CC(C)(C)C[C@H](CO)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540148120 1037604303 /nfs/dbraw/zinc/60/43/03/1037604303.db2.gz HGEWAIGDILBKCE-UAGQMJEPSA-N 1 0 334.460 3.693 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](CC)c2c(C)nn(C)c2C)ccc1[N+](=O)[O-] ZINC000491677906 1037616750 /nfs/dbraw/zinc/61/67/50/1037616750.db2.gz RENJVXMTTVTLNO-OAHLLOKOSA-N 1 0 346.431 3.585 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000030154309 1037632313 /nfs/dbraw/zinc/63/23/13/1037632313.db2.gz NVCZMMILDDLNQO-UHFFFAOYSA-N 1 0 339.439 3.611 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@@]2(CCSC2)C1 ZINC000540164174 1037650163 /nfs/dbraw/zinc/65/01/63/1037650163.db2.gz KFTIKCRJWJZAAZ-ZQIUZPCESA-N 1 0 336.457 3.609 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000325663272 1037740525 /nfs/dbraw/zinc/74/05/25/1037740525.db2.gz NLNCBEDKHLYLAM-KRWDZBQOSA-N 1 0 328.416 3.793 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2(CCO)CCC2)c2ccccc2)c1 ZINC000494030008 1037787940 /nfs/dbraw/zinc/78/79/40/1037787940.db2.gz SKRICZFRBVMTJG-IBGZPJMESA-N 1 0 340.423 3.827 20 5 EHBDRO CCCN(Cc1onc(C)c1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC000595297271 1037943455 /nfs/dbraw/zinc/94/34/55/1037943455.db2.gz QMPWLUMEGAMKFX-ZDUSSCGKSA-N 1 0 333.388 3.873 20 5 EHBDRO Cn1cc(C[NH2+]CC2CCC(F)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000592377510 1037949689 /nfs/dbraw/zinc/94/96/89/1037949689.db2.gz UCIZIKKVHCCYHB-UHFFFAOYSA-N 1 0 346.406 3.613 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC2)CC1 ZINC000378325676 1038465106 /nfs/dbraw/zinc/46/51/06/1038465106.db2.gz HCCQUONNWUIYPJ-LBPRGKRZSA-N 1 0 328.372 3.582 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC([NH+]2CCCC2)CC1 ZINC000470174504 1038468623 /nfs/dbraw/zinc/46/86/23/1038468623.db2.gz LKOIBKHNXXCDEU-DTQAZKPQSA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1cc(NCc2ccc(F)c(C[NH+](C)C)c2)c(F)cc1[N+](=O)[O-] ZINC000461935244 1038683994 /nfs/dbraw/zinc/68/39/94/1038683994.db2.gz JOMFIZWPMJVIQK-UHFFFAOYSA-N 1 0 335.354 3.855 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000479865983 1038840779 /nfs/dbraw/zinc/84/07/79/1038840779.db2.gz XJJAJVHHFMFDAE-VQIMIIECSA-N 1 0 341.455 3.727 20 5 EHBDRO CC1CC[NH+](CCCNc2ccc([N+](=O)[O-])c3cnccc23)CC1 ZINC000026761305 1038907917 /nfs/dbraw/zinc/90/79/17/1038907917.db2.gz DCMWWPCFNCYPJH-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](CO)CC2)s1 ZINC000552146503 1039023112 /nfs/dbraw/zinc/02/31/12/1039023112.db2.gz LHSAWLJQGQMDJW-AWEZNQCLSA-N 1 0 346.452 3.918 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480064999 1039090182 /nfs/dbraw/zinc/09/01/82/1039090182.db2.gz UFKWSYXMUUHXSA-CQSZACIVSA-N 1 0 333.432 3.577 20 5 EHBDRO COc1ccc(CN(Cc2cc([N+](=O)[O-])ccc2OC)C2CC2)cc1 ZINC000015309547 1039106791 /nfs/dbraw/zinc/10/67/91/1039106791.db2.gz KAOMDIJMIPFNLS-UHFFFAOYSA-N 1 0 342.395 3.777 20 5 EHBDRO CC(C)[C@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CS1 ZINC000488518032 1039253946 /nfs/dbraw/zinc/25/39/46/1039253946.db2.gz PLXXNMOXESPCHV-UKRRQHHQSA-N 1 0 328.865 3.910 20 5 EHBDRO C[C@@H]([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000485802498 1039577283 /nfs/dbraw/zinc/57/72/83/1039577283.db2.gz BBNOGVIGYCHWRV-GFCCVEGCSA-N 1 0 343.408 3.934 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)OCO3)CCCC2 ZINC000417295753 1039648614 /nfs/dbraw/zinc/64/86/14/1039648614.db2.gz FOGRARFEYWWHPF-QGZVFWFLSA-N 1 0 340.379 3.881 20 5 EHBDRO CCCC[NH+]1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436312809 1039648889 /nfs/dbraw/zinc/64/88/89/1039648889.db2.gz WDKCJFCLNPFBRT-UHFFFAOYSA-N 1 0 346.353 3.685 20 5 EHBDRO COc1ccncc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417353417 1039711602 /nfs/dbraw/zinc/71/16/02/1039711602.db2.gz XEUYLCXGNLCHLR-KRWDZBQOSA-N 1 0 327.384 3.556 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CC[C@@H](C[NH+]2CCCC2)C1 ZINC000553079429 1039762191 /nfs/dbraw/zinc/76/21/91/1039762191.db2.gz PNWMJDQXQSFLEM-NSHDSACASA-N 1 0 344.242 3.824 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@H](C)c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000074763920 1039800711 /nfs/dbraw/zinc/80/07/11/1039800711.db2.gz FATXOVGZJIHOMJ-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000486390273 1040103705 /nfs/dbraw/zinc/10/37/05/1040103705.db2.gz VASNSTUMXLSMFL-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H](Cc2ccccc2)CN(C)C)cccc1[N+](=O)[O-] ZINC000480884735 1040132188 /nfs/dbraw/zinc/13/21/88/1040132188.db2.gz UUZLWSGVTWUBHR-SJLPKXTDSA-N 1 0 341.455 3.727 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CCC1=CCCCC1 ZINC000500041166 1040365981 /nfs/dbraw/zinc/36/59/81/1040365981.db2.gz WOXWCOAKNWXFKF-AWEZNQCLSA-N 1 0 331.416 3.792 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H]2CCCCO2)c2ccccc2)c1 ZINC000490183782 1040371888 /nfs/dbraw/zinc/37/18/88/1040371888.db2.gz BNZLHRXEWBXDAR-RBUKOAKNSA-N 1 0 326.396 3.843 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481207351 1040490797 /nfs/dbraw/zinc/49/07/97/1040490797.db2.gz QDFFRUNFHANJFK-WCQYABFASA-N 1 0 339.823 3.745 20 5 EHBDRO COc1ccc(CSCC[N@H+](C)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000433033876 1040521082 /nfs/dbraw/zinc/52/10/82/1040521082.db2.gz QTIJNCYQMSXAAI-UHFFFAOYSA-N 1 0 346.452 3.969 20 5 EHBDRO CCOC(=O)CC(C)(C)CC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000553876175 1040554231 /nfs/dbraw/zinc/55/42/31/1040554231.db2.gz VJLRSRBVNBFGEA-AWEZNQCLSA-N 1 0 336.432 3.923 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555421847 1040559398 /nfs/dbraw/zinc/55/93/98/1040559398.db2.gz QXGNXCRVHQOQPW-ZDUSSCGKSA-N 1 0 334.338 3.500 20 5 EHBDRO CCOc1cc(NCc2ccc(F)c(C[NH+](C)C)c2)ccc1[N+](=O)[O-] ZINC000486925082 1040560091 /nfs/dbraw/zinc/56/00/91/1040560091.db2.gz FMRDHQXNVVVFSN-UHFFFAOYSA-N 1 0 347.390 3.806 20 5 EHBDRO C[C@@H]([C@@H]1Cc2ccccc2O1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593284 1040621700 /nfs/dbraw/zinc/62/17/00/1040621700.db2.gz VJJPCHYUCBINMU-SGTLLEGYSA-N 1 0 330.359 3.558 20 5 EHBDRO COCCCC[N@H+](C)Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000418131304 1040623030 /nfs/dbraw/zinc/62/30/30/1040623030.db2.gz HQEFWPXQDFWGAZ-UHFFFAOYSA-N 1 0 348.399 3.722 20 5 EHBDRO CC1(C)C[C@@H](N[C@@H]2CC[N@@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114677 1040764944 /nfs/dbraw/zinc/76/49/44/1040764944.db2.gz GTIKIRFAQFDIBV-AUUYWEPGSA-N 1 0 343.471 3.924 20 5 EHBDRO C[C@H](CO)[C@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000123266902 1040789680 /nfs/dbraw/zinc/78/96/80/1040789680.db2.gz LPXUHNSKPJQWKN-OLZOCXBDSA-N 1 0 348.374 3.633 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C2)cc1[N+](=O)[O-] ZINC000600198324 1040818870 /nfs/dbraw/zinc/81/88/70/1040818870.db2.gz WMOWPLBDTPRTQR-GDBMZVCRSA-N 1 0 348.443 3.703 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CCCC2(C)C)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000555638827 1040940999 /nfs/dbraw/zinc/94/09/99/1040940999.db2.gz HKDRCJOWQKNVGK-INIZCTEOSA-N 1 0 342.443 3.911 20 5 EHBDRO Cc1cnc(NC[C@H](c2ccco2)[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000078625302 1040974760 /nfs/dbraw/zinc/97/47/60/1040974760.db2.gz LHHUBKIHZJYZKS-OAHLLOKOSA-N 1 0 330.388 3.530 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2[nH]c(=O)oc2c1 ZINC000586791500 1041026134 /nfs/dbraw/zinc/02/61/34/1041026134.db2.gz PKAVCJAOUKCECH-QWRGUYRKSA-N 1 0 327.340 3.853 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCc3ccc([N+](=O)[O-])cc3)cccc21 ZINC000433203557 1041056818 /nfs/dbraw/zinc/05/68/18/1041056818.db2.gz CIEQVQKKKLUNLG-QGZVFWFLSA-N 1 0 327.384 3.592 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@H](C)C1 ZINC000481604704 1041145784 /nfs/dbraw/zinc/14/57/84/1041145784.db2.gz ZYHVPOVZUUZLIJ-RYUDHWBXSA-N 1 0 339.823 3.697 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000487974689 1041229760 /nfs/dbraw/zinc/22/97/60/1041229760.db2.gz LWQBAABSCOQNMK-UHFFFAOYSA-N 1 0 347.390 3.677 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@@H](N[C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000433282947 1041234208 /nfs/dbraw/zinc/23/42/08/1041234208.db2.gz NJYOOWYMVBWBLW-LBTNJELSSA-N 1 0 331.460 3.780 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C)C[C@H](C)c1ccccc1 ZINC000066854386 1041237859 /nfs/dbraw/zinc/23/78/59/1041237859.db2.gz KZQAWKQAQTVDBG-HNNXBMFYSA-N 1 0 341.411 3.577 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000181746204 1041901347 /nfs/dbraw/zinc/90/13/47/1041901347.db2.gz ZUUPPXMNVUSZPT-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO CC(C)[NH+]1CCC(NC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000044986119 1042020619 /nfs/dbraw/zinc/02/06/19/1042020619.db2.gz HANOTZFBUJNMSL-UHFFFAOYSA-N 1 0 347.462 3.991 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCS[C@@H](C)CC1 ZINC000249142571 1042533998 /nfs/dbraw/zinc/53/39/98/1042533998.db2.gz ZPILTHLLYYXTRN-NWDGAFQWSA-N 1 0 348.428 3.533 20 5 EHBDRO CN(CC1([NH+](C)C)CCC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000187021201 1042745487 /nfs/dbraw/zinc/74/54/87/1042745487.db2.gz BCVGPSPKEJUMNC-UHFFFAOYSA-N 1 0 347.462 3.944 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165434862 1042813843 /nfs/dbraw/zinc/81/38/43/1042813843.db2.gz SEUBGSDNDNVAGX-QWHCGFSZSA-N 1 0 342.399 3.806 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979138 1042829948 /nfs/dbraw/zinc/82/99/48/1042829948.db2.gz RUAGUVIYCFUGTI-CYBMUJFWSA-N 1 0 330.384 3.854 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432345681 1042980184 /nfs/dbraw/zinc/98/01/84/1042980184.db2.gz IBKJKWNUDXQFBY-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC2CC(O)C2)s1 ZINC000432353800 1042989434 /nfs/dbraw/zinc/98/94/34/1042989434.db2.gz PLLICXKKDYRWCZ-UHFFFAOYSA-N 1 0 332.425 3.574 20 5 EHBDRO C[N@H+](Cc1cc([N+](=O)[O-])cc2c1OCOC2)C(C)(C)c1ccccc1 ZINC000585754342 1043024334 /nfs/dbraw/zinc/02/43/34/1043024334.db2.gz IOBYMVNZEFMLSL-UHFFFAOYSA-N 1 0 342.395 3.828 20 5 EHBDRO COCCC[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000512297833 1044564061 /nfs/dbraw/zinc/56/40/61/1044564061.db2.gz AGGVEMSMDSQIMB-UHFFFAOYSA-N 1 0 348.374 3.995 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+]2CC=C(c3ccc(F)cc3)CC2)c1 ZINC000178568464 1044638245 /nfs/dbraw/zinc/63/82/45/1044638245.db2.gz BLYZQVSFFUZECA-IBGZPJMESA-N 1 0 342.370 3.557 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1(C(F)(F)F)CC1)C1CC1 ZINC000552099438 1127578178 /nfs/dbraw/zinc/57/81/78/1127578178.db2.gz IWPDLVDLKNEVPY-ZDUSSCGKSA-N 1 0 328.334 3.848 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)[N@H+](C)Cc1ccccc1 ZINC000301279156 1127626487 /nfs/dbraw/zinc/62/64/87/1127626487.db2.gz NGGIRIFVLRWJKD-GFCCVEGCSA-N 1 0 334.807 3.576 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000301377089 1127739926 /nfs/dbraw/zinc/73/99/26/1127739926.db2.gz RWBNDDOKOKARRZ-UHFFFAOYSA-N 1 0 343.374 3.871 20 5 EHBDRO COc1cc(NC[C@H]2CCC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000301410310 1127742978 /nfs/dbraw/zinc/74/29/78/1127742978.db2.gz XQFPFCBJHWJXEK-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C[S@@](C)=O)cc1 ZINC000552317877 1127749080 /nfs/dbraw/zinc/74/90/80/1127749080.db2.gz JWEQKVYLLIKZAQ-LFPIHBKWSA-N 1 0 346.452 3.633 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCc1ccc(CC(=O)OC)cc1 ZINC001168567581 1127833382 /nfs/dbraw/zinc/83/33/82/1127833382.db2.gz OQKIDPCDFKKARH-UHFFFAOYSA-N 1 0 341.475 3.611 20 5 EHBDRO COCCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000282156306 1127892785 /nfs/dbraw/zinc/89/27/85/1127892785.db2.gz DCXUEZYZURNWSP-SFHVURJKSA-N 1 0 332.375 3.991 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@H](C)[N@@H+]2CCc3sccc3C2)c1 ZINC000338644309 1127968566 /nfs/dbraw/zinc/96/85/66/1127968566.db2.gz FOAQLISWYSQFHP-LBPRGKRZSA-N 1 0 347.440 3.524 20 5 EHBDRO CC[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@H]1C ZINC001307703134 1128456275 /nfs/dbraw/zinc/45/62/75/1128456275.db2.gz OMQOOHXQGCZZCN-WDEREUQCSA-N 1 0 327.222 3.978 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428835 1128486265 /nfs/dbraw/zinc/48/62/65/1128486265.db2.gz OSHFTHORABYXHH-ZBFHGGJFSA-N 1 0 326.400 3.546 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000349428834 1128486459 /nfs/dbraw/zinc/48/64/59/1128486459.db2.gz OSHFTHORABYXHH-HOCLYGCPSA-N 1 0 326.400 3.546 20 5 EHBDRO C[C@@H]1C[NH+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@@H](C)O1 ZINC000301580725 1128500547 /nfs/dbraw/zinc/50/05/47/1128500547.db2.gz SHSZWXCDCQVXLW-CHWSQXEVSA-N 1 0 341.839 3.550 20 5 EHBDRO CC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)C1CCCC1 ZINC000153663248 1128574303 /nfs/dbraw/zinc/57/43/03/1128574303.db2.gz RXNONKXRNDGFOQ-UHFFFAOYSA-N 1 0 328.416 3.760 20 5 EHBDRO C[C@H](CCc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000554527702 1128644975 /nfs/dbraw/zinc/64/49/75/1128644975.db2.gz RVFSXLBIZNVWRB-OAHLLOKOSA-N 1 0 341.411 3.534 20 5 EHBDRO Cc1nc(NC[C@@H](c2ccco2)[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000301627424 1128761954 /nfs/dbraw/zinc/76/19/54/1128761954.db2.gz HSGXPWOQXIOTCE-HNNXBMFYSA-N 1 0 330.388 3.530 20 5 EHBDRO CN(C(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCC[N@H+](C)C1 ZINC000172659541 1128775024 /nfs/dbraw/zinc/77/50/24/1128775024.db2.gz YBEUWLSSRCQSOP-MRXNPFEDSA-N 1 0 333.435 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2Cc2ccccc2)c2ccncc21 ZINC000715711903 1128810337 /nfs/dbraw/zinc/81/03/37/1128810337.db2.gz KYWVJRXURMAUFF-INIZCTEOSA-N 1 0 348.406 3.829 20 5 EHBDRO Cc1c(C[NH2+]CCCN(C)c2ccccc2F)cccc1[N+](=O)[O-] ZINC001648891956 1120062692 /nfs/dbraw/zinc/06/26/92/1120062692.db2.gz VUJLNOCMAJBINA-UHFFFAOYSA-N 1 0 331.391 3.658 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCc2ccccc2OC1 ZINC000494760627 1120780391 /nfs/dbraw/zinc/78/03/91/1120780391.db2.gz PHNVCYLLPNVSOB-INIZCTEOSA-N 1 0 346.814 3.774 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H](O)c2ccc(F)c(F)c2)C2CC2)c1 ZINC000153259913 1120928079 /nfs/dbraw/zinc/92/80/79/1120928079.db2.gz PLKDHQPJVLEGND-SFHVURJKSA-N 1 0 348.349 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(Nc3ccc(F)cc3)CC2)cc1 ZINC000170650880 1121005112 /nfs/dbraw/zinc/00/51/12/1121005112.db2.gz PLNGEQHDGUBPRE-UHFFFAOYSA-N 1 0 343.402 3.853 20 5 EHBDRO COc1cnccc1[C@@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193329010 1121114265 /nfs/dbraw/zinc/11/42/65/1121114265.db2.gz ZHJXEFBNHUXVMP-SJKOYZFVSA-N 1 0 327.384 3.727 20 5 EHBDRO C[C@@H]1CC2(CCC2)CN1Cn1ncc2cc([N+](=O)[O-])cc(Cl)c21 ZINC000762138277 1121126158 /nfs/dbraw/zinc/12/61/58/1121126158.db2.gz LJVDFIHJARUPST-LLVKDONJSA-N 1 0 334.807 3.820 20 5 EHBDRO COc1cccc([C@H](CNc2ccccc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC000301055711 1121196150 /nfs/dbraw/zinc/19/61/50/1121196150.db2.gz GXQPEDIZPBUENL-IBGZPJMESA-N 1 0 341.411 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)c(F)c1 ZINC000301067184 1121307242 /nfs/dbraw/zinc/30/72/42/1121307242.db2.gz GEZSAJYOVKBXIC-UHFFFAOYSA-N 1 0 347.365 3.950 20 5 EHBDRO Cc1ccccc1NC(=O)CN(Cc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000153318430 1121665681 /nfs/dbraw/zinc/66/56/81/1121665681.db2.gz HVBPVSFKOPCVAV-UHFFFAOYSA-N 1 0 339.395 3.506 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154339240 1122564482 /nfs/dbraw/zinc/56/44/82/1122564482.db2.gz VMMZNGBALPVJJB-NRXGSXMXSA-N 1 0 344.386 3.645 20 5 EHBDRO COc1cccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000556064287 1122801286 /nfs/dbraw/zinc/80/12/86/1122801286.db2.gz XSGIIMASFDARPO-IBGZPJMESA-N 1 0 326.396 3.813 20 5 EHBDRO Cc1ccc(C(=O)NCCCCCCC[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000920251189 1123343205 /nfs/dbraw/zinc/34/32/05/1123343205.db2.gz WFJAYWBJDVIWLJ-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO C[C@H]([N@H+](C)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)C(C)(C)C ZINC000920406103 1123364599 /nfs/dbraw/zinc/36/45/99/1123364599.db2.gz JHNZYJSYRPUWBC-JTQLQIEISA-N 1 0 327.812 3.553 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610133754 1123739052 /nfs/dbraw/zinc/73/90/52/1123739052.db2.gz SUFGRGRJXAHMFI-AAEUAGOBSA-N 1 0 345.365 3.923 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@@H]1c1ccccc1 ZINC000301823519 1129144200 /nfs/dbraw/zinc/14/42/00/1129144200.db2.gz CMIYZSKDHAOAIF-CABCVRRESA-N 1 0 332.791 3.501 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)[C@@H]1c1ccccc1 ZINC000301823520 1129144967 /nfs/dbraw/zinc/14/49/67/1129144967.db2.gz CMIYZSKDHAOAIF-GJZGRUSLSA-N 1 0 332.791 3.501 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@H]1CCCc2c1cnn2C ZINC000615835118 1123883975 /nfs/dbraw/zinc/88/39/75/1123883975.db2.gz PURRORKVIFRPAP-BLSFAOBESA-N 1 0 340.427 3.741 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccnn1C ZINC000615966866 1123919653 /nfs/dbraw/zinc/91/96/53/1123919653.db2.gz KPPLDTDTTPLLTH-DOTOQJQBSA-N 1 0 344.459 3.679 20 5 EHBDRO C[N@@H+]1CCC[C@H](CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000180507344 1124019343 /nfs/dbraw/zinc/01/93/43/1124019343.db2.gz QFCLJLXJDVBIHZ-UZLBHIALSA-N 1 0 339.439 3.616 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000069064189 1124102982 /nfs/dbraw/zinc/10/29/82/1124102982.db2.gz ISWLZJNBDZWBRC-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO CCc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000181824496 1125054048 /nfs/dbraw/zinc/05/40/48/1125054048.db2.gz UGLXTGFXQFMLFO-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCCCc2ccccc2)n1 ZINC000618562229 1125112658 /nfs/dbraw/zinc/11/26/58/1125112658.db2.gz SNWGVVJJTGOPKS-ZWKOTPCHSA-N 1 0 342.443 3.888 20 5 EHBDRO CCOc1cc(NC[C@H](c2ccco2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000080763519 1125348583 /nfs/dbraw/zinc/34/85/83/1125348583.db2.gz RRBTVEZCENVBEU-MRXNPFEDSA-N 1 0 345.399 3.836 20 5 EHBDRO COC(=O)C1(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)CCCC1 ZINC000619654418 1125378497 /nfs/dbraw/zinc/37/84/97/1125378497.db2.gz LSZDQRORLODLKY-UHFFFAOYSA-N 1 0 334.416 3.541 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@@H](C)c2ccsc2)cccc1[N+](=O)[O-] ZINC000619782835 1125404043 /nfs/dbraw/zinc/40/40/43/1125404043.db2.gz LPBOTDVYCRUPTF-LBPRGKRZSA-N 1 0 333.413 3.644 20 5 EHBDRO CC(=O)c1ccc(N[C@@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845873 1129194682 /nfs/dbraw/zinc/19/46/82/1129194682.db2.gz TXXGTEDYCCIEBF-MJGOQNOKSA-N 1 0 339.395 3.655 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc([N+](=O)[O-])c3cccnc23)CC1 ZINC000301921067 1129368148 /nfs/dbraw/zinc/36/81/48/1129368148.db2.gz FOHITDCSJCLFOG-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO CCOc1cc(Nc2ccc(CC[NH+](C)C)cc2)ccc1[N+](=O)[O-] ZINC000301968164 1129458373 /nfs/dbraw/zinc/45/83/73/1129458373.db2.gz XTKPOOIBASAIFX-UHFFFAOYSA-N 1 0 329.400 3.841 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383681 1129504337 /nfs/dbraw/zinc/50/43/37/1129504337.db2.gz CLSQHRJCGPYMRK-STQMWFEESA-N 1 0 326.824 3.764 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1NC[C@@H](c1ccccc1)[NH+](CC)CC ZINC000327985930 1129541676 /nfs/dbraw/zinc/54/16/76/1129541676.db2.gz ZYIUGLBNNHGPFV-INIZCTEOSA-N 1 0 345.447 3.615 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N[C@@H]3CC[N@H+](Cc4ccccc4)C3)ccnc21 ZINC000389197215 1129561518 /nfs/dbraw/zinc/56/15/18/1129561518.db2.gz QIKPNDPQLXWVGY-MRXNPFEDSA-N 1 0 348.406 3.829 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000922542502 1129568597 /nfs/dbraw/zinc/56/85/97/1129568597.db2.gz WINREUWDWOSCKY-GFCCVEGCSA-N 1 0 345.399 3.567 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390545295 1129622595 /nfs/dbraw/zinc/62/25/95/1129622595.db2.gz UCPWKIGVAKWULJ-OXJNMPFZSA-N 1 0 339.439 3.910 20 5 EHBDRO CCN(CC)C(=O)C1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000330734601 1129644349 /nfs/dbraw/zinc/64/43/49/1129644349.db2.gz VBUYTQSTMMEWEY-OAHLLOKOSA-N 1 0 347.459 3.545 20 5 EHBDRO Cc1csc(N2CCC([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)CC2)n1 ZINC000155786202 1129667416 /nfs/dbraw/zinc/66/74/16/1129667416.db2.gz UXXYKFFYUDUHCS-CYBMUJFWSA-N 1 0 346.456 3.679 20 5 EHBDRO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302051570 1129765956 /nfs/dbraw/zinc/76/59/56/1129765956.db2.gz OCOCNFJNRACJEQ-NEPJUHHUSA-N 1 0 338.839 3.708 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc(Cl)cc1)c1cccc([N+](=O)[O-])c1 ZINC000056197307 1129806198 /nfs/dbraw/zinc/80/61/98/1129806198.db2.gz HPESGXKJIMDFPN-NEPJUHHUSA-N 1 0 347.802 3.926 20 5 EHBDRO O=C(C[NH+](C1CCC1)C1CCC1)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000429130341 1129837529 /nfs/dbraw/zinc/83/75/29/1129837529.db2.gz CGNGMFFCHDIFRH-UHFFFAOYSA-N 1 0 337.807 3.594 20 5 EHBDRO C[C@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475458 1129848303 /nfs/dbraw/zinc/84/83/03/1129848303.db2.gz RQXQHRXJYXVBLE-RBSFLKMASA-N 1 0 342.443 3.921 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000226690049 1129864492 /nfs/dbraw/zinc/86/44/92/1129864492.db2.gz GLZVVTHSZLYJMZ-SWLSCSKDSA-N 1 0 346.818 3.891 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1ccco1)[NH+]1CCCCC1 ZINC000076664330 1129975917 /nfs/dbraw/zinc/97/59/17/1129975917.db2.gz GKKKFEJBJZPRBH-HNNXBMFYSA-N 1 0 330.388 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000245515206 1130228327 /nfs/dbraw/zinc/22/83/27/1130228327.db2.gz DFVPQKYQLNKJSS-DLBZAZTESA-N 1 0 331.460 3.915 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2cc(F)ccc2n1C)c1cccc([N+](=O)[O-])c1 ZINC000173429255 1130229788 /nfs/dbraw/zinc/22/97/88/1130229788.db2.gz XRIMZWDXSBKVCG-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173451137 1130232100 /nfs/dbraw/zinc/23/21/00/1130232100.db2.gz XRVCDZBDJJACDB-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@H](C)[C@H](n3ccnc3)C2)cc1[N+](=O)[O-] ZINC000246429302 1130380962 /nfs/dbraw/zinc/38/09/62/1130380962.db2.gz MVSOINKKYRPZFS-HNAYVOBHSA-N 1 0 342.443 3.998 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1O)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000246462971 1130384758 /nfs/dbraw/zinc/38/47/58/1130384758.db2.gz PYLWBFGBPQFZMJ-NJZAAPMLSA-N 1 0 332.425 3.887 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccccc2)C2CCOCC2)cs1 ZINC001168759184 1130432957 /nfs/dbraw/zinc/43/29/57/1130432957.db2.gz YYKOHPYCTSLUEL-QGZVFWFLSA-N 1 0 332.425 3.914 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H](CCO)C2CC2)s1 ZINC000741258527 1131590179 /nfs/dbraw/zinc/59/01/79/1131590179.db2.gz NHGOTLPHQMXUIG-HNNXBMFYSA-N 1 0 332.425 3.574 20 5 EHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742150030 1131693399 /nfs/dbraw/zinc/69/33/99/1131693399.db2.gz TYFOILBQSHBOSC-GOEBONIOSA-N 1 0 343.431 3.711 20 5 EHBDRO CCc1nncn1CC[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000742388155 1131714042 /nfs/dbraw/zinc/71/40/42/1131714042.db2.gz LZKSGCBRVAQPRP-UHFFFAOYSA-N 1 0 330.435 3.937 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@H]1CCN(c2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000742423495 1131723646 /nfs/dbraw/zinc/72/36/46/1131723646.db2.gz VGTFBWHSXCFCHW-INIZCTEOSA-N 1 0 345.830 3.959 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cc(F)ccc1F)CC2 ZINC001172897918 1131880333 /nfs/dbraw/zinc/88/03/33/1131880333.db2.gz DKNDREOFFWOBAX-MRXNPFEDSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cccc(F)c1F)CC2 ZINC001172899587 1131882231 /nfs/dbraw/zinc/88/22/31/1131882231.db2.gz ARVVHEGDUGKCTO-OAHLLOKOSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CC[C@@H](O)c1ccccc1)CC2 ZINC001172901875 1131884601 /nfs/dbraw/zinc/88/46/01/1131884601.db2.gz QOLPDNAGAJYPET-AZUAARDMSA-N 1 0 340.423 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cccnc1Cl)CC2 ZINC001172902528 1131884873 /nfs/dbraw/zinc/88/48/73/1131884873.db2.gz ZINPAZZJLPJQKL-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](F)C(F)(F)CC1)CC2 ZINC001172907905 1131887436 /nfs/dbraw/zinc/88/74/36/1131887436.db2.gz JJPLPXJAMUCTLY-ZBFHGGJFSA-N 1 0 342.361 3.911 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172906505 1131888413 /nfs/dbraw/zinc/88/84/13/1131888413.db2.gz XPADBEGXROXLEU-WMLDXEAASA-N 1 0 332.444 3.637 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1ccc(F)cc1)CC2 ZINC001172896102 1131901948 /nfs/dbraw/zinc/90/19/48/1131901948.db2.gz LXOQBLAUZRUSHP-GOSISDBHSA-N 1 0 328.387 3.814 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1Cc3cccc(F)c3C1)CC2 ZINC001172914459 1131902325 /nfs/dbraw/zinc/90/23/25/1131902325.db2.gz GWFHBLAYHZYLJS-INIZCTEOSA-N 1 0 326.371 3.997 20 5 EHBDRO Cc1ccnc(CCC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172912387 1131917446 /nfs/dbraw/zinc/91/74/46/1131917446.db2.gz NVSAIPFXUXJUDJ-GOSISDBHSA-N 1 0 339.439 3.768 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1CCC1 ZINC001173011737 1131935575 /nfs/dbraw/zinc/93/55/75/1131935575.db2.gz IKCVEMFVJNXWTD-NSHDSACASA-N 1 0 339.386 3.620 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2cccc(O)c2)c1F ZINC001173175501 1131990703 /nfs/dbraw/zinc/99/07/03/1131990703.db2.gz CWLYHCJBMQBZIC-NEPJUHHUSA-N 1 0 348.374 3.730 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]CCc2ccccc2)c1F ZINC001173175068 1131990831 /nfs/dbraw/zinc/99/08/31/1131990831.db2.gz JXHCEEPDIKTUDO-CYBMUJFWSA-N 1 0 332.375 3.506 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c1F ZINC001173177590 1131992584 /nfs/dbraw/zinc/99/25/84/1131992584.db2.gz VRJLECJOKBHYQW-QWRGUYRKSA-N 1 0 346.349 3.699 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)c1F ZINC001173179266 1131992869 /nfs/dbraw/zinc/99/28/69/1131992869.db2.gz OPKKVJXXZSMCEE-OLZOCXBDSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2ccc(C)cn2)c1F ZINC001173187403 1131993284 /nfs/dbraw/zinc/99/32/84/1131993284.db2.gz FFDZESAXMUPUPD-CHWSQXEVSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)CCc2ccccc2)c1F ZINC001173184527 1131993531 /nfs/dbraw/zinc/99/35/31/1131993531.db2.gz NPXLCFKPNODJKY-CQSZACIVSA-N 1 0 346.402 3.848 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC001173217814 1132001584 /nfs/dbraw/zinc/00/15/84/1132001584.db2.gz GGUMRZSONZWNJG-RDTXWAMCSA-N 1 0 326.396 3.948 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCN(CC2CCCCC2)C1 ZINC001173219498 1132002984 /nfs/dbraw/zinc/00/29/84/1132002984.db2.gz COJWEAUVNCFSFX-APWZRJJASA-N 1 0 345.487 3.770 20 5 EHBDRO Cc1cccn2c([C@H](C)[NH2+][C@H](C)Cc3ccc([N+](=O)[O-])cc3)cnc12 ZINC001173222340 1132004050 /nfs/dbraw/zinc/00/40/50/1132004050.db2.gz WQMGXTZCVMKHFG-CABCVRRESA-N 1 0 338.411 3.833 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccncc2)CC1 ZINC001173228368 1132007910 /nfs/dbraw/zinc/00/79/10/1132007910.db2.gz VOJRBKXJGFCYRN-OAHLLOKOSA-N 1 0 325.412 3.800 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1Cc1ccccn1 ZINC001173228542 1132008207 /nfs/dbraw/zinc/00/82/07/1132008207.db2.gz XMSPKYVQYRCTLA-HNAYVOBHSA-N 1 0 325.412 3.628 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(Cc2ccncc2)CC1 ZINC001173229956 1132008539 /nfs/dbraw/zinc/00/85/39/1132008539.db2.gz CHGNENBSLQWXEW-INIZCTEOSA-N 1 0 339.439 3.876 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ncccc1C(F)(F)F ZINC001173211154 1132014325 /nfs/dbraw/zinc/01/43/25/1132014325.db2.gz QAVOISXGUNFAIX-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236663 1132025920 /nfs/dbraw/zinc/02/59/20/1132025920.db2.gz DQVIUSGKYFOMKW-CQSZACIVSA-N 1 0 342.395 3.777 20 5 EHBDRO CCCCn1cc(CNCc2cc(Cl)ccc2[N+](=O)[O-])c(C)n1 ZINC000773409403 1132472717 /nfs/dbraw/zinc/47/27/17/1132472717.db2.gz MISBSABNUQWQLC-UHFFFAOYSA-N 1 0 336.823 3.843 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC001168976063 1132617178 /nfs/dbraw/zinc/61/71/78/1132617178.db2.gz YXQKYVLSERZMBZ-RTBURBONSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)c(Cl)c2)C1 ZINC001168971830 1132623366 /nfs/dbraw/zinc/62/33/66/1132623366.db2.gz LNTJDJRETYFTJH-MNOVXSKESA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(C(F)(F)F)c(Cl)c2)C1 ZINC001168971831 1132624051 /nfs/dbraw/zinc/62/40/51/1132624051.db2.gz LNTJDJRETYFTJH-QWRGUYRKSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H](CC2CCOCC2)c2ccccc2)C1 ZINC001169003519 1132628894 /nfs/dbraw/zinc/62/88/94/1132628894.db2.gz NWMUHWHRCGLSIZ-BHIYHBOVSA-N 1 0 332.444 3.579 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(Br)cc2Cl)C1 ZINC001169005420 1132630579 /nfs/dbraw/zinc/63/05/79/1132630579.db2.gz UDTMXBXWMDNCKG-CABZTGNLSA-N 1 0 347.640 3.638 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009405 1132631438 /nfs/dbraw/zinc/63/14/38/1132631438.db2.gz WCMXKLXGHJCEBU-IEBWSBKVSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1NCCOc1cccc3ccccc31)C[NH2+]C2 ZINC001169012632 1132631757 /nfs/dbraw/zinc/63/17/57/1132631757.db2.gz CPULVHHBLGPSCH-UHFFFAOYSA-N 1 0 349.390 3.842 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCc3cccc(C(F)(F)F)c3C2)C1 ZINC001169039023 1132638522 /nfs/dbraw/zinc/63/85/22/1132638522.db2.gz MPANHCCZJQYBLO-DGCLKSJQSA-N 1 0 328.334 3.509 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3ccc(F)cc32)C1 ZINC001169049670 1132642823 /nfs/dbraw/zinc/64/28/23/1132642823.db2.gz XSMDBWXZLLUZOM-BBRMVZONSA-N 1 0 345.418 3.865 20 5 EHBDRO C[C@H]1CN(Cc2ccc([N+](=O)[O-])cc2Cl)CC[N@@H+]1C1CCCC1 ZINC001176153309 1132864609 /nfs/dbraw/zinc/86/46/09/1132864609.db2.gz DMOSAILYOOOUEK-ZDUSSCGKSA-N 1 0 337.851 3.697 20 5 EHBDRO C[C@]1(Cc2ccccc2)CCC[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000767936031 1133072287 /nfs/dbraw/zinc/07/22/87/1133072287.db2.gz OJGMATXFUBRMSZ-WOJBJXKFSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]C[C@H](O)C3CCCCC3)o2)c1 ZINC001177625206 1133088279 /nfs/dbraw/zinc/08/82/79/1133088279.db2.gz YLKQEOTWCQJJND-SFHVURJKSA-N 1 0 344.411 3.886 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](O)c1ccccc1 ZINC000768087352 1133090595 /nfs/dbraw/zinc/09/05/95/1133090595.db2.gz PNEFPZULJLEIFB-RDJZCZTQSA-N 1 0 346.452 3.789 20 5 EHBDRO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000768214969 1133113567 /nfs/dbraw/zinc/11/35/67/1133113567.db2.gz KFOVVESDAZPOGS-UHFFFAOYSA-N 1 0 347.846 3.942 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3CCC[C@@H]4OCC[C@H]43)o2)c1 ZINC001177976465 1133125941 /nfs/dbraw/zinc/12/59/41/1133125941.db2.gz FIYJVBHUEVDYGR-SCTDSRPQSA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2C[C@@H](O)C23CCC3)s1 ZINC001179154599 1133232142 /nfs/dbraw/zinc/23/21/42/1133232142.db2.gz YLJZFRCPLDHBQA-DLBZAZTESA-N 1 0 344.436 3.716 20 5 EHBDRO C[C@H]1COC[C@H]1[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644934 1133265755 /nfs/dbraw/zinc/26/57/55/1133265755.db2.gz AQHBBWLNBTUIFF-IINYFYTJSA-N 1 0 336.775 3.633 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC001180488491 1133376588 /nfs/dbraw/zinc/37/65/88/1133376588.db2.gz PFZLJODRLJYGSY-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO Cc1nn(C[N@H+]2CC[C@@H](C)C3(CCC3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000770670937 1133457724 /nfs/dbraw/zinc/45/77/24/1133457724.db2.gz UUMJLEBWSMXHCG-CYBMUJFWSA-N 1 0 328.416 3.723 20 5 EHBDRO CSCc1ccc(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC001181268326 1133474853 /nfs/dbraw/zinc/47/48/53/1133474853.db2.gz ZDELGRFARMBXNL-UHFFFAOYSA-N 1 0 342.424 3.624 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCOc2ccc(F)c(Cl)c2)c(F)c1 ZINC001181880725 1133546462 /nfs/dbraw/zinc/54/64/62/1133546462.db2.gz ZVXZAIORQPCOTI-UHFFFAOYSA-N 1 0 342.729 3.695 20 5 EHBDRO C[NH+](C)CC1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000771983879 1133623911 /nfs/dbraw/zinc/62/39/11/1133623911.db2.gz DFSKFHOPMIRVEV-UHFFFAOYSA-N 1 0 332.231 3.680 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774204202 1133632154 /nfs/dbraw/zinc/63/21/54/1133632154.db2.gz QGGNVUOCWKYDSV-HKUYNNGSSA-N 1 0 338.411 3.738 20 5 EHBDRO Cc1ccc([C@@H]2C[C@@H](C)[N@@H+](C[C@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126797 1133810802 /nfs/dbraw/zinc/81/08/02/1133810802.db2.gz UHWRNXWMLPYYCO-ZTNFWEORSA-N 1 0 340.423 3.815 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)c2ccc(Cl)cc2)C2CC2)cc1 ZINC000774764041 1133966623 /nfs/dbraw/zinc/96/66/23/1133966623.db2.gz QRRHGUPQDGZRFM-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccccc1 ZINC000774877080 1134085746 /nfs/dbraw/zinc/08/57/46/1134085746.db2.gz VYKICJUBPXHKBK-CYBMUJFWSA-N 1 0 329.356 3.739 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886614 1134100512 /nfs/dbraw/zinc/10/05/12/1134100512.db2.gz WGAZCGAXJHFDSH-XJKSGUPXSA-N 1 0 341.367 3.881 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H]1CCCN(c2ccccc2)C1 ZINC000788481274 1134130379 /nfs/dbraw/zinc/13/03/79/1134130379.db2.gz HFPCAGTVIXUVBJ-QGZVFWFLSA-N 1 0 343.402 3.835 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCOc2ccc(F)cc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788643296 1134155071 /nfs/dbraw/zinc/15/50/71/1134155071.db2.gz PQLAXFGJQQRFAC-MEDUHNTESA-N 1 0 345.374 3.881 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000788754588 1134165279 /nfs/dbraw/zinc/16/52/79/1134165279.db2.gz QLSRDTJRWYCVOD-IQUTYRLHSA-N 1 0 342.443 3.519 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788796783 1134170662 /nfs/dbraw/zinc/17/06/62/1134170662.db2.gz VALAHSBJEWIJKP-BZNIZROVSA-N 1 0 349.818 3.869 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000789366165 1134263400 /nfs/dbraw/zinc/26/34/00/1134263400.db2.gz MZWUVRYPOGZWQO-IFXJQAMLSA-N 1 0 328.412 3.850 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccccc1OC ZINC000775071180 1134284851 /nfs/dbraw/zinc/28/48/51/1134284851.db2.gz DDWUULMKEBCJJI-HNNXBMFYSA-N 1 0 330.384 3.723 20 5 EHBDRO CC(C)c1cccc2c1CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC000789549159 1134295585 /nfs/dbraw/zinc/29/55/85/1134295585.db2.gz PRMUAJJNYVRIFI-HXUWFJFHSA-N 1 0 340.423 3.810 20 5 EHBDRO CCOc1cc(N[C@H]2CC[N@@H+](C3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC001187081314 1134296729 /nfs/dbraw/zinc/29/67/29/1134296729.db2.gz JYHZBSPREAUCQG-HNNXBMFYSA-N 1 0 333.432 3.812 20 5 EHBDRO C[N@@H+]1C[C@@H]2CC[C@@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@H]2C1 ZINC001187913798 1134396230 /nfs/dbraw/zinc/39/62/30/1134396230.db2.gz QCYXKPKVKRNJLG-ATZCPNFKSA-N 1 0 330.215 3.654 20 5 EHBDRO CCC(CC)C[N@H+](CC)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001190325983 1134682556 /nfs/dbraw/zinc/68/25/56/1134682556.db2.gz WBQYTTGBBFAOLX-UHFFFAOYSA-N 1 0 335.448 3.990 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C(C)C ZINC000775375411 1134684313 /nfs/dbraw/zinc/68/43/13/1134684313.db2.gz STFNJMCYTQKAKA-INIZCTEOSA-N 1 0 342.823 3.706 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC001170305644 1134739968 /nfs/dbraw/zinc/73/99/68/1134739968.db2.gz OLEOIZLNZQICMF-KZULUSFZSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3cc(C)ncc32)c([N+](=O)[O-])c1 ZINC001170324115 1134747633 /nfs/dbraw/zinc/74/76/33/1134747633.db2.gz OGMMOBPZQXAKMV-SCLBCKFNSA-N 1 0 341.411 3.515 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ncccc1C ZINC001170309232 1134753233 /nfs/dbraw/zinc/75/32/33/1134753233.db2.gz PNVKGNMETPSSRP-YOEHRIQHSA-N 1 0 343.427 3.979 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(O)cc2)c([N+](=O)[O-])c1 ZINC001170308748 1134753441 /nfs/dbraw/zinc/75/34/41/1134753441.db2.gz OIKWKGLDZGXQAK-OLZOCXBDSA-N 1 0 330.384 3.591 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](Cc2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC001170352870 1134754294 /nfs/dbraw/zinc/75/42/94/1134754294.db2.gz SIFBYIAYZFONLV-ZDUSSCGKSA-N 1 0 330.384 3.792 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170350550 1134760484 /nfs/dbraw/zinc/76/04/84/1134760484.db2.gz BCKOBKZPJAPXAH-KBXCAEBGSA-N 1 0 326.396 3.981 20 5 EHBDRO CC(C)O[C@@H]1C[C@@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001170386075 1134762266 /nfs/dbraw/zinc/76/22/66/1134762266.db2.gz MJQXZTJMKUYTKS-HUUCEWRRSA-N 1 0 326.824 3.930 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ccccc2)C2CCOCC2)cc1 ZINC000775439555 1134807734 /nfs/dbraw/zinc/80/77/34/1134807734.db2.gz NYJZQBXWBUSGDY-FQEVSTJZSA-N 1 0 340.423 3.895 20 5 EHBDRO CC(C)C[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC001192196260 1134978029 /nfs/dbraw/zinc/97/80/29/1134978029.db2.gz AZLOPFGKFAFTQW-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000804532136 1135109368 /nfs/dbraw/zinc/10/93/68/1135109368.db2.gz WWBRNOWNVLXNKD-MRXNPFEDSA-N 1 0 334.807 3.545 20 5 EHBDRO CCOc1cc(N2CC[NH+](CCCC(C)(C)C)CC2)ccc1[N+](=O)[O-] ZINC001193987339 1135210869 /nfs/dbraw/zinc/21/08/69/1135210869.db2.gz CFJZSWQQIZZUMY-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C1(C)C ZINC001195045430 1135359143 /nfs/dbraw/zinc/35/91/43/1135359143.db2.gz JDBHOVHEKFTGHJ-JKSUJKDBSA-N 1 0 336.432 3.545 20 5 EHBDRO C[C@@H]1CC[C@@H](C(=O)OC(C)(C)C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287104 1135407225 /nfs/dbraw/zinc/40/72/25/1135407225.db2.gz APXAMQVWRIXMFT-GDBMZVCRSA-N 1 0 348.443 3.580 20 5 EHBDRO CC[NH+]1CCN(c2ccc(Nc3sccc3[N+](=O)[O-])cc2)CC1 ZINC000775665776 1135443485 /nfs/dbraw/zinc/44/34/85/1135443485.db2.gz YTVZIWLSMIMELZ-UHFFFAOYSA-N 1 0 332.429 3.542 20 5 EHBDRO C[C@]1(Cc2ccccc2Cl)CCC[N@@H+]1CCn1ccc([N+](=O)[O-])n1 ZINC001196020270 1135506951 /nfs/dbraw/zinc/50/69/51/1135506951.db2.gz AQCKLEYBYZAAPB-QGZVFWFLSA-N 1 0 348.834 3.542 20 5 EHBDRO O=C(C[N@@H+]1CCCC[C@H]1CC1CCC1)Nc1ccccc1[N+](=O)[O-] ZINC001196330481 1135547100 /nfs/dbraw/zinc/54/71/00/1135547100.db2.gz ZEXPNZGIFAECCE-HNNXBMFYSA-N 1 0 331.416 3.578 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NC1CC[NH+](CC2CCCC2)CC1 ZINC000807945742 1135594883 /nfs/dbraw/zinc/59/48/83/1135594883.db2.gz APDFULLRXOVCSH-UHFFFAOYSA-N 1 0 345.443 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCC[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001196898873 1135628405 /nfs/dbraw/zinc/62/84/05/1135628405.db2.gz ICOUEGBUXVPTRB-IAGOWNOFSA-N 1 0 341.367 3.929 20 5 EHBDRO C[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1cc(Cl)cc(Cl)c1F ZINC001197610215 1135707871 /nfs/dbraw/zinc/70/78/71/1135707871.db2.gz CVABIQGWAPENSZ-QMMMGPOBSA-N 1 0 347.177 3.588 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1COc2ccccc2[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728425 1135723095 /nfs/dbraw/zinc/72/30/95/1135723095.db2.gz DUCARYJTAXLGNT-JENIJYKNSA-N 1 0 342.395 3.520 20 5 EHBDRO CCC(CC)[N@H+](CC)CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000808782346 1135736660 /nfs/dbraw/zinc/73/66/60/1135736660.db2.gz PBLPKLANUOURKV-UHFFFAOYSA-N 1 0 325.384 3.573 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563869 1135831011 /nfs/dbraw/zinc/83/10/11/1135831011.db2.gz TXPOPYPMTOLTCL-LSDHHAIUSA-N 1 0 338.835 3.887 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000775894919 1135860684 /nfs/dbraw/zinc/86/06/84/1135860684.db2.gz KOFMWXPOINDFDJ-MRXNPFEDSA-N 1 0 342.823 3.706 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000809750538 1135885033 /nfs/dbraw/zinc/88/50/33/1135885033.db2.gz ZPIRRAXQKCPOQZ-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809750194 1135885799 /nfs/dbraw/zinc/88/57/99/1135885799.db2.gz QNZQQYKPPCMIPV-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@H]([NH+]2CCCC2)C1 ZINC000809939968 1135902531 /nfs/dbraw/zinc/90/25/31/1135902531.db2.gz AODPDESFLVKODL-ZDUSSCGKSA-N 1 0 344.242 3.572 20 5 EHBDRO C[N@@H+](Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC000809973118 1135907410 /nfs/dbraw/zinc/90/74/10/1135907410.db2.gz ITOOKFSZXQFMKL-IINYFYTJSA-N 1 0 347.242 3.885 20 5 EHBDRO C[C@H](C[NH2+]CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C(C)(C)C)cc1 ZINC001201192184 1135993852 /nfs/dbraw/zinc/99/38/52/1135993852.db2.gz JDGXWLRMAMDNMY-HNNXBMFYSA-N 1 0 344.459 3.557 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCCC[C@H]1O ZINC000811483106 1136091231 /nfs/dbraw/zinc/09/12/31/1136091231.db2.gz BWNCBPXZKNGYLH-HIFRSBDPSA-N 1 0 347.242 3.932 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(CCO)CCCC1 ZINC000811482459 1136091599 /nfs/dbraw/zinc/09/15/99/1136091599.db2.gz KLXSGIYRFGAJRA-UHFFFAOYSA-N 1 0 347.242 3.934 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN[C@H]1CC[N@@H+]2CCC[C@H]2C1 ZINC000811474567 1136096464 /nfs/dbraw/zinc/09/64/64/1136096464.db2.gz LVQMHQZRVZDYEH-STQMWFEESA-N 1 0 344.242 3.618 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476038 1136096551 /nfs/dbraw/zinc/09/65/51/1136096551.db2.gz WKFSFKPNLSHIIS-LLVKDONJSA-N 1 0 346.258 3.723 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCC1 ZINC000776257303 1136113567 /nfs/dbraw/zinc/11/35/67/1136113567.db2.gz KSRAXUFBAHQIRR-GFCCVEGCSA-N 1 0 326.824 3.527 20 5 EHBDRO Cc1c([N+](=O)[O-])cc(F)cc1-n1c(-c2ccccc2)cnc1[C@H](C)[NH3+] ZINC001170681644 1136226442 /nfs/dbraw/zinc/22/64/42/1136226442.db2.gz SGLLADOSEIKQMY-LBPRGKRZSA-N 1 0 340.358 3.915 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCCC[C@H]2c2ccccc2)c1 ZINC000776487379 1136304287 /nfs/dbraw/zinc/30/42/87/1136304287.db2.gz ZBYQSOBGOVGDIQ-SLFFLAALSA-N 1 0 340.423 3.944 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1)C1(CO)CCC1 ZINC000814169680 1136415024 /nfs/dbraw/zinc/41/50/24/1136415024.db2.gz LTMUQGJSDHFFNG-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO CC(C)(C)[N@@H+](Cc1ccsc1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000852312003 1136447907 /nfs/dbraw/zinc/44/79/07/1136447907.db2.gz RQGRNQVDTLDTAK-INIZCTEOSA-N 1 0 334.441 3.990 20 5 EHBDRO CC[C@@H](Cc1ccc(C)cc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776588693 1136453189 /nfs/dbraw/zinc/45/31/89/1136453189.db2.gz NXTNMRJAGUIMAG-AZUAARDMSA-N 1 0 342.439 3.890 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)CN2CC[C@@H]2c2ccc(Cl)cc2)cc1 ZINC000776593024 1136453601 /nfs/dbraw/zinc/45/36/01/1136453601.db2.gz TUKXPSXDBHFJJB-SJORKVTESA-N 1 0 332.787 3.729 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CC3(CCCC3)[C@H]2c2ccco2)c1 ZINC000852426872 1136455522 /nfs/dbraw/zinc/45/55/22/1136455522.db2.gz PURCLXDHKAYYCH-SJLPKXTDSA-N 1 0 342.395 3.839 20 5 EHBDRO CCOc1ccccc1[C@H](CC)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776605471 1136473799 /nfs/dbraw/zinc/47/37/99/1136473799.db2.gz KXPJUJBOXLGKSM-ZWKOTPCHSA-N 1 0 344.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H](C[NH+]3CCCC3)C2)c(C(F)(F)F)c1 ZINC000814852817 1136515661 /nfs/dbraw/zinc/51/56/61/1136515661.db2.gz QFKMPJZFHXFTFH-GFCCVEGCSA-N 1 0 343.349 3.536 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H](O)c1cc2ccccc2o1 ZINC000815111407 1136550247 /nfs/dbraw/zinc/55/02/47/1136550247.db2.gz CKEYTUBOAPZKIT-QGZVFWFLSA-N 1 0 340.379 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@H](CO)C2CCCCC2)c1 ZINC000815151295 1136557571 /nfs/dbraw/zinc/55/75/71/1136557571.db2.gz WQVVNSLHOYKRIF-AWEZNQCLSA-N 1 0 326.824 3.527 20 5 EHBDRO C[C@H](OC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448823 1136597295 /nfs/dbraw/zinc/59/72/95/1136597295.db2.gz VGJNTCBBHHMVRF-KBXCAEBGSA-N 1 0 346.427 3.996 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCCc2cccc(Cl)c2)cc1 ZINC000818984600 1136896669 /nfs/dbraw/zinc/89/66/69/1136896669.db2.gz IZMDBCLTDBPLLB-KRWDZBQOSA-N 1 0 334.803 3.504 20 5 EHBDRO CC(C)(C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000818984359 1136896807 /nfs/dbraw/zinc/89/68/07/1136896807.db2.gz FOUUBTKUYXANRP-QGZVFWFLSA-N 1 0 348.830 3.849 20 5 EHBDRO CC[C@@H](CSc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819187749 1136920935 /nfs/dbraw/zinc/92/09/35/1136920935.db2.gz RXHVSROKYUESTF-MAUKXSAKSA-N 1 0 346.452 3.789 20 5 EHBDRO Cc1ccc(O[C@H]2CC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035856 1136934219 /nfs/dbraw/zinc/93/42/19/1136934219.db2.gz LVVHUJVNYVJDLT-CABCVRRESA-N 1 0 327.384 3.513 20 5 EHBDRO Cc1cccc([C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)c1 ZINC000858363678 1136961886 /nfs/dbraw/zinc/96/18/86/1136961886.db2.gz YGTGFWNQPCFANW-MOPGFXCFSA-N 1 0 328.412 3.924 20 5 EHBDRO Cc1ccc(-c2noc([C@@H]3C[C@@H]4CCCC[C@H]4[NH2+]3)n2)cc1[N+](=O)[O-] ZINC000822722365 1137071706 /nfs/dbraw/zinc/07/17/06/1137071706.db2.gz DFNTVGKTJDIVMK-YUTCNCBUSA-N 1 0 328.372 3.546 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCO1 ZINC000824799382 1137152732 /nfs/dbraw/zinc/15/27/32/1137152732.db2.gz NFBYTSLDLSPAGB-CJNGLKHVSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccnc3)C2)cc1Cl ZINC000824932847 1137158165 /nfs/dbraw/zinc/15/81/65/1137158165.db2.gz YDMPVNNOHGMESQ-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824953799 1137159268 /nfs/dbraw/zinc/15/92/68/1137159268.db2.gz LSXITLZXNIKTQD-NVXWUHKLSA-N 1 0 347.802 3.653 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@]2(CCSC2)C1 ZINC000825215309 1137169128 /nfs/dbraw/zinc/16/91/28/1137169128.db2.gz LWNXIXZSRQCZDJ-OAHLLOKOSA-N 1 0 326.849 3.967 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@]2(CCSC2)C1 ZINC000825215308 1137169208 /nfs/dbraw/zinc/16/92/08/1137169208.db2.gz LWNXIXZSRQCZDJ-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3c(Cl)nccc3[N+](=O)[O-])c2c1 ZINC001171165443 1137276887 /nfs/dbraw/zinc/27/68/87/1137276887.db2.gz IJXUBXXOCFNHQE-LLVKDONJSA-N 1 0 344.802 3.785 20 5 EHBDRO C[NH+](C)C1CCN(c2ccc(Nc3ccsc3[N+](=O)[O-])cc2)CC1 ZINC000865655816 1137302211 /nfs/dbraw/zinc/30/22/11/1137302211.db2.gz GURQAGQDIJBHSH-UHFFFAOYSA-N 1 0 346.456 3.930 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259743 1137339981 /nfs/dbraw/zinc/33/99/81/1137339981.db2.gz PHUCROUBHGXIQC-STQMWFEESA-N 1 0 332.375 3.591 20 5 EHBDRO CCCc1nc(C)c(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])o1 ZINC000866364871 1137349741 /nfs/dbraw/zinc/34/97/41/1137349741.db2.gz QLIZIXNZVWQIDK-NSHDSACASA-N 1 0 335.379 3.704 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866367132 1137349918 /nfs/dbraw/zinc/34/99/18/1137349918.db2.gz GECGNVLQYNOQAE-QWQRMKEZSA-N 1 0 338.423 3.706 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1COCc2ccccc21 ZINC000866377094 1137350412 /nfs/dbraw/zinc/35/04/12/1137350412.db2.gz SEAVQSCHZHYFFR-SJKOYZFVSA-N 1 0 330.359 3.526 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(C)(C)C(C)(F)F ZINC000866543653 1137363612 /nfs/dbraw/zinc/36/36/12/1137363612.db2.gz ZYMQHWHRPWBZBK-NSHDSACASA-N 1 0 343.374 3.583 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(C(=O)OC(C)C)CC1 ZINC000772975343 1137392080 /nfs/dbraw/zinc/39/20/80/1137392080.db2.gz CKGDWJQXCJFWPF-CQSZACIVSA-N 1 0 349.431 3.563 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)c1ccc2c(c1)CCO2 ZINC000122413842 1137436884 /nfs/dbraw/zinc/43/68/84/1137436884.db2.gz HKKQSUQFJDSJPR-QGZVFWFLSA-N 1 0 342.395 3.779 20 5 EHBDRO [NH3+]C[C@H]1COc2ccccc2N1c1ccc([N+](=O)[O-])c2ccccc21 ZINC001171398998 1137470841 /nfs/dbraw/zinc/47/08/41/1137470841.db2.gz YQPPUOXNRKMMFY-ZDUSSCGKSA-N 1 0 335.363 3.606 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCc2ccccc2OC1 ZINC000511038757 1137471386 /nfs/dbraw/zinc/47/13/86/1137471386.db2.gz VDXMIRCFIUIVRT-HOCLYGCPSA-N 1 0 326.396 3.948 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCc2ccccc2OC1 ZINC000511038756 1137471403 /nfs/dbraw/zinc/47/14/03/1137471403.db2.gz VDXMIRCFIUIVRT-GOEBONIOSA-N 1 0 326.396 3.948 20 5 EHBDRO C/C(=C/c1nc(C2C[C@H]3CC[C@@H](C2)[NH2+]3)no1)c1ccc([N+](=O)[O-])cc1 ZINC000871797350 1137558585 /nfs/dbraw/zinc/55/85/85/1137558585.db2.gz KVGKRLXOVGATEF-FMJKMSLOSA-N 1 0 340.383 3.536 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2SC)ccn1 ZINC000872021479 1137565279 /nfs/dbraw/zinc/56/52/79/1137565279.db2.gz PUVPFSZUUMNJMP-NSHDSACASA-N 1 0 333.413 3.571 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCn1ccnc1C ZINC000872025333 1137565778 /nfs/dbraw/zinc/56/57/78/1137565778.db2.gz KXUKAGHNBLVWLC-GFCCVEGCSA-N 1 0 334.445 3.563 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872032622 1137566521 /nfs/dbraw/zinc/56/65/21/1137566521.db2.gz WVIIYHBZUDGNJG-GFCCVEGCSA-N 1 0 345.374 3.586 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC[S@](=O)C(C)(C)C ZINC000872033204 1137566584 /nfs/dbraw/zinc/56/65/84/1137566584.db2.gz BRRDNAYHDUOSCE-SAHAZLINSA-N 1 0 344.502 3.515 20 5 EHBDRO CCC[C@@H](CCO)C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041140 1137567150 /nfs/dbraw/zinc/56/71/50/1137567150.db2.gz QCKBXVNUMWQVRY-OLZOCXBDSA-N 1 0 326.462 3.766 20 5 EHBDRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872043218 1137567428 /nfs/dbraw/zinc/56/74/28/1137567428.db2.gz HPAYUNWATDAJJP-DZKIICNBSA-N 1 0 346.402 3.939 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872045531 1137567474 /nfs/dbraw/zinc/56/74/74/1137567474.db2.gz NXLXXVWJPRQEOX-DVOMOZLQSA-N 1 0 332.375 3.549 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1cc(C)n[nH]1 ZINC000872049625 1137567814 /nfs/dbraw/zinc/56/78/14/1137567814.db2.gz UHWNETMYKFWAGM-CMPLNLGQSA-N 1 0 334.445 3.630 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1ccncc1C ZINC000872052140 1137568102 /nfs/dbraw/zinc/56/81/02/1137568102.db2.gz PVYMTMAMHSVASI-ZDUSSCGKSA-N 1 0 331.441 3.913 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000872061077 1137568888 /nfs/dbraw/zinc/56/88/88/1137568888.db2.gz VXLYXSVFGJIQEW-HNNXBMFYSA-N 1 0 338.835 3.872 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])[C@](C)(O)c1ccccc1 ZINC000872082841 1137570310 /nfs/dbraw/zinc/57/03/10/1137570310.db2.gz BZMZTVNTPDFLRM-JCGVRSQUSA-N 1 0 332.375 3.681 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)[C@@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872088462 1137570588 /nfs/dbraw/zinc/57/05/88/1137570588.db2.gz OWXBWGBOBUASNS-GDZNZVCISA-N 1 0 332.375 3.549 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129776 1137573145 /nfs/dbraw/zinc/57/31/45/1137573145.db2.gz RXBVVVFJLLTSGN-HUUCEWRRSA-N 1 0 341.411 3.971 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000872134415 1137573569 /nfs/dbraw/zinc/57/35/69/1137573569.db2.gz WBPWOYKQZUJVTH-YQVWRLOYSA-N 1 0 326.396 3.684 20 5 EHBDRO CCOc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000873012164 1137587987 /nfs/dbraw/zinc/58/79/87/1137587987.db2.gz OJRAPDMANDBUEL-UHFFFAOYSA-N 1 0 344.411 3.909 20 5 EHBDRO COCCOc1ccccc1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873019996 1137588231 /nfs/dbraw/zinc/58/82/31/1137588231.db2.gz AUHITDLSUYSDEH-UHFFFAOYSA-N 1 0 344.411 3.527 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](C[C@H](C)O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000873080052 1137589615 /nfs/dbraw/zinc/58/96/15/1137589615.db2.gz ZYNNZZSBBDWYOS-KSSFIOAISA-N 1 0 328.412 3.548 20 5 EHBDRO Cc1c(C[NH2+]CC2([C@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000873095645 1137590113 /nfs/dbraw/zinc/59/01/13/1137590113.db2.gz GZFQYWAWBWIFFV-GOSISDBHSA-N 1 0 326.396 3.507 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccc2c1CCOC2 ZINC000873151713 1137591441 /nfs/dbraw/zinc/59/14/41/1137591441.db2.gz YZOQCCYPEZNOAH-UHFFFAOYSA-N 1 0 326.396 3.574 20 5 EHBDRO Cc1ccc([C@@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C2CC2)cc1 ZINC000876921171 1137665290 /nfs/dbraw/zinc/66/52/90/1137665290.db2.gz LUSBKJXOBKENSZ-LEOMRAHMSA-N 1 0 326.400 3.544 20 5 EHBDRO COCCC[N@H+](Cc1ccncc1)Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000877526578 1137679708 /nfs/dbraw/zinc/67/97/08/1137679708.db2.gz SRMARFPSEXOIHN-UHFFFAOYSA-N 1 0 343.427 3.645 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(C(F)(F)F)nc1 ZINC000877827844 1137692445 /nfs/dbraw/zinc/69/24/45/1137692445.db2.gz VDSNTPCUCGZRSS-LLVKDONJSA-N 1 0 339.317 3.902 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCOCC3)CO2)cc1[N+](=O)[O-] ZINC000878371848 1137713147 /nfs/dbraw/zinc/71/31/47/1137713147.db2.gz SFKPWSSTBIUMON-DOTOQJQBSA-N 1 0 348.443 3.530 20 5 EHBDRO CC[C@H]([NH2+]C[C@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000878369776 1137713205 /nfs/dbraw/zinc/71/32/05/1137713205.db2.gz APBPZPPITZYBFP-MSOLQXFVSA-N 1 0 348.443 3.611 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000879206641 1137741087 /nfs/dbraw/zinc/74/10/87/1137741087.db2.gz QCUSYFSYGNWVIR-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO C[C@@H]1CN(c2ccc([N+](=O)[O-])cc2C(F)F)CCN1c1cc[nH+]cc1 ZINC000882820745 1137835224 /nfs/dbraw/zinc/83/52/24/1137835224.db2.gz ZDNDLRCBPCCFKP-GFCCVEGCSA-N 1 0 348.353 3.643 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113318950 1137912527 /nfs/dbraw/zinc/91/25/27/1137912527.db2.gz RFOBOJCAFYWLMX-CYBMUJFWSA-N 1 0 348.472 3.538 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccccc2[N+](=O)[O-])CC1 ZINC000119296364 1137940164 /nfs/dbraw/zinc/94/01/64/1137940164.db2.gz IDWYZVITYRZBIK-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@@H]1CCCOC1 ZINC000119753323 1137944360 /nfs/dbraw/zinc/94/43/60/1137944360.db2.gz GFEYTGFMVBCBDA-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO CCC(CC)(CO)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000120477857 1137950118 /nfs/dbraw/zinc/95/01/18/1137950118.db2.gz GVLAUHYUSKKRGK-UHFFFAOYSA-N 1 0 349.456 3.607 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000884717212 1137970949 /nfs/dbraw/zinc/97/09/49/1137970949.db2.gz VPXHBGIASKEFPD-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(NC(=O)OC(C)(C)C)CC1 ZINC000052909535 1138046001 /nfs/dbraw/zinc/04/60/01/1138046001.db2.gz OPWYQVXRDNXCDE-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000886707417 1138120427 /nfs/dbraw/zinc/12/04/27/1138120427.db2.gz HQABYGNAESPKLV-MAUKXSAKSA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@@H](C)[C@H]3C)O2)cc1[N+](=O)[O-] ZINC000886771668 1138137370 /nfs/dbraw/zinc/13/73/70/1138137370.db2.gz LSRGLTPSSQJCQC-OKVDMCGNSA-N 1 0 348.443 3.526 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324886 1138155033 /nfs/dbraw/zinc/15/50/33/1138155033.db2.gz MBNRSNNKAQZDDM-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO CCc1ccccc1NC(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000089508950 1138200192 /nfs/dbraw/zinc/20/01/92/1138200192.db2.gz DQYDFCICPCUZCZ-CQSZACIVSA-N 1 0 341.411 3.755 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580876 1138201709 /nfs/dbraw/zinc/20/17/09/1138201709.db2.gz DDPXDURRZJZSDJ-ZDUSSCGKSA-N 1 0 346.431 3.584 20 5 EHBDRO Cc1occc1C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000092438426 1138228241 /nfs/dbraw/zinc/22/82/41/1138228241.db2.gz UTVIECZHQWNQKU-UHFFFAOYSA-N 1 0 340.383 3.529 20 5 EHBDRO COCC1CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000093103604 1138234310 /nfs/dbraw/zinc/23/43/10/1138234310.db2.gz YKZMPYRLNMSTKU-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765741 1138294300 /nfs/dbraw/zinc/29/43/00/1138294300.db2.gz MJVFNPVQPBLENV-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO C[C@H]1c2ccccc2CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337261167 1138512237 /nfs/dbraw/zinc/51/22/37/1138512237.db2.gz XSBIQZQGPMDLGV-AWEZNQCLSA-N 1 0 339.395 3.543 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cnn(C3CCCC3)c2)cc1[N+](=O)[O-] ZINC000337469491 1138578363 /nfs/dbraw/zinc/57/83/63/1138578363.db2.gz NAZZBOZHPXMUER-ZDUSSCGKSA-N 1 0 344.415 3.766 20 5 EHBDRO CSC(C)(C)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000174437967 1139420393 /nfs/dbraw/zinc/42/03/93/1139420393.db2.gz BJPJBDASYRQCNE-UHFFFAOYSA-N 1 0 337.470 3.950 20 5 EHBDRO CCc1ccc(C(=O)Nc2cc(C[NH+](C)C)ccc2C)cc1[N+](=O)[O-] ZINC000177306964 1139612236 /nfs/dbraw/zinc/61/22/36/1139612236.db2.gz BUJLIKFIYUMSMZ-UHFFFAOYSA-N 1 0 341.411 3.780 20 5 EHBDRO CCCNC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000178646061 1139709356 /nfs/dbraw/zinc/70/93/56/1139709356.db2.gz PUSUBZDWNACLTN-AWEZNQCLSA-N 1 0 341.411 3.585 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1ccc([N+](=O)[O-])cc1Cl)c1nccs1 ZINC000184009893 1140073873 /nfs/dbraw/zinc/07/38/73/1140073873.db2.gz YDISQABVBKCBEH-JTQLQIEISA-N 1 0 325.821 3.940 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000186731960 1140219185 /nfs/dbraw/zinc/21/91/85/1140219185.db2.gz YGJRJHUWAACWGL-VXGBXAGGSA-N 1 0 335.429 3.904 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781868 1140724129 /nfs/dbraw/zinc/72/41/29/1140724129.db2.gz NEASNZXHJZMKDP-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccc2c(c1)CC(=O)N2C ZINC000266899162 1140735665 /nfs/dbraw/zinc/73/56/65/1140735665.db2.gz TUAYBGRJDUQEGE-CHWSQXEVSA-N 1 0 339.395 3.526 20 5 EHBDRO CC(C)n1cnnc1[C@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924391 1140738158 /nfs/dbraw/zinc/73/81/58/1140738158.db2.gz MUKRJPMPPQTOKN-GJZGRUSLSA-N 1 0 343.431 3.708 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000268809171 1140997231 /nfs/dbraw/zinc/99/72/31/1140997231.db2.gz ILUTYZJULFNFBZ-LBPRGKRZSA-N 1 0 345.355 3.671 20 5 EHBDRO CCC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCOCC1 ZINC000268976059 1141038496 /nfs/dbraw/zinc/03/84/96/1141038496.db2.gz NLGGNXKRKWDAFU-KRWDZBQOSA-N 1 0 332.444 3.712 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](CCO)c2ccccc2)cccc1[N+](=O)[O-] ZINC000268994919 1141041127 /nfs/dbraw/zinc/04/11/27/1141041127.db2.gz NGKHNYMUTFZBRD-NVXWUHKLSA-N 1 0 328.412 3.720 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667645 1141253052 /nfs/dbraw/zinc/25/30/52/1141253052.db2.gz PUWIRWCJPKVYCF-SWLSCSKDSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](CCO)CC(C)C)cc1[N+](=O)[O-] ZINC000271199141 1141323744 /nfs/dbraw/zinc/32/37/44/1141323744.db2.gz ZAOGXJHFACVVPJ-GJZGRUSLSA-N 1 0 338.448 3.689 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc([S@](C)=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000271454718 1141371922 /nfs/dbraw/zinc/37/19/22/1141371922.db2.gz GPHBILIPEDXGEK-XCMOZONUSA-N 1 0 332.425 3.744 20 5 EHBDRO CC(C)(CCCO)C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000271584795 1141401967 /nfs/dbraw/zinc/40/19/67/1141401967.db2.gz RZTCLQGMEAXHGO-NVXWUHKLSA-N 1 0 334.460 3.694 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000274470346 1141537961 /nfs/dbraw/zinc/53/79/61/1141537961.db2.gz OFWBAMKSGGPBKY-HNNXBMFYSA-N 1 0 326.396 3.639 20 5 EHBDRO Cc1ccoc1C[N@@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000430154568 1014447910 /nfs/dbraw/zinc/44/79/10/1014447910.db2.gz IFBOUGKIDKEFMU-UHFFFAOYSA-N 1 0 340.383 3.529 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)c1cc[nH]c(=O)c1 ZINC000339453256 1014512188 /nfs/dbraw/zinc/51/21/88/1014512188.db2.gz FQSIINXQYQJVII-LBPRGKRZSA-N 1 0 339.351 3.806 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(CNc2cc3c(c[nH+]2)CCC3)c1 ZINC000339555148 1014847126 /nfs/dbraw/zinc/84/71/26/1014847126.db2.gz ICPOOQRZURQBMA-UHFFFAOYSA-N 1 0 335.310 3.692 20 5 EHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346963 1015073412 /nfs/dbraw/zinc/07/34/12/1015073412.db2.gz NTOQKCUDNVCIKN-HNNXBMFYSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C)[C@H]1Oc2ccccc2[C@H]1C ZINC000430219832 1015086741 /nfs/dbraw/zinc/08/67/41/1015086741.db2.gz NWZFVASZVGGNBO-VPZZIHKRSA-N 1 0 342.395 3.646 20 5 EHBDRO Cc1cc(N2CC[NH+](C3CCCC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000302044635 1015176706 /nfs/dbraw/zinc/17/67/06/1015176706.db2.gz XNJWLXCQPWIISV-UHFFFAOYSA-N 1 0 340.427 3.516 20 5 EHBDRO CCn1nc(C)c(CN(Cc2cccc([N+](=O)[O-])c2)C2CC2)c1C ZINC000154283829 1015340813 /nfs/dbraw/zinc/34/08/13/1015340813.db2.gz ZBPWPWKCNWFWHT-UHFFFAOYSA-N 1 0 328.416 3.593 20 5 EHBDRO COc1ccc(COCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000091741141 1015639693 /nfs/dbraw/zinc/63/96/93/1015639693.db2.gz PMWSCCHKGHYZRJ-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO CCOc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)ccc1OC ZINC000336878944 1015989287 /nfs/dbraw/zinc/98/92/87/1015989287.db2.gz JZRRNHPYBHVWRI-UHFFFAOYSA-N 1 0 330.384 3.600 20 5 EHBDRO Cc1cc(NC[C@]2(C)CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000311211006 1016397496 /nfs/dbraw/zinc/39/74/96/1016397496.db2.gz PCTBCYAEXHAYHY-IBGZPJMESA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1ncc(CN(C)c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)s1 ZINC000181459804 1016729298 /nfs/dbraw/zinc/72/92/98/1016729298.db2.gz IWYOVPZONAPTPX-UHFFFAOYSA-N 1 0 328.397 3.853 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F)CC(F)(F)F ZINC000414534074 1016962072 /nfs/dbraw/zinc/96/20/72/1016962072.db2.gz WDKKRMGUAWATAR-MRVPVSSYSA-N 1 0 342.264 3.874 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1c[nH]c2cc(F)ccc12 ZINC000449107464 1032185595 /nfs/dbraw/zinc/18/55/95/1032185595.db2.gz MUNKPLOSZWJAEV-ZDUSSCGKSA-N 1 0 341.386 3.979 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(OC(F)F)c1 ZINC000449135609 1032233483 /nfs/dbraw/zinc/23/34/83/1032233483.db2.gz QKHOULNNXLDVDQ-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)N[C@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000538276641 1032265424 /nfs/dbraw/zinc/26/54/24/1032265424.db2.gz LHNNXHWUCZCBSQ-HZPDHXFCSA-N 1 0 349.475 3.885 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1cccnc1 ZINC000449191285 1032287179 /nfs/dbraw/zinc/28/71/79/1032287179.db2.gz XAQASNRNJSQBCB-MAUKXSAKSA-N 1 0 327.428 3.950 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2C[C@@H](OCC(C)C)C2(C)C)cc1[N+](=O)[O-] ZINC000538399231 1032328426 /nfs/dbraw/zinc/32/84/26/1032328426.db2.gz ZZSMMZQNWVNZNI-IAGOWNOFSA-N 1 0 336.432 3.533 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(c1)COC2 ZINC000536849245 1032344408 /nfs/dbraw/zinc/34/44/08/1032344408.db2.gz AWMSPRWLFUTLBV-AWEZNQCLSA-N 1 0 326.396 3.736 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000459650941 1032373211 /nfs/dbraw/zinc/37/32/11/1032373211.db2.gz ONDCQVBBVVHFBG-CVEARBPZSA-N 1 0 327.428 3.922 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000449330400 1032442078 /nfs/dbraw/zinc/44/20/78/1032442078.db2.gz KZZMKAXMGAUWBV-CXAGYDPISA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1OCCc2sccc21 ZINC000449341125 1032457598 /nfs/dbraw/zinc/45/75/98/1032457598.db2.gz RVMABCVOGBMVQO-VFVRVIDISA-N 1 0 346.452 3.879 20 5 EHBDRO COc1cc2c(c(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)c1)O[C@@H](C)C2 ZINC000449348288 1032464358 /nfs/dbraw/zinc/46/43/58/1032464358.db2.gz LIHFUPDOFJVSDE-STQMWFEESA-N 1 0 342.395 3.778 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@]1(C)OCCc2sccc21 ZINC000449337005 1032474719 /nfs/dbraw/zinc/47/47/19/1032474719.db2.gz OXJRHSNZMJOWGV-SCLBCKFNSA-N 1 0 346.452 3.665 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)c1ccccn1 ZINC000449393306 1032500739 /nfs/dbraw/zinc/50/07/39/1032500739.db2.gz MEEKDLGNCYCIRS-PTNGSMBKSA-N 1 0 325.412 3.961 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CCO[C@H](C(C)C)C1 ZINC000449490273 1032655132 /nfs/dbraw/zinc/65/51/32/1032655132.db2.gz BRRIONTXLVPIGP-KSSFIOAISA-N 1 0 336.432 3.534 20 5 EHBDRO CC(C)[C@@H]([NH3+])CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414805411 1017207573 /nfs/dbraw/zinc/20/75/73/1017207573.db2.gz YKQKDGFMPIDYBT-HNNXBMFYSA-N 1 0 337.807 3.581 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]([C@H]4CCOC4)C3)o2)c1 ZINC000377237779 1017513615 /nfs/dbraw/zinc/51/36/15/1017513615.db2.gz JJAAWQQJODIPTA-HOTGVXAUSA-N 1 0 342.395 3.713 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@@H]1CCN(c2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000610281964 1017615065 /nfs/dbraw/zinc/61/50/65/1017615065.db2.gz OLFSPAKKHCNUOI-MRXNPFEDSA-N 1 0 345.830 3.959 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000134946190 1017709055 /nfs/dbraw/zinc/70/90/55/1017709055.db2.gz FNOSIDDXGZQZIQ-DYVFJYSZSA-N 1 0 349.862 3.697 20 5 EHBDRO C[C@H]([NH2+]C1(c2ccc3c(c2)OCO3)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000537449882 1032739416 /nfs/dbraw/zinc/73/94/16/1032739416.db2.gz LNBIJIHTBCKHRY-LBPRGKRZSA-N 1 0 326.352 3.663 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1c2ccccc2CC12CCOCC2 ZINC000377646445 1018117396 /nfs/dbraw/zinc/11/73/96/1018117396.db2.gz DJUKHIIQNRHHKH-IBGZPJMESA-N 1 0 338.407 3.779 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCC[C@H](Cc3ccccc3)C2)c1 ZINC001167332759 1018224933 /nfs/dbraw/zinc/22/49/33/1018224933.db2.gz RMFFABLLYJSPRF-GOSISDBHSA-N 1 0 340.423 3.928 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@H](c3ncc[nH]3)C2)cc1[N+](=O)[O-] ZINC000092072746 1032763554 /nfs/dbraw/zinc/76/35/54/1032763554.db2.gz KEAMYLBHTGPGTP-HNNXBMFYSA-N 1 0 328.416 3.821 20 5 EHBDRO Cc1nccc([C@H]2CCC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)n1 ZINC000610368004 1018536324 /nfs/dbraw/zinc/53/63/24/1018536324.db2.gz AQKGNPWQJAHLQC-ZFWWWQNUSA-N 1 0 326.400 3.634 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1C[C@H]2CN(c3ccccc3)C[C@@H]2C1 ZINC000610367960 1018536656 /nfs/dbraw/zinc/53/66/56/1018536656.db2.gz SAAWRGAYDFTKDR-IKGGRYGDSA-N 1 0 337.423 3.724 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccccc2OC(F)F)c(F)c1 ZINC000471527331 1018539844 /nfs/dbraw/zinc/53/98/44/1018539844.db2.gz QKFGXLDLPSZJNR-UHFFFAOYSA-N 1 0 340.301 3.668 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCCc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000894160336 1018757998 /nfs/dbraw/zinc/75/79/98/1018757998.db2.gz BMWPOCZSSOPVCZ-OAHLLOKOSA-N 1 0 346.358 3.615 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)N(C)C ZINC000449556444 1032796352 /nfs/dbraw/zinc/79/63/52/1032796352.db2.gz MVOQCFBOIDPBTD-ZDUSSCGKSA-N 1 0 347.390 3.566 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)c2c1 ZINC000610420573 1019025878 /nfs/dbraw/zinc/02/58/78/1019025878.db2.gz YEZRLHWLNMHPKS-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO CN(c1ccsc1[N+](=O)[O-])[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000610431090 1019084377 /nfs/dbraw/zinc/08/43/77/1019084377.db2.gz QAYHKZROZCFXQP-OAHLLOKOSA-N 1 0 331.441 3.757 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)[C@@H](C)c1cccc(OC)c1 ZINC000178857584 1019131492 /nfs/dbraw/zinc/13/14/92/1019131492.db2.gz JMCVYZJBCVBKOH-IFXJQAMLSA-N 1 0 344.411 3.720 20 5 EHBDRO CC(C)c1ccc(C(=O)N(C)[C@@H](C)C2CC[NH+](C)CC2)cc1[N+](=O)[O-] ZINC000275917562 1019622356 /nfs/dbraw/zinc/62/23/56/1019622356.db2.gz XPXJXEUAZSDTQT-AWEZNQCLSA-N 1 0 347.459 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2C2CC2)c2ccncc21 ZINC000433812023 1019638266 /nfs/dbraw/zinc/63/82/66/1019638266.db2.gz TXVFYFJMSZQQTE-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000182951609 1019867877 /nfs/dbraw/zinc/86/78/77/1019867877.db2.gz AVWQANPUKKMQHY-RYUDHWBXSA-N 1 0 330.388 3.559 20 5 EHBDRO Cc1ccc(NC(=O)[C@H]2CCCC[N@@H+]2C2CCCC2)cc1[N+](=O)[O-] ZINC000433117778 1019884397 /nfs/dbraw/zinc/88/43/97/1019884397.db2.gz VHERSKVWRWYSJO-MRXNPFEDSA-N 1 0 331.416 3.639 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000120682554 1019945914 /nfs/dbraw/zinc/94/59/14/1019945914.db2.gz UHRNRKOKDMHKKV-KPZWWZAWSA-N 1 0 330.432 3.617 20 5 EHBDRO CCOC[C@H]1CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602467018 1032903582 /nfs/dbraw/zinc/90/35/82/1032903582.db2.gz CKYQHVQUDZVJQF-LBPRGKRZSA-N 1 0 346.349 3.862 20 5 EHBDRO CC[C@](C)(CCO)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000134471302 1020851653 /nfs/dbraw/zinc/85/16/53/1020851653.db2.gz RLFUJBGXEDFVAL-GOSISDBHSA-N 1 0 348.399 3.504 20 5 EHBDRO Cc1csc(CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])n1 ZINC000602510102 1032945030 /nfs/dbraw/zinc/94/50/30/1032945030.db2.gz JWBXBZHZPILOJC-UHFFFAOYSA-N 1 0 345.346 3.711 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1CCCOC1 ZINC000507423537 1021254817 /nfs/dbraw/zinc/25/48/17/1021254817.db2.gz RFMIZDUFUACNFB-SOUVJXGZSA-N 1 0 338.473 3.870 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1CCCOC1 ZINC000507423252 1021255013 /nfs/dbraw/zinc/25/50/13/1021255013.db2.gz RFMIZDUFUACNFB-QLFBSQMISA-N 1 0 338.473 3.870 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCOC[C@H]1Cc1ccccc1 ZINC000507685690 1021435006 /nfs/dbraw/zinc/43/50/06/1021435006.db2.gz ULEVWCKOYIUJQE-FUKWUPMWSA-N 1 0 338.407 3.552 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2ccc([N+](=O)[O-])nc2)c2cccs2)CC1 ZINC000550299674 1021523343 /nfs/dbraw/zinc/52/33/43/1021523343.db2.gz JNFONUDBFNZYKJ-OAHLLOKOSA-N 1 0 346.456 3.936 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)c(Cl)c1 ZINC000519673849 1021603002 /nfs/dbraw/zinc/60/30/02/1021603002.db2.gz WWWYECZGVHFEKA-NUEKZKHPSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@H]2CCC(F)(F)C2)cc1Br ZINC000602577315 1032995246 /nfs/dbraw/zinc/99/52/46/1032995246.db2.gz RXSBREMIZYBXMY-LURJTMIESA-N 1 0 341.177 3.696 20 5 EHBDRO CCc1nc2c(s1)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCC2 ZINC000090910279 1021694450 /nfs/dbraw/zinc/69/44/50/1021694450.db2.gz JMQPBJYCDUUTTF-CQSZACIVSA-N 1 0 331.441 3.823 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516937611 1021871883 /nfs/dbraw/zinc/87/18/83/1021871883.db2.gz LUAWFUIYGPBPEM-CZUORRHYSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCC[C@H](C(=O)NC(C)C)C2)cc1[N+](=O)[O-] ZINC000124742112 1022570874 /nfs/dbraw/zinc/57/08/74/1022570874.db2.gz SBLZXIAUWRMBIO-XIRDDKMYSA-N 1 0 347.459 3.637 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C1CCC(C)(C)CC1 ZINC000438482656 1022702722 /nfs/dbraw/zinc/70/27/22/1022702722.db2.gz BJSRUNWNDSRHNT-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)[C@H]1CC[N@@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000438498571 1022727631 /nfs/dbraw/zinc/72/76/31/1022727631.db2.gz YFWBLTLOKRLXGT-JSGCOSHPSA-N 1 0 330.388 3.684 20 5 EHBDRO CCC1(CC)CC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000438507905 1022744703 /nfs/dbraw/zinc/74/47/03/1022744703.db2.gz LBMBGYFPYHUHHJ-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc(C[NH2+]C2(Cc3ccccc3)CCOCC2)cc1[N+](=O)[O-] ZINC000449711857 1033086272 /nfs/dbraw/zinc/08/62/72/1033086272.db2.gz FVRCJTWOQATPTQ-UHFFFAOYSA-N 1 0 340.423 3.785 20 5 EHBDRO Cc1c(C[N@H+](CCO)[C@H]2CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510697644 1022902656 /nfs/dbraw/zinc/90/26/56/1022902656.db2.gz IEQQEGLSNQLCNF-FQEVSTJZSA-N 1 0 340.423 3.775 20 5 EHBDRO CN(Cc1csc([N+](=O)[O-])c1)C(C)(C)C[NH+]1CCCCCC1 ZINC000426741787 1023010229 /nfs/dbraw/zinc/01/02/29/1023010229.db2.gz GVEJWUFSFNIPPI-UHFFFAOYSA-N 1 0 325.478 3.743 20 5 EHBDRO CCOc1cccc(CN(Cc2ccc([N+](=O)[O-])cc2)C(C)C)n1 ZINC000507189510 1023182423 /nfs/dbraw/zinc/18/24/23/1023182423.db2.gz VWJNHOCPMRRWHK-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO NC(=O)NC1CC[NH+](Cc2c3ccccc3cc3ccccc32)CC1 ZINC000093051462 1023258895 /nfs/dbraw/zinc/25/88/95/1023258895.db2.gz USOSNQOJEWMKQP-UHFFFAOYSA-N 1 0 333.435 3.626 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000546126938 1023265231 /nfs/dbraw/zinc/26/52/31/1023265231.db2.gz PUTZJQDYMLWPSE-JSGCOSHPSA-N 1 0 333.432 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CC(c3nc4ccccc4s3)C2)cc1 ZINC000535666495 1023451425 /nfs/dbraw/zinc/45/14/25/1023451425.db2.gz UXDFOKJHGZGKKC-UHFFFAOYSA-N 1 0 339.420 3.846 20 5 EHBDRO CCOc1cc(C[NH2+]C2(c3cccc(F)c3)CC2)ccc1[N+](=O)[O-] ZINC000276954624 1023468132 /nfs/dbraw/zinc/46/81/32/1023468132.db2.gz USBUIRDRGHAJOJ-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO COc1ccc(OCC[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000610764373 1023475744 /nfs/dbraw/zinc/47/57/44/1023475744.db2.gz HCSGSJGTQSWUBD-UHFFFAOYSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@H]4COCC[C@@H]43)o2)c1 ZINC000535801270 1023647566 /nfs/dbraw/zinc/64/75/66/1023647566.db2.gz GFPMOJHYYBTBHI-QAPCUYQASA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCOc3c(Cl)cccc32)cc1 ZINC000610811095 1023710667 /nfs/dbraw/zinc/71/06/67/1023710667.db2.gz VHZZRSHRZMFDNH-MRXNPFEDSA-N 1 0 332.787 3.904 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2ccc(F)cc2)C2CCOCC2)c1 ZINC000277069289 1023735172 /nfs/dbraw/zinc/73/51/72/1023735172.db2.gz RCAVQLIFWTXFEQ-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000277086281 1023754460 /nfs/dbraw/zinc/75/44/60/1023754460.db2.gz AXSXTOMMHBHSEZ-KRWDZBQOSA-N 1 0 347.462 3.944 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H](CO)CC1CCCC1 ZINC000511010835 1024433372 /nfs/dbraw/zinc/43/33/72/1024433372.db2.gz KJIDANJTZLISEW-WDSOQIARSA-N 1 0 346.471 3.837 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H](c3cccnc3)C2)ccc1[N+](=O)[O-] ZINC000602857292 1033211280 /nfs/dbraw/zinc/21/12/80/1033211280.db2.gz UGKWJRSKOPWQEH-KRWDZBQOSA-N 1 0 341.411 3.768 20 5 EHBDRO CCOC(=O)C[C@H](C)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319061 1024618708 /nfs/dbraw/zinc/61/87/08/1024618708.db2.gz DGJNAZASLOLAEC-ZDUSSCGKSA-N 1 0 346.383 3.628 20 5 EHBDRO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383927376 1024634187 /nfs/dbraw/zinc/63/41/87/1024634187.db2.gz RZLKOBUNVLYCMS-RDJZCZTQSA-N 1 0 325.412 3.917 20 5 EHBDRO C[C@H]1C[C@@H](O)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000430132981 1024665296 /nfs/dbraw/zinc/66/52/96/1024665296.db2.gz DKTGVSHXAIZFJH-STQMWFEESA-N 1 0 332.425 3.669 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000342293444 1024740266 /nfs/dbraw/zinc/74/02/66/1024740266.db2.gz GLMLJIDRUSTZEU-RCFWFJCLSA-N 1 0 346.814 3.975 20 5 EHBDRO COC1CCC(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)CC1 ZINC000892109531 1024745226 /nfs/dbraw/zinc/74/52/26/1024745226.db2.gz BENRKZWIHZWQLE-UHFFFAOYSA-N 1 0 348.443 3.643 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3C[C@@H]4[C@H](O)CC[C@@H]4C3)s2)cc1 ZINC000895785649 1024830499 /nfs/dbraw/zinc/83/04/99/1024830499.db2.gz ZUKMGJDZOAPXOS-XOKHGSTOSA-N 1 0 344.436 3.526 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000427883240 1024863438 /nfs/dbraw/zinc/86/34/38/1024863438.db2.gz BPXMOPZZBUMRMR-ZDUSSCGKSA-N 1 0 332.375 3.853 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000281308151 1024873885 /nfs/dbraw/zinc/87/38/85/1024873885.db2.gz HUSLGUPQFZAQQS-KRWDZBQOSA-N 1 0 337.419 3.947 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425371669 1024895681 /nfs/dbraw/zinc/89/56/81/1024895681.db2.gz LOIXXGCCCVUSCF-WSGSOLELSA-N 1 0 342.439 3.889 20 5 EHBDRO COc1ccccc1N1CC[C@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000119617344 1025079018 /nfs/dbraw/zinc/07/90/18/1025079018.db2.gz QPKHYCVZTDYLAN-ZBFHGGJFSA-N 1 0 341.411 3.533 20 5 EHBDRO COC(=O)C(C)(C)[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000611322286 1025087520 /nfs/dbraw/zinc/08/75/20/1025087520.db2.gz IQTARADSKNIRTJ-DZGCQCFKSA-N 1 0 334.416 3.567 20 5 EHBDRO CSc1ccc([C@H](C)[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000281557577 1025228637 /nfs/dbraw/zinc/22/86/37/1025228637.db2.gz XYZVMMJEPKWGLS-SJCJKPOMSA-N 1 0 332.425 3.701 20 5 EHBDRO COCC[N@H+](CCOc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000521221372 1025280572 /nfs/dbraw/zinc/28/05/72/1025280572.db2.gz AQSBFJCMRHZKGP-INIZCTEOSA-N 1 0 344.411 3.683 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C2CC(CCO)C2)s1 ZINC000898008230 1033272812 /nfs/dbraw/zinc/27/28/12/1033272812.db2.gz PWNPMKIMBCVIKL-UHFFFAOYSA-N 1 0 332.425 3.574 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000515510213 1025304493 /nfs/dbraw/zinc/30/44/93/1025304493.db2.gz HLSZEEKUGVNTGR-QGZVFWFLSA-N 1 0 344.386 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000438996703 1025381917 /nfs/dbraw/zinc/38/19/17/1025381917.db2.gz PPOLSGIVJKGAMM-FDQGKXFDSA-N 1 0 336.407 3.640 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000119927207 1025435296 /nfs/dbraw/zinc/43/52/96/1025435296.db2.gz PAUMYXIDGBLDIK-CQSZACIVSA-N 1 0 330.388 3.703 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347110864 1025516054 /nfs/dbraw/zinc/51/60/54/1025516054.db2.gz PWQPIYFJYQDLCD-FKEKPDDDSA-N 1 0 341.411 3.570 20 5 EHBDRO Cn1cc(C[NH2+][C@H](c2ccc(F)cc2)C2CCCCC2)c([N+](=O)[O-])n1 ZINC000602966598 1033290464 /nfs/dbraw/zinc/29/04/64/1033290464.db2.gz LDVDYLIWGXEKEZ-KRWDZBQOSA-N 1 0 346.406 3.879 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1c2c(ccc1[N+](=O)[O-])NCC2)c1ccco1 ZINC000436312020 1025574313 /nfs/dbraw/zinc/57/43/13/1025574313.db2.gz LTJSGTPKAABLIG-INIZCTEOSA-N 1 0 344.415 3.651 20 5 EHBDRO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCCC[C@@H]1C ZINC000436311837 1025575293 /nfs/dbraw/zinc/57/52/93/1025575293.db2.gz XVIUJYGWTNQQBW-QWRGUYRKSA-N 1 0 346.353 3.683 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)[C@H](c1ccccc1C)N(C)C ZINC000443001279 1025641386 /nfs/dbraw/zinc/64/13/86/1025641386.db2.gz PSIQZXDWDHEONN-OXJNMPFZSA-N 1 0 341.455 3.993 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)[C@@H](c1ccccc1C)N(C)C ZINC000443001278 1025642762 /nfs/dbraw/zinc/64/27/62/1025642762.db2.gz PSIQZXDWDHEONN-JXFKEZNVSA-N 1 0 341.455 3.993 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425557011 1025725617 /nfs/dbraw/zinc/72/56/17/1025725617.db2.gz VNOWHFQQZBIYKM-KBXCAEBGSA-N 1 0 330.428 3.937 20 5 EHBDRO CC(C)(C)OC(=O)NC1CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC000098214233 1025960257 /nfs/dbraw/zinc/96/02/57/1025960257.db2.gz SBXOFLUZOJPYBP-UHFFFAOYSA-N 1 0 349.431 3.520 20 5 EHBDRO CSc1ccc([C@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338832538 1026213924 /nfs/dbraw/zinc/21/39/24/1026213924.db2.gz MZTLJMAYPDFKDG-INIZCTEOSA-N 1 0 346.456 3.735 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000475144053 1026248058 /nfs/dbraw/zinc/24/80/58/1026248058.db2.gz LAMWTEOTAJOCFO-WBVHZDCISA-N 1 0 333.432 3.646 20 5 EHBDRO COc1ccccc1CCC[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000511127892 1026280903 /nfs/dbraw/zinc/28/09/03/1026280903.db2.gz XRENYHWZXLPIGB-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1-c1nc(-c2ccc(C[NH+](C)C)cc2)no1 ZINC000530871833 1026371820 /nfs/dbraw/zinc/37/18/20/1026371820.db2.gz DRSFSUVCOSJCEC-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000127758558 1026431648 /nfs/dbraw/zinc/43/16/48/1026431648.db2.gz CTDDJLQMPASZQO-UHFFFAOYSA-N 1 0 348.447 3.642 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000540789166 1026471997 /nfs/dbraw/zinc/47/19/97/1026471997.db2.gz MWMVCGJOAUOAOG-PAYONLEZSA-N 1 0 330.428 3.902 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000582526067 1026499732 /nfs/dbraw/zinc/49/97/32/1026499732.db2.gz GXSKEPVLCMAMLE-KRWDZBQOSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)CC1CCC1 ZINC000479555397 1026707290 /nfs/dbraw/zinc/70/72/90/1026707290.db2.gz OOWBPPURTXKPNW-GJZGRUSLSA-N 1 0 338.473 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2Cn2cnc3ccccc32)cc1 ZINC000339905525 1026726182 /nfs/dbraw/zinc/72/61/82/1026726182.db2.gz MGMABUBANYZJQR-KRWDZBQOSA-N 1 0 336.395 3.609 20 5 EHBDRO CC(C)N(C)C[C@@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000562096523 1026758544 /nfs/dbraw/zinc/75/85/44/1026758544.db2.gz HEUIXBDWCXXSOL-JFIYKMOQSA-N 1 0 333.476 3.624 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@H]2[N@H+](C)CCCC2(C)C)cc1[N+](=O)[O-] ZINC001271542699 1026841493 /nfs/dbraw/zinc/84/14/93/1026841493.db2.gz IDABGWASBRMWFE-QGZVFWFLSA-N 1 0 347.459 3.568 20 5 EHBDRO Cc1ccnc(Nc2cccc(CC[NH+]3CCCC3)c2)c1[N+](=O)[O-] ZINC000301917834 1026993975 /nfs/dbraw/zinc/99/39/75/1026993975.db2.gz AYRJKOLAPKJBIJ-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC3CC[NH+](C4CCCC4)CC3)c2c1 ZINC000413165631 1027191344 /nfs/dbraw/zinc/19/13/44/1027191344.db2.gz FEERLUQXLFDBMG-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](Cc1ccccc1)CN(C)C ZINC000531684226 1027211312 /nfs/dbraw/zinc/21/13/12/1027211312.db2.gz FBWYMNPZZCHQKR-WMZOPIPTSA-N 1 0 341.455 3.727 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@@H]([C@@H](O)C(F)(F)F)C1 ZINC000277845604 1027249698 /nfs/dbraw/zinc/24/96/98/1027249698.db2.gz SMMASRNHWLXDDK-YWPYICTPSA-N 1 0 346.349 3.599 20 5 EHBDRO CCOc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccc1O ZINC000459289159 1027312795 /nfs/dbraw/zinc/31/27/95/1027312795.db2.gz BCIBDQUFZFEQQJ-UHFFFAOYSA-N 1 0 342.395 3.864 20 5 EHBDRO CCOc1cc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)ccc1O ZINC000459292498 1027336051 /nfs/dbraw/zinc/33/60/51/1027336051.db2.gz FAGJMAGYSLTMRL-UHFFFAOYSA-N 1 0 342.395 3.864 20 5 EHBDRO Cc1ccc(NC(=O)c2cc([N+](=O)[O-])cc(C)c2F)c(C[NH+](C)C)c1 ZINC000277854553 1027361719 /nfs/dbraw/zinc/36/17/19/1027361719.db2.gz YYZUKSYYGLMMPR-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2sccc2[N+](=O)[O-])CC1 ZINC000611764648 1027399939 /nfs/dbraw/zinc/39/99/39/1027399939.db2.gz TWAOMABXHBCPAZ-UHFFFAOYSA-N 1 0 325.478 3.995 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC3CC[NH+](C4CCC4)CC3)c2c1 ZINC000413313058 1027513232 /nfs/dbraw/zinc/51/32/32/1027513232.db2.gz GWQHTFMSLBCYAD-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000475556006 1027596685 /nfs/dbraw/zinc/59/66/85/1027596685.db2.gz ZRJJDNKSXBPNMV-LSDHHAIUSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC([NH+]3CCCCC3)CC2)ccc1Cl ZINC000268541116 1027693861 /nfs/dbraw/zinc/69/38/61/1027693861.db2.gz GRFFFICLPBALMX-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1cc(Nc2ncccc2[N+](=O)[O-])cnc1N1CCCC[C@@H]1C ZINC000503276367 1027699926 /nfs/dbraw/zinc/69/99/26/1027699926.db2.gz NWDRTGPKDGWYBC-ZDUSSCGKSA-N 1 0 327.388 3.816 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccsc1 ZINC000783598656 1027718381 /nfs/dbraw/zinc/71/83/81/1027718381.db2.gz VLCOCTWTNXKHMZ-HNNXBMFYSA-N 1 0 339.848 3.702 20 5 EHBDRO CCN(CC)C(=O)C1([NH2+]Cc2cccc([N+](=O)[O-])c2C)CCCCC1 ZINC000533383143 1027750222 /nfs/dbraw/zinc/75/02/22/1027750222.db2.gz BTHCBEWCICLAMG-UHFFFAOYSA-N 1 0 347.459 3.564 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCCCCC[NH+]1CCCC1 ZINC000455149691 1027783231 /nfs/dbraw/zinc/78/32/31/1027783231.db2.gz XYGGMMLOOGFXOQ-UHFFFAOYSA-N 1 0 348.447 3.599 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c1 ZINC000422621587 1027825100 /nfs/dbraw/zinc/82/51/00/1027825100.db2.gz YKYTZLNVOUQMCS-UHFFFAOYSA-N 1 0 327.384 3.573 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000178682051 1027871316 /nfs/dbraw/zinc/87/13/16/1027871316.db2.gz UKFYRGGLGSHUPF-MTKIKNGMSA-N 1 0 347.459 3.637 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000420951912 1027917007 /nfs/dbraw/zinc/91/70/07/1027917007.db2.gz RIZWGNORHYERGG-GFCCVEGCSA-N 1 0 332.322 3.768 20 5 EHBDRO O=[N+]([O-])c1cccc(N2CC[NH+](C[C@@H]3CCCC(F)(F)C3)CC2)c1 ZINC000513973418 1027967745 /nfs/dbraw/zinc/96/77/45/1027967745.db2.gz WBEBOXIBZAOXLY-CQSZACIVSA-N 1 0 339.386 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCCO3)o2)c(Cl)c1 ZINC000237816296 1028066877 /nfs/dbraw/zinc/06/68/77/1028066877.db2.gz GNWYAQUDWJKXAO-GFCCVEGCSA-N 1 0 336.775 3.777 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]CC2CCC(F)(F)CC2)n1 ZINC000503954302 1028261449 /nfs/dbraw/zinc/26/14/49/1028261449.db2.gz VEQBIYSSVUKBLE-ZIAGYGMSSA-N 1 0 342.390 3.690 20 5 EHBDRO CC(C)[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCC1 ZINC000444774559 1028263270 /nfs/dbraw/zinc/26/32/70/1028263270.db2.gz JOTANCZXHJUJEX-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1ccc(NC(=O)c2cc([N+](=O)[O-])c(C)cc2C)c(C[NH+](C)C)c1 ZINC000421463054 1028438773 /nfs/dbraw/zinc/43/87/73/1028438773.db2.gz DIINHRKFCWFNLD-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO CC[C@H](CC(F)(F)F)[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000546268340 1028456780 /nfs/dbraw/zinc/45/67/80/1028456780.db2.gz WPDJZFDDLKTYFX-GHMZBOCLSA-N 1 0 347.337 3.633 20 5 EHBDRO COc1cc(F)c([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178734359 1028477606 /nfs/dbraw/zinc/47/76/06/1028477606.db2.gz QRHKWQNMPCUJRR-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2CCc3cc(Cl)ccc32)c1 ZINC000749694685 1028520483 /nfs/dbraw/zinc/52/04/83/1028520483.db2.gz XYQPBLYJLNIXMM-IRXDYDNUSA-N 1 0 332.787 3.559 20 5 EHBDRO CCC[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)CC(C)(C)O ZINC000513751074 1028550074 /nfs/dbraw/zinc/55/00/74/1028550074.db2.gz VZAHEROHLYXVSC-UHFFFAOYSA-N 1 0 332.400 3.838 20 5 EHBDRO C[N@H+](CCCCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CC1 ZINC000583029556 1028592797 /nfs/dbraw/zinc/59/27/97/1028592797.db2.gz UVGVCLYAVUVATF-OAHLLOKOSA-N 1 0 345.365 3.662 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(c2ccccc2F)CC1 ZINC000524080654 1028840110 /nfs/dbraw/zinc/84/01/10/1028840110.db2.gz XESGOHGLDVMAIR-UHFFFAOYSA-N 1 0 344.386 3.992 20 5 EHBDRO Cc1c(CNC(=O)CC[C@H]([NH3+])CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000424177056 1028851753 /nfs/dbraw/zinc/85/17/53/1028851753.db2.gz TXXSPYLZRVUNQX-KRWDZBQOSA-N 1 0 347.459 3.597 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCOc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000504899703 1029042681 /nfs/dbraw/zinc/04/26/81/1029042681.db2.gz KREMBSNONXPZEH-ZDUSSCGKSA-N 1 0 348.374 3.862 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)C2CCOCC2)cc1[N+](=O)[O-] ZINC000504918770 1029042992 /nfs/dbraw/zinc/04/29/92/1029042992.db2.gz IPDWGOHTSZZCIF-BBRMVZONSA-N 1 0 336.432 3.849 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)c1ccccc1 ZINC000504919524 1029044398 /nfs/dbraw/zinc/04/43/98/1029044398.db2.gz KTBSIYZADHUFGO-HZPDHXFCSA-N 1 0 346.452 3.789 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000269027662 1029070138 /nfs/dbraw/zinc/07/01/38/1029070138.db2.gz QXRYASWIBPZQOF-MRXNPFEDSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000504926343 1029072803 /nfs/dbraw/zinc/07/28/03/1029072803.db2.gz IFXOJFJNEITEKA-XHSDSOJGSA-N 1 0 349.475 3.765 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCCC2(CCCC2)C1 ZINC000445850243 1029187158 /nfs/dbraw/zinc/18/71/58/1029187158.db2.gz RPOHDJODEDWZQV-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO C[N@@H+]1C[C@@H]2CCCN(C(=O)c3cc4ccccc4c4cccnc34)[C@@H]2C1 ZINC000425061020 1029512671 /nfs/dbraw/zinc/51/26/71/1029512671.db2.gz XKMRKHGZBGOBFE-OXJNMPFZSA-N 1 0 345.446 3.554 20 5 EHBDRO CCc1oc2ccccc2c1C[N@H+](C)CCn1c(C)ncc1[N+](=O)[O-] ZINC000611766586 1029729673 /nfs/dbraw/zinc/72/96/73/1029729673.db2.gz JGJVAOFIXMLOBB-UHFFFAOYSA-N 1 0 342.399 3.540 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN(C[C@H]2CCCO2)C2CCCC2)c(F)c1 ZINC000509686681 1029765045 /nfs/dbraw/zinc/76/50/45/1029765045.db2.gz RQFZJGJQUVCAEM-CQSZACIVSA-N 1 0 340.370 3.797 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000481739427 1029898588 /nfs/dbraw/zinc/89/85/88/1029898588.db2.gz GJLNGMZJFOPVML-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CO[C@H]1CCCC[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000441191659 1029916346 /nfs/dbraw/zinc/91/63/46/1029916346.db2.gz FGTGVOCDVWLBHV-YJBOKZPZSA-N 1 0 330.384 3.902 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(C)c1 ZINC000453279896 1030020491 /nfs/dbraw/zinc/02/04/91/1030020491.db2.gz FLTINEBXTACFPR-OAHLLOKOSA-N 1 0 331.441 3.959 20 5 EHBDRO C[C@@H](CCCO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453285219 1030027457 /nfs/dbraw/zinc/02/74/57/1030027457.db2.gz WVYKEESVEKHGQE-KXBFYZLASA-N 1 0 328.412 3.682 20 5 EHBDRO C[C@H](CCCO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453285214 1030028118 /nfs/dbraw/zinc/02/81/18/1030028118.db2.gz WVYKEESVEKHGQE-BEFAXECRSA-N 1 0 328.412 3.682 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272911 1030038228 /nfs/dbraw/zinc/03/82/28/1030038228.db2.gz VXJHWFBFDQRZTJ-ZWNOBZJWSA-N 1 0 338.795 3.778 20 5 EHBDRO C[C@@H](CC(C)(C)O)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325780 1030109297 /nfs/dbraw/zinc/10/92/97/1030109297.db2.gz RQJFXFMWAADXJG-KBXCAEBGSA-N 1 0 328.412 3.823 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453375877 1030197095 /nfs/dbraw/zinc/19/70/95/1030197095.db2.gz XNCMQKFMPIDPRC-OWQGQXMQSA-N 1 0 327.384 3.561 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(Cl)cc2)n1 ZINC000447514332 1030260028 /nfs/dbraw/zinc/26/00/28/1030260028.db2.gz DCSXYYWCNVYINL-HUUCEWRRSA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)cc2)n1 ZINC000447514333 1030260235 /nfs/dbraw/zinc/26/02/35/1030260235.db2.gz DCSXYYWCNVYINL-LSDHHAIUSA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccc(Cl)cc2)n1 ZINC000447514330 1030260484 /nfs/dbraw/zinc/26/04/84/1030260484.db2.gz DCSXYYWCNVYINL-CABCVRRESA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]Cc2ccc(Cl)cc2)n1 ZINC000447514331 1030260702 /nfs/dbraw/zinc/26/07/02/1030260702.db2.gz DCSXYYWCNVYINL-GJZGRUSLSA-N 1 0 334.807 3.718 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1F ZINC000447535828 1030271997 /nfs/dbraw/zinc/27/19/97/1030271997.db2.gz IRTNWQOHTKQGDF-HOTGVXAUSA-N 1 0 332.379 3.512 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)C(=O)N[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000245870655 1030274300 /nfs/dbraw/zinc/27/43/00/1030274300.db2.gz LBOPCOLJZKIQAC-JWDQPFGJSA-N 1 0 347.459 3.637 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(c3ccc(O)cc3)CC2)cc1 ZINC000052467495 1030280597 /nfs/dbraw/zinc/28/05/97/1030280597.db2.gz YQNJHDLYYLDSIL-UHFFFAOYSA-N 1 0 326.396 3.723 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447563187 1030308167 /nfs/dbraw/zinc/30/81/67/1030308167.db2.gz OUDBPZCWIVUAPM-XLIONFOSSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3(O)CCCCC3)o2)c1 ZINC000171052222 1030569565 /nfs/dbraw/zinc/56/95/65/1030569565.db2.gz DHJVIAOLVICPBW-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000160181413 1030583426 /nfs/dbraw/zinc/58/34/26/1030583426.db2.gz MDCOSCLJTGQOAN-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2c(c1)OCO2 ZINC000527039100 1030587034 /nfs/dbraw/zinc/58/70/34/1030587034.db2.gz UJVHGEIZDHQGBT-ZROIWOOFSA-N 1 0 340.379 3.559 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H](CO)C1CCCCC1)C1CC1 ZINC000550896274 1030776521 /nfs/dbraw/zinc/77/65/21/1030776521.db2.gz ZUYXWATZUTWYJH-RTBURBONSA-N 1 0 346.471 3.694 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCC[C@@H]1O ZINC000537687565 1030981468 /nfs/dbraw/zinc/98/14/68/1030981468.db2.gz HYTDQOLQYIBJPM-PBHICJAKSA-N 1 0 346.452 3.916 20 5 EHBDRO C[C@@H](O)C[C@H]1CCCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000448360661 1030985424 /nfs/dbraw/zinc/98/54/24/1030985424.db2.gz CORVCHKFCXLNDS-RHSMWYFYSA-N 1 0 344.411 3.980 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000537695046 1031082379 /nfs/dbraw/zinc/08/23/79/1031082379.db2.gz WKPYBIAGIZHFQK-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1c(C)cc(CO)cc1C ZINC000903303296 1031329195 /nfs/dbraw/zinc/32/91/95/1031329195.db2.gz OEXZSMBZIQZGMU-AWEZNQCLSA-N 1 0 344.411 3.563 20 5 EHBDRO Cc1c(NC(=O)NC[C@H]2CCCC[N@H+]2CC(C)C)cccc1[N+](=O)[O-] ZINC000483874487 1031386623 /nfs/dbraw/zinc/38/66/23/1031386623.db2.gz VNQRSFRJJZENTI-OAHLLOKOSA-N 1 0 348.447 3.535 20 5 EHBDRO COc1ccc2c(c1)OC[C@@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000537946249 1032053191 /nfs/dbraw/zinc/05/31/91/1032053191.db2.gz WCIFIMXJFHWAOJ-BBRMVZONSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](Cc2nccs2)C1 ZINC000898071952 1033325174 /nfs/dbraw/zinc/32/51/74/1033325174.db2.gz VNRSXUGSAJGJDY-LYKUJDHUSA-N 1 0 329.425 3.629 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1cccs1 ZINC000063482990 1033389661 /nfs/dbraw/zinc/38/96/61/1033389661.db2.gz RRUCEJHFEVXLRK-UHFFFAOYSA-N 1 0 347.440 3.815 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494519 1033396188 /nfs/dbraw/zinc/39/61/88/1033396188.db2.gz CAMYCALXMKLKBS-HZMBPMFUSA-N 1 0 338.367 3.515 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000594500299 1033402667 /nfs/dbraw/zinc/40/26/67/1033402667.db2.gz MNTBXMBAMVWNGJ-HZPDHXFCSA-N 1 0 328.343 3.835 20 5 EHBDRO Cc1nn(C[N@@H+](C)C[C@@H](C)c2ccccc2)c2cc([N+](=O)[O-])ccc12 ZINC000761291553 1033549625 /nfs/dbraw/zinc/54/96/25/1033549625.db2.gz UTPPTUHRNUMZQV-CQSZACIVSA-N 1 0 338.411 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH2+][C@@H]2CCc3ccccc32)c1 ZINC000594972770 1033577705 /nfs/dbraw/zinc/57/77/05/1033577705.db2.gz JFPDYSHOGMJOFP-OAHLLOKOSA-N 1 0 334.322 3.973 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CCC[C@H]3C[C@H]32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594974834 1033581358 /nfs/dbraw/zinc/58/13/58/1033581358.db2.gz KGZVYUIXHUGNDG-RLFYNMQTSA-N 1 0 340.427 3.521 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1ccccc1[N+](=O)[O-] ZINC000594936931 1033586104 /nfs/dbraw/zinc/58/61/04/1033586104.db2.gz YCSNGXBBSBXQGJ-WMLDXEAASA-N 1 0 342.395 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@H]3Cc4cc(Cl)ccc4[C@@H]23)c(F)c1 ZINC000598986701 1033611955 /nfs/dbraw/zinc/61/19/55/1033611955.db2.gz LGUGKOLKKOXONM-USXIJHARSA-N 1 0 332.762 3.815 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595022754 1033614945 /nfs/dbraw/zinc/61/49/45/1033614945.db2.gz VHVQLVXHSXLFLA-YVEFUNNKSA-N 1 0 342.395 3.950 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(Cl)ccc4[C@@H]32)cc1[N+](=O)[O-] ZINC000598989937 1033617105 /nfs/dbraw/zinc/61/71/05/1033617105.db2.gz WODLADYAPNQREC-FHLIZLRMSA-N 1 0 344.798 3.685 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000595003160 1033628559 /nfs/dbraw/zinc/62/85/59/1033628559.db2.gz FKWJXWFHEUCCAW-KBXCAEBGSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595008498 1033630907 /nfs/dbraw/zinc/63/09/07/1033630907.db2.gz VBNZCCVUMJLFND-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cccnc2N2CCCC2)cc1[N+](=O)[O-] ZINC000595063005 1033641812 /nfs/dbraw/zinc/64/18/12/1033641812.db2.gz BSNRUTGMHHVENJ-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CO[C@H](C3CC3)C2)o1 ZINC000599006854 1033642445 /nfs/dbraw/zinc/64/24/45/1033642445.db2.gz LNXHIIRFKQMHOX-ACJLOTCBSA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)COc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000595072775 1033646116 /nfs/dbraw/zinc/64/61/16/1033646116.db2.gz QOPVEJWVYZVXLI-NWDGAFQWSA-N 1 0 336.338 3.991 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC)c1c(C)nn(C)c1C ZINC000595027283 1033648372 /nfs/dbraw/zinc/64/83/72/1033648372.db2.gz RCFNLXUZXYPLGE-MEDUHNTESA-N 1 0 346.431 3.756 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCc3cc(Cl)ccc32)c([N+](=O)[O-])cc1O ZINC000598996623 1033649131 /nfs/dbraw/zinc/64/91/31/1033649131.db2.gz VQAVHWANUSHWIQ-CQSZACIVSA-N 1 0 348.786 3.740 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000595032287 1033652392 /nfs/dbraw/zinc/65/23/92/1033652392.db2.gz MCIYFACWUPUEPL-CABCVRRESA-N 1 0 335.448 3.519 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCO[C@H](C(C)(C)C)C1 ZINC000595035517 1033656202 /nfs/dbraw/zinc/65/62/02/1033656202.db2.gz LCQJPOOKKPIQDM-AHIWAGSCSA-N 1 0 336.432 3.848 20 5 EHBDRO Cn1ncc(C2CCC2)c1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595101603 1033689519 /nfs/dbraw/zinc/68/95/19/1033689519.db2.gz XIYYKHZGUQYEAU-GOSISDBHSA-N 1 0 340.427 3.763 20 5 EHBDRO O=[N+]([O-])c1c(NCCCCC[NH+]2CCCC2)ccc2cnccc21 ZINC000599087186 1033726073 /nfs/dbraw/zinc/72/60/73/1033726073.db2.gz XRXJIFHAVXHQLZ-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599094659 1033731061 /nfs/dbraw/zinc/73/10/61/1033731061.db2.gz XKEPDUOLVVCCGR-XIKOKIGWSA-N 1 0 327.384 3.800 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595340899 1033732222 /nfs/dbraw/zinc/73/22/22/1033732222.db2.gz YNGPCEUNNPKQLO-SFHVURJKSA-N 1 0 329.400 3.736 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](CCc3cccs3)CC2)cc1 ZINC000174245120 1033850072 /nfs/dbraw/zinc/85/00/72/1033850072.db2.gz QQRVVIHTPNCZEW-UHFFFAOYSA-N 1 0 332.425 3.742 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccnc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000599349376 1033884984 /nfs/dbraw/zinc/88/49/84/1033884984.db2.gz HDVBICMBTDHUSF-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)C1 ZINC000046934147 1033894776 /nfs/dbraw/zinc/89/47/76/1033894776.db2.gz YTTKYRGZUUVAED-CYBMUJFWSA-N 1 0 343.383 3.672 20 5 EHBDRO C[NH+](C)C1(CNc2ccc3ncccc3c2[N+](=O)[O-])CCCCC1 ZINC000603837574 1033961656 /nfs/dbraw/zinc/96/16/56/1033961656.db2.gz TTWTZUQEYLEJSI-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CC[N@H+](CCOc1cccc([N+](=O)[O-])c1)Cc1ccc(OC)cc1 ZINC000603855033 1033980279 /nfs/dbraw/zinc/98/02/79/1033980279.db2.gz ZYTDPNPREXZJHD-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO COc1ccccc1C[N@H+](CCOc1cccc([N+](=O)[O-])c1)C1CC1 ZINC000603857625 1033981140 /nfs/dbraw/zinc/98/11/40/1033981140.db2.gz IBBOZIUMYYYUDH-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CCOc1cc(C[NH+]2CCC([C@H]3CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000595782274 1033995737 /nfs/dbraw/zinc/99/57/37/1033995737.db2.gz IPZIYZPRLOUPNQ-GOSISDBHSA-N 1 0 348.443 3.775 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1[C@@H]2CC[C@H]1CC(C)C2 ZINC000595856398 1034010128 /nfs/dbraw/zinc/01/01/28/1034010128.db2.gz BWGNLJJOSXVNAC-AHBJDQSVSA-N 1 0 342.399 3.969 20 5 EHBDRO O=[N+]([O-])c1ncccc1Nc1ccc(CC[NH+]2CCCCC2)cc1 ZINC000603942715 1034058531 /nfs/dbraw/zinc/05/85/31/1034058531.db2.gz MKDOXPKSHLNPMX-UHFFFAOYSA-N 1 0 326.400 3.762 20 5 EHBDRO CCC[NH+]1CCC(Nc2cc(OC)c([N+](=O)[O-])cc2Cl)CC1 ZINC000596062277 1034066938 /nfs/dbraw/zinc/06/69/38/1034066938.db2.gz ORYVLANUVMRLKF-UHFFFAOYSA-N 1 0 327.812 3.543 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688046 1034115764 /nfs/dbraw/zinc/11/57/64/1034115764.db2.gz BNGUZGQGSJRJAW-HSWBROFVSA-N 1 0 342.399 3.823 20 5 EHBDRO CN(c1ccc(C(F)(F)F)c([N+](=O)[O-])c1)C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000596231515 1034130032 /nfs/dbraw/zinc/13/00/32/1034130032.db2.gz KGRBSPAWLPWZGL-QYJAPNMZSA-N 1 0 343.349 3.675 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(F)cc1F ZINC000604012656 1034134959 /nfs/dbraw/zinc/13/49/59/1034134959.db2.gz ZJADYPNYLYTPMI-UHFFFAOYSA-N 1 0 336.338 3.774 20 5 EHBDRO CC[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC)cc1 ZINC000604013397 1034137545 /nfs/dbraw/zinc/13/75/45/1034137545.db2.gz GVUAEQNJDHJTRQ-UHFFFAOYSA-N 1 0 344.411 3.894 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CC[N@@H+](C(C)(C)C)C2)c([N+](=O)[O-])c1 ZINC000596307890 1034163810 /nfs/dbraw/zinc/16/38/10/1034163810.db2.gz QDUZMCHGAHCXLB-ZDUSSCGKSA-N 1 0 333.432 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NC[C@H]1CCC[N@H+](CC2CC2)C1 ZINC000596569740 1034292246 /nfs/dbraw/zinc/29/22/46/1034292246.db2.gz DMABIKMGFMDNKH-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@H](NC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000450413040 1034298595 /nfs/dbraw/zinc/29/85/95/1034298595.db2.gz SKMDWINSCADWGZ-KSSFIOAISA-N 1 0 345.443 3.569 20 5 EHBDRO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCC[C@@H](C)C1 ZINC000229718874 1034370648 /nfs/dbraw/zinc/37/06/48/1034370648.db2.gz PYRIPQLZTJNOGG-VXGBXAGGSA-N 1 0 334.445 3.737 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174577 1034378417 /nfs/dbraw/zinc/37/84/17/1034378417.db2.gz IUNWSAUQCFZRMA-CZUORRHYSA-N 1 0 330.359 3.948 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000604435881 1034379254 /nfs/dbraw/zinc/37/92/54/1034379254.db2.gz CJFQXNNXBGLRGE-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO COC[C@@H](C)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000604451704 1034390562 /nfs/dbraw/zinc/39/05/62/1034390562.db2.gz LFTORMIHTLORCX-ZDUSSCGKSA-N 1 0 348.374 3.898 20 5 EHBDRO Cc1c(NC(=O)NCC(C)(C)[N@@H+]2CCC[C@@H](C)C2)cccc1[N+](=O)[O-] ZINC000054355513 1034410821 /nfs/dbraw/zinc/41/08/21/1034410821.db2.gz QHPOIARBYBJAJR-CYBMUJFWSA-N 1 0 348.447 3.535 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H]([C@H]2CCCCO2)C1 ZINC000597225036 1034625212 /nfs/dbraw/zinc/62/52/12/1034625212.db2.gz LXIGQLRSVOSRPP-MGFNVVHASA-N 1 0 330.428 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000177148083 1034697254 /nfs/dbraw/zinc/69/72/54/1034697254.db2.gz ABBLYWBAWVSBJK-SFHVURJKSA-N 1 0 344.386 3.568 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)[C@H](C)c2ccccc2)cc1[N+](=O)[O-] ZINC000450675297 1034702331 /nfs/dbraw/zinc/70/23/31/1034702331.db2.gz CRZRAQQPLWHZBE-VCBZYWHSSA-N 1 0 328.412 3.718 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@H]2C12CCCC2 ZINC000450855967 1034898782 /nfs/dbraw/zinc/89/87/82/1034898782.db2.gz HVIKTAVNEREGBC-FVQBIDKESA-N 1 0 336.819 3.686 20 5 EHBDRO Cc1ccccc1C(C)(C)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000411767644 1035013978 /nfs/dbraw/zinc/01/39/78/1035013978.db2.gz ONXOMJIYINFPPE-UHFFFAOYSA-N 1 0 341.411 3.757 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](c3ccncc3)C2)ccc1[N+](=O)[O-] ZINC000451007156 1035024743 /nfs/dbraw/zinc/02/47/43/1035024743.db2.gz SQDBNSHQAHRVLN-QGZVFWFLSA-N 1 0 341.411 3.768 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@H]1CCO[C@@H]1c1ccccc1 ZINC000431658607 1035025068 /nfs/dbraw/zinc/02/50/68/1035025068.db2.gz BVUXOFYMHCNYLV-IEBWSBKVSA-N 1 0 326.396 3.771 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCOC3(CCCCC3)C2)cc1[N+](=O)[O-] ZINC000136749625 1035086777 /nfs/dbraw/zinc/08/67/77/1035086777.db2.gz OUZWHQAKZDFADF-OAHLLOKOSA-N 1 0 334.416 3.575 20 5 EHBDRO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)N1CCCCCCC1 ZINC000003538922 1035397477 /nfs/dbraw/zinc/39/74/77/1035397477.db2.gz SOLMLAAQCPSESB-GFCCVEGCSA-N 1 0 339.823 3.841 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000511428220 1035402524 /nfs/dbraw/zinc/40/25/24/1035402524.db2.gz WUZRFLHKZIKKQO-OAHLLOKOSA-N 1 0 328.412 3.844 20 5 EHBDRO Cn1cc(C[N@@H+]2CC(C)(C)[C@@H]2C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000580655304 1035446490 /nfs/dbraw/zinc/44/64/90/1035446490.db2.gz FFNWWEVGUCISAO-SFHVURJKSA-N 1 0 340.427 3.616 20 5 EHBDRO CC(C)[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CS1 ZINC000581039229 1035465907 /nfs/dbraw/zinc/46/59/07/1035465907.db2.gz QMUNJOTYZUOLMT-CXAGYDPISA-N 1 0 333.457 3.738 20 5 EHBDRO C[C@H]([NH2+]C1CCN(Cc2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000122129240 1035594620 /nfs/dbraw/zinc/59/46/20/1035594620.db2.gz OKVNABLJFOSDOT-INIZCTEOSA-N 1 0 339.439 3.910 20 5 EHBDRO CC[N@H+](CCc1cccs1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463517940 1035596151 /nfs/dbraw/zinc/59/61/51/1035596151.db2.gz ZOVXGQUFBMMQHI-UHFFFAOYSA-N 1 0 338.404 3.869 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[N@@H+]3CCCC[C@@H]3C)C2)c1 ZINC000540906904 1035787153 /nfs/dbraw/zinc/78/71/53/1035787153.db2.gz AJWCMXNXBDGEAW-HOTGVXAUSA-N 1 0 347.459 3.694 20 5 EHBDRO CCOc1cc(C[N@H+](C)C2Cc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000492460276 1035843312 /nfs/dbraw/zinc/84/33/12/1035843312.db2.gz IHRZVKNBNYJMRJ-UHFFFAOYSA-N 1 0 326.396 3.593 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492510719 1035921233 /nfs/dbraw/zinc/92/12/33/1035921233.db2.gz HYUZUTOLYGEGJX-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO Cc1c(C[N@H+](Cc2ccccc2)[C@@H](CO)C2CC2)cccc1[N+](=O)[O-] ZINC000535091575 1036016502 /nfs/dbraw/zinc/01/65/02/1036016502.db2.gz FYFVCLQVJAQYRW-FQEVSTJZSA-N 1 0 340.423 3.676 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@](C)(O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000156968718 1036115103 /nfs/dbraw/zinc/11/51/03/1036115103.db2.gz ILJVOLLIARSDEQ-NVXWUHKLSA-N 1 0 334.441 3.995 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687389 1036246240 /nfs/dbraw/zinc/24/62/40/1036246240.db2.gz JCIPZARFMLWMOV-KXBFYZLASA-N 1 0 328.412 3.938 20 5 EHBDRO CC(C)c1ccc(CN2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC000589188632 1036296631 /nfs/dbraw/zinc/29/66/31/1036296631.db2.gz DPHTWEYOGBJMSA-RDJZCZTQSA-N 1 0 331.460 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(O)cc2)CC2CC2)c(F)c1 ZINC000589196622 1036303456 /nfs/dbraw/zinc/30/34/56/1036303456.db2.gz OWDRHDCWAMOIBM-UHFFFAOYSA-N 1 0 330.359 3.852 20 5 EHBDRO CC1(C)CCC[N@@H+]1CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572652669 1036447989 /nfs/dbraw/zinc/44/79/89/1036447989.db2.gz ZLRXOYDDGHDSML-CQSZACIVSA-N 1 0 345.365 3.662 20 5 EHBDRO CC(C)[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000045471145 1036448318 /nfs/dbraw/zinc/44/83/18/1036448318.db2.gz VFKTYRODIHMAEF-GOSISDBHSA-N 1 0 345.374 3.659 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](Cc1ccccc1)C1CC1 ZINC000541569755 1036461112 /nfs/dbraw/zinc/46/11/12/1036461112.db2.gz OOCZQVPYBPZEDI-SFHVURJKSA-N 1 0 326.396 3.714 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccsc2[N+](=O)[O-])cc1 ZINC000609132857 1036468689 /nfs/dbraw/zinc/46/86/89/1036468689.db2.gz XGUANIQIGIVYSO-UHFFFAOYSA-N 1 0 335.429 3.599 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@@H](n2cc(Cl)cn2)C1 ZINC000589519801 1036489028 /nfs/dbraw/zinc/48/90/28/1036489028.db2.gz ANUWUELLRUGZPY-SDSFWRRZSA-N 1 0 346.818 3.795 20 5 EHBDRO CC(C)[C@H](O)CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050285 1036580137 /nfs/dbraw/zinc/58/01/37/1036580137.db2.gz BKIQFWBDZJERCU-MOPGFXCFSA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1cnc(NCc2cccc(C[NH+]3CCCC3)c2)c(Cl)c1 ZINC000122615295 1036683179 /nfs/dbraw/zinc/68/31/79/1036683179.db2.gz IZCIPHFDRHWGQH-UHFFFAOYSA-N 1 0 346.818 3.851 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cncn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000152782579 1036723205 /nfs/dbraw/zinc/72/32/05/1036723205.db2.gz GLRDWIAFUSYIBO-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO CC(C)[N@H+](C)CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180394284 1036771070 /nfs/dbraw/zinc/77/10/70/1036771070.db2.gz MVMNGRUFWJNPHU-LJQANCHMSA-N 1 0 327.428 3.614 20 5 EHBDRO CC(C)(C)Oc1cc(N2CC[C@@H](C[NH+]3CCCC3)C2)ccc1[N+](=O)[O-] ZINC000590135972 1036786511 /nfs/dbraw/zinc/78/65/11/1036786511.db2.gz IKUSUOQKBRZUON-HNNXBMFYSA-N 1 0 347.459 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cccc(O)c3Cl)c2c1 ZINC000590192463 1036792779 /nfs/dbraw/zinc/79/27/79/1036792779.db2.gz AZXSFKKPOPEPME-UHFFFAOYSA-N 1 0 345.786 3.767 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2CCCc2ccccc2)n1 ZINC000443637417 1036913077 /nfs/dbraw/zinc/91/30/77/1036913077.db2.gz IYBLFRPPGGQMPV-SFHVURJKSA-N 1 0 342.443 3.669 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000249777560 1036924255 /nfs/dbraw/zinc/92/42/55/1036924255.db2.gz CJIMKUAUUMBZER-MLGOLLRUSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CCC(OC(F)F)CC1 ZINC000590662247 1036996051 /nfs/dbraw/zinc/99/60/51/1036996051.db2.gz FRWFVAVNIFLYKC-HWKANZROSA-N 1 0 326.343 3.748 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOC(C)(C)C ZINC000539625284 1036999967 /nfs/dbraw/zinc/99/99/67/1036999967.db2.gz MEJGVIXRXVLJOX-ZDUSSCGKSA-N 1 0 326.462 3.870 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2cccc(-n3ccnc3)c2)cccc1[N+](=O)[O-] ZINC000180645838 1037036005 /nfs/dbraw/zinc/03/60/05/1037036005.db2.gz HHVWGSZXOVECPZ-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1nc(C)c(C)s1 ZINC000595021078 1037153681 /nfs/dbraw/zinc/15/36/81/1037153681.db2.gz OYIZFEOHHHSZIC-NSHDSACASA-N 1 0 335.429 3.570 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H](c1ccccc1)c1ccccn1 ZINC000493279386 1037214486 /nfs/dbraw/zinc/21/44/86/1037214486.db2.gz YLMCVQXNCPTWLI-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000595046633 1037215802 /nfs/dbraw/zinc/21/58/02/1037215802.db2.gz LWBSDNQSYONQCE-DZGCQCFKSA-N 1 0 334.416 3.746 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@H](C2CCC2)C1 ZINC000591061790 1037223680 /nfs/dbraw/zinc/22/36/80/1037223680.db2.gz IJRZIFUAFMCBLT-WFASDCNBSA-N 1 0 342.399 3.828 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOC[C@@H]3C3CC3)s2)cc1 ZINC000539818357 1037239931 /nfs/dbraw/zinc/23/99/31/1037239931.db2.gz XEPAFFHOCNSBKM-QGZVFWFLSA-N 1 0 344.436 3.934 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCCN(CC(C)(C)C)C2=O)cc1[N+](=O)[O-] ZINC000460674027 1037362293 /nfs/dbraw/zinc/36/22/93/1037362293.db2.gz RJZMWUJXIRWDQV-GDBMZVCRSA-N 1 0 347.459 3.591 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072491911 1037426253 /nfs/dbraw/zinc/42/62/53/1037426253.db2.gz QRUQBWLIZJBVBL-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@](C)(OC)C1CC1 ZINC000462807044 1037426394 /nfs/dbraw/zinc/42/63/94/1037426394.db2.gz KZVGYELDVYRAKT-WMLDXEAASA-N 1 0 338.473 3.870 20 5 EHBDRO CCOC[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C(C)C ZINC000188869447 1037521354 /nfs/dbraw/zinc/52/13/54/1037521354.db2.gz WQLGHYNZBCRVOB-MRXNPFEDSA-N 1 0 349.456 3.869 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462921742 1037563059 /nfs/dbraw/zinc/56/30/59/1037563059.db2.gz JERSJMKSUIRRMG-GFCCVEGCSA-N 1 0 343.374 3.873 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1F ZINC000181354283 1037568663 /nfs/dbraw/zinc/56/86/63/1037568663.db2.gz WXZFUJICNWXSQN-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](c2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000491596731 1037575554 /nfs/dbraw/zinc/57/55/54/1037575554.db2.gz NJJRJIGRNBMUHV-SFHVURJKSA-N 1 0 327.384 3.629 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000532553302 1037609245 /nfs/dbraw/zinc/60/92/45/1037609245.db2.gz YRQVJPCGSZUNOF-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@H]1CCCC[C@H]1O)C1CC1 ZINC000540159599 1037617696 /nfs/dbraw/zinc/61/76/96/1037617696.db2.gz ALEURVDILDGAKT-IMFGXOCKSA-N 1 0 346.471 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCSc3ccccc32)cc1 ZINC000540168318 1037635845 /nfs/dbraw/zinc/63/58/45/1037635845.db2.gz IVRUIDAKCQQNMF-MRXNPFEDSA-N 1 0 330.409 3.800 20 5 EHBDRO COc1cncc(/C=C/CC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000592122785 1037836137 /nfs/dbraw/zinc/83/61/37/1037836137.db2.gz PFSAAINEZICWHP-SOFGYWHQSA-N 1 0 341.411 3.927 20 5 EHBDRO CCOc1cc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000897464864 1037873461 /nfs/dbraw/zinc/87/34/61/1037873461.db2.gz PMSNCGLXTZPIMC-CYBMUJFWSA-N 1 0 330.384 3.592 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(CO)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000592392986 1037934942 /nfs/dbraw/zinc/93/49/42/1037934942.db2.gz NVUALNBZLNFSMQ-GOSISDBHSA-N 1 0 326.396 3.599 20 5 EHBDRO CC[N@H+](CCSC)Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000592202977 1037946639 /nfs/dbraw/zinc/94/66/39/1037946639.db2.gz UHLIKGPNPAROJF-UHFFFAOYSA-N 1 0 333.251 3.542 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@@H]3CC[C@@H]4C[C@@H]4C3)cs2)c1 ZINC000592378781 1037948358 /nfs/dbraw/zinc/94/83/58/1037948358.db2.gz CVHLWTFQYWLXRQ-MRVWCRGKSA-N 1 0 329.425 3.997 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C(C)C)C2CCCC2)cc1[N+](=O)[O-] ZINC000540476004 1037982598 /nfs/dbraw/zinc/98/25/98/1037982598.db2.gz GZQQXFVZHUTTCS-HNNXBMFYSA-N 1 0 347.459 3.733 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCOCC2CC2)c2ccccc2)c1 ZINC000492122230 1038004426 /nfs/dbraw/zinc/00/44/26/1038004426.db2.gz KLOUHMTWAAJBLF-LJQANCHMSA-N 1 0 326.396 3.700 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CC2(C[C@@H]1C)CCOCC2 ZINC000592529434 1038028614 /nfs/dbraw/zinc/02/86/14/1038028614.db2.gz ZIRDBJVHHPMVQO-KMPOOHAWSA-N 1 0 330.428 3.889 20 5 EHBDRO Cc1nn(C(C)C)cc1C[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000341395774 1038121851 /nfs/dbraw/zinc/12/18/51/1038121851.db2.gz GJXYZBIXHYTOMD-UHFFFAOYSA-N 1 0 330.432 3.793 20 5 EHBDRO C[C@@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]C1(c2ccccc2)CC1 ZINC000538523061 1038343200 /nfs/dbraw/zinc/34/32/00/1038343200.db2.gz DILJFCWOHOLABJ-AWEZNQCLSA-N 1 0 339.395 3.591 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)Cc1ccc2c(c1)OCO2 ZINC000470171217 1038408889 /nfs/dbraw/zinc/40/88/89/1038408889.db2.gz GXTDTUNWXKRLPH-ZSOIEALJSA-N 1 0 340.379 3.859 20 5 EHBDRO CCc1nc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000192804736 1038560131 /nfs/dbraw/zinc/56/01/31/1038560131.db2.gz PGMZHUZZKLVJEH-INIZCTEOSA-N 1 0 331.441 3.823 20 5 EHBDRO C[C@H]([NH2+]CCCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000539063137 1038662255 /nfs/dbraw/zinc/66/22/55/1038662255.db2.gz TURZEKZNTJCPIH-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000378632456 1038796204 /nfs/dbraw/zinc/79/62/04/1038796204.db2.gz KEYNUPZZXPQNHE-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccc(C(=O)CC)cc2[N+](=O)[O-])CC1 ZINC000479948756 1038935375 /nfs/dbraw/zinc/93/53/75/1038935375.db2.gz VTVOBUSSRUILHD-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1COC)c1ccco1 ZINC000175059899 1039150400 /nfs/dbraw/zinc/15/04/00/1039150400.db2.gz LAPLKDMOGFFIFM-KRWDZBQOSA-N 1 0 347.415 3.829 20 5 EHBDRO C[C@H]([NH2+]CCCN1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000480253206 1039340519 /nfs/dbraw/zinc/34/05/19/1039340519.db2.gz VHPBZYMNWBXPRN-INIZCTEOSA-N 1 0 339.439 3.694 20 5 EHBDRO COc1cc(CN(Cc2cccc(F)c2)C2CC2)ccc1[N+](=O)[O-] ZINC000485739821 1039492404 /nfs/dbraw/zinc/49/24/04/1039492404.db2.gz UCNVBTATANNUIW-UHFFFAOYSA-N 1 0 330.359 3.907 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc3c(c1)OCO3)CCCC2 ZINC000417295750 1039648651 /nfs/dbraw/zinc/64/86/51/1039648651.db2.gz FOGRARFEYWWHPF-KRWDZBQOSA-N 1 0 340.379 3.881 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC1 ZINC000480535603 1039656203 /nfs/dbraw/zinc/65/62/03/1039656203.db2.gz KWTUTTHXVYZFLU-AZUAARDMSA-N 1 0 345.487 3.626 20 5 EHBDRO Cc1cnccc1CC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417313016 1039668680 /nfs/dbraw/zinc/66/86/80/1039668680.db2.gz UNTPAXWQCCVEPQ-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CC1(CCO)CCCC1)CCCC2 ZINC000417314620 1039669495 /nfs/dbraw/zinc/66/94/95/1039669495.db2.gz RNQFRJYWHPGBSW-SFHVURJKSA-N 1 0 332.444 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH+]1CCC(c2ccsc2)CC1 ZINC000485912033 1039685075 /nfs/dbraw/zinc/68/50/75/1039685075.db2.gz GMKSXRVFEKLEAY-UHFFFAOYSA-N 1 0 332.425 3.915 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cnn3ccccc13)CCCC2 ZINC000417331190 1039687921 /nfs/dbraw/zinc/68/79/21/1039687921.db2.gz LYBKEGWBNPFQSW-SFHVURJKSA-N 1 0 336.395 3.800 20 5 EHBDRO COC(=O)C(C)(C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000512541594 1039689634 /nfs/dbraw/zinc/68/96/34/1039689634.db2.gz GHVYPYCGYZKUAL-UHFFFAOYSA-N 1 0 346.383 3.534 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2cccs2)cc1[N+](=O)[O-] ZINC000417337553 1039695085 /nfs/dbraw/zinc/69/50/85/1039695085.db2.gz JCEZGDJNFGXXSH-FPMFFAJLSA-N 1 0 332.425 3.947 20 5 EHBDRO Cc1noc2ncc(C[N@@H+](Cc3ccc([N+](=O)[O-])cc3)C(C)C)cc12 ZINC000893946351 1039869101 /nfs/dbraw/zinc/86/91/01/1039869101.db2.gz ZBIXCAUJSABHSP-UHFFFAOYSA-N 1 0 340.383 3.850 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(OC)CCCCC2)cc1[N+](=O)[O-] ZINC000480716180 1039943818 /nfs/dbraw/zinc/94/38/18/1039943818.db2.gz QPAUISXSUMUKRS-CQSZACIVSA-N 1 0 336.432 3.993 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccc(F)cc2)N(C)C)cc1[N+](=O)[O-] ZINC000480896513 1040144915 /nfs/dbraw/zinc/14/49/15/1040144915.db2.gz CZQPPFWYOCYOMZ-KUHUBIRLSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128286715 1040284965 /nfs/dbraw/zinc/28/49/65/1040284965.db2.gz BAXAMESXXUOEJA-OLZOCXBDSA-N 1 0 337.395 3.573 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)CC1CCC1 ZINC000479555400 1040374332 /nfs/dbraw/zinc/37/43/32/1040374332.db2.gz OOWBPPURTXKPNW-LSDHHAIUSA-N 1 0 338.473 3.606 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000486787131 1040444209 /nfs/dbraw/zinc/44/42/09/1040444209.db2.gz HEDIZDDHMCMDDG-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000486804450 1040472463 /nfs/dbraw/zinc/47/24/63/1040472463.db2.gz YQTBZWDQIKKDOP-SUMWQHHRSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H]1CCCCC1(C)C ZINC000481196432 1040472839 /nfs/dbraw/zinc/47/28/39/1040472839.db2.gz ZDAZBAVRROZXRJ-INIZCTEOSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[C@H]([NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC000490309108 1040491379 /nfs/dbraw/zinc/49/13/79/1040491379.db2.gz SMQHYRDCWDFNQD-NXOAAHMSSA-N 1 0 331.460 3.993 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@H]34)o2)c1 ZINC000190350939 1040503278 /nfs/dbraw/zinc/50/32/78/1040503278.db2.gz DXBYHNXONLILHJ-NUJGCVRESA-N 1 0 328.368 3.512 20 5 EHBDRO C[C@@H](CO)[C@@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000123266281 1040790293 /nfs/dbraw/zinc/79/02/93/1040790293.db2.gz LPXUHNSKPJQWKN-QWHCGFSZSA-N 1 0 348.374 3.633 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCN(C3CC3)C2)c2ccccc2)c1 ZINC000491022886 1040868327 /nfs/dbraw/zinc/86/83/27/1040868327.db2.gz QDAMCVZUECETNM-FXAWDEMLSA-N 1 0 337.423 3.511 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433163703 1040948750 /nfs/dbraw/zinc/94/87/50/1040948750.db2.gz CLLKUZIWXSMBEM-LPHOPBHVSA-N 1 0 340.423 3.510 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000054981072 1041090860 /nfs/dbraw/zinc/09/08/60/1041090860.db2.gz KEYUIKSVPRIXEO-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433235653 1041124805 /nfs/dbraw/zinc/12/48/05/1041124805.db2.gz WWQMXQZUSBXGBQ-IRXDYDNUSA-N 1 0 332.444 3.704 20 5 EHBDRO CC(=O)c1cc(NCCCC[N@H+]2CCC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000341520194 1041213530 /nfs/dbraw/zinc/21/35/30/1041213530.db2.gz ACZOJNISNHTZQC-CQSZACIVSA-N 1 0 333.432 3.721 20 5 EHBDRO CC(C)C[C@@H](CCO)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433284381 1041232390 /nfs/dbraw/zinc/23/23/90/1041232390.db2.gz DZSWYMVCPGCLHK-KDOFPFPSSA-N 1 0 334.460 3.952 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854518 1041236374 /nfs/dbraw/zinc/23/63/74/1041236374.db2.gz QCVNWMDOXGJSKO-AWEZNQCLSA-N 1 0 342.395 3.697 20 5 EHBDRO C[C@@H](C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854650 1041246496 /nfs/dbraw/zinc/24/64/96/1041246496.db2.gz GJHRWOUHORNMFS-HNNXBMFYSA-N 1 0 341.411 3.659 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@H]1CC1(C)C ZINC000419314401 1041271087 /nfs/dbraw/zinc/27/10/87/1041271087.db2.gz HYVWIHKXJYFOEK-DGCLKSJQSA-N 1 0 339.823 3.601 20 5 EHBDRO COC1(C(F)(F)F)CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000419336906 1041412709 /nfs/dbraw/zinc/41/27/09/1041412709.db2.gz VPQVOYLLEOORPT-NSHDSACASA-N 1 0 332.322 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](Cc2cccs2)C[C@H]2CCCO2)cc1 ZINC000108086122 1042004871 /nfs/dbraw/zinc/00/48/71/1042004871.db2.gz GUHLIAGHEAMTPI-QGZVFWFLSA-N 1 0 346.452 3.880 20 5 EHBDRO CCCO[C@@H]1CCC[N@H+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000108392797 1042046436 /nfs/dbraw/zinc/04/64/36/1042046436.db2.gz WXGBAZRQQNUKMO-QGZVFWFLSA-N 1 0 336.432 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811026 1042436271 /nfs/dbraw/zinc/43/62/71/1042436271.db2.gz WOMHUDFMWBGYAS-DLBZAZTESA-N 1 0 331.460 3.772 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)N(C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000181835855 1042550098 /nfs/dbraw/zinc/55/00/98/1042550098.db2.gz MZCUZFDHLMAMKD-GJZGRUSLSA-N 1 0 347.459 3.733 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CC[C@@H](Cc3cnn(C)c3)C2)cc1[N+](=O)[O-] ZINC000093870289 1042567363 /nfs/dbraw/zinc/56/73/63/1042567363.db2.gz MSMMPSGWHNIFKM-INIZCTEOSA-N 1 0 342.443 3.516 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN(Cc1ccccc1)CC1(CO)CC1 ZINC000341972898 1042779550 /nfs/dbraw/zinc/77/95/50/1042779550.db2.gz PFIKXOQGWKKXCC-UHFFFAOYSA-N 1 0 344.386 3.509 20 5 EHBDRO CCO[C@@H]1C[C@@H]([N@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820816 1042907058 /nfs/dbraw/zinc/90/70/58/1042907058.db2.gz WUSMMBICVPLTBQ-IAGOWNOFSA-N 1 0 336.432 3.716 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432333012 1042965225 /nfs/dbraw/zinc/96/52/25/1042965225.db2.gz FGIHINZSEXIUID-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC3CCN(c4ccccn4)CC3)ccnc21 ZINC000432338802 1042973362 /nfs/dbraw/zinc/97/33/62/1042973362.db2.gz XCDOZCKDOATMAB-UHFFFAOYSA-N 1 0 349.394 3.619 20 5 EHBDRO Cc1cc(NCc2ccc(C[NH3+])cc2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000569362458 1043003823 /nfs/dbraw/zinc/00/38/23/1043003823.db2.gz GINHSGKIYCEMOE-UHFFFAOYSA-N 1 0 339.317 3.993 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCCCC[C@@H]3CCO)o2)c1 ZINC000585767888 1043030247 /nfs/dbraw/zinc/03/02/47/1043030247.db2.gz XQHFCCFJTCYKMB-MRXNPFEDSA-N 1 0 344.411 3.982 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCCO2 ZINC000344050410 1043169019 /nfs/dbraw/zinc/16/90/19/1043169019.db2.gz QFQFCQUHMOVMLW-KRWDZBQOSA-N 1 0 342.395 3.649 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(OC)c(OC)c1 ZINC000344095087 1043245070 /nfs/dbraw/zinc/24/50/70/1043245070.db2.gz SBPVRQXRJUDKKN-MRXNPFEDSA-N 1 0 344.411 3.895 20 5 EHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344212991 1043438415 /nfs/dbraw/zinc/43/84/15/1043438415.db2.gz NZXDTOSLAFSCEE-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000728898519 1043598017 /nfs/dbraw/zinc/59/80/17/1043598017.db2.gz YMKUBPLKMLTKQD-KSSFIOAISA-N 1 0 328.416 3.926 20 5 EHBDRO C[C@H]1CCSCC[N@@H+]1Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279259957 1043667282 /nfs/dbraw/zinc/66/72/82/1043667282.db2.gz MAQMXLSQKHEHSX-LBPRGKRZSA-N 1 0 333.413 3.577 20 5 EHBDRO CC[C@H](CSC)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000182134407 1044100553 /nfs/dbraw/zinc/10/05/53/1044100553.db2.gz FWVKBRDBECUJPB-GFCCVEGCSA-N 1 0 337.470 3.950 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542803 1044207450 /nfs/dbraw/zinc/20/74/50/1044207450.db2.gz QGJDBLKZLRGOQZ-HWPZZCPQSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279622717 1044323703 /nfs/dbraw/zinc/32/37/03/1044323703.db2.gz YIWKJCZSVSOENQ-VIFPVBQESA-N 1 0 342.321 3.506 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](COCc2ccccc2)C1 ZINC000183370829 1125545410 /nfs/dbraw/zinc/54/54/10/1125545410.db2.gz PUEUHYLRAIGBCX-SFHVURJKSA-N 1 0 340.423 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](c2ccco2)N2CCCC2)c(Cl)c1 ZINC000183383813 1125549260 /nfs/dbraw/zinc/54/92/60/1125549260.db2.gz MPEBUPLQKHZRRO-INIZCTEOSA-N 1 0 349.818 3.768 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000183725327 1125746832 /nfs/dbraw/zinc/74/68/32/1125746832.db2.gz TUPXOORHSIBRGD-OAHLLOKOSA-N 1 0 341.411 3.525 20 5 EHBDRO Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1 ZINC000466917928 1126094314 /nfs/dbraw/zinc/09/43/14/1126094314.db2.gz HNJOUDWIAWKLCW-GOSISDBHSA-N 1 0 342.439 3.720 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])c(C)c2)c(C[NH+](C)C)c1 ZINC000072839881 1126901416 /nfs/dbraw/zinc/90/14/16/1126901416.db2.gz KBPDQOMASJWPHB-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2ccnn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000090879384 1127082081 /nfs/dbraw/zinc/08/20/81/1127082081.db2.gz MQYGOFPBLUKSJB-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000185856072 1127163259 /nfs/dbraw/zinc/16/32/59/1127163259.db2.gz SSJGJWBGBZIDIQ-AWEZNQCLSA-N 1 0 330.388 3.799 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cn2nc(C)c3cc([N+](=O)[O-])ccc32)C1 ZINC000765009862 1127564767 /nfs/dbraw/zinc/56/47/67/1127564767.db2.gz FCWOHAVZQLIJAZ-OAHLLOKOSA-N 1 0 348.472 3.818 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1cc(C)no1 ZINC000552340170 1127750110 /nfs/dbraw/zinc/75/01/10/1127750110.db2.gz MGZKNWHTZNMMRS-CYBMUJFWSA-N 1 0 335.429 3.594 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000282220540 1128097722 /nfs/dbraw/zinc/09/77/22/1128097722.db2.gz HYNJQAUBNSDKQW-CZUORRHYSA-N 1 0 330.384 3.854 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1NCC[NH+]1CCCCCC1 ZINC000110519520 1128223557 /nfs/dbraw/zinc/22/35/57/1128223557.db2.gz ZMZADIVPIYIGKY-UHFFFAOYSA-N 1 0 342.237 3.645 20 5 EHBDRO Cc1cc(C2CC[NH+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)[nH]n1 ZINC000273031456 1128433687 /nfs/dbraw/zinc/43/36/87/1128433687.db2.gz ULUQQYMTPBQBEA-AWEZNQCLSA-N 1 0 328.416 3.875 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](CC3CCCC3)C2)c2ccncc21 ZINC000301465043 1128437209 /nfs/dbraw/zinc/43/72/09/1128437209.db2.gz LGLPTVZJCAMYPQ-OAHLLOKOSA-N 1 0 340.427 3.819 20 5 EHBDRO C[C@@H]1C[C@@H](CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000273187574 1128447939 /nfs/dbraw/zinc/44/79/39/1128447939.db2.gz GBBUOSBGWPYMFG-VKJFTORMSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1nccn1CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000338709113 1128728910 /nfs/dbraw/zinc/72/89/10/1128728910.db2.gz QGEFARDQCCMKLH-UHFFFAOYSA-N 1 0 342.424 3.618 20 5 EHBDRO COc1cc(NC[C@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])cc1F ZINC000301623143 1128764042 /nfs/dbraw/zinc/76/40/42/1128764042.db2.gz OMXJVYJYVSEULO-CYBMUJFWSA-N 1 0 339.392 3.519 20 5 EHBDRO C[C@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCC[C@H](C)C1 ZINC000252132112 1120423893 /nfs/dbraw/zinc/42/38/93/1120423893.db2.gz KYXJZOWUMBHMGD-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO CCc1ccc([C@H](NCC[NH+](CC)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542479390 1120469702 /nfs/dbraw/zinc/46/97/02/1120469702.db2.gz RERGKRRXEYUNRT-LJQANCHMSA-N 1 0 345.443 3.771 20 5 EHBDRO CCCC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CCC1 ZINC000542523848 1120904756 /nfs/dbraw/zinc/90/47/56/1120904756.db2.gz WPYJWKNKPDGGPC-OAHLLOKOSA-N 1 0 333.432 3.790 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@H](C)C1CCCCC1 ZINC000542533561 1120933210 /nfs/dbraw/zinc/93/32/10/1120933210.db2.gz UDHXTSOXLREZJZ-UONOGXRCSA-N 1 0 333.432 3.728 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+](Cc2cccc([N+](=O)[O-])c2)CC2CC2)c1 ZINC000914873666 1121032059 /nfs/dbraw/zinc/03/20/59/1121032059.db2.gz MHFSIYUGZZEYNN-UHFFFAOYSA-N 1 0 341.367 3.915 20 5 EHBDRO COc1ccc(F)cc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193311566 1121087131 /nfs/dbraw/zinc/08/71/31/1121087131.db2.gz GJPRKAULNOBVLR-KRWDZBQOSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)nc1 ZINC000311225885 1128989510 /nfs/dbraw/zinc/98/95/10/1128989510.db2.gz POIWVMGPFMRQMR-QGZVFWFLSA-N 1 0 340.427 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)c(F)c1 ZINC000301081369 1121474240 /nfs/dbraw/zinc/47/42/40/1121474240.db2.gz KOLIMSBQRCMSIH-SFHVURJKSA-N 1 0 329.375 3.983 20 5 EHBDRO CSC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCC1 ZINC000193652502 1121533021 /nfs/dbraw/zinc/53/30/21/1121533021.db2.gz XTPCLLLKEMUTIT-UHFFFAOYSA-N 1 0 332.372 3.572 20 5 EHBDRO COC1(C)CC[NH+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000272379043 1121597756 /nfs/dbraw/zinc/59/77/56/1121597756.db2.gz QYXVMFIBXBZXEJ-UHFFFAOYSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H](O)[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000272536203 1121681438 /nfs/dbraw/zinc/68/14/38/1121681438.db2.gz OCUXWHABLIVFPY-OLZOCXBDSA-N 1 0 332.425 3.526 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000301735105 1129010752 /nfs/dbraw/zinc/01/07/52/1129010752.db2.gz ZPKKDYFANIYQHD-DGCLKSJQSA-N 1 0 343.349 3.534 20 5 EHBDRO Cc1c(C[NH2+]Cc2cc(Cl)c3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000326468808 1121950026 /nfs/dbraw/zinc/95/00/26/1121950026.db2.gz SFEOGORVDUXIPF-UHFFFAOYSA-N 1 0 348.786 3.618 20 5 EHBDRO CC(=O)Nc1ccc([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000272776193 1122224199 /nfs/dbraw/zinc/22/41/99/1122224199.db2.gz UJSKAEPDIJUKJU-QWHCGFSZSA-N 1 0 327.384 3.965 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CCO[C@H](CCc2ccccc2)C1 ZINC000544530204 1122320250 /nfs/dbraw/zinc/32/02/50/1122320250.db2.gz SGMZOVDWBHBDGJ-OXJNMPFZSA-N 1 0 340.423 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H]3[C@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000301775458 1129064383 /nfs/dbraw/zinc/06/43/83/1129064383.db2.gz LCIRCOFLJCIHFP-WBMJQRKESA-N 1 0 335.835 3.701 20 5 EHBDRO CCCC[N@H+](Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](C)CC ZINC000917438452 1122602707 /nfs/dbraw/zinc/60/27/07/1122602707.db2.gz VEFJWLBSNUARMY-CQSZACIVSA-N 1 0 331.420 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@@H]3C3CCCCC3)c2c1 ZINC000917478189 1122613491 /nfs/dbraw/zinc/61/34/91/1122613491.db2.gz LHFDFGWSUPYAPC-QGZVFWFLSA-N 1 0 328.416 3.947 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@H+](C2CC2)[C@H]2CCc3ccccc32)c1 ZINC000154493448 1122667154 /nfs/dbraw/zinc/66/71/54/1122667154.db2.gz POTZCJZWMPUMGU-PMACEKPBSA-N 1 0 338.407 3.780 20 5 EHBDRO COc1ccc(-c2ccc(C[N@H+](C)[C@H]3CCSC3)o2)c([N+](=O)[O-])c1 ZINC000130566356 1122777637 /nfs/dbraw/zinc/77/76/37/1122777637.db2.gz FAARRBCIBVTZCQ-LBPRGKRZSA-N 1 0 348.424 3.801 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(C(=O)OC)cc1 ZINC000556094115 1122809351 /nfs/dbraw/zinc/80/93/51/1122809351.db2.gz QCLCUVGCEAZBNL-QGZVFWFLSA-N 1 0 342.395 3.665 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]C[C@H]1CCCC1(C)C)c1cccc([N+](=O)[O-])c1 ZINC000556251718 1122898827 /nfs/dbraw/zinc/89/88/27/1122898827.db2.gz DYGZFADFHLFCOO-NVXWUHKLSA-N 1 0 342.443 3.834 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(c3cn[nH]c3)CC2)cc1[N+](=O)[O-] ZINC000352644042 1123064728 /nfs/dbraw/zinc/06/47/28/1123064728.db2.gz OGTDJILBBFUGLF-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1(C)CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000556886825 1123166969 /nfs/dbraw/zinc/16/69/69/1123166969.db2.gz WOMQWMNSCYRYDT-KRWDZBQOSA-N 1 0 342.443 3.978 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](CCc1ccc(F)cc1)C1CC1 ZINC000609744780 1123655500 /nfs/dbraw/zinc/65/55/00/1123655500.db2.gz XJTPWWLWEAXGMG-UHFFFAOYSA-N 1 0 344.386 3.820 20 5 EHBDRO C[N@H+](CCCn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCCCC1 ZINC000609771037 1123659891 /nfs/dbraw/zinc/65/98/91/1123659891.db2.gz VMKTUMNOEXCCOJ-UHFFFAOYSA-N 1 0 347.415 3.547 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@H]1c1ccccc1 ZINC000301827770 1129141915 /nfs/dbraw/zinc/14/19/15/1129141915.db2.gz FUTNLCPLXOIZSC-DOTOQJQBSA-N 1 0 333.338 3.730 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000615720660 1123863644 /nfs/dbraw/zinc/86/36/44/1123863644.db2.gz HTPPVWNAEIPWBT-JYRVWZFOSA-N 1 0 341.411 3.808 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CNc1cnn(-c2cc[nH+]cc2)c1 ZINC000615720751 1123863771 /nfs/dbraw/zinc/86/37/71/1123863771.db2.gz WHSXCRCBAJZNSS-ZROIWOOFSA-N 1 0 335.367 3.691 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](c1ccnn1C)C(C)C ZINC000615943140 1123912576 /nfs/dbraw/zinc/91/25/76/1123912576.db2.gz FWFKYIRFOORGKX-BXBOZWQASA-N 1 0 342.443 3.761 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](c1ccnn1C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000615967268 1123919748 /nfs/dbraw/zinc/91/97/48/1123919748.db2.gz YLNQGKUIPOQFEZ-SJORKVTESA-N 1 0 330.432 3.809 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301838379 1129171660 /nfs/dbraw/zinc/17/16/60/1129171660.db2.gz WRIXLILWBLKQTR-FZMZJTMJSA-N 1 0 343.349 3.534 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122855410 1124985102 /nfs/dbraw/zinc/98/51/02/1124985102.db2.gz OVEQIAMPOISCLV-AUUYWEPGSA-N 1 0 340.423 3.842 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2cc(O)ccc2C1 ZINC000618615629 1125134252 /nfs/dbraw/zinc/13/42/52/1125134252.db2.gz GNAWUGYOVHQUQB-RDTXWAMCSA-N 1 0 340.423 3.769 20 5 EHBDRO CO[C@@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000619430964 1125348284 /nfs/dbraw/zinc/34/82/84/1125348284.db2.gz TXVZCWCRIAKLMP-TZMCWYRMSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)s1 ZINC000182751980 1125360518 /nfs/dbraw/zinc/36/05/18/1125360518.db2.gz ICUYUFNPWPWPFT-GFCCVEGCSA-N 1 0 347.440 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(CN2CCCC[C@H]([NH+]3CCCC3)C2)c1 ZINC000735493383 1131352846 /nfs/dbraw/zinc/35/28/46/1131352846.db2.gz PCQLBJJCLGIDPF-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@H](C)c2ccsc2)cccc1[N+](=O)[O-] ZINC000619782834 1125403929 /nfs/dbraw/zinc/40/39/29/1125403929.db2.gz LPBOTDVYCRUPTF-GFCCVEGCSA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@H]([NH2+]C1CCN(C(=O)OC(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000079723933 1129289982 /nfs/dbraw/zinc/28/99/82/1129289982.db2.gz URGOGUHJMOHPQD-ZDUSSCGKSA-N 1 0 349.431 3.645 20 5 EHBDRO C[C@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC(C)(C)C1 ZINC000543182043 1129316013 /nfs/dbraw/zinc/31/60/13/1129316013.db2.gz NCNACEOJEUHGGI-GFCCVEGCSA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000067961106 1129326669 /nfs/dbraw/zinc/32/66/69/1129326669.db2.gz JMNOHFLUJXLWSN-HNNXBMFYSA-N 1 0 341.411 3.925 20 5 EHBDRO CC[NH+](CC)[C@H](C(=O)Nc1ccc(C)cc1[N+](=O)[O-])c1ccccc1 ZINC000499707721 1129388320 /nfs/dbraw/zinc/38/83/20/1129388320.db2.gz SCZIKZIYUCPGHY-SFHVURJKSA-N 1 0 341.411 3.925 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(F)c(F)c2F)c(Cl)c1 ZINC000543412328 1129470442 /nfs/dbraw/zinc/47/04/42/1129470442.db2.gz JTCZTBKBUTXAGQ-UHFFFAOYSA-N 1 0 344.720 3.998 20 5 EHBDRO CCC[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)C1 ZINC000466488075 1129489546 /nfs/dbraw/zinc/48/95/46/1129489546.db2.gz GOVSWUWMHVMYIY-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO Cn1cc(C[N@@H+]2CCc3ccccc3C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000154427670 1129558090 /nfs/dbraw/zinc/55/80/90/1129558090.db2.gz VARPRRRLHKNENL-UHFFFAOYSA-N 1 0 348.406 3.554 20 5 EHBDRO COc1cc2c(c(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)c1)O[C@H](C)C2 ZINC000922537842 1129565337 /nfs/dbraw/zinc/56/53/37/1129565337.db2.gz LIHFUPDOFJVSDE-CHWSQXEVSA-N 1 0 342.395 3.778 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](C(F)(F)F)C2(C)C)cc1[N+](=O)[O-] ZINC000330961009 1129649886 /nfs/dbraw/zinc/64/98/86/1129649886.db2.gz JMLMJWGCHJEKBS-ZDUSSCGKSA-N 1 0 332.322 3.766 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCCC[C@H]1C(C)C ZINC000331055546 1129652069 /nfs/dbraw/zinc/65/20/69/1129652069.db2.gz KRXXFRBYACFKCV-LSDHHAIUSA-N 1 0 333.432 3.646 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@H]1C ZINC000331075866 1129652846 /nfs/dbraw/zinc/65/28/46/1129652846.db2.gz WDVWGTMYWVFDSU-CABCVRRESA-N 1 0 348.447 3.548 20 5 EHBDRO C[C@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C[NH+]1CCCCC1 ZINC000392537338 1129716499 /nfs/dbraw/zinc/71/64/99/1129716499.db2.gz SMLWXNRNXNLYBG-LLVKDONJSA-N 1 0 346.353 3.543 20 5 EHBDRO Cc1cc(N[C@H]2CCC[C@H]([NH+](C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302003705 1129762986 /nfs/dbraw/zinc/76/29/86/1129762986.db2.gz JZABMMGOMHNWNS-KBPBESRZSA-N 1 0 328.416 3.736 20 5 EHBDRO Cc1cc(NC[C@H](C)CC2(C)OCCO2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302211972 1129773401 /nfs/dbraw/zinc/77/34/01/1129773401.db2.gz YWXVHLAKKUOTPN-GFCCVEGCSA-N 1 0 345.399 3.653 20 5 EHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)c1cccc(-n2cccn2)c1 ZINC001168750316 1129939698 /nfs/dbraw/zinc/93/96/98/1129939698.db2.gz JTTWWACMPHLRIJ-LBPRGKRZSA-N 1 0 328.397 3.693 20 5 EHBDRO CC(C)C[C@H](CNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)[NH+](C)C ZINC000498281472 1129971262 /nfs/dbraw/zinc/97/12/62/1129971262.db2.gz DRIQHDFKRNFWHX-OAHLLOKOSA-N 1 0 349.475 3.598 20 5 EHBDRO Cc1n[nH]cc1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000171384363 1130049982 /nfs/dbraw/zinc/04/99/82/1130049982.db2.gz POOCJVMUHVYXKF-UHFFFAOYSA-N 1 0 328.397 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@@H](n2ccnc2)C1 ZINC000245515291 1130228550 /nfs/dbraw/zinc/22/85/50/1130228550.db2.gz DJQBSAGIKSFGQZ-VKJFTORMSA-N 1 0 328.416 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[C@@H](O)C3)s2)cc1 ZINC000174430119 1130358795 /nfs/dbraw/zinc/35/87/95/1130358795.db2.gz AVOQGTKDBNYRQY-XJKSGUPXSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](O)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000246306914 1130370827 /nfs/dbraw/zinc/37/08/27/1130370827.db2.gz DMEUQOLFEGEQMJ-DOXZYTNZSA-N 1 0 328.412 3.546 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc([N+](=O)[O-])c(OC)c1)c1ccco1 ZINC000174704872 1130378474 /nfs/dbraw/zinc/37/84/74/1130378474.db2.gz ZOPRYEDBJLFYGY-OAHLLOKOSA-N 1 0 333.388 3.691 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H](CO)CC2CCCC2)o1 ZINC000509447825 1130649591 /nfs/dbraw/zinc/64/95/91/1130649591.db2.gz LGZREPFBIWEQNQ-HNNXBMFYSA-N 1 0 344.411 3.886 20 5 EHBDRO CC(C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[NH+]1CCCC1 ZINC000731208335 1130779048 /nfs/dbraw/zinc/77/90/48/1130779048.db2.gz BGTQXTBUQMCNFE-CQSZACIVSA-N 1 0 334.445 3.737 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1nc2ccc([N+](=O)[O-])cc2s1 ZINC000731208670 1130779124 /nfs/dbraw/zinc/77/91/24/1130779124.db2.gz CSRIBIGJRIOEQO-VXGBXAGGSA-N 1 0 334.445 3.737 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2cccc(Cl)c2Cl)cc1 ZINC000731678178 1130831774 /nfs/dbraw/zinc/83/17/74/1130831774.db2.gz HVISOTQSHAQTAG-AWEZNQCLSA-N 1 0 341.194 3.725 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cn2ncc3ccc([N+](=O)[O-])cc32)C1 ZINC000738228766 1131463773 /nfs/dbraw/zinc/46/37/73/1131463773.db2.gz ZNMMIKVUACILEQ-OAHLLOKOSA-N 1 0 334.445 3.510 20 5 EHBDRO [NH3+]Cc1c(F)cccc1N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172897912 1131881805 /nfs/dbraw/zinc/88/18/05/1131881805.db2.gz DFYZSIBZAYIZAD-CQSZACIVSA-N 1 0 329.375 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOc1ccc(F)cc1)CC2 ZINC001172898994 1131882221 /nfs/dbraw/zinc/88/22/21/1131882221.db2.gz KGSXFKSWDSOYCD-QGZVFWFLSA-N 1 0 344.386 3.650 20 5 EHBDRO CCCN(CCC)CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898657 1131882335 /nfs/dbraw/zinc/88/23/35/1131882335.db2.gz IICGKHYDHRKBMP-SFHVURJKSA-N 1 0 333.476 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ccc3ncoc3c1)CC2 ZINC001172903010 1131885335 /nfs/dbraw/zinc/88/53/35/1131885335.db2.gz OTHHSRGUGNKQEY-MRXNPFEDSA-N 1 0 337.379 3.773 20 5 EHBDRO CC1(C)C[C@H](C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CCO1 ZINC001172906503 1131887680 /nfs/dbraw/zinc/88/76/80/1131887680.db2.gz XPADBEGXROXLEU-PBHICJAKSA-N 1 0 332.444 3.637 20 5 EHBDRO COCCC1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172915509 1131902464 /nfs/dbraw/zinc/90/24/64/1131902464.db2.gz NPHHAOQLQHIZSJ-SFHVURJKSA-N 1 0 332.444 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@@H](c3ccccn3)C1)CC2 ZINC001172914248 1131902787 /nfs/dbraw/zinc/90/27/87/1131902787.db2.gz FSYUFEQUSQZVQT-MSOLQXFVSA-N 1 0 337.423 3.727 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000743380842 1131907247 /nfs/dbraw/zinc/90/72/47/1131907247.db2.gz SZYDYGVHTNKFKH-PBHICJAKSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H](c1ccccn1)C1CC1)CC2 ZINC001172910742 1131917751 /nfs/dbraw/zinc/91/77/51/1131917751.db2.gz CKKWPMPTBFYHKN-FXAWDEMLSA-N 1 0 337.423 3.978 20 5 EHBDRO Cc1ccc(CCC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911541 1131917844 /nfs/dbraw/zinc/91/78/44/1131917844.db2.gz JGTZSVCDXCCSBE-IBGZPJMESA-N 1 0 339.439 3.768 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccccc1[N+](=O)[O-] ZINC000743475669 1131928298 /nfs/dbraw/zinc/92/82/98/1131928298.db2.gz WKYLVXQHAZOLKY-QWHCGFSZSA-N 1 0 339.395 3.526 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCc3ccccc32)c1F ZINC001173179819 1131992667 /nfs/dbraw/zinc/99/26/67/1131992667.db2.gz QBMMMXOQZZLWAF-BLLLJJGKSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2CCCC[C@H]2F)c1F ZINC001173176888 1131992696 /nfs/dbraw/zinc/99/26/96/1131992696.db2.gz NKJYCLUNSGJDCN-RAIGVLPGSA-N 1 0 328.359 3.544 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)nc1 ZINC001173215602 1132001011 /nfs/dbraw/zinc/00/10/11/1132001011.db2.gz XHTKEBZKSAGSSX-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1C[C@@H](CF)[C@H](C(F)(F)F)C1 ZINC001173223966 1132005982 /nfs/dbraw/zinc/00/59/82/1132005982.db2.gz CKWYELAXGZOPQT-MPKXVKKWSA-N 1 0 334.313 3.606 20 5 EHBDRO Cc1ccccc1O[C@H]1CC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226641 1132006227 /nfs/dbraw/zinc/00/62/27/1132006227.db2.gz KWGPDJQXFPUFSZ-APWZRJJASA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1CC[NH2+]C2 ZINC001173226375 1132006384 /nfs/dbraw/zinc/00/63/84/1132006384.db2.gz JCRSOGYRUYLLLX-AWEZNQCLSA-N 1 0 335.407 3.999 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)c1ncccc1F ZINC001173226750 1132006578 /nfs/dbraw/zinc/00/65/78/1132006578.db2.gz ZIRFGNASPYFPJD-ZDUSSCGKSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccc2c(c1)CCO2 ZINC001173226856 1132006784 /nfs/dbraw/zinc/00/67/84/1132006784.db2.gz CGPFDXXHRDRACB-ZIAGYGMSSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(c2ccncc2)CC1 ZINC001173228367 1132008219 /nfs/dbraw/zinc/00/82/19/1132008219.db2.gz VOJRBKXJGFCYRN-HNNXBMFYSA-N 1 0 325.412 3.800 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCN1CCCc2ccccc21 ZINC001173235754 1132010244 /nfs/dbraw/zinc/01/02/44/1132010244.db2.gz UUPOFWHPUCAWFO-MRXNPFEDSA-N 1 0 339.439 3.568 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC001173210064 1132012481 /nfs/dbraw/zinc/01/24/81/1132012481.db2.gz HKSYQPFEJRHBTL-UONOGXRCSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C(C)(C)C(=O)c1ccccc1 ZINC001173212345 1132013602 /nfs/dbraw/zinc/01/36/02/1132013602.db2.gz ZVDVDSVLUFCATB-AWEZNQCLSA-N 1 0 326.396 3.777 20 5 EHBDRO Cc1ccn2cc(C[N@@H+](C)[C@@H](C)Cc3ccc([N+](=O)[O-])cc3)nc2c1 ZINC001173237750 1132026445 /nfs/dbraw/zinc/02/64/45/1132026445.db2.gz LYSXLJIXSRAALN-HNNXBMFYSA-N 1 0 338.411 3.614 20 5 EHBDRO COc1ccccc1OCC[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000509394499 1132486894 /nfs/dbraw/zinc/48/68/94/1132486894.db2.gz XZWVTWRHAXYBKN-VQHVLOKHSA-N 1 0 342.395 3.627 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2cc(C)ccc2C)c([N+](=O)[O-])c1 ZINC001168925820 1132598425 /nfs/dbraw/zinc/59/84/25/1132598425.db2.gz UVLHMFVILTXJLF-OAHLLOKOSA-N 1 0 344.411 3.950 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]C2(c3ccccc3C(F)(F)F)CC2)C1 ZINC001168977418 1132617439 /nfs/dbraw/zinc/61/74/39/1132617439.db2.gz JQGFSHUEVMVSAU-NEPJUHHUSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)c(C(F)(F)F)c2)C1 ZINC001168965927 1132621298 /nfs/dbraw/zinc/62/12/98/1132621298.db2.gz DMZWPERZBNKMRU-QWRGUYRKSA-N 1 0 336.741 3.894 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)s1 ZINC001168966028 1132621418 /nfs/dbraw/zinc/62/14/18/1132621418.db2.gz FWBLGBCXOXSBIH-LPEHRKFASA-N 1 0 333.251 3.607 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccc(C[NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1 ZINC001168966130 1132621795 /nfs/dbraw/zinc/62/17/95/1132621795.db2.gz GLQOJGFYAOLPDH-ZBFHGGJFSA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2Cl)C1 ZINC001168969496 1132622279 /nfs/dbraw/zinc/62/22/79/1132622279.db2.gz FBSREAYEFKFTKJ-JOYOIKCWSA-N 1 0 347.640 3.638 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168991824 1132626261 /nfs/dbraw/zinc/62/62/61/1132626261.db2.gz CERNDIOBGIMJKF-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccc(C(F)(F)F)cn2)C2CC2)C1 ZINC001168998093 1132627560 /nfs/dbraw/zinc/62/75/60/1132627560.db2.gz ICAZZWRNJNZZTQ-WDBKCZKBSA-N 1 0 343.349 3.587 20 5 EHBDRO CCc1ccccc1-c1nc(C[NH2+][C@@H]2CC[C@H](C[N+](=O)[O-])C2)cs1 ZINC001169006392 1132630254 /nfs/dbraw/zinc/63/02/54/1132630254.db2.gz HPBKZQHOBZSZBO-DZGCQCFKSA-N 1 0 345.468 3.908 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]C2(c3cccc(C(F)(F)F)c3)CC2)C1 ZINC001168986685 1132633688 /nfs/dbraw/zinc/63/36/88/1132633688.db2.gz YHODWRZUVLNGSN-SMDDNHRTSA-N 1 0 328.334 3.730 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3cccc(F)c32)C1 ZINC001169041115 1132637846 /nfs/dbraw/zinc/63/78/46/1132637846.db2.gz BCCWBDVOTMHAJX-HIFRSBDPSA-N 1 0 345.418 3.865 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1[C@H](C)C[C@H](c2ccccc2)C1(C)C ZINC001175650096 1132722424 /nfs/dbraw/zinc/72/24/24/1132722424.db2.gz DXKYPXGICRVRIG-RHSMWYFYSA-N 1 0 342.443 3.756 20 5 EHBDRO C[NH+](C)CCOc1cc(F)ccc1Nc1cc([N+](=O)[O-])ccc1F ZINC001175736769 1132749360 /nfs/dbraw/zinc/74/93/60/1132749360.db2.gz ACDQCWLTFOWLIV-UHFFFAOYSA-N 1 0 337.326 3.557 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ncc(F)c(C)c1[N+](=O)[O-] ZINC001169686227 1132820267 /nfs/dbraw/zinc/82/02/67/1132820267.db2.gz WLGMGYUEEKYXBO-CQSZACIVSA-N 1 0 330.363 3.677 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767761574 1133049292 /nfs/dbraw/zinc/04/92/92/1133049292.db2.gz BGMBBGSIXKPNTB-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](C[C@@H]2CCOC2)C1 ZINC000773699588 1133091598 /nfs/dbraw/zinc/09/15/98/1133091598.db2.gz IAJNUQAHLUBJJK-KBPBESRZSA-N 1 0 338.835 3.887 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOc1cccnc1 ZINC000768106091 1133095390 /nfs/dbraw/zinc/09/53/90/1133095390.db2.gz RHTOMKLAOJCLGE-CQSZACIVSA-N 1 0 347.440 3.529 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555298 1133155629 /nfs/dbraw/zinc/15/56/29/1133155629.db2.gz PTUBEMVHGYPQCN-TZMCWYRMSA-N 1 0 325.840 3.553 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+](CCCO)Cc2ccccc2)ccc1Cl ZINC000768558259 1133155657 /nfs/dbraw/zinc/15/56/57/1133155657.db2.gz ZUVWYISZBDJTOM-UHFFFAOYSA-N 1 0 334.803 3.633 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H]2CCN(c3ccc(F)c(Cl)c3)C2)c1 ZINC001178326162 1133160135 /nfs/dbraw/zinc/16/01/35/1133160135.db2.gz COIXWFBKJHLWSD-ZDUSSCGKSA-N 1 0 349.793 3.756 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1c(F)cccc1F ZINC001178326504 1133160144 /nfs/dbraw/zinc/16/01/44/1133160144.db2.gz LOXWWCDFXVXHJT-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO CC(C)(C)N1CC[C@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001179142759 1133228326 /nfs/dbraw/zinc/22/83/26/1133228326.db2.gz MNGINLRZARKVOR-INIZCTEOSA-N 1 0 343.427 3.817 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cc2ccccc2[nH]c1=O ZINC001179824842 1133291902 /nfs/dbraw/zinc/29/19/02/1133291902.db2.gz HNPGJZKQNNCWKY-UHFFFAOYSA-N 1 0 337.379 3.755 20 5 EHBDRO CN(CC[NH+]1CCCCC1)Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182653190 1133716208 /nfs/dbraw/zinc/71/62/08/1133716208.db2.gz GSNNIMPZKRJSRG-UHFFFAOYSA-N 1 0 345.365 3.531 20 5 EHBDRO CC[NH+](CC)CCN(CCC(F)(F)F)c1ccc([N+](=O)[O-])cc1 ZINC000774537367 1133724360 /nfs/dbraw/zinc/72/43/60/1133724360.db2.gz RVTRIBMXZRCTDU-UHFFFAOYSA-N 1 0 333.354 3.695 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCCC[C@@H]([NH+]2CCCC2)C1 ZINC000746666120 1133985315 /nfs/dbraw/zinc/98/53/15/1133985315.db2.gz NCIBLWHJUDZWDX-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1ccc(N2CCC(C[NH+]3CCCCCC3)CC2)c([N+](=O)[O-])c1 ZINC001184847288 1133992254 /nfs/dbraw/zinc/99/22/54/1133992254.db2.gz GNIUYCBIXKFMCE-UHFFFAOYSA-N 1 0 331.460 3.996 20 5 EHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774907259 1134116255 /nfs/dbraw/zinc/11/62/55/1134116255.db2.gz GHVBJHIXGZQUFS-SUMWQHHRSA-N 1 0 341.367 3.881 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)COCc1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788568809 1134146314 /nfs/dbraw/zinc/14/63/14/1134146314.db2.gz DGKJJOJCADTMCP-LSDHHAIUSA-N 1 0 343.427 3.681 20 5 EHBDRO Cc1cccc([C@@H](O)C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)c1 ZINC000788592940 1134148661 /nfs/dbraw/zinc/14/86/61/1134148661.db2.gz PLLFGWCJNRSEQY-OALUTQOASA-N 1 0 340.423 3.949 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccc(C)cc1 ZINC000775015555 1134211846 /nfs/dbraw/zinc/21/18/46/1134211846.db2.gz TVKBSXJESCWMTI-DQXUBXGMSA-N 1 0 326.396 3.630 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cccc1[N+](=O)[O-] ZINC000792183458 1134664584 /nfs/dbraw/zinc/66/45/84/1134664584.db2.gz OBTJNEGOAJOWND-UHFFFAOYSA-N 1 0 335.747 3.755 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2csc(C)n2)c([N+](=O)[O-])c1 ZINC001170297710 1134736987 /nfs/dbraw/zinc/73/69/87/1134736987.db2.gz QTRVMDWFRWDREV-QWRGUYRKSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC001170298414 1134737913 /nfs/dbraw/zinc/73/79/13/1134737913.db2.gz LKDJDAYRESLIPT-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170299238 1134737920 /nfs/dbraw/zinc/73/79/20/1134737920.db2.gz SZWJAMOZHIKTQS-ZDUSSCGKSA-N 1 0 332.375 3.506 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccncc1 ZINC001170304267 1134738712 /nfs/dbraw/zinc/73/87/12/1134738712.db2.gz ARNYZKCLOLQFFE-SUMWQHHRSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCc3ncccc32)c([N+](=O)[O-])c1 ZINC001170304667 1134738765 /nfs/dbraw/zinc/73/87/65/1134738765.db2.gz DSXIZLGAOUYCMH-FZKQIMNGSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)COc2ccccc2)c([N+](=O)[O-])c1 ZINC001170317241 1134746236 /nfs/dbraw/zinc/74/62/36/1134746236.db2.gz CYSHRZAVZVFZAY-LSDHHAIUSA-N 1 0 344.411 3.592 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](c2cccnc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170318947 1134746620 /nfs/dbraw/zinc/74/66/20/1134746620.db2.gz SYCITEZXIIWNRJ-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3sccc32)c([N+](=O)[O-])c1 ZINC001170326360 1134748201 /nfs/dbraw/zinc/74/82/01/1134748201.db2.gz HXRZVCBMIGBULY-IAQYHMDHSA-N 1 0 332.425 3.873 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329842 1134748941 /nfs/dbraw/zinc/74/89/41/1134748941.db2.gz VRCMLUXFOADKFF-RYUDHWBXSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH+]2CCC(C(F)(F)F)CC2)c([N+](=O)[O-])c1 ZINC001170336116 1134752032 /nfs/dbraw/zinc/75/20/32/1134752032.db2.gz UFXGWFJKWHELBF-LLVKDONJSA-N 1 0 346.349 3.809 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2Cc3ccccc3C[C@@H]2C)c([N+](=O)[O-])c1 ZINC001170353120 1134753844 /nfs/dbraw/zinc/75/38/44/1134753844.db2.gz WGZOCBFUQGLFNY-GJZGRUSLSA-N 1 0 340.423 3.981 20 5 EHBDRO CO[C@]1(C)C[C@H]([N@H+](C)Cc2ccc([N+](=O)[O-])cc2Cl)C1(C)C ZINC001191204364 1134814872 /nfs/dbraw/zinc/81/48/72/1134814872.db2.gz SQTXHELUKBAAOM-GOEBONIOSA-N 1 0 326.824 3.884 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1cccnc1F ZINC000793279195 1134901171 /nfs/dbraw/zinc/90/11/71/1134901171.db2.gz BBCCMOXNNIPPEN-XJKSGUPXSA-N 1 0 329.375 3.630 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NCCCCC[NH+]2CCCCC2)c1 ZINC000747217376 1135212017 /nfs/dbraw/zinc/21/20/17/1135212017.db2.gz CIBDORQYFBYYBU-UHFFFAOYSA-N 1 0 339.411 3.811 20 5 EHBDRO CC[C@@H]1C[N@H+](CC)CCN1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC001194325121 1135257323 /nfs/dbraw/zinc/25/73/23/1135257323.db2.gz QCTLGZVJTYAVNA-CYBMUJFWSA-N 1 0 345.365 3.530 20 5 EHBDRO CC[C@H](c1ccccc1OC)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834343 1135333029 /nfs/dbraw/zinc/33/30/29/1135333029.db2.gz FWOAMEDKWYVDSD-QZTJIDSGSA-N 1 0 344.411 3.720 20 5 EHBDRO CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1cccs1 ZINC000805840170 1135333360 /nfs/dbraw/zinc/33/33/60/1135333360.db2.gz MMTQTRMJJPTKFD-ZBFHGGJFSA-N 1 0 332.425 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@@H](C4CCCCC4)C3)nc2c1 ZINC001195892634 1135481940 /nfs/dbraw/zinc/48/19/40/1135481940.db2.gz IKLZXVHIBXXBDI-CQSZACIVSA-N 1 0 328.416 3.873 20 5 EHBDRO Cc1ccc(C[N@H+](Cc2ccccc2)CC(C)(C)O)cc1[N+](=O)[O-] ZINC000775766389 1135669198 /nfs/dbraw/zinc/66/91/98/1135669198.db2.gz XKJRSMYNTVVOIR-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1CN1CCCC12CCC2 ZINC001198027159 1135767184 /nfs/dbraw/zinc/76/71/84/1135767184.db2.gz NADFOZJSBNORQX-UHFFFAOYSA-N 1 0 325.206 3.876 20 5 EHBDRO Cc1cccc(C[N@@H+](C)[C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1C ZINC001170571897 1135788099 /nfs/dbraw/zinc/78/80/99/1135788099.db2.gz JWAJGJDYQMXHQU-HNNXBMFYSA-N 1 0 341.411 3.671 20 5 EHBDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809733366 1135873957 /nfs/dbraw/zinc/87/39/57/1135873957.db2.gz UBKKECQRTMXIME-KXBFYZLASA-N 1 0 342.439 3.974 20 5 EHBDRO C[NH+](C)CC1CCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809936088 1135902375 /nfs/dbraw/zinc/90/23/75/1135902375.db2.gz QRLPZJLKEVXVPY-UHFFFAOYSA-N 1 0 346.258 3.675 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC1 ZINC000809940046 1135902788 /nfs/dbraw/zinc/90/27/88/1135902788.db2.gz BSGODCSIIOAJSS-UHFFFAOYSA-N 1 0 346.258 3.818 20 5 EHBDRO CC(C)(C)C[N@H+](CCO)Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809943993 1135903162 /nfs/dbraw/zinc/90/31/62/1135903162.db2.gz HPPJEMLDDUTDQL-UHFFFAOYSA-N 1 0 335.231 3.742 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000809961536 1135903974 /nfs/dbraw/zinc/90/39/74/1135903974.db2.gz VOPOPDYJDDGZLB-ZDUSSCGKSA-N 1 0 346.258 3.864 20 5 EHBDRO CCCCC[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)(C)C ZINC000776025232 1135929109 /nfs/dbraw/zinc/92/91/09/1135929109.db2.gz QBKDOTJQGSFLCQ-INIZCTEOSA-N 1 0 335.448 3.778 20 5 EHBDRO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CCCc2ccccc21 ZINC000776270562 1136123860 /nfs/dbraw/zinc/12/38/60/1136123860.db2.gz CTNWEHDRUXFYBE-OALUTQOASA-N 1 0 326.396 3.638 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000776277110 1136126420 /nfs/dbraw/zinc/12/64/20/1136126420.db2.gz PEUDBWMDOMLULX-ZWKOTPCHSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274365 1136130205 /nfs/dbraw/zinc/13/02/05/1136130205.db2.gz HFTLOTDYQPDFFQ-DIFFPNOSSA-N 1 0 336.338 3.599 20 5 EHBDRO CC(C)([NH2+]C[C@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650853 1136162086 /nfs/dbraw/zinc/16/20/86/1136162086.db2.gz QGPDLTATISZBJF-RISCZKNCSA-N 1 0 346.349 3.920 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000850312276 1136234109 /nfs/dbraw/zinc/23/41/09/1136234109.db2.gz GTRFHDNWSGEFDH-IFXJQAMLSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](Cn1ccnc1)C(C)(C)C ZINC000850424808 1136256538 /nfs/dbraw/zinc/25/65/38/1136256538.db2.gz HMQWRFRQCMUZLW-SUMWQHHRSA-N 1 0 346.431 3.565 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](O)c1cc(C)cc(C)c1 ZINC000850467732 1136265085 /nfs/dbraw/zinc/26/50/85/1136265085.db2.gz SDVRDHLYEJMZIW-KSSFIOAISA-N 1 0 344.411 3.604 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850524905 1136277408 /nfs/dbraw/zinc/27/74/08/1136277408.db2.gz JNMJQAIXKVQGLC-XIRDDKMYSA-N 1 0 330.428 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814226410 1136425280 /nfs/dbraw/zinc/42/52/80/1136425280.db2.gz WNGPKDSMEKMOQO-INIZCTEOSA-N 1 0 336.395 3.782 20 5 EHBDRO Cc1ccc(C[C@@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583740 1136442309 /nfs/dbraw/zinc/44/23/09/1136442309.db2.gz GMKLKTWJRPXIIA-PMACEKPBSA-N 1 0 340.423 3.644 20 5 EHBDRO CC[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccc(F)cc1 ZINC000776580719 1136445459 /nfs/dbraw/zinc/44/54/59/1136445459.db2.gz ZGNAYPLDXVBUNY-ACJLOTCBSA-N 1 0 332.375 3.850 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)c1 ZINC000852426873 1136455513 /nfs/dbraw/zinc/45/55/13/1136455513.db2.gz PURCLXDHKAYYCH-WMZOPIPTSA-N 1 0 342.395 3.839 20 5 EHBDRO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)C[NH+]1CCCCC1 ZINC000111190154 1136520149 /nfs/dbraw/zinc/52/01/49/1136520149.db2.gz LTRHHSCGVRGNQG-LBPRGKRZSA-N 1 0 334.445 3.738 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240417 1136521553 /nfs/dbraw/zinc/52/15/53/1136521553.db2.gz GZWASNNHGHUPCA-CHWSQXEVSA-N 1 0 341.411 3.914 20 5 EHBDRO C[NH+]1CCC([C@H]2CCN(c3ccc(C(F)F)cc3[N+](=O)[O-])C2)CC1 ZINC000853457765 1136534123 /nfs/dbraw/zinc/53/41/23/1136534123.db2.gz LZEKRUVEASBPJG-AWEZNQCLSA-N 1 0 339.386 3.701 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(O)CCCC2)s1 ZINC000111385274 1136540394 /nfs/dbraw/zinc/54/03/94/1136540394.db2.gz BEBVUQZDYMUCRG-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO O=[N+]([O-])c1cc(CNc2cc3c(c[nH+]2)CCC3)ccc1Br ZINC000815158806 1136558576 /nfs/dbraw/zinc/55/85/76/1136558576.db2.gz BAJAUIVTNVKQJW-UHFFFAOYSA-N 1 0 348.200 3.853 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567825 1136612249 /nfs/dbraw/zinc/61/22/49/1136612249.db2.gz NDIOHSMAGJNYPL-NSHDSACASA-N 1 0 335.791 3.560 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1SCCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815587116 1136615110 /nfs/dbraw/zinc/61/51/10/1136615110.db2.gz ZYELPBYLRSSUGW-KPZWWZAWSA-N 1 0 343.452 3.858 20 5 EHBDRO C[C@H]([NH2+]Cc1ccccc1OC1CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815593608 1136616496 /nfs/dbraw/zinc/61/64/96/1136616496.db2.gz RQIJRUUJDWAXCO-ZDUSSCGKSA-N 1 0 341.411 3.959 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614993 1136618858 /nfs/dbraw/zinc/61/88/58/1136618858.db2.gz FZLIGKXWBWCEJI-ZANVPECISA-N 1 0 332.429 3.670 20 5 EHBDRO Cc1c(C[N@@H+](Cc2ccccc2)[C@@H](CO)C(C)C)cccc1[N+](=O)[O-] ZINC000112659813 1136644012 /nfs/dbraw/zinc/64/40/12/1136644012.db2.gz IHGPFIAUVSJTLB-FQEVSTJZSA-N 1 0 342.439 3.922 20 5 EHBDRO CCC[C@H](Cc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819013548 1136902838 /nfs/dbraw/zinc/90/28/38/1136902838.db2.gz WEMVDLBGFPPGNJ-IEBWSBKVSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[N@@H+](c1ccc(NC[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1)C(C)C ZINC000819397294 1136935611 /nfs/dbraw/zinc/93/56/11/1136935611.db2.gz JLPIILHKMNZKPC-IBGZPJMESA-N 1 0 343.427 3.975 20 5 EHBDRO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000859213994 1137007849 /nfs/dbraw/zinc/00/78/49/1137007849.db2.gz DYHMAWGAZVYIMW-UHFFFAOYSA-N 1 0 347.846 3.942 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]C2(c3c(F)cccc3F)CCC2)c1 ZINC000860203950 1137049426 /nfs/dbraw/zinc/04/94/26/1137049426.db2.gz UUTPVGKOVVFSDG-INIZCTEOSA-N 1 0 348.349 3.575 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2(c3ccccc3Cl)CCC2)c1 ZINC000844351886 1137214408 /nfs/dbraw/zinc/21/44/08/1137214408.db2.gz SPYWBAUOKPDGPD-QGZVFWFLSA-N 1 0 346.814 3.951 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc(F)c(F)c2N(C)C)cc1[N+](=O)[O-] ZINC000865788051 1137312019 /nfs/dbraw/zinc/31/20/19/1137312019.db2.gz XLMJZSLJVYGGDB-UHFFFAOYSA-N 1 0 335.354 3.537 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1OC1CC1 ZINC000865787119 1137312094 /nfs/dbraw/zinc/31/20/94/1137312094.db2.gz IAUYXPAFPQKGCH-UHFFFAOYSA-N 1 0 342.395 3.743 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000846190125 1137340771 /nfs/dbraw/zinc/34/07/71/1137340771.db2.gz SKPHYQWOVYZHOT-MDASCCDHSA-N 1 0 328.412 3.932 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000866306985 1137344022 /nfs/dbraw/zinc/34/40/22/1137344022.db2.gz PSWXUMZMPCYTSE-CZUORRHYSA-N 1 0 336.407 3.746 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@H]2CCCCO2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866480303 1137357958 /nfs/dbraw/zinc/35/79/58/1137357958.db2.gz CCEBFWXTTWYDHX-CXAGYDPISA-N 1 0 333.432 3.567 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)cc1[N+](=O)[O-] ZINC000866528785 1137361462 /nfs/dbraw/zinc/36/14/62/1137361462.db2.gz JYAVZEAZZRDVIP-ZBFHGGJFSA-N 1 0 348.443 3.851 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)C(C)(F)F ZINC000866543148 1137363465 /nfs/dbraw/zinc/36/34/65/1137363465.db2.gz RTUDXHIODSRCFO-NSHDSACASA-N 1 0 343.374 3.583 20 5 EHBDRO CCC(CC)[NH+]1CCC(Nc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC001161094765 1137419037 /nfs/dbraw/zinc/41/90/37/1137419037.db2.gz KIKXNULEIXXZMQ-UHFFFAOYSA-N 1 0 326.828 3.708 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000339085539 1137431739 /nfs/dbraw/zinc/43/17/39/1137431739.db2.gz HDLJKLGXGVEXDQ-GHMZBOCLSA-N 1 0 332.322 3.518 20 5 EHBDRO CC[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000773121191 1137466780 /nfs/dbraw/zinc/46/67/80/1137466780.db2.gz UZSFXSYQEYYECH-KRWDZBQOSA-N 1 0 329.356 3.786 20 5 EHBDRO [NH3+]C[C@H]1COc2ccccc2N1c1cc2ccccc2c([N+](=O)[O-])c1 ZINC001171398770 1137470803 /nfs/dbraw/zinc/47/08/03/1137470803.db2.gz WPUBUDZBWCCBTC-HNNXBMFYSA-N 1 0 335.363 3.606 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872017251 1137564733 /nfs/dbraw/zinc/56/47/33/1137564733.db2.gz XROCXGTWDHKWFH-BBRMVZONSA-N 1 0 347.390 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](C)Cc1ccncc1 ZINC000872041700 1137567246 /nfs/dbraw/zinc/56/72/46/1137567246.db2.gz KEZSFFSMZBWTDY-QWHCGFSZSA-N 1 0 331.441 3.994 20 5 EHBDRO C[C@H]([NH2+][C@@H]1[C@@H]2CCO[C@H]2C12CCCC2)c1c(F)cccc1[N+](=O)[O-] ZINC000872057564 1137568617 /nfs/dbraw/zinc/56/86/17/1137568617.db2.gz GBQFDZKXLMIHHJ-IYVPYFHTSA-N 1 0 334.391 3.732 20 5 EHBDRO C[C@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064607 1137569186 /nfs/dbraw/zinc/56/91/86/1137569186.db2.gz IUHWAWQZYATFBP-UGSOOPFHSA-N 1 0 332.375 3.682 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC([NH+]2CCCCC2)C1 ZINC000872069474 1137569455 /nfs/dbraw/zinc/56/94/55/1137569455.db2.gz QADFZBFWZUHFSL-VQCLRJIVSA-N 1 0 349.500 3.984 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1c2ccccc2CN1C)c1c(F)cccc1[N+](=O)[O-] ZINC000872091965 1137570941 /nfs/dbraw/zinc/57/09/41/1137570941.db2.gz KRQJEEJQUOAXAH-SJKOYZFVSA-N 1 0 329.375 3.571 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCn2nccc21 ZINC000872095226 1137570983 /nfs/dbraw/zinc/57/09/83/1137570983.db2.gz RTMHTBLUAJQTRQ-SMDDNHRTSA-N 1 0 332.429 3.699 20 5 EHBDRO C[C@H](CC(=O)Nc1ccccc1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872130752 1137573095 /nfs/dbraw/zinc/57/30/95/1137573095.db2.gz QLOMZECIFYVOHZ-ZIAGYGMSSA-N 1 0 327.384 3.663 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1ccc(F)cc1)c1ccccc1[N+](=O)[O-] ZINC000872131255 1137573298 /nfs/dbraw/zinc/57/32/98/1137573298.db2.gz YXPGREOAGBOLEB-QWHCGFSZSA-N 1 0 345.374 3.802 20 5 EHBDRO COC(=O)CC[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000873045438 1137588867 /nfs/dbraw/zinc/58/88/67/1137588867.db2.gz DYSTXUQWTQIVKX-QGZVFWFLSA-N 1 0 342.395 3.687 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1c(C2CCC2)cnn1C ZINC000873137723 1137591047 /nfs/dbraw/zinc/59/10/47/1137591047.db2.gz FNEYLCCJKDLGGG-UHFFFAOYSA-N 1 0 328.416 3.502 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)cc1O ZINC000876633515 1137657752 /nfs/dbraw/zinc/65/77/52/1137657752.db2.gz RFQWEPONYBWQMA-UHFFFAOYSA-N 1 0 330.384 3.558 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(Cl)s1 ZINC000877035755 1137668194 /nfs/dbraw/zinc/66/81/94/1137668194.db2.gz JSEGUAMKJWUDFX-RTYFJBAXSA-N 1 0 340.836 3.951 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@@H]3CC[C@H](c4ccc(F)cc4)C3)C2)c1 ZINC000877488232 1137678007 /nfs/dbraw/zinc/67/80/07/1137678007.db2.gz CTLYJBYPWZDEIF-DFULUXCASA-N 1 0 344.390 3.560 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CCC[C@@H]3CC3(Cl)Cl)nc2c1 ZINC000877614834 1137683039 /nfs/dbraw/zinc/68/30/39/1137683039.db2.gz NHAHAGDUTMPTDD-SECBINFHSA-N 1 0 344.198 3.800 20 5 EHBDRO CC(C)[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1F ZINC000877624717 1137683409 /nfs/dbraw/zinc/68/34/09/1137683409.db2.gz DCHLVJPUBDDXSJ-FVKWTLKZSA-N 1 0 332.379 3.621 20 5 EHBDRO CC(C)[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1F ZINC000877624718 1137683476 /nfs/dbraw/zinc/68/34/76/1137683476.db2.gz DCHLVJPUBDDXSJ-QWQCLYJRSA-N 1 0 332.379 3.621 20 5 EHBDRO CCO[P@@](C)(=O)CC[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000877827757 1137692324 /nfs/dbraw/zinc/69/23/24/1137692324.db2.gz OQNCLXKJNSNZEU-GPAUDHNESA-N 1 0 328.349 3.968 20 5 EHBDRO C[C@@H](c1cccs1)N(C)Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000877971341 1137697550 /nfs/dbraw/zinc/69/75/50/1137697550.db2.gz VRQMNZXZBWPOMA-NSHDSACASA-N 1 0 344.396 3.899 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C[C@H]1CCC2(CCOCC2)O1 ZINC000877993107 1137698838 /nfs/dbraw/zinc/69/88/38/1137698838.db2.gz XHLRZJCXRLBHBI-GOSISDBHSA-N 1 0 348.443 3.533 20 5 EHBDRO CC(C)C1CC[NH+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000878134805 1137704045 /nfs/dbraw/zinc/70/40/45/1137704045.db2.gz RNTULSOXCZNJBE-UHFFFAOYSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCCC1 ZINC000878348053 1137711931 /nfs/dbraw/zinc/71/19/31/1137711931.db2.gz CLPABRHPCWBNFA-GFCCVEGCSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CC(C)(C)C1 ZINC000878713072 1137725943 /nfs/dbraw/zinc/72/59/43/1137725943.db2.gz JQCIKCYQNAIGAZ-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@]12C[C@@H]1CCCC2 ZINC000879266287 1137742904 /nfs/dbraw/zinc/74/29/04/1137742904.db2.gz UETVGXRGSFFMCO-XAYKYTGQSA-N 1 0 342.399 3.703 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(OC)c1OC ZINC000879466571 1137748564 /nfs/dbraw/zinc/74/85/64/1137748564.db2.gz UMBYAGFSWOHCRW-OAHLLOKOSA-N 1 0 348.374 3.992 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CCCN(C(=O)CC(C)C)CC1 ZINC000879760763 1137758193 /nfs/dbraw/zinc/75/81/93/1137758193.db2.gz LKJXTSPJHQYZBD-INIZCTEOSA-N 1 0 347.459 3.545 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000130372132 1137836682 /nfs/dbraw/zinc/83/66/82/1137836682.db2.gz UPFVSCMSDZTCOX-MSOLQXFVSA-N 1 0 332.375 3.898 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCCc3nc(C)sc32)cc1[N+](=O)[O-] ZINC000111312371 1137904189 /nfs/dbraw/zinc/90/41/89/1137904189.db2.gz MHCBZZDZCJEMDK-CQSZACIVSA-N 1 0 347.440 3.878 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901931 1137925166 /nfs/dbraw/zinc/92/51/66/1137925166.db2.gz JRXSICFUKJONQJ-RTOBDTNUSA-N 1 0 332.444 3.917 20 5 EHBDRO COCC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000119294066 1137940274 /nfs/dbraw/zinc/94/02/74/1137940274.db2.gz UZTDGQRFUBDBCX-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000332338776 1137940561 /nfs/dbraw/zinc/94/05/61/1137940561.db2.gz LFQLNANNOBJTQF-IRXDYDNUSA-N 1 0 334.416 3.766 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000884717646 1137970952 /nfs/dbraw/zinc/97/09/52/1137970952.db2.gz HSMDGZXZRARKKA-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2C[C@@H]3CCC[C@]3(C(F)(F)F)C2)cc1F ZINC000886617268 1138102461 /nfs/dbraw/zinc/10/24/61/1138102461.db2.gz JAJHDXRDKNDNFO-FZMZJTMJSA-N 1 0 332.297 3.898 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1cc(C2CC2)no1 ZINC000886684278 1138114859 /nfs/dbraw/zinc/11/48/59/1138114859.db2.gz IUXZWCPFLNOGOW-WMLDXEAASA-N 1 0 341.411 3.961 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](c2ncccn2)C1 ZINC000886685947 1138115131 /nfs/dbraw/zinc/11/51/31/1138115131.db2.gz HGJWUBWRTKQUAU-CABCVRRESA-N 1 0 326.400 3.634 20 5 EHBDRO C[C@@H]([NH2+]CC[C@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000886707612 1138120381 /nfs/dbraw/zinc/12/03/81/1138120381.db2.gz MGMYBSFQZSLCBK-CRAIPNDOSA-N 1 0 348.443 3.611 20 5 EHBDRO CCOc1ccc([C@H](C)NC2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000089512952 1138200432 /nfs/dbraw/zinc/20/04/32/1138200432.db2.gz PMPLXRSARCXMEJ-AWEZNQCLSA-N 1 0 349.475 3.907 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(=O)oc2ccc3ccccc3c12)C1CCOCC1 ZINC000125365480 1138306901 /nfs/dbraw/zinc/30/69/01/1138306901.db2.gz NQLGCKCWZCSJCS-AWEZNQCLSA-N 1 0 337.419 3.851 20 5 EHBDRO C[C@H]1C[C@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130655966 1138467463 /nfs/dbraw/zinc/46/74/63/1138467463.db2.gz LBYVWKSJWUEBNM-GOEBONIOSA-N 1 0 343.427 3.769 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000151583555 1139046174 /nfs/dbraw/zinc/04/61/74/1139046174.db2.gz GSAAKOVIPXIFDO-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152567429 1139098376 /nfs/dbraw/zinc/09/83/76/1139098376.db2.gz DLFSYRJRHSKTGE-HOTGVXAUSA-N 1 0 325.412 3.772 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000178209572 1139679159 /nfs/dbraw/zinc/67/91/59/1139679159.db2.gz HRCMHCKTEVKIQS-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO O=C(Nc1cccc(CC[NH+]2CCCC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000179548457 1139764469 /nfs/dbraw/zinc/76/44/69/1139764469.db2.gz GECRAUHPQSRBHP-UHFFFAOYSA-N 1 0 345.424 3.547 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1O ZINC000182840930 1139996194 /nfs/dbraw/zinc/99/61/94/1139996194.db2.gz JTQUKYLVEKBBKB-ZDUSSCGKSA-N 1 0 330.384 3.810 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2cccc(F)c2)CCOCC1 ZINC000183493490 1140042679 /nfs/dbraw/zinc/04/26/79/1140042679.db2.gz XNPGVJJPZVQKRE-UHFFFAOYSA-N 1 0 344.386 3.838 20 5 EHBDRO CC[C@@H]([NH2+]CC1CCC2(CC1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000190326465 1140398372 /nfs/dbraw/zinc/39/83/72/1140398372.db2.gz YMHWFTKJCRPIBH-QGZVFWFLSA-N 1 0 334.416 3.569 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120628 1140504337 /nfs/dbraw/zinc/50/43/37/1140504337.db2.gz GCZYCLLWXAZZHM-SJLPKXTDSA-N 1 0 348.349 3.801 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1OC ZINC000192592562 1140539602 /nfs/dbraw/zinc/53/96/02/1140539602.db2.gz KMJXAOROBILUAP-QGZVFWFLSA-N 1 0 342.395 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1cnn(-c3ccccc3)c1)CCC2 ZINC000192643577 1140541452 /nfs/dbraw/zinc/54/14/52/1140541452.db2.gz YDENZTRSVBEPGX-FQEVSTJZSA-N 1 0 348.406 3.948 20 5 EHBDRO CC(=O)Nc1cccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000192669823 1140543303 /nfs/dbraw/zinc/54/33/03/1140543303.db2.gz IBDZTRKVWFPSAD-LJQANCHMSA-N 1 0 339.395 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCO[C@]3(CCSC3)C1)CCC2 ZINC000193030968 1140561051 /nfs/dbraw/zinc/56/10/51/1140561051.db2.gz PILMHKXSNSXJHL-FHLIZLRMSA-N 1 0 348.468 3.617 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@@H]1C[C@H](O)c1cccs1 ZINC000267441947 1140791810 /nfs/dbraw/zinc/79/18/10/1140791810.db2.gz IDZVVRPXWQOADD-ZBFHGGJFSA-N 1 0 332.425 3.744 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)cc1 ZINC000269640036 1141130951 /nfs/dbraw/zinc/13/09/51/1141130951.db2.gz BXKFPZSCBVPUQJ-OALUTQOASA-N 1 0 344.411 3.624 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000270602489 1141243814 /nfs/dbraw/zinc/24/38/14/1141243814.db2.gz FXZIRXJVUHLMSG-FHSNZYRGSA-N 1 0 332.375 3.897 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000270621355 1141247016 /nfs/dbraw/zinc/24/70/16/1141247016.db2.gz FRGWDYVMUSYYKQ-RHSMWYFYSA-N 1 0 336.432 3.677 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1c1ccncc1 ZINC000271045873 1141299407 /nfs/dbraw/zinc/29/94/07/1141299407.db2.gz VDHFSCYRFVGLQG-KRWDZBQOSA-N 1 0 327.384 3.726 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([S@@](C)=O)cc1)c1ccccc1[N+](=O)[O-] ZINC000271445035 1141368999 /nfs/dbraw/zinc/36/89/99/1141368999.db2.gz FLWYICUGCOJWNH-WDVBMNPBSA-N 1 0 332.425 3.744 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271558782 1141397634 /nfs/dbraw/zinc/39/76/34/1141397634.db2.gz WIBDAPHEKCVWEI-UONOGXRCSA-N 1 0 346.456 3.856 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271684348 1141417932 /nfs/dbraw/zinc/41/79/32/1141417932.db2.gz POGHCYJDNACNJU-HNNXBMFYSA-N 1 0 327.384 3.664 20 5 EHBDRO [NH3+]CCN(Cc1cccc(C(F)(F)F)c1)c1ccccc1[N+](=O)[O-] ZINC000348907582 1141607437 /nfs/dbraw/zinc/60/74/37/1141607437.db2.gz XLQNVUHIRVCJSV-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[N@@H+]1CCC[C@@H](C)C1 ZINC000052160046 214121288 /nfs/dbraw/zinc/12/12/88/214121288.db2.gz KYXJZOWUMBHMGD-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO O=C(NCC[NH+]1CCCCC1)c1cc2ccccc2c2cccnc12 ZINC000044530078 1014159872 /nfs/dbraw/zinc/15/98/72/1014159872.db2.gz BEECVUGQABUQED-UHFFFAOYSA-N 1 0 333.435 3.604 20 5 EHBDRO CCOC(=O)C(C)(C)C1CC[NH+]([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000510077042 1014724214 /nfs/dbraw/zinc/72/42/14/1014724214.db2.gz AHTPXUJEWZKSAK-CQSZACIVSA-N 1 0 348.443 3.957 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2OC)c1 ZINC000430195117 1014795333 /nfs/dbraw/zinc/79/53/33/1014795333.db2.gz NAKIVMDIRTZCLW-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@@H](c1ccc2c(c1)CCC2)[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000459424937 1032109860 /nfs/dbraw/zinc/10/98/60/1032109860.db2.gz KYQALCPGAXESMB-AWEZNQCLSA-N 1 0 340.427 3.678 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000120524214 1015403613 /nfs/dbraw/zinc/40/36/13/1015403613.db2.gz YCHZNQKXWBZIJV-SCLBCKFNSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CC[C@@H](CC2CC2)C1 ZINC000339670821 1015491887 /nfs/dbraw/zinc/49/18/87/1015491887.db2.gz FUFRMWBBMHGYDF-OCCSQVGLSA-N 1 0 342.399 3.828 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)c1cn[nH]c1 ZINC000339791005 1015675714 /nfs/dbraw/zinc/67/57/14/1015675714.db2.gz FXBMHRQAXRQKDB-LLVKDONJSA-N 1 0 328.397 3.897 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@H]2Cn2cnc3ccccc32)c1 ZINC000339908754 1015881638 /nfs/dbraw/zinc/88/16/38/1015881638.db2.gz FLVVAGQVUXXFCJ-KRWDZBQOSA-N 1 0 336.395 3.609 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc([C@@H]3CCC[N@@H+]3C3CCCC3)n2)c1 ZINC000275420252 1016733294 /nfs/dbraw/zinc/73/32/94/1016733294.db2.gz HHCPFBBMBUCEME-HNNXBMFYSA-N 1 0 328.372 3.724 20 5 EHBDRO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@H+](C)CCC1CCCCC1 ZINC001167273379 1016913694 /nfs/dbraw/zinc/91/36/94/1016913694.db2.gz DREQRKKVHBAMDP-AWEZNQCLSA-N 1 0 333.432 3.824 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000336893099 1016932710 /nfs/dbraw/zinc/93/27/10/1016932710.db2.gz TUJJSUUAKHSBCP-QGZVFWFLSA-N 1 0 342.395 3.649 20 5 EHBDRO CC(C)[C@H]1[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])CC12CCOCC2 ZINC000414527942 1016953410 /nfs/dbraw/zinc/95/34/10/1016953410.db2.gz NJYBVTZHILJHEM-SUQGKYDKSA-N 1 0 330.428 3.745 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000449108044 1032187690 /nfs/dbraw/zinc/18/76/90/1032187690.db2.gz SAVWBDGMGFOZQC-MAUKXSAKSA-N 1 0 345.443 3.792 20 5 EHBDRO CCOc1ccc(OCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000538176986 1032196854 /nfs/dbraw/zinc/19/68/54/1032196854.db2.gz WYINTCGFOOXZOE-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC2 ZINC000538196273 1032211441 /nfs/dbraw/zinc/21/14/41/1032211441.db2.gz ZSGYWUIYOHYONY-UHFFFAOYSA-N 1 0 343.349 3.678 20 5 EHBDRO CCc1nc(CC[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])sc1C ZINC000449113250 1032234331 /nfs/dbraw/zinc/23/43/31/1032234331.db2.gz FYHJLIOLFQRBJW-LBPRGKRZSA-N 1 0 333.457 3.685 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc2c(s1)CCCC2 ZINC000449138270 1032240417 /nfs/dbraw/zinc/24/04/17/1032240417.db2.gz HQSAVJVPFXNKPJ-CYBMUJFWSA-N 1 0 345.468 3.693 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCO[C@@H]1C(C)(C)C ZINC000449146223 1032247510 /nfs/dbraw/zinc/24/75/10/1032247510.db2.gz BJCKMUYYTHITTR-HFTRVMKXSA-N 1 0 334.460 3.957 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2cc3cccnc3o2)cc1 ZINC000449178187 1032273562 /nfs/dbraw/zinc/27/35/62/1032273562.db2.gz WWDPVUAIUIXLMX-UHFFFAOYSA-N 1 0 325.368 3.849 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(C(=O)CC(C)C)CC1 ZINC000536825373 1032325800 /nfs/dbraw/zinc/32/58/00/1032325800.db2.gz GFVFFVUAKMSAEJ-OAHLLOKOSA-N 1 0 347.459 3.591 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000536838863 1032332797 /nfs/dbraw/zinc/33/27/97/1032332797.db2.gz LJCSEWKRVJAMCH-DNVCBOLYSA-N 1 0 339.439 3.692 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000459633759 1032351808 /nfs/dbraw/zinc/35/18/08/1032351808.db2.gz FBGRFDCVXCGNRY-ZDUSSCGKSA-N 1 0 340.383 3.632 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@H]1OCCc2sccc21 ZINC000449341122 1032457488 /nfs/dbraw/zinc/45/74/88/1032457488.db2.gz RVMABCVOGBMVQO-SNUQEOBHSA-N 1 0 346.452 3.879 20 5 EHBDRO CO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC000459777500 1032463616 /nfs/dbraw/zinc/46/36/16/1032463616.db2.gz WBAGSUGENWSUKP-ZIAGYGMSSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000449347813 1032464344 /nfs/dbraw/zinc/46/43/44/1032464344.db2.gz JEMLJERUFPXPMY-STQMWFEESA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H](CCO)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449355564 1032493407 /nfs/dbraw/zinc/49/34/07/1032493407.db2.gz AUBXWDBKHNFTTR-ZDUSSCGKSA-N 1 0 334.441 3.822 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CCOC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000449416769 1032521144 /nfs/dbraw/zinc/52/11/44/1032521144.db2.gz VFOZAFLMBRHECE-QGZVFWFLSA-N 1 0 346.383 3.521 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCOC3(C)C)o2)c([N+](=O)[O-])c1 ZINC000449416768 1032520325 /nfs/dbraw/zinc/52/03/25/1032520325.db2.gz VFOZAFLMBRHECE-KRWDZBQOSA-N 1 0 346.383 3.521 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC000449402006 1032525555 /nfs/dbraw/zinc/52/55/55/1032525555.db2.gz OZVJWNKRITYFAH-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO Cc1csc(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000449481431 1032607991 /nfs/dbraw/zinc/60/79/91/1032607991.db2.gz SUSUCCQWVFBCES-UHFFFAOYSA-N 1 0 328.340 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccc4c[nH]nc4c3)C2)cc1 ZINC000449500937 1032677726 /nfs/dbraw/zinc/67/77/26/1032677726.db2.gz OSNGRZIZDGBKGI-KRWDZBQOSA-N 1 0 336.395 3.851 20 5 EHBDRO C[NH2+]C[C@H]1CCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000414659958 1017110305 /nfs/dbraw/zinc/11/03/05/1017110305.db2.gz LXFCVZOVFQQBMN-OAHLLOKOSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2ccccc2n1 ZINC000089580713 1017246617 /nfs/dbraw/zinc/24/66/17/1017246617.db2.gz LNIAFKACTCRCLK-CQSZACIVSA-N 1 0 337.379 3.873 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@@H](O)c2ccc(Cl)c(F)c2)cc1[N+](=O)[O-] ZINC000136138247 1017264706 /nfs/dbraw/zinc/26/47/06/1017264706.db2.gz QIXMDUJCPJFPTE-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO CC[C@H]([NH3+])CNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414975830 1017368865 /nfs/dbraw/zinc/36/88/65/1017368865.db2.gz HEPHNNCBFMRQKC-ZDUSSCGKSA-N 1 0 349.818 3.867 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1ccc2c(c1)CCCN2 ZINC000414979215 1017369580 /nfs/dbraw/zinc/36/95/80/1017369580.db2.gz UGTRMIFOGMURMS-UHFFFAOYSA-N 1 0 341.411 3.641 20 5 EHBDRO C[C@@H](NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1)[C@H](C)[NH3+] ZINC000415014164 1017408636 /nfs/dbraw/zinc/40/86/36/1017408636.db2.gz LOHVRPDQLHDFHK-NWDGAFQWSA-N 1 0 349.818 3.866 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H]([C@@H]4CCOC4)C3)o2)c1 ZINC000377237781 1017514902 /nfs/dbraw/zinc/51/49/02/1017514902.db2.gz JJAAWQQJODIPTA-JKSUJKDBSA-N 1 0 342.395 3.713 20 5 EHBDRO C[NH2+]CCCN(C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000415138998 1017601900 /nfs/dbraw/zinc/60/19/00/1017601900.db2.gz WDYIIWTUDJPMQQ-UHFFFAOYSA-N 1 0 337.807 3.550 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181552690 1017712598 /nfs/dbraw/zinc/71/25/98/1017712598.db2.gz PZJBGRIUOIVRTN-NIKGAXFTSA-N 1 0 328.412 3.628 20 5 EHBDRO Cc1ccncc1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449527129 1032728110 /nfs/dbraw/zinc/72/81/10/1032728110.db2.gz ZRIOXFGTMBTBKR-MAUKXSAKSA-N 1 0 325.412 3.799 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H](C)O ZINC000449533519 1032744958 /nfs/dbraw/zinc/74/49/58/1032744958.db2.gz BEPUVCSXLRTWLQ-BMIGLBTASA-N 1 0 338.791 3.757 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010020 1018198243 /nfs/dbraw/zinc/19/82/43/1018198243.db2.gz BSXIIFICMOXOGP-PBHICJAKSA-N 1 0 340.427 3.678 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCO[C@H](c2ccncc2)C1 ZINC000449535680 1032750163 /nfs/dbraw/zinc/75/01/63/1032750163.db2.gz HWYZFFACQNTKML-DUVWHUSGSA-N 1 0 339.395 3.513 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCC(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000592400518 1032757200 /nfs/dbraw/zinc/75/72/00/1032757200.db2.gz VGCIKJASSXMLPX-PGEKIEPBSA-N 1 0 346.406 3.536 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)CCc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000327565942 1018482790 /nfs/dbraw/zinc/48/27/90/1018482790.db2.gz YIECZZYPPIJMGU-ZDUSSCGKSA-N 1 0 342.395 3.743 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000468632517 1018567171 /nfs/dbraw/zinc/56/71/71/1018567171.db2.gz SVMBTVOEVRUOJP-BAAYTWLHSA-N 1 0 326.396 3.925 20 5 EHBDRO Cc1c(NC(=O)CC[NH+]2C3CCCC2CCC3)cccc1[N+](=O)[O-] ZINC000610395007 1018744523 /nfs/dbraw/zinc/74/45/23/1018744523.db2.gz IUVPLTDBSPOHSQ-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+]1C2CCCC1CCC2 ZINC000610395059 1018753157 /nfs/dbraw/zinc/75/31/57/1018753157.db2.gz VRALUVYCPKLLRQ-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H](C)[C@@H](C)[C@H]1C ZINC000419373609 1018952301 /nfs/dbraw/zinc/95/23/01/1018952301.db2.gz OLWWMVHRXZQMFB-FDYHWXHSSA-N 1 0 330.388 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@H](CCO)c1ccccc1F)CCC2 ZINC000592403641 1032799338 /nfs/dbraw/zinc/79/93/38/1032799338.db2.gz ROCHLRDRTBCCEY-RBUKOAKNSA-N 1 0 344.386 3.825 20 5 EHBDRO CCOc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1OC ZINC000236959842 1019075624 /nfs/dbraw/zinc/07/56/24/1019075624.db2.gz AGTRUVGRKKRVMQ-UHFFFAOYSA-N 1 0 330.384 3.600 20 5 EHBDRO C[N@@H+]1CCN(c2nc3ccccc3cc2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000473507442 1019078008 /nfs/dbraw/zinc/07/80/08/1019078008.db2.gz LAARLNPUCTZRCF-LJQANCHMSA-N 1 0 348.406 3.636 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000120615842 1019101489 /nfs/dbraw/zinc/10/14/89/1019101489.db2.gz KADLSLKVOUJDME-WCQYABFASA-N 1 0 330.432 3.535 20 5 EHBDRO CC[C@H]1CCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000340686672 1019324350 /nfs/dbraw/zinc/32/43/50/1019324350.db2.gz IWHPMXGTRITDAI-NSHDSACASA-N 1 0 330.331 3.579 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCSCC1 ZINC000580597558 1019715720 /nfs/dbraw/zinc/71/57/20/1019715720.db2.gz AYIDOGFTNZEMMH-GFCCVEGCSA-N 1 0 333.457 3.740 20 5 EHBDRO Cc1ncc([C@@H](C)[N@@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)c(C)n1 ZINC000602439162 1032889975 /nfs/dbraw/zinc/88/99/75/1032889975.db2.gz IGXXBXGPQQPUGD-CQSZACIVSA-N 1 0 328.416 3.973 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1ccccc1Cn1cccn1 ZINC000581141734 1020471820 /nfs/dbraw/zinc/47/18/20/1020471820.db2.gz BBPPKVXKXWXBFH-LJQANCHMSA-N 1 0 348.406 3.617 20 5 EHBDRO Cc1csc(C[C@@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)n1 ZINC000933127125 1020631207 /nfs/dbraw/zinc/63/12/07/1020631207.db2.gz WDUPGOLZQIRAGZ-LBPRGKRZSA-N 1 0 335.404 3.563 20 5 EHBDRO C[C@H]([C@@H](C)c1ccc(Cl)cc1)[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488557 1032919325 /nfs/dbraw/zinc/91/93/25/1032919325.db2.gz ZHKFHFQPDXPOKO-VXGBXAGGSA-N 1 0 336.823 3.606 20 5 EHBDRO Cc1ccc(C[NH2+]C2CCC(C(=O)OC(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000094015424 1032927671 /nfs/dbraw/zinc/92/76/71/1032927671.db2.gz VAXZRBASWDVRPG-UHFFFAOYSA-N 1 0 348.443 3.893 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)cc1 ZINC000602518786 1032932126 /nfs/dbraw/zinc/93/21/26/1032932126.db2.gz SFCQUAMPIYNQLK-HNNXBMFYSA-N 1 0 340.427 3.618 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@H]1c1cccc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000610505057 1020861524 /nfs/dbraw/zinc/86/15/24/1020861524.db2.gz XLUBLBAQYOOJAF-INIZCTEOSA-N 1 0 343.358 3.510 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000510436044 1021147877 /nfs/dbraw/zinc/14/78/77/1021147877.db2.gz YAQLVGKIUURGKP-HOCLYGCPSA-N 1 0 336.395 3.953 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCC[C@@H](c3cccnc3)C2)cc1[N+](=O)[O-] ZINC000337348439 1021424128 /nfs/dbraw/zinc/42/41/28/1021424128.db2.gz ZAVGYHWMVLGANT-NVXWUHKLSA-N 1 0 341.411 3.814 20 5 EHBDRO C[C@@]1(CCCO)CCC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000516478520 1021475070 /nfs/dbraw/zinc/47/50/70/1021475070.db2.gz KNLNCWWMIFGVOP-IBGZPJMESA-N 1 0 344.411 3.982 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000322943095 1021475767 /nfs/dbraw/zinc/47/57/67/1021475767.db2.gz MUOVGBZQCTTXOG-MJEQTWJJSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCCc1ccccn1 ZINC000602574015 1032983947 /nfs/dbraw/zinc/98/39/47/1032983947.db2.gz DHNDOXKZRVXUFH-UHFFFAOYSA-N 1 0 339.317 3.731 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NCC[N@H+]1CCCC[C@@H]1CC ZINC000518746227 1021506333 /nfs/dbraw/zinc/50/63/33/1021506333.db2.gz NFLUVCGVUBHOPI-HNNXBMFYSA-N 1 0 348.447 3.543 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNCCC[N@H+](C)C1CCCCC1 ZINC000509601217 1021546739 /nfs/dbraw/zinc/54/67/39/1021546739.db2.gz OGDPMSLDZRSQBT-UHFFFAOYSA-N 1 0 349.475 3.738 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NCCC[NH2+]Cc1cccnc1 ZINC000326298970 1021568451 /nfs/dbraw/zinc/56/84/51/1021568451.db2.gz IJNWXILWQQQAMK-UHFFFAOYSA-N 1 0 336.342 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000490037575 1021591888 /nfs/dbraw/zinc/59/18/88/1021591888.db2.gz IBUOPEXCVKJFDK-RDJZCZTQSA-N 1 0 331.460 3.628 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000519751499 1021658602 /nfs/dbraw/zinc/65/86/02/1021658602.db2.gz XOJUQFPOLQUWNW-UKRRQHHQSA-N 1 0 326.396 3.730 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1 ZINC000090909880 1021696225 /nfs/dbraw/zinc/69/62/25/1021696225.db2.gz SFENHCSGPJICOC-LSDHHAIUSA-N 1 0 328.412 3.928 20 5 EHBDRO Cc1cc(NCc2cccc(N(C)C)n2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302055076 1021737353 /nfs/dbraw/zinc/73/73/53/1021737353.db2.gz AHMRIDCHGACDJI-UHFFFAOYSA-N 1 0 337.383 3.525 20 5 EHBDRO CN(CCc1ccccc1[N+](=O)[O-])Cc1csc(C(F)(F)F)n1 ZINC000894392024 1021827805 /nfs/dbraw/zinc/82/78/05/1021827805.db2.gz UGBOTIQIVNQZIN-UHFFFAOYSA-N 1 0 345.346 3.745 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000516937610 1021872830 /nfs/dbraw/zinc/87/28/30/1021872830.db2.gz LUAWFUIYGPBPEM-CJNGLKHVSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1c(C[N@H+](CCc2ccccc2)[C@H]2CCOC2)cccc1[N+](=O)[O-] ZINC000437503837 1021898339 /nfs/dbraw/zinc/89/83/39/1021898339.db2.gz FQNLBSJYZVCAHT-IBGZPJMESA-N 1 0 340.423 3.737 20 5 EHBDRO C[C@H]1C[C@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602607309 1033023584 /nfs/dbraw/zinc/02/35/84/1033023584.db2.gz HWYOLZIMPMJWMH-NWDGAFQWSA-N 1 0 346.349 3.908 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000178204905 1022140657 /nfs/dbraw/zinc/14/06/57/1022140657.db2.gz OBMIJYQMLTXVIW-AWEZNQCLSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1cc(N[C@@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000302157002 1022208299 /nfs/dbraw/zinc/20/82/99/1022208299.db2.gz FJQLFBDRRHYVJO-RHSMWYFYSA-N 1 0 341.411 3.536 20 5 EHBDRO CC1(C)CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602627800 1033042398 /nfs/dbraw/zinc/04/23/98/1033042398.db2.gz UEGBORHSBBPXHK-HNNXBMFYSA-N 1 0 332.448 3.517 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@H]([NH+]2CCCC2)CC1 ZINC000276702656 1022339585 /nfs/dbraw/zinc/33/95/85/1022339585.db2.gz XRUDCCGWCUSTBK-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])CCO2 ZINC000341562069 1022344138 /nfs/dbraw/zinc/34/41/38/1022344138.db2.gz SEEODPMZTORROK-YXMMZVCTSA-N 1 0 340.379 3.730 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC(C)(C)[C@H]3CCC[C@@H]32)cccc1[N+](=O)[O-] ZINC000550079252 1022361406 /nfs/dbraw/zinc/36/14/06/1022361406.db2.gz KSBMYMARPMGBNT-YOEHRIQHSA-N 1 0 345.443 3.742 20 5 EHBDRO CC1(C)CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)CC1 ZINC000782497607 1033054593 /nfs/dbraw/zinc/05/45/93/1033054593.db2.gz CMMTWCVMCWGEBK-UHFFFAOYSA-N 1 0 337.395 3.575 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CCC[C@@]4(CCOC4)C3)o2)c1 ZINC000449688683 1033072358 /nfs/dbraw/zinc/07/23/58/1033072358.db2.gz WKOBRUBIWVMPCR-LJQANCHMSA-N 1 0 342.395 3.857 20 5 EHBDRO C[N@@H+]1CCC2(CN(C(=O)c3c4ccccc4cc4ccccc43)C2)C1 ZINC001270376461 1022921363 /nfs/dbraw/zinc/92/13/63/1022921363.db2.gz GATRPJIEOHKRPS-UHFFFAOYSA-N 1 0 330.431 3.771 20 5 EHBDRO COc1ccc(OCC[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@@H]32)c([N+](=O)[O-])c1 ZINC000441476441 1023096989 /nfs/dbraw/zinc/09/69/89/1023096989.db2.gz POUOFLFSBIRUEM-YCPHGPKFSA-N 1 0 334.416 3.635 20 5 EHBDRO C[C@@H]1C[C@H](C)CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000127388249 1023147805 /nfs/dbraw/zinc/14/78/05/1023147805.db2.gz ZFYSHGAABDHQLO-CHWSQXEVSA-N 1 0 330.388 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCN(C3CC3)C2)s1 ZINC000518274321 1023185384 /nfs/dbraw/zinc/18/53/84/1023185384.db2.gz VBVGRHCUVKJMRK-CYBMUJFWSA-N 1 0 343.452 3.650 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000602731851 1033122374 /nfs/dbraw/zinc/12/23/74/1033122374.db2.gz BYTPOJNPZUGDRM-VURMDHGXSA-N 1 0 329.444 3.558 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548486541 1023494666 /nfs/dbraw/zinc/49/46/66/1023494666.db2.gz PVMQKAXYMRJARI-WBMJQRKESA-N 1 0 334.416 3.766 20 5 EHBDRO CCOC(=O)C1CCC([NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])CC1 ZINC000602752953 1033145498 /nfs/dbraw/zinc/14/54/98/1033145498.db2.gz ZJJAHFGZRUUBEL-ODIFPOPNSA-N 1 0 348.443 3.627 20 5 EHBDRO C[N@@H+]1CCC[C@H](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000458159335 1023605537 /nfs/dbraw/zinc/60/55/37/1023605537.db2.gz FBKWQFPWVABHDD-MRXNPFEDSA-N 1 0 347.462 3.850 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccncc1 ZINC000610830990 1023780791 /nfs/dbraw/zinc/78/07/91/1023780791.db2.gz YZCPGTWOHQOATF-RDTXWAMCSA-N 1 0 325.412 3.704 20 5 EHBDRO CCO[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000610930479 1023877387 /nfs/dbraw/zinc/87/73/87/1023877387.db2.gz ROADPMCUZVXJHZ-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO Cn1cc(C[NH2+][C@H](CC2CCCC2)c2ccccc2)c([N+](=O)[O-])n1 ZINC000602804000 1033178094 /nfs/dbraw/zinc/17/80/94/1033178094.db2.gz FKIUSOXHZNZOBY-QGZVFWFLSA-N 1 0 328.416 3.740 20 5 EHBDRO CCC(CC)C[N@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000514124544 1024154628 /nfs/dbraw/zinc/15/46/28/1024154628.db2.gz JYNLZRGXGCOEEC-UHFFFAOYSA-N 1 0 341.839 3.945 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1ccc(F)c2ccccc21 ZINC000602834155 1033198110 /nfs/dbraw/zinc/19/81/10/1033198110.db2.gz RRMVHVISCUWHBM-GFCCVEGCSA-N 1 0 342.374 3.743 20 5 EHBDRO CC[NH+](CC)C[C@H](C)NC(=O)c1cc2ccccc2c2cccnc12 ZINC000520621944 1024269397 /nfs/dbraw/zinc/26/93/97/1024269397.db2.gz LSFJDKVBLDIORM-HNNXBMFYSA-N 1 0 335.451 3.848 20 5 EHBDRO C[C@@H]1CCC[C@@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1C ZINC000248544655 1024298439 /nfs/dbraw/zinc/29/84/39/1024298439.db2.gz DSWMIKYBYNOFEG-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCCN(Cc3nc(C4CCC4)no3)C2)cc1 ZINC000602842111 1033218417 /nfs/dbraw/zinc/21/84/17/1033218417.db2.gz QCBRTOIAYXFLBG-OAHLLOKOSA-N 1 0 342.399 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCSC[C@@H]23)c(C(F)F)c1 ZINC000895567677 1024623203 /nfs/dbraw/zinc/62/32/03/1024623203.db2.gz GQVFMDOQZNHBDC-KBPBESRZSA-N 1 0 343.399 3.524 20 5 EHBDRO C[N@H+](Cc1ccccc1)[C@H](CNCc1csc([N+](=O)[O-])c1)C1CC1 ZINC000185220683 1024653534 /nfs/dbraw/zinc/65/35/34/1024653534.db2.gz UNIIWLDRCUUIBZ-QGZVFWFLSA-N 1 0 345.468 3.657 20 5 EHBDRO CC1CC[NH+]([C@H](CNc2ccc([N+](=O)[O-])cn2)c2cccs2)CC1 ZINC000025371284 1024733598 /nfs/dbraw/zinc/73/35/98/1024733598.db2.gz ZIQIOGHQRZKYGZ-OAHLLOKOSA-N 1 0 346.456 3.936 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H](CO)c1ccccc1Cl ZINC000342292388 1024751478 /nfs/dbraw/zinc/75/14/78/1024751478.db2.gz ZGLLIFJQKUWJFM-PKYBCLHXSA-N 1 0 346.814 3.627 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cccc1[N+](=O)[O-] ZINC000602886873 1033236365 /nfs/dbraw/zinc/23/63/65/1033236365.db2.gz JPISQKBYXZBWTP-QGZVFWFLSA-N 1 0 348.406 3.836 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(C(=O)OC(C)C)CC1 ZINC000895828857 1024892885 /nfs/dbraw/zinc/89/28/85/1024892885.db2.gz OPSDLFYRXKQRGY-PTNGSMBKSA-N 1 0 346.427 3.662 20 5 EHBDRO Cc1cnc(CC[N@@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)s1 ZINC000157524976 1024940440 /nfs/dbraw/zinc/94/04/40/1024940440.db2.gz POYKHBJNJZSODL-UHFFFAOYSA-N 1 0 325.821 3.688 20 5 EHBDRO C/C=C\C[C@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000472142202 1025091463 /nfs/dbraw/zinc/09/14/63/1025091463.db2.gz MBEXILMJOAEBSM-PYLYLYNFSA-N 1 0 332.425 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@H]3CCc4ccccc4C3)c2c1 ZINC000520879482 1025101159 /nfs/dbraw/zinc/10/11/59/1025101159.db2.gz GMFDAXDOCXWNOW-KRWDZBQOSA-N 1 0 335.407 3.766 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc(-c2ccccc2)no1 ZINC000511062912 1025119148 /nfs/dbraw/zinc/11/91/48/1025119148.db2.gz FOORELRWXGNFDG-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCOC(F)(F)F)c2ccccc2)c1 ZINC000474031643 1025252239 /nfs/dbraw/zinc/25/22/39/1025252239.db2.gz MPUHRBJEIHBWMK-OAHLLOKOSA-N 1 0 340.301 3.810 20 5 EHBDRO CCCC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC1 ZINC000521317791 1025326553 /nfs/dbraw/zinc/32/65/53/1025326553.db2.gz XIVATWYZPIUYLW-OAHLLOKOSA-N 1 0 333.432 3.872 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CC2(C(F)(F)F)CCC2)n1 ZINC000353963557 1025339253 /nfs/dbraw/zinc/33/92/53/1025339253.db2.gz XQFIHNZWAOLFDI-NEPJUHHUSA-N 1 0 346.353 3.597 20 5 EHBDRO CC[C@H]([NH2+]Cc1c(C)cc(C)nc1OC)c1cccc([N+](=O)[O-])c1 ZINC000346951874 1025344358 /nfs/dbraw/zinc/34/43/58/1025344358.db2.gz URRBHBHXNXDJPR-KRWDZBQOSA-N 1 0 329.400 3.856 20 5 EHBDRO CC[C@H]1[C@@H](C)CC[N@@H+]1CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185606590 1025455786 /nfs/dbraw/zinc/45/57/86/1025455786.db2.gz CLJFPMMCJQSLOL-BBRMVZONSA-N 1 0 329.400 3.913 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000602991078 1033289969 /nfs/dbraw/zinc/28/99/69/1033289969.db2.gz UHLCWACDYUCTBQ-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+][C@H]2C[C@H](c3ccccc3)C2)n1 ZINC000436299184 1025563211 /nfs/dbraw/zinc/56/32/11/1025563211.db2.gz DXHVPPJNCAKQBQ-TVFCKZIOSA-N 1 0 340.427 3.811 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1F ZINC000451104043 1025567057 /nfs/dbraw/zinc/56/70/57/1025567057.db2.gz JHQYSCFAIOTZKU-QWHCGFSZSA-N 1 0 345.374 3.720 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCOCC(F)(F)F ZINC000530326359 1025663371 /nfs/dbraw/zinc/66/33/71/1025663371.db2.gz PCPFZHWRNPFPPG-XYOKQWHBSA-N 1 0 332.322 3.557 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ncc[nH]2)CC1 ZINC000347355958 1025700337 /nfs/dbraw/zinc/70/03/37/1025700337.db2.gz JUXCZMKUAAHYHB-KAMYIIQDSA-N 1 0 326.400 3.601 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000474888980 1025755792 /nfs/dbraw/zinc/75/57/92/1025755792.db2.gz QQWUFRKNQUABRV-VNSJNIRKSA-N 1 0 334.416 3.757 20 5 EHBDRO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1C ZINC000544612149 1025830428 /nfs/dbraw/zinc/83/04/28/1025830428.db2.gz SOUZJQWYMFHWTP-IBGZPJMESA-N 1 0 328.412 3.676 20 5 EHBDRO Cc1c(NC(=O)CC[NH+]2CCC(C(C)C)CC2)cccc1[N+](=O)[O-] ZINC000444206960 1025924682 /nfs/dbraw/zinc/92/46/82/1025924682.db2.gz SSWXOUZEKIFMDL-UHFFFAOYSA-N 1 0 333.432 3.600 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@@H]1O ZINC000451412183 1025946198 /nfs/dbraw/zinc/94/61/98/1025946198.db2.gz FWFSNZZCDLBFFL-KSZLIROESA-N 1 0 348.443 3.507 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1c2ccccc2C[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000178571159 1026026187 /nfs/dbraw/zinc/02/61/87/1026026187.db2.gz YSQKEXXWYNHPGQ-CEXWTWQISA-N 1 0 326.396 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCO[C@H]3CCCCO3)C2)cc1 ZINC000451550477 1026101311 /nfs/dbraw/zinc/10/13/11/1026101311.db2.gz RWDMXBSULQQXDV-MJGOQNOKSA-N 1 0 348.443 3.708 20 5 EHBDRO Cc1cnc([C@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553129 1026103653 /nfs/dbraw/zinc/10/36/53/1026103653.db2.gz XKWYEGNAIJXXGW-HOCLYGCPSA-N 1 0 326.400 3.634 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCCOCC(F)(F)F)C2CC2)cc1 ZINC000130043644 1026141839 /nfs/dbraw/zinc/14/18/39/1026141839.db2.gz WIFCCBIBZWKFRP-UHFFFAOYSA-N 1 0 332.322 3.528 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H]1CCCC[C@H]1C(C)C ZINC000475144052 1026249206 /nfs/dbraw/zinc/24/92/06/1026249206.db2.gz LAMWTEOTAJOCFO-RDJZCZTQSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1ccn(-c2ccccc2C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000127667734 1026278663 /nfs/dbraw/zinc/27/86/63/1026278663.db2.gz NQIPIHDFIPLOFR-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000475274985 1026425802 /nfs/dbraw/zinc/42/58/02/1026425802.db2.gz KPRFQBBYSYBIIB-SFHVURJKSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)c1 ZINC000452097149 1026474199 /nfs/dbraw/zinc/47/41/99/1026474199.db2.gz XWVVLQHIPDOBCE-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])cc1Cl ZINC000475375799 1026541972 /nfs/dbraw/zinc/54/19/72/1026541972.db2.gz UYKRTHWMFDLMEE-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO COc1cccc(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000475429863 1026614174 /nfs/dbraw/zinc/61/41/74/1026614174.db2.gz UGSVHPXOGLNIHG-INIZCTEOSA-N 1 0 347.459 3.696 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](c2cccs2)[NH+]2CCCC2)c1 ZINC000531148226 1026633984 /nfs/dbraw/zinc/63/39/84/1026633984.db2.gz RYOIZHQJSOMKOP-INIZCTEOSA-N 1 0 347.440 3.914 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](OCCCc2ccccc2)C1 ZINC000531209312 1026688008 /nfs/dbraw/zinc/68/80/08/1026688008.db2.gz WASWVBNSVJZHDP-IBGZPJMESA-N 1 0 340.423 3.819 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCCCC[C@H]1O ZINC000562108023 1026781446 /nfs/dbraw/zinc/78/14/46/1026781446.db2.gz PHVQNAGBQHAVJW-ITQYTPKQSA-N 1 0 332.444 3.589 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](Cc2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000479865980 1026866262 /nfs/dbraw/zinc/86/62/62/1026866262.db2.gz XJJAJVHHFMFDAE-APWZRJJASA-N 1 0 341.455 3.727 20 5 EHBDRO CCC(=O)c1ccc(NCCC2CC[NH+](CC)CC2)c([N+](=O)[O-])c1 ZINC000480057946 1026965295 /nfs/dbraw/zinc/96/52/95/1026965295.db2.gz INAKFHXSISRBMI-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H](c1ccccc1)c1ccccn1 ZINC000076581271 1027302669 /nfs/dbraw/zinc/30/26/69/1027302669.db2.gz ZARNWUUYFIEVPW-HXUWFJFHSA-N 1 0 349.390 3.748 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@H](c2ccccc2)c2ccccn2)c1 ZINC000076581097 1027302715 /nfs/dbraw/zinc/30/27/15/1027302715.db2.gz FIGRDIBWHKQPAM-HXUWFJFHSA-N 1 0 349.390 3.748 20 5 EHBDRO COc1ccc(CCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178650893 1027325995 /nfs/dbraw/zinc/32/59/95/1027325995.db2.gz AFOVFYWXZDCGNI-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN2CCCC[C@@H]12 ZINC000513784977 1027705946 /nfs/dbraw/zinc/70/59/46/1027705946.db2.gz COOFMJXOOVPDLL-CAIZAGQASA-N 1 0 343.471 3.522 20 5 EHBDRO C[C@@H](c1ccccc1Cl)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000440495059 1028084747 /nfs/dbraw/zinc/08/47/47/1028084747.db2.gz NZIJVPZOMSCUAQ-QWHCGFSZSA-N 1 0 346.818 3.891 20 5 EHBDRO C[C@H]1[C@H](c2ccccc2)CC[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648910 1028111507 /nfs/dbraw/zinc/11/15/07/1028111507.db2.gz OUZKRECSXAJAKA-XJKSGUPXSA-N 1 0 336.395 3.849 20 5 EHBDRO CCS[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685662 1028131023 /nfs/dbraw/zinc/13/10/23/1028131023.db2.gz PAIQAFHEMYBTQK-DZGCQCFKSA-N 1 0 334.445 3.625 20 5 EHBDRO COc1cc(C[N@H+](C)CC2(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000444683477 1028154836 /nfs/dbraw/zinc/15/48/36/1028154836.db2.gz HFIIYAUYXKWSSO-UHFFFAOYSA-N 1 0 326.396 3.767 20 5 EHBDRO COC(=O)c1cc([C@H](C)N[C@H](C)c2cccc([N+](=O)[O-])c2)oc1C ZINC000292375318 1028196797 /nfs/dbraw/zinc/19/67/97/1028196797.db2.gz GVHMPKIVRJBYOK-MNOVXSKESA-N 1 0 332.356 3.695 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cnn(C2CCCC2)c1 ZINC000502427458 1028213944 /nfs/dbraw/zinc/21/39/44/1028213944.db2.gz ILVZRYBJGFWPBD-CQSZACIVSA-N 1 0 328.416 3.800 20 5 EHBDRO CC1(C)C[N@H+](Cc2cccc([N+](=O)[O-])c2)C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440538450 1028229490 /nfs/dbraw/zinc/22/94/90/1028229490.db2.gz LLSLSNQWINKLHA-ALKREAHSSA-N 1 0 330.428 3.764 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](C(C)C)C2)cccc1[N+](=O)[O-] ZINC000444764811 1028251442 /nfs/dbraw/zinc/25/14/42/1028251442.db2.gz CHERDLKYBCZWPJ-OAHLLOKOSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@H](N[C@@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284198 1028322046 /nfs/dbraw/zinc/32/20/46/1028322046.db2.gz WPNATHNSKKNLCX-FZMZJTMJSA-N 1 0 331.441 3.711 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(COC)CCC1 ZINC000502593387 1028410719 /nfs/dbraw/zinc/41/07/19/1028410719.db2.gz CIFSZMQURHTYIM-AWEZNQCLSA-N 1 0 338.473 3.872 20 5 EHBDRO C[NH+](C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1ccsc1 ZINC000440594878 1028413453 /nfs/dbraw/zinc/41/34/53/1028413453.db2.gz CRVKXRVWUXQURM-CYBMUJFWSA-N 1 0 327.356 3.649 20 5 EHBDRO CC(C)c1ccc(C(=O)N(CCC[NH3+])CC2CCCC2)cc1[N+](=O)[O-] ZINC000423634967 1028542466 /nfs/dbraw/zinc/54/24/66/1028542466.db2.gz DIGFCNZOYVVOOM-UHFFFAOYSA-N 1 0 347.459 3.699 20 5 EHBDRO CCC[NH+]1CCC(Nc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000035014115 1028660786 /nfs/dbraw/zinc/66/07/86/1028660786.db2.gz GLMAACFMBQLVDD-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(CO)c1 ZINC000504899078 1029026691 /nfs/dbraw/zinc/02/66/91/1029026691.db2.gz AILUCGMEPZTRJH-MRXNPFEDSA-N 1 0 346.452 3.748 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000504899741 1029041233 /nfs/dbraw/zinc/04/12/33/1029041233.db2.gz LISZDSVWIXGMLD-HOCLYGCPSA-N 1 0 337.464 3.620 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@](C)(O)[C@@H](C)CC ZINC000504911791 1029052166 /nfs/dbraw/zinc/05/21/66/1029052166.db2.gz LJLHYGMALQYNQY-JJRVBVJISA-N 1 0 340.489 3.852 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC2([NH+](C)C)CCCCC2)cc1[N+](=O)[O-] ZINC000504911514 1029053334 /nfs/dbraw/zinc/05/33/34/1029053334.db2.gz HOMWCUQRJSRJMQ-OAHLLOKOSA-N 1 0 349.475 3.909 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000504912013 1029054735 /nfs/dbraw/zinc/05/47/35/1029054735.db2.gz OVGQBILFCUNYPI-OAGGEKHMSA-N 1 0 349.475 3.907 20 5 EHBDRO Cc1cccc(CN(C)Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)c1 ZINC000532920277 1029072518 /nfs/dbraw/zinc/07/25/18/1029072518.db2.gz ZJUXLFPLFQCHTM-UHFFFAOYSA-N 1 0 338.367 3.585 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000228842866 1029141857 /nfs/dbraw/zinc/14/18/57/1029141857.db2.gz RPZZFRIKFQXCSR-VHSXEESVSA-N 1 0 330.215 3.940 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)N(C)C1CC1 ZINC000237409254 1029177584 /nfs/dbraw/zinc/17/75/84/1029177584.db2.gz WMMMCRBCWGNLEA-ZDUSSCGKSA-N 1 0 345.468 3.896 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513823528 1029523184 /nfs/dbraw/zinc/52/31/84/1029523184.db2.gz VZMSUWKWWHHDTI-IDCNUPLLSA-N 1 0 334.460 3.693 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513829988 1029528018 /nfs/dbraw/zinc/52/80/18/1029528018.db2.gz NPNCCIPNULMQMY-GOEBONIOSA-N 1 0 348.443 3.627 20 5 EHBDRO C[C@H](C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000533263856 1029562734 /nfs/dbraw/zinc/56/27/34/1029562734.db2.gz QQXVEJIYQZCIFR-OAHLLOKOSA-N 1 0 341.411 3.659 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+]1CCCC[C@@H]1C(C)C ZINC000533296490 1029599473 /nfs/dbraw/zinc/59/94/73/1029599473.db2.gz BFNRIEZQDDQLSO-QGZVFWFLSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC000441184012 1029876923 /nfs/dbraw/zinc/87/69/23/1029876923.db2.gz YMSXSAVTKKIQGS-KRWDZBQOSA-N 1 0 342.395 3.602 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(Oc3ccncc3C)CC2)cc1[N+](=O)[O-] ZINC000447100155 1029937728 /nfs/dbraw/zinc/93/77/28/1029937728.db2.gz TWXZMUVTVRXAFL-UHFFFAOYSA-N 1 0 341.411 3.650 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@H]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000441223906 1030002056 /nfs/dbraw/zinc/00/20/56/1030002056.db2.gz ZBUSOUCQMSXNOL-INIZCTEOSA-N 1 0 334.416 3.637 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000531944950 1030067471 /nfs/dbraw/zinc/06/74/71/1030067471.db2.gz KOAKNHSSJODQMT-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980951 1030129379 /nfs/dbraw/zinc/12/93/79/1030129379.db2.gz XVBMJJKQEKDPQY-TZMCWYRMSA-N 1 0 330.359 3.818 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)cc1[N+](=O)[O-] ZINC000453382647 1030160903 /nfs/dbraw/zinc/16/09/03/1030160903.db2.gz SVOXZYSTKDXSCS-IDHHARJASA-N 1 0 341.411 3.869 20 5 EHBDRO C[C@@H](CC(C)(C)C)[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453407550 1030217830 /nfs/dbraw/zinc/21/78/30/1030217830.db2.gz DMEXAXLOFJADDH-XJKSGUPXSA-N 1 0 330.432 3.832 20 5 EHBDRO CCc1ccc(CC[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447539787 1030274413 /nfs/dbraw/zinc/27/44/13/1030274413.db2.gz HKRXPMXYBWFWJM-ZWKOTPCHSA-N 1 0 342.443 3.670 20 5 EHBDRO Cc1cc(C)cc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000447540245 1030276454 /nfs/dbraw/zinc/27/64/54/1030276454.db2.gz IYQTUHVFLGCITJ-QZTJIDSGSA-N 1 0 342.443 3.724 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccc(F)cc1 ZINC000447563163 1030309155 /nfs/dbraw/zinc/30/91/55/1030309155.db2.gz OPFFXSYXSUOKDT-COXVUDFISA-N 1 0 346.406 3.807 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@H]3CC[C@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631582 1030433189 /nfs/dbraw/zinc/43/31/89/1030433189.db2.gz OAMWBRBKAKUCFQ-GXTWGEPZSA-N 1 0 346.383 3.521 20 5 EHBDRO C[C@H]([NH2+]CCN(C)Cc1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000160106945 1030539445 /nfs/dbraw/zinc/53/94/45/1030539445.db2.gz LCRNVSNLWSTBSO-AWEZNQCLSA-N 1 0 331.391 3.517 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCCCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000448022172 1030653342 /nfs/dbraw/zinc/65/33/42/1030653342.db2.gz MUIZICMQJXARAO-GOSISDBHSA-N 1 0 332.400 3.592 20 5 EHBDRO Cc1cc(N[C@@H]2CCO[C@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000160340248 1030686981 /nfs/dbraw/zinc/68/69/81/1030686981.db2.gz KLPAUVBDFSNNEM-ACJLOTCBSA-N 1 0 327.384 3.821 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](Cc1ccccc1)C[C@@H](C)O ZINC000527304334 1030768662 /nfs/dbraw/zinc/76/86/62/1030768662.db2.gz AQYOAMXUWBKYFF-ABPVARSCSA-N 1 0 340.423 3.881 20 5 EHBDRO C[NH+](C)CCOc1ccccc1CNc1ccc(Cl)cc1[N+](=O)[O-] ZINC000527314850 1030787605 /nfs/dbraw/zinc/78/76/05/1030787605.db2.gz VEJDIRVRNCVWAW-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])s2)[C@H]1c1cccs1 ZINC000249213483 1030831333 /nfs/dbraw/zinc/83/13/33/1030831333.db2.gz DFJGXVDATKCAFT-GWCFXTLKSA-N 1 0 338.458 3.608 20 5 EHBDRO Cc1cccc(CN(CC[NH+](C)C)c2ncc([N+](=O)[O-])cc2Cl)c1 ZINC000470050501 1030918384 /nfs/dbraw/zinc/91/83/84/1030918384.db2.gz KDKZJDOILNUOFC-UHFFFAOYSA-N 1 0 348.834 3.520 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C[C@@H]1O ZINC000537698511 1031139013 /nfs/dbraw/zinc/13/90/13/1031139013.db2.gz VUCLSPDYJCHPQR-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)nc1 ZINC000052719959 1031273467 /nfs/dbraw/zinc/27/34/67/1031273467.db2.gz LRNIDFPYYJRQDE-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@H]2c2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000477440639 1031568591 /nfs/dbraw/zinc/56/85/91/1031568591.db2.gz SSKAOLAFOYZNOW-QGZVFWFLSA-N 1 0 340.379 3.969 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@@H](C)[C@@H]1C ZINC000475744892 1031790849 /nfs/dbraw/zinc/79/08/49/1031790849.db2.gz DFHCTBQZBXBXAU-NFAWXSAZSA-N 1 0 333.432 3.598 20 5 EHBDRO COCC[C@H](Cc1cccc(F)c1)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000477746533 1031824062 /nfs/dbraw/zinc/82/40/62/1031824062.db2.gz YLRLZMUIKKRKML-GOSISDBHSA-N 1 0 346.402 3.780 20 5 EHBDRO Cc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950664 1032036806 /nfs/dbraw/zinc/03/68/06/1032036806.db2.gz HTEWZVLQVWMNJN-IRXDYDNUSA-N 1 0 333.476 3.922 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000537950705 1032037637 /nfs/dbraw/zinc/03/76/37/1032037637.db2.gz JDKHDIVXJUXJAW-LIRRHRJNSA-N 1 0 325.412 3.741 20 5 EHBDRO COc1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000537956062 1032043597 /nfs/dbraw/zinc/04/35/97/1032043597.db2.gz YKELDSKCMNOSFO-GOSISDBHSA-N 1 0 344.386 3.853 20 5 EHBDRO Cn1cc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c(-c2ccccc2)n1 ZINC000594500560 1033402195 /nfs/dbraw/zinc/40/21/95/1033402195.db2.gz OXXNOEHMTCGJIZ-GOSISDBHSA-N 1 0 348.406 3.772 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)Cc2ccccn2)cc1[N+](=O)[O-] ZINC000594513164 1033417868 /nfs/dbraw/zinc/41/78/68/1033417868.db2.gz BOXQHYJAPBUUAF-KGLIPLIRSA-N 1 0 329.400 3.670 20 5 EHBDRO O=[N+]([O-])c1cccc(CNCC2([NH+]3CCCCC3)CCCCC2)c1 ZINC000061013320 1033432917 /nfs/dbraw/zinc/43/29/17/1033432917.db2.gz PWCNOILRSMJTCK-UHFFFAOYSA-N 1 0 331.460 3.873 20 5 EHBDRO COCCC1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)CCCC1 ZINC000595011630 1033605512 /nfs/dbraw/zinc/60/55/12/1033605512.db2.gz CMTSZRJMMUNINX-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO CCOC(=O)c1[nH]c(C)c(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000598954356 1033608705 /nfs/dbraw/zinc/60/87/05/1033608705.db2.gz CDBSBDJXVINHIT-LBPRGKRZSA-N 1 0 345.399 3.567 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)CCc1ccc(O)cc1 ZINC000595014993 1033608926 /nfs/dbraw/zinc/60/89/26/1033608926.db2.gz XFVJYXOFUGNZFS-KGLIPLIRSA-N 1 0 344.411 3.981 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC(C4(O)CC4)CC3)o2)c1 ZINC000593647634 1033609340 /nfs/dbraw/zinc/60/93/40/1033609340.db2.gz FEQFSRORDJNZSM-UHFFFAOYSA-N 1 0 342.395 3.592 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](CCCO)c1ccccc1 ZINC000595020761 1033614251 /nfs/dbraw/zinc/61/42/51/1033614251.db2.gz BLCDFTZALKJILP-KBXCAEBGSA-N 1 0 344.411 3.768 20 5 EHBDRO C[N@@H+]1CC[C@@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973343 1033618723 /nfs/dbraw/zinc/61/87/23/1033618723.db2.gz WHVICIUZGFIXBE-CYBMUJFWSA-N 1 0 345.365 3.576 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2CCC(O)CC2)s1 ZINC000594991905 1033622393 /nfs/dbraw/zinc/62/23/93/1033622393.db2.gz NASXJOMMXIFCPP-UHFFFAOYSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]Cc1cccc(N(C)C)c1 ZINC000595009510 1033633092 /nfs/dbraw/zinc/63/30/92/1033633092.db2.gz CDRYDGLKIJBKJD-CYBMUJFWSA-N 1 0 329.400 3.520 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CO[C@H](C3CC3)C2)s1 ZINC000599008207 1033641794 /nfs/dbraw/zinc/64/17/94/1033641794.db2.gz WIQOVMLSOOGUDG-DYVFJYSZSA-N 1 0 344.436 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccnc1N1CCCC1 ZINC000595064142 1033642005 /nfs/dbraw/zinc/64/20/05/1033642005.db2.gz DNGGJHVWPYTUKQ-HNNXBMFYSA-N 1 0 340.427 3.749 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CC12CCSCC2 ZINC000595046445 1033662870 /nfs/dbraw/zinc/66/28/70/1033662870.db2.gz ZNDPIRPPDUHMIX-OLZOCXBDSA-N 1 0 336.457 3.787 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)c1cccnc1 ZINC000595042840 1033662894 /nfs/dbraw/zinc/66/28/94/1033662894.db2.gz CJNRZJPSUJZWQC-CYBMUJFWSA-N 1 0 329.400 3.627 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](Cc1ccccc1)OC ZINC000595043246 1033663766 /nfs/dbraw/zinc/66/37/66/1033663766.db2.gz VNZOECWUPMQWSG-RHSMWYFYSA-N 1 0 344.411 3.512 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCCc2scnc21 ZINC000599042127 1033672863 /nfs/dbraw/zinc/67/28/63/1033672863.db2.gz KAMLFUMREPJNPL-GFCCVEGCSA-N 1 0 337.832 3.914 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000595079786 1033697263 /nfs/dbraw/zinc/69/72/63/1033697263.db2.gz YRKMOVKEHUQJGG-TXPKVOOTSA-N 1 0 338.407 3.744 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC[C@@H]1CCCOC1 ZINC000599059608 1033698664 /nfs/dbraw/zinc/69/86/64/1033698664.db2.gz ZOGNPTJMJLEFMK-BQFCYCMXSA-N 1 0 332.444 3.712 20 5 EHBDRO CC[C@@H]([NH2+]Cc1c(C(F)(F)F)cnn1C)c1cccc([N+](=O)[O-])c1 ZINC000599061270 1033700881 /nfs/dbraw/zinc/70/08/81/1033700881.db2.gz PXYMDSKRLZMNCK-CYBMUJFWSA-N 1 0 342.321 3.588 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2CCC(O)CC2)c2ccccc2)c1 ZINC000595092596 1033701642 /nfs/dbraw/zinc/70/16/42/1033701642.db2.gz LVKDYIVZMXJYEW-RGKRWLCDSA-N 1 0 340.423 3.825 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)OC)c1 ZINC000599061968 1033701538 /nfs/dbraw/zinc/70/15/38/1033701538.db2.gz MXIKLEZSXSQVJS-AUUYWEPGSA-N 1 0 344.411 3.950 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2ccc3cnccc3c2[N+](=O)[O-])CC1 ZINC000599066305 1033707249 /nfs/dbraw/zinc/70/72/49/1033707249.db2.gz UPJCZOIZOLBUKD-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)CCC2 ZINC000599074671 1033717248 /nfs/dbraw/zinc/71/72/48/1033717248.db2.gz UFNNVVQHAAJIFI-IEBWSBKVSA-N 1 0 329.444 3.579 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093025 1033730462 /nfs/dbraw/zinc/73/04/62/1033730462.db2.gz MEDBTRPCEIIGQC-SGTLLEGYSA-N 1 0 327.384 3.800 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C2CC2)cn1 ZINC000599092081 1033731630 /nfs/dbraw/zinc/73/16/30/1033731630.db2.gz FDRSMOMPYOGJJB-KPZWWZAWSA-N 1 0 327.384 3.800 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCC2)cc1OC(F)F ZINC000599164757 1033780523 /nfs/dbraw/zinc/78/05/23/1033780523.db2.gz LTRBRXPCFGIXAE-ZDUSSCGKSA-N 1 0 341.358 3.625 20 5 EHBDRO CCC(=O)c1ccc(NC[C@H]2CC[N@@H+]2C2CCCC2)c([N+](=O)[O-])c1 ZINC000599164703 1033781039 /nfs/dbraw/zinc/78/10/39/1033781039.db2.gz KDAZBASUXXDAEY-OAHLLOKOSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(Cc2ccccc2)CCOCC1 ZINC000595528275 1033844978 /nfs/dbraw/zinc/84/49/78/1033844978.db2.gz PJIHYGZLPJCHFK-UHFFFAOYSA-N 1 0 344.386 3.615 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000593721494 1033847295 /nfs/dbraw/zinc/84/72/95/1033847295.db2.gz VSOSCFYQYKGURR-BSDSXHPESA-N 1 0 340.427 3.729 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccnc1C(F)(F)F ZINC000599412636 1033925711 /nfs/dbraw/zinc/92/57/11/1033925711.db2.gz MAZCOBGRFOOPHF-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO COc1ccc([C@@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])cc1 ZINC000603837531 1033961977 /nfs/dbraw/zinc/96/19/77/1033961977.db2.gz PHFFMGJDQHARGS-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787963 1033999890 /nfs/dbraw/zinc/99/98/90/1033999890.db2.gz LAZXWPQISLFDEP-WMZOPIPTSA-N 1 0 348.443 3.775 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599584499 1034026164 /nfs/dbraw/zinc/02/61/64/1034026164.db2.gz ADZICILGQCIYDR-ILXRZTDVSA-N 1 0 348.443 3.956 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CCC3CC3)CC3CC3)n2)c1 ZINC000595871037 1034031224 /nfs/dbraw/zinc/03/12/24/1034031224.db2.gz KBRPBSBSOZJFIX-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1noc(CS[C@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000596020526 1034058600 /nfs/dbraw/zinc/05/86/00/1034058600.db2.gz LFBZDOVVEUTLMM-HNNXBMFYSA-N 1 0 347.440 3.789 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H](CNc2ncc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000596308809 1034165587 /nfs/dbraw/zinc/16/55/87/1034165587.db2.gz VWEHPJJDYSRUHH-SNVBAGLBSA-N 1 0 346.353 3.541 20 5 EHBDRO C[NH+](C)CCCC(C)(C)NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000456211949 1034212519 /nfs/dbraw/zinc/21/25/19/1034212519.db2.gz YKXABJMBCRUOIV-UHFFFAOYSA-N 1 0 349.475 3.743 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+](CC3CC3)C2)c2ccncc21 ZINC000596570704 1034293165 /nfs/dbraw/zinc/29/31/65/1034293165.db2.gz MVZYZOVLKBQQHG-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000596649330 1034345534 /nfs/dbraw/zinc/34/55/34/1034345534.db2.gz IIFIZMIVDQJSRE-UPRAQXHNSA-N 1 0 343.402 3.530 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2ccc([N+](=O)[O-])cn2)c2ccccc2)CC1 ZINC000060451877 1034543137 /nfs/dbraw/zinc/54/31/37/1034543137.db2.gz DVJCWNJXWFONLY-SFHVURJKSA-N 1 0 340.427 3.875 20 5 EHBDRO CCOc1ccccc1[C@H](CC)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000179742867 1034599257 /nfs/dbraw/zinc/59/92/57/1034599257.db2.gz GZICGVKRLXCMSS-ZWKOTPCHSA-N 1 0 344.411 3.768 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccon2)CC1 ZINC000597227950 1034608943 /nfs/dbraw/zinc/60/89/43/1034608943.db2.gz JIQWHHZGVMZKTG-SDNWHVSQSA-N 1 0 327.384 3.866 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000450855966 1034898421 /nfs/dbraw/zinc/89/84/21/1034898421.db2.gz HVIKTAVNEREGBC-BMFZPTHFSA-N 1 0 336.819 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCC3)CC2)c2ccncc21 ZINC000450878145 1034905446 /nfs/dbraw/zinc/90/54/46/1034905446.db2.gz RRIPMUPBZDTRFE-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000180043009 1035254318 /nfs/dbraw/zinc/25/43/18/1035254318.db2.gz XSOQRNNBTUSBAQ-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000580215759 1035418974 /nfs/dbraw/zinc/41/89/74/1035418974.db2.gz CPIQFBYNQOHMHA-KDOFPFPSSA-N 1 0 325.412 3.978 20 5 EHBDRO CCC[C@](C)(O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223241 1035510770 /nfs/dbraw/zinc/51/07/70/1035510770.db2.gz KJPKBMVZVVPMOW-OALUTQOASA-N 1 0 328.412 3.825 20 5 EHBDRO Cc1cccn2cc(C[NH2+][C@H](C)CCc3ccccc3[N+](=O)[O-])nc12 ZINC000090044767 1035641753 /nfs/dbraw/zinc/64/17/53/1035641753.db2.gz MJGIXJGKYGPNJO-OAHLLOKOSA-N 1 0 338.411 3.662 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535518 1035655139 /nfs/dbraw/zinc/65/51/39/1035655139.db2.gz IDXIPSDFYFZKEP-ZIAGYGMSSA-N 1 0 349.431 3.563 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2cccs2)c([N+](=O)[O-])c1 ZINC000173539066 1035669490 /nfs/dbraw/zinc/66/94/90/1035669490.db2.gz UYEOZADGXIKQGN-LBPRGKRZSA-N 1 0 336.413 3.737 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccn(C)n1 ZINC000414170110 1035867684 /nfs/dbraw/zinc/86/76/84/1035867684.db2.gz BQRLWLJNMSYBOQ-CHWSQXEVSA-N 1 0 334.445 3.550 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000443958073 1035999445 /nfs/dbraw/zinc/99/94/45/1035999445.db2.gz LNHWZFBNSZXQEK-KBPBESRZSA-N 1 0 348.447 3.596 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(C3CCC3)CC2)c1Br ZINC000697384626 1036046414 /nfs/dbraw/zinc/04/64/14/1036046414.db2.gz JGRNSTCRQJJQBD-UHFFFAOYSA-N 1 0 325.206 3.780 20 5 EHBDRO C[C@H]1C[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]1c1ccccc1 ZINC000174987167 1036160119 /nfs/dbraw/zinc/16/01/19/1036160119.db2.gz ILYCMPHIXDWONU-LIRRHRJNSA-N 1 0 339.395 3.616 20 5 EHBDRO CCCc1csc(C[NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)n1 ZINC000588933651 1036187716 /nfs/dbraw/zinc/18/77/16/1036187716.db2.gz RHBZKXMSOOFAGJ-UHFFFAOYSA-N 1 0 344.440 3.817 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](O)CCc2ccccc2)cc1[N+](=O)[O-] ZINC000541386670 1036267541 /nfs/dbraw/zinc/26/75/41/1036267541.db2.gz QWFMCPPTISHCRI-SFHVURJKSA-N 1 0 342.439 3.802 20 5 EHBDRO CC(C)(C)[C@@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000541391376 1036277366 /nfs/dbraw/zinc/27/73/66/1036277366.db2.gz VPTGDVXIINPCQN-LLVKDONJSA-N 1 0 339.823 3.555 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC2(CCC2)[C@@H]1[C@@H]1CCCO1 ZINC000589300215 1036330147 /nfs/dbraw/zinc/33/01/47/1036330147.db2.gz DZPLUVRBFZUSFE-WBAXXEDZSA-N 1 0 330.428 3.998 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)OCCc2ccccc21 ZINC000589319283 1036358842 /nfs/dbraw/zinc/35/88/42/1036358842.db2.gz FOCYWCYYDGVRNS-LJQANCHMSA-N 1 0 344.386 3.702 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+]C1(c2ccccc2)CCC1 ZINC000175521120 1036416445 /nfs/dbraw/zinc/41/64/45/1036416445.db2.gz SYDSVEZKYOVUCS-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CCC(CC)[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)C1CC1 ZINC000165364656 1036433924 /nfs/dbraw/zinc/43/39/24/1036433924.db2.gz LLKSFYPOGJIODP-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c2ccccc2n1 ZINC000572735046 1036475747 /nfs/dbraw/zinc/47/57/47/1036475747.db2.gz OOFJLSJGYOKPDU-KRWDZBQOSA-N 1 0 349.390 3.929 20 5 EHBDRO COc1ccc2c(c1)CCC[N@@H+](Cc1cccc([N+](=O)[O-])c1C)C2 ZINC000609133990 1036529091 /nfs/dbraw/zinc/52/90/91/1036529091.db2.gz VMDQIVFGXWYDPH-UHFFFAOYSA-N 1 0 326.396 3.860 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000541662201 1036547497 /nfs/dbraw/zinc/54/74/97/1036547497.db2.gz BSTLVVJZNYHZPZ-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000152411708 1036596717 /nfs/dbraw/zinc/59/67/17/1036596717.db2.gz DGGCNARREVOJIK-OAHLLOKOSA-N 1 0 349.475 3.940 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CC[C@](O)(C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000589950076 1036676972 /nfs/dbraw/zinc/67/69/72/1036676972.db2.gz UBEDLIUIXYWYDC-AEGPPILISA-N 1 0 346.349 3.872 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736839 1036694017 /nfs/dbraw/zinc/69/40/17/1036694017.db2.gz LTXPSCIYHXSGDB-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO Cn1cc(C[NH+]2CCC(C3CC3)CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000590053052 1036739381 /nfs/dbraw/zinc/73/93/81/1036739381.db2.gz VNFSPZLGFZLJEN-UHFFFAOYSA-N 1 0 340.427 3.617 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C(C)(C)C ZINC000539493325 1036817287 /nfs/dbraw/zinc/81/72/87/1036817287.db2.gz MCHMWSLFTQZNPD-CYBMUJFWSA-N 1 0 327.812 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@H+]3C[C@@H]4CCCC[C@@H]4C3)co2)cc1 ZINC000089908693 1036936234 /nfs/dbraw/zinc/93/62/34/1036936234.db2.gz TUXGHSBGBSZVLJ-GASCZTMLSA-N 1 0 327.384 3.872 20 5 EHBDRO C[C@](CO)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCCCC1 ZINC000761528133 1037101107 /nfs/dbraw/zinc/10/11/07/1037101107.db2.gz ZKUDWNYXNHONGE-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000324752184 1037157975 /nfs/dbraw/zinc/15/79/75/1037157975.db2.gz TYXUJTILFKCSSM-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccc(CO)cc1)CCCC2 ZINC000591348293 1037368910 /nfs/dbraw/zinc/36/89/10/1037368910.db2.gz MVYVZXBXKSRUMQ-HXUWFJFHSA-N 1 0 340.423 3.687 20 5 EHBDRO C[C@@H]1C[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@@H+]1C1CC1 ZINC000177185115 1037410550 /nfs/dbraw/zinc/41/05/50/1037410550.db2.gz CRTWYUFDTRZXTO-ZBFHGGJFSA-N 1 0 345.446 3.743 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C[C@@H](C)OC ZINC000462827490 1037430952 /nfs/dbraw/zinc/43/09/52/1037430952.db2.gz PSTDSGDXFSGPJV-CYBMUJFWSA-N 1 0 348.399 3.720 20 5 EHBDRO CCc1ccc([C@@H](CNc2ccc([N+](=O)[O-])c(OC)c2)[NH+](C)C)cc1 ZINC000462916017 1037546192 /nfs/dbraw/zinc/54/61/92/1037546192.db2.gz AUQNMSUZFWASGV-GOSISDBHSA-N 1 0 343.427 3.881 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000491661750 1037610511 /nfs/dbraw/zinc/61/05/11/1037610511.db2.gz JJJZSJPFPCGXHU-RHSMWYFYSA-N 1 0 333.432 3.790 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H]2CCCOc3ccc(F)cc32)cc1 ZINC000540170168 1037640200 /nfs/dbraw/zinc/64/02/00/1037640200.db2.gz ZHAWBIZKYDYEAE-KRWDZBQOSA-N 1 0 346.358 3.616 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000463009650 1037642865 /nfs/dbraw/zinc/64/28/65/1037642865.db2.gz LUUMUOXDEQYGGJ-HNNXBMFYSA-N 1 0 332.425 3.934 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+](Cc2ccccc2)[C@H](CO)C2CCC2)cs1 ZINC000592139216 1037856537 /nfs/dbraw/zinc/85/65/37/1037856537.db2.gz OLCVWMITWCDCMN-QGZVFWFLSA-N 1 0 346.452 3.820 20 5 EHBDRO CCCc1csc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])n1 ZINC000494181926 1037883925 /nfs/dbraw/zinc/88/39/25/1037883925.db2.gz GFOLBUHUGJJSPD-UHFFFAOYSA-N 1 0 339.848 3.990 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCO[C@@H](c3cccnc3)C2)cccc1[N+](=O)[O-] ZINC000592395279 1037938670 /nfs/dbraw/zinc/93/86/70/1037938670.db2.gz AAIZUCGTHUQOID-IDHHARJASA-N 1 0 341.411 3.869 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](CC(C)C)c1ccncc1 ZINC000592387602 1037954585 /nfs/dbraw/zinc/95/45/85/1037954585.db2.gz WSRSHDBRNCYZMX-KRWDZBQOSA-N 1 0 329.400 3.875 20 5 EHBDRO COc1ccc([C@@H](C)C[N@@H+]2CCc3ccc([N+](=O)[O-])cc3C2)cc1 ZINC000540481618 1037993207 /nfs/dbraw/zinc/99/32/07/1037993207.db2.gz YEAPNJKMRJKBPT-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO Cc1cccc([C@@H](C)[N@@H+]2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c1 ZINC000072665180 1038500074 /nfs/dbraw/zinc/50/00/74/1038500074.db2.gz MXTWDYUMFMDDLD-ZBFHGGJFSA-N 1 0 326.400 3.546 20 5 EHBDRO O=C(/C=C/c1ccc([N+](=O)[O-])cc1)Nc1cccc2c1C[N@@H+](C1CC1)C2 ZINC000378528762 1038702239 /nfs/dbraw/zinc/70/22/39/1038702239.db2.gz KSPRDEHUCYYKSF-IZZDOVSWSA-N 1 0 349.390 3.725 20 5 EHBDRO C[C@@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000237498419 1038745394 /nfs/dbraw/zinc/74/53/94/1038745394.db2.gz OBUVTBALGBXWEJ-HNNXBMFYSA-N 1 0 343.427 3.819 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000500504009 1038858232 /nfs/dbraw/zinc/85/82/32/1038858232.db2.gz QRSNLCWSDGMFIK-RLWBPUTGSA-N 1 0 326.343 3.748 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H]([NH+]3CCCC3)CC2)c(Cl)c1 ZINC000182183957 1038893958 /nfs/dbraw/zinc/89/39/58/1038893958.db2.gz RIGOPVHNZKNKAV-HNNXBMFYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+]3CC[C@H](OC(F)F)C3)o2)c1 ZINC000549451639 1038931507 /nfs/dbraw/zinc/93/15/07/1038931507.db2.gz OZBZUYYCMVASFU-AWEZNQCLSA-N 1 0 338.310 3.668 20 5 EHBDRO C[C@](O)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)C1CCCCC1 ZINC000477855856 1038963830 /nfs/dbraw/zinc/96/38/30/1038963830.db2.gz IZLXCYKKLQCUTI-QUCCMNQESA-N 1 0 346.471 3.837 20 5 EHBDRO CC(C)[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(C)(C)O ZINC000477864390 1038976657 /nfs/dbraw/zinc/97/66/57/1038976657.db2.gz ZMYMEEDRUSSHMM-ZVZYQTTQSA-N 1 0 334.460 3.691 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN([C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000026850575 1039178122 /nfs/dbraw/zinc/17/81/22/1039178122.db2.gz OPGIFOKSAKMBHA-QGZVFWFLSA-N 1 0 339.439 3.782 20 5 EHBDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000432786703 1039187987 /nfs/dbraw/zinc/18/79/87/1039187987.db2.gz DOCUPYAYQPJKNN-NSHDSACASA-N 1 0 326.343 3.961 20 5 EHBDRO Cc1cc(N2CCC(OC3CCC3)CC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000418975053 1039192501 /nfs/dbraw/zinc/19/25/01/1039192501.db2.gz RMKRPRJPYCYWBD-UHFFFAOYSA-N 1 0 341.411 3.989 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+]1C[C@H](C)C[C@H](C)C1 ZINC000015377597 1039302205 /nfs/dbraw/zinc/30/22/05/1039302205.db2.gz WIKUAGQISFWWMG-XQQFMLRXSA-N 1 0 330.388 3.684 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCN([C@@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494830 1039483735 /nfs/dbraw/zinc/48/37/35/1039483735.db2.gz BEICKWFBVRKEGU-QFBILLFUSA-N 1 0 339.439 3.828 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)C1CCCCC1 ZINC000480503511 1039613922 /nfs/dbraw/zinc/61/39/22/1039613922.db2.gz YNPWDQVEZYSQQI-FERCGXDMSA-N 1 0 332.444 3.919 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000489093885 1039619338 /nfs/dbraw/zinc/61/93/38/1039619338.db2.gz HPBQPIAVJOVSPD-INIZCTEOSA-N 1 0 326.396 3.901 20 5 EHBDRO COCC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)c1ccccc1 ZINC000489126225 1039637109 /nfs/dbraw/zinc/63/71/09/1039637109.db2.gz JWXQAHLTLWZDDL-HNNXBMFYSA-N 1 0 344.411 3.813 20 5 EHBDRO COc1ncccc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417308072 1039660312 /nfs/dbraw/zinc/66/03/12/1039660312.db2.gz DYDDTUZPDGVUPJ-KRWDZBQOSA-N 1 0 327.384 3.556 20 5 EHBDRO Cc1cccc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417333860 1039692975 /nfs/dbraw/zinc/69/29/75/1039692975.db2.gz QNLVHFGZAATGCS-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO CS[C@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000129406334 1039765487 /nfs/dbraw/zinc/76/54/87/1039765487.db2.gz IECRKCPWFORBFN-QAPCUYQASA-N 1 0 349.500 3.827 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1C[C@@H](C)O[C@H](C)C1 ZINC000554937000 1039977904 /nfs/dbraw/zinc/97/79/04/1039977904.db2.gz DSVRQZKMUKTOGZ-ZIAGYGMSSA-N 1 0 336.432 3.677 20 5 EHBDRO COc1cccc(NC[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000192953296 1040158103 /nfs/dbraw/zinc/15/81/03/1040158103.db2.gz GVZBZLREKJGBJR-MRXNPFEDSA-N 1 0 341.411 3.537 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(Nc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000432925142 1040191043 /nfs/dbraw/zinc/19/10/43/1040191043.db2.gz BAQPPHJKHLTHGN-INIZCTEOSA-N 1 0 331.347 3.863 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]2C[NH+]2CCCC2)cc1C(F)(F)F ZINC000489887833 1040222786 /nfs/dbraw/zinc/22/27/86/1040222786.db2.gz OMNCWJMHDXEYJR-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO O=C(Nc1ccc(-c2ncc[nH]2)cc1)c1c[nH]c2cccc([N+](=O)[O-])c12 ZINC000342885060 1040268153 /nfs/dbraw/zinc/26/81/53/1040268153.db2.gz YNQKLNWJLZEPAT-UHFFFAOYSA-N 1 0 347.334 3.719 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490034294 1040301124 /nfs/dbraw/zinc/30/11/24/1040301124.db2.gz VBXTYPPEPKBEFF-YOEHRIQHSA-N 1 0 326.396 3.981 20 5 EHBDRO CC1(C)C[C@H](NC2CC([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000479514585 1040332276 /nfs/dbraw/zinc/33/22/76/1040332276.db2.gz JXPURABHHBTMRP-KJXMEXGPSA-N 1 0 343.471 3.924 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000481187222 1040451378 /nfs/dbraw/zinc/45/13/78/1040451378.db2.gz FTAMUCVNVSGJSQ-DUVNUKRYSA-N 1 0 333.432 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@@H]4OCCC[C@H]34)o2)cc1 ZINC000190351024 1040502265 /nfs/dbraw/zinc/50/22/65/1040502265.db2.gz OIRLCRDVXGEPKW-NUJGCVRESA-N 1 0 328.368 3.512 20 5 EHBDRO C[N@@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)CC1CCCCC1 ZINC000029455063 1040625884 /nfs/dbraw/zinc/62/58/84/1040625884.db2.gz HCCUUKCAHYCUPH-UHFFFAOYSA-N 1 0 339.823 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(CSCC2CC[NH2+]CC2)c(C(F)(F)F)c1 ZINC000571043860 1041151142 /nfs/dbraw/zinc/15/11/42/1041151142.db2.gz VDKRNNZXBJSFJF-UHFFFAOYSA-N 1 0 334.363 3.846 20 5 EHBDRO CC(C)([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c(Cl)c1 ZINC000174839769 1041156760 /nfs/dbraw/zinc/15/67/60/1041156760.db2.gz MHBVSEIMIISJGG-UHFFFAOYSA-N 1 0 343.214 3.623 20 5 EHBDRO Cc1cccc(NCC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433285568 1041236673 /nfs/dbraw/zinc/23/66/73/1041236673.db2.gz IFDUPBLBIHQMRW-KRWDZBQOSA-N 1 0 340.427 3.722 20 5 EHBDRO CCOC1(C)CC[NH+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)CC1 ZINC000428744385 1041347708 /nfs/dbraw/zinc/34/77/08/1041347708.db2.gz MWMQTZOGRQCHJX-UHFFFAOYSA-N 1 0 336.432 3.773 20 5 EHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])C[C@@H]1OCCc2ccccc21 ZINC000511668797 1041457527 /nfs/dbraw/zinc/45/75/27/1041457527.db2.gz VSILLLZNSGRWBA-NSDNCLLMSA-N 1 0 338.407 3.854 20 5 EHBDRO COC1CCC(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000893401023 1041703491 /nfs/dbraw/zinc/70/34/91/1041703491.db2.gz GSXXVFHCZHNLCB-UHFFFAOYSA-N 1 0 326.824 3.586 20 5 EHBDRO Cc1nc(C)c([C@@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000106875321 1041788910 /nfs/dbraw/zinc/78/89/10/1041788910.db2.gz NLRAZLQZLISFTF-GFCCVEGCSA-N 1 0 335.429 3.740 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000107072386 1041814795 /nfs/dbraw/zinc/81/47/95/1041814795.db2.gz BZGFPRFSLOUBKH-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1nc2c(s1)[C@H]([N@H+](C)CCOc1cccc([N+](=O)[O-])c1)CCC2 ZINC000111310834 1042260262 /nfs/dbraw/zinc/26/02/62/1042260262.db2.gz ABUTZKAZXIPZSN-MRXNPFEDSA-N 1 0 347.440 3.748 20 5 EHBDRO CC(C)[C@@H](CO)[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000112659805 1042416776 /nfs/dbraw/zinc/41/67/76/1042416776.db2.gz KRYFRRSOJHCRTH-HXUWFJFHSA-N 1 0 342.439 3.656 20 5 EHBDRO O=[N+]([O-])c1cc(CNCc2sccc2Br)cs1 ZINC000112838243 1042427619 /nfs/dbraw/zinc/42/76/19/1042427619.db2.gz NQEINGJXWBWHQG-UHFFFAOYSA-N 1 0 333.232 3.770 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CCN(CC(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000125825059 1042801794 /nfs/dbraw/zinc/80/17/94/1042801794.db2.gz STPKWTUTKSXRTQ-ZFWWWQNUSA-N 1 0 345.365 3.662 20 5 EHBDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820815 1042906681 /nfs/dbraw/zinc/90/66/81/1042906681.db2.gz WUSMMBICVPLTBQ-DLBZAZTESA-N 1 0 336.432 3.716 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000166932100 1043118920 /nfs/dbraw/zinc/11/89/20/1043118920.db2.gz HMTUBGDIXNZJQV-KRWDZBQOSA-N 1 0 343.427 3.819 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCCO2 ZINC000344049569 1043168750 /nfs/dbraw/zinc/16/87/50/1043168750.db2.gz PHKPWWQCKQPXAI-QGZVFWFLSA-N 1 0 326.396 3.949 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000279096224 1043345814 /nfs/dbraw/zinc/34/58/14/1043345814.db2.gz NWMUECOQNGGICJ-KRWDZBQOSA-N 1 0 340.427 3.568 20 5 EHBDRO Cc1cc(C[C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)[nH]n1 ZINC000279114931 1043373731 /nfs/dbraw/zinc/37/37/31/1043373731.db2.gz PMSDKPHVTNPSSR-APPDUMDISA-N 1 0 328.416 3.570 20 5 EHBDRO CC[C@@H](O)CCC[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000344483582 1044065054 /nfs/dbraw/zinc/06/50/54/1044065054.db2.gz LUBFVFFVGOIRTK-CYBMUJFWSA-N 1 0 348.399 3.504 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c2ccc([N+](=O)[O-])cc12 ZINC000765068983 1127569693 /nfs/dbraw/zinc/56/96/93/1127569693.db2.gz UUHLSDBARMJYBS-SJORKVTESA-N 1 0 346.456 3.570 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000765308093 1127596768 /nfs/dbraw/zinc/59/67/68/1127596768.db2.gz VNARXYYIPISGNU-HZPDHXFCSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)[C@H]1C[C@H]1C ZINC001168541731 1127623574 /nfs/dbraw/zinc/62/35/74/1127623574.db2.gz JWXZKDVVZARPHF-XQAQDONZSA-N 1 0 348.834 3.740 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)N1CCc2ccccc2C1 ZINC000301283646 1127729808 /nfs/dbraw/zinc/72/98/08/1127729808.db2.gz PLLCCRPPRQEKQR-LBPRGKRZSA-N 1 0 346.818 3.502 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@@H]2CCC[N@@H+]2Cc2ccccc2)c(Cl)c1 ZINC000301286211 1127731674 /nfs/dbraw/zinc/73/16/74/1127731674.db2.gz QSKDKDMLTRYMKE-AWEZNQCLSA-N 1 0 346.818 3.720 20 5 EHBDRO CC(C)(C)C[C@@H](O)C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000172269375 1127865143 /nfs/dbraw/zinc/86/51/43/1127865143.db2.gz VGWJLXZGJVGUIZ-OAHLLOKOSA-N 1 0 349.456 3.605 20 5 EHBDRO Cc1cc(NC2CC[NH+](CC3CCCCC3)CC2)ncc1[N+](=O)[O-] ZINC000301444393 1127890674 /nfs/dbraw/zinc/89/06/74/1127890674.db2.gz QBOURWBIOQNHFU-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347625208 1128151576 /nfs/dbraw/zinc/15/15/76/1128151576.db2.gz BJMNNAVQQMQAML-ZDUSSCGKSA-N 1 0 326.805 3.523 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@H](CCO)c2ccc(Cl)cc2)cs1 ZINC000347625206 1128151652 /nfs/dbraw/zinc/15/16/52/1128151652.db2.gz BJMNNAVQQMQAML-CYBMUJFWSA-N 1 0 326.805 3.523 20 5 EHBDRO C[C@@H]1C[C@@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000553337306 1128411356 /nfs/dbraw/zinc/41/13/56/1128411356.db2.gz FJPYNSXREXBRDB-DGCLKSJQSA-N 1 0 343.349 3.677 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@H](C)C1CCCCC1 ZINC000553436632 1128427585 /nfs/dbraw/zinc/42/75/85/1128427585.db2.gz HMKTYCJYBWSXIG-CQSZACIVSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc(C2CC[NH+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)CC2)[nH]n1 ZINC000273031458 1128434288 /nfs/dbraw/zinc/43/42/88/1128434288.db2.gz ULUQQYMTPBQBEA-CQSZACIVSA-N 1 0 328.416 3.875 20 5 EHBDRO O=C(CCCC[NH2+]Cc1csc([N+](=O)[O-])c1)OCc1ccccc1 ZINC000273046989 1128436763 /nfs/dbraw/zinc/43/67/63/1128436763.db2.gz AXZPSQJFDIHYBX-UHFFFAOYSA-N 1 0 348.424 3.660 20 5 EHBDRO CC[C@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2Br)[C@H]1C ZINC001307703133 1128456232 /nfs/dbraw/zinc/45/62/32/1128456232.db2.gz OMQOOHXQGCZZCN-QWRGUYRKSA-N 1 0 327.222 3.978 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC[C@@H]2CCO[C@H](C)C2)cc1[N+](=O)[O-] ZINC000273291614 1128476055 /nfs/dbraw/zinc/47/60/55/1128476055.db2.gz SINBBXJGHXTPLJ-QLFBSQMISA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000301558587 1128496770 /nfs/dbraw/zinc/49/67/70/1128496770.db2.gz TZEAJJYXLGIMGN-OAHLLOKOSA-N 1 0 335.423 3.826 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844703 1128547345 /nfs/dbraw/zinc/54/73/45/1128547345.db2.gz HXFKTPKBPJGEMF-HZPDHXFCSA-N 1 0 348.399 3.594 20 5 EHBDRO CC(C)Oc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765847355 1128556497 /nfs/dbraw/zinc/55/64/97/1128556497.db2.gz BCBZRXNGXLWMOS-LIRRHRJNSA-N 1 0 344.411 3.766 20 5 EHBDRO Cc1nccn1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338709875 1128732547 /nfs/dbraw/zinc/73/25/47/1128732547.db2.gz SWJOKIKNQGXVNY-UHFFFAOYSA-N 1 0 342.424 3.618 20 5 EHBDRO CC[N@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C(C)C ZINC000110423258 1128785511 /nfs/dbraw/zinc/78/55/11/1128785511.db2.gz BTYUYWVERFUNHR-UHFFFAOYSA-N 1 0 335.451 3.848 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cc1[N+](=O)[O-] ZINC000921818791 1128786951 /nfs/dbraw/zinc/78/69/51/1128786951.db2.gz QWSLMVPXAVEGJK-AWEZNQCLSA-N 1 0 328.416 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C/C=C\c3ccccc3)CC2)cc1 ZINC000765952227 1128890989 /nfs/dbraw/zinc/89/09/89/1128890989.db2.gz SXMFJCHHWLLUTC-DAXSKMNVSA-N 1 0 337.423 3.867 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000109841419 1120127030 /nfs/dbraw/zinc/12/70/30/1120127030.db2.gz KBCYZTGSJDEXQM-HNNXBMFYSA-N 1 0 344.411 3.545 20 5 EHBDRO COc1ccc(C[NH2+]C2(c3ccc(F)cc3)CCC2)cc1[N+](=O)[O-] ZINC000609194223 1120543276 /nfs/dbraw/zinc/54/32/76/1120543276.db2.gz GLZRAIQEQUWRCM-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO C[C@H](C(=O)Nc1ccc(C[NH+](C)C)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000761988711 1121036878 /nfs/dbraw/zinc/03/68/78/1121036878.db2.gz YSMYERPMAJBJGX-LBPRGKRZSA-N 1 0 345.374 3.538 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000495492506 1121231832 /nfs/dbraw/zinc/23/18/32/1121231832.db2.gz MLROMLWVTDXBJG-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000089513254 1121276903 /nfs/dbraw/zinc/27/69/03/1121276903.db2.gz KTLBDBCFRUGLAA-GFCCVEGCSA-N 1 0 339.395 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@@H]3SCCS[C@@H]23)c1 ZINC000762613017 1121382964 /nfs/dbraw/zinc/38/29/64/1121382964.db2.gz GPJVEMOVJVUEEB-RDBSUJKOSA-N 1 0 344.889 3.717 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CC[NH+](C4CCCCC4)CC3)ccc2c1 ZINC000301713673 1128983556 /nfs/dbraw/zinc/98/35/56/1128983556.db2.gz LWRNRRPPAPHTRG-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=C(NC[C@@H]1CC[N@@H+](C2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000171709262 1121480642 /nfs/dbraw/zinc/48/06/42/1121480642.db2.gz LGFPHKNOZCDBRK-HNNXBMFYSA-N 1 0 345.446 3.602 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCOC3CCCC3)cs2)c1 ZINC000113329746 1129001521 /nfs/dbraw/zinc/00/15/21/1129001521.db2.gz FWTRHKMJFFEQFM-UHFFFAOYSA-N 1 0 347.440 3.767 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1(C2CC2)CCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272573500 1121730313 /nfs/dbraw/zinc/73/03/13/1121730313.db2.gz WNCVFKMTTCYPRS-QGZVFWFLSA-N 1 0 340.427 3.588 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C1CCCCC1 ZINC000194059375 1121764380 /nfs/dbraw/zinc/76/43/80/1121764380.db2.gz VYBNMYCDHLEGAO-LSDHHAIUSA-N 1 0 347.459 3.815 20 5 EHBDRO C[C@@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])[C@H]1CCC[N@@H+](C2CCC2)C1 ZINC000272722564 1121963660 /nfs/dbraw/zinc/96/36/60/1121963660.db2.gz XSTVDMBNNZSCNK-PMPSAXMXSA-N 1 0 331.460 3.898 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1CCN(c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090801272 1122232798 /nfs/dbraw/zinc/23/27/98/1122232798.db2.gz CBMLIIQJNYBVLZ-SJLPKXTDSA-N 1 0 340.427 3.700 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132035891 1129040570 /nfs/dbraw/zinc/04/05/70/1129040570.db2.gz KQXUYHGOIJCSDT-DOMZBBRYSA-N 1 0 337.395 3.621 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000301205684 1122530910 /nfs/dbraw/zinc/53/09/10/1122530910.db2.gz SJGMADBFODAHQL-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154366953 1122583508 /nfs/dbraw/zinc/58/35/08/1122583508.db2.gz JODXWICKXRABEQ-MJGOQNOKSA-N 1 0 328.412 3.581 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@@H]2[C@H](CCC[N@@H+]2C2CC2)C1 ZINC000301788530 1129069977 /nfs/dbraw/zinc/06/99/77/1129069977.db2.gz PWIIBULWHPASRI-IUODEOHRSA-N 1 0 335.835 3.701 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000255323700 1129071231 /nfs/dbraw/zinc/07/12/31/1129071231.db2.gz NKZDWXMFJHATEU-VURMDHGXSA-N 1 0 331.460 3.662 20 5 EHBDRO CCC[N@H+](CC1CCCCC1)Cn1c2cc([N+](=O)[O-])ccc2oc1=O ZINC000918734622 1122900890 /nfs/dbraw/zinc/90/08/90/1122900890.db2.gz BUFIVRPMFBFQFJ-UHFFFAOYSA-N 1 0 347.415 3.753 20 5 EHBDRO COc1ccccc1[C@@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000154970382 1123054137 /nfs/dbraw/zinc/05/41/37/1123054137.db2.gz UEFSTCPBWYESPG-RDTXWAMCSA-N 1 0 343.427 3.557 20 5 EHBDRO C[NH+](C)[C@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000301807419 1129104731 /nfs/dbraw/zinc/10/47/31/1129104731.db2.gz WLPAMTSKAMWAMW-GFCCVEGCSA-N 1 0 327.356 3.649 20 5 EHBDRO C[N@H+](Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1CCCc2ccccc21 ZINC000557049271 1123283712 /nfs/dbraw/zinc/28/37/12/1123283712.db2.gz WDVSFJYHZLJNLS-GOSISDBHSA-N 1 0 336.395 3.981 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC[C@@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000078270591 1129124902 /nfs/dbraw/zinc/12/49/02/1129124902.db2.gz DRZIBRQPZJJXJX-MJVIPROJSA-N 1 0 339.823 3.744 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])s1)c1ccsc1 ZINC000195508674 1123494462 /nfs/dbraw/zinc/49/44/62/1123494462.db2.gz MNOLYUWELUCEJI-NSHDSACASA-N 1 0 326.447 3.608 20 5 EHBDRO Cc1ccc(NC(=O)NCCCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000609553317 1123612557 /nfs/dbraw/zinc/61/25/57/1123612557.db2.gz NRIHHHXWIDDCJN-UHFFFAOYSA-N 1 0 348.447 3.681 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@@H](Cc2ccc(F)cc2)C1 ZINC000609916522 1123691866 /nfs/dbraw/zinc/69/18/66/1123691866.db2.gz WFJCXUNTEXNRFZ-AWEZNQCLSA-N 1 0 332.350 3.938 20 5 EHBDRO CC(C)CCn1cccc1C[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000610008426 1123712839 /nfs/dbraw/zinc/71/28/39/1123712839.db2.gz VHTAIOJJEDVBFW-UHFFFAOYSA-N 1 0 331.416 3.611 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000610008003 1123713001 /nfs/dbraw/zinc/71/30/01/1123713001.db2.gz BRZZPFSCLQTDRO-QGZVFWFLSA-N 1 0 336.338 3.993 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2c(F)cc([N+](=O)[O-])cc2F)[C@@H]1c1ccccc1 ZINC000301827773 1129144123 /nfs/dbraw/zinc/14/41/23/1129144123.db2.gz FUTNLCPLXOIZSC-WBVHZDCISA-N 1 0 333.338 3.730 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC[NH+]2Cc3ccccc3C2)c2ccncc21 ZINC000068321604 1123917696 /nfs/dbraw/zinc/91/76/96/1123917696.db2.gz JXYZKLGVXQNQBO-UHFFFAOYSA-N 1 0 334.379 3.571 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](c1ccnn1C)C(C)C ZINC000615967169 1123920127 /nfs/dbraw/zinc/92/01/27/1123920127.db2.gz PYKSNDOANDHORR-YOEHRIQHSA-N 1 0 330.432 3.727 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000078635509 1129174902 /nfs/dbraw/zinc/17/49/02/1129174902.db2.gz JIQYWUVQQMMZRH-INIZCTEOSA-N 1 0 328.368 3.607 20 5 EHBDRO Cc1cc(N(C)CCC2CCOCC2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000181528915 1124917535 /nfs/dbraw/zinc/91/75/35/1124917535.db2.gz WPDIEKJALDOGJY-UHFFFAOYSA-N 1 0 329.400 3.704 20 5 EHBDRO CCOc1cc(NC[C@@H](c2ccco2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000080763515 1125347988 /nfs/dbraw/zinc/34/79/88/1125347988.db2.gz RRBTVEZCENVBEU-INIZCTEOSA-N 1 0 345.399 3.836 20 5 EHBDRO Cc1ccnc(NC2CC[NH+]([C@H](C)c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000301261032 1125421013 /nfs/dbraw/zinc/42/10/13/1125421013.db2.gz BKHHYVPMWGGMDW-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C[N@@H+]1C1CC1 ZINC000301846025 1129191571 /nfs/dbraw/zinc/19/15/71/1129191571.db2.gz ALBPLEWMCWDQED-HIFRSBDPSA-N 1 0 338.411 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](CCCO)[C@@H]2CCCc3ccccc32)cc1 ZINC000531163523 1129404949 /nfs/dbraw/zinc/40/49/49/1129404949.db2.gz DNBWVWUVSBXZFN-HXUWFJFHSA-N 1 0 340.423 3.857 20 5 EHBDRO CC[C@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000117342445 1129434813 /nfs/dbraw/zinc/43/48/13/1129434813.db2.gz XSLIRELBMMPVBM-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CCO[C@@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543422847 1129477506 /nfs/dbraw/zinc/47/75/06/1129477506.db2.gz IPKYFUJMTDGJOF-ZBQZNYHESA-N 1 0 344.411 3.997 20 5 EHBDRO CCn1c(C)nc([N+](=O)[O-])c1NC[C@H](c1ccccc1)[NH+](CC)CC ZINC000327985931 1129541680 /nfs/dbraw/zinc/54/16/80/1129541680.db2.gz ZYIUGLBNNHGPFV-MRXNPFEDSA-N 1 0 345.447 3.615 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000464690155 1129557884 /nfs/dbraw/zinc/55/78/84/1129557884.db2.gz VZYPBGXYAJZHJM-CYBMUJFWSA-N 1 0 342.436 3.850 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000154462685 1129560875 /nfs/dbraw/zinc/56/08/75/1129560875.db2.gz VCXAIWZCGCRJFX-QGZVFWFLSA-N 1 0 330.384 3.590 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H]2C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000555189491 1129573909 /nfs/dbraw/zinc/57/39/09/1129573909.db2.gz XCQSTELADUGXNG-COXVUDFISA-N 1 0 326.396 3.885 20 5 EHBDRO Cc1c(C[N@@H+](Cc2ccccc2)[C@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303986 1129583725 /nfs/dbraw/zinc/58/37/25/1129583725.db2.gz QOCXCOAJOWXQBT-OAHLLOKOSA-N 1 0 328.412 3.676 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1cc(F)ccc1OC ZINC000922623895 1129600121 /nfs/dbraw/zinc/60/01/21/1129600121.db2.gz WREWSGSWZVQVOH-OAHLLOKOSA-N 1 0 348.374 3.992 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](C2CCOCC2)C1 ZINC000330447104 1129637714 /nfs/dbraw/zinc/63/77/14/1129637714.db2.gz HTDXEZHURAWAKY-INIZCTEOSA-N 1 0 348.443 3.631 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)cc1[N+](=O)[O-] ZINC000922774547 1129656784 /nfs/dbraw/zinc/65/67/84/1129656784.db2.gz AKDVHEDEKFCRAX-RHSMWYFYSA-N 1 0 348.349 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCCOC1CCCC1)C1CC1 ZINC000125232353 1129672223 /nfs/dbraw/zinc/67/22/23/1129672223.db2.gz PTGKEDSMRNYDGU-GOSISDBHSA-N 1 0 332.444 3.855 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156533751 1129723032 /nfs/dbraw/zinc/72/30/32/1129723032.db2.gz YBPJBHAWOHZKHF-XJKSGUPXSA-N 1 0 332.400 3.795 20 5 EHBDRO Cc1cccc([C@H](O)CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)c1 ZINC000302060160 1129766129 /nfs/dbraw/zinc/76/61/29/1129766129.db2.gz CBIXUYGUZHVFAK-LJQANCHMSA-N 1 0 337.379 3.905 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1F ZINC000056196508 1129805458 /nfs/dbraw/zinc/80/54/58/1129805458.db2.gz UUEJOIWTNDOEBG-GHMZBOCLSA-N 1 0 349.337 3.551 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000056196917 1129805777 /nfs/dbraw/zinc/80/57/77/1129805777.db2.gz VNCSBLGHKWVGPV-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1cc(C)ccc1OC ZINC000303085811 1129814835 /nfs/dbraw/zinc/81/48/35/1129814835.db2.gz BDQRIUDYOJUTLH-UHFFFAOYSA-N 1 0 344.411 3.643 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC001168741708 1129836163 /nfs/dbraw/zinc/83/61/63/1129836163.db2.gz PEUVPRFNMWUCGM-KYNGSXCRSA-N 1 0 328.412 3.800 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509142989 1129846178 /nfs/dbraw/zinc/84/61/78/1129846178.db2.gz UNFBVSMUCLIZEF-JKSUJKDBSA-N 1 0 328.359 3.556 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000509148175 1129853946 /nfs/dbraw/zinc/85/39/46/1129853946.db2.gz AQAATKKWPNKYRV-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000509159042 1129870746 /nfs/dbraw/zinc/87/07/46/1129870746.db2.gz YVMLOWMERMPHKF-HNNXBMFYSA-N 1 0 332.425 3.934 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CCCc2nn(C)cc21)c1cccc([N+](=O)[O-])c1 ZINC000282509056 1129974400 /nfs/dbraw/zinc/97/44/00/1129974400.db2.gz SQGZRWBBRNFERJ-IRXDYDNUSA-N 1 0 328.416 3.837 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000164535714 1129980490 /nfs/dbraw/zinc/98/04/90/1129980490.db2.gz IDXIPSDFYFZKEP-KBPBESRZSA-N 1 0 349.431 3.563 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2Br)C[C@@H]1C ZINC001307590580 1130099963 /nfs/dbraw/zinc/09/99/63/1130099963.db2.gz WDZVJQAAZWTGDU-MNOVXSKESA-N 1 0 327.222 3.835 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[N@@H+](C2CCCC2)CC1 ZINC000172373312 1130127572 /nfs/dbraw/zinc/12/75/72/1130127572.db2.gz ZPJBZRRQMPLJHW-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCC[N@@H+](C2CCCC2)CC1 ZINC000172584150 1130146140 /nfs/dbraw/zinc/14/61/40/1130146140.db2.gz YAUJUKAOGVFYDM-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@@H](c1c(F)cccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446251 1130208689 /nfs/dbraw/zinc/20/86/89/1130208689.db2.gz KZVOWUFJBFCTGU-NWDGAFQWSA-N 1 0 348.353 3.515 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000246463088 1130384496 /nfs/dbraw/zinc/38/44/96/1130384496.db2.gz PZJBGRIUOIVRTN-CCKFTAQKSA-N 1 0 328.412 3.628 20 5 EHBDRO Cc1ccccc1NC(=O)CC[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000429252953 1130389056 /nfs/dbraw/zinc/38/90/56/1130389056.db2.gz NDMRUOBZNTUKGB-UHFFFAOYSA-N 1 0 341.411 3.757 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802478 1130413762 /nfs/dbraw/zinc/41/37/62/1130413762.db2.gz SUSAXAMKTUKPHK-OLZOCXBDSA-N 1 0 330.388 3.513 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCO2 ZINC000766190782 1130796503 /nfs/dbraw/zinc/79/65/03/1130796503.db2.gz AGOBROXTWCFVTH-QGZVFWFLSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082835 1131149748 /nfs/dbraw/zinc/14/97/48/1131149748.db2.gz TZTHCZVPPGSGMK-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO Cc1ccc(N2CCC[C@@H]([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC000742381251 1131712906 /nfs/dbraw/zinc/71/29/06/1131712906.db2.gz XNOSJWNKLJMYHV-GOSISDBHSA-N 1 0 339.439 3.970 20 5 EHBDRO COc1cccc2cc(C[NH2+]CCc3ccccc3[N+](=O)[O-])oc21 ZINC000742381350 1131713090 /nfs/dbraw/zinc/71/30/90/1131713090.db2.gz WFKXDWYSPPRZFY-UHFFFAOYSA-N 1 0 326.352 3.682 20 5 EHBDRO CC(C)c1cc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)on1 ZINC001172902057 1131884893 /nfs/dbraw/zinc/88/48/93/1131884893.db2.gz UMRUXAKXNUBULY-HNNXBMFYSA-N 1 0 329.400 3.743 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1ccc(F)cc1F)CC2 ZINC001172901685 1131885622 /nfs/dbraw/zinc/88/56/22/1131885622.db2.gz JFAJYTNLUKPLDN-QGZVFWFLSA-N 1 0 346.377 3.953 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCc3sccc3C1)CC2 ZINC001172905595 1131887841 /nfs/dbraw/zinc/88/78/41/1131887841.db2.gz SKLLJOKPGJYYOP-MRXNPFEDSA-N 1 0 328.437 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]C1(Cc3cccnc3)CC1)CC2 ZINC001172905796 1131888202 /nfs/dbraw/zinc/88/82/02/1131888202.db2.gz KUMAUAMDHIZFTG-GOSISDBHSA-N 1 0 337.423 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cc(Cl)ccn1)CC2 ZINC001172895224 1131901265 /nfs/dbraw/zinc/90/12/65/1131901265.db2.gz BBVJSRSJERSZPT-OAHLLOKOSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1Cc3ccc(F)cc3C1)CC2 ZINC001172915241 1131902521 /nfs/dbraw/zinc/90/25/21/1131902521.db2.gz MNTQDTWKOSHQLG-GOSISDBHSA-N 1 0 326.371 3.997 20 5 EHBDRO CCC[C@H]1[C@@H](C)CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381062 1131914019 /nfs/dbraw/zinc/91/40/19/1131914019.db2.gz TUJABFOPVRSLDP-HOCLYGCPSA-N 1 0 343.431 3.711 20 5 EHBDRO Cc1ccc(CCC[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911542 1131918306 /nfs/dbraw/zinc/91/83/06/1131918306.db2.gz JGTZSVCDXCCSBE-LJQANCHMSA-N 1 0 339.439 3.768 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccccc2F)c1F ZINC001173175009 1131990693 /nfs/dbraw/zinc/99/06/93/1131990693.db2.gz INHPEFRTOQAWPW-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C(C)(C)c2ccccn2)c1F ZINC001173182113 1131993545 /nfs/dbraw/zinc/99/35/45/1131993545.db2.gz HLLMXMLFMBLCRK-GFCCVEGCSA-N 1 0 347.390 3.593 20 5 EHBDRO CC[N@H+](Cc1cccnc1)[C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-] ZINC001173187616 1131993589 /nfs/dbraw/zinc/99/35/89/1131993589.db2.gz AVXXDVUQUZQZDR-ZDUSSCGKSA-N 1 0 347.390 3.591 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2ccc(N)cc2)c1F ZINC001173194235 1131995255 /nfs/dbraw/zinc/99/52/55/1131995255.db2.gz YVTRNBMZEFBYPD-VXGBXAGGSA-N 1 0 347.390 3.607 20 5 EHBDRO COc1cccc(OC)c1[C@H](C)[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173216592 1132002307 /nfs/dbraw/zinc/00/23/07/1132002307.db2.gz DHFXXHQZBMWDEE-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1ccc2c(c1)C[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173218468 1132003586 /nfs/dbraw/zinc/00/35/86/1132003586.db2.gz KAGLIASRGBKWOG-KSSFIOAISA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)n1 ZINC001173223386 1132005551 /nfs/dbraw/zinc/00/55/51/1132005551.db2.gz IGHHXQRVBYODLE-OAHLLOKOSA-N 1 0 327.428 3.797 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC001173228359 1132007487 /nfs/dbraw/zinc/00/74/87/1132007487.db2.gz VJHBAQMLCJXIRD-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO COc1cccc([C@@H](C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173230014 1132007530 /nfs/dbraw/zinc/00/75/30/1132007530.db2.gz PWKWXFNXBFIDOH-GJZGRUSLSA-N 1 0 328.412 3.928 20 5 EHBDRO COc1cncc([C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229231 1132008577 /nfs/dbraw/zinc/00/85/77/1132008577.db2.gz RTMSLRRHGJLSQP-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](CC(=O)OC(C)(C)C)C1 ZINC001173230945 1132008733 /nfs/dbraw/zinc/00/87/33/1132008733.db2.gz GXZQIZWNHXLRFP-ZBFHGGJFSA-N 1 0 348.443 3.580 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCc2ccccc2O1 ZINC001173231054 1132008967 /nfs/dbraw/zinc/00/89/67/1132008967.db2.gz WVGURDWKNGHARN-RDTXWAMCSA-N 1 0 326.396 3.509 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](O)c1cc2ccccc2o1 ZINC001173231074 1132009060 /nfs/dbraw/zinc/00/90/60/1132009060.db2.gz XDCOSKKNRDPTLE-CXAGYDPISA-N 1 0 340.379 3.595 20 5 EHBDRO Cc1ccc([C@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173231101 1132009417 /nfs/dbraw/zinc/00/94/17/1132009417.db2.gz XKKTXKVBQRCSSF-AUUYWEPGSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@H]1C1CCCCC1 ZINC001173231060 1132009511 /nfs/dbraw/zinc/00/95/11/1132009511.db2.gz JGKGABKPWVFJSP-BEFAXECRSA-N 1 0 332.444 3.807 20 5 EHBDRO Cc1ccc(C)c([C@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC001168924549 1132605893 /nfs/dbraw/zinc/60/58/93/1132605893.db2.gz DSYFTDJCIIXMMK-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H]2CCc3c2cccc3OC(F)(F)F)C1 ZINC001168978235 1132618220 /nfs/dbraw/zinc/61/82/20/1132618220.db2.gz QCYBTWKFCAAHMJ-SUNKGSAMSA-N 1 0 344.333 3.608 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]CCCCCCCCCCCCO)C1 ZINC001168983794 1132619309 /nfs/dbraw/zinc/61/93/09/1132619309.db2.gz LFBNOWTZPWLROY-ROUUACIJSA-N 1 0 328.497 3.915 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@@H]2CCCC[C@H]2OCc2ccccc2)C1 ZINC001168958891 1132620326 /nfs/dbraw/zinc/62/03/26/1132620326.db2.gz RDRYBDZEEHHBPG-WJFTUGDTSA-N 1 0 332.444 3.549 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168967627 1132622233 /nfs/dbraw/zinc/62/22/33/1132622233.db2.gz RKTAZUJKQVXJMP-RISCZKNCSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cc(Br)ccc2Cl)C1 ZINC001168969491 1132622761 /nfs/dbraw/zinc/62/27/61/1132622761.db2.gz FBSREAYEFKFTKJ-BXKDBHETSA-N 1 0 347.640 3.638 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001168973379 1132625140 /nfs/dbraw/zinc/62/51/40/1132625140.db2.gz ONVGLUOKKVESIN-JTNHKYCSSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@H]2CC[C@@H](OCc3ccccc3)CC2)C1 ZINC001169000657 1132629065 /nfs/dbraw/zinc/62/90/65/1132629065.db2.gz YLPXHEQNOYECPN-INDMIFKZSA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(c3noc4cc(F)ccc43)CC2)C1 ZINC001169010100 1132631289 /nfs/dbraw/zinc/63/12/89/1132631289.db2.gz AYGCUVYYDLBGPP-DOMZBBRYSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3ccccc32)C1 ZINC001169027883 1132634849 /nfs/dbraw/zinc/63/48/49/1132634849.db2.gz RLIHNUSCRVVHNH-GDBMZVCRSA-N 1 0 327.428 3.726 20 5 EHBDRO C[C@H](c1cccc(Br)c1)[N@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169057843 1132646448 /nfs/dbraw/zinc/64/64/48/1132646448.db2.gz XZYGCMJLHFNDNO-TYNCELHUSA-N 1 0 341.249 3.887 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1c(C)noc1C ZINC001176182953 1132858889 /nfs/dbraw/zinc/85/88/89/1132858889.db2.gz FYWXPPDELNADDN-UHFFFAOYSA-N 1 0 348.406 3.849 20 5 EHBDRO CCOc1cc(N2CC[NH+]([C@@H](C)CC(C)C)CC2)ccc1[N+](=O)[O-] ZINC001169907309 1132895997 /nfs/dbraw/zinc/89/59/97/1132895997.db2.gz DNFSLFJSFCWBNF-HNNXBMFYSA-N 1 0 335.448 3.550 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCCOc1ccc2c(c1)OCO2 ZINC001169930368 1132900429 /nfs/dbraw/zinc/90/04/29/1132900429.db2.gz KBCLCSRLYCYOAJ-UHFFFAOYSA-N 1 0 343.447 3.503 20 5 EHBDRO COc1ccc(Nc2cc[nH+]cc2Oc2ccccc2)cc1[N+](=O)[O-] ZINC001176359471 1132919763 /nfs/dbraw/zinc/91/97/63/1132919763.db2.gz HKUSGZWKLDCMMD-UHFFFAOYSA-N 1 0 337.335 3.956 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@H]([NH+]2[C@H](C)CC[C@H]2C)C1 ZINC000804357267 1133007275 /nfs/dbraw/zinc/00/72/75/1133007275.db2.gz BPCRBLZVQBMDJU-CPUCHLNUSA-N 1 0 345.443 3.639 20 5 EHBDRO CC(C)CC[C@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758655 1133048573 /nfs/dbraw/zinc/04/85/73/1133048573.db2.gz DUXWZSMKXMYGAK-MRXNPFEDSA-N 1 0 343.431 3.711 20 5 EHBDRO COCC[C@H]1CCCC[N@H+](Cc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC000767941487 1133073209 /nfs/dbraw/zinc/07/32/09/1133073209.db2.gz RWUSEZAKLCKDED-CYBMUJFWSA-N 1 0 326.824 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)c1 ZINC000773705258 1133095196 /nfs/dbraw/zinc/09/51/96/1133095196.db2.gz UQUJVVMDMQUHKX-UONOGXRCSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2ccccc2C1 ZINC001178295687 1133153854 /nfs/dbraw/zinc/15/38/54/1133153854.db2.gz VMXPCDOJWHMEGH-KRWDZBQOSA-N 1 0 326.396 3.641 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1([C@@H]2CCCCO2)CCC1 ZINC001179274802 1133242623 /nfs/dbraw/zinc/24/26/23/1133242623.db2.gz RFILULZOCXRUHY-SFHVURJKSA-N 1 0 348.443 3.823 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348063 1133242889 /nfs/dbraw/zinc/24/28/89/1133242889.db2.gz NFFKLIRTWXZGTI-SJBDTSRBSA-N 1 0 330.384 3.756 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccnn1-c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC001179685031 1133269740 /nfs/dbraw/zinc/26/97/40/1133269740.db2.gz AOTXRMUVVSZAKQ-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001181880666 1133546443 /nfs/dbraw/zinc/54/64/43/1133546443.db2.gz YETXRPVHPOQYFK-MLGOLLRUSA-N 1 0 326.824 3.789 20 5 EHBDRO Cc1cccc(C)c1C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000774258234 1133647661 /nfs/dbraw/zinc/64/76/61/1133647661.db2.gz QMVKODFQOIAQFZ-DLBZAZTESA-N 1 0 328.416 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1COC3(CCCCC3)O1)CCC2 ZINC000774273530 1133652668 /nfs/dbraw/zinc/65/26/68/1133652668.db2.gz SKHKHJRXQLICHB-WMZOPIPTSA-N 1 0 346.427 3.638 20 5 EHBDRO Cc1ccc([C@@H]2C[C@H](C)[N@@H+](C[C@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000786126335 1133810882 /nfs/dbraw/zinc/81/08/82/1133810882.db2.gz PLEBESVGBBUXCQ-CVAIRZPRSA-N 1 0 340.423 3.815 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@H]1CC[C@@H](C2CC2)O1 ZINC001184053647 1133890963 /nfs/dbraw/zinc/89/09/63/1133890963.db2.gz BZNMYUWNMXDZJB-NFBUACBFSA-N 1 0 344.455 3.853 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000786810997 1133909635 /nfs/dbraw/zinc/90/96/35/1133909635.db2.gz WXYWMRHKFKRCGN-GWCFYCIZSA-N 1 0 346.814 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCc3ccccc3OC2)c1 ZINC000786866495 1133913773 /nfs/dbraw/zinc/91/37/73/1133913773.db2.gz YLQHWFTXUXXCKA-AWEZNQCLSA-N 1 0 332.787 3.732 20 5 EHBDRO C[C@@H](OC(=O)[C@H]1CCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000786877268 1133915367 /nfs/dbraw/zinc/91/53/67/1133915367.db2.gz CDKQUPUZLPHLKS-CXAGYDPISA-N 1 0 332.400 3.606 20 5 EHBDRO CC[N@H+](CCNc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1)C(C)C ZINC001185202973 1134050037 /nfs/dbraw/zinc/05/00/37/1134050037.db2.gz AEDMNLRVWJRXET-UHFFFAOYSA-N 1 0 346.406 3.938 20 5 EHBDRO CC(C)[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccnn1C ZINC000788265827 1134103152 /nfs/dbraw/zinc/10/31/52/1134103152.db2.gz KCUXCITZXHOGEJ-CYBMUJFWSA-N 1 0 336.823 3.511 20 5 EHBDRO C[C@@H]([NH2+]CCSCc1ccccc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788506036 1134133235 /nfs/dbraw/zinc/13/32/35/1134133235.db2.gz UXKOCCNUFVIQGD-GFCCVEGCSA-N 1 0 349.431 3.900 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C(C)C)[C@H](O)c1ccccc1 ZINC000788540205 1134139655 /nfs/dbraw/zinc/13/96/55/1134139655.db2.gz RMFXHKWUXRRDPH-RBUKOAKNSA-N 1 0 328.412 3.751 20 5 EHBDRO CC(C)[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@H](O)c1ccccc1 ZINC000788541922 1134139691 /nfs/dbraw/zinc/13/96/91/1134139691.db2.gz ZGKDXYIATDDOKQ-IJQANDGASA-N 1 0 340.423 3.956 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788543611 1134140435 /nfs/dbraw/zinc/14/04/35/1134140435.db2.gz XYHORRJSLUKCAF-CYBMUJFWSA-N 1 0 329.400 3.817 20 5 EHBDRO CCO[C@H](CC[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)C1CCCC1 ZINC000788606742 1134150392 /nfs/dbraw/zinc/15/03/92/1134150392.db2.gz ADYLULQYJHAFOB-SCLBCKFNSA-N 1 0 335.448 3.813 20 5 EHBDRO COc1ccc(C(C)(C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788642015 1134154972 /nfs/dbraw/zinc/15/49/72/1134154972.db2.gz BWLNDIGTAVYNNE-ZDUSSCGKSA-N 1 0 343.427 3.814 20 5 EHBDRO CCOc1cc(NCC[N@H+](CC)CCC(F)(F)F)ccc1[N+](=O)[O-] ZINC001186089108 1134168613 /nfs/dbraw/zinc/16/86/13/1134168613.db2.gz MUUVDMSPAHMVKM-UHFFFAOYSA-N 1 0 349.353 3.680 20 5 EHBDRO Cc1cc(Br)cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)c1 ZINC000774977451 1134174192 /nfs/dbraw/zinc/17/41/92/1134174192.db2.gz QVABNHZAZKOIPB-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccc(C)cc1 ZINC000775016694 1134212710 /nfs/dbraw/zinc/21/27/10/1134212710.db2.gz TVKBSXJESCWMTI-XATQLNLPSA-N 1 0 326.396 3.630 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccccc1OC ZINC000775071183 1134284669 /nfs/dbraw/zinc/28/46/69/1134284669.db2.gz DDWUULMKEBCJJI-OAHLLOKOSA-N 1 0 330.384 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CC[C@H]4CCCC[C@@H]4C3)nc2c1 ZINC000775180555 1134484106 /nfs/dbraw/zinc/48/41/06/1134484106.db2.gz ZZCMDSVIHPIGPF-MGPQQGTHSA-N 1 0 328.416 3.920 20 5 EHBDRO CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@H](c2ccccc2)C1 ZINC000746958448 1134488903 /nfs/dbraw/zinc/48/89/03/1134488903.db2.gz LFEJIXNRYOMMPH-KRWDZBQOSA-N 1 0 331.803 3.741 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)c(C)c1 ZINC000791606103 1134582945 /nfs/dbraw/zinc/58/29/45/1134582945.db2.gz QMDFJUOFNRJTQX-FXAWDEMLSA-N 1 0 340.423 3.735 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000775387115 1134697736 /nfs/dbraw/zinc/69/77/36/1134697736.db2.gz WYBUIKIVMRGEHD-UPRAQXHNSA-N 1 0 326.396 3.541 20 5 EHBDRO CCCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](C)c1ccc(C)o1 ZINC001190588769 1134723232 /nfs/dbraw/zinc/72/32/32/1134723232.db2.gz DUWGOTYWFCQKFE-CQSZACIVSA-N 1 0 334.420 3.864 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2cccc(O)c2)c([N+](=O)[O-])c1 ZINC001170296254 1134737225 /nfs/dbraw/zinc/73/72/25/1134737225.db2.gz FWDPGYIUNVKZJN-STQMWFEESA-N 1 0 330.384 3.591 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(F)c(F)c2)c([N+](=O)[O-])c1 ZINC001170298413 1134738444 /nfs/dbraw/zinc/73/84/44/1134738444.db2.gz LKDJDAYRESLIPT-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170304461 1134739105 /nfs/dbraw/zinc/73/91/05/1134739105.db2.gz CAXIIDCAKMWZAG-DGCLKSJQSA-N 1 0 328.359 3.702 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CC2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170313346 1134745766 /nfs/dbraw/zinc/74/57/66/1134745766.db2.gz LNNQEZFBSCHDQC-OAHLLOKOSA-N 1 0 340.423 3.856 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3sccc32)c([N+](=O)[O-])c1 ZINC001170326359 1134748541 /nfs/dbraw/zinc/74/85/41/1134748541.db2.gz HXRZVCBMIGBULY-ABAIWWIYSA-N 1 0 332.425 3.873 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CC[C@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326684 1134748718 /nfs/dbraw/zinc/74/87/18/1134748718.db2.gz BOOOAQJSJARJMU-QWHCGFSZSA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3sccc3C2)c([N+](=O)[O-])c1 ZINC001170334319 1134751833 /nfs/dbraw/zinc/75/18/33/1134751833.db2.gz CAOBFZNSMDAYQN-LBPRGKRZSA-N 1 0 332.425 3.654 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cnc(Cl)c(C)c2)c([N+](=O)[O-])c1 ZINC001170306482 1134752196 /nfs/dbraw/zinc/75/21/96/1134752196.db2.gz VZEXKLGKWXPZGH-GFCCVEGCSA-N 1 0 349.818 3.681 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCOC3(CCCCC3)C2)c([N+](=O)[O-])c1 ZINC001170353158 1134753916 /nfs/dbraw/zinc/75/39/16/1134753916.db2.gz WWRKEEXHVTYJEA-HNNXBMFYSA-N 1 0 348.443 3.570 20 5 EHBDRO CO[C@@H]1[C@H](C)[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397973 1134764254 /nfs/dbraw/zinc/76/42/54/1134764254.db2.gz BWVPFEYDSAIGLM-OAUYIBNBSA-N 1 0 336.432 3.531 20 5 EHBDRO CC[C@H]1c2ccccc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC001191039250 1134782131 /nfs/dbraw/zinc/78/21/31/1134782131.db2.gz NTZNQKRCEIBVHP-IBGZPJMESA-N 1 0 326.396 3.983 20 5 EHBDRO C[N@@H+]1CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC001191307056 1134845030 /nfs/dbraw/zinc/84/50/30/1134845030.db2.gz UJGQXEFDNZBRBE-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000747100696 1134848865 /nfs/dbraw/zinc/84/88/65/1134848865.db2.gz NWQHJAYUWVFRGU-OAHLLOKOSA-N 1 0 334.803 3.596 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)NC(=O)OC(C)(C)C ZINC000793222604 1134876656 /nfs/dbraw/zinc/87/66/56/1134876656.db2.gz DPTBYHFZQVDCAQ-KADHNRKRSA-N 1 0 349.431 3.501 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)[C@@H](O)c1ccccc1 ZINC000793235938 1134880751 /nfs/dbraw/zinc/88/07/51/1134880751.db2.gz IBNXUBHYQKBDJR-OALUTQOASA-N 1 0 328.412 3.895 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC001191789194 1134922938 /nfs/dbraw/zinc/92/29/38/1134922938.db2.gz GKABKYFLPKOGBC-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(C)c(F)c1 ZINC001192909040 1135071631 /nfs/dbraw/zinc/07/16/31/1135071631.db2.gz BQLDSKFDQIEDIG-QZTJIDSGSA-N 1 0 332.375 3.817 20 5 EHBDRO CC(C)C1(C)CC[NH+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)CC1 ZINC001193616528 1135159527 /nfs/dbraw/zinc/15/95/27/1135159527.db2.gz OHIGVGQCTJMESO-AWEZNQCLSA-N 1 0 333.432 3.680 20 5 EHBDRO C[C@]1(CNc2ccc(N)cc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000804684317 1135168504 /nfs/dbraw/zinc/16/85/04/1135168504.db2.gz ZACZVWLSURGYDV-LJQANCHMSA-N 1 0 340.427 3.501 20 5 EHBDRO C[C@H]1C[C@H]([NH+]2CCCC2)CN1c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC000804814193 1135203323 /nfs/dbraw/zinc/20/33/23/1135203323.db2.gz ZYCKENUMWVHASF-AAEUAGOBSA-N 1 0 343.349 3.677 20 5 EHBDRO COCC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@H]1CC[C@@H](C)C1 ZINC001193974788 1135208366 /nfs/dbraw/zinc/20/83/66/1135208366.db2.gz CKHAOLVFLRTEFN-DOMZBBRYSA-N 1 0 326.824 3.885 20 5 EHBDRO CCCN(CC[NH+]1CCCCC1)Cc1cc([N+](=O)[O-])ccc1Cl ZINC001194240528 1135248955 /nfs/dbraw/zinc/24/89/55/1135248955.db2.gz LBRVSYDHJQYNQD-UHFFFAOYSA-N 1 0 339.867 3.946 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@@H](c3ccccc3F)C2)c1 ZINC001170535866 1135577110 /nfs/dbraw/zinc/57/71/10/1135577110.db2.gz IRTNWEXBWNMDTO-CQSZACIVSA-N 1 0 330.359 3.602 20 5 EHBDRO Cc1ccc(C[C@]2(C)CCC[N@@H+]2Cc2cccnc2[N+](=O)[O-])cc1 ZINC001196595264 1135582031 /nfs/dbraw/zinc/58/20/31/1135582031.db2.gz RILZXLKFOXSNPH-IBGZPJMESA-N 1 0 325.412 3.895 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H](C)[C@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000808445341 1135668522 /nfs/dbraw/zinc/66/85/22/1135668522.db2.gz OMRFWMDYXNYAEL-KUHUBIRLSA-N 1 0 328.412 3.930 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)c1ccccc1 ZINC000808720501 1135720871 /nfs/dbraw/zinc/72/08/71/1135720871.db2.gz AASSFSBNYBCCNO-FASAQXTFSA-N 1 0 326.396 3.684 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1COc2ccccc2[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000808728426 1135723473 /nfs/dbraw/zinc/72/34/73/1135723473.db2.gz DUCARYJTAXLGNT-LNLFQRSKSA-N 1 0 342.395 3.520 20 5 EHBDRO CC[C@H](c1cccc(OC)c1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000808761675 1135729602 /nfs/dbraw/zinc/72/96/02/1135729602.db2.gz QHDLGQJFXNWVHT-RTBURBONSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@H](Cc3nccs3)C2)cccc1[N+](=O)[O-] ZINC001197921396 1135751023 /nfs/dbraw/zinc/75/10/23/1135751023.db2.gz SGZUWGYNFUVWLU-AWEZNQCLSA-N 1 0 331.441 3.814 20 5 EHBDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)cc1 ZINC000809701712 1135874122 /nfs/dbraw/zinc/87/41/22/1135874122.db2.gz JCOUALUGGMOFFB-SJKOYZFVSA-N 1 0 334.803 3.768 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@H](O)c1ccccc1 ZINC000809748601 1135885308 /nfs/dbraw/zinc/88/53/08/1135885308.db2.gz WBTKNBZFPLJKHC-QZEGLACASA-N 1 0 326.396 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCC[C@H]4OCC[C@H]43)o2)cc1 ZINC001200971405 1135969958 /nfs/dbraw/zinc/96/99/58/1135969958.db2.gz LIFCJTROTLJJNW-YQVWRLOYSA-N 1 0 342.395 3.902 20 5 EHBDRO C[C@H](C[C@H]1CCOC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001201380833 1136014250 /nfs/dbraw/zinc/01/42/50/1136014250.db2.gz VZGGCVUVFCZDMO-ZIAGYGMSSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1N(CC[NH3+])C12CC3CC(CC(C3)C1)C2 ZINC001170626923 1136048703 /nfs/dbraw/zinc/04/87/03/1136048703.db2.gz MLVIYHNXXUKUJD-UHFFFAOYSA-N 1 0 329.444 3.637 20 5 EHBDRO C[N@H+](CCc1cccc(NCc2cccc([N+](=O)[O-])c2)c1)C1CC1 ZINC001201734671 1136062414 /nfs/dbraw/zinc/06/24/14/1136062414.db2.gz MOBTWEHPRCFIIZ-UHFFFAOYSA-N 1 0 325.412 3.844 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@@H](OC(C)C)C1(C)C ZINC001201887871 1136070121 /nfs/dbraw/zinc/07/01/21/1136070121.db2.gz DGUPGSHSGKUGAR-IAGOWNOFSA-N 1 0 336.432 3.675 20 5 EHBDRO COc1ccc2c(c1)CCC[C@@H]2C[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC001201910618 1136074309 /nfs/dbraw/zinc/07/43/09/1136074309.db2.gz HRPWUMHHXYBUIZ-MRXNPFEDSA-N 1 0 326.396 3.813 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCCC3(CCCC3)C2)c1 ZINC000811494086 1136093543 /nfs/dbraw/zinc/09/35/43/1136093543.db2.gz POHJAOKTJKEQRT-UHFFFAOYSA-N 1 0 332.400 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@H+]2CC=C(c3ccc(F)cc3)CC2)cc1 ZINC000776279661 1136134619 /nfs/dbraw/zinc/13/46/19/1136134619.db2.gz XDXHXWVNBADCLK-LJQANCHMSA-N 1 0 342.370 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@H](c3ccccc3)C2)c1 ZINC000814226411 1136425512 /nfs/dbraw/zinc/42/55/12/1136425512.db2.gz WNGPKDSMEKMOQO-MRXNPFEDSA-N 1 0 336.395 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@H+](C2CC2)[C@H]2CCc3ccccc32)cc1 ZINC000776586829 1136448832 /nfs/dbraw/zinc/44/88/32/1136448832.db2.gz ISDGNUZBTPJYCA-VQTJNVASSA-N 1 0 338.407 3.780 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776597660 1136459651 /nfs/dbraw/zinc/45/96/51/1136459651.db2.gz JRQSRFKYPXMKRF-QHRIQVFBSA-N 1 0 344.386 3.775 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000852566977 1136467202 /nfs/dbraw/zinc/46/72/02/1136467202.db2.gz JVTUAHXLUGDTJN-CRAIPNDOSA-N 1 0 325.412 3.799 20 5 EHBDRO CC(C)([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000776605856 1136472574 /nfs/dbraw/zinc/47/25/74/1136472574.db2.gz PPJKIHZBIDQHDV-MRXNPFEDSA-N 1 0 334.803 3.807 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666336 1136491983 /nfs/dbraw/zinc/49/19/83/1136491983.db2.gz GMGJIIKVNURMBM-MAUKXSAKSA-N 1 0 346.814 3.771 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC([C@H]2CCC[NH2+]C2)CC1 ZINC000853016090 1136498541 /nfs/dbraw/zinc/49/85/41/1136498541.db2.gz NOQYCAXPTCZOLE-AWEZNQCLSA-N 1 0 339.386 3.748 20 5 EHBDRO Cc1cccc2c1CCC[C@@H]2[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000853126082 1136512212 /nfs/dbraw/zinc/51/22/12/1136512212.db2.gz AHALUVLNYBODHI-OALUTQOASA-N 1 0 326.396 3.604 20 5 EHBDRO Cc1cccc(C)c1OCC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815567519 1136611755 /nfs/dbraw/zinc/61/17/55/1136611755.db2.gz BRXYIAPFJWDAEY-CQSZACIVSA-N 1 0 329.400 3.523 20 5 EHBDRO CCC1(CC)CC[NH+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)CC1 ZINC000776771861 1136659772 /nfs/dbraw/zinc/65/97/72/1136659772.db2.gz NIVVOFNXVRPODC-UHFFFAOYSA-N 1 0 343.431 3.713 20 5 EHBDRO CCC(CC)C(=O)N1CCC([NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173333689 1136773126 /nfs/dbraw/zinc/77/31/26/1136773126.db2.gz DQQHAPBDLOATCD-CQSZACIVSA-N 1 0 347.459 3.673 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(Cl)c1 ZINC000218471808 1136814123 /nfs/dbraw/zinc/81/41/23/1136814123.db2.gz YJFIWKIHXYIFLX-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819015445 1136903381 /nfs/dbraw/zinc/90/33/81/1136903381.db2.gz HMUWBBGTDVQJSR-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1ccc(SC[C@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819238625 1136923405 /nfs/dbraw/zinc/92/34/05/1136923405.db2.gz LBAGTXNWNKOSTL-KBXCAEBGSA-N 1 0 346.452 3.707 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035861 1136934513 /nfs/dbraw/zinc/93/45/13/1136934513.db2.gz LVVHUJVNYVJDLT-LSDHHAIUSA-N 1 0 327.384 3.513 20 5 EHBDRO C[C@H]([NH2+]CCC1CN(C(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000859236444 1137009274 /nfs/dbraw/zinc/00/92/74/1137009274.db2.gz FOCSAYOKQGYWDM-ZDUSSCGKSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH+]2CCC3(CCC(O)CC3)CC2)c1 ZINC000824521655 1137141185 /nfs/dbraw/zinc/14/11/85/1137141185.db2.gz LOQDVNBSHIQXLY-UHFFFAOYSA-N 1 0 338.835 3.765 20 5 EHBDRO C[C@]1(CO)C[N@@H+](Cc2c3ccccc3cc3ccccc32)C[C@@]1(C)CO ZINC000862518963 1137147727 /nfs/dbraw/zinc/14/77/27/1137147727.db2.gz MZHDJWCAPIQRKZ-ZRZAMGCNSA-N 1 0 349.474 3.806 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@@H]2O)ccc1Cl ZINC000824696254 1137148691 /nfs/dbraw/zinc/14/86/91/1137148691.db2.gz JHCMHNHIVMOSIB-LXZKKBNFSA-N 1 0 338.835 3.764 20 5 EHBDRO Cc1nc(F)ccc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824820972 1137153702 /nfs/dbraw/zinc/15/37/02/1137153702.db2.gz RSALAEKRXPIWSW-INIZCTEOSA-N 1 0 329.375 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCO[C@@H](c2ccncc2)C1 ZINC000824953797 1137159211 /nfs/dbraw/zinc/15/92/11/1137159211.db2.gz LSXITLZXNIKTQD-DOTOQJQBSA-N 1 0 347.802 3.653 20 5 EHBDRO COC[C@]1(CO)CC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000825158615 1137168331 /nfs/dbraw/zinc/16/83/31/1137168331.db2.gz SJFWREVGVCQZDS-JOCHJYFZSA-N 1 0 335.447 3.824 20 5 EHBDRO C[C@H]([NH3+])CN(C)Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000863651170 1137196836 /nfs/dbraw/zinc/19/68/36/1137196836.db2.gz CEFZMNZDKDMCKG-LBPRGKRZSA-N 1 0 349.818 3.820 20 5 EHBDRO C[NH+]1CCC([C@@H]2CCN(c3ccc([N+](=O)[O-])cc3C(F)F)C2)CC1 ZINC000865641833 1137301242 /nfs/dbraw/zinc/30/12/42/1137301242.db2.gz KDDIJNAVMREPQZ-CYBMUJFWSA-N 1 0 339.386 3.701 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000865725997 1137306895 /nfs/dbraw/zinc/30/68/95/1137306895.db2.gz SGOCONIJOPVOQA-UHFFFAOYSA-N 1 0 332.787 3.611 20 5 EHBDRO CCC1([NH+]2CCCC2)CCN(c2ccc([N+](=O)[O-])cc2COC)CC1 ZINC000866022887 1137324996 /nfs/dbraw/zinc/32/49/96/1137324996.db2.gz FQHVRJHDMLHOLW-UHFFFAOYSA-N 1 0 347.459 3.586 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCc1ccc(Cl)nc1 ZINC000866286176 1137342793 /nfs/dbraw/zinc/34/27/93/1137342793.db2.gz WAPYUJSMASAISA-LLVKDONJSA-N 1 0 337.782 3.546 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1nc(C2CC2)cs1 ZINC000866306824 1137343998 /nfs/dbraw/zinc/34/39/98/1137343998.db2.gz WDMLBFZCVRAYBO-JTQLQIEISA-N 1 0 335.404 3.789 20 5 EHBDRO Cc1noc(C)c1[C@@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866309510 1137344227 /nfs/dbraw/zinc/34/42/27/1137344227.db2.gz PKRSJWQCDFUTHW-WDEREUQCSA-N 1 0 335.379 3.663 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC(C)(C)c1ccccn1 ZINC000866364207 1137349689 /nfs/dbraw/zinc/34/96/89/1137349689.db2.gz BDTLRMIQMPNVPP-ZDUSSCGKSA-N 1 0 331.391 3.627 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000866389981 1137351271 /nfs/dbraw/zinc/35/12/71/1137351271.db2.gz JWYHTPMCZFBKIY-PIGZYNQJSA-N 1 0 330.359 3.648 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000772949621 1137361650 /nfs/dbraw/zinc/36/16/50/1137361650.db2.gz CSELNCPSVVVRHK-OAHLLOKOSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)C1CC=CC1 ZINC001146698396 1137392571 /nfs/dbraw/zinc/39/25/71/1137392571.db2.gz NVKOIKUCYZBEHZ-UHFFFAOYSA-N 1 0 347.418 3.861 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1OC ZINC000772978157 1137398055 /nfs/dbraw/zinc/39/80/55/1137398055.db2.gz CHADVERGQAEHGN-QGZVFWFLSA-N 1 0 330.384 3.723 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1cc2cccnc2c([N+](=O)[O-])c1 ZINC001171305699 1137407172 /nfs/dbraw/zinc/40/71/72/1137407172.db2.gz VTYPDEOJGPZKAG-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO COc1ccc(C[N@@H+]2CCc3ccccc3C2(C)C)cc1[N+](=O)[O-] ZINC001171416968 1137476643 /nfs/dbraw/zinc/47/66/43/1137476643.db2.gz JODYEPTTYSIASN-UHFFFAOYSA-N 1 0 326.396 3.897 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001171619742 1137500859 /nfs/dbraw/zinc/50/08/59/1137500859.db2.gz DFFWBIWYEWMNJC-YVEFUNNKSA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](C2CCCCC2)C1 ZINC001171804856 1137513541 /nfs/dbraw/zinc/51/35/41/1137513541.db2.gz JMGFYLVOCLVSPE-GDBMZVCRSA-N 1 0 345.443 3.824 20 5 EHBDRO C/C(=C\c1ccc([N+](=O)[O-])cc1)c1nc(C2C[C@H]3CC[C@@H](C2)[NH2+]3)no1 ZINC000871797681 1137558655 /nfs/dbraw/zinc/55/86/55/1137558655.db2.gz ZIJSOBANECWGGN-OKEYKJPBSA-N 1 0 340.383 3.536 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000872061539 1137568907 /nfs/dbraw/zinc/56/89/07/1137568907.db2.gz YUEWGYNYYAYFRN-UKRRQHHQSA-N 1 0 326.824 3.586 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccnn1C ZINC000872064423 1137569178 /nfs/dbraw/zinc/56/91/78/1137569178.db2.gz GNWYGNZHBOYHNH-STQMWFEESA-N 1 0 334.395 3.558 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@H](c2ccncc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872075568 1137569958 /nfs/dbraw/zinc/56/99/58/1137569958.db2.gz DUPCUFBTPUFACD-JDFRZJQESA-N 1 0 345.374 3.700 20 5 EHBDRO Cc1cc(C)c(NC(=O)C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(C)c1 ZINC000873007421 1137587823 /nfs/dbraw/zinc/58/78/23/1137587823.db2.gz PRNFZELVBDRBJE-UHFFFAOYSA-N 1 0 341.411 3.557 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2c(F)cccc2Cl)cccc1[N+](=O)[O-] ZINC000873060600 1137589246 /nfs/dbraw/zinc/58/92/46/1137589246.db2.gz JVYSJSABODVPNM-OAHLLOKOSA-N 1 0 338.766 3.519 20 5 EHBDRO Cc1cccc2oc(CC[NH2+]Cc3cccc([N+](=O)[O-])c3C)nc21 ZINC000873065385 1137589358 /nfs/dbraw/zinc/58/93/58/1137589358.db2.gz HOSKVZSFQIOWTD-UHFFFAOYSA-N 1 0 325.368 3.685 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1Cl ZINC000877054920 1137668843 /nfs/dbraw/zinc/66/88/43/1137668843.db2.gz LMVIWKZUKVUTNB-OIKLOGQESA-N 1 0 338.770 3.638 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC12CCC2 ZINC000878337484 1137711334 /nfs/dbraw/zinc/71/13/34/1137711334.db2.gz LGVSXYQMCGHMBB-CYBMUJFWSA-N 1 0 342.399 3.657 20 5 EHBDRO CC1(C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878673012 1137724689 /nfs/dbraw/zinc/72/46/89/1137724689.db2.gz MAORULDMKDDPSQ-LBPRGKRZSA-N 1 0 336.779 3.576 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CCC[C@H](C)C1 ZINC000878691187 1137725339 /nfs/dbraw/zinc/72/53/39/1137725339.db2.gz LCACKYPKEMQJTG-IHRRRGAJSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(F)CC1 ZINC000878989310 1137734456 /nfs/dbraw/zinc/73/44/56/1137734456.db2.gz ITTCYPOFGMFCBZ-PNESKVBLSA-N 1 0 348.378 3.651 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@]12C[C@@H]1CCCC2 ZINC000879267078 1137742854 /nfs/dbraw/zinc/74/28/54/1137742854.db2.gz UWWPAYVVIIFJRQ-ZJNRKIDTSA-N 1 0 342.399 3.703 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2cc3cnccc3o2)ccc1[N+](=O)[O-] ZINC000879715292 1137756403 /nfs/dbraw/zinc/75/64/03/1137756403.db2.gz TZAPEOJLULRWHQ-GFCCVEGCSA-N 1 0 341.367 3.986 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2cccc(Cl)c2)cc1[N+](=O)[O-] ZINC000130271751 1137835789 /nfs/dbraw/zinc/83/57/89/1137835789.db2.gz CSKXPJNVCXATBV-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](c2ccc(F)cc2)C2CCOCC2)cc1 ZINC000883200685 1137848253 /nfs/dbraw/zinc/84/82/53/1137848253.db2.gz OSHNMPPEZOFPTB-IBGZPJMESA-N 1 0 344.386 3.991 20 5 EHBDRO CC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CC(F)(F)C1 ZINC000883250289 1137850475 /nfs/dbraw/zinc/85/04/75/1137850475.db2.gz MSBCRHRSWUEQGK-UHFFFAOYSA-N 1 0 336.285 3.721 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CCC2(CCOCC2)CO1 ZINC000883261939 1137851146 /nfs/dbraw/zinc/85/11/46/1137851146.db2.gz QZWPAAGTDCBBGM-RDJZCZTQSA-N 1 0 348.443 3.530 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H]2CCC3(CCOCC3)CO2)cccc1[N+](=O)[O-] ZINC000883261779 1137851215 /nfs/dbraw/zinc/85/12/15/1137851215.db2.gz MNCJKUHMSKMGNO-HOTGVXAUSA-N 1 0 348.443 3.530 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901928 1137925158 /nfs/dbraw/zinc/92/51/58/1137925158.db2.gz JRXSICFUKJONQJ-IIZUFCTNSA-N 1 0 332.444 3.917 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)c1cccs1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000348312989 1137938071 /nfs/dbraw/zinc/93/80/71/1137938071.db2.gz FJZPRGCJDKJXFU-LLVKDONJSA-N 1 0 333.413 3.508 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1OC ZINC000885926346 1138025426 /nfs/dbraw/zinc/02/54/26/1138025426.db2.gz BCBCNOSKKPXAFQ-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1cc(C)cc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)c1OC ZINC000886179356 1138056427 /nfs/dbraw/zinc/05/64/27/1138056427.db2.gz STMWNEQERALOOF-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO Cc1nc(C2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886659183 1138109705 /nfs/dbraw/zinc/10/97/05/1138109705.db2.gz FSOCWHRFYNMXNF-UHFFFAOYSA-N 1 0 328.416 3.623 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)c1 ZINC000075864319 1138129131 /nfs/dbraw/zinc/12/91/31/1138129131.db2.gz IGBQYBOENWCBDO-SFHVURJKSA-N 1 0 326.396 3.634 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093770288 1138241017 /nfs/dbraw/zinc/24/10/17/1138241017.db2.gz BKCGETOOGFJFSP-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO C[C@@H]([NH2+]CCN(C(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000301489399 1138566440 /nfs/dbraw/zinc/56/64/40/1138566440.db2.gz RKFAIELMNNVEKE-CYBMUJFWSA-N 1 0 349.431 3.645 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCOC2(CCCC2)C1 ZINC000136673696 1138808258 /nfs/dbraw/zinc/80/82/58/1138808258.db2.gz PWSDMLBGYYSJAB-HNNXBMFYSA-N 1 0 334.416 3.575 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1OC ZINC000151583486 1139045486 /nfs/dbraw/zinc/04/54/86/1139045486.db2.gz GSAAKOVIPXIFDO-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCCOC1 ZINC000174146209 1139402279 /nfs/dbraw/zinc/40/22/79/1139402279.db2.gz STWSBAGUZAOVGJ-HNNXBMFYSA-N 1 0 337.419 3.805 20 5 EHBDRO Cc1nc(C)c(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000174245156 1139408728 /nfs/dbraw/zinc/40/87/28/1139408728.db2.gz UEPGEUNBHZSIJO-UHFFFAOYSA-N 1 0 347.440 3.712 20 5 EHBDRO Cc1nc(NCc2ccccc2C[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000178008421 1139662375 /nfs/dbraw/zinc/66/23/75/1139662375.db2.gz MZJXYENRWHRWSQ-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c1 ZINC000178729403 1139715665 /nfs/dbraw/zinc/71/56/65/1139715665.db2.gz BDTZEATYPQUAIP-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000183229652 1140022800 /nfs/dbraw/zinc/02/28/00/1140022800.db2.gz LADHCOQOQBCUBU-KYABYICQSA-N 1 0 346.427 3.602 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000183928857 1140066583 /nfs/dbraw/zinc/06/65/83/1140066583.db2.gz CXRAMNPHGDCVDV-SNVBAGLBSA-N 1 0 325.821 3.940 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC[C@H]1CCCCO1)C1CC1 ZINC000183998875 1140072953 /nfs/dbraw/zinc/07/29/53/1140072953.db2.gz ZQJMVYYHFJEWMM-QZTJIDSGSA-N 1 0 332.444 3.855 20 5 EHBDRO COc1cc(C[NH2+]C2(c3ccccc3)CCC2)c([N+](=O)[O-])cc1F ZINC000184239870 1140089934 /nfs/dbraw/zinc/08/99/34/1140089934.db2.gz PQWJVALPQCQQCC-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000190568750 1140409159 /nfs/dbraw/zinc/40/91/59/1140409159.db2.gz RVNQENFDLRGRIF-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCO[C@@H]2c2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000192120632 1140504071 /nfs/dbraw/zinc/50/40/71/1140504071.db2.gz GCZYCLLWXAZZHM-FUHWJXTLSA-N 1 0 348.349 3.801 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2c(C)cccc2[N+](=O)[O-])cc1 ZINC000192626697 1140541011 /nfs/dbraw/zinc/54/10/11/1140541011.db2.gz OSZKKZKPHJASKW-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO C[C@@](O)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192887811 1140554306 /nfs/dbraw/zinc/55/43/06/1140554306.db2.gz PHTJRSFCLMEBOC-NVXWUHKLSA-N 1 0 332.425 3.531 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+][C@H]3CCCSC3)cs2)c1 ZINC000267223633 1140769399 /nfs/dbraw/zinc/76/93/99/1140769399.db2.gz UBGGHFDJGSHNQN-LBPRGKRZSA-N 1 0 335.454 3.704 20 5 EHBDRO COC(=O)Nc1ccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000267460900 1140794302 /nfs/dbraw/zinc/79/43/02/1140794302.db2.gz VCADPKMLQAGOFP-CYBMUJFWSA-N 1 0 343.383 3.666 20 5 EHBDRO CC(C)Oc1cccc([C@@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268915308 1141024842 /nfs/dbraw/zinc/02/48/42/1141024842.db2.gz NQSVMYSIQZMYNX-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO CO[C@H](C)c1nc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cs1 ZINC000269125266 1141069159 /nfs/dbraw/zinc/06/91/59/1141069159.db2.gz YINIHRZEEZQEFJ-QWHCGFSZSA-N 1 0 349.456 3.870 20 5 EHBDRO C[C@H](O)C(C)(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000270743744 1141264563 /nfs/dbraw/zinc/26/45/63/1141264563.db2.gz VULVIYFFEMHKAH-JTQLQIEISA-N 1 0 338.791 3.757 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025738 1141296637 /nfs/dbraw/zinc/29/66/37/1141296637.db2.gz BBXDJHABSSFHEL-SJCJKPOMSA-N 1 0 348.374 3.517 20 5 EHBDRO COC1CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000271055202 1141302000 /nfs/dbraw/zinc/30/20/00/1141302000.db2.gz YYZPOGVTQQSBKA-UHFFFAOYSA-N 1 0 332.425 3.934 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCN(CC)CC1 ZINC000271136027 1141313358 /nfs/dbraw/zinc/31/33/58/1141313358.db2.gz NDCRGNFPKFTAEW-AWEZNQCLSA-N 1 0 337.489 3.539 20 5 EHBDRO C[C@H](O)C[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339137754 1141507211 /nfs/dbraw/zinc/50/72/11/1141507211.db2.gz GBVYMPDFSRTHBX-WCQYABFASA-N 1 0 346.349 3.739 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1c[nH]nc1-c1ccsc1 ZINC000348672562 1141564940 /nfs/dbraw/zinc/56/49/40/1141564940.db2.gz LVEPUMLMDBDXQI-UHFFFAOYSA-N 1 0 342.424 3.721 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000097262014 219006356 /nfs/dbraw/zinc/00/63/56/219006356.db2.gz PDAAKFVJABXONH-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430208122 1014954505 /nfs/dbraw/zinc/95/45/05/1014954505.db2.gz AEZZHMYTRIMAPS-GOSISDBHSA-N 1 0 342.395 3.949 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@@H](C)Cc1ccc(O)cc1 ZINC000536673376 1032106431 /nfs/dbraw/zinc/10/64/31/1032106431.db2.gz PWXPNCUEQLHYEE-AWEZNQCLSA-N 1 0 344.411 3.762 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000430226732 1015123606 /nfs/dbraw/zinc/12/36/06/1015123606.db2.gz NQMFNJVEKFLXMX-NXHRZFHOSA-N 1 0 348.443 3.629 20 5 EHBDRO C[C@H](Nc1ncc(Cl)cc1[N+](=O)[O-])[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302045564 1015132242 /nfs/dbraw/zinc/13/22/42/1015132242.db2.gz KILYNVKOMMVPCN-NWDGAFQWSA-N 1 0 338.839 3.708 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](C(F)(F)F)C1(C)C ZINC000430242912 1015207576 /nfs/dbraw/zinc/20/75/76/1015207576.db2.gz YYTRFVYBVVVZBM-CYBMUJFWSA-N 1 0 332.322 3.766 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC000533418057 1015390711 /nfs/dbraw/zinc/39/07/11/1015390711.db2.gz POWDWVBPAHFRIX-OAHLLOKOSA-N 1 0 333.432 3.600 20 5 EHBDRO CC(=O)c1ccc2c(c1)CCN(Cc1ccc([N+](=O)[O-])cc1F)CC2 ZINC000339623035 1015399980 /nfs/dbraw/zinc/39/99/80/1015399980.db2.gz MJJWWENXFUIIIT-UHFFFAOYSA-N 1 0 342.370 3.537 20 5 EHBDRO CC(=O)Nc1ccccc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C(C)C ZINC000154466158 1015467800 /nfs/dbraw/zinc/46/78/00/1015467800.db2.gz DFZOWWQMCFGSSR-UHFFFAOYSA-N 1 0 341.411 3.964 20 5 EHBDRO CC[C@@H](C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000536680284 1032122867 /nfs/dbraw/zinc/12/28/67/1032122867.db2.gz LMBDJUNXJWBDFN-RDJZCZTQSA-N 1 0 340.427 3.670 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(CC[NH+](C)C)cc1 ZINC000449051412 1032127101 /nfs/dbraw/zinc/12/71/01/1032127101.db2.gz ACVQFAAYKICCAU-HNNXBMFYSA-N 1 0 327.428 3.742 20 5 EHBDRO CCOc1cc(NC[C@@H](c2ccc(F)cc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471252406 1016130287 /nfs/dbraw/zinc/13/02/87/1016130287.db2.gz YGVQEQWFLDLHFB-KRWDZBQOSA-N 1 0 347.390 3.847 20 5 EHBDRO CC(C)c1ccc(C(=O)NC2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000189073029 1016432735 /nfs/dbraw/zinc/43/27/35/1016432735.db2.gz NUGMLRTWLZGOHK-UHFFFAOYSA-N 1 0 347.459 3.711 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000247187988 1016917382 /nfs/dbraw/zinc/91/73/82/1016917382.db2.gz UHDQDNICDCNOQF-UMPGKWJCSA-N 1 0 338.473 3.634 20 5 EHBDRO C[C@@H]1C[C@H](O)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000414518981 1016949008 /nfs/dbraw/zinc/94/90/08/1016949008.db2.gz AOXISIZVLJZIQL-OLZOCXBDSA-N 1 0 332.425 3.526 20 5 EHBDRO COC1([C@H](C)[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC1 ZINC000414527725 1016953598 /nfs/dbraw/zinc/95/35/98/1016953598.db2.gz RLDWLLUCJCHCCT-ZDUSSCGKSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@H]1CC(C)(C)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000414524725 1016954567 /nfs/dbraw/zinc/95/45/67/1016954567.db2.gz KYXLJTZCSCXDEZ-ZDUSSCGKSA-N 1 0 328.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@@H](CO)C3)s2)cc1 ZINC000414565733 1016979183 /nfs/dbraw/zinc/97/91/83/1016979183.db2.gz FJIDHPSXMYAOHN-HIFRSBDPSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc2c(c1)OCO2 ZINC000449076959 1032166659 /nfs/dbraw/zinc/16/66/59/1032166659.db2.gz VGGXZZYRFXFRQO-QWHCGFSZSA-N 1 0 328.368 3.605 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2CCC(OC3CCCC3)CC2)cc1 ZINC000449129819 1032224551 /nfs/dbraw/zinc/22/45/51/1032224551.db2.gz DPVOUQJITFUIAS-UHFFFAOYSA-N 1 0 332.444 3.997 20 5 EHBDRO CCc1ccc([C@@H](COC)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449152787 1032254966 /nfs/dbraw/zinc/25/49/66/1032254966.db2.gz HFUYDTHQZZSBAY-CZUORRHYSA-N 1 0 332.400 3.659 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)CC2CCCCC2)cc1[N+](=O)[O-] ZINC000538276621 1032264769 /nfs/dbraw/zinc/26/47/69/1032264769.db2.gz KZFJUFYQQWDBAX-HNNXBMFYSA-N 1 0 347.459 3.593 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCCO)c1ccccc1 ZINC000449162839 1032279053 /nfs/dbraw/zinc/27/90/53/1032279053.db2.gz UGKSJSHBTNVALU-CRAIPNDOSA-N 1 0 328.412 3.629 20 5 EHBDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000459632630 1032349003 /nfs/dbraw/zinc/34/90/03/1032349003.db2.gz LZCICJWBNLJSMA-AKAXFMLLSA-N 1 0 347.440 3.764 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCOc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000536860357 1032358609 /nfs/dbraw/zinc/35/86/09/1032358609.db2.gz XJCCIVDPWFGYOW-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO C[NH2+]Cc1cccc(NCc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000414868116 1017259770 /nfs/dbraw/zinc/25/97/70/1017259770.db2.gz OUWHKSBMASBTRZ-UHFFFAOYSA-N 1 0 337.326 3.528 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H]2CCN(c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000602003371 1032589884 /nfs/dbraw/zinc/58/98/84/1032589884.db2.gz JDYHSUBATLWAJD-INIZCTEOSA-N 1 0 325.412 3.519 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000537294344 1032601699 /nfs/dbraw/zinc/60/16/99/1032601699.db2.gz BYGGQXXMFWMQOL-IEODJVTJSA-N 1 0 343.427 3.874 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000449494100 1032658773 /nfs/dbraw/zinc/65/87/73/1032658773.db2.gz GFXIFHWQHFFRBN-CXAGYDPISA-N 1 0 330.384 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN(C2CC2)[C@@H]2CC[NH2+]C2)s1 ZINC000414659167 1017107075 /nfs/dbraw/zinc/10/70/75/1017107075.db2.gz KOUMKYDRFCTMNM-CQSZACIVSA-N 1 0 343.452 3.650 20 5 EHBDRO C[C@@H]([NH3+])[C@@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014166 1017409661 /nfs/dbraw/zinc/40/96/61/1017409661.db2.gz LOHVRPDQLHDFHK-VXGBXAGGSA-N 1 0 349.818 3.866 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2cccnc2[N+](=O)[O-])[C@@H]1c1cccs1 ZINC000610281279 1017607146 /nfs/dbraw/zinc/60/71/46/1017607146.db2.gz AHSLAZZDVOFQIO-SWLSCSKDSA-N 1 0 332.429 3.546 20 5 EHBDRO CCC[C@@H]([NH2+]C1CCN(C(=O)OCC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000120176068 1017706749 /nfs/dbraw/zinc/70/67/49/1017706749.db2.gz INGZQSHZCZEOSM-QGZVFWFLSA-N 1 0 349.431 3.647 20 5 EHBDRO O=[N+]([O-])c1cc(Nc2ccc(CC[NH+]3CCCC3)cc2)ccc1[O-] ZINC001210400840 1017957768 /nfs/dbraw/zinc/95/77/68/1017957768.db2.gz MIPFZJVIHKXPOY-UHFFFAOYSA-N 1 0 327.384 3.682 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@](C)(CO)c2ccccc2)cc1[N+](=O)[O-] ZINC000236660106 1017980124 /nfs/dbraw/zinc/98/01/24/1017980124.db2.gz GAOHIJDTTSCGJD-LJQANCHMSA-N 1 0 328.412 3.716 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)N[C@H](CCC[NH3+])c1ccccc1 ZINC000415509742 1018117849 /nfs/dbraw/zinc/11/78/49/1018117849.db2.gz XDLBEIKJHQHENX-QGZVFWFLSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCc3nc[nH]c3C2)c2ccccc2)c1 ZINC000377799748 1018394253 /nfs/dbraw/zinc/39/42/53/1018394253.db2.gz YWSRMZCRZGKJLG-OXQOHEQNSA-N 1 0 348.406 3.554 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099340 1018470306 /nfs/dbraw/zinc/47/03/06/1018470306.db2.gz LPSCNUHECWEEGT-STQMWFEESA-N 1 0 330.384 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CC[C@@H](Cc4ccccc4)C3)nc2c1 ZINC000083211417 1018547818 /nfs/dbraw/zinc/54/78/18/1018547818.db2.gz KTFFUEFGBXOICH-HNNXBMFYSA-N 1 0 337.379 3.801 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+][C@@H]1CCCc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000365738211 1018620673 /nfs/dbraw/zinc/62/06/73/1018620673.db2.gz RRIMYWVMTNRJSQ-CRAIPNDOSA-N 1 0 340.427 3.644 20 5 EHBDRO C[C@@]1(CNCc2csc([N+](=O)[O-])c2)CCC[N@@H+]1Cc1ccccc1 ZINC000397985404 1018944929 /nfs/dbraw/zinc/94/49/29/1018944929.db2.gz NWFNCCJADAFZNU-SFHVURJKSA-N 1 0 345.468 3.801 20 5 EHBDRO CC(C)[C@H](C[N@H+](C)Cc1ccccc1)Nc1ccc([N+](=O)[O-])cn1 ZINC000398004827 1018950205 /nfs/dbraw/zinc/95/02/05/1018950205.db2.gz AMIFQUGJTKUNFV-KRWDZBQOSA-N 1 0 328.416 3.558 20 5 EHBDRO CC[C@H](N[C@@H](C)c1ccccc1[N+](=O)[O-])c1nnc2n1CCCCC2 ZINC000610420483 1019022092 /nfs/dbraw/zinc/02/20/92/1019022092.db2.gz VCLSYLOLPCMMRS-ZFWWWQNUSA-N 1 0 343.431 3.715 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+][C@H]2C[C@@H]2C2CCCCC2)n1 ZINC000447586429 1019353289 /nfs/dbraw/zinc/35/32/89/1019353289.db2.gz NTUREXGMFUQJFW-LTIDMASMSA-N 1 0 332.448 3.833 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](n3ncc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000513414835 1019646570 /nfs/dbraw/zinc/64/65/70/1019646570.db2.gz PJRGSOKSXPKDGE-KRWDZBQOSA-N 1 0 336.395 3.700 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN[C@@H]2CC[NH2+]C23CCCC3)o1 ZINC000592439078 1032844476 /nfs/dbraw/zinc/84/44/76/1032844476.db2.gz ZPVPKKZTRBYGOS-GOSISDBHSA-N 1 0 341.411 3.619 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2ccccc2)CCN1Cc1ccc([N+](=O)[O-])cc1 ZINC000610452222 1019834797 /nfs/dbraw/zinc/83/47/97/1019834797.db2.gz YRUMEWZXMUFDBU-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000594042784 1032864391 /nfs/dbraw/zinc/86/43/91/1032864391.db2.gz DQOCIZNCNFRMRH-GFCCVEGCSA-N 1 0 328.359 3.777 20 5 EHBDRO CCC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000610476499 1020415396 /nfs/dbraw/zinc/41/53/96/1020415396.db2.gz WIKVCDAYICLDAS-DJIMGWMZSA-N 1 0 336.407 3.759 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)c1OC ZINC000513698147 1020489028 /nfs/dbraw/zinc/48/90/28/1020489028.db2.gz XEBSBVIHDMIFCG-CYBMUJFWSA-N 1 0 344.411 3.641 20 5 EHBDRO Cc1ccncc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000280584643 1020511189 /nfs/dbraw/zinc/51/11/89/1020511189.db2.gz MTBTTWBXMLTULP-UHFFFAOYSA-N 1 0 325.290 3.607 20 5 EHBDRO COC(=O)C[C@@H]1CC[C@H]([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)[C@@H]1C ZINC000280660048 1020551761 /nfs/dbraw/zinc/55/17/61/1020551761.db2.gz BMAJPMZNGJLGHY-NYTXWWLZSA-N 1 0 334.416 3.532 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413089404 1020664956 /nfs/dbraw/zinc/66/49/56/1020664956.db2.gz BISQKMVJRSZSLM-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403170 1020767610 /nfs/dbraw/zinc/76/76/10/1020767610.db2.gz UDIOURXSBPUGRQ-KBXCAEBGSA-N 1 0 336.395 3.953 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3ccc(O)cc3)CC2)cc1F ZINC000276323884 1021039772 /nfs/dbraw/zinc/03/97/72/1021039772.db2.gz PGXFLFOPSWEVQD-UHFFFAOYSA-N 1 0 330.359 3.819 20 5 EHBDRO CCCC(=O)Nc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602513169 1032951622 /nfs/dbraw/zinc/95/16/22/1032951622.db2.gz DIAHIZQAEQVVLJ-UHFFFAOYSA-N 1 0 341.411 3.666 20 5 EHBDRO COc1ccc(C[NH2+]C2CCC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000337325496 1021396632 /nfs/dbraw/zinc/39/66/32/1021396632.db2.gz ASKGFMYYKOCRQO-UHFFFAOYSA-N 1 0 342.395 3.825 20 5 EHBDRO CC[C@@H](C)[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000507676154 1021435920 /nfs/dbraw/zinc/43/59/20/1021435920.db2.gz DKYSVARXSWAXGG-OAHLLOKOSA-N 1 0 341.411 3.834 20 5 EHBDRO Cc1c(C[N@@H+]2CCCN3c4ccccc4C[C@H]3C2)cccc1[N+](=O)[O-] ZINC000516514787 1021506752 /nfs/dbraw/zinc/50/67/52/1021506752.db2.gz CLAIPALGZWCTBC-SFHVURJKSA-N 1 0 337.423 3.540 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602574501 1032984864 /nfs/dbraw/zinc/98/48/64/1032984864.db2.gz ABOZJFJLSULTSV-GFCCVEGCSA-N 1 0 332.322 3.661 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])c1nccs1 ZINC000602614530 1033008104 /nfs/dbraw/zinc/00/81/04/1033008104.db2.gz SNNBLVHNYAAQCL-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@]2(C)CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402325 1022076879 /nfs/dbraw/zinc/07/68/79/1022076879.db2.gz HLDLIRTTZUEUNM-MOPGFXCFSA-N 1 0 344.411 3.856 20 5 EHBDRO CC(C)[N@H+](Cc1cn(C)nc1C1CC1)Cc1ccc([N+](=O)[O-])cc1 ZINC000891626179 1022146608 /nfs/dbraw/zinc/14/66/08/1022146608.db2.gz UTPKGMMXDBTJCI-UHFFFAOYSA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(Cl)s1 ZINC000178206007 1022146893 /nfs/dbraw/zinc/14/68/93/1022146893.db2.gz CTOIPTDTYSEIAT-SECBINFHSA-N 1 0 339.804 3.599 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN(C)CC[C@H]1CCCC[N@@H+]1C ZINC000441346945 1022182381 /nfs/dbraw/zinc/18/23/81/1022182381.db2.gz BRNRPOWJYGURFH-QGZVFWFLSA-N 1 0 349.475 3.688 20 5 EHBDRO CO[C@@H](C)[C@@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000517265023 1022194517 /nfs/dbraw/zinc/19/45/17/1022194517.db2.gz HTKMHPUDVUPJDZ-CABCVRRESA-N 1 0 343.427 3.876 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCC[C@@H]3CCOC3)o2)cc1 ZINC000449684256 1033039410 /nfs/dbraw/zinc/03/94/10/1033039410.db2.gz OWPSPCNHNYORBG-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000276702659 1022340232 /nfs/dbraw/zinc/34/02/32/1022340232.db2.gz XRUDCCGWCUSTBK-MRXNPFEDSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]CCCCOc1ccccc1 ZINC000437770157 1022420279 /nfs/dbraw/zinc/42/02/79/1022420279.db2.gz CFHLEYJYAOSWRY-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)c1cccs1 ZINC000237160559 1022424232 /nfs/dbraw/zinc/42/42/32/1022424232.db2.gz AFLQVYQMXXCUOT-AWEZNQCLSA-N 1 0 339.848 3.702 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)Cc1cccc([N+](=O)[O-])c1C ZINC000441425850 1022476118 /nfs/dbraw/zinc/47/61/18/1022476118.db2.gz BTLOVOUEIOEITA-CQSZACIVSA-N 1 0 328.412 3.975 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000602658928 1033060004 /nfs/dbraw/zinc/06/00/04/1033060004.db2.gz ZHVCTQMCDFRJND-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccccc2N(C)C(C)C)cc1[N+](=O)[O-] ZINC000438321745 1022562642 /nfs/dbraw/zinc/56/26/42/1022562642.db2.gz BGBNALZTYNQSES-UHFFFAOYSA-N 1 0 343.427 3.738 20 5 EHBDRO CC(C)Oc1cccc([C@H](O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000266813201 1022696228 /nfs/dbraw/zinc/69/62/28/1022696228.db2.gz WTCNAEHHAMCVKG-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1(C)C ZINC000602683533 1033082199 /nfs/dbraw/zinc/08/21/99/1033082199.db2.gz CUHSZNJHPLOGEY-AWEZNQCLSA-N 1 0 346.349 3.861 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCC[C@@H]1CCOC1 ZINC000602683276 1033083407 /nfs/dbraw/zinc/08/34/07/1033083407.db2.gz WDRYVTDVNZZDKL-LLVKDONJSA-N 1 0 332.322 3.520 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@]2(CCOC2)C1 ZINC000602682749 1033082969 /nfs/dbraw/zinc/08/29/69/1033082969.db2.gz RNNKQQLUYIBZMA-HNNXBMFYSA-N 1 0 344.333 3.616 20 5 EHBDRO C[C@@H]1[NH2+]CCC[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414955588 1023014844 /nfs/dbraw/zinc/01/48/44/1023014844.db2.gz OQSFDPWBSAXJOH-ZBEGNZNMSA-N 1 0 349.818 3.738 20 5 EHBDRO C[C@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)[C@H]1Oc2ccccc2[C@@H]1C ZINC000509578311 1023075707 /nfs/dbraw/zinc/07/57/07/1023075707.db2.gz HFKSEQCLGDTGAR-FHGNATFXSA-N 1 0 348.349 3.916 20 5 EHBDRO COc1cc(C[NH+]2CCC3(CC3)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000611177424 1023117576 /nfs/dbraw/zinc/11/75/76/1023117576.db2.gz KCJSGKXPTKZARG-UHFFFAOYSA-N 1 0 342.342 3.581 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](O)C[C@H]1c1ccccc1 ZINC000602729764 1033117762 /nfs/dbraw/zinc/11/77/62/1033117762.db2.gz CLMOGNKHTAMATJ-OALUTQOASA-N 1 0 326.396 3.601 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@@H]2CCCC[C@H]21 ZINC000248417904 1023260781 /nfs/dbraw/zinc/26/07/81/1023260781.db2.gz JXUAFBHIIUQWAD-UHOFOFEASA-N 1 0 342.399 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H](O)C2CCC2)s1 ZINC000449738813 1033139187 /nfs/dbraw/zinc/13/91/87/1033139187.db2.gz FWSRKCLJCUKZGL-INIZCTEOSA-N 1 0 332.425 3.574 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccccc3OC2)cc1[N+](=O)[O-] ZINC000510982828 1023547809 /nfs/dbraw/zinc/54/78/09/1023547809.db2.gz GPZIZXZDTXNISG-PBHICJAKSA-N 1 0 326.396 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C3C[C@H]4CC[C@@H](C3)S4)CC2)cc1 ZINC000897748980 1033148646 /nfs/dbraw/zinc/14/86/46/1033148646.db2.gz NPGZMPBFBXPCIK-DODVFSASSA-N 1 0 347.484 3.580 20 5 EHBDRO CCC1(CC)[C@H](OC)C[C@H]1[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000610845667 1023788533 /nfs/dbraw/zinc/78/85/33/1023788533.db2.gz DASJTARBDBJUOD-HZPDHXFCSA-N 1 0 347.415 3.762 20 5 EHBDRO C[C@H]1CC2(CC([NH2+]Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)CO1 ZINC000897781190 1033174273 /nfs/dbraw/zinc/17/42/73/1033174273.db2.gz SCASZPBGOSFDIT-CDJWAVJASA-N 1 0 342.395 3.902 20 5 EHBDRO Cn1cc(C[NH2+][C@H](CC(C)(C)C)c2ccc(F)cc2)c([N+](=O)[O-])n1 ZINC000602802208 1033175588 /nfs/dbraw/zinc/17/55/88/1033175588.db2.gz PTIAOUQZOOWOMB-OAHLLOKOSA-N 1 0 334.395 3.735 20 5 EHBDRO CC1=NO[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000895311296 1024269551 /nfs/dbraw/zinc/26/95/51/1024269551.db2.gz ONSLNTSNSVIMHX-GFCCVEGCSA-N 1 0 331.397 3.578 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CC2(CCCC2)[C@@H]1c1ccccc1 ZINC000602838731 1033199112 /nfs/dbraw/zinc/19/91/12/1033199112.db2.gz BPCPRJVHMYXZSY-SFHVURJKSA-N 1 0 340.427 3.717 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641874 1024301013 /nfs/dbraw/zinc/30/10/13/1024301013.db2.gz MRWWXEVIYQOYGL-KBPBESRZSA-N 1 0 333.432 3.600 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C[C@@H]2[C@@H](c3ccccc3)C2(F)F)cc1 ZINC000896887053 1024344163 /nfs/dbraw/zinc/34/41/63/1024344163.db2.gz GNHMNEMCIXTFIQ-IAGOWNOFSA-N 1 0 332.350 3.776 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000320438311 1024437001 /nfs/dbraw/zinc/43/70/01/1024437001.db2.gz CKOPMACPUULORS-LLVKDONJSA-N 1 0 331.338 3.756 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000277291279 1024477945 /nfs/dbraw/zinc/47/79/45/1024477945.db2.gz ZOCPCMBHZZKRAZ-NSHDSACASA-N 1 0 331.338 3.534 20 5 EHBDRO CC(C)([NH2+]Cc1cccc2c1CCOC2)c1ccccc1[N+](=O)[O-] ZINC000602841607 1033216082 /nfs/dbraw/zinc/21/60/82/1033216082.db2.gz RMMVRNJAEPCRNJ-UHFFFAOYSA-N 1 0 326.396 3.692 20 5 EHBDRO Cn1cc(C[NH2+][C@@H]2CCC(C)(C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000346220808 1024534233 /nfs/dbraw/zinc/53/42/33/1024534233.db2.gz KIJXENRPVOTZHV-OAHLLOKOSA-N 1 0 328.416 3.664 20 5 EHBDRO CCOC(=O)C[C@H](C)[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000346336821 1024659743 /nfs/dbraw/zinc/65/97/43/1024659743.db2.gz PQOGFGFSHPKIHY-ZDUSSCGKSA-N 1 0 346.383 3.628 20 5 EHBDRO C[C@@H]([NH2+]CCCc1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000539063138 1024727919 /nfs/dbraw/zinc/72/79/19/1024727919.db2.gz TURZEKZNTJCPIH-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602887554 1033236688 /nfs/dbraw/zinc/23/66/88/1033236688.db2.gz NUJDRFXTUXIEIC-KRWDZBQOSA-N 1 0 348.406 3.570 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H]([C@H]2CCCO2)C1 ZINC000895844050 1024890706 /nfs/dbraw/zinc/89/07/06/1024890706.db2.gz LOBOKPPTPOVYLV-IUODEOHRSA-N 1 0 344.333 3.615 20 5 EHBDRO C[C@@H](CCO)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000449355563 1025072100 /nfs/dbraw/zinc/07/21/00/1025072100.db2.gz AUBXWDBKHNFTTR-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@]2(CC(F)(F)C2(F)F)C1 ZINC000896227658 1025261644 /nfs/dbraw/zinc/26/16/44/1025261644.db2.gz NUNQXHYFWUEOTB-KQIUPUNMSA-N 1 0 344.308 3.974 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccnn1-c1ccccc1 ZINC000467340213 1025327706 /nfs/dbraw/zinc/32/77/06/1025327706.db2.gz DUZHCPPROLTCOY-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCCN(Cc3c(F)cccc3F)C2)cc1 ZINC000521372294 1025349391 /nfs/dbraw/zinc/34/93/91/1025349391.db2.gz GTBHNPMEKVBPHV-AWEZNQCLSA-N 1 0 347.365 3.950 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cccc(N2CCC2=O)c1)c1cccc([N+](=O)[O-])c1 ZINC000442823363 1025501952 /nfs/dbraw/zinc/50/19/52/1025501952.db2.gz ZVRFLALWLRJAEJ-GOSISDBHSA-N 1 0 339.395 3.572 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)C1CCCCC1 ZINC000451100840 1025562042 /nfs/dbraw/zinc/56/20/42/1025562042.db2.gz YKDXNRQGHYFRRL-LSDHHAIUSA-N 1 0 347.459 3.815 20 5 EHBDRO Cc1nc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000347155928 1025590773 /nfs/dbraw/zinc/59/07/73/1025590773.db2.gz RCXFZZCIGLBWIU-INIZCTEOSA-N 1 0 331.441 3.513 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](c3ncc4n3CCCC4)C2)c1 ZINC000281881090 1025632416 /nfs/dbraw/zinc/63/24/16/1025632416.db2.gz AJDVYKRUQGYTBW-MRXNPFEDSA-N 1 0 340.427 3.507 20 5 EHBDRO CC[C@H]([NH2+]CCOc1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000358007798 1025659964 /nfs/dbraw/zinc/65/99/64/1025659964.db2.gz RTUKXKZOTBSOII-SFHVURJKSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000425557013 1025725667 /nfs/dbraw/zinc/72/56/67/1025725667.db2.gz VNOWHFQQZBIYKM-KSSFIOAISA-N 1 0 330.428 3.937 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730849 1025916899 /nfs/dbraw/zinc/91/68/99/1025916899.db2.gz QXGRHFSAPVHZKC-CXAGYDPISA-N 1 0 334.416 3.862 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cc(F)cc([N+](=O)[O-])c2)cc1 ZINC000338267068 1025992541 /nfs/dbraw/zinc/99/25/41/1025992541.db2.gz AAHUBEOUVKLCFD-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478328259 1026068120 /nfs/dbraw/zinc/06/81/20/1026068120.db2.gz PCWOAYNCGHODCG-DIFFPNOSSA-N 1 0 336.338 3.739 20 5 EHBDRO CCO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000451549067 1026097091 /nfs/dbraw/zinc/09/70/91/1026097091.db2.gz VTWDQYHDNCRGML-RHSMWYFYSA-N 1 0 336.432 3.629 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000451552604 1026104031 /nfs/dbraw/zinc/10/40/31/1026104031.db2.gz WPZVSABDOJLQPZ-GOSISDBHSA-N 1 0 325.412 3.986 20 5 EHBDRO C[C@@H]1C[C@H](C)CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000127629343 1026195901 /nfs/dbraw/zinc/19/59/01/1026195901.db2.gz GHVULNVRYMBPBZ-CHWSQXEVSA-N 1 0 330.388 3.513 20 5 EHBDRO CSc1cccc(C(=O)Nc2cccc(C[NH+](C)C)c2)c1[N+](=O)[O-] ZINC000186133248 1026256201 /nfs/dbraw/zinc/25/62/01/1026256201.db2.gz WVJGIOBXZSTFFQ-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO COc1ccc(C[NH2+]Cc2c(C)c3ccccc3n2C)cc1[N+](=O)[O-] ZINC000475199806 1026379539 /nfs/dbraw/zinc/37/95/39/1026379539.db2.gz XKYLHNIIOWSHLR-UHFFFAOYSA-N 1 0 339.395 3.693 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000530901688 1026386564 /nfs/dbraw/zinc/38/65/64/1026386564.db2.gz QALZDDPMZPDKGL-NVXWUHKLSA-N 1 0 349.475 3.687 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]C2(Cc3ccccc3)CCOCC2)cc1 ZINC000451940485 1026388978 /nfs/dbraw/zinc/38/89/78/1026388978.db2.gz LVARQSRKTNSPGF-UHFFFAOYSA-N 1 0 340.423 3.519 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)cc1[N+](=O)[O-] ZINC000530974897 1026449381 /nfs/dbraw/zinc/44/93/81/1026449381.db2.gz KWUWBEAFNYNQDY-XEKQOVJPSA-N 1 0 342.395 3.646 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1 ZINC000452096757 1026475085 /nfs/dbraw/zinc/47/50/85/1026475085.db2.gz XMIYLXIBGQRBKS-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@H+](Cc2ccc(F)cc2)C2CCCCC2)c1 ZINC000531103700 1026572977 /nfs/dbraw/zinc/57/29/77/1026572977.db2.gz DMVFSCCQOLAKFY-UHFFFAOYSA-N 1 0 346.406 3.765 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000479581126 1026709914 /nfs/dbraw/zinc/70/99/14/1026709914.db2.gz RGBALOZMLPGJPE-CVEARBPZSA-N 1 0 326.824 3.932 20 5 EHBDRO Cc1cnc(NC2CC[NH+](Cc3ccccc3C)CC2)c([N+](=O)[O-])c1 ZINC000301444928 1026809481 /nfs/dbraw/zinc/80/94/81/1026809481.db2.gz NSFBREJICZYZAV-UHFFFAOYSA-N 1 0 340.427 3.683 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](CO)Cc2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000531696896 1027216467 /nfs/dbraw/zinc/21/64/67/1027216467.db2.gz JLYDSVZCHPDLGE-HOCLYGCPSA-N 1 0 346.402 3.544 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)CC[C@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000237573889 1027369352 /nfs/dbraw/zinc/36/93/52/1027369352.db2.gz HTGICRXFOQBYEK-PBHICJAKSA-N 1 0 341.411 3.561 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCc3ccc(O)cc3CC2)c(Cl)c1 ZINC000611791082 1027442610 /nfs/dbraw/zinc/44/26/10/1027442610.db2.gz RTDGIGJWRMRZDU-UHFFFAOYSA-N 1 0 332.787 3.555 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(CNc3[nH+]ccn3C3CC3)cs2)c1 ZINC000840887618 1027484497 /nfs/dbraw/zinc/48/44/97/1027484497.db2.gz QHNUZWJGJZPTAB-UHFFFAOYSA-N 1 0 341.396 3.862 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)ccc1OC ZINC000178656381 1027613617 /nfs/dbraw/zinc/61/36/17/1027613617.db2.gz VFVLEBARVDRYCC-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000501899954 1027629576 /nfs/dbraw/zinc/62/95/76/1027629576.db2.gz PJZDRZUPGAQQQB-CQSZACIVSA-N 1 0 333.432 3.682 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCN(Cc3ccccc3)[C@@H]2C)cc1[N+](=O)[O-] ZINC000310751866 1027766391 /nfs/dbraw/zinc/76/63/91/1027766391.db2.gz INFZEXCXLRFDRJ-APWZRJJASA-N 1 0 339.439 3.656 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1nccc2c1cccc2[N+](=O)[O-] ZINC001167624280 1027899432 /nfs/dbraw/zinc/89/94/32/1027899432.db2.gz RQYCPPHAPMRYAZ-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)c2ccccc2C)cc1[N+](=O)[O-] ZINC000536626012 1028012335 /nfs/dbraw/zinc/01/23/35/1028012335.db2.gz VKRQGEBONFBZQA-RHSMWYFYSA-N 1 0 344.411 3.686 20 5 EHBDRO CC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC1CCC1 ZINC000355608526 1028087598 /nfs/dbraw/zinc/08/75/98/1028087598.db2.gz QAMAXSMPKDQQOU-UHFFFAOYSA-N 1 0 344.358 3.827 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444688456 1028161568 /nfs/dbraw/zinc/16/15/68/1028161568.db2.gz YVMPQLJLIXBEQM-GFCCVEGCSA-N 1 0 330.310 3.538 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCCOC1 ZINC000503942118 1028247818 /nfs/dbraw/zinc/24/78/18/1028247818.db2.gz BOCVFLXNXOBZMN-ZFWWWQNUSA-N 1 0 330.384 3.760 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@H](O)CC34CCC4)o2)cc1 ZINC000421376087 1028336527 /nfs/dbraw/zinc/33/65/27/1028336527.db2.gz RDGHAOPTQZAEHM-INIZCTEOSA-N 1 0 342.395 3.734 20 5 EHBDRO CCc1ccc([C@H](N[C@H]2CCC[C@@H]([NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423375036 1028413144 /nfs/dbraw/zinc/41/31/44/1028413144.db2.gz IPIWAEXTGNMUPC-ZRGWGRIASA-N 1 0 343.427 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cc(C)cc(N)c2)cc1[N+](=O)[O-] ZINC000423481282 1028464111 /nfs/dbraw/zinc/46/41/11/1028464111.db2.gz QCUJPLJDORDYOA-ZDUSSCGKSA-N 1 0 329.400 3.735 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CC[C@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513803 1028490031 /nfs/dbraw/zinc/49/00/31/1028490031.db2.gz RNQSIBIAACHOPK-ZBQZNYHESA-N 1 0 343.427 3.557 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673267 1028555980 /nfs/dbraw/zinc/55/59/80/1028555980.db2.gz KOEJXIZSDLLPNI-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc([N+](=O)[O-])c2ncccc12 ZINC000324831817 1028692732 /nfs/dbraw/zinc/69/27/32/1028692732.db2.gz CGGCNELQSNNSOE-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)Nc3cccc([N+](=O)[O-])c3)ccc21 ZINC000454315254 1028755521 /nfs/dbraw/zinc/75/55/21/1028755521.db2.gz HTOPCEJEDVCDJC-KRWDZBQOSA-N 1 0 340.383 3.788 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)CC1CCCCC1 ZINC000532755501 1028799526 /nfs/dbraw/zinc/79/95/26/1028799526.db2.gz LHSPHZJLBHEIMY-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3cccnc3CC2)cc1[N+](=O)[O-] ZINC000421832678 1028823013 /nfs/dbraw/zinc/82/30/13/1028823013.db2.gz GRJDGCMMPFMPJI-YOEHRIQHSA-N 1 0 325.412 3.896 20 5 EHBDRO Cc1ccc(CN2C[C@H](c3ccccc3)OC[C@@H]2C)cc1[N+](=O)[O-] ZINC000513761748 1029006097 /nfs/dbraw/zinc/00/60/97/1029006097.db2.gz OEVMLIBODNLMKU-HNAYVOBHSA-N 1 0 326.396 3.865 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@@H](C)N(C2CC2)C1 ZINC000504893859 1029038873 /nfs/dbraw/zinc/03/88/73/1029038873.db2.gz IQTMABBXSOMICH-RBSFLKMASA-N 1 0 349.500 3.680 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000186732012 1029048340 /nfs/dbraw/zinc/04/83/40/1029048340.db2.gz YGJRJHUWAACWGL-RYUDHWBXSA-N 1 0 335.429 3.904 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000504905161 1029049874 /nfs/dbraw/zinc/04/98/74/1029049874.db2.gz DKXOBAINTIIVCP-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cccc(O)c1 ZINC000504912490 1029054600 /nfs/dbraw/zinc/05/46/00/1029054600.db2.gz WVZRRVQDRPXUMJ-AWEZNQCLSA-N 1 0 332.425 3.961 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC23CCC[NH+]2CCC3)cc1C(F)(F)F ZINC000343086604 1029076003 /nfs/dbraw/zinc/07/60/03/1029076003.db2.gz JOWUWPPVZDCRMO-UHFFFAOYSA-N 1 0 329.322 3.654 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCCC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000191850733 1029082825 /nfs/dbraw/zinc/08/28/25/1029082825.db2.gz PHEQYYDZBHDNQV-YGRLFVJLSA-N 1 0 339.823 3.744 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C[C@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000237388940 1029121782 /nfs/dbraw/zinc/12/17/82/1029121782.db2.gz OJVHXNQSEAXIIR-AWEZNQCLSA-N 1 0 346.452 3.772 20 5 EHBDRO COCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000508546392 1029227468 /nfs/dbraw/zinc/22/74/68/1029227468.db2.gz SFKNDULKOOCFFT-HNNXBMFYSA-N 1 0 344.411 3.813 20 5 EHBDRO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000524894992 1029587677 /nfs/dbraw/zinc/58/76/77/1029587677.db2.gz ZHDFBNKVZALTKC-JQHSSLGASA-N 1 0 332.444 3.929 20 5 EHBDRO CC[C@@H](CCO)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000524885157 1029593812 /nfs/dbraw/zinc/59/38/12/1029593812.db2.gz LCRHUMSXXXRMDK-INIZCTEOSA-N 1 0 343.427 3.613 20 5 EHBDRO CC[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000533298144 1029601282 /nfs/dbraw/zinc/60/12/82/1029601282.db2.gz IEDSIQOVQHSWRO-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO CC[C@]1(O)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000428446352 1029668416 /nfs/dbraw/zinc/66/84/16/1029668416.db2.gz JRXQKGJHJCIPBN-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000162952853 1029735991 /nfs/dbraw/zinc/73/59/91/1029735991.db2.gz PKXXTRZGILAMGH-PITYFXLSSA-N 1 0 338.473 3.715 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]CC=Cc3ccc(F)cc3F)nc2c1 ZINC000446837808 1029807071 /nfs/dbraw/zinc/80/70/71/1029807071.db2.gz AYLIPUDMORZZLF-OWOJBTEDSA-N 1 0 344.321 3.552 20 5 EHBDRO Cc1cccc(CC[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)c1 ZINC000446845716 1029825515 /nfs/dbraw/zinc/82/55/15/1029825515.db2.gz QDPBZCRRXAULEB-CQSZACIVSA-N 1 0 338.411 3.890 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+][C@H]1CCCc2occc21 ZINC000152250715 1029867995 /nfs/dbraw/zinc/86/79/95/1029867995.db2.gz NKGFMOUZDSTNGN-WBMJQRKESA-N 1 0 343.383 3.572 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ccc(F)cc1F)C1CC1 ZINC000481720386 1029891369 /nfs/dbraw/zinc/89/13/69/1029891369.db2.gz SNRCBXBJPIRGGZ-QGZVFWFLSA-N 1 0 332.350 3.984 20 5 EHBDRO COC[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000537626883 1029931635 /nfs/dbraw/zinc/93/16/35/1029931635.db2.gz HKLCSOQNMWRGGP-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000531868871 1029945274 /nfs/dbraw/zinc/94/52/74/1029945274.db2.gz NZYANAJHMQPGEZ-INIZCTEOSA-N 1 0 348.443 3.581 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@H](CC)c1cccc([N+](=O)[O-])c1 ZINC000453258971 1029990864 /nfs/dbraw/zinc/99/08/64/1029990864.db2.gz OLQCGVJUYYOPBC-TZMCWYRMSA-N 1 0 334.338 3.993 20 5 EHBDRO Cc1cccnc1CCC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453311280 1030083364 /nfs/dbraw/zinc/08/33/64/1030083364.db2.gz SGUIRUZWQDIBKG-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO Cc1nc(C[C@@H]2CCC[N@@H+]([C@H](C)c3cc([N+](=O)[O-])ccc3C)C2)no1 ZINC000245514439 1030110464 /nfs/dbraw/zinc/11/04/64/1030110464.db2.gz BWLNLPPWYBNUAD-HIFRSBDPSA-N 1 0 344.415 3.610 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCO[C@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000453340682 1030123957 /nfs/dbraw/zinc/12/39/57/1030123957.db2.gz HXMRYHUBEQEOPA-QOKNQOGYSA-N 1 0 341.411 3.869 20 5 EHBDRO [NH3+][C@H]1CCC[C@@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000567847678 1030143504 /nfs/dbraw/zinc/14/35/04/1030143504.db2.gz WMPDRKJYUUDALF-ZBFHGGJFSA-N 1 0 333.435 3.635 20 5 EHBDRO Cc1cnc(CCN(C)Cc2cc([N+](=O)[O-])ccc2Cl)c(C)c1 ZINC000828021166 1030197375 /nfs/dbraw/zinc/19/73/75/1030197375.db2.gz MLHLEGYUBQQWID-UHFFFAOYSA-N 1 0 333.819 3.935 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000441266383 1030216732 /nfs/dbraw/zinc/21/67/32/1030216732.db2.gz UJVYFWWKWVJMMM-QGZVFWFLSA-N 1 0 339.439 3.782 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000163239919 1030220726 /nfs/dbraw/zinc/22/07/26/1030220726.db2.gz GKSFSNBNEKGUKY-IUODEOHRSA-N 1 0 330.388 3.703 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cn1 ZINC000453392289 1030238806 /nfs/dbraw/zinc/23/88/06/1030238806.db2.gz YUHSVTUYBAVBNW-MPGHIAIKSA-N 1 0 342.443 3.873 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H]2CCCC[C@H]2OCC)cc1[N+](=O)[O-] ZINC000453396258 1030248551 /nfs/dbraw/zinc/24/85/51/1030248551.db2.gz HJXAQVHCTQBEMU-FRFSOERESA-N 1 0 336.432 3.992 20 5 EHBDRO CSc1ccc(C[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447533905 1030269359 /nfs/dbraw/zinc/26/93/59/1030269359.db2.gz ZFSYFYUYFVQDQE-HZPDHXFCSA-N 1 0 346.456 3.787 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447537333 1030274164 /nfs/dbraw/zinc/27/41/64/1030274164.db2.gz VANHMOLEEKTGSM-QZTJIDSGSA-N 1 0 342.443 3.724 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1ccncc1F ZINC000550819832 1030274379 /nfs/dbraw/zinc/27/43/79/1030274379.db2.gz RPTPTGYNBPBRLQ-NSHDSACASA-N 1 0 328.347 3.504 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000532034879 1030295016 /nfs/dbraw/zinc/29/50/16/1030295016.db2.gz VMXKDAFTLLDSOZ-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1c[nH]c3ncccc13)CCC2 ZINC000447588493 1030323756 /nfs/dbraw/zinc/32/37/56/1030323756.db2.gz UOPQFIPXRQTHAX-SFHVURJKSA-N 1 0 336.395 3.681 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccc(C3CC3)cc2)n1 ZINC000447603874 1030359160 /nfs/dbraw/zinc/35/91/60/1030359160.db2.gz ZDZWRZOLPJRPBJ-MSOLQXFVSA-N 1 0 340.427 3.942 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CCC[C@H](C)[C@@H]2C)cccc1[N+](=O)[O-] ZINC000042382463 1030383077 /nfs/dbraw/zinc/38/30/77/1030383077.db2.gz IHKGLNMGZZFVLM-NZBPQXDJSA-N 1 0 333.432 3.645 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C[N@@H+]1C1CC1 ZINC000583666505 1030394126 /nfs/dbraw/zinc/39/41/26/1030394126.db2.gz BXUPSIHINWMCBK-TZMCWYRMSA-N 1 0 333.432 3.809 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000532210597 1030481676 /nfs/dbraw/zinc/48/16/76/1030481676.db2.gz HIBGJRWMLJVOTB-GJZGRUSLSA-N 1 0 325.412 3.697 20 5 EHBDRO COc1cccc(NC[C@H](c2cccs2)[NH+]2CCCC2)c1[N+](=O)[O-] ZINC000548117152 1030482596 /nfs/dbraw/zinc/48/25/96/1030482596.db2.gz MJBSJNHHGBENLR-CQSZACIVSA-N 1 0 347.440 3.914 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H]1C[C@H](C)O ZINC000447836902 1030527292 /nfs/dbraw/zinc/52/72/92/1030527292.db2.gz YOVHCEZXVBRMQT-HOCLYGCPSA-N 1 0 336.432 3.507 20 5 EHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000192607422 1030750010 /nfs/dbraw/zinc/75/00/10/1030750010.db2.gz OSCIMSKGPUCKGO-SWLSCSKDSA-N 1 0 330.388 3.655 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000527286528 1030770839 /nfs/dbraw/zinc/77/08/39/1030770839.db2.gz NVVPFCRFNIAJMX-CKOFDZGGSA-N 1 0 337.423 3.774 20 5 EHBDRO Cc1nccnc1CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000550895076 1030777375 /nfs/dbraw/zinc/77/73/75/1030777375.db2.gz LLQLKZWMSDBBNK-HXUWFJFHSA-N 1 0 348.406 3.615 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nn(-c3ccccc3)cc2C[NH2+]CC2CC2)cc1 ZINC000237999020 1030812161 /nfs/dbraw/zinc/81/21/61/1030812161.db2.gz GUBKFBBADVCXNF-UHFFFAOYSA-N 1 0 348.406 3.947 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@@H]1CCC[C@@H]1O ZINC000537687568 1030981279 /nfs/dbraw/zinc/98/12/79/1030981279.db2.gz HYTDQOLQYIBJPM-YOEHRIQHSA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H]1CCC(C)(C)C1 ZINC000483126647 1030987577 /nfs/dbraw/zinc/98/75/77/1030987577.db2.gz VMJOASXJSAFZSE-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C(C)(C)C)C1 ZINC000483254979 1031066920 /nfs/dbraw/zinc/06/69/20/1031066920.db2.gz IWTQSZFLWAFKHE-KBPBESRZSA-N 1 0 333.432 3.680 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CCC(C[NH+]2CCCC2)CC1 ZINC000302809033 1031242468 /nfs/dbraw/zinc/24/24/68/1031242468.db2.gz GLVJZESWAAACCP-UHFFFAOYSA-N 1 0 337.851 3.869 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccccc1 ZINC000161105539 1031319754 /nfs/dbraw/zinc/31/97/54/1031319754.db2.gz MLFJRRVOBBDSCU-MAUKXSAKSA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000161106323 1031320332 /nfs/dbraw/zinc/32/03/32/1031320332.db2.gz GYZCGTFLIZJHIB-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO CCC[NH+](CCC)CCCNC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000551741432 1031620894 /nfs/dbraw/zinc/62/08/94/1031620894.db2.gz CKEYBYRECXVLQM-UHFFFAOYSA-N 1 0 336.436 3.537 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]2[C@H]2CCCO2)o1 ZINC000551826595 1031698365 /nfs/dbraw/zinc/69/83/65/1031698365.db2.gz NTAARYCJMYRPON-PKOBYXMFSA-N 1 0 342.395 3.998 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000584102630 1031735545 /nfs/dbraw/zinc/73/55/45/1031735545.db2.gz YUCZYGWHGHBBQX-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CN(C)Cc2ccccc21 ZINC000537950703 1032036602 /nfs/dbraw/zinc/03/66/02/1032036602.db2.gz JDKHDIVXJUXJAW-IFXJQAMLSA-N 1 0 325.412 3.741 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)cc1 ZINC000537952479 1032039453 /nfs/dbraw/zinc/03/94/53/1032039453.db2.gz HRXVENAVKWPPQG-OAHLLOKOSA-N 1 0 336.395 3.674 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(C)CCOCC1 ZINC000537955782 1032041604 /nfs/dbraw/zinc/04/16/04/1032041604.db2.gz LCGZEIXEZNGHGO-AWEZNQCLSA-N 1 0 338.473 3.872 20 5 EHBDRO CC(=O)c1ccc(NCCCC[N@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])c1 ZINC000076795347 1033329415 /nfs/dbraw/zinc/32/94/15/1033329415.db2.gz FNCRYHGHMMUQMJ-AWEZNQCLSA-N 1 0 333.432 3.864 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CS1 ZINC000594499439 1033402611 /nfs/dbraw/zinc/40/26/11/1033402611.db2.gz GWVUUBJEIMOQAA-SKDRFNHKSA-N 1 0 334.363 3.987 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)C(=O)OC(C)(C)C ZINC000594513096 1033418021 /nfs/dbraw/zinc/41/80/21/1033418021.db2.gz BDPQCLYWJIJMJC-KADHNRKRSA-N 1 0 334.416 3.566 20 5 EHBDRO Cc1nn(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)c2cc([N+](=O)[O-])ccc12 ZINC000761292789 1033555357 /nfs/dbraw/zinc/55/53/57/1033555357.db2.gz NEMYBXOUWMBCEA-WBVHZDCISA-N 1 0 346.456 3.570 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595022751 1033613524 /nfs/dbraw/zinc/61/35/24/1033613524.db2.gz VHVQLVXHSXLFLA-PXAZEXFGSA-N 1 0 342.395 3.950 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000594986228 1033619056 /nfs/dbraw/zinc/61/90/56/1033619056.db2.gz UMEVLBBIXNOVHE-MLGOLLRUSA-N 1 0 347.440 3.766 20 5 EHBDRO CC1(C)OCC[C@@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000594997130 1033624289 /nfs/dbraw/zinc/62/42/89/1033624289.db2.gz YBMMNICEOYVILJ-CQSZACIVSA-N 1 0 330.384 3.760 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(O)CCC(F)(F)CC1 ZINC000595000452 1033626782 /nfs/dbraw/zinc/62/67/82/1033626782.db2.gz MIWOGVYDOSMBLX-UKTHLTGXSA-N 1 0 340.370 3.528 20 5 EHBDRO CCC(CC)[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[NH+](C)C ZINC000603438473 1033629672 /nfs/dbraw/zinc/62/96/72/1033629672.db2.gz OXAPCPIVXBENGU-GOSISDBHSA-N 1 0 330.432 3.921 20 5 EHBDRO CCOCc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595008530 1033630160 /nfs/dbraw/zinc/63/01/60/1033630160.db2.gz UXUSVVRNYWFSAO-AWEZNQCLSA-N 1 0 344.411 3.991 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(OC)c1 ZINC000595064820 1033641731 /nfs/dbraw/zinc/64/17/31/1033641731.db2.gz BOLKJAHABDUSTA-UGSOOPFHSA-N 1 0 330.384 3.642 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000595070512 1033646609 /nfs/dbraw/zinc/64/66/09/1033646609.db2.gz VKQLYUDVQKKESE-FZKQIMNGSA-N 1 0 330.384 3.642 20 5 EHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595029584 1033651044 /nfs/dbraw/zinc/65/10/44/1033651044.db2.gz ZREGFAXQTFPQSW-CHWSQXEVSA-N 1 0 329.400 3.973 20 5 EHBDRO COC1([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCC1 ZINC000595037644 1033657577 /nfs/dbraw/zinc/65/75/77/1033657577.db2.gz BBGWIAVKEPMMHH-JTQLQIEISA-N 1 0 332.322 3.661 20 5 EHBDRO COC(=O)CC1CCC([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000599032496 1033660572 /nfs/dbraw/zinc/66/05/72/1033660572.db2.gz SJYSADDPEVSIAE-UHFFFAOYSA-N 1 0 348.443 3.629 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CC12CCSCC2 ZINC000595046444 1033663585 /nfs/dbraw/zinc/66/35/85/1033663585.db2.gz ZNDPIRPPDUHMIX-CHWSQXEVSA-N 1 0 336.457 3.787 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CC(OC)C1 ZINC000595051981 1033667721 /nfs/dbraw/zinc/66/77/21/1033667721.db2.gz ZOPOMSAAKANVJP-SHARSMKWSA-N 1 0 338.473 3.870 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2c(C3CCC3)cnn2C)cccc1[N+](=O)[O-] ZINC000595100047 1033689108 /nfs/dbraw/zinc/68/91/08/1033689108.db2.gz TTXUYTDYSCRGMP-ZDUSSCGKSA-N 1 0 328.416 3.755 20 5 EHBDRO Cc1ncccc1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000599072282 1033715315 /nfs/dbraw/zinc/71/53/15/1033715315.db2.gz AJGSJUHLTVGAGS-MAUKXSAKSA-N 1 0 325.412 3.799 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CO[C@@H](C3CC3)C2)c2ccccc2)c1 ZINC000599085126 1033724903 /nfs/dbraw/zinc/72/49/03/1033724903.db2.gz NEHJSEGGHLAPDA-DFQSSKMNSA-N 1 0 338.407 3.841 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000595426319 1033798929 /nfs/dbraw/zinc/79/89/29/1033798929.db2.gz SHKOEJUAOIZZSO-SFHVURJKSA-N 1 0 330.359 3.983 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1OCCc2sccc21 ZINC000595509001 1033837324 /nfs/dbraw/zinc/83/73/24/1033837324.db2.gz DRPYMXCBRWLUMM-HWPZZCPQSA-N 1 0 336.388 3.588 20 5 EHBDRO CC[N@@H+](Cc1cc(F)ccc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000174282476 1033878477 /nfs/dbraw/zinc/87/84/77/1033878477.db2.gz RYFIPTSNMVECOC-GOSISDBHSA-N 1 0 332.375 3.598 20 5 EHBDRO Cc1cc(N2CCC([NH2+]Cc3ccccc3)CC2)c(F)cc1[N+](=O)[O-] ZINC000596250615 1034135840 /nfs/dbraw/zinc/13/58/40/1034135840.db2.gz IPFWFAHGUQTEOI-UHFFFAOYSA-N 1 0 343.402 3.801 20 5 EHBDRO COc1cc(NC2CCC([NH+](C)C)CC2)c(Cl)cc1[N+](=O)[O-] ZINC000596278612 1034140086 /nfs/dbraw/zinc/14/00/86/1034140086.db2.gz RKUDVWKVIYIGLD-UHFFFAOYSA-N 1 0 327.812 3.542 20 5 EHBDRO CC(=O)c1ccc(N[C@@H]2CC[N@@H+](C3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000596478484 1034254043 /nfs/dbraw/zinc/25/40/43/1034254043.db2.gz NXAQIWDHYXDOJG-OAHLLOKOSA-N 1 0 331.416 3.616 20 5 EHBDRO C[C@@H](CC[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000604550256 1034409541 /nfs/dbraw/zinc/40/95/41/1034409541.db2.gz SNWWSSYWNOBVOE-AWEZNQCLSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@H](CC[NH2+]Cc1cc2c(cc1[N+](=O)[O-])OCCO2)c1ccccc1 ZINC000604550257 1034410024 /nfs/dbraw/zinc/41/00/24/1034410024.db2.gz SNWWSSYWNOBVOE-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CCCCO1 ZINC000612186116 1034430482 /nfs/dbraw/zinc/43/04/82/1034430482.db2.gz QLIUHENGZNCEIT-HNNXBMFYSA-N 1 0 326.824 3.933 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C1 ZINC000310496137 1034526599 /nfs/dbraw/zinc/52/65/99/1034526599.db2.gz GIQUYUQGCDHJDN-GJZGRUSLSA-N 1 0 349.431 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@](O)(C4CC4)C3)o2)cc1 ZINC000597205084 1034607626 /nfs/dbraw/zinc/60/76/26/1034607626.db2.gz LHWKUHZPPGUWMQ-LJQANCHMSA-N 1 0 342.395 3.592 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@H+]1C[C@]23COC[C@@]2(C1)CCCC3 ZINC000597247775 1034640687 /nfs/dbraw/zinc/64/06/87/1034640687.db2.gz CBFNWRAAJGSJRZ-QCHNEIPXSA-N 1 0 328.412 3.501 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)CC2 ZINC000364577246 1034702146 /nfs/dbraw/zinc/70/21/46/1034702146.db2.gz JCHZBQAHTWWLRU-BBRMVZONSA-N 1 0 328.416 3.580 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[NH2+][C@@H]1[C@@H]2CCO[C@@H]2C12CCCC2 ZINC000450855934 1034899112 /nfs/dbraw/zinc/89/91/12/1034899112.db2.gz HRVJMHHUWWDRGR-XZJROXQQSA-N 1 0 336.819 3.686 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCCN1C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000310635233 1035037203 /nfs/dbraw/zinc/03/72/03/1035037203.db2.gz BKFBUAMSYJDZAP-CZUORRHYSA-N 1 0 349.431 3.645 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2COc3ccc(F)cc3C2)cccc1[N+](=O)[O-] ZINC000570123223 1035065876 /nfs/dbraw/zinc/06/58/76/1035065876.db2.gz HRRCWPVORGLKDG-IUODEOHRSA-N 1 0 330.359 3.697 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2NCc1cccc(C(F)(F)F)n1 ZINC000580843410 1035458645 /nfs/dbraw/zinc/45/86/45/1035458645.db2.gz DIPBJWCERLQGNQ-ZDUSSCGKSA-N 1 0 337.301 3.786 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)c2ncccc12 ZINC000594596672 1035737859 /nfs/dbraw/zinc/73/78/59/1035737859.db2.gz BAYAFLHWZJROQO-WMLDXEAASA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1cc(O)cc(C(F)(F)F)c1 ZINC000582389506 1035747944 /nfs/dbraw/zinc/74/79/44/1035747944.db2.gz OPSUYGWMEUCBIU-UHFFFAOYSA-N 1 0 340.301 3.652 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c(C)oc3ccccc32)cc1[N+](=O)[O-] ZINC000463701031 1035751815 /nfs/dbraw/zinc/75/18/15/1035751815.db2.gz AIVOZQRMMRFZPJ-UHFFFAOYSA-N 1 0 340.379 3.990 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H](CO)C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000588231255 1035827627 /nfs/dbraw/zinc/82/76/27/1035827627.db2.gz ZBKXUDLTYYHPFY-DNVCBOLYSA-N 1 0 346.427 3.694 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc(C(F)(F)F)c([N+](=O)[O-])c1)c1ccco1 ZINC000589103581 1036235620 /nfs/dbraw/zinc/23/56/20/1036235620.db2.gz NQFMRHBGMXBQJV-CYBMUJFWSA-N 1 0 343.305 3.921 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[NH+]2CCC3(CCC3)CC2)c1 ZINC000589188215 1036296836 /nfs/dbraw/zinc/29/68/36/1036296836.db2.gz MUYBPCZULUODJF-UHFFFAOYSA-N 1 0 326.343 3.962 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)c(F)c1 ZINC000589325179 1036347175 /nfs/dbraw/zinc/34/71/75/1036347175.db2.gz UZXLOSXOCMSCPN-AEFFLSMTSA-N 1 0 330.359 3.744 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccccc1Cl ZINC000026224939 1036397512 /nfs/dbraw/zinc/39/75/12/1036397512.db2.gz XHGAXMNCMMUPIP-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C(C)C)C1CCCCC1 ZINC000491197729 1036398543 /nfs/dbraw/zinc/39/85/43/1036398543.db2.gz XNBLZKZVVGPMMU-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@H](Oc2cccc(Cl)c2)C1 ZINC000535375717 1036416297 /nfs/dbraw/zinc/41/62/97/1036416297.db2.gz XAKGACSZGAXOAT-INIZCTEOSA-N 1 0 332.787 3.902 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CC[C@@](O)(C(F)(F)F)C2)cc1[N+](=O)[O-] ZINC000589939094 1036686351 /nfs/dbraw/zinc/68/63/51/1036686351.db2.gz OYGPWPWDVJOFMA-DOMZBBRYSA-N 1 0 346.349 3.654 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000464781906 1036778037 /nfs/dbraw/zinc/77/80/37/1036778037.db2.gz WTFMTTYNPMRUFN-SFHVURJKSA-N 1 0 333.432 3.744 20 5 EHBDRO Cc1c(Cl)cccc1NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180452171 1036841246 /nfs/dbraw/zinc/84/12/46/1036841246.db2.gz SEVONTAEXKPZNF-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CCC[C@H]3Cc3ccccc3)c2c1 ZINC000026235877 1036844043 /nfs/dbraw/zinc/84/40/43/1036844043.db2.gz OBRXLFOKULTMLD-KRWDZBQOSA-N 1 0 336.395 3.609 20 5 EHBDRO CC[C@H](C)[C@H](O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180531530 1036920974 /nfs/dbraw/zinc/92/09/74/1036920974.db2.gz OSXQVIVIVROWSG-KYNGSXCRSA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC(C[NH+]2CCCCCC2)CC1 ZINC000609144054 1036948369 /nfs/dbraw/zinc/94/83/69/1036948369.db2.gz JNGSDQYUGWNQOZ-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000590568848 1036952206 /nfs/dbraw/zinc/95/22/06/1036952206.db2.gz DLILOEUVTSGPBQ-UHFFFAOYSA-N 1 0 345.365 3.923 20 5 EHBDRO COCC[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761511989 1037083842 /nfs/dbraw/zinc/08/38/42/1037083842.db2.gz ZKFYSDAKCVTCTK-UHFFFAOYSA-N 1 0 334.803 3.897 20 5 EHBDRO C[C@H](COc1cccc(F)c1)[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761521369 1037099303 /nfs/dbraw/zinc/09/93/03/1037099303.db2.gz GGNIOCIQLJYXOY-LLVKDONJSA-N 1 0 338.766 3.944 20 5 EHBDRO COCc1csc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c1 ZINC000594987201 1037112247 /nfs/dbraw/zinc/11/22/47/1037112247.db2.gz XMUDGAQMNDJMCO-AWNIVKPZSA-N 1 0 332.425 3.996 20 5 EHBDRO CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000271789240 1037270682 /nfs/dbraw/zinc/27/06/82/1037270682.db2.gz QGINSEXIPSTVDS-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318609 1037283912 /nfs/dbraw/zinc/28/39/12/1037283912.db2.gz VGVLMWBJMVZROP-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000532470206 1037414056 /nfs/dbraw/zinc/41/40/56/1037414056.db2.gz CFUNJGIUYAJXOM-QANKJYHBSA-N 1 0 345.443 3.742 20 5 EHBDRO C[NH+](C)C(C)(C)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491365647 1037422234 /nfs/dbraw/zinc/42/22/34/1037422234.db2.gz FIRDUYWBWCQLHS-GOSISDBHSA-N 1 0 327.428 3.614 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000462815813 1037435487 /nfs/dbraw/zinc/43/54/87/1037435487.db2.gz FBXHIINGBISJGE-LSDHHAIUSA-N 1 0 343.402 3.911 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000051053809 1037531568 /nfs/dbraw/zinc/53/15/68/1037531568.db2.gz FQUKDQQPUXBILH-ZOBUZTSGSA-N 1 0 347.459 3.673 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1nc(C)oc1C ZINC000540084392 1037551576 /nfs/dbraw/zinc/55/15/76/1037551576.db2.gz BNPIMGTZYJXFTQ-AWEZNQCLSA-N 1 0 349.456 3.903 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)cc1[N+](=O)[O-] ZINC000491571347 1037565448 /nfs/dbraw/zinc/56/54/48/1037565448.db2.gz CJTABBAAXZFNBN-CYBMUJFWSA-N 1 0 328.359 3.909 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000491661748 1037610037 /nfs/dbraw/zinc/61/00/37/1037610037.db2.gz JJJZSJPFPCGXHU-PBHICJAKSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCN(C)[C@@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000540150020 1037620498 /nfs/dbraw/zinc/62/04/98/1037620498.db2.gz CXFWFLGZZWEOOR-ZAAXVRCTSA-N 1 0 339.439 3.999 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(F)cc1N(C)C ZINC000540154103 1037625644 /nfs/dbraw/zinc/62/56/44/1037625644.db2.gz VTXFIFOIQLPXQK-ZDUSSCGKSA-N 1 0 331.391 3.693 20 5 EHBDRO O=[N+]([O-])c1ncccc1S[C@@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000591827504 1037639409 /nfs/dbraw/zinc/63/94/09/1037639409.db2.gz QHVBNVTWFAGDFM-OAHLLOKOSA-N 1 0 329.425 3.747 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2COc3ccccc32)cc1[N+](=O)[O-] ZINC000573858776 1037785017 /nfs/dbraw/zinc/78/50/17/1037785017.db2.gz YTZHYSXTRZZFFW-HIFRSBDPSA-N 1 0 342.395 3.820 20 5 EHBDRO C[C@H](C[NH2+]Cc1csc(C(F)(F)F)n1)c1ccccc1[N+](=O)[O-] ZINC000897458967 1037797463 /nfs/dbraw/zinc/79/74/63/1037797463.db2.gz GUDHBMWAMAEMLW-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO C[C@H](C[NH2+][C@@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000897460709 1037847063 /nfs/dbraw/zinc/84/70/63/1037847063.db2.gz VCEZSLGTLBEKLY-CXAGYDPISA-N 1 0 343.431 3.728 20 5 EHBDRO C[C@@H](C[NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897461719 1037849789 /nfs/dbraw/zinc/84/97/89/1037849789.db2.gz WETWORGXQVMWQX-IRXDYDNUSA-N 1 0 339.439 3.814 20 5 EHBDRO COc1ccc(C[N@@H+](Cc2ccc(C)nc2)CC2CC2)cc1[N+](=O)[O-] ZINC000592145479 1037866346 /nfs/dbraw/zinc/86/63/46/1037866346.db2.gz RWNSVYZSRMAIKV-UHFFFAOYSA-N 1 0 341.411 3.719 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC(C)(C)C ZINC000463360801 1038072821 /nfs/dbraw/zinc/07/28/21/1038072821.db2.gz WRGOAQKKWWMWHA-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO COc1ccc2oc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)cc2c1 ZINC000128013266 1038343070 /nfs/dbraw/zinc/34/30/70/1038343070.db2.gz HTHSQKFMNVIKMR-UHFFFAOYSA-N 1 0 326.352 3.682 20 5 EHBDRO COc1ccccc1[C@H](CNc1cc(C)c([N+](=O)[O-])cc1F)[NH+](C)C ZINC000461719252 1038579270 /nfs/dbraw/zinc/57/92/70/1038579270.db2.gz QAZCCXKLUJUZFI-KRWDZBQOSA-N 1 0 347.390 3.766 20 5 EHBDRO Cc1cc(NCC2=CC[N@H+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461943109 1038689368 /nfs/dbraw/zinc/68/93/68/1038689368.db2.gz QRMLUDVDFACBQE-UHFFFAOYSA-N 1 0 329.322 3.596 20 5 EHBDRO COc1cc(N[C@H]2CC[N@@H+]([C@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185524 1038723409 /nfs/dbraw/zinc/72/34/09/1038723409.db2.gz DYBSKHLKUGOSBA-PBHICJAKSA-N 1 0 341.411 3.851 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477843981 1038948787 /nfs/dbraw/zinc/94/87/87/1038948787.db2.gz HGJYJXRPLOVDLB-OXQOHEQNSA-N 1 0 342.439 3.795 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@](C)(CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC000477843980 1038948924 /nfs/dbraw/zinc/94/89/24/1038948924.db2.gz HGJYJXRPLOVDLB-OXJNMPFZSA-N 1 0 342.439 3.795 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@@H](O)Cc1ccccc1 ZINC000552293348 1039164232 /nfs/dbraw/zinc/16/42/32/1039164232.db2.gz YZTYMNPUWAZWHW-VZEGMYIASA-N 1 0 340.423 3.534 20 5 EHBDRO CC(C)(CNc1ccc([N+](=O)[O-])c2cccnc12)C[NH+]1CCCC1 ZINC000478049579 1039173074 /nfs/dbraw/zinc/17/30/74/1039173074.db2.gz WQGBSTJTWAGUEE-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](Cc3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000485574441 1039264072 /nfs/dbraw/zinc/26/40/72/1039264072.db2.gz YGFBWZCWWISFPM-INIZCTEOSA-N 1 0 344.386 3.807 20 5 EHBDRO C[C@@H](CCc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000554527701 1039434356 /nfs/dbraw/zinc/43/43/56/1039434356.db2.gz RVFSXLBIZNVWRB-HNNXBMFYSA-N 1 0 341.411 3.534 20 5 EHBDRO Cc1cc(NC[C@@H]2CC[N@@H+](C3CC3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000549465150 1039478974 /nfs/dbraw/zinc/47/89/74/1039478974.db2.gz HXGAKJISGZAREM-NSHDSACASA-N 1 0 343.349 3.818 20 5 EHBDRO COc1cc(C[NH+]2CCC(c3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000485769693 1039524223 /nfs/dbraw/zinc/52/42/23/1039524223.db2.gz HROQZMKUANEEAG-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC000480440165 1039547271 /nfs/dbraw/zinc/54/72/71/1039547271.db2.gz AIJXJZIAWXBZLI-UONOGXRCSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2cccc(C[NH+]3CCCC3)c2)c(F)c1 ZINC000042098460 1039600887 /nfs/dbraw/zinc/60/08/87/1039600887.db2.gz NYZSDRBWDHVLSJ-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3cccc(F)c3)C2)ccc1[N+](=O)[O-] ZINC000489100651 1039623668 /nfs/dbraw/zinc/62/36/68/1039623668.db2.gz GISJMASOARRXLT-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417299055 1039640501 /nfs/dbraw/zinc/64/05/01/1039640501.db2.gz LWWQGSVIOKMSFY-ROUUACIJSA-N 1 0 343.427 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1cccc3c1OCO3)CCCC2 ZINC000417309121 1039662663 /nfs/dbraw/zinc/66/26/63/1039662663.db2.gz DOAKULWQQKWNRD-QGZVFWFLSA-N 1 0 340.379 3.881 20 5 EHBDRO CCC[NH+]1CCC(N[C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320296 1039676508 /nfs/dbraw/zinc/67/65/08/1039676508.db2.gz JIBMJNZTKZKUDY-LJQANCHMSA-N 1 0 331.460 3.826 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]Cc1cc(Cl)cc2c1OCC2 ZINC000566474830 1039767728 /nfs/dbraw/zinc/76/77/28/1039767728.db2.gz SWLXBHRLEVOLEW-MRXNPFEDSA-N 1 0 344.798 3.960 20 5 EHBDRO COc1ccc(C[NH2+]CC2CC(c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000554918914 1039930916 /nfs/dbraw/zinc/93/09/16/1039930916.db2.gz HUVABDHBQSPNCF-UHFFFAOYSA-N 1 0 326.396 3.887 20 5 EHBDRO COc1c(O)ccc(C[NH2+]Cc2ccc(C3CCC3)cc2)c1[N+](=O)[O-] ZINC000894024184 1039989115 /nfs/dbraw/zinc/98/91/15/1039989115.db2.gz OZEIRORGDABNNQ-UHFFFAOYSA-N 1 0 342.395 3.866 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(C)[C@H](C1)C2(F)F ZINC000428731543 1040117851 /nfs/dbraw/zinc/11/78/51/1040117851.db2.gz YLQDEJMMVNEEAL-JKSUJKDBSA-N 1 0 340.370 3.859 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CCCC[NH+]2CCCCC2)c1C ZINC000899231749 1040196357 /nfs/dbraw/zinc/19/63/57/1040196357.db2.gz XYDCLDDHSRIJCG-UHFFFAOYSA-N 1 0 347.459 3.550 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(Nc3ccc(F)cc3[N+](=O)[O-])cccc21 ZINC000432928686 1040201658 /nfs/dbraw/zinc/20/16/58/1040201658.db2.gz NWVHGAFAOWIHPY-OAHLLOKOSA-N 1 0 331.347 3.863 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](CCO)CC2CC2)s1 ZINC000092506005 1040333911 /nfs/dbraw/zinc/33/39/11/1040333911.db2.gz IIAQSYNUADOLKF-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000479580436 1040402537 /nfs/dbraw/zinc/40/25/37/1040402537.db2.gz QSSJEZJXFHXEJE-GOSISDBHSA-N 1 0 331.460 3.539 20 5 EHBDRO CCC[C@H]([NH2+]C1CCN(C(=O)C(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000192839819 1040438483 /nfs/dbraw/zinc/43/84/83/1040438483.db2.gz VAJCUFGDFJLEDZ-SFHVURJKSA-N 1 0 347.459 3.673 20 5 EHBDRO COc1ccc(C[NH2+]CCCOc2cccc(C)c2C)cc1[N+](=O)[O-] ZINC000486786781 1040443499 /nfs/dbraw/zinc/44/34/99/1040443499.db2.gz HZXWPMAPDQOWNA-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000490355377 1040523306 /nfs/dbraw/zinc/52/33/06/1040523306.db2.gz RVLZOBDLRYCXMO-LIRRHRJNSA-N 1 0 326.396 3.902 20 5 EHBDRO CC(C)(C)[C@@H](CCO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000555421846 1040559664 /nfs/dbraw/zinc/55/96/64/1040559664.db2.gz QXGNXCRVHQOQPW-CYBMUJFWSA-N 1 0 334.338 3.500 20 5 EHBDRO C[C@@H]1CC[C@@H]([N@H+](C)Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000433051137 1040563770 /nfs/dbraw/zinc/56/37/70/1040563770.db2.gz GLUQZTUZOLYFQO-CXAGYDPISA-N 1 0 328.416 3.616 20 5 EHBDRO C[C@@]1(O)C[C@H]([NH2+]Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000418108042 1040582807 /nfs/dbraw/zinc/58/28/07/1040582807.db2.gz FLCAVEVBUBTSHX-UJKQEGAGSA-N 1 0 346.358 3.529 20 5 EHBDRO C[C@H](O)CCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000433172493 1040970379 /nfs/dbraw/zinc/97/03/79/1040970379.db2.gz CPNHHBKDQNZQRE-HNNXBMFYSA-N 1 0 343.427 3.613 20 5 EHBDRO C[C@@H](CC(C)(C)C)[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000453407254 1041077485 /nfs/dbraw/zinc/07/74/85/1041077485.db2.gz DMEXAXLOFJADDH-BBRMVZONSA-N 1 0 330.432 3.832 20 5 EHBDRO CC(C)[C@@H](O)C1(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433235651 1041124176 /nfs/dbraw/zinc/12/41/76/1041124176.db2.gz WWQMXQZUSBXGBQ-IAGOWNOFSA-N 1 0 332.444 3.704 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)N1CCCC[C@@H](C)C1 ZINC000481604705 1041145963 /nfs/dbraw/zinc/14/59/63/1041145963.db2.gz ZYHVPOVZUUZLIJ-VXGBXAGGSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)c(F)c1 ZINC000181640779 1041162794 /nfs/dbraw/zinc/16/27/94/1041162794.db2.gz YSZIYQCISRUMFY-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000158286420 1041272776 /nfs/dbraw/zinc/27/27/76/1041272776.db2.gz FSPHGIZCNUXKPP-IEBWSBKVSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CC1(C)C ZINC000419315167 1041275166 /nfs/dbraw/zinc/27/51/66/1041275166.db2.gz JIDMINXPSNGAFP-ZIAGYGMSSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H](NC(=O)Nc1cccc(C[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000047505613 1041681811 /nfs/dbraw/zinc/68/18/11/1041681811.db2.gz SZXQKYQCQQGDLZ-CYBMUJFWSA-N 1 0 342.399 3.539 20 5 EHBDRO Cc1nc(C)c([C@@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)s1 ZINC000106874913 1041788092 /nfs/dbraw/zinc/78/80/92/1041788092.db2.gz MKILCEHEACYJLG-GFCCVEGCSA-N 1 0 335.429 3.740 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](CCO)C3)s2)cc1 ZINC000093105935 1041877088 /nfs/dbraw/zinc/87/70/88/1041877088.db2.gz ZFBPJZMPFYIXGD-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO CCC[N@@H+](Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-])CC1CC1 ZINC000045003984 1042022208 /nfs/dbraw/zinc/02/22/08/1042022208.db2.gz CTQFQNWCHZPCPN-UHFFFAOYSA-N 1 0 344.358 3.827 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2ccc3ncccc3c2[N+](=O)[O-])C1 ZINC000112077765 1042333924 /nfs/dbraw/zinc/33/39/24/1042333924.db2.gz HJGAIVBZNOQZSU-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])c3cnccc23)CCCCC1 ZINC000015168781 1042748028 /nfs/dbraw/zinc/74/80/28/1042748028.db2.gz PPGYRLHMHHFMRH-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2cc([O-])ccc2[N+](=O)[O-])C1(CC)CC ZINC001167820817 1042906734 /nfs/dbraw/zinc/90/67/34/1042906734.db2.gz WUSMMBICVPLTBQ-IRXDYDNUSA-N 1 0 336.432 3.716 20 5 EHBDRO CC(C)(C)c1ncc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000585767175 1043029137 /nfs/dbraw/zinc/02/91/37/1043029137.db2.gz HADUIVORWDOFJA-UHFFFAOYSA-N 1 0 328.416 3.707 20 5 EHBDRO COc1ccc(C[NH2+]C/C=C/c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000512087392 1043174271 /nfs/dbraw/zinc/17/42/71/1043174271.db2.gz JJTRDOYWJXQJNI-NSCUHMNNSA-N 1 0 334.322 3.685 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(CO)c(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279091598 1043340367 /nfs/dbraw/zinc/34/03/67/1043340367.db2.gz NLGZBBCEIPPECT-GOSISDBHSA-N 1 0 344.386 3.738 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCc3ccc(F)cn3)o2)cc1 ZINC000344904853 1044666266 /nfs/dbraw/zinc/66/62/66/1044666266.db2.gz LZFFYMGFEHVKSX-UHFFFAOYSA-N 1 0 327.315 3.679 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2cccn2)c1 ZINC000183594145 1125612867 /nfs/dbraw/zinc/61/28/67/1125612867.db2.gz WDPLBPDSVXSJQL-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO Cc1cc(N2CCC[C@@H](c3ncc[nH]3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272892023 1127097444 /nfs/dbraw/zinc/09/74/44/1127097444.db2.gz YCHGULUEOSRMMW-CYBMUJFWSA-N 1 0 337.383 3.559 20 5 EHBDRO Cc1nn(C[N@@H+](C)C[C@@H](C)c2ccccc2)c2ccc([N+](=O)[O-])cc12 ZINC000764965543 1127559894 /nfs/dbraw/zinc/55/98/94/1127559894.db2.gz YBPJLEBKLLPBNC-CQSZACIVSA-N 1 0 338.411 3.946 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000765308091 1127596731 /nfs/dbraw/zinc/59/67/31/1127596731.db2.gz VNARXYYIPISGNU-CVEARBPZSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+](CC3CCCCC3)CC2)n1 ZINC000765486894 1127617710 /nfs/dbraw/zinc/61/77/10/1127617710.db2.gz DFUPHAAFIZXADJ-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(OCC2CC2)nc1 ZINC000131339056 1127628345 /nfs/dbraw/zinc/62/83/45/1127628345.db2.gz RVVPSNPZYWFNJB-CQSZACIVSA-N 1 0 341.411 3.938 20 5 EHBDRO [NH3+]CC[C@H]1CN(c2ccc3cnccc3c2[N+](=O)[O-])c2ccccc21 ZINC001168548886 1127708745 /nfs/dbraw/zinc/70/87/45/1127708745.db2.gz JLJVSCJBFCWOEZ-AWEZNQCLSA-N 1 0 334.379 3.727 20 5 EHBDRO C[N@H+](CCCNc1ncc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000301290964 1127735051 /nfs/dbraw/zinc/73/50/51/1127735051.db2.gz UHOCXJJVGJJZGJ-UHFFFAOYSA-N 1 0 326.828 3.710 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000301286494 1127731702 /nfs/dbraw/zinc/73/17/02/1127731702.db2.gz ROJDZOQVEJPZPH-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@@H](c2cccs2)[NH+](C)C)c1 ZINC000301325881 1127737976 /nfs/dbraw/zinc/73/79/76/1127737976.db2.gz ARYJCNHEAHWYQJ-ZDUSSCGKSA-N 1 0 339.392 3.519 20 5 EHBDRO COc1cc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000301370089 1127741954 /nfs/dbraw/zinc/74/19/54/1127741954.db2.gz SCFXFWYUCBCJEF-KRWDZBQOSA-N 1 0 341.411 3.852 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000347571539 1128106013 /nfs/dbraw/zinc/10/60/13/1128106013.db2.gz XPIIQPVFOKPQBR-GFCCVEGCSA-N 1 0 347.440 3.953 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000065208568 1128186345 /nfs/dbraw/zinc/18/63/45/1128186345.db2.gz GQPYBDRGGXIQSZ-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO Cc1ccc2c(ccnc2N[C@H]2CCCC[C@@H]2[NH+](C)C)c1[N+](=O)[O-] ZINC001168592918 1128196754 /nfs/dbraw/zinc/19/67/54/1128196754.db2.gz CEKBZNRLVIMFSL-HOTGVXAUSA-N 1 0 328.416 3.736 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301469258 1128434276 /nfs/dbraw/zinc/43/42/76/1128434276.db2.gz NRKNIRRFINOMAE-GFCCVEGCSA-N 1 0 331.338 3.534 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](O)c1cccc(F)c1 ZINC000273063595 1128438573 /nfs/dbraw/zinc/43/85/73/1128438573.db2.gz IBMNWEWMGDRDMM-MGPLVRAMSA-N 1 0 338.766 3.599 20 5 EHBDRO CC(=O)c1cc(NC[C@H]2CCCC[N@H+]2CC(C)C)ccc1[N+](=O)[O-] ZINC000553506519 1128458121 /nfs/dbraw/zinc/45/81/21/1128458121.db2.gz CQGUTUMOCDJUQP-MRXNPFEDSA-N 1 0 333.432 3.720 20 5 EHBDRO Cc1ccnc(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)c1[N+](=O)[O-] ZINC000301484130 1128473380 /nfs/dbraw/zinc/47/33/80/1128473380.db2.gz VCFOXFYUTYBQLT-CQSZACIVSA-N 1 0 334.807 3.666 20 5 EHBDRO C[C@@H]1C[C@H](Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000301554964 1128496505 /nfs/dbraw/zinc/49/65/05/1128496505.db2.gz ICXPBAWNVXSAHO-KOLCDFICSA-N 1 0 329.322 3.651 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@@H](C[N@H+]2CCCC[C@@H]2C)C1 ZINC000542703458 1128548937 /nfs/dbraw/zinc/54/89/37/1128548937.db2.gz NREBROWZIHKNCX-ZWKOTPCHSA-N 1 0 345.487 3.990 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)ccc1Br ZINC000091469567 1128670190 /nfs/dbraw/zinc/67/01/90/1128670190.db2.gz JTOQFIGAAKETDX-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO COc1cc(NC[C@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])cc1F ZINC000301624734 1128766878 /nfs/dbraw/zinc/76/68/78/1128766878.db2.gz PIHLVJJTWVBKCX-OAHLLOKOSA-N 1 0 349.362 3.585 20 5 EHBDRO O=[N+]([O-])c1c(NCCCCC[NH+]2CCCC2)ccc2ncccc21 ZINC000338754885 1128871045 /nfs/dbraw/zinc/87/10/45/1128871045.db2.gz GRFUIGQXUHHIHV-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO Cc1cc(NC(=O)c2ccc(C[NH+]3CCCC3)cc2)cc([N+](=O)[O-])c1 ZINC001648799315 1120039754 /nfs/dbraw/zinc/03/97/54/1120039754.db2.gz VAKAQMUBYDKHAI-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO CC[NH+](CC)CCCCNc1ccc(Br)cc1[N+](=O)[O-] ZINC001650849768 1120044975 /nfs/dbraw/zinc/04/49/75/1120044975.db2.gz WFNKJNRUDSUCOL-UHFFFAOYSA-N 1 0 344.253 3.891 20 5 EHBDRO C[C@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[NH+]1CCCC1 ZINC001648832609 1120050876 /nfs/dbraw/zinc/05/08/76/1120050876.db2.gz DBNPBRUVSVROPT-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO CC1(C)[C@@H](O)C[C@@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000494484483 1120570265 /nfs/dbraw/zinc/57/02/65/1120570265.db2.gz KLXAPQPBVZFBEU-HOTGVXAUSA-N 1 0 332.425 3.572 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000193234567 1120995909 /nfs/dbraw/zinc/99/59/09/1120995909.db2.gz GPSGCVFDLDCBBI-OLZOCXBDSA-N 1 0 327.384 3.965 20 5 EHBDRO COc1cnccc1[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193329019 1121113926 /nfs/dbraw/zinc/11/39/26/1121113926.db2.gz ZHJXEFBNHUXVMP-SJCJKPOMSA-N 1 0 327.384 3.727 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[N@@H+]1CCC[C@@H](C)C1 ZINC000301075499 1121358305 /nfs/dbraw/zinc/35/83/05/1121358305.db2.gz FCUUQZBLNYAFTN-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCc3nccs3)cs2)c1 ZINC000113331374 1129002494 /nfs/dbraw/zinc/00/24/94/1129002494.db2.gz CNNQVWOOIJEEPN-UHFFFAOYSA-N 1 0 346.437 3.507 20 5 EHBDRO C[C@H](c1ccccc1)N(C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180422 1122545397 /nfs/dbraw/zinc/54/53/97/1122545397.db2.gz SOFIZULJYJDBPI-GFCCVEGCSA-N 1 0 347.802 3.880 20 5 EHBDRO COc1ccc(C[N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)cc1F ZINC000917830525 1122694412 /nfs/dbraw/zinc/69/44/12/1122694412.db2.gz HYAQYKGJLWEELP-UHFFFAOYSA-N 1 0 348.374 3.643 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1NC[C@H](c1ccccc1)[NH+]1CCCC1 ZINC000919962542 1123247754 /nfs/dbraw/zinc/24/77/54/1123247754.db2.gz LBLKHLYAVKGUDZ-QGZVFWFLSA-N 1 0 329.375 3.983 20 5 EHBDRO COC(=O)C(C)(C)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000499242475 1123292975 /nfs/dbraw/zinc/29/29/75/1123292975.db2.gz GUHLYENGXAGCGR-UHFFFAOYSA-N 1 0 348.424 3.612 20 5 EHBDRO CN(c1ccccc1)C1CC[NH+](Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000065956284 1129114743 /nfs/dbraw/zinc/11/47/43/1129114743.db2.gz SRSUJPHDYCWTBB-UHFFFAOYSA-N 1 0 325.412 3.696 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CC[C@H](Cc3ccc(F)cc3)C2)c1 ZINC000609916192 1123691857 /nfs/dbraw/zinc/69/18/57/1123691857.db2.gz DQYYQERBFMYTON-MRXNPFEDSA-N 1 0 344.386 3.677 20 5 EHBDRO COc1ccc([C@@H](CNc2ccc([N+](=O)[O-])s2)[NH+]2CCCC2)cc1 ZINC000139409107 1123746323 /nfs/dbraw/zinc/74/63/23/1123746323.db2.gz YJGYYLGODOFUDH-OAHLLOKOSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249647 1123754018 /nfs/dbraw/zinc/75/40/18/1123754018.db2.gz CTPDUXWRMYUOHR-CABCVRRESA-N 1 0 335.423 3.825 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCOC2)ccc1Oc1ccc(F)cc1 ZINC000237883970 1123902684 /nfs/dbraw/zinc/90/26/84/1123902684.db2.gz DNFFNNFTTIZALQ-HNNXBMFYSA-N 1 0 346.358 3.795 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1ccnn1C)C(C)C ZINC000615943144 1123912504 /nfs/dbraw/zinc/91/25/04/1123912504.db2.gz FWFKYIRFOORGKX-SPQRHKFCSA-N 1 0 342.443 3.761 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122855005 1124985446 /nfs/dbraw/zinc/98/54/46/1124985446.db2.gz OVEQIAMPOISCLV-KUHUBIRLSA-N 1 0 340.423 3.842 20 5 EHBDRO CCN(C(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000181807789 1125045628 /nfs/dbraw/zinc/04/56/28/1125045628.db2.gz FZSCCYBVVFIMQC-OAHLLOKOSA-N 1 0 341.411 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1OCCc3ccccc31)CCC2 ZINC000618571748 1125120172 /nfs/dbraw/zinc/12/01/72/1125120172.db2.gz VZQSWZPHMWSYOJ-PMACEKPBSA-N 1 0 338.407 3.876 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@H](C[NH+]3CCCCC3)C2)c(Cl)c1 ZINC000182192126 1125194939 /nfs/dbraw/zinc/19/49/39/1125194939.db2.gz JHYMGVYSNVDLQE-CQSZACIVSA-N 1 0 337.851 3.556 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@H](c2nccn2C)C1 ZINC000446843446 1125334937 /nfs/dbraw/zinc/33/49/37/1125334937.db2.gz NNLUWKOSCRDPHK-JMPLCFMRSA-N 1 0 340.427 3.611 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccsc1 ZINC000619782827 1125404325 /nfs/dbraw/zinc/40/43/25/1125404325.db2.gz LKTQVICATSUHAH-VIFPVBQESA-N 1 0 339.804 3.599 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ccccc2)c2ccccn2)cc1 ZINC000067386482 1129268999 /nfs/dbraw/zinc/26/89/99/1129268999.db2.gz CDYYMGITWGPCFS-HXUWFJFHSA-N 1 0 349.390 3.748 20 5 EHBDRO CC(C)([NH2+]Cc1ccc(-n2cccn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000080347117 1129347981 /nfs/dbraw/zinc/34/79/81/1129347981.db2.gz ZJMRKWZRZKKMHU-UHFFFAOYSA-N 1 0 336.395 3.805 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H](C)c2ccco2)cccc1[N+](=O)[O-] ZINC000069070392 1129420737 /nfs/dbraw/zinc/42/07/37/1129420737.db2.gz YJQWGTIAHPTTAD-ZDUSSCGKSA-N 1 0 331.372 3.518 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](O)CCc2ccccc2)cccc1[N+](=O)[O-] ZINC000543416596 1129476573 /nfs/dbraw/zinc/47/65/73/1129476573.db2.gz PORGCHPBPDBBLC-DOTOQJQBSA-N 1 0 328.412 3.548 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@H]2CCO[C@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543422844 1129477569 /nfs/dbraw/zinc/47/75/69/1129477569.db2.gz IPKYFUJMTDGJOF-FRIZHTMISA-N 1 0 344.411 3.997 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000388884131 1129547943 /nfs/dbraw/zinc/54/79/43/1129547943.db2.gz RAWDOSCMDNCLJR-DOMZBBRYSA-N 1 0 326.824 3.764 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cn1 ZINC000922538927 1129566004 /nfs/dbraw/zinc/56/60/04/1129566004.db2.gz YYRRGIGXDUSPPR-CQSZACIVSA-N 1 0 328.416 3.685 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](CCc3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000155214143 1129619537 /nfs/dbraw/zinc/61/95/37/1129619537.db2.gz HNVBDBSFRRNCRH-QGZVFWFLSA-N 1 0 326.396 3.635 20 5 EHBDRO CC(=O)c1ccc(N[C@@H](C)[C@H]2CCC[N@@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044414 1129765198 /nfs/dbraw/zinc/76/51/98/1129765198.db2.gz JUNXAXLRHUVHRM-BBRMVZONSA-N 1 0 345.443 3.862 20 5 EHBDRO C[C@@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302051575 1129765751 /nfs/dbraw/zinc/76/57/51/1129765751.db2.gz OCOCNFJNRACJEQ-VXGBXAGGSA-N 1 0 338.839 3.708 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1F ZINC000056196503 1129805795 /nfs/dbraw/zinc/80/57/95/1129805795.db2.gz UUEJOIWTNDOEBG-QWRGUYRKSA-N 1 0 349.337 3.551 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196571 1129806234 /nfs/dbraw/zinc/80/62/34/1129806234.db2.gz TUFCMTDDOWAITG-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1c(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cccc1[N+](=O)[O-] ZINC000303207313 1129827648 /nfs/dbraw/zinc/82/76/48/1129827648.db2.gz QEDOPMFMFPZUGM-SFHVURJKSA-N 1 0 345.487 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccc4[nH]cnc4c3)C2)cc1 ZINC000556165307 1129835361 /nfs/dbraw/zinc/83/53/61/1129835361.db2.gz MGRSVIYHPIHTCP-MRXNPFEDSA-N 1 0 336.395 3.851 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NC1CC[NH+](Cc2ccccc2)CC1 ZINC000305251261 1129915312 /nfs/dbraw/zinc/91/53/12/1129915312.db2.gz PQWWFIPNKKQNPW-UHFFFAOYSA-N 1 0 329.375 3.810 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCC1 ZINC000172169423 1130111479 /nfs/dbraw/zinc/11/14/79/1130111479.db2.gz RVSBCEHZEOLQQI-MNOVXSKESA-N 1 0 339.823 3.744 20 5 EHBDRO COc1cccc(O[C@H](C)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173449867 1130232629 /nfs/dbraw/zinc/23/26/29/1130232629.db2.gz JYOIWEMNVIIJRR-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173451356 1130232666 /nfs/dbraw/zinc/23/26/66/1130232666.db2.gz NOEXCQILTHUYBJ-ZIAGYGMSSA-N 1 0 330.384 3.722 20 5 EHBDRO CC(C)O[C@H]1C[C@@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C1(C)C ZINC000766090457 1130256169 /nfs/dbraw/zinc/25/61/69/1130256169.db2.gz SZKPBENVBGJPGO-CABCVRRESA-N 1 0 326.824 3.930 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000246581415 1130392614 /nfs/dbraw/zinc/39/26/14/1130392614.db2.gz YQRFHTLOLITXKL-QRTARXTBSA-N 1 0 336.457 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@@H](c4ccccc4F)C3)c2c1 ZINC000730455257 1130712433 /nfs/dbraw/zinc/71/24/33/1130712433.db2.gz RPIUAEUZGJZKGY-CQSZACIVSA-N 1 0 340.358 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2ccc(-c3ccccc3)o2)cc1 ZINC000731678486 1130830881 /nfs/dbraw/zinc/83/08/81/1130830881.db2.gz NGXNJWZLULUTFD-GOSISDBHSA-N 1 0 338.363 3.678 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000741261954 1131591300 /nfs/dbraw/zinc/59/13/00/1131591300.db2.gz SJZLYURZBDRPRZ-INIZCTEOSA-N 1 0 342.351 3.579 20 5 EHBDRO [NH3+]Cc1ccc(N[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1F ZINC001172905280 1131886476 /nfs/dbraw/zinc/88/64/76/1131886476.db2.gz HSNUXVBADPVGOX-HNNXBMFYSA-N 1 0 329.375 3.552 20 5 EHBDRO COc1ccccc1C[N@H+](C)[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172908357 1131887665 /nfs/dbraw/zinc/88/76/65/1131887665.db2.gz CGTKGFPCPUMYKD-GOSISDBHSA-N 1 0 340.423 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](C(F)(F)F)C1)CC2 ZINC001172914275 1131902917 /nfs/dbraw/zinc/90/29/17/1131902917.db2.gz GFDYQZACDTXDLG-ZIAGYGMSSA-N 1 0 328.334 3.726 20 5 EHBDRO [NH3+][C@H]1CCN([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc21 ZINC001172911018 1131918179 /nfs/dbraw/zinc/91/81/79/1131918179.db2.gz GTMXFBDMWFGDAS-APWZRJJASA-N 1 0 337.423 3.752 20 5 EHBDRO CCC[C@@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173007217 1131934861 /nfs/dbraw/zinc/93/48/61/1131934861.db2.gz FLIURFAMVGPGSY-LLVKDONJSA-N 1 0 327.375 3.620 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCC[C@@H](F)C2)c1F ZINC001173174916 1131990985 /nfs/dbraw/zinc/99/09/85/1131990985.db2.gz GBZBTGFVACZBJZ-QJPTWQEYSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccc(C)cc2)c1F ZINC001173174828 1131991141 /nfs/dbraw/zinc/99/11/41/1131991141.db2.gz DBUGUFJNGGKWMT-ZDUSSCGKSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C(C)(C)c2ccncc2)c1F ZINC001173183099 1131993643 /nfs/dbraw/zinc/99/36/43/1131993643.db2.gz LEYGNNDCKDNMRH-LBPRGKRZSA-N 1 0 347.390 3.593 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCCC23CCC3)c1F ZINC001173187355 1131994299 /nfs/dbraw/zinc/99/42/99/1131994299.db2.gz ZZIMVSRAOZHCIJ-BLLLJJGKSA-N 1 0 336.407 3.986 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)Cc2ccsc2)c1F ZINC001173195171 1131995349 /nfs/dbraw/zinc/99/53/49/1131995349.db2.gz CSZNIQRMHFHAIG-NSHDSACASA-N 1 0 338.404 3.867 20 5 EHBDRO Cc1nc2cc(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)ccc2o1 ZINC001173215943 1132001861 /nfs/dbraw/zinc/00/18/61/1132001861.db2.gz GBFVFHRGJPHELN-LBPRGKRZSA-N 1 0 325.368 3.765 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC001173217869 1132002102 /nfs/dbraw/zinc/00/21/02/1132002102.db2.gz MUDVZNQWNKYPJT-UGSOOPFHSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(OC2CCC2)ccn1 ZINC001173225551 1132006521 /nfs/dbraw/zinc/00/65/21/1132006521.db2.gz RQICRFDYDUIESF-CQSZACIVSA-N 1 0 341.411 3.642 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1ccncc1 ZINC001173225597 1132007163 /nfs/dbraw/zinc/00/71/63/1132007163.db2.gz SNXMLURZRNGXMS-OAHLLOKOSA-N 1 0 327.428 3.779 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC001173229583 1132007854 /nfs/dbraw/zinc/00/78/54/1132007854.db2.gz NURDXTLSMGCWOP-CJNGLKHVSA-N 1 0 348.830 3.545 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C1CCCCCCC1 ZINC000744392952 1132083210 /nfs/dbraw/zinc/08/32/10/1132083210.db2.gz GZYUPXBDHBCUPN-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO CCC[N@@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)CC(C)C ZINC000746145348 1132384545 /nfs/dbraw/zinc/38/45/45/1132384545.db2.gz KNSRGDPULINYFK-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCNc1ccccc1)C1CC1 ZINC000766515793 1132584148 /nfs/dbraw/zinc/58/41/48/1132584148.db2.gz QOQPTIYQDRXIOA-SFHVURJKSA-N 1 0 325.412 3.618 20 5 EHBDRO Cc1ccc(C)c([C@@H](C)[NH2+]CC(=O)Nc2c(C)cccc2[N+](=O)[O-])c1 ZINC001168924551 1132606076 /nfs/dbraw/zinc/60/60/76/1132606076.db2.gz DSYFTDJCIIXMMK-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168978350 1132618457 /nfs/dbraw/zinc/61/84/57/1132618457.db2.gz RGFSIMHQTFYVMG-JTNHKYCSSA-N 1 0 327.222 3.545 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001168982869 1132619503 /nfs/dbraw/zinc/61/95/03/1132619503.db2.gz TVFCPKHZRNWDEP-JLSDUUJJSA-N 1 0 345.443 3.649 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2cncc(C(F)(F)F)c2)C2CC2)C1 ZINC001168999791 1132627243 /nfs/dbraw/zinc/62/72/43/1132627243.db2.gz VTGPUVKMMMXEMB-VCTAVGKDSA-N 1 0 343.349 3.587 20 5 EHBDRO COc1cccc2c1CC[C@H](CCC[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)C2 ZINC001169006850 1132629797 /nfs/dbraw/zinc/62/97/97/1132629797.db2.gz ZLSLWNITDCDARV-BQFCYCMXSA-N 1 0 346.471 3.615 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(Oc3ccc(Cl)cc3)CC2)C1 ZINC001169014415 1132632711 /nfs/dbraw/zinc/63/27/11/1132632711.db2.gz ZLICRSIWJAYVBF-HIFRSBDPSA-N 1 0 338.835 3.629 20 5 EHBDRO CC1(C)OC2(CC[NH+]([C@@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169040160 1132637745 /nfs/dbraw/zinc/63/77/45/1132637745.db2.gz YKHUPARIRPJWAY-HZPDHXFCSA-N 1 0 344.455 3.688 20 5 EHBDRO CC(C)(C)c1ccc(N2CC[NH+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)cc1 ZINC001169042069 1132637888 /nfs/dbraw/zinc/63/78/88/1132637888.db2.gz CTPRUWWDCVIAEY-APWZRJJASA-N 1 0 345.487 3.552 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040150 1132638302 /nfs/dbraw/zinc/63/83/02/1132638302.db2.gz YHTQTDVZJKYHRM-FRFSOERESA-N 1 0 338.835 3.629 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(c3noc4ccc(F)cc43)CC2)C1 ZINC001169038588 1132638404 /nfs/dbraw/zinc/63/84/04/1132638404.db2.gz ZTJHJHFURARBRN-WFASDCNBSA-N 1 0 347.390 3.592 20 5 EHBDRO CC1(C)OC2(CC[NH+]([C@@H]3CC[C@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169040161 1132638548 /nfs/dbraw/zinc/63/85/48/1132638548.db2.gz YKHUPARIRPJWAY-JKSUJKDBSA-N 1 0 344.455 3.688 20 5 EHBDRO CC[N@H+](Cc1cccc(C(F)(F)F)c1)[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169045712 1132640981 /nfs/dbraw/zinc/64/09/81/1132640981.db2.gz JTISPAKFDIDFTR-HIFRSBDPSA-N 1 0 330.350 3.973 20 5 EHBDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055407 1132644362 /nfs/dbraw/zinc/64/43/62/1132644362.db2.gz PXDFNMORLFYEOR-SLEUVZQESA-N 1 0 341.249 3.887 20 5 EHBDRO CC1(C)C[C@@H](Nc2cc(F)cc(F)c2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169141597 1132673965 /nfs/dbraw/zinc/67/39/65/1132673965.db2.gz CLIOPDFPTZWSAT-BDJLRTHQSA-N 1 0 327.375 3.829 20 5 EHBDRO CC1(C)C[C@H](Nc2nc(Cl)ccc2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169146710 1132676009 /nfs/dbraw/zinc/67/60/09/1132676009.db2.gz RWYNOTJLNWXVGI-ZUZCIYMTSA-N 1 0 326.828 3.599 20 5 EHBDRO COc1ccc2c(c1)c(CC[NH3+])c(C)n2-c1cccc(C)c1[N+](=O)[O-] ZINC001169173264 1132692157 /nfs/dbraw/zinc/69/21/57/1132692157.db2.gz BFGYNAJNNQFHKA-UHFFFAOYSA-N 1 0 339.395 3.665 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(Nc3cc([N+](=O)[O-])ccc3F)cccc21 ZINC001175737411 1132749276 /nfs/dbraw/zinc/74/92/76/1132749276.db2.gz SFNROOFLRQHVOF-MRXNPFEDSA-N 1 0 331.347 3.863 20 5 EHBDRO CC[C@@H]1CC[N@H+](Cc2ccc(Br)cc2[N+](=O)[O-])[C@H]1C ZINC001169495405 1132771174 /nfs/dbraw/zinc/77/11/74/1132771174.db2.gz RGIBIXISCNJULE-WDEREUQCSA-N 1 0 327.222 3.978 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])cc1C ZINC001175999837 1132814466 /nfs/dbraw/zinc/81/44/66/1132814466.db2.gz LXJNJWWBWBKJLI-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C1=CCOCC1 ZINC001176146435 1132845340 /nfs/dbraw/zinc/84/53/40/1132845340.db2.gz CLSQFTBICPZRPH-UHFFFAOYSA-N 1 0 335.407 3.516 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)cc1NCC12CC[NH+](CC1)CC2 ZINC001169796459 1132861519 /nfs/dbraw/zinc/86/15/19/1132861519.db2.gz NWSZCBWPEMXTME-UHFFFAOYSA-N 1 0 329.322 3.511 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOc1cccnc1 ZINC000768106090 1133095848 /nfs/dbraw/zinc/09/58/48/1133095848.db2.gz RHTOMKLAOJCLGE-AWEZNQCLSA-N 1 0 347.440 3.529 20 5 EHBDRO Cc1cccn2c(C[NH2+]CCc3ccc(Cl)cc3[N+](=O)[O-])cnc12 ZINC001178326117 1133160119 /nfs/dbraw/zinc/16/01/19/1133160119.db2.gz AJHKHTGZRLMXKI-UHFFFAOYSA-N 1 0 344.802 3.537 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@H+](CCc3ccccc3)C3CC3)nc2c1 ZINC000769704065 1133332896 /nfs/dbraw/zinc/33/28/96/1133332896.db2.gz AKUIFYBOEQMLIC-UHFFFAOYSA-N 1 0 336.395 3.678 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CCC(C)(C)[NH2+]C(C)(C)C2)cc1[N+](=O)[O-] ZINC001181429298 1133486314 /nfs/dbraw/zinc/48/63/14/1133486314.db2.gz CZDIOCWVTLMBPQ-UHFFFAOYSA-N 1 0 347.459 3.711 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCCCC1 ZINC001182172616 1133576126 /nfs/dbraw/zinc/57/61/26/1133576126.db2.gz FOLVDSVQIIUTMP-UHFFFAOYSA-N 1 0 326.824 3.935 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@H](O)c1cccc(F)c1 ZINC000774258961 1133647553 /nfs/dbraw/zinc/64/75/53/1133647553.db2.gz PLIQGSZWYIZHLP-GESALYCCSA-N 1 0 344.386 3.823 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000774411529 1133673334 /nfs/dbraw/zinc/67/33/34/1133673334.db2.gz PYCAKLJFAKDCLH-OALUTQOASA-N 1 0 326.396 3.678 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COc2cc(F)ccc2C1 ZINC001182960481 1133751679 /nfs/dbraw/zinc/75/16/79/1133751679.db2.gz RZDYKXUBHWXLEI-SUMWQHHRSA-N 1 0 344.386 3.648 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000786811116 1133909098 /nfs/dbraw/zinc/90/90/98/1133909098.db2.gz IVWCLOOLGHFLLF-UKTHLTGXSA-N 1 0 327.340 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CCc3ccccc3OC2)c1 ZINC000786866496 1133914088 /nfs/dbraw/zinc/91/40/88/1133914088.db2.gz YLQHWFTXUXXCKA-CQSZACIVSA-N 1 0 332.787 3.732 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1C[C@@H]1C1CCCC1 ZINC001184373622 1133932344 /nfs/dbraw/zinc/93/23/44/1133932344.db2.gz BLDGLYGNMBLKDL-DDUZABMNSA-N 1 0 345.443 3.728 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H]1C[C@H]1C1CCCC1 ZINC001184373625 1133932586 /nfs/dbraw/zinc/93/25/86/1133932586.db2.gz BLDGLYGNMBLKDL-XUWXXGDYSA-N 1 0 345.443 3.728 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc(Cl)ccc2[N+](=O)[O-])C[C@H]1C ZINC000746671973 1133990568 /nfs/dbraw/zinc/99/05/68/1133990568.db2.gz CYRYNVPJZPODHK-IUODEOHRSA-N 1 0 325.840 3.553 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1CCCC[C@@H]1C ZINC001184856781 1133999593 /nfs/dbraw/zinc/99/95/93/1133999593.db2.gz LQXLJTGQOXGAQO-WDEREUQCSA-N 1 0 346.353 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000774837305 1134043644 /nfs/dbraw/zinc/04/36/44/1134043644.db2.gz PGVCOOKUQYTPPF-MRXNPFEDSA-N 1 0 345.330 3.979 20 5 EHBDRO CC1(C)CC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CCS1 ZINC000788376550 1134118846 /nfs/dbraw/zinc/11/88/46/1134118846.db2.gz MIBWTEWYXRGQAZ-UHFFFAOYSA-N 1 0 346.456 3.633 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1F ZINC000788479664 1134130131 /nfs/dbraw/zinc/13/01/31/1134130131.db2.gz ZLXQAMVHWAKAGX-KRWDZBQOSA-N 1 0 344.386 3.915 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479727 1134130592 /nfs/dbraw/zinc/13/05/92/1134130592.db2.gz AAOQNCBNVAVBAF-NVXWUHKLSA-N 1 0 349.450 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)cc1F ZINC000788482744 1134137890 /nfs/dbraw/zinc/13/78/90/1134137890.db2.gz NGJZQTRRJQKTIF-QGZVFWFLSA-N 1 0 349.450 3.822 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H](O)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000788574826 1134147362 /nfs/dbraw/zinc/14/73/62/1134147362.db2.gz BDJCYRWQLJCUBT-QZTJIDSGSA-N 1 0 344.386 3.780 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H]2CSCCS2)c2cc([N+](=O)[O-])ccc21 ZINC000788584572 1134148123 /nfs/dbraw/zinc/14/81/23/1134148123.db2.gz KGSRLCOBPLUXDX-WFASDCNBSA-N 1 0 338.498 3.755 20 5 EHBDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788691443 1134157761 /nfs/dbraw/zinc/15/77/61/1134157761.db2.gz ZRELSCQYJNQGHH-NSHDSACASA-N 1 0 347.365 3.838 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694559 1134163796 /nfs/dbraw/zinc/16/37/96/1134163796.db2.gz WATSOADGMNQKOA-KBPBESRZSA-N 1 0 325.412 3.633 20 5 EHBDRO C[N@@H+]1CCCC[C@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187044812 1134287526 /nfs/dbraw/zinc/28/75/26/1134287526.db2.gz POWXGAXBWIUNRQ-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO C[N@@H+]1CCCC[C@@H](CNc2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001187044813 1134287592 /nfs/dbraw/zinc/28/75/92/1134287592.db2.gz POWXGAXBWIUNRQ-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO C[NH+](C)C1(C)CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC001187371027 1134327920 /nfs/dbraw/zinc/32/79/20/1134327920.db2.gz GJWYUPXRKSOVLC-UHFFFAOYSA-N 1 0 343.374 3.871 20 5 EHBDRO Cn1nccc1[C@H]1CCC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000790494796 1134426286 /nfs/dbraw/zinc/42/62/86/1134426286.db2.gz HJECLEMEGDFZPL-GXTWGEPZSA-N 1 0 348.834 3.798 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000775371660 1134675202 /nfs/dbraw/zinc/67/52/02/1134675202.db2.gz OUNKCLWCLPPAAA-HOTGVXAUSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(F)ccc2F)c([N+](=O)[O-])c1 ZINC001170298092 1134738017 /nfs/dbraw/zinc/73/80/17/1134738017.db2.gz ZXPSZIMHVBTIPF-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cccc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170298277 1134738259 /nfs/dbraw/zinc/73/82/59/1134738259.db2.gz IATDUYSJHOJEAP-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170314367 1134745779 /nfs/dbraw/zinc/74/57/79/1134745779.db2.gz VAFJQZVOOYVCIS-IGNZVWTISA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170314381 1134746016 /nfs/dbraw/zinc/74/60/16/1134746016.db2.gz VAFJQZVOOYVCIS-RZAIGCCYSA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(C)Cc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170317442 1134746550 /nfs/dbraw/zinc/74/65/50/1134746550.db2.gz IRGNVRUERDZEAB-AWEZNQCLSA-N 1 0 340.423 3.682 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3cc(C)ncc32)c([N+](=O)[O-])c1 ZINC001170324116 1134747396 /nfs/dbraw/zinc/74/73/96/1134747396.db2.gz OGMMOBPZQXAKMV-UGSOOPFHSA-N 1 0 341.411 3.515 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347886 1134759371 /nfs/dbraw/zinc/75/93/71/1134759371.db2.gz SUJBEQDEYXABRP-ZDUSSCGKSA-N 1 0 332.375 3.806 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CC2CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170351624 1134760566 /nfs/dbraw/zinc/76/05/66/1134760566.db2.gz GMDKTUSCAZPJBM-LLVKDONJSA-N 1 0 328.359 3.512 20 5 EHBDRO CC(C)[C@H]1CCC[N@@H+]1Cc1c(Br)cccc1[N+](=O)[O-] ZINC001191201917 1134814639 /nfs/dbraw/zinc/81/46/39/1134814639.db2.gz CGIGKFCTQOBPFV-CYBMUJFWSA-N 1 0 327.222 3.978 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CCC[C@H](C)[C@@H]1c1ccc(C)cc1 ZINC001191184187 1134821148 /nfs/dbraw/zinc/82/11/48/1134821148.db2.gz VEFYAGDIAVMLPU-HNAYVOBHSA-N 1 0 342.443 3.881 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000793238121 1134894122 /nfs/dbraw/zinc/89/41/22/1134894122.db2.gz NQLJAJYQNXFRNO-VQIMIIECSA-N 1 0 344.411 3.595 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2ncc3cccc([N+](=O)[O-])c3n2)CC1(C)C ZINC001170451725 1135076491 /nfs/dbraw/zinc/07/64/91/1135076491.db2.gz XECKGJAISSHLLY-UHFFFAOYSA-N 1 0 343.431 3.601 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1ccc(C[NH2+]C[C@H]2CCCO2)o1 ZINC000078968765 1135141816 /nfs/dbraw/zinc/14/18/16/1135141816.db2.gz OFYCTSJKFFWJHS-GFCCVEGCSA-N 1 0 336.775 3.777 20 5 EHBDRO COCC[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])[C@@H]1CC[C@H](C)C1 ZINC001193974790 1135208737 /nfs/dbraw/zinc/20/87/37/1135208737.db2.gz CKHAOLVFLRTEFN-SWLSCSKDSA-N 1 0 326.824 3.885 20 5 EHBDRO CC[C@H](c1ccccc1OC)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834342 1135332846 /nfs/dbraw/zinc/33/28/46/1135332846.db2.gz FWOAMEDKWYVDSD-MSOLQXFVSA-N 1 0 344.411 3.720 20 5 EHBDRO Cc1c(C[N@@H+]2C[C@H](C)C[C@H](C(=O)OC(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC001195250332 1135398968 /nfs/dbraw/zinc/39/89/68/1135398968.db2.gz MBUCTEKVNBDKTA-CJNGLKHVSA-N 1 0 348.443 3.703 20 5 EHBDRO O=C(CC[N@@H+]1CCCC2(CCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001196038399 1135511139 /nfs/dbraw/zinc/51/11/39/1135511139.db2.gz ADRCFSDIRFWWRX-UHFFFAOYSA-N 1 0 345.443 3.970 20 5 EHBDRO COC(=O)CC[C@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468856 1135693652 /nfs/dbraw/zinc/69/36/52/1135693652.db2.gz OMFCEDPZEFFEGA-HUUCEWRRSA-N 1 0 334.416 3.629 20 5 EHBDRO CCc1ccc([C@@H](C[NH2+]Cc2cccc([N+](=O)[O-])c2C)N(C)C)cc1 ZINC001198968967 1135870229 /nfs/dbraw/zinc/87/02/29/1135870229.db2.gz LJICPCMWVODRGN-HXUWFJFHSA-N 1 0 341.455 3.858 20 5 EHBDRO C[C@@H](Cc1ccccc1Cl)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000809732342 1135873937 /nfs/dbraw/zinc/87/39/37/1135873937.db2.gz BZQCJFGINLBMGJ-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CNCCC[NH+]1C[C@H](C)C[C@@H](C)C1 ZINC001199329621 1135898401 /nfs/dbraw/zinc/89/84/01/1135898401.db2.gz XFHLEPUDEJFXGD-HUUCEWRRSA-N 1 0 333.476 3.669 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@@H](C2CCOCC2)C1 ZINC001201635032 1136045451 /nfs/dbraw/zinc/04/54/51/1136045451.db2.gz XZUDRUDMSJRXDG-NVXWUHKLSA-N 1 0 348.443 3.678 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@H](OC(C)C)C1(C)C ZINC001201887876 1136070250 /nfs/dbraw/zinc/07/02/50/1136070250.db2.gz DGUPGSHSGKUGAR-SJORKVTESA-N 1 0 336.432 3.675 20 5 EHBDRO CC[C@@H](CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[NH+]1CCCC1 ZINC000811474160 1136095768 /nfs/dbraw/zinc/09/57/68/1136095768.db2.gz VUOGYMVOCWTTCX-ZDUSSCGKSA-N 1 0 346.258 3.866 20 5 EHBDRO CC(C)(C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000776276962 1136130418 /nfs/dbraw/zinc/13/04/18/1136130418.db2.gz MNYMXWOSTMNBSF-QGZVFWFLSA-N 1 0 348.830 3.849 20 5 EHBDRO CC(C)[C@H]1c2ccccc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276665 1136130780 /nfs/dbraw/zinc/13/07/80/1136130780.db2.gz IRXVKSUNGNNAQF-PMACEKPBSA-N 1 0 340.423 3.884 20 5 EHBDRO CC[N@@H+](Cc1cccc(Cl)c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277924 1136130849 /nfs/dbraw/zinc/13/08/49/1136130849.db2.gz QVGNDOKYQUYEKI-KRWDZBQOSA-N 1 0 334.803 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279702 1136134776 /nfs/dbraw/zinc/13/47/76/1136134776.db2.gz XENNFJNEXIYUNE-ROUUACIJSA-N 1 0 330.359 3.604 20 5 EHBDRO C[C@@H](c1ccccc1)[C@@H](O)C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000850411564 1136252987 /nfs/dbraw/zinc/25/29/87/1136252987.db2.gz FPXNOEVYJQMOJB-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)c1ccc(C)cc1 ZINC000850468337 1136265144 /nfs/dbraw/zinc/26/51/44/1136265144.db2.gz BOMPPMDNXVNXJC-CKFHNAJUSA-N 1 0 344.411 3.685 20 5 EHBDRO Cc1ccc(C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)cc1C ZINC000776584684 1136442359 /nfs/dbraw/zinc/44/23/59/1136442359.db2.gz ORUNKPLGJWDNEY-FQEVSTJZSA-N 1 0 340.423 3.910 20 5 EHBDRO CC(C)[N@@H+](Cc1ccccc1F)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580024 1136444949 /nfs/dbraw/zinc/44/49/49/1136444949.db2.gz QPEQVZPXECSFCO-GOSISDBHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC000852446602 1136456574 /nfs/dbraw/zinc/45/65/74/1136456574.db2.gz KPUVLNYUFWGKRN-QZTJIDSGSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@@H]([NH2+]CCCO[C@H](C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554509 1136609836 /nfs/dbraw/zinc/60/98/36/1136609836.db2.gz AXNXQLBBGFINOV-HUUCEWRRSA-N 1 0 343.427 3.996 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc2cccnc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815556818 1136610129 /nfs/dbraw/zinc/61/01/29/1136610129.db2.gz FXEJDJQJGAPEFG-ZDUSSCGKSA-N 1 0 336.395 3.619 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2cc(F)ccc12)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571649 1136617982 /nfs/dbraw/zinc/61/79/82/1136617982.db2.gz JAKBUAOQHUGBNP-LLVKDONJSA-N 1 0 342.374 3.691 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2cnn(C)c2)s1)c1cccc([N+](=O)[O-])c1 ZINC000509476910 1136625500 /nfs/dbraw/zinc/62/55/00/1136625500.db2.gz QKSSWMJEPNPKMX-LBPRGKRZSA-N 1 0 342.424 3.908 20 5 EHBDRO CCCCOc1cccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818960196 1136891395 /nfs/dbraw/zinc/89/13/95/1136891395.db2.gz DVUGZQJAJXEFOJ-LJQANCHMSA-N 1 0 344.411 3.597 20 5 EHBDRO CC(C)(C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000819012939 1136900499 /nfs/dbraw/zinc/90/04/99/1136900499.db2.gz MFORBKLHRALQAS-QGZVFWFLSA-N 1 0 348.830 3.849 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+]1CC[C@@H](Oc2ccc(C3CC3)cn2)C1 ZINC000858013480 1136930630 /nfs/dbraw/zinc/93/06/30/1136930630.db2.gz CYIMXRYHFJUGAR-QGZVFWFLSA-N 1 0 339.395 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@H]2CCC[C@H]2c2ccccc2)cc1 ZINC000819340212 1136932698 /nfs/dbraw/zinc/93/26/98/1136932698.db2.gz SXMNPHMNWVZHPT-YZGWKJHDSA-N 1 0 340.423 3.802 20 5 EHBDRO Cc1ccc(O[C@@H]2CC[N@@H+]([C@H](C)c3ccccc3[N+](=O)[O-])C2)nc1 ZINC000858035860 1136934504 /nfs/dbraw/zinc/93/45/04/1136934504.db2.gz LVVHUJVNYVJDLT-HUUCEWRRSA-N 1 0 327.384 3.513 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F)C1(CO)CCCC1 ZINC001170929857 1136950351 /nfs/dbraw/zinc/95/03/51/1136950351.db2.gz NWIZSMIMPQJLQW-MRXNPFEDSA-N 1 0 342.386 3.540 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2cc(Cl)c(F)cc2[N+](=O)[O-])C1 ZINC000820670576 1137000308 /nfs/dbraw/zinc/00/03/08/1137000308.db2.gz RFEFBIPEOMDFIZ-NSHDSACASA-N 1 0 329.803 3.555 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000780764768 1137017402 /nfs/dbraw/zinc/01/74/02/1137017402.db2.gz QLBRYPXKDTYYPJ-XJKSGUPXSA-N 1 0 330.432 3.690 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000824555445 1137142672 /nfs/dbraw/zinc/14/26/72/1137142672.db2.gz UPVNCJIQSGQOIA-SNVBAGLBSA-N 1 0 340.729 3.695 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCO1 ZINC000824799380 1137152712 /nfs/dbraw/zinc/15/27/12/1137152712.db2.gz NFBYTSLDLSPAGB-BBRMVZONSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C2CCC(OC(F)F)CC2)c1 ZINC000825143587 1137167113 /nfs/dbraw/zinc/16/71/13/1137167113.db2.gz GVTMKDACSQAZNA-UHFFFAOYSA-N 1 0 334.750 3.888 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@]3(CCSC3)C2)cc1Cl ZINC000825215480 1137169133 /nfs/dbraw/zinc/16/91/33/1137169133.db2.gz PLGIOYFMQGWUKH-HNNXBMFYSA-N 1 0 326.849 3.967 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CCc3ccc(Cl)cc32)c1 ZINC000863587733 1137193035 /nfs/dbraw/zinc/19/30/35/1137193035.db2.gz SDSDUVPWCZRZAC-IAGOWNOFSA-N 1 0 332.787 3.559 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000120481774 1137275912 /nfs/dbraw/zinc/27/59/12/1137275912.db2.gz PDQDPJRXHWBGLF-YVEFUNNKSA-N 1 0 334.803 3.941 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@]12C[C@H]1CCCC2 ZINC000865702942 1137305233 /nfs/dbraw/zinc/30/52/33/1137305233.db2.gz AQZFKBFJNFNNMW-PNPHSEOMSA-N 1 0 332.400 3.520 20 5 EHBDRO Cc1cn2c(C[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)c(C)nc2s1 ZINC000865786495 1137311648 /nfs/dbraw/zinc/31/16/48/1137311648.db2.gz OJAXZQSJGXAQBT-UHFFFAOYSA-N 1 0 330.413 3.519 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)[C@](C)(O)c1ccccc1 ZINC000846038767 1137328895 /nfs/dbraw/zinc/32/88/95/1137328895.db2.gz QEZUOPLPEDQWPQ-PXAZEXFGSA-N 1 0 334.803 3.634 20 5 EHBDRO COc1ccc(C[NH2+]CCC[C@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC000846103285 1137335473 /nfs/dbraw/zinc/33/54/73/1137335473.db2.gz VYFBMEQAXOTOCU-NSHDSACASA-N 1 0 333.215 3.667 20 5 EHBDRO COc1cccc2c1OCCC[C@H]2[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000866250413 1137339122 /nfs/dbraw/zinc/33/91/22/1137339122.db2.gz ZYNBIRPEJKWCCO-MRXNPFEDSA-N 1 0 328.368 3.607 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](c1cccnc1)C1CC1 ZINC000866312632 1137344731 /nfs/dbraw/zinc/34/47/31/1137344731.db2.gz PHJZMFOJXLNVKV-KZULUSFZSA-N 1 0 329.375 3.801 20 5 EHBDRO CC(C)C[C@@H]1C[C@@H]([NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866326049 1137345736 /nfs/dbraw/zinc/34/57/36/1137345736.db2.gz HUHNBDGDSVHVMI-XOKHGSTOSA-N 1 0 338.423 3.848 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@@H](CC(C)(C)C)C1 ZINC001171227663 1137353991 /nfs/dbraw/zinc/35/39/91/1137353991.db2.gz ANIDFVWVHQMOPH-AWEZNQCLSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC12CCOCC2 ZINC000866528892 1137361451 /nfs/dbraw/zinc/36/14/51/1137361451.db2.gz JZWWLRHKCSKTEZ-NVXWUHKLSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1cccc(F)n1 ZINC000773092190 1137464610 /nfs/dbraw/zinc/46/46/10/1137464610.db2.gz ZMUOVSBHWZSAFF-CZUORRHYSA-N 1 0 329.375 3.630 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@]1(O)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000773097634 1137465431 /nfs/dbraw/zinc/46/54/31/1137465431.db2.gz HELPCCXZLHODQT-WOJBJXKFSA-N 1 0 340.423 3.860 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171805315 1137513397 /nfs/dbraw/zinc/51/33/97/1137513397.db2.gz RLTKFOMMLZUHES-INIZCTEOSA-N 1 0 345.443 3.744 20 5 EHBDRO CCC[NH+]1CCC(N[C@@H](C)c2cc([N+](=O)[O-])ccc2SC)CC1 ZINC000872018102 1137564702 /nfs/dbraw/zinc/56/47/02/1137564702.db2.gz IKDVWUOQOBXKAW-ZDUSSCGKSA-N 1 0 337.489 3.842 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017572 1137564744 /nfs/dbraw/zinc/56/47/44/1137564744.db2.gz CJEZCOYSCCEICF-FZMZJTMJSA-N 1 0 337.420 3.749 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCCc2c1cnn2C ZINC000872021375 1137565215 /nfs/dbraw/zinc/56/52/15/1137565215.db2.gz OQRMTYYFUGJCPI-XHDPSFHLSA-N 1 0 346.456 3.778 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2c(F)cccc2[N+](=O)[O-])c1OC ZINC000872026175 1137565901 /nfs/dbraw/zinc/56/59/01/1137565901.db2.gz YPZYCQWNRVXLAT-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC[NH+](CC2CC2)CC1 ZINC000872025908 1137565930 /nfs/dbraw/zinc/56/59/30/1137565930.db2.gz VOPZPBHVDHVLST-ZDUSSCGKSA-N 1 0 349.500 3.842 20 5 EHBDRO C[C@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053408 1137568250 /nfs/dbraw/zinc/56/82/50/1137568250.db2.gz JXIDURYROWBJOG-LBPRGKRZSA-N 1 0 340.395 3.897 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@H](C2CC2)C1 ZINC000872060807 1137568845 /nfs/dbraw/zinc/56/88/45/1137568845.db2.gz ABDVUMCBDLBNHG-RBOXIYTFSA-N 1 0 336.457 3.925 20 5 EHBDRO C[C@H]1CCCc2ccccc2[C@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877373595 1137674798 /nfs/dbraw/zinc/67/47/98/1137674798.db2.gz FCECDFSYWRBJQK-FGAHCWIFSA-N 1 0 340.427 3.798 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]CCSCCC(F)(F)F)nc2c1 ZINC000877729872 1137686903 /nfs/dbraw/zinc/68/69/03/1137686903.db2.gz DNFRYWWNSQALBF-UHFFFAOYSA-N 1 0 349.334 3.511 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1-c1nnc(C[N@@H+]2CC[C@H](C3CC3)C2)o1 ZINC000878323657 1137710974 /nfs/dbraw/zinc/71/09/74/1137710974.db2.gz BASXXAOKQGVUTE-NSHDSACASA-N 1 0 348.790 3.530 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCCC3(CCCC3)C2)o1 ZINC000878480409 1137717558 /nfs/dbraw/zinc/71/75/58/1137717558.db2.gz CMRAAKCISNKZJI-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(CN2CCC(C3CCC3)CC2)o1 ZINC000878914696 1137731962 /nfs/dbraw/zinc/73/19/62/1137731962.db2.gz HRYVEIOKJQHJQT-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878995707 1137734725 /nfs/dbraw/zinc/73/47/25/1137734725.db2.gz UXGCDPWXOYHXDY-QWHCGFSZSA-N 1 0 330.388 3.798 20 5 EHBDRO C[N@@H+](Cc1ccc(Cl)c(F)c1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000127647379 1137744285 /nfs/dbraw/zinc/74/42/85/1137744285.db2.gz YPKBDQCXWQOYMG-INIZCTEOSA-N 1 0 338.766 3.553 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1Cc2cccnc2N2CCC[C@H]2C1 ZINC000879688730 1137755369 /nfs/dbraw/zinc/75/53/69/1137755369.db2.gz CSCUYTHNNQNJOS-KSSFIOAISA-N 1 0 338.411 3.535 20 5 EHBDRO C[C@H](NCc1ccccc1[N+](=O)[O-])c1ccc(C(F)(F)F)nc1 ZINC000880100290 1137768100 /nfs/dbraw/zinc/76/81/00/1137768100.db2.gz YUCHMMIMFZFENE-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO C[N@H+](Cc1ccccc1)Cc1ccc(Br)c([N+](=O)[O-])c1 ZINC000129270523 1137816170 /nfs/dbraw/zinc/81/61/70/1137816170.db2.gz PZQMLDXSTVIWCY-UHFFFAOYSA-N 1 0 335.201 3.989 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ccnc(F)c2[N+](=O)[O-])CC1 ZINC000881988351 1137818277 /nfs/dbraw/zinc/81/82/77/1137818277.db2.gz CHPSUEZFIWQMAR-ZDUSSCGKSA-N 1 0 344.390 3.766 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCC2(COC2)CC1 ZINC000883382578 1137858482 /nfs/dbraw/zinc/85/84/82/1137858482.db2.gz JLGSAOCOIWPQDC-GFCCVEGCSA-N 1 0 336.457 3.927 20 5 EHBDRO C[C@@](CO)(C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000348253306 1137881242 /nfs/dbraw/zinc/88/12/42/1137881242.db2.gz DMQLSIHOZRZCDP-PMACEKPBSA-N 1 0 340.423 3.512 20 5 EHBDRO C[NH+](C)C[C@@H](NCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000282865592 1137889777 /nfs/dbraw/zinc/88/97/77/1137889777.db2.gz QQTBWHXXMDYZOK-QGZVFWFLSA-N 1 0 333.819 3.641 20 5 EHBDRO COc1cc(C[NH2+]C[C@@H]2C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000111398369 1137904457 /nfs/dbraw/zinc/90/44/57/1137904457.db2.gz LLEXHFORBWKLRT-HOCLYGCPSA-N 1 0 342.395 3.505 20 5 EHBDRO CC(C)[C@@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000117432287 1137930161 /nfs/dbraw/zinc/93/01/61/1137930161.db2.gz GGIQPPGTYDMNQX-HNNXBMFYSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802706 1137960887 /nfs/dbraw/zinc/96/08/87/1137960887.db2.gz CWZZOVNBHGBCGR-HKUYNNGSSA-N 1 0 344.386 3.822 20 5 EHBDRO CC[C@@H]1c2ccsc2CC[N@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136930116 1138044304 /nfs/dbraw/zinc/04/43/04/1138044304.db2.gz RYHYJPWCHHMWNE-CVEARBPZSA-N 1 0 332.425 3.699 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000068486885 1138085307 /nfs/dbraw/zinc/08/53/07/1138085307.db2.gz FZPFCKCKSRZDRT-MRXNPFEDSA-N 1 0 333.435 3.554 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@H]2C)O1)c1cccc([N+](=O)[O-])c1 ZINC000886771910 1138137638 /nfs/dbraw/zinc/13/76/38/1138137638.db2.gz PSKYXSHSYBZREI-QYESJMSASA-N 1 0 348.443 3.608 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)cc1F ZINC000282976709 1138244895 /nfs/dbraw/zinc/24/48/95/1138244895.db2.gz DDEHQFNCOQJSRO-UHFFFAOYSA-N 1 0 348.349 3.669 20 5 EHBDRO CC1(C)CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000127084623 1138346435 /nfs/dbraw/zinc/34/64/35/1138346435.db2.gz WDFKKSYNUJXCKQ-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000264300682 1138467946 /nfs/dbraw/zinc/46/79/46/1138467946.db2.gz VLPWEPZQMFZOPV-AWEZNQCLSA-N 1 0 330.388 3.655 20 5 EHBDRO O=c1cc(C[NH2+][C@H]2CCC[C@@H]3OCC[C@@H]32)c2c(ccc3ccccc32)o1 ZINC000151136454 1139011635 /nfs/dbraw/zinc/01/16/35/1139011635.db2.gz UQYFHDQTWLIEMA-QYZOEREBSA-N 1 0 349.430 3.993 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256506 1139128935 /nfs/dbraw/zinc/12/89/35/1139128935.db2.gz FOXYEKUQOTVUPI-SJCJKPOMSA-N 1 0 348.374 3.517 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256599 1139129011 /nfs/dbraw/zinc/12/90/11/1139129011.db2.gz FOXYEKUQOTVUPI-SJKOYZFVSA-N 1 0 348.374 3.517 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000153607134 1139144808 /nfs/dbraw/zinc/14/48/08/1139144808.db2.gz YQPOBXYELWYWTR-HOTGVXAUSA-N 1 0 349.475 3.765 20 5 EHBDRO Cc1ccc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000888984755 1139153932 /nfs/dbraw/zinc/15/39/32/1139153932.db2.gz YEVNMHXIVDPSMA-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO O=C(Nc1cccc([N+](=O)[O-])c1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000176248363 1139547349 /nfs/dbraw/zinc/54/73/49/1139547349.db2.gz MPQUVKAKWCXWMK-UHFFFAOYSA-N 1 0 346.431 3.513 20 5 EHBDRO CCCO[C@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177064670 1139595166 /nfs/dbraw/zinc/59/51/66/1139595166.db2.gz IQOLHRSGUBKRQP-AWEZNQCLSA-N 1 0 333.388 3.517 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCC[C@H]([S@@](=O)CC)C1)c1cccc([N+](=O)[O-])c1 ZINC000178331930 1139687793 /nfs/dbraw/zinc/68/77/93/1139687793.db2.gz PKXXTRZGILAMGH-VMIQBGAZSA-N 1 0 338.473 3.715 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc(OC)c(O)c2)cc1[N+](=O)[O-] ZINC000179416466 1139755875 /nfs/dbraw/zinc/75/58/75/1139755875.db2.gz NLWFYVJKNJSDQV-GFCCVEGCSA-N 1 0 346.383 3.559 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000181809218 1139933152 /nfs/dbraw/zinc/93/31/52/1139933152.db2.gz YWOJLRMOXDHMAD-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)c2cc([N+](=O)[O-])ccc2C)ccc1O ZINC000182747627 1139989783 /nfs/dbraw/zinc/98/97/83/1139989783.db2.gz JMRRIISHKBMBTK-ZDUSSCGKSA-N 1 0 330.384 3.810 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2ccc(C(C)(C)O)cc2)cccc1[N+](=O)[O-] ZINC000186618056 1140213508 /nfs/dbraw/zinc/21/35/08/1140213508.db2.gz ZZZDBRBFGLDSDL-AWEZNQCLSA-N 1 0 328.412 3.981 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1-n1cccn1)CCC2 ZINC000192776048 1140550545 /nfs/dbraw/zinc/55/05/45/1140550545.db2.gz NHEVFABUKILYRK-IBGZPJMESA-N 1 0 348.406 3.948 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](CCO)c1ccccc1)CCC2 ZINC000192889891 1140553654 /nfs/dbraw/zinc/55/36/54/1140553654.db2.gz ZYBKDRGJLNGLGA-YLJYHZDGSA-N 1 0 340.423 3.728 20 5 EHBDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192883094 1140554237 /nfs/dbraw/zinc/55/42/37/1140554237.db2.gz QLRMHLYFSGBNGL-BBATYDOGSA-N 1 0 329.400 3.798 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCO[C@]3(CCSC3)C1)CCC2 ZINC000193030984 1140561225 /nfs/dbraw/zinc/56/12/25/1140561225.db2.gz PILMHKXSNSXJHL-BMGDILEWSA-N 1 0 348.468 3.617 20 5 EHBDRO CC(C)(C)[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000270667644 1141253373 /nfs/dbraw/zinc/25/33/73/1141253373.db2.gz PUWIRWCJPKVYCF-IUODEOHRSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548323 1141394988 /nfs/dbraw/zinc/39/49/88/1141394988.db2.gz UEFSGFWVDMEDHW-XIKOKIGWSA-N 1 0 348.374 3.608 20 5 EHBDRO CCOc1ccc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1OC ZINC000348676187 1141565797 /nfs/dbraw/zinc/56/57/97/1141565797.db2.gz SGBRIOBZLJEWII-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000348753143 1141575542 /nfs/dbraw/zinc/57/55/42/1141575542.db2.gz HXBNLKXPGRVFAN-SJCJKPOMSA-N 1 0 327.384 3.727 20 5 EHBDRO [NH3+]CCN(Cc1cccc(-c2cccnc2)c1)c1ccccc1[N+](=O)[O-] ZINC000348889044 1141604302 /nfs/dbraw/zinc/60/43/02/1141604302.db2.gz BSNVTNJXVPDSEV-UHFFFAOYSA-N 1 0 348.406 3.622 20 5 EHBDRO COCC[N@H+](C/C(C)=C/c1cccc([N+](=O)[O-])c1)Cc1ccccn1 ZINC000349059077 1141630940 /nfs/dbraw/zinc/63/09/40/1141630940.db2.gz BFCNHDZQEILWAF-FOWTUZBSSA-N 1 0 341.411 3.542 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])cn2)C1 ZINC000052244792 214122546 /nfs/dbraw/zinc/12/25/46/214122546.db2.gz OPIZTFNMWWDMJT-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO Cc1cc(N2CC[NH+](C3CCCC3)CC2)nc2ccc([N+](=O)[O-])cc12 ZINC001165029299 721854529 /nfs/dbraw/zinc/85/45/29/721854529.db2.gz JKHPFICJGOHTOD-UHFFFAOYSA-N 1 0 340.427 3.516 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000537986723 1032063382 /nfs/dbraw/zinc/06/33/82/1032063382.db2.gz IWFCUTYTSMQZEY-CZUORRHYSA-N 1 0 336.432 3.585 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNc1ccc(C(C)(C)[NH3+])cc1 ZINC000904470736 1032068327 /nfs/dbraw/zinc/06/83/27/1032068327.db2.gz OXDITOCYPYEJMB-UHFFFAOYSA-N 1 0 329.400 3.799 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)[C@H](C)Cc1ccc(O)cc1 ZINC000536673377 1032106402 /nfs/dbraw/zinc/10/64/02/1032106402.db2.gz PWXPNCUEQLHYEE-CQSZACIVSA-N 1 0 344.411 3.762 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2OC)C2CC2)cc1 ZINC000430217706 1015077394 /nfs/dbraw/zinc/07/73/94/1015077394.db2.gz KEPVSMXEYCLUPD-IBGZPJMESA-N 1 0 342.395 3.853 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339737681 1015610629 /nfs/dbraw/zinc/61/06/29/1015610629.db2.gz MWNBJOQNAIHOPC-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO COc1ccc(COCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000091741139 1015645776 /nfs/dbraw/zinc/64/57/76/1015645776.db2.gz PMWSCCHKGHYZRJ-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CCc3c[nH]nc3C2)c2ccccc2)c1 ZINC000359895407 1015910303 /nfs/dbraw/zinc/91/03/03/1015910303.db2.gz GWIYINRSQQWNND-YLJYHZDGSA-N 1 0 348.406 3.554 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246944342 1016192880 /nfs/dbraw/zinc/19/28/80/1016192880.db2.gz UGWKHLIUPLNLSS-SIXWZSSISA-N 1 0 329.444 3.605 20 5 EHBDRO COCCc1nc(C)c([C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)s1 ZINC000181392499 1016426512 /nfs/dbraw/zinc/42/65/12/1016426512.db2.gz IYPCUJFIDMAOEI-VXGBXAGGSA-N 1 0 349.456 3.960 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCC[C@H]3CCO)s2)cc1 ZINC000189930340 1016780522 /nfs/dbraw/zinc/78/05/22/1016780522.db2.gz TYNAQHVGLPAPHP-GUYCJALGSA-N 1 0 346.452 3.964 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696703 1032156560 /nfs/dbraw/zinc/15/65/60/1032156560.db2.gz FLLPFZSONCFIIE-KRWDZBQOSA-N 1 0 333.476 3.882 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000449077015 1032166800 /nfs/dbraw/zinc/16/68/00/1032166800.db2.gz QOYHBSOOYFERSA-DLBZAZTESA-N 1 0 339.439 3.642 20 5 EHBDRO CC(C)(C)Oc1cc(N2CC[C@@H]([NH+]3CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000484982310 1032198802 /nfs/dbraw/zinc/19/88/02/1032198802.db2.gz BJLAPNMBXUPJPO-MRXNPFEDSA-N 1 0 347.459 3.837 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2nc3ccccc3n2C)cc1[N+](=O)[O-] ZINC000538277518 1032264952 /nfs/dbraw/zinc/26/49/52/1032264952.db2.gz RWNBSGVMUSYZHB-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO COC[C@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000538281148 1032269149 /nfs/dbraw/zinc/26/91/49/1032269149.db2.gz YHZGRJILQCQTPQ-HNNXBMFYSA-N 1 0 338.766 3.865 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCCO)c1ccccc1 ZINC000449162845 1032279070 /nfs/dbraw/zinc/27/90/70/1032279070.db2.gz UGKSJSHBTNVALU-YJBOKZPZSA-N 1 0 328.412 3.629 20 5 EHBDRO COCC[C@@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000278750291 1032338113 /nfs/dbraw/zinc/33/81/13/1032338113.db2.gz NXLKRPVWGIRNRB-IAGOWNOFSA-N 1 0 330.384 3.933 20 5 EHBDRO COc1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1F ZINC000536879394 1032386063 /nfs/dbraw/zinc/38/60/63/1032386063.db2.gz XKDXALCGYWGAGK-QGZVFWFLSA-N 1 0 344.386 3.853 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC000449269766 1032390830 /nfs/dbraw/zinc/39/08/30/1032390830.db2.gz OIODZXCGHNSEFK-MLGOLLRUSA-N 1 0 330.359 3.778 20 5 EHBDRO COC1CCC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000459690107 1032416725 /nfs/dbraw/zinc/41/67/25/1032416725.db2.gz UAWHPHMXQZQMIH-UHFFFAOYSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CC1(c2ccccn2)CCC1 ZINC000449323030 1032435782 /nfs/dbraw/zinc/43/57/82/1032435782.db2.gz RHSWNGJEXQZJHR-HNNXBMFYSA-N 1 0 325.412 3.632 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CC3(CCCCC3)[C@@H]2c2ccccc2)c1 ZINC000459757708 1032451065 /nfs/dbraw/zinc/45/10/65/1032451065.db2.gz UQQJQBYNTVDGBI-SFHVURJKSA-N 1 0 340.427 3.799 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000449350406 1032467018 /nfs/dbraw/zinc/46/70/18/1032467018.db2.gz VUAKPIPSEDEGET-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H]2CSc3ccccc32)cc1[N+](=O)[O-] ZINC000449363875 1032478798 /nfs/dbraw/zinc/47/87/98/1032478798.db2.gz MRHVCUQHFHMCEF-CYBMUJFWSA-N 1 0 330.409 3.583 20 5 EHBDRO COc1cc(C[NH2+]CC[C@@H]2CCc3ccccc32)c([N+](=O)[O-])cc1O ZINC000449379761 1032505555 /nfs/dbraw/zinc/50/55/55/1032505555.db2.gz UNEWKGUKCXOVRP-AWEZNQCLSA-N 1 0 342.395 3.519 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)c2cccc(F)c2)c([N+](=O)[O-])c1 ZINC000537114838 1032525670 /nfs/dbraw/zinc/52/56/70/1032525670.db2.gz LDVOMQCVMRXRBM-UHFFFAOYSA-N 1 0 348.374 3.646 20 5 EHBDRO CC(C)n1nccc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000449501590 1032682588 /nfs/dbraw/zinc/68/25/88/1032682588.db2.gz QCDRCNXWEFFFIL-INIZCTEOSA-N 1 0 328.416 3.752 20 5 EHBDRO N[C@H](C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000414842982 1017233194 /nfs/dbraw/zinc/23/31/94/1017233194.db2.gz ZXVIWHXCRVTCEP-UHOSZYNNSA-N 1 0 339.439 3.596 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]([C@@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000449505096 1032688755 /nfs/dbraw/zinc/68/87/55/1032688755.db2.gz JSIUNAXSRPMTGO-HKUYNNGSSA-N 1 0 332.444 3.605 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CC(C)(C)Oc3ccc(N)cc32)cc1[N+](=O)[O-] ZINC000415020557 1017408223 /nfs/dbraw/zinc/40/82/23/1017408223.db2.gz GUJQENOLOLEFQH-INIZCTEOSA-N 1 0 341.411 3.877 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H](C)C2(C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000177242542 1017602362 /nfs/dbraw/zinc/60/23/62/1017602362.db2.gz SJLTUPUEZRNPAJ-SNVBAGLBSA-N 1 0 344.358 3.825 20 5 EHBDRO COc1ccccc1C1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000544900733 1017736259 /nfs/dbraw/zinc/73/62/59/1017736259.db2.gz OBQCIWKBCLWTSJ-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](CC2CC2)c2ccccc2)c1[N+](=O)[O-] ZINC000892962122 1017988892 /nfs/dbraw/zinc/98/88/92/1017988892.db2.gz JJMCAYQZUTUVAM-MRXNPFEDSA-N 1 0 342.395 3.940 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000118850282 1017992062 /nfs/dbraw/zinc/99/20/62/1017992062.db2.gz DOGKNZKQZLWAKG-WWGRRREGSA-N 1 0 342.399 3.798 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000574200717 1032738649 /nfs/dbraw/zinc/73/86/49/1032738649.db2.gz DWIHXFTUGXXKOY-FLIBITNWSA-N 1 0 325.412 3.806 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H]1c2ccccc2CC12CCOCC2 ZINC000377646448 1018118017 /nfs/dbraw/zinc/11/80/17/1018118017.db2.gz DJUKHIIQNRHHKH-LJQANCHMSA-N 1 0 338.407 3.779 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(CCC[NH3+])CC1CCCC1 ZINC000415588256 1018252012 /nfs/dbraw/zinc/25/20/12/1018252012.db2.gz XOBOZNSSWMKTIW-UHFFFAOYSA-N 1 0 348.447 3.585 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)CCC2 ZINC000377837606 1018454847 /nfs/dbraw/zinc/45/48/47/1018454847.db2.gz PADPXEUYJWROBJ-MRXNPFEDSA-N 1 0 342.443 3.890 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NC1CC[NH+](C2CCC2)CC1 ZINC000593481659 1032775050 /nfs/dbraw/zinc/77/50/50/1032775050.db2.gz LBZVAYOJVWCCGQ-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3[C@@H]4CCC[C@@H]43)o2)c([N+](=O)[O-])c1 ZINC000576293284 1018732310 /nfs/dbraw/zinc/73/23/10/1018732310.db2.gz PBTKQXFROPCPFM-ZSBFGKGUSA-N 1 0 328.368 3.752 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)N(C)CC(=O)Nc1cccc(Cl)c1 ZINC000015548914 1018757745 /nfs/dbraw/zinc/75/77/45/1018757745.db2.gz ZFEATQULNHRVDI-GFCCVEGCSA-N 1 0 347.802 3.880 20 5 EHBDRO C[C@H]([NH2+][C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997944 1018934159 /nfs/dbraw/zinc/93/41/59/1018934159.db2.gz CRGBNLRVOJOOIM-JTDSTZFVSA-N 1 0 339.439 3.908 20 5 EHBDRO CC(C)C(C)(C)C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000275823005 1018995203 /nfs/dbraw/zinc/99/52/03/1018995203.db2.gz FKLGTANDGRXWND-INIZCTEOSA-N 1 0 330.432 3.690 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1ccc(F)cc1F)CCC2 ZINC000447572287 1019083281 /nfs/dbraw/zinc/08/32/81/1019083281.db2.gz BGFVNWAVETWYJH-KRWDZBQOSA-N 1 0 348.349 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN(Cc1cccc(F)c1)C[C@H]1CCCO1 ZINC000050231546 1019364179 /nfs/dbraw/zinc/36/41/79/1019364179.db2.gz ALOQIYDKRFAQBE-GOSISDBHSA-N 1 0 344.386 3.915 20 5 EHBDRO CC1([NH3+])CCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC1 ZINC000592431600 1032835270 /nfs/dbraw/zinc/83/52/70/1032835270.db2.gz NOECVNDKWZIMOU-UHFFFAOYSA-N 1 0 331.441 3.637 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC2(CO)CC2)s1 ZINC000449576546 1032838363 /nfs/dbraw/zinc/83/83/63/1032838363.db2.gz AYPLIFLGABJNSK-UHFFFAOYSA-N 1 0 332.425 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2C2CC2)c2ncccc12 ZINC000433809158 1019636073 /nfs/dbraw/zinc/63/60/73/1019636073.db2.gz IEMMBBMKPRKZGA-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO C[NH2+][C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000261921079 1019716045 /nfs/dbraw/zinc/71/60/45/1019716045.db2.gz BOWVMZNZGRNNNH-GFCCVEGCSA-N 1 0 349.818 3.692 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@H](Cc2nccn2C)C1 ZINC000182970068 1019860509 /nfs/dbraw/zinc/86/05/09/1019860509.db2.gz QJIXSGDGBJIGTC-HZPDHXFCSA-N 1 0 342.443 3.652 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2CCN(c3ccccc3)CC2)cs1 ZINC000280536672 1020465994 /nfs/dbraw/zinc/46/59/94/1020465994.db2.gz IVKJLZNCBUJFCB-UHFFFAOYSA-N 1 0 331.441 3.663 20 5 EHBDRO CCC1(C[NH2+][C@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CCCC1 ZINC000513696722 1020479456 /nfs/dbraw/zinc/47/94/56/1020479456.db2.gz CUHJWSMVZPVUDX-KRWDZBQOSA-N 1 0 342.443 3.978 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169795 1020498880 /nfs/dbraw/zinc/49/88/80/1020498880.db2.gz MGICBUAQHOGBFX-GUYCJALGSA-N 1 0 328.416 3.515 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)C1CC1 ZINC000449629117 1032929484 /nfs/dbraw/zinc/92/94/84/1032929484.db2.gz KBUXFAKJJGHEIC-ZBEGNZNMSA-N 1 0 347.440 3.621 20 5 EHBDRO CCC(CC)[N@H+](CC)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000518432820 1021179048 /nfs/dbraw/zinc/17/90/48/1021179048.db2.gz GJSIDGDOXUAXOK-UHFFFAOYSA-N 1 0 327.812 3.697 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000426296733 1021199946 /nfs/dbraw/zinc/19/99/46/1021199946.db2.gz SXDUSVQPEIWOBX-DZGCQCFKSA-N 1 0 329.375 3.663 20 5 EHBDRO CC[C@H]([NH2+]CCc1nnc(C(C)C)s1)c1cccc([N+](=O)[O-])c1 ZINC000426300741 1021210598 /nfs/dbraw/zinc/21/05/98/1021210598.db2.gz IXABJDRLIVCCIX-AWEZNQCLSA-N 1 0 334.445 3.853 20 5 EHBDRO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000518606313 1021367522 /nfs/dbraw/zinc/36/75/22/1021367522.db2.gz JWACGEYOHVPWHR-TULSNZSCSA-N 1 0 328.343 3.859 20 5 EHBDRO C[N@@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCC1CCCCC1 ZINC000507581758 1021373226 /nfs/dbraw/zinc/37/32/26/1021373226.db2.gz DFNGUCRWTACRFN-UHFFFAOYSA-N 1 0 333.432 3.826 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3N(C)C2)cc1[N+](=O)[O-] ZINC000437074592 1021526178 /nfs/dbraw/zinc/52/61/78/1021526178.db2.gz DEBPLANPCNMCMX-CVEARBPZSA-N 1 0 339.439 3.863 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1c(OC)cccc1[N+](=O)[O-])c1ccco1 ZINC000519619946 1021577619 /nfs/dbraw/zinc/57/76/19/1021577619.db2.gz XFRJDQVDIRBGQS-CQSZACIVSA-N 1 0 333.388 3.691 20 5 EHBDRO COc1ccc([C@@H](OC)[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000602583748 1033003054 /nfs/dbraw/zinc/00/30/54/1033003054.db2.gz SJSNCDYUZHHKAK-KUHUBIRLSA-N 1 0 344.411 3.512 20 5 EHBDRO O=C(Nc1ccc(-n2ccnc2)cc1)c1ccc([N+](=O)[O-])cc1Cl ZINC000023889602 1021812757 /nfs/dbraw/zinc/81/27/57/1021812757.db2.gz DFOMCXDMIKEUQZ-UHFFFAOYSA-N 1 0 342.742 3.686 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000473608691 1021874927 /nfs/dbraw/zinc/87/49/27/1021874927.db2.gz NBOMRWLGYNOHPV-UHFFFAOYSA-N 1 0 347.459 3.713 20 5 EHBDRO CC1CCC([N@H+](C)Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000045913742 1021916506 /nfs/dbraw/zinc/91/65/06/1021916506.db2.gz NZDBADUSZIFBMJ-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCOc1ccc(F)cc1F ZINC000579251559 1022211743 /nfs/dbraw/zinc/21/17/43/1022211743.db2.gz ABPSWTBPUYNIIF-OAHLLOKOSA-N 1 0 334.322 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3C[C@H](c4ccc(F)cc4)C3)nc2c1 ZINC000602671644 1033049527 /nfs/dbraw/zinc/04/95/27/1033049527.db2.gz WLHVZTNLVOHVJM-MQMHXKEQSA-N 1 0 341.342 3.911 20 5 EHBDRO CCC[C@@]1(CO)CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602672659 1033052652 /nfs/dbraw/zinc/05/26/52/1033052652.db2.gz ZTGIEJXEMAOPMQ-OAHLLOKOSA-N 1 0 346.349 3.598 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226127 1022586927 /nfs/dbraw/zinc/58/69/27/1022586927.db2.gz WFRQDXZGIGODBT-CHWSQXEVSA-N 1 0 342.436 3.849 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000266489169 1022661259 /nfs/dbraw/zinc/66/12/59/1022661259.db2.gz RZVXFNKPFUNTEN-OAHLLOKOSA-N 1 0 325.412 3.914 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000430821825 1022736724 /nfs/dbraw/zinc/73/67/24/1022736724.db2.gz OKJHNQTXJQWZGZ-YJBOKZPZSA-N 1 0 347.459 3.534 20 5 EHBDRO COc1cccc2c1CC[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])C2 ZINC000426056717 1022774391 /nfs/dbraw/zinc/77/43/91/1022774391.db2.gz BUCZRVKMASDLBH-UKRRQHHQSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@@H]2/C=C/c2ccccc2)c1 ZINC000438563096 1022792661 /nfs/dbraw/zinc/79/26/61/1022792661.db2.gz SAFXHYSZZXACHI-DOJUMQAQSA-N 1 0 340.427 3.749 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932539 1033087177 /nfs/dbraw/zinc/08/71/77/1033087177.db2.gz FDHXMDMTPRCGKJ-IBGZPJMESA-N 1 0 342.395 3.819 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)N(C)c1ccccc1 ZINC000509573969 1023072533 /nfs/dbraw/zinc/07/25/33/1023072533.db2.gz WNUIIDVDAKTBIK-OAHLLOKOSA-N 1 0 343.427 3.608 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)C[C@H]1OCCc2ccccc21 ZINC000507233861 1023206925 /nfs/dbraw/zinc/20/69/25/1023206925.db2.gz PPZXYOSDYYOSFS-IFXJQAMLSA-N 1 0 326.396 3.902 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](CCCO)c2ccccc2)ccc1[N+](=O)[O-] ZINC000276892517 1023314965 /nfs/dbraw/zinc/31/49/65/1023314965.db2.gz KLMFIADRGDUNOI-QGZVFWFLSA-N 1 0 344.411 3.597 20 5 EHBDRO CC[C@H](C)C[N@H+](C)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000247494864 1023352037 /nfs/dbraw/zinc/35/20/37/1023352037.db2.gz HIZJUVAOCIPLJF-WDEREUQCSA-N 1 0 327.812 3.553 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1C)c1ccsc1 ZINC000341913001 1023673437 /nfs/dbraw/zinc/67/34/37/1023673437.db2.gz AWJZMQZHBAYRPV-HNNXBMFYSA-N 1 0 334.445 3.855 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CCOCC2)CC1 ZINC000341988536 1023742283 /nfs/dbraw/zinc/74/22/83/1023742283.db2.gz IQKQLFZUWDODPW-UHFFFAOYSA-N 1 0 348.443 3.775 20 5 EHBDRO Cn1cc(C[NH2+]C2(c3ccc(Cl)cc3)CCCCC2)c([N+](=O)[O-])n1 ZINC000602788969 1033161891 /nfs/dbraw/zinc/16/18/91/1033161891.db2.gz UWHJDLPCXNOWGV-UHFFFAOYSA-N 1 0 348.834 3.931 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2Cc3ccccc3C[C@H]2c2ccccc2)n1 ZINC000176270071 1023949164 /nfs/dbraw/zinc/94/91/64/1023949164.db2.gz MSIRLEVTEFGLMH-IBGZPJMESA-N 1 0 348.406 3.591 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)cc1[N+](=O)[O-] ZINC000449764286 1033176497 /nfs/dbraw/zinc/17/64/97/1033176497.db2.gz AIBPMFIJCRLVGO-KRWDZBQOSA-N 1 0 346.452 3.958 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)[C@@H]1CCC[C@H](C)C1 ZINC000449769109 1033184603 /nfs/dbraw/zinc/18/46/03/1033184603.db2.gz UKYAOSKGIQBICY-MELADBBJSA-N 1 0 334.416 3.766 20 5 EHBDRO C[C@H](C[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1)c1ccccc1 ZINC000522664119 1024157373 /nfs/dbraw/zinc/15/73/73/1024157373.db2.gz JHMUDXNISKBJAE-MRXNPFEDSA-N 1 0 325.412 3.521 20 5 EHBDRO CCOC[C@H]([NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000474097935 1024163354 /nfs/dbraw/zinc/16/33/54/1024163354.db2.gz SXNHWDHDNUPQLN-SZMVWBNQSA-N 1 0 334.460 3.957 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000544356828 1024177676 /nfs/dbraw/zinc/17/76/76/1024177676.db2.gz BHWGOPILKABDPG-KUHUBIRLSA-N 1 0 346.427 3.838 20 5 EHBDRO CC(C)[N@@H+]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000514186232 1024205666 /nfs/dbraw/zinc/20/56/66/1024205666.db2.gz IKOQZSVYYUQYPC-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO Cc1noc([C@H]2CCC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)n1 ZINC000091832829 1024387853 /nfs/dbraw/zinc/38/78/53/1024387853.db2.gz AXDSJGADBYJSJJ-HNNXBMFYSA-N 1 0 344.415 3.789 20 5 EHBDRO COCc1csc(C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000895377420 1024424850 /nfs/dbraw/zinc/42/48/50/1024424850.db2.gz MUKVHNAWEWPEBA-UHFFFAOYSA-N 1 0 326.805 3.746 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H](c1ccc(C)cc1)[NH+](C)C ZINC000474156068 1024447426 /nfs/dbraw/zinc/44/74/26/1024447426.db2.gz XWUBPLGYUMLLTI-LJQANCHMSA-N 1 0 343.427 3.764 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000053123328 1024515299 /nfs/dbraw/zinc/51/52/99/1024515299.db2.gz NAEMLCQTFGQXEJ-UHFFFAOYSA-N 1 0 341.839 3.991 20 5 EHBDRO C[C@H](Nc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000383927372 1024634598 /nfs/dbraw/zinc/63/45/98/1024634598.db2.gz RZLKOBUNVLYCMS-DOTOQJQBSA-N 1 0 325.412 3.917 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc(C)cc2OC)cc1[N+](=O)[O-] ZINC000537970353 1024797315 /nfs/dbraw/zinc/79/73/15/1024797315.db2.gz RJJNSEHBFYBJFF-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602887555 1033236070 /nfs/dbraw/zinc/23/60/70/1033236070.db2.gz NUJDRFXTUXIEIC-QGZVFWFLSA-N 1 0 348.406 3.570 20 5 EHBDRO CN(Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C1CC[NH2+]CC1 ZINC000435375091 1024843645 /nfs/dbraw/zinc/84/36/45/1024843645.db2.gz ZNRKVZVAOJYRSP-UHFFFAOYSA-N 1 0 349.818 3.692 20 5 EHBDRO CC(C)(C)[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001168403615 1033252452 /nfs/dbraw/zinc/25/24/52/1033252452.db2.gz OKKXDRKYBTXSNA-NSHDSACASA-N 1 0 339.823 3.555 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cc2ccc(F)cc2[nH]1 ZINC000515332110 1025173995 /nfs/dbraw/zinc/17/39/95/1025173995.db2.gz QIJUVEFJMUUOBB-UHFFFAOYSA-N 1 0 327.359 3.890 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCc1ccc(F)c(F)c1F ZINC000544366676 1025201675 /nfs/dbraw/zinc/20/16/75/1025201675.db2.gz YUACYNZAAKNPTH-HWKANZROSA-N 1 0 336.313 3.858 20 5 EHBDRO CCN1CCCC[C@@H]1C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000521175844 1025248384 /nfs/dbraw/zinc/24/83/84/1025248384.db2.gz YWGYTLLQRQNCTP-QGZVFWFLSA-N 1 0 343.427 3.819 20 5 EHBDRO C[C@@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467886 1025465971 /nfs/dbraw/zinc/46/59/71/1025465971.db2.gz OHVOOXVKXRUJFQ-NEPJUHHUSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(CC(F)(F)F)CC1 ZINC000515684441 1025472256 /nfs/dbraw/zinc/47/22/56/1025472256.db2.gz OPEDOXCZILYFSC-LBPRGKRZSA-N 1 0 345.365 3.581 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1C[C@H]2OCCC[C@H]12 ZINC000439060397 1025517175 /nfs/dbraw/zinc/51/71/75/1025517175.db2.gz VAIPYOKVHSEROB-IXYNUQLISA-N 1 0 336.457 3.623 20 5 EHBDRO COC(=O)C(C)(C)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000611406440 1025607127 /nfs/dbraw/zinc/60/71/27/1025607127.db2.gz XXHDTGDSAUWPOU-KRWDZBQOSA-N 1 0 342.395 3.625 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000121056481 1025613217 /nfs/dbraw/zinc/61/32/17/1025613217.db2.gz BCTYOOSJPPJNRL-HOCLYGCPSA-N 1 0 341.411 3.971 20 5 EHBDRO C[C@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1cccc([N+](=O)[O-])c1 ZINC000119751258 1025889919 /nfs/dbraw/zinc/88/99/19/1025889919.db2.gz RRUSPUSPTJUWBB-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2ccco2)N2CCCC2)c([N+](=O)[O-])c1 ZINC000023386313 1025994626 /nfs/dbraw/zinc/99/46/26/1025994626.db2.gz AYIFDILOIOMQJT-KRWDZBQOSA-N 1 0 343.383 3.639 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1[C@@H]2CCCO[C@H]2C1(C)C ZINC000451480214 1025997549 /nfs/dbraw/zinc/99/75/49/1025997549.db2.gz PQUIVNNTUQBODP-CGTJXYLNSA-N 1 0 348.443 3.675 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@H+]2CC=C(c3cccc4ccccc43)CC2)n1 ZINC000478437790 1026102497 /nfs/dbraw/zinc/10/24/97/1026102497.db2.gz VLSJQJOLNSZNLF-UHFFFAOYSA-N 1 0 348.406 3.734 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCCO3)o2)c([N+](=O)[O-])c1 ZINC000237429181 1026229051 /nfs/dbraw/zinc/22/90/51/1026229051.db2.gz NBDKVIJRANBXJV-AWEZNQCLSA-N 1 0 346.383 3.522 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cn2cc(Cl)ccc2n1 ZINC000511123753 1026245376 /nfs/dbraw/zinc/24/53/76/1026245376.db2.gz RJPBBAYNEKMDRJ-UHFFFAOYSA-N 1 0 344.802 3.570 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475287495 1026443059 /nfs/dbraw/zinc/44/30/59/1026443059.db2.gz VIJBSSWDMPGSAZ-GOSISDBHSA-N 1 0 330.384 3.856 20 5 EHBDRO CO[C@@]1(C)CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000475287496 1026443332 /nfs/dbraw/zinc/44/33/32/1026443332.db2.gz VIJBSSWDMPGSAZ-SFHVURJKSA-N 1 0 330.384 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3ccccc3F)CC2)cc1 ZINC000523016918 1026450307 /nfs/dbraw/zinc/45/03/07/1026450307.db2.gz LQIZGLDENXNHQL-UHFFFAOYSA-N 1 0 344.386 3.992 20 5 EHBDRO CC(C)(C)C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000452067675 1026460864 /nfs/dbraw/zinc/46/08/64/1026460864.db2.gz ANXGCSRRGIAFLO-CYBMUJFWSA-N 1 0 344.415 3.903 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@@H](c1ccccc1)N(C)C ZINC000186319837 1026486426 /nfs/dbraw/zinc/48/64/26/1026486426.db2.gz AVCUQWUMTZAXCC-KHYOSLBOSA-N 1 0 327.428 3.937 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000582526068 1026499155 /nfs/dbraw/zinc/49/91/55/1026499155.db2.gz GXSKEPVLCMAMLE-QGZVFWFLSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000511156700 1026560966 /nfs/dbraw/zinc/56/09/66/1026560966.db2.gz ACZBOZVJDITGQB-MRXNPFEDSA-N 1 0 347.462 3.850 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000479851755 1026854697 /nfs/dbraw/zinc/85/46/97/1026854697.db2.gz NQIUNFWYBXHKRM-SFHVURJKSA-N 1 0 341.411 3.902 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H]2CCC[N@H+](CC(C)C)C2)c([N+](=O)[O-])c1 ZINC000480080371 1026982541 /nfs/dbraw/zinc/98/25/41/1026982541.db2.gz GFGLCKFGCAXABE-HNNXBMFYSA-N 1 0 347.459 3.967 20 5 EHBDRO CCOc1cccc(N2CCC(C[N@H+](C)C(C)C)CC2)c1[N+](=O)[O-] ZINC000545864984 1027111361 /nfs/dbraw/zinc/11/13/61/1027111361.db2.gz NKILQSKNTQUALL-UHFFFAOYSA-N 1 0 335.448 3.550 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](Cc1ccccc1)C(C)C ZINC000028842940 1027119269 /nfs/dbraw/zinc/11/92/69/1027119269.db2.gz ZCGUZEKFTSHFNU-UHFFFAOYSA-N 1 0 341.411 3.752 20 5 EHBDRO COc1ccc(OC)c(CC[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000531700316 1027221458 /nfs/dbraw/zinc/22/14/58/1027221458.db2.gz IAWUYNNCYSMQSD-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CCC[C@H]([NH2+]CC1(O)Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000531720923 1027270070 /nfs/dbraw/zinc/27/00/70/1027270070.db2.gz VXVBGBOFPLSVIH-IBGZPJMESA-N 1 0 340.423 3.556 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)Cc1ccsc1 ZINC000187800853 1027273433 /nfs/dbraw/zinc/27/34/33/1027273433.db2.gz KLZABSOQGHUWGG-ZDUSSCGKSA-N 1 0 347.440 3.548 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@@H](c2ccccc2)c2ccccn2)c1 ZINC000076581094 1027303061 /nfs/dbraw/zinc/30/30/61/1027303061.db2.gz FIGRDIBWHKQPAM-FQEVSTJZSA-N 1 0 349.390 3.748 20 5 EHBDRO CN(C)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccsc1 ZINC000783598657 1027717365 /nfs/dbraw/zinc/71/73/65/1027717365.db2.gz VLCOCTWTNXKHMZ-OAHLLOKOSA-N 1 0 339.848 3.702 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCc1ccc(O)cc1 ZINC000513790218 1027839945 /nfs/dbraw/zinc/83/99/45/1027839945.db2.gz UIZNZUCXDAKBPF-LPHOPBHVSA-N 1 0 340.423 3.844 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCCCC[NH+]1CCCC1 ZINC000455241290 1027897200 /nfs/dbraw/zinc/89/72/00/1027897200.db2.gz FTVPERNJFZGUMD-UHFFFAOYSA-N 1 0 348.447 3.599 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000178689275 1027987537 /nfs/dbraw/zinc/98/75/37/1027987537.db2.gz JMNYCNNIRYWATC-CABCVRRESA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1cnc(NCc2ccccc2C[N@@H+](C)C(C)C)c([N+](=O)[O-])c1 ZINC000078631105 1028036721 /nfs/dbraw/zinc/03/67/21/1028036721.db2.gz WDUPQJUMWRBXGU-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO COCC1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCC1 ZINC000502373274 1028171099 /nfs/dbraw/zinc/17/10/99/1028171099.db2.gz LZTVJYQZZRGWST-DOTOQJQBSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(=O)c1cc(N[C@@H](C)[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000572898101 1028366225 /nfs/dbraw/zinc/36/62/25/1028366225.db2.gz LFBMXHPQLLNHKW-DJJJIMSYSA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)cc1C ZINC000909613437 1028427837 /nfs/dbraw/zinc/42/78/37/1028427837.db2.gz WPBMZKVXYCHTOC-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H]1NCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000423437954 1028446756 /nfs/dbraw/zinc/44/67/56/1028446756.db2.gz URCVDPDIFXEXQY-RTBURBONSA-N 1 0 325.412 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2Cc2ccc(F)cc2)cc1 ZINC000523701851 1028556994 /nfs/dbraw/zinc/55/69/94/1028556994.db2.gz NCVLGUZIKZMKKG-IBGZPJMESA-N 1 0 328.387 3.984 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCSC[C@H]1c1ccccc1 ZINC000523791358 1028628028 /nfs/dbraw/zinc/62/80/28/1028628028.db2.gz XZNZEHVJVSGBEC-KRWDZBQOSA-N 1 0 344.436 3.764 20 5 EHBDRO O=C(C[C@@H]1CCC[N@H+]1Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000532737526 1028775103 /nfs/dbraw/zinc/77/51/03/1028775103.db2.gz ZGYPVPAJNHYASL-SFHVURJKSA-N 1 0 342.370 3.971 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)N(C)C1CC1 ZINC000504899157 1029027289 /nfs/dbraw/zinc/02/72/89/1029027289.db2.gz BLUJULSVVANRKO-KGLIPLIRSA-N 1 0 337.489 3.538 20 5 EHBDRO CO[C@]1(C(F)(F)F)CCCN([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000614925023 1029109308 /nfs/dbraw/zinc/10/93/08/1029109308.db2.gz RSHIXXWFPALGIU-SMDDNHRTSA-N 1 0 332.322 3.699 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CC1(CCO)CCCC1 ZINC000513822895 1029523498 /nfs/dbraw/zinc/52/34/98/1029523498.db2.gz KRUMLNXIGNYPRP-AEFFLSMTSA-N 1 0 346.471 3.838 20 5 EHBDRO CCC(CC)[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC1 ZINC000533268646 1029568617 /nfs/dbraw/zinc/56/86/17/1029568617.db2.gz PGMIZDORFIMXJP-UHFFFAOYSA-N 1 0 339.823 3.840 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H]2C(C)(C)C)cccc1[N+](=O)[O-] ZINC000533290614 1029583920 /nfs/dbraw/zinc/58/39/20/1029583920.db2.gz LVBLZEGHPBBNCO-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN(Cc1cccs1)[C@@H]1C=C[C@@H](CO)C1 ZINC000347387819 1029719291 /nfs/dbraw/zinc/71/92/91/1029719291.db2.gz ZOXCAMRCBVLWBC-GDBMZVCRSA-N 1 0 344.436 3.596 20 5 EHBDRO COC[C@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(C)C ZINC000525194881 1029739518 /nfs/dbraw/zinc/73/95/18/1029739518.db2.gz IKKMSRVULBVBGG-INIZCTEOSA-N 1 0 348.399 3.624 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCN(c2ccc(F)cc2)C1 ZINC000583391096 1029755110 /nfs/dbraw/zinc/75/51/10/1029755110.db2.gz KJQLQCICDWTYES-KBXCAEBGSA-N 1 0 341.386 3.590 20 5 EHBDRO CC(C)C[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000192512905 1029807390 /nfs/dbraw/zinc/80/73/90/1029807390.db2.gz DCQLJBBZWAEEEF-QGZVFWFLSA-N 1 0 341.411 3.571 20 5 EHBDRO C[C@H](CCc1ccccc1F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446834449 1029815787 /nfs/dbraw/zinc/81/57/87/1029815787.db2.gz XEJJOXLNAPECLD-GFCCVEGCSA-N 1 0 342.374 3.721 20 5 EHBDRO C[C@@H](Cc1ccc(Cl)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835008 1029816065 /nfs/dbraw/zinc/81/60/65/1029816065.db2.gz JBIJLPZQEJPVBO-NSHDSACASA-N 1 0 344.802 3.845 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@H]2/C=C\c2ccccc2)n1 ZINC000441173633 1029866953 /nfs/dbraw/zinc/86/69/53/1029866953.db2.gz CNLLEDBNAKUUBN-LENZSSGSSA-N 1 0 340.427 3.749 20 5 EHBDRO CC(C)(C)OC(=O)C[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000531867875 1029942895 /nfs/dbraw/zinc/94/28/95/1029942895.db2.gz KBHBWSGKDKQNPI-HNNXBMFYSA-N 1 0 334.416 3.539 20 5 EHBDRO Cc1cccnc1OC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000429704281 1029957208 /nfs/dbraw/zinc/95/72/08/1029957208.db2.gz VFXFPPPMRKEEGH-HNNXBMFYSA-N 1 0 341.411 3.903 20 5 EHBDRO CC[NH+](CC)[C@@H](c1nc(-c2ccc([N+](=O)[O-])o2)no1)c1ccccc1 ZINC000453252529 1029981456 /nfs/dbraw/zinc/98/14/56/1029981456.db2.gz HACCFDXEJLBHMR-OAHLLOKOSA-N 1 0 342.355 3.669 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453255101 1029986551 /nfs/dbraw/zinc/98/65/51/1029986551.db2.gz KLAHAFJFFJMIAM-WFASDCNBSA-N 1 0 346.349 3.919 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH+]3CCCCC3)CC2)c2ccncc21 ZINC000052428336 1030096977 /nfs/dbraw/zinc/09/69/77/1030096977.db2.gz QUHCCYHSDIKGPQ-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1Cc1cc([O-])ccc1[N+](=O)[O-] ZINC000572980950 1030127366 /nfs/dbraw/zinc/12/73/66/1030127366.db2.gz XVBMJJKQEKDPQY-OCCSQVGLSA-N 1 0 330.359 3.818 20 5 EHBDRO Cc1ccc([C@@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000481956223 1030133668 /nfs/dbraw/zinc/13/36/68/1030133668.db2.gz CBDLHGSNLVKVCV-HNAYVOBHSA-N 1 0 327.428 3.857 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CC)[C@@H](O)CC ZINC000453380886 1030161282 /nfs/dbraw/zinc/16/12/82/1030161282.db2.gz RTAKCAIZKOYDRP-NFAWXSAZSA-N 1 0 326.462 3.605 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453370397 1030188830 /nfs/dbraw/zinc/18/88/30/1030188830.db2.gz NQLMDXYOILRARH-SZVBFZGTSA-N 1 0 341.411 3.951 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000531993681 1030241621 /nfs/dbraw/zinc/24/16/21/1030241621.db2.gz VTISKKHYAUCHDG-DOTOQJQBSA-N 1 0 328.412 3.812 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCCc2cccc(F)c2)n1 ZINC000447530825 1030252417 /nfs/dbraw/zinc/25/24/17/1030252417.db2.gz PCEDBCZDZICGNQ-SJORKVTESA-N 1 0 346.406 3.637 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000520327133 1030265792 /nfs/dbraw/zinc/26/57/92/1030265792.db2.gz XWTWASJTLPYNLB-KBXCAEBGSA-N 1 0 342.443 3.823 20 5 EHBDRO CCc1ccccc1C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000447540986 1030276258 /nfs/dbraw/zinc/27/62/58/1030276258.db2.gz LCALGUCJVOYPCC-IRXDYDNUSA-N 1 0 328.416 3.627 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2ccc(F)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000052486029 1030363734 /nfs/dbraw/zinc/36/37/34/1030363734.db2.gz QGLAIIWLPKZPEY-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO C/C(=C/c1ccc([N+](=O)[O-])cc1)c1nc(-c2ccn3c[nH+]cc3c2)no1 ZINC000447952334 1030622702 /nfs/dbraw/zinc/62/27/02/1030622702.db2.gz FCHCHYZPJKEJGC-WQLSENKSSA-N 1 0 347.334 3.853 20 5 EHBDRO C[C@H]([NH2+]Cc1cncn1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000527074813 1030627748 /nfs/dbraw/zinc/62/77/48/1030627748.db2.gz LWNSAQSZJCAYJW-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)ccn1 ZINC000550938177 1030806137 /nfs/dbraw/zinc/80/61/37/1030806137.db2.gz RFIZDCPQWWCRBU-CQSZACIVSA-N 1 0 329.400 3.672 20 5 EHBDRO CN(CC[NH+]1CCCC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000343492457 1031112995 /nfs/dbraw/zinc/11/29/95/1031112995.db2.gz LMYOHYGYAJNHDO-UHFFFAOYSA-N 1 0 333.435 3.556 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916528 1031274270 /nfs/dbraw/zinc/27/42/70/1031274270.db2.gz QDUBSAUDZWPPOT-MJVIPROJSA-N 1 0 332.322 3.745 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C12CCC2 ZINC000483742200 1031311159 /nfs/dbraw/zinc/31/11/59/1031311159.db2.gz JFGRTQCXHALQGF-QXAKKESOSA-N 1 0 344.455 3.853 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000161502324 1031580308 /nfs/dbraw/zinc/58/03/08/1031580308.db2.gz DGURAIKWTVKJPY-IEBWSBKVSA-N 1 0 328.412 3.802 20 5 EHBDRO C[C@@H]1C[C@H](C)[C@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000475728739 1031663223 /nfs/dbraw/zinc/66/32/23/1031663223.db2.gz CPDQPXJSTPIIGJ-AGIUHOORSA-N 1 0 330.388 3.511 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCCCC34CC[NH2+]CC4)n2)s1 ZINC000904110568 1031735522 /nfs/dbraw/zinc/73/55/22/1031735522.db2.gz XCKQUCFPYHYVEE-LLVKDONJSA-N 1 0 348.428 3.734 20 5 EHBDRO COc1ccccc1OC[C@@H](C)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537941105 1032026426 /nfs/dbraw/zinc/02/64/26/1032026426.db2.gz IETJNCYFKUTPCW-LSDHHAIUSA-N 1 0 344.411 3.969 20 5 EHBDRO COc1cc(F)cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000537961006 1032048603 /nfs/dbraw/zinc/04/86/03/1032048603.db2.gz RYEHIHOZIFVJEQ-SFHVURJKSA-N 1 0 344.386 3.853 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000603054322 1033329666 /nfs/dbraw/zinc/32/96/66/1033329666.db2.gz IJXHOYSNPPILOL-LBPRGKRZSA-N 1 0 332.404 3.759 20 5 EHBDRO C[C@H]([NH2+][C@@H](CNC(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000173439589 1033333614 /nfs/dbraw/zinc/33/36/14/1033333614.db2.gz HCVPCBLNLDGWEO-LRDDRELGSA-N 1 0 349.431 3.549 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1C)Cc1ccccc1 ZINC000063481923 1033388889 /nfs/dbraw/zinc/38/88/89/1033388889.db2.gz YFKNSWPLSWDHFC-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO Cc1cnc(CC[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])c(C)c1 ZINC000594512235 1033417417 /nfs/dbraw/zinc/41/74/17/1033417417.db2.gz VMWFRPNCBZAWLF-INIZCTEOSA-N 1 0 327.428 3.760 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC000595021425 1033613956 /nfs/dbraw/zinc/61/39/56/1033613956.db2.gz DKVBLDSDPBUXAN-CXAGYDPISA-N 1 0 336.432 3.849 20 5 EHBDRO CCOc1cc(CN[C@@H](C)c2ccccc2[N+](=O)[O-])c(F)cc1OC ZINC000598972733 1033621814 /nfs/dbraw/zinc/62/18/14/1033621814.db2.gz DLZFSRJIFGGJMF-LBPRGKRZSA-N 1 0 348.374 3.992 20 5 EHBDRO CCOc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595008119 1033631064 /nfs/dbraw/zinc/63/10/64/1033631064.db2.gz AEXBJRRGANRKLY-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595009161 1033631740 /nfs/dbraw/zinc/63/17/40/1033631740.db2.gz ANAVOEPYAFCUPP-GFCCVEGCSA-N 1 0 348.374 3.644 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@H]([S@@](C)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000595061446 1033639507 /nfs/dbraw/zinc/63/95/07/1033639507.db2.gz KZFGMRYJRFBBSB-PITYFXLSSA-N 1 0 338.473 3.715 20 5 EHBDRO COC[C@@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1cccc(OC)c1 ZINC000595066515 1033643678 /nfs/dbraw/zinc/64/36/78/1033643678.db2.gz ICASTSIRBLXQOK-ZWKOTPCHSA-N 1 0 342.395 3.568 20 5 EHBDRO C[N@@H+]1CCCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000598994761 1033647800 /nfs/dbraw/zinc/64/78/00/1033647800.db2.gz RGFDQAPAFNDOIE-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO COC(=O)CC(C)(C)C[C@H](C)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000595025846 1033649500 /nfs/dbraw/zinc/64/95/00/1033649500.db2.gz IZUIWUKGYWHGPD-KBPBESRZSA-N 1 0 336.432 3.922 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](C)c1c(C)noc1C ZINC000595035039 1033655265 /nfs/dbraw/zinc/65/52/65/1033655265.db2.gz GMLKMSHAFHKRJQ-WDEREUQCSA-N 1 0 333.388 3.663 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599035739 1033663976 /nfs/dbraw/zinc/66/39/76/1033663976.db2.gz NDHSKZNZGQIULZ-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])c(OC)c1 ZINC000599072210 1033715206 /nfs/dbraw/zinc/71/52/06/1033715206.db2.gz FIWMVGRXYSOYJV-YVEFUNNKSA-N 1 0 342.395 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2CO[C@H](C3CC3)C2)c2ccccc2)c1 ZINC000599085128 1033723474 /nfs/dbraw/zinc/72/34/74/1033723474.db2.gz NEHJSEGGHLAPDA-YSIASYRMSA-N 1 0 338.407 3.841 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@@H]2CCC[C@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327733 1033727944 /nfs/dbraw/zinc/72/79/44/1033727944.db2.gz RHQZDZMLUCNZRI-JKSUJKDBSA-N 1 0 329.400 3.968 20 5 EHBDRO COCCC1CCN(c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)CC1 ZINC000599120989 1033742931 /nfs/dbraw/zinc/74/29/31/1033742931.db2.gz PFDVLLMBRRFLAQ-UHFFFAOYSA-N 1 0 329.400 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2C2CCCC2)c2ccncc21 ZINC000599164780 1033780842 /nfs/dbraw/zinc/78/08/42/1033780842.db2.gz MJYXGYLMZZXPDS-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000595410886 1033786610 /nfs/dbraw/zinc/78/66/10/1033786610.db2.gz UBXOPZVHFISFPX-UHFFFAOYSA-N 1 0 329.375 3.584 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000595419950 1033791595 /nfs/dbraw/zinc/79/15/95/1033791595.db2.gz BGYPHHUKHVUSMR-CABCVRRESA-N 1 0 347.459 3.530 20 5 EHBDRO C[N@H+](CCc1nsc2ccccc21)CCc1ccccc1[N+](=O)[O-] ZINC000595485117 1033809293 /nfs/dbraw/zinc/80/92/93/1033809293.db2.gz RTCNLOAHSIHIOW-UHFFFAOYSA-N 1 0 341.436 3.922 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H](c3ccccn3)C2)cc1 ZINC000595502893 1033834682 /nfs/dbraw/zinc/83/46/82/1033834682.db2.gz XDMPCGDITXZYKJ-MRXNPFEDSA-N 1 0 341.411 3.638 20 5 EHBDRO Cc1ccc(CN(Cc2ccc(F)cc2[N+](=O)[O-])CC2CC2)cn1 ZINC000595562433 1033843208 /nfs/dbraw/zinc/84/32/08/1033843208.db2.gz KWARKYPUBNPUMS-UHFFFAOYSA-N 1 0 329.375 3.850 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@@H](c3ccccc3)C3(CCC3)C2)c1[N+](=O)[O-] ZINC000595545133 1033856111 /nfs/dbraw/zinc/85/61/11/1033856111.db2.gz ONLPOFYETGAMMF-HNNXBMFYSA-N 1 0 327.384 3.661 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000089512027 1033862574 /nfs/dbraw/zinc/86/25/74/1033862574.db2.gz RGCLJEOOBFTVRO-INIZCTEOSA-N 1 0 341.367 3.614 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCCCC1 ZINC000608782308 1033886177 /nfs/dbraw/zinc/88/61/77/1033886177.db2.gz BPSHYQFFSIMSOS-QGZVFWFLSA-N 1 0 334.416 3.910 20 5 EHBDRO CC(C)C[C@H](CNCc1ccc(-c2ccccc2[N+](=O)[O-])o1)[NH+](C)C ZINC000608835786 1033907630 /nfs/dbraw/zinc/90/76/30/1033907630.db2.gz QNRLKZIUBMCGNZ-OAHLLOKOSA-N 1 0 345.443 3.921 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000603868003 1033993989 /nfs/dbraw/zinc/99/39/89/1033993989.db2.gz IHOVFOOKEXZFQA-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@@H]([C@H]3CCCCO3)C2)cc1 ZINC000595788259 1033999454 /nfs/dbraw/zinc/99/94/54/1033999454.db2.gz HOEYLHIGZDOHEK-VQIMIIECSA-N 1 0 348.443 3.645 20 5 EHBDRO O=C(C[N@@H+]1CCC[C@@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896348 1034003137 /nfs/dbraw/zinc/00/31/37/1034003137.db2.gz OOMSGTDZLFPLKM-MRXNPFEDSA-N 1 0 331.416 3.578 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450381272 1034214547 /nfs/dbraw/zinc/21/45/47/1034214547.db2.gz ULDKJSBLZKZNHY-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO COC(=O)c1cc([N+](=O)[O-])cc(-c2cc(C[NH+](C)C)ccc2F)c1C ZINC000596640679 1034344203 /nfs/dbraw/zinc/34/42/03/1034344203.db2.gz OSJBANOYKDQQIX-UHFFFAOYSA-N 1 0 346.358 3.558 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCC[C@H](C)C1 ZINC000604435951 1034380105 /nfs/dbraw/zinc/38/01/05/1034380105.db2.gz OHAMOWXAWCUCHW-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+]1CCC[C@@H]1c1ccc(O)cc1 ZINC000604484500 1034387873 /nfs/dbraw/zinc/38/78/73/1034387873.db2.gz XTIZHPBZDJBEGL-MRXNPFEDSA-N 1 0 328.368 3.516 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000604484462 1034388313 /nfs/dbraw/zinc/38/83/13/1034388313.db2.gz PMMTYFLFIMXJLW-MRXNPFEDSA-N 1 0 328.368 3.646 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[N@@H+]1CCC[C@H](C)C1 ZINC000054349128 1034405495 /nfs/dbraw/zinc/40/54/95/1034405495.db2.gz UHHYAFLGDGRLMO-ZDUSSCGKSA-N 1 0 348.447 3.535 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000450600318 1034551426 /nfs/dbraw/zinc/55/14/26/1034551426.db2.gz NGSUKYRUVHZTSN-FOIQADDNSA-N 1 0 340.423 3.724 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000364374427 1034603883 /nfs/dbraw/zinc/60/38/83/1034603883.db2.gz MTJHXNRZFOAFLE-CJNGLKHVSA-N 1 0 328.416 3.580 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccon2)CC1 ZINC000597227949 1034608781 /nfs/dbraw/zinc/60/87/81/1034608781.db2.gz JIQWHHZGVMZKTG-KAMYIIQDSA-N 1 0 327.384 3.866 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3COC[C@@H]3C2)s1 ZINC000597231201 1034612858 /nfs/dbraw/zinc/61/28/58/1034612858.db2.gz OHBOIKSYPMEDCS-KGLIPLIRSA-N 1 0 344.436 3.792 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](c1ccccc1)[C@@H](C)O ZINC000597249325 1034640511 /nfs/dbraw/zinc/64/05/11/1034640511.db2.gz QAVZZQKVXUXAJO-GIYJESFFSA-N 1 0 326.396 3.710 20 5 EHBDRO CCC[C@H](C)NC(=O)[C@@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000250425156 1034847536 /nfs/dbraw/zinc/84/75/36/1034847536.db2.gz FQUKDQQPUXBILH-ZMSDIMECSA-N 1 0 347.459 3.673 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000167458459 1034903237 /nfs/dbraw/zinc/90/32/37/1034903237.db2.gz YBJDYWWERUDXLV-GXTWGEPZSA-N 1 0 347.365 3.803 20 5 EHBDRO Cc1cc(NC2CC[NH+](C3CCC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000450880200 1034907879 /nfs/dbraw/zinc/90/78/79/1034907879.db2.gz PBTSDCAKYJJZJF-UHFFFAOYSA-N 1 0 340.427 3.880 20 5 EHBDRO COc1cc(C[N@@H+]2CCSC3(CCC3)CC2)c([N+](=O)[O-])cc1F ZINC000411877755 1035065412 /nfs/dbraw/zinc/06/54/12/1035065412.db2.gz UBOAPWBSPMUQOB-UHFFFAOYSA-N 1 0 340.420 3.604 20 5 EHBDRO CO[C@](C)([C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CC1 ZINC000411948122 1035079655 /nfs/dbraw/zinc/07/96/55/1035079655.db2.gz MWOMOEYRNTZWPY-FZKQIMNGSA-N 1 0 336.432 3.675 20 5 EHBDRO CC(C)(C)c1ccc([C@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000472452592 1035127833 /nfs/dbraw/zinc/12/78/33/1035127833.db2.gz YMMNZCBSAZQKRF-GOSISDBHSA-N 1 0 342.443 3.926 20 5 EHBDRO COc1cc(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)ccn1 ZINC000180065983 1035348479 /nfs/dbraw/zinc/34/84/79/1035348479.db2.gz VVUCCIYMEFYASC-HXUWFJFHSA-N 1 0 349.390 3.878 20 5 EHBDRO COC[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000540617152 1035508109 /nfs/dbraw/zinc/50/81/09/1035508109.db2.gz BMQZDPYYMXNTSS-XQDHMALISA-N 1 0 330.359 3.724 20 5 EHBDRO CCCC[N@H+](CC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000045003889 1035601814 /nfs/dbraw/zinc/60/18/14/1035601814.db2.gz RDAKHUAQZOWKKP-UHFFFAOYSA-N 1 0 332.347 3.827 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C2(c3ccc4c(c3)OCO4)CC2)cccc1[N+](=O)[O-] ZINC000540749311 1035658794 /nfs/dbraw/zinc/65/87/94/1035658794.db2.gz APOUALDXIISPGG-ZDUSSCGKSA-N 1 0 340.379 3.972 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1Cc2ccccc2O1)C1CC1 ZINC000540766987 1035660425 /nfs/dbraw/zinc/66/04/25/1035660425.db2.gz LVYCGEZHKXEZOP-ZWKOTPCHSA-N 1 0 338.407 3.509 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CN(C)C(C)C ZINC000582247923 1035720716 /nfs/dbraw/zinc/72/07/16/1035720716.db2.gz UQKFBVMCOFIKME-LSDHHAIUSA-N 1 0 339.505 3.784 20 5 EHBDRO C[C@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000588232398 1035832390 /nfs/dbraw/zinc/83/23/90/1035832390.db2.gz DFBNJBUEYFRTNI-SWLSCSKDSA-N 1 0 334.803 3.675 20 5 EHBDRO CC[C@H](C)[N@H+](C)CCN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000572047258 1035956092 /nfs/dbraw/zinc/95/60/92/1035956092.db2.gz YTZPWSOFVASMBX-SMDDNHRTSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+][C@@H]2C[C@H]2c2ccccc2F)n1 ZINC000414186666 1035965076 /nfs/dbraw/zinc/96/50/76/1035965076.db2.gz PZNFZNUCMYOYDV-RKTXRCNFSA-N 1 0 344.390 3.560 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(Nc2ccccn2)CC1 ZINC000540911776 1036003888 /nfs/dbraw/zinc/00/38/88/1036003888.db2.gz NLYBIIVDAIHLSH-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CCCC[C@@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000442723080 1036212837 /nfs/dbraw/zinc/21/28/37/1036212837.db2.gz YNAFKPHSINLDGQ-QGZVFWFLSA-N 1 0 343.383 3.843 20 5 EHBDRO CC(C)[N@H+](C)Cc1ccccc1CNc1c(Cl)cncc1[N+](=O)[O-] ZINC000589108497 1036254957 /nfs/dbraw/zinc/25/49/57/1036254957.db2.gz UPIQGGXLQGUHDZ-UHFFFAOYSA-N 1 0 348.834 3.517 20 5 EHBDRO CC(C)c1ccc(CN2C[C@H]([NH+]3CCCC3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000589188630 1036298058 /nfs/dbraw/zinc/29/80/58/1036298058.db2.gz DPHTWEYOGBJMSA-NVXWUHKLSA-N 1 0 331.460 3.777 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000589243729 1036319018 /nfs/dbraw/zinc/31/90/18/1036319018.db2.gz MVRSUYJEAUBLRF-GFCCVEGCSA-N 1 0 340.383 3.721 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCOc2c(F)cccc21 ZINC000191119953 1036605323 /nfs/dbraw/zinc/60/53/23/1036605323.db2.gz XMUFFMCHDLEWCR-NBUZRDOWSA-N 1 0 328.343 3.861 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H]2CCc3ccccc3C2)c([N+](=O)[O-])cc1F ZINC000464677556 1036651763 /nfs/dbraw/zinc/65/17/63/1036651763.db2.gz LXLOIXRXELUVMC-INIZCTEOSA-N 1 0 344.386 3.732 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@@H](CO)C1 ZINC000414337135 1036744967 /nfs/dbraw/zinc/74/49/67/1036744967.db2.gz KMTHLFMWDLVAMN-KFWWJZLASA-N 1 0 338.473 3.606 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000076004793 1036788490 /nfs/dbraw/zinc/78/84/90/1036788490.db2.gz ROJMZFPUACGCRU-INIZCTEOSA-N 1 0 349.475 3.546 20 5 EHBDRO CO[C@@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000590173532 1036799641 /nfs/dbraw/zinc/79/96/41/1036799641.db2.gz ZRGHVRUSLXARKY-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@@H]1CC[C@]2(CC[N@H+](CCC(=O)Nc3cc([N+](=O)[O-])ccc3F)C2)C1 ZINC000130169331 1036880776 /nfs/dbraw/zinc/88/07/76/1036880776.db2.gz VLZICBROBABZKZ-ACJLOTCBSA-N 1 0 349.406 3.575 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[NH+]3C[C@H]4CCCC[C@@H]4C3)co2)cc1 ZINC000089908694 1036938821 /nfs/dbraw/zinc/93/88/21/1036938821.db2.gz TUXGHSBGBSZVLJ-HUUCEWRRSA-N 1 0 327.384 3.872 20 5 EHBDRO COc1cc(NC[C@@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])cc1C ZINC000590568257 1036952829 /nfs/dbraw/zinc/95/28/29/1036952829.db2.gz AULRBXOTLANFRE-AWEZNQCLSA-N 1 0 335.429 3.688 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(-n2ccnc2)c1 ZINC000180662555 1037052339 /nfs/dbraw/zinc/05/23/39/1037052339.db2.gz HBQKZSHTYOOIGS-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO COc1cccc(C[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761525467 1037109564 /nfs/dbraw/zinc/10/95/64/1037109564.db2.gz KFESUZDJDOQIGB-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO C[NH+](C)Cc1ccccc1NC(=O)c1ccc(Cl)cc1[N+](=O)[O-] ZINC000031232889 1037195027 /nfs/dbraw/zinc/19/50/27/1037195027.db2.gz GYOVKHHVBMOKFI-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CCC[NH2+]CC3)o2)c(Cl)c1 ZINC000591278468 1037318260 /nfs/dbraw/zinc/31/82/60/1037318260.db2.gz DWDGZDBTNOYNIF-GFCCVEGCSA-N 1 0 349.818 3.740 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCCN(CC(C)(C)C)C2=O)cc1[N+](=O)[O-] ZINC000460674029 1037362134 /nfs/dbraw/zinc/36/21/34/1037362134.db2.gz RJZMWUJXIRWDQV-GOEBONIOSA-N 1 0 347.459 3.591 20 5 EHBDRO COc1cc(NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000462786736 1037394657 /nfs/dbraw/zinc/39/46/57/1037394657.db2.gz BFAUKNSKCRGYRM-GJZGRUSLSA-N 1 0 335.448 3.773 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CC[C@H](O)C2)s1 ZINC000188843219 1037435859 /nfs/dbraw/zinc/43/58/59/1037435859.db2.gz BFANAEYBYIIMHF-STQMWFEESA-N 1 0 332.425 3.574 20 5 EHBDRO CN(C)c1cccc(C[N@H+](C)Cc2ccc(Cl)c([N+](=O)[O-])c2)c1 ZINC000760866757 1037539353 /nfs/dbraw/zinc/53/93/53/1037539353.db2.gz HKZRVCONUFLGHD-UHFFFAOYSA-N 1 0 333.819 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(OCC3CCCC3)CC2)cc1 ZINC000177480082 1037552240 /nfs/dbraw/zinc/55/22/40/1037552240.db2.gz HWWLXIVEBFXFGR-UHFFFAOYSA-N 1 0 332.444 3.809 20 5 EHBDRO CCOc1cc(CN[C@@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000491667726 1037626042 /nfs/dbraw/zinc/62/60/42/1037626042.db2.gz LRYZGDJTHCYKGE-MRXNPFEDSA-N 1 0 347.440 3.999 20 5 EHBDRO Cc1nc2ccc(C[NH2+]CCc3ccc([N+](=O)[O-])cc3)cc2s1 ZINC000494008491 1037792101 /nfs/dbraw/zinc/79/21/01/1037792101.db2.gz WXMZBBCSDKYJCU-UHFFFAOYSA-N 1 0 327.409 3.845 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cccc2c1CCOC2)c1ccccc1[N+](=O)[O-] ZINC000897461078 1037847930 /nfs/dbraw/zinc/84/79/30/1037847930.db2.gz YMLXFAOMVGXUAB-AWEZNQCLSA-N 1 0 326.396 3.561 20 5 EHBDRO Cc1ccc(C[N@H+](CCOc2ccccc2[N+](=O)[O-])CC2CC2)cn1 ZINC000592145636 1037871649 /nfs/dbraw/zinc/87/16/49/1037871649.db2.gz XHUCXDAWIJUJFY-UHFFFAOYSA-N 1 0 341.411 3.589 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000592393135 1037934037 /nfs/dbraw/zinc/93/40/37/1037934037.db2.gz FKBQORGHIHZAQX-TVFCKZIOSA-N 1 0 340.427 3.668 20 5 EHBDRO CC(C)[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592527488 1038024541 /nfs/dbraw/zinc/02/45/41/1038024541.db2.gz HIBCBLGAESCBOM-YPLUBFQTSA-N 1 0 330.428 3.551 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1cc(C)c([N+](=O)[O-])cn1)c1ccccc1 ZINC000325693560 1038079485 /nfs/dbraw/zinc/07/94/85/1038079485.db2.gz SUBYNSCKNHAVIL-QGZVFWFLSA-N 1 0 328.416 3.793 20 5 EHBDRO Cc1cc(NCC2CC[NH+](C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461786455 1038609267 /nfs/dbraw/zinc/60/92/67/1038609267.db2.gz QKJGYFWZSSFPHG-UHFFFAOYSA-N 1 0 331.338 3.676 20 5 EHBDRO COc1ccc(OC)c(CCC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000539056215 1038657564 /nfs/dbraw/zinc/65/75/64/1038657564.db2.gz AAAAOOVECQMIMD-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH+](C)C)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461950146 1038690236 /nfs/dbraw/zinc/69/02/36/1038690236.db2.gz STKDTVONFCVPJX-LBPRGKRZSA-N 1 0 345.365 3.843 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000539188661 1038730204 /nfs/dbraw/zinc/73/02/04/1038730204.db2.gz PTVLIWUTIAARHR-INIZCTEOSA-N 1 0 347.459 3.552 20 5 EHBDRO CC[C@H](C)[C@@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000539317352 1038770894 /nfs/dbraw/zinc/77/08/94/1038770894.db2.gz WFQPXCLKLUPCGT-BLLLJJGKSA-N 1 0 336.823 3.822 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000378635420 1038788052 /nfs/dbraw/zinc/78/80/52/1038788052.db2.gz UMOFAARDMUWZAD-INIZCTEOSA-N 1 0 347.440 3.719 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481168574 1038974830 /nfs/dbraw/zinc/97/48/30/1038974830.db2.gz MOGMJKQNBMWHFU-RHSMWYFYSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480229740 1039313211 /nfs/dbraw/zinc/31/32/11/1039313211.db2.gz LZASLLIUCBINTP-SUMWQHHRSA-N 1 0 333.457 3.918 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@H]1[C@@H](O)c1ccccc1 ZINC000728918107 1039392169 /nfs/dbraw/zinc/39/21/69/1039392169.db2.gz JEJBMXZAZXGMCD-OALUTQOASA-N 1 0 344.386 3.822 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCc2ccc(C[NH+]3CCCC3)cc2)n1 ZINC000120434463 1039635257 /nfs/dbraw/zinc/63/52/57/1039635257.db2.gz LRJKIODJBWXOLG-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO CN(C)c1ncccc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417309364 1039664288 /nfs/dbraw/zinc/66/42/88/1039664288.db2.gz GCXVLHHUILVJBN-GOSISDBHSA-N 1 0 340.427 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(CF)CCOCC1)CCCC2 ZINC000417353619 1039710784 /nfs/dbraw/zinc/71/07/84/1039710784.db2.gz XQPOLNGFGJKLKD-QGZVFWFLSA-N 1 0 336.407 3.718 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2ccc([N+](=O)[O-])c(OC)c2)cc1C ZINC000489251773 1039775178 /nfs/dbraw/zinc/77/51/78/1039775178.db2.gz CXZPGDWEMKUKDS-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@@H](C)c3ccccc3)CC2)ncc1[N+](=O)[O-] ZINC000074763918 1039804266 /nfs/dbraw/zinc/80/42/66/1039804266.db2.gz FATXOVGZJIHOMJ-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO CC(=O)c1cc(NCCC[NH+]2C[C@H](C)C[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000553297685 1039943406 /nfs/dbraw/zinc/94/34/06/1039943406.db2.gz HIAUHYGASVKTMT-ZIAGYGMSSA-N 1 0 333.432 3.577 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000489603314 1040100732 /nfs/dbraw/zinc/10/07/32/1040100732.db2.gz HQFRXIFJCQQZDA-CQSZACIVSA-N 1 0 326.396 3.765 20 5 EHBDRO CCC(CC)(CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236909759 1040116199 /nfs/dbraw/zinc/11/61/99/1040116199.db2.gz FFXBULAWBIUNDV-UHFFFAOYSA-N 1 0 334.441 3.964 20 5 EHBDRO CC(C)(C)CC(C)(C)[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128487648 1040176341 /nfs/dbraw/zinc/17/63/41/1040176341.db2.gz SNKPUSXOSFAABZ-UHFFFAOYSA-N 1 0 339.411 3.867 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(SCC[N@@H+](C)Cc2ccccc2)n1 ZINC000432925593 1040193868 /nfs/dbraw/zinc/19/38/68/1040193868.db2.gz AEVFMLPJPRRXKE-UHFFFAOYSA-N 1 0 331.441 3.831 20 5 EHBDRO Cc1cccc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000479466578 1040287244 /nfs/dbraw/zinc/28/72/44/1040287244.db2.gz WAVWFTWULDHAFG-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000092626566 1040464321 /nfs/dbraw/zinc/46/43/21/1040464321.db2.gz FWZRHNPMWZMTKO-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO CCC1CCC([N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000500138438 1040587453 /nfs/dbraw/zinc/58/74/53/1040587453.db2.gz LOMGWEKOXGSXQG-UHFFFAOYSA-N 1 0 333.432 3.824 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCN2CCc3ccccc32)cc1[N+](=O)[O-] ZINC000481278583 1040599768 /nfs/dbraw/zinc/59/97/68/1040599768.db2.gz YCBSKKJSHVTHFP-OAHLLOKOSA-N 1 0 325.412 3.617 20 5 EHBDRO CN(Cc1ccccc1[N+](=O)[O-])Cc1ccc(F)c2cccnc12 ZINC000029724627 1040881208 /nfs/dbraw/zinc/88/12/08/1040881208.db2.gz DWKGVHXESQLNAV-UHFFFAOYSA-N 1 0 325.343 3.914 20 5 EHBDRO COc1ccc([C@@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)cc1 ZINC000491137929 1040923986 /nfs/dbraw/zinc/92/39/86/1040923986.db2.gz HASDKCMUYLTTFG-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO CC(C)([NH2+]Cc1cccc2c1OCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000080347081 1040930891 /nfs/dbraw/zinc/93/08/91/1040930891.db2.gz PNMBHKOPXHZWQM-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO CC[C@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2C)OCCc2ccccc21 ZINC000570889051 1040965017 /nfs/dbraw/zinc/96/50/17/1040965017.db2.gz RIIGYUQWIULQAP-HXUWFJFHSA-N 1 0 340.423 3.871 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cc1 ZINC000433196964 1041044915 /nfs/dbraw/zinc/04/49/15/1041044915.db2.gz OGJRZWADXVBKMV-KRWDZBQOSA-N 1 0 325.412 3.601 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCCc2ccccn2)c2cc([N+](=O)[O-])ccc21 ZINC000433295455 1041246892 /nfs/dbraw/zinc/24/68/92/1041246892.db2.gz PBTGWXZIUJULCH-GOSISDBHSA-N 1 0 325.412 3.935 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000433295136 1041247233 /nfs/dbraw/zinc/24/72/33/1041247233.db2.gz OLGKNYIOVYBMPK-VBHSOAQHSA-N 1 0 329.444 3.532 20 5 EHBDRO C[C@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481733645 1041308251 /nfs/dbraw/zinc/30/82/51/1041308251.db2.gz UMLWMZAQOKWUCK-KGLIPLIRSA-N 1 0 342.395 3.995 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCc1ccccc1C[NH+]1CCCCC1 ZINC000110930747 1041634664 /nfs/dbraw/zinc/63/46/64/1041634664.db2.gz KYDKCMYQLNCPBE-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCCNC(=O)OC(C)(C)C ZINC000125250871 1041926933 /nfs/dbraw/zinc/92/69/33/1041926933.db2.gz SDXROIZQEORKOM-CYBMUJFWSA-N 1 0 337.420 3.502 20 5 EHBDRO CC(C)c1ccccc1C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC001167779542 1042146384 /nfs/dbraw/zinc/14/63/84/1042146384.db2.gz UYNRDIASYROEFN-INIZCTEOSA-N 1 0 340.427 3.800 20 5 EHBDRO COc1ccc(C[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000468890624 1042179026 /nfs/dbraw/zinc/17/90/26/1042179026.db2.gz HRNFFZAFGMFTMH-MDWZMJQESA-N 1 0 330.359 3.936 20 5 EHBDRO CCc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+](C)C)cc1 ZINC000111176624 1042237839 /nfs/dbraw/zinc/23/78/39/1042237839.db2.gz BWACYBHFPZXWIW-KRWDZBQOSA-N 1 0 328.416 3.575 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000181832189 1042480423 /nfs/dbraw/zinc/48/04/23/1042480423.db2.gz SXYRUIKAPXEBLE-ZDUSSCGKSA-N 1 0 329.356 3.971 20 5 EHBDRO Cc1ccc(C[NH+]2CCCC2)cc1NC(=O)c1ccc([N+](=O)[O-])s1 ZINC000128775538 1042948432 /nfs/dbraw/zinc/94/84/32/1042948432.db2.gz BLQNSLDKTQWJRL-UHFFFAOYSA-N 1 0 345.424 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1COc3ccc(F)cc3C1)CCC2 ZINC000343962658 1042957861 /nfs/dbraw/zinc/95/78/61/1042957861.db2.gz AXWQDNHAXKVHCU-CRAIPNDOSA-N 1 0 342.370 3.705 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754308 1043024459 /nfs/dbraw/zinc/02/44/59/1043024459.db2.gz GZZZJWSYEQZHHP-UHFFFAOYSA-N 1 0 341.411 3.709 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2cccc(CO)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279006172 1043173167 /nfs/dbraw/zinc/17/31/67/1043173167.db2.gz GJCOPDRRXXCZSI-SFHVURJKSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)o1 ZINC000279029802 1043219706 /nfs/dbraw/zinc/21/97/06/1043219706.db2.gz IHPPRCYEJUXYNH-HZPDHXFCSA-N 1 0 330.384 3.542 20 5 EHBDRO C[N@H+](CC1CCCCC1)Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1 ZINC000728898364 1043614445 /nfs/dbraw/zinc/61/44/45/1043614445.db2.gz UFBJNLZAODNWRL-UHFFFAOYSA-N 1 0 328.416 3.928 20 5 EHBDRO CCC1(C)CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000728900808 1043829164 /nfs/dbraw/zinc/82/91/64/1043829164.db2.gz QOFLWFVPNAPHAW-UHFFFAOYSA-N 1 0 328.416 3.928 20 5 EHBDRO CCn1cc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)cn1 ZINC000279508378 1044152275 /nfs/dbraw/zinc/15/22/75/1044152275.db2.gz NFWZYPYYPCDXHO-JTQLQIEISA-N 1 0 342.321 3.681 20 5 EHBDRO C[C@H](c1ccccc1)N(CC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000512259846 1044430454 /nfs/dbraw/zinc/43/04/54/1044430454.db2.gz LSLACFRFNZNJRL-CQSZACIVSA-N 1 0 339.395 3.759 20 5 EHBDRO CO[C@@H](CC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(F)(F)F ZINC000344865636 1044553549 /nfs/dbraw/zinc/55/35/49/1044553549.db2.gz MYPYQLJTQXWILU-AWEZNQCLSA-N 1 0 334.338 3.775 20 5 EHBDRO NC(=NOCc1c(F)cccc1[N+](=O)[O-])C12CC3CC(CC(C3)C1)C2 ZINC000728910531 1044668750 /nfs/dbraw/zinc/66/87/50/1044668750.db2.gz NSTNZWUVTYYKKQ-UHFFFAOYSA-N 1 0 347.390 3.949 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1C ZINC000183720609 1125742283 /nfs/dbraw/zinc/74/22/83/1125742283.db2.gz AHGZYCNEABRESZ-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO CCCC[NH+]1CCC(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192772048 1126936661 /nfs/dbraw/zinc/93/66/61/1126936661.db2.gz OFRADJYBFMMUOV-IBGZPJMESA-N 1 0 331.460 3.826 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H](c2ccccc2)C2CC2)cc1[N+](=O)[O-] ZINC000552060071 1127550167 /nfs/dbraw/zinc/55/01/67/1127550167.db2.gz GZYXQOLVDLAXFR-QGZVFWFLSA-N 1 0 326.396 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]Cc3ccc(F)c(F)c3)CC2)cc1 ZINC000765328891 1127598308 /nfs/dbraw/zinc/59/83/08/1127598308.db2.gz FUHMVHVGZUNFFO-UHFFFAOYSA-N 1 0 347.365 3.632 20 5 EHBDRO [NH3+]CC[C@@H]1CN(c2cc3cccnc3c([N+](=O)[O-])c2)c2ccccc21 ZINC001168549495 1127714145 /nfs/dbraw/zinc/71/41/45/1127714145.db2.gz OCDPNZMDNIYEKC-CQSZACIVSA-N 1 0 334.379 3.727 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000282220538 1128097504 /nfs/dbraw/zinc/09/75/04/1128097504.db2.gz HYNJQAUBNSDKQW-CJNGLKHVSA-N 1 0 330.384 3.854 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c(C)[nH]c3ccccc32)cc1[N+](=O)[O-] ZINC000106469065 1128494843 /nfs/dbraw/zinc/49/48/43/1128494843.db2.gz PAZUGLTVUVROEH-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO C[C@@H]1C[N@@H+](CCCCNc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000301580724 1128499687 /nfs/dbraw/zinc/49/96/87/1128499687.db2.gz SHSZWXCDCQVXLW-BETUJISGSA-N 1 0 341.839 3.550 20 5 EHBDRO COc1ccccc1[C@@H](CNc1cc(C)ccc1[N+](=O)[O-])[NH+](C)C ZINC000301591861 1128506138 /nfs/dbraw/zinc/50/61/38/1128506138.db2.gz ZIMRKQKYBZKPIL-QGZVFWFLSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN1CCC[C@H](C[N@H+]2CCCC[C@H]2C)C1 ZINC000542703449 1128549030 /nfs/dbraw/zinc/54/90/30/1128549030.db2.gz NREBROWZIHKNCX-MSOLQXFVSA-N 1 0 345.487 3.990 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2ccc([N+](=O)[O-])cc2C)cc(OC)c1 ZINC000542703601 1128549098 /nfs/dbraw/zinc/54/90/98/1128549098.db2.gz RRIJQILZEWHCRI-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846231 1128550030 /nfs/dbraw/zinc/55/00/30/1128550030.db2.gz WKNYNNZKOFQCNA-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO COc1cc(C[N@H+]2[C@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000123120548 1128609586 /nfs/dbraw/zinc/60/95/86/1128609586.db2.gz PPABTBCBVMJTSZ-AOOOYVTPSA-N 1 0 330.331 3.578 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cnc(C4CC4)s3)c2c1 ZINC000554723773 1128665033 /nfs/dbraw/zinc/66/50/33/1128665033.db2.gz QNSBMGGMWRERAA-UHFFFAOYSA-N 1 0 342.424 3.742 20 5 EHBDRO Cc1nc(NC2CC[NH+](CC3CCCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301624985 1128764648 /nfs/dbraw/zinc/76/46/48/1128764648.db2.gz GSYGUXOJYHXMEZ-UHFFFAOYSA-N 1 0 332.448 3.755 20 5 EHBDRO CC(C)CCOC1CC[NH+](CCOc2cccc([N+](=O)[O-])c2)CC1 ZINC000193106226 1120917002 /nfs/dbraw/zinc/91/70/02/1120917002.db2.gz XNXKKRVKVRLBPC-UHFFFAOYSA-N 1 0 336.432 3.501 20 5 EHBDRO CCC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])Cc1ccccc1 ZINC000198629584 1128965680 /nfs/dbraw/zinc/96/56/80/1128965680.db2.gz LTCRAGWJWBKXFA-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO CC[N@@H+]1CCCC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC000303542974 1121159380 /nfs/dbraw/zinc/15/93/80/1121159380.db2.gz YVSGSYCDTFLVIQ-KRWDZBQOSA-N 1 0 347.462 3.992 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)/C=C\c1ccccc1[N+](=O)[O-] ZINC000255001843 1128980396 /nfs/dbraw/zinc/98/03/96/1128980396.db2.gz CHNPZMQWRCFHDQ-KHPPLWFESA-N 1 0 339.395 3.617 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000153343131 1121744691 /nfs/dbraw/zinc/74/46/91/1121744691.db2.gz SJWHLWYGGHXBPY-BBRMVZONSA-N 1 0 342.395 3.648 20 5 EHBDRO CCCC[NH+]1CCC(N[C@@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000153345593 1121745321 /nfs/dbraw/zinc/74/53/21/1121745321.db2.gz VRMGAJLMWCFHSE-HNNXBMFYSA-N 1 0 349.475 3.909 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@@H]21 ZINC000302268877 1121939907 /nfs/dbraw/zinc/93/99/07/1121939907.db2.gz GPNOAGSTHSFZQL-HZMBPMFUSA-N 1 0 344.242 3.822 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NCCC[N@@H+]1CCc2ccccc2C1 ZINC000301747782 1129025862 /nfs/dbraw/zinc/02/58/62/1129025862.db2.gz RIGRANGFCFUIAR-UHFFFAOYSA-N 1 0 346.818 3.504 20 5 EHBDRO CC(=O)c1ccc(NCC(C)(C)[N@@H+]2CCC[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301196423 1122423181 /nfs/dbraw/zinc/42/31/81/1122423181.db2.gz UJRMMZNPQIPSAW-ZDUSSCGKSA-N 1 0 333.432 3.720 20 5 EHBDRO Cc1ccc(N2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000917088273 1122485608 /nfs/dbraw/zinc/48/56/08/1122485608.db2.gz HMZUDKFEBFXUPC-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO C[C@@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)[C@H](c2ccco2)C1 ZINC000154388991 1122600751 /nfs/dbraw/zinc/60/07/51/1122600751.db2.gz CFMTUOYSLNUCSV-COXVUDFISA-N 1 0 330.384 3.694 20 5 EHBDRO C[C@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cn2c(n1)CCCC2 ZINC000925467421 1123076822 /nfs/dbraw/zinc/07/68/22/1123076822.db2.gz SVGIBHCJEHODJI-HNNXBMFYSA-N 1 0 342.443 3.801 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+](Cc1cccc(O)c1)CC1CC1 ZINC000498893749 1123100530 /nfs/dbraw/zinc/10/05/30/1123100530.db2.gz JUNCCWDALTUWAO-UHFFFAOYSA-N 1 0 342.395 3.591 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@H]1C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000078270596 1129124932 /nfs/dbraw/zinc/12/49/32/1129124932.db2.gz DRZIBRQPZJJXJX-UHIISALHSA-N 1 0 339.823 3.744 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)c2c1 ZINC000609600439 1123619257 /nfs/dbraw/zinc/61/92/57/1123619257.db2.gz CSMDEZWNFAGYLV-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO C[NH+](C)[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)C1CCCCC1 ZINC000609891712 1123687569 /nfs/dbraw/zinc/68/75/69/1123687569.db2.gz GGBQDJNXZXMYNN-CQSZACIVSA-N 1 0 326.828 3.566 20 5 EHBDRO C[C@H]1C[C@H](C)C[NH+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)C1 ZINC000609891360 1123687989 /nfs/dbraw/zinc/68/79/89/1123687989.db2.gz AHPAYYPYGNLCNX-STQMWFEESA-N 1 0 340.855 3.813 20 5 EHBDRO C[C@](CO)([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000610140410 1123735210 /nfs/dbraw/zinc/73/52/10/1123735210.db2.gz WGARNWADZXNQSL-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO Cc1cccc(C(C)(C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000179590077 1123799220 /nfs/dbraw/zinc/79/92/20/1123799220.db2.gz RIKYNLGCPWNQDU-UHFFFAOYSA-N 1 0 341.411 3.675 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCCOC2)ccc1Oc1ccc(F)cc1 ZINC000237883722 1123902713 /nfs/dbraw/zinc/90/27/13/1123902713.db2.gz DNFFNNFTTIZALQ-OAHLLOKOSA-N 1 0 346.358 3.795 20 5 EHBDRO CC[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCOC1 ZINC000616487732 1124011662 /nfs/dbraw/zinc/01/16/62/1124011662.db2.gz UZUGXHIKGKVZTI-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000734839146 1131284334 /nfs/dbraw/zinc/28/43/34/1131284334.db2.gz XJMYDQCJKYSHCO-INIZCTEOSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571684 1125120669 /nfs/dbraw/zinc/12/06/69/1125120669.db2.gz LAQVIQHTMXWDJK-JSNMRZPZSA-N 1 0 340.423 3.726 20 5 EHBDRO CCC(=O)c1ccc(Nc2cnn(-c3cc[nH+]cc3)c2)c([N+](=O)[O-])c1 ZINC000619479733 1125352193 /nfs/dbraw/zinc/35/21/93/1125352193.db2.gz ZPAYRXSQYSBPSB-UHFFFAOYSA-N 1 0 337.339 3.512 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569435 1125363838 /nfs/dbraw/zinc/36/38/38/1125363838.db2.gz CKBYRUPCGACMKL-AXUOBQJMSA-N 1 0 332.444 3.746 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181738 1129316444 /nfs/dbraw/zinc/31/64/44/1129316444.db2.gz IYXZSELUSQFTLB-GJZGRUSLSA-N 1 0 331.416 3.518 20 5 EHBDRO CSc1ccc([C@H](CNc2nccc(C)c2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000338834811 1129397970 /nfs/dbraw/zinc/39/79/70/1129397970.db2.gz FHKBSUDHOUAMOA-HNNXBMFYSA-N 1 0 346.456 3.735 20 5 EHBDRO CCOc1ccc([C@@H](C)NCC[C@H](C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000543418039 1129474751 /nfs/dbraw/zinc/47/47/51/1129474751.db2.gz MFRPFGRKJBZBSX-JKSUJKDBSA-N 1 0 349.475 3.909 20 5 EHBDRO CCC[C@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000466489443 1129489540 /nfs/dbraw/zinc/48/95/40/1129489540.db2.gz RKCFGWGKLKNRHH-HNNXBMFYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@@H](c1ccncc1)N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091987765 1129529542 /nfs/dbraw/zinc/52/95/42/1129529542.db2.gz AIIIXDPHSOMSLE-ZDUSSCGKSA-N 1 0 338.367 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/CN(Cc1ccco1)C[C@H]1CCCO1 ZINC000092436353 1129546057 /nfs/dbraw/zinc/54/60/57/1129546057.db2.gz ZZZQJZDQMSEYMZ-NTSMAEHXSA-N 1 0 342.395 3.882 20 5 EHBDRO Cc1nccn1CCCC[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000154396906 1129555221 /nfs/dbraw/zinc/55/52/21/1129555221.db2.gz RORQOZUDQNTDPX-UHFFFAOYSA-N 1 0 328.416 3.545 20 5 EHBDRO COc1cc(C)c(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000922538690 1129565923 /nfs/dbraw/zinc/56/59/23/1129565923.db2.gz VUAKPIPSEDEGET-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1c(C)cc(CO)cc1C ZINC000922562322 1129570825 /nfs/dbraw/zinc/57/08/25/1129570825.db2.gz LBSXZMKJFJJDLS-UHFFFAOYSA-N 1 0 328.412 3.611 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)[C@@H]1C[C@H]1c1ccccc1 ZINC000555228868 1129587174 /nfs/dbraw/zinc/58/71/74/1129587174.db2.gz LMSUWWPGZFGISG-KKXDTOCCSA-N 1 0 326.396 3.885 20 5 EHBDRO C[C@H](N[C@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955484 1129593671 /nfs/dbraw/zinc/59/36/71/1129593671.db2.gz YJLYJYGKEMUJSL-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)c1ccc(CN2CC[C@H](C[NH+]3CCCC3)C2)cc1[N+](=O)[O-] ZINC000093597656 1129595121 /nfs/dbraw/zinc/59/51/21/1129595121.db2.gz KFJUTCWZINSJEH-QGZVFWFLSA-N 1 0 331.460 3.636 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H](Nc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000154947174 1129600960 /nfs/dbraw/zinc/60/09/60/1129600960.db2.gz UUBVJQWKFHQRGD-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO CC(C)[C@H](CO)[N@H+](Cc1ccccc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000735871622 1131384791 /nfs/dbraw/zinc/38/47/91/1131384791.db2.gz LZFDXLUIUBBTLI-IBGZPJMESA-N 1 0 346.402 3.753 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CC[C@]4(CCOC4)C3)s2)cc1 ZINC000093820048 1129604817 /nfs/dbraw/zinc/60/48/17/1129604817.db2.gz FJYDYGYNCSNHLK-SFHVURJKSA-N 1 0 344.436 3.936 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@]3(CCOC3)C2)s1 ZINC000093820300 1129604883 /nfs/dbraw/zinc/60/48/83/1129604883.db2.gz VVBIOZISVNKEJQ-GOSISDBHSA-N 1 0 344.436 3.936 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ncc([N+](=O)[O-])s1 ZINC000390940174 1129642918 /nfs/dbraw/zinc/64/29/18/1129642918.db2.gz PETXPJUQODYMFF-AWEZNQCLSA-N 1 0 346.456 3.764 20 5 EHBDRO CC(C)[C@H](C)NC(=O)C1CC[NH+]([C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000331276516 1129658860 /nfs/dbraw/zinc/65/88/60/1129658860.db2.gz QXOVRYXMMYBKEP-LSDHHAIUSA-N 1 0 347.459 3.529 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000391839306 1129687812 /nfs/dbraw/zinc/68/78/12/1129687812.db2.gz LSXIRMWTRAIZTQ-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CCc1nc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cs1 ZINC000156405204 1129714667 /nfs/dbraw/zinc/71/46/67/1129714667.db2.gz NNQZUFALMJJXNO-OAHLLOKOSA-N 1 0 331.441 3.725 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@H]([NH+](C)C)C2)c2cccc([N+](=O)[O-])c2n1 ZINC000302003706 1129762817 /nfs/dbraw/zinc/76/28/17/1129762817.db2.gz JZABMMGOMHNWNS-KGLIPLIRSA-N 1 0 328.416 3.736 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)[C@@H]2CCC[N@@H+](C3CCC3)C2)c([N+](=O)[O-])c1 ZINC000302044417 1129765316 /nfs/dbraw/zinc/76/53/16/1129765316.db2.gz JUNXAXLRHUVHRM-CZUORRHYSA-N 1 0 345.443 3.862 20 5 EHBDRO Cc1cc(NCc2cccc([N+](=O)[O-])c2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302214806 1129773364 /nfs/dbraw/zinc/77/33/64/1129773364.db2.gz ZUZIYOZTXLSFBS-UHFFFAOYSA-N 1 0 338.323 3.972 20 5 EHBDRO Cc1cc(N2CCOCC3(CCCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302391557 1129777797 /nfs/dbraw/zinc/77/77/97/1129777797.db2.gz JKWLALMTYNRGFO-UHFFFAOYSA-N 1 0 341.411 3.848 20 5 EHBDRO Cc1ccc(F)cc1NC(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196350 1129805702 /nfs/dbraw/zinc/80/57/02/1129805702.db2.gz NSKJMSZBBOGRFI-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO C[C@@H]([NH2+]Cc1cncc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000163923057 1129953931 /nfs/dbraw/zinc/95/39/31/1129953931.db2.gz XDORSMWZEGKPFQ-SNVBAGLBSA-N 1 0 336.189 3.603 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173451107 1130232451 /nfs/dbraw/zinc/23/24/51/1130232451.db2.gz XRVCDZBDJJACDB-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H](c2nccs2)C1 ZINC000175147157 1130409416 /nfs/dbraw/zinc/40/94/16/1130409416.db2.gz WVUSJPJYJAZACI-CYBMUJFWSA-N 1 0 347.440 3.830 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1ccc(C(F)(F)F)cn1 ZINC000282571308 1131101364 /nfs/dbraw/zinc/10/13/64/1131101364.db2.gz ZOHGPSIFDRLIGO-UHFFFAOYSA-N 1 0 339.317 3.683 20 5 EHBDRO C[C@@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC000741932115 1131671052 /nfs/dbraw/zinc/67/10/52/1131671052.db2.gz QTVWNYRXXUFWIA-LBPRGKRZSA-N 1 0 340.807 3.556 20 5 EHBDRO CC(C)C1CC[NH+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)CC1 ZINC000742168569 1131692459 /nfs/dbraw/zinc/69/24/59/1131692459.db2.gz DFZKKCFOGKULMH-UHFFFAOYSA-N 1 0 328.416 3.784 20 5 EHBDRO C[C@H]1CCCN1CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000742388431 1131713980 /nfs/dbraw/zinc/71/39/80/1131713980.db2.gz UKDZRVPIUXZDCQ-AWEZNQCLSA-N 1 0 345.468 3.897 20 5 EHBDRO Cc1ccnc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172897609 1131880945 /nfs/dbraw/zinc/88/09/45/1131880945.db2.gz BCSMAHBHAXMJBV-WMLDXEAASA-N 1 0 325.412 3.896 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899506 1131882386 /nfs/dbraw/zinc/88/23/86/1131882386.db2.gz NTKWTEOWCDWEIH-GOSISDBHSA-N 1 0 339.439 3.698 20 5 EHBDRO CC(C)(Cc1ccccn1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899876 1131884225 /nfs/dbraw/zinc/88/42/25/1131884225.db2.gz AANBZIONOLGOAR-QGZVFWFLSA-N 1 0 339.439 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cncn1C1CCC1)CC2 ZINC001172902706 1131884610 /nfs/dbraw/zinc/88/46/10/1131884610.db2.gz BOQKJUSYNMTTFJ-MRXNPFEDSA-N 1 0 340.427 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cc(F)cc(F)c1)CC2 ZINC001172895945 1131901042 /nfs/dbraw/zinc/90/10/42/1131901042.db2.gz JYJSCOTWQJDDMH-KRWDZBQOSA-N 1 0 332.350 3.910 20 5 EHBDRO CCCOC1CC[NH+]([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172914294 1131903200 /nfs/dbraw/zinc/90/32/00/1131903200.db2.gz GMPJZBYCOHKLJG-KRWDZBQOSA-N 1 0 332.444 3.733 20 5 EHBDRO Cc1cc([C@@H]2CCC[N@@H+]2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910417 1131916509 /nfs/dbraw/zinc/91/65/09/1131916509.db2.gz ZFIDFAGNRXRWQF-LPHOPBHVSA-N 1 0 341.411 3.976 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@@H]3CC=CCC3)CC2)c(F)c1 ZINC001173013047 1131935356 /nfs/dbraw/zinc/93/53/56/1131935356.db2.gz OHRZUTFETLVMAR-GFCCVEGCSA-N 1 0 337.370 3.540 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(C)(C)C ZINC001173011375 1131935865 /nfs/dbraw/zinc/93/58/65/1131935865.db2.gz CAVNDGBACHRNQN-LLVKDONJSA-N 1 0 341.402 3.866 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2sccc2C)c1F ZINC001173175647 1131991258 /nfs/dbraw/zinc/99/12/58/1131991258.db2.gz QIZUSMFWTNTQTF-NSHDSACASA-N 1 0 338.404 3.833 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH+]2CCC3(CCC3)CC2)c1F ZINC001173180471 1131992526 /nfs/dbraw/zinc/99/25/26/1131992526.db2.gz KZLXAAOJLHDGBP-CYBMUJFWSA-N 1 0 336.407 3.940 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC23CCCCC3)c1F ZINC001173184173 1131993992 /nfs/dbraw/zinc/99/39/92/1131993992.db2.gz OQBITZFOZKNJLO-LRDDRELGSA-N 1 0 336.407 3.986 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccncc1 ZINC001173190023 1131994615 /nfs/dbraw/zinc/99/46/15/1131994615.db2.gz UCNQCELXDBVGHT-DOMZBBRYSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H](C)c2ccc(N)cc2)c1F ZINC001173194227 1131995602 /nfs/dbraw/zinc/99/56/02/1131995602.db2.gz YVTRNBMZEFBYPD-NWDGAFQWSA-N 1 0 347.390 3.607 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1COc2cc(Cl)ccc21 ZINC001173218153 1132002959 /nfs/dbraw/zinc/00/29/59/1132002959.db2.gz BPYGMKORNOLFNJ-ZBEGNZNMSA-N 1 0 332.787 3.903 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2cc(O)ccc21 ZINC001173219083 1132003610 /nfs/dbraw/zinc/00/36/10/1132003610.db2.gz WVBRFXYUMBJPCW-CYBMUJFWSA-N 1 0 339.395 3.560 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)NC(=[NH2+])c1ccc(F)c(Cl)c1 ZINC001173221028 1132003860 /nfs/dbraw/zinc/00/38/60/1132003860.db2.gz FFDMDDOKUGOFMB-SNVBAGLBSA-N 1 0 335.766 3.933 20 5 EHBDRO Cc1cccc(N2CC[NH+]([C@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC001173224695 1132005972 /nfs/dbraw/zinc/00/59/72/1132005972.db2.gz GLAMPWFWQZLWPB-QGZVFWFLSA-N 1 0 339.439 3.656 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC001173229723 1132007622 /nfs/dbraw/zinc/00/76/22/1132007622.db2.gz PRZFBWBOAHXKOW-LLVKDONJSA-N 1 0 339.317 3.729 20 5 EHBDRO COc1cncc([C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229229 1132008183 /nfs/dbraw/zinc/00/81/83/1132008183.db2.gz RTMSLRRHGJLSQP-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO Cc1cncc([C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC001173229274 1132008291 /nfs/dbraw/zinc/00/82/91/1132008291.db2.gz SEOMDEIXXWYZDX-IFXJQAMLSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccccc1)c1cccnn1 ZINC001173231524 1132009128 /nfs/dbraw/zinc/00/91/28/1132009128.db2.gz ZZXJPVKNUUNOIY-MGPUTAFESA-N 1 0 348.406 3.695 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[N@@H+](C2CCCCC2)[C@@H](C)C1 ZINC001173237121 1132025940 /nfs/dbraw/zinc/02/59/40/1132025940.db2.gz HXYIFULWVDTYFY-IRXDYDNUSA-N 1 0 345.487 3.865 20 5 EHBDRO CC(C)(C)OC(=O)CCCC[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000773429641 1132522695 /nfs/dbraw/zinc/52/26/95/1132522695.db2.gz VAFCKNORIVGYKZ-UHFFFAOYSA-N 1 0 342.823 3.850 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(OCc3ccccc3)cc2)C1 ZINC001168976062 1132617424 /nfs/dbraw/zinc/61/74/24/1132617424.db2.gz YXQKYVLSERZMBZ-RBUKOAKNSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1 ZINC001168972679 1132623875 /nfs/dbraw/zinc/62/38/75/1132623875.db2.gz ASNOPXWTWRJFRY-BXUZGUMPSA-N 1 0 331.243 3.961 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001169005901 1132629887 /nfs/dbraw/zinc/62/98/87/1132629887.db2.gz VQQPYZZNIBOFRD-TUKIKUTGSA-N 1 0 341.249 3.935 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1Br ZINC001168990033 1132634571 /nfs/dbraw/zinc/63/45/71/1132634571.db2.gz AXRBPRCFKVUTJJ-HOSYDEDBSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]C2(c3ccc(C(F)(F)F)cc3)CC2)C1 ZINC001168986785 1132634598 /nfs/dbraw/zinc/63/45/98/1132634598.db2.gz ZLANGDHMMZOHRH-SMDDNHRTSA-N 1 0 328.334 3.730 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168988321 1132634982 /nfs/dbraw/zinc/63/49/82/1132634982.db2.gz QVVVSYMNGGFUEZ-SMDDNHRTSA-N 1 0 341.249 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3ccccc32)C1 ZINC001169027886 1132636113 /nfs/dbraw/zinc/63/61/13/1132636113.db2.gz RLIHNUSCRVVHNH-ZBFHGGJFSA-N 1 0 327.428 3.726 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H](c3cccc(C(F)(F)F)c3)C2)C1 ZINC001169025939 1132640781 /nfs/dbraw/zinc/64/07/81/1132640781.db2.gz KCLKROIDROIISD-XNRPHZJLSA-N 1 0 342.361 3.940 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1cc(C)ccc1C ZINC001175362163 1132650011 /nfs/dbraw/zinc/65/00/11/1132650011.db2.gz RKRKEOPDAUUNEW-INIZCTEOSA-N 1 0 341.411 3.891 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O)C1CCCCCC1 ZINC001169137888 1132667338 /nfs/dbraw/zinc/66/73/38/1132667338.db2.gz XRHJOTLLTRWIRD-RDTXWAMCSA-N 1 0 345.443 3.649 20 5 EHBDRO CC1(C)C[C@H](Nc2cc(F)cc(F)c2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169141599 1132673994 /nfs/dbraw/zinc/67/39/94/1132673994.db2.gz CLIOPDFPTZWSAT-MEDUHNTESA-N 1 0 327.375 3.829 20 5 EHBDRO Cc1cccc([C@@H]2CC[N@H+](CCOc3ccc([N+](=O)[O-])cc3)C2)c1 ZINC001169197577 1132688834 /nfs/dbraw/zinc/68/88/34/1132688834.db2.gz OOQPNRATFPIKCZ-QGZVFWFLSA-N 1 0 326.396 3.772 20 5 EHBDRO c1nc(CNc2nc3ccccc3c3ccccc32)c2n1CCC[NH2+]C2 ZINC001169244496 1132708390 /nfs/dbraw/zinc/70/83/90/1132708390.db2.gz GCLCMTRBZLXVJC-UHFFFAOYSA-N 1 0 343.434 3.690 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967255 1132924352 /nfs/dbraw/zinc/92/43/52/1132924352.db2.gz IGQNOMCBQIYNBI-WBMJQRKESA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1c([N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000804352047 1132981509 /nfs/dbraw/zinc/98/15/09/1132981509.db2.gz NLRDJWMYEDSYIL-ZDUSSCGKSA-N 1 0 336.392 3.570 20 5 EHBDRO Cc1ccc(C)c(C2CC[NH+](Cc3cccnc3[N+](=O)[O-])CC2)c1 ZINC001176803562 1133000490 /nfs/dbraw/zinc/00/04/90/1133000490.db2.gz HOFDUFZNVLHHTA-UHFFFAOYSA-N 1 0 325.412 3.986 20 5 EHBDRO CC(C)CC[C@@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000767758652 1133048706 /nfs/dbraw/zinc/04/87/06/1133048706.db2.gz DUXWZSMKXMYGAK-INIZCTEOSA-N 1 0 343.431 3.711 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccco1 ZINC001177554217 1133074912 /nfs/dbraw/zinc/07/49/12/1133074912.db2.gz QECFLXCRQBFVTF-QGZVFWFLSA-N 1 0 331.416 3.669 20 5 EHBDRO CC[N@@H+]1CCC[C@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541962 1133079670 /nfs/dbraw/zinc/07/96/70/1133079670.db2.gz GYRNHKJGWYSPAE-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1Cl ZINC000773700943 1133089705 /nfs/dbraw/zinc/08/97/05/1133089705.db2.gz LGFDFAWLESGVEF-DZGCQCFKSA-N 1 0 338.835 3.887 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC)C12CCCCC2 ZINC001170001414 1133241292 /nfs/dbraw/zinc/24/12/92/1133241292.db2.gz KODWAIVWIVCRNR-QZTJIDSGSA-N 1 0 348.443 3.821 20 5 EHBDRO C[C@@H]1COC[C@H]1[NH2+]Cc1ccc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC001179644935 1133265649 /nfs/dbraw/zinc/26/56/49/1133265649.db2.gz AQHBBWLNBTUIFF-QMTHXVAHSA-N 1 0 336.775 3.633 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)c1ccccc1 ZINC001181871606 1133544169 /nfs/dbraw/zinc/54/41/69/1133544169.db2.gz XGSCIXHQTFCLGD-KRWDZBQOSA-N 1 0 334.803 3.900 20 5 EHBDRO CC(C)(C)[C@@H](Cn1ccnc1)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774133928 1133620747 /nfs/dbraw/zinc/62/07/47/1133620747.db2.gz JRHLCGWLNROLLS-ZWKOTPCHSA-N 1 0 342.443 3.873 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000772024786 1133635368 /nfs/dbraw/zinc/63/53/68/1133635368.db2.gz VLEHXXANXUAARZ-JTQLQIEISA-N 1 0 332.231 3.868 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)c1ccccc1Cl)CCC2 ZINC000774256046 1133645153 /nfs/dbraw/zinc/64/51/53/1133645153.db2.gz WGBBGZRFWGNKOD-ZWKOTPCHSA-N 1 0 346.814 3.949 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1cccc([N+](=O)[O-])c1 ZINC000786822066 1133911095 /nfs/dbraw/zinc/91/10/95/1133911095.db2.gz ZMVLHPBHVRQJNK-GXDHUFHOSA-N 1 0 341.367 3.739 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC(C)(C)[NH2+]C(C)(C)C1 ZINC001184376087 1133932835 /nfs/dbraw/zinc/93/28/35/1133932835.db2.gz ZSOVJZWVMRGHHT-RVDMUPIBSA-N 1 0 331.460 3.851 20 5 EHBDRO COc1cc(NC[C@@H](C(C)C)[NH+]2CCCC2)c(Cl)cc1[N+](=O)[O-] ZINC001184739483 1133984997 /nfs/dbraw/zinc/98/49/97/1133984997.db2.gz GRYCOOVDUNJRST-HNNXBMFYSA-N 1 0 341.839 3.789 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CC[NH+](CC3CCCCC3)CC2)c(F)c1 ZINC001185088399 1134026248 /nfs/dbraw/zinc/02/62/48/1134026248.db2.gz FAQQRQIEULHXRF-UHFFFAOYSA-N 1 0 339.386 3.575 20 5 EHBDRO Cc1ccccc1[C@H](O)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000788580147 1134147148 /nfs/dbraw/zinc/14/71/48/1134147148.db2.gz JMPUVVGEPQKPEW-RTBURBONSA-N 1 0 340.423 3.949 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000788576374 1134147241 /nfs/dbraw/zinc/14/72/41/1134147241.db2.gz ZJAZAJNQHNTTTO-DYVFJYSZSA-N 1 0 346.431 3.504 20 5 EHBDRO Cc1cccc(O[C@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788607094 1134150456 /nfs/dbraw/zinc/15/04/56/1134150456.db2.gz COVPFFRJHHBNGQ-ZIAGYGMSSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc(F)cc1Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788641086 1134154616 /nfs/dbraw/zinc/15/46/16/1134154616.db2.gz VHBDCTGRNGFPFB-SNVBAGLBSA-N 1 0 337.782 3.863 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788688723 1134157531 /nfs/dbraw/zinc/15/75/31/1134157531.db2.gz GTQQPQPTWQVQQF-PZROIBLQSA-N 1 0 347.390 3.743 20 5 EHBDRO C[C@@H]([NH2+]CC1(Cc2ccccc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788669016 1134160032 /nfs/dbraw/zinc/16/00/32/1134160032.db2.gz CEZAFXOTGLJQGD-CQSZACIVSA-N 1 0 325.412 3.851 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788749715 1134164725 /nfs/dbraw/zinc/16/47/25/1134164725.db2.gz GUCJDFJFEZNJCR-URKNILKWSA-N 1 0 341.411 3.748 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCC2(CCCCC2)O1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788777871 1134174536 /nfs/dbraw/zinc/17/45/36/1134174536.db2.gz QHPMSYYJDMCITF-ZFWWWQNUSA-N 1 0 333.432 3.710 20 5 EHBDRO C[N@H+](CCSCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC001189215681 1134559631 /nfs/dbraw/zinc/55/96/31/1134559631.db2.gz PRSZNVWCPKWEGJ-UHFFFAOYSA-N 1 0 346.452 3.839 20 5 EHBDRO Cc1ccc([C@H]2CC[N@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)c(C)c1 ZINC000791604443 1134582225 /nfs/dbraw/zinc/58/22/25/1134582225.db2.gz JPRXSFICEPHISE-FXAWDEMLSA-N 1 0 340.423 3.735 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2csc(C)n2)c([N+](=O)[O-])c1 ZINC001170297711 1134737628 /nfs/dbraw/zinc/73/76/28/1134737628.db2.gz QTRVMDWFRWDREV-WDEREUQCSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2c(C)cccc2C)c([N+](=O)[O-])c1 ZINC001170304478 1134739261 /nfs/dbraw/zinc/73/92/61/1134739261.db2.gz CHDBOBGHMASYEP-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](c2cccnc2)C(C)C)c([N+](=O)[O-])c1 ZINC001170305679 1134739844 /nfs/dbraw/zinc/73/98/44/1134739844.db2.gz PKQUBQXBADMEFM-AUUYWEPGSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001170312738 1134744944 /nfs/dbraw/zinc/74/49/44/1134744944.db2.gz HLJLZRFJLPBMMW-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2cncc(Cl)c2)c([N+](=O)[O-])c1 ZINC001170326347 1134748733 /nfs/dbraw/zinc/74/87/33/1134748733.db2.gz HOPOVBCTKSGHSC-NWDGAFQWSA-N 1 0 349.818 3.934 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1cccnc1 ZINC001170306523 1134752452 /nfs/dbraw/zinc/75/24/52/1134752452.db2.gz WWEJNFIQUJRWFR-SUMWQHHRSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CC2(C)CC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170309291 1134752874 /nfs/dbraw/zinc/75/28/74/1134752874.db2.gz PYWOMHPRLAWTRP-LLVKDONJSA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170344336 1134758600 /nfs/dbraw/zinc/75/86/00/1134758600.db2.gz ANQYNCPAECPRFN-AWEZNQCLSA-N 1 0 346.402 3.848 20 5 EHBDRO O=[N+]([O-])CC[N@H+](Cc1ccccc1OC(F)(F)F)C1CCCC1 ZINC001190912549 1134769003 /nfs/dbraw/zinc/76/90/03/1134769003.db2.gz FBZCNRFBJFRMJK-UHFFFAOYSA-N 1 0 332.322 3.607 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ccccc2)C2CCOCC2)cc1 ZINC000775439557 1134807548 /nfs/dbraw/zinc/80/75/48/1134807548.db2.gz NYJZQBXWBUSGDY-HXUWFJFHSA-N 1 0 340.423 3.895 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001191214070 1134819267 /nfs/dbraw/zinc/81/92/67/1134819267.db2.gz MAZLJVQMBFBLOU-ZWKOTPCHSA-N 1 0 342.443 3.676 20 5 EHBDRO Nc1ccc(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000804386697 1135051836 /nfs/dbraw/zinc/05/18/36/1135051836.db2.gz HFXUPWYHSHQWTH-INIZCTEOSA-N 1 0 340.427 3.501 20 5 EHBDRO O=[N+]([O-])c1cccc([N+](=O)[O-])c1NC1CC[NH+](CC2CCCC2)CC1 ZINC000804389343 1135052644 /nfs/dbraw/zinc/05/26/44/1135052644.db2.gz DAXNLQDEPRKFGR-UHFFFAOYSA-N 1 0 348.403 3.570 20 5 EHBDRO CSCCCCC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000775582174 1135117565 /nfs/dbraw/zinc/11/75/65/1135117565.db2.gz ODCOHMMCKUEZGA-UHFFFAOYSA-N 1 0 337.489 3.687 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC001193954718 1135205864 /nfs/dbraw/zinc/20/58/64/1135205864.db2.gz LDUBLLPGWHSNBP-SCTDSRPQSA-N 1 0 332.444 3.809 20 5 EHBDRO CCCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@@H]1CCC[C@H](C)C1 ZINC001194714601 1135311463 /nfs/dbraw/zinc/31/14/63/1135311463.db2.gz IWFYJJRIKUUNMX-WMLDXEAASA-N 1 0 347.459 3.875 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@H](c2ccccc2)C2CCCCC2)c1 ZINC000775629051 1135348395 /nfs/dbraw/zinc/34/83/95/1135348395.db2.gz NLVXVNWRYAEWTQ-GOSISDBHSA-N 1 0 328.416 3.703 20 5 EHBDRO C[C@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001195809866 1135474123 /nfs/dbraw/zinc/47/41/23/1135474123.db2.gz OSVACOKPYYDYOE-HNNXBMFYSA-N 1 0 326.396 3.635 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613092 1135589537 /nfs/dbraw/zinc/58/95/37/1135589537.db2.gz HTUWVHRXYYYZRL-RDFMZFSFSA-N 1 0 332.400 3.560 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCCCC[N@H+]1CCCC[C@@H]1C ZINC000807926237 1135591375 /nfs/dbraw/zinc/59/13/75/1135591375.db2.gz FYNXIYYKJSFAIB-AWEZNQCLSA-N 1 0 333.432 3.864 20 5 EHBDRO CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])[C@@H](CO)c1ccccc1 ZINC001197256213 1135666718 /nfs/dbraw/zinc/66/67/18/1135666718.db2.gz OSWLZZRJLMRRFY-KRWDZBQOSA-N 1 0 334.803 3.804 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](Cc1ccccc1)C(C)C ZINC001197770798 1135735457 /nfs/dbraw/zinc/73/54/57/1135735457.db2.gz VGWXNANPRGMSST-SFHVURJKSA-N 1 0 328.412 3.960 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000775870918 1135833397 /nfs/dbraw/zinc/83/33/97/1135833397.db2.gz OWKKFTWLKSKOBC-ZBFHGGJFSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])C(C)C ZINC000775894917 1135860592 /nfs/dbraw/zinc/86/05/92/1135860592.db2.gz KOFMWXPOINDFDJ-INIZCTEOSA-N 1 0 342.823 3.706 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2CC(c3cccc(Cl)c3)C2)cc1 ZINC000809732599 1135873683 /nfs/dbraw/zinc/87/36/83/1135873683.db2.gz GJVCCLNPNRFLPL-JFUPDXTOSA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CC2(c3ccccn3)CCC2)cc1Cl ZINC000809710918 1135875918 /nfs/dbraw/zinc/87/59/18/1135875918.db2.gz CXCMVEUPWZJGJG-UHFFFAOYSA-N 1 0 331.803 3.855 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000809749100 1135885015 /nfs/dbraw/zinc/88/50/15/1135885015.db2.gz BNLJGMDNEQQOKO-UHFFFAOYSA-N 1 0 325.840 3.556 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@@]2(CCOC2)C1 ZINC000809954054 1135905841 /nfs/dbraw/zinc/90/58/41/1135905841.db2.gz PGCBDYCCMHRLDM-CQSZACIVSA-N 1 0 331.199 3.514 20 5 EHBDRO CCCCC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C(C)(C)C ZINC000776025233 1135929134 /nfs/dbraw/zinc/92/91/34/1135929134.db2.gz QBKDOTJQGSFLCQ-MRXNPFEDSA-N 1 0 335.448 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000810165505 1135929675 /nfs/dbraw/zinc/92/96/75/1135929675.db2.gz URSKPJDDCSLDJD-SJLPKXTDSA-N 1 0 346.814 3.504 20 5 EHBDRO COc1ccc([C@H](OC)[C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001201704131 1136054510 /nfs/dbraw/zinc/05/45/10/1136054510.db2.gz MEJGGIOMYRQDKY-AUUYWEPGSA-N 1 0 344.411 3.778 20 5 EHBDRO C[C@@H]1C[C@@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000811484364 1136092071 /nfs/dbraw/zinc/09/20/71/1136092071.db2.gz VJUBXPBZFORUOO-BXKDBHETSA-N 1 0 344.242 3.616 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776275873 1136130105 /nfs/dbraw/zinc/13/01/05/1136130105.db2.gz IAZNQQSXXNZVRR-GOSISDBHSA-N 1 0 344.411 3.595 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275762 1136130194 /nfs/dbraw/zinc/13/01/94/1136130194.db2.gz HPFAIAFKYMBXLO-LJQANCHMSA-N 1 0 328.412 3.583 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H]2CCc2ccccc2)cc1 ZINC000776279057 1136133641 /nfs/dbraw/zinc/13/36/41/1136133641.db2.gz WYKOBLSYIXTKMK-QUCCMNQESA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@H]2COc2ccccc2)c(F)c1 ZINC001170651881 1136162518 /nfs/dbraw/zinc/16/25/18/1136162518.db2.gz ZYWIXKRKMZBTOL-ZDUSSCGKSA-N 1 0 348.349 3.916 20 5 EHBDRO Cn1c2cc(F)ccc2nc1NCc1cc([N+](=O)[O-])ccc1Cl ZINC000814258347 1136428356 /nfs/dbraw/zinc/42/83/56/1136428356.db2.gz DPESKGGLLJBJQI-UHFFFAOYSA-N 1 0 334.738 3.886 20 5 EHBDRO CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)[C@@H]1c1ccccc1 ZINC000776591398 1136453433 /nfs/dbraw/zinc/45/34/33/1136453433.db2.gz MECOHKIAHSLRCG-QZTJIDSGSA-N 1 0 326.396 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC3(CCCC3)[C@@H]2c2ccco2)cc1 ZINC000852427128 1136455340 /nfs/dbraw/zinc/45/53/40/1136455340.db2.gz STCNJWMFCBFGOL-WMZOPIPTSA-N 1 0 342.395 3.839 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+](Cc2ccccc2F)CC2CC2)c1 ZINC000852563280 1136466716 /nfs/dbraw/zinc/46/67/16/1136466716.db2.gz BEEPYDBKLBOSJR-IBGZPJMESA-N 1 0 344.386 3.680 20 5 EHBDRO Cc1ccc2c(c1)C[N@@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)C2 ZINC000815185512 1136563840 /nfs/dbraw/zinc/56/38/40/1136563840.db2.gz ILCMZTIFDIOSAL-IBGZPJMESA-N 1 0 340.423 3.774 20 5 EHBDRO Cc1ccc(OC[C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815570714 1136617978 /nfs/dbraw/zinc/61/79/78/1136617978.db2.gz KSOVYIOUMWPGCC-ZIAGYGMSSA-N 1 0 329.400 3.604 20 5 EHBDRO CCOC1(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCCC1 ZINC000815644695 1136625624 /nfs/dbraw/zinc/62/56/24/1136625624.db2.gz JZMDNIPXGOKALO-UHFFFAOYSA-N 1 0 347.459 3.503 20 5 EHBDRO Cc1ccc(NC(=O)c2cc(Cl)ccc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000776924411 1136851926 /nfs/dbraw/zinc/85/19/26/1136851926.db2.gz BFKFDXROWWVLDA-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(c3ccc(Cl)cc3)CC2)c1 ZINC000819009816 1136899768 /nfs/dbraw/zinc/89/97/68/1136899768.db2.gz SGEQTOKIOXIZNI-QGZVFWFLSA-N 1 0 346.814 3.603 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000819091927 1136907311 /nfs/dbraw/zinc/90/73/11/1136907311.db2.gz OKRRUHAVUFAHKE-LJQANCHMSA-N 1 0 328.412 3.549 20 5 EHBDRO CC[C@H](CSc1ccccc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819187128 1136921222 /nfs/dbraw/zinc/92/12/22/1136921222.db2.gz BIBJOGSTFWVAHE-CRAIPNDOSA-N 1 0 346.452 3.789 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@@H]1[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819196332 1136922331 /nfs/dbraw/zinc/92/23/31/1136922331.db2.gz AARYUUGPHAEKEB-UPRAQXHNSA-N 1 0 326.396 3.541 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)CCC2 ZINC000819328841 1136931792 /nfs/dbraw/zinc/93/17/92/1136931792.db2.gz PIFBMZGEAWDRSV-MOPGFXCFSA-N 1 0 326.396 3.604 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859586368 1137021339 /nfs/dbraw/zinc/02/13/39/1137021339.db2.gz NNUFMVNEJLHNMS-DNVCBOLYSA-N 1 0 326.396 3.639 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)CC[N@H+](C)C2CCCCC2)c1C ZINC001143769969 1137197186 /nfs/dbraw/zinc/19/71/86/1137197186.db2.gz NDDZUHAKRWRAQT-UHFFFAOYSA-N 1 0 347.459 3.548 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(C)s2)c1 ZINC000844318059 1137212324 /nfs/dbraw/zinc/21/23/24/1137212324.db2.gz LXNHUOZNFMVPGK-LLVKDONJSA-N 1 0 334.397 3.602 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)N(CC[NH+](C)C)C1CCCCC1 ZINC001143964087 1137219646 /nfs/dbraw/zinc/21/96/46/1137219646.db2.gz DZCGSUMSPJOEET-UHFFFAOYSA-N 1 0 347.459 3.548 20 5 EHBDRO Cc1ccc2c(C[C@@H](C)[NH3+])cn(-c3ncc(F)c(C)c3[N+](=O)[O-])c2c1 ZINC001171164127 1137275952 /nfs/dbraw/zinc/27/59/52/1137275952.db2.gz HEJBCKCJSOHJPC-LLVKDONJSA-N 1 0 342.374 3.579 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])cc1C(F)F)c1ccco1 ZINC000865406452 1137280478 /nfs/dbraw/zinc/28/04/78/1137280478.db2.gz UORBQJDPJISULD-CYBMUJFWSA-N 1 0 325.315 3.840 20 5 EHBDRO CC(C)([NH2+][C@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000865577491 1137296366 /nfs/dbraw/zinc/29/63/66/1137296366.db2.gz LAFNIRPRLHXEDY-HNNXBMFYSA-N 1 0 325.412 3.762 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[C@H](C)C1 ZINC001171188381 1137297648 /nfs/dbraw/zinc/29/76/48/1137297648.db2.gz BKHCZRLCYNWANS-AEGPPILISA-N 1 0 333.432 3.646 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000866022400 1137324959 /nfs/dbraw/zinc/32/49/59/1137324959.db2.gz XDIQHHBMOMAVPH-UHFFFAOYSA-N 1 0 346.456 3.659 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](CCCO)c1ccccc1 ZINC000866271743 1137341688 /nfs/dbraw/zinc/34/16/88/1137341688.db2.gz PHLAXYZRGZFYPI-KDOFPFPSSA-N 1 0 346.402 3.768 20 5 EHBDRO CCc1cnc(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866274695 1137341916 /nfs/dbraw/zinc/34/19/16/1137341916.db2.gz QRVPQKSXJILAOS-LLVKDONJSA-N 1 0 337.420 3.516 20 5 EHBDRO Cc1csc([C@@H](C)C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])n1 ZINC000866336680 1137347133 /nfs/dbraw/zinc/34/71/33/1137347133.db2.gz GMDWAQRNAJYBBW-WDEREUQCSA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@]1(C)CC1(Cl)Cl ZINC000866367122 1137349855 /nfs/dbraw/zinc/34/98/55/1137349855.db2.gz GBSWSXCIAGZMMK-ZANVPECISA-N 1 0 335.206 3.838 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(F)c1 ZINC000866473631 1137357918 /nfs/dbraw/zinc/35/79/18/1137357918.db2.gz OWTXNGLTQMGKBO-ZDUSSCGKSA-N 1 0 335.404 3.789 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C2CCC2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000866510047 1137359993 /nfs/dbraw/zinc/35/99/93/1137359993.db2.gz IQYOFOHDUPQQBX-AXHNFQJDSA-N 1 0 348.443 3.849 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000121154332 1137369614 /nfs/dbraw/zinc/36/96/14/1137369614.db2.gz KQFUHCNSZZNGOJ-VXGBXAGGSA-N 1 0 347.802 3.926 20 5 EHBDRO [NH3+]CCc1cc2ccccc2n1-c1ccc([N+](=O)[O-])c2cnccc21 ZINC001171304743 1137406797 /nfs/dbraw/zinc/40/67/97/1137406797.db2.gz MGSZFLGGGONJRE-UHFFFAOYSA-N 1 0 332.363 3.588 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](C2CCCCC2)C1 ZINC001171804858 1137513544 /nfs/dbraw/zinc/51/35/44/1137513544.db2.gz JMGFYLVOCLVSPE-HOCLYGCPSA-N 1 0 345.443 3.824 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](C)Cn1ccnc1C ZINC000872030726 1137566387 /nfs/dbraw/zinc/56/63/87/1137566387.db2.gz BCSVSEVUDWRDDI-STQMWFEESA-N 1 0 348.472 3.809 20 5 EHBDRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])c1ccccc1 ZINC000872043226 1137567341 /nfs/dbraw/zinc/56/73/41/1137567341.db2.gz HPAYUNWATDAJJP-OFQRWUPVSA-N 1 0 346.402 3.939 20 5 EHBDRO C[C@@H]([NH2+]CCCCC(=O)OC(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872053407 1137568246 /nfs/dbraw/zinc/56/82/46/1137568246.db2.gz JXIDURYROWBJOG-GFCCVEGCSA-N 1 0 340.395 3.897 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067618 1137569501 /nfs/dbraw/zinc/56/95/01/1137569501.db2.gz ZSUOUTRZRMOIPS-TZMCWYRMSA-N 1 0 346.406 3.719 20 5 EHBDRO CC(C)(C)[C@H]1C[C@@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)CCO1 ZINC000872073168 1137569811 /nfs/dbraw/zinc/56/98/11/1137569811.db2.gz NXKSKFXTDNQELK-KBXCAEBGSA-N 1 0 345.443 3.802 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)Cc1ccccn1 ZINC000872084425 1137570415 /nfs/dbraw/zinc/57/04/15/1137570415.db2.gz SBQGPTFLILGRTC-CHWSQXEVSA-N 1 0 331.441 3.994 20 5 EHBDRO C[C@H](NC[C@@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086667 1137570548 /nfs/dbraw/zinc/57/05/48/1137570548.db2.gz BNHWWAMYWLCMDV-ZFWWWQNUSA-N 1 0 335.423 3.507 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000872128116 1137572977 /nfs/dbraw/zinc/57/29/77/1137572977.db2.gz FLWYICUGCOJWNH-PSVOKBTDSA-N 1 0 332.425 3.744 20 5 EHBDRO CC(=O)Nc1ccc(CC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC000873042207 1137588699 /nfs/dbraw/zinc/58/86/99/1137588699.db2.gz NNFONWKSISUFGI-UHFFFAOYSA-N 1 0 341.411 3.502 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](C[C@H](C)O)c1ccccc1 ZINC000873079573 1137589595 /nfs/dbraw/zinc/58/95/95/1137589595.db2.gz VZDUDXXYZPPKPF-MAUKXSAKSA-N 1 0 342.439 3.856 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)C[C@H](O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000873096946 1137590039 /nfs/dbraw/zinc/59/00/39/1137590039.db2.gz BLURANRJZWIGRV-SGTLLEGYSA-N 1 0 332.375 3.644 20 5 EHBDRO C[C@@H](Cc1ccco1)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000876917364 1137665356 /nfs/dbraw/zinc/66/53/56/1137665356.db2.gz ROLVQHJZPKMSCU-QMMMGPOBSA-N 1 0 345.218 3.733 20 5 EHBDRO CC(C)Oc1ccc([C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000876940449 1137665960 /nfs/dbraw/zinc/66/59/60/1137665960.db2.gz VHEVBFPEHHSLBU-IUDNXUCKSA-N 1 0 344.415 3.633 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3ccc(-c4ccccc4)o3)C2)c1 ZINC000876949167 1137665970 /nfs/dbraw/zinc/66/59/70/1137665970.db2.gz TVNZDOTZPJXDIW-UHFFFAOYSA-N 1 0 338.367 3.545 20 5 EHBDRO CCSc1ccc([C@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877014818 1137667626 /nfs/dbraw/zinc/66/76/26/1137667626.db2.gz RXNXQEPHHKNSRE-GRTSSRMGSA-N 1 0 346.456 3.958 20 5 EHBDRO CCSc1ccc([C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877014819 1137667633 /nfs/dbraw/zinc/66/76/33/1137667633.db2.gz RXNXQEPHHKNSRE-LRVUVFPRSA-N 1 0 346.456 3.958 20 5 EHBDRO CCc1ccc(C(C)(C)C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877077630 1137669681 /nfs/dbraw/zinc/66/96/81/1137669681.db2.gz PHJCGSDJBBTKSF-UHFFFAOYSA-N 1 0 342.443 3.625 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]CCCCCCc3ccccc3)C2)c1 ZINC000877650610 1137684270 /nfs/dbraw/zinc/68/42/70/1137684270.db2.gz MPPFXGSDMLCRLM-UHFFFAOYSA-N 1 0 342.443 3.888 20 5 EHBDRO Cc1cccc([C@@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C(C)C)c1 ZINC000877657164 1137684611 /nfs/dbraw/zinc/68/46/11/1137684611.db2.gz XEJXXRKPKXDVTP-HTWSVDAQSA-N 1 0 328.416 3.790 20 5 EHBDRO C[N@@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)CC1CCCCC1 ZINC000877898854 1137694716 /nfs/dbraw/zinc/69/47/16/1137694716.db2.gz GSLNGQXBMHXSSE-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000878152395 1137704718 /nfs/dbraw/zinc/70/47/18/1137704718.db2.gz BBFVUDSLVTYKHE-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CC[C@@H](C3CCCC3)C2)o1 ZINC000878720967 1137726105 /nfs/dbraw/zinc/72/61/05/1137726105.db2.gz RMORJGIZDKGSFJ-CQSZACIVSA-N 1 0 342.399 3.657 20 5 EHBDRO C=C/C=C\CC[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CC[C@H](O)CC1 ZINC000878754801 1137727095 /nfs/dbraw/zinc/72/70/95/1137727095.db2.gz BRCFUCVGUDYOFR-BSWVIFLNSA-N 1 0 330.428 3.833 20 5 EHBDRO CCOc1cc(C[NH+]2CCC3(CCCCO3)CC2)ccc1[N+](=O)[O-] ZINC000880457314 1137779106 /nfs/dbraw/zinc/77/91/06/1137779106.db2.gz HJTPYSAFSCJXJF-UHFFFAOYSA-N 1 0 334.416 3.529 20 5 EHBDRO CC(=O)c1c(NC2CC[NH+](C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000882056454 1137819902 /nfs/dbraw/zinc/81/99/02/1137819902.db2.gz VERPEDCHLHYHLJ-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000130625896 1137840133 /nfs/dbraw/zinc/84/01/33/1137840133.db2.gz WVUODFOSEWKOBK-UYAOXDASSA-N 1 0 340.423 3.548 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC001202637620 1137903384 /nfs/dbraw/zinc/90/33/84/1137903384.db2.gz FKOYBFFXVCRVHU-HNNXBMFYSA-N 1 0 343.402 3.719 20 5 EHBDRO CC[C@H](C)[N@H+](C)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333603 1137912779 /nfs/dbraw/zinc/91/27/79/1137912779.db2.gz KNANKBYVHHSSBI-ZDUSSCGKSA-N 1 0 348.472 3.538 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@H](C)C1 ZINC000119245146 1137939530 /nfs/dbraw/zinc/93/95/30/1137939530.db2.gz GXQJTLBXQIGZSW-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775511 1137952416 /nfs/dbraw/zinc/95/24/16/1137952416.db2.gz NBQBXQLKNNLRII-SWLSCSKDSA-N 1 0 344.415 3.949 20 5 EHBDRO CCC[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000121060819 1137954810 /nfs/dbraw/zinc/95/48/10/1137954810.db2.gz SPULUNFNDVKWCE-ZDUSSCGKSA-N 1 0 330.388 3.657 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(c2[nH]c(C)c(C)[nH+]2)CC1 ZINC000884707147 1137969688 /nfs/dbraw/zinc/96/96/88/1137969688.db2.gz ZGDSWFUFUKNVQR-UHFFFAOYSA-N 1 0 342.399 3.521 20 5 EHBDRO C[N@@H+](Cc1csc2ccccc12)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136940716 1138044313 /nfs/dbraw/zinc/04/43/13/1138044313.db2.gz DUHZAHACEOHTIE-QGZVFWFLSA-N 1 0 342.420 3.975 20 5 EHBDRO C[C@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1cccc([N+](=O)[O-])c1 ZINC000886707615 1138120530 /nfs/dbraw/zinc/12/05/30/1138120530.db2.gz MGMYBSFQZSLCBK-YJBOKZPZSA-N 1 0 348.443 3.611 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CCc3c2cccc3F)ccc1[N+](=O)[O-] ZINC000886927530 1138173196 /nfs/dbraw/zinc/17/31/96/1138173196.db2.gz KKYYHNVDMHYLTG-MRXNPFEDSA-N 1 0 330.359 3.910 20 5 EHBDRO CS[C@H]1CCCC[N@H+](Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000089924792 1138207903 /nfs/dbraw/zinc/20/79/03/1138207903.db2.gz YCTOIVGIYGJQBY-INIZCTEOSA-N 1 0 347.440 3.967 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cccc3c2OCCCO3)cccc1[N+](=O)[O-] ZINC000090546615 1138211826 /nfs/dbraw/zinc/21/18/26/1138211826.db2.gz NWVOYWJCWRANNB-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000124409849 1138286174 /nfs/dbraw/zinc/28/61/74/1138286174.db2.gz NDCOBTXKBWNKAC-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000152570094 1139098750 /nfs/dbraw/zinc/09/87/50/1139098750.db2.gz DLYYNJPGUGGIDL-BBRMVZONSA-N 1 0 347.415 3.540 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2cccc(N(C)C)c2)cc1[N+](=O)[O-] ZINC000153573944 1139142579 /nfs/dbraw/zinc/14/25/79/1139142579.db2.gz AXAQCAYVNXTYNM-AWEZNQCLSA-N 1 0 343.427 3.910 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CCO)c2ccccc2)cc1[N+](=O)[O-] ZINC000178648763 1139708864 /nfs/dbraw/zinc/70/88/64/1139708864.db2.gz PIWPKPIARFUJNT-YJBOKZPZSA-N 1 0 328.412 3.720 20 5 EHBDRO Cc1cc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c(C)c1 ZINC000178639716 1139709388 /nfs/dbraw/zinc/70/93/88/1139709388.db2.gz CAYFXJFVXQFDQT-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000179135677 1139737903 /nfs/dbraw/zinc/73/79/03/1139737903.db2.gz QUZGOGAMNAHGMZ-DDUZABMNSA-N 1 0 342.443 3.699 20 5 EHBDRO C[C@H]([NH3+])[C@@H]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000179219006 1139742858 /nfs/dbraw/zinc/74/28/58/1139742858.db2.gz ZPACPJRVBCFVHC-GOEBONIOSA-N 1 0 333.435 3.587 20 5 EHBDRO Cc1ccc(C)c(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181812918 1139933558 /nfs/dbraw/zinc/93/35/58/1139933558.db2.gz BDCGERRFXHHPGQ-HNNXBMFYSA-N 1 0 341.411 3.809 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000185865707 1140174163 /nfs/dbraw/zinc/17/41/63/1140174163.db2.gz GIMJCOKFJFJNJP-AWEZNQCLSA-N 1 0 330.388 3.799 20 5 EHBDRO COC[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000192994552 1140558463 /nfs/dbraw/zinc/55/84/63/1140558463.db2.gz UMBOREFCTZYDQF-MOPGFXCFSA-N 1 0 326.396 3.950 20 5 EHBDRO C[C@@H](CO)[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000266142435 1140647267 /nfs/dbraw/zinc/64/72/67/1140647267.db2.gz HSWYFFJAFDHXFU-NSHDSACASA-N 1 0 336.775 3.511 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1c(F)cccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000266781855 1140723795 /nfs/dbraw/zinc/72/37/95/1140723795.db2.gz NEASNZXHJZMKDP-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO CC(C)n1cnnc1[C@@H]1CCC[N@@H+]([C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000266924398 1140738071 /nfs/dbraw/zinc/73/80/71/1140738071.db2.gz MUKRJPMPPQTOKN-LSDHHAIUSA-N 1 0 343.431 3.708 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2ccc(F)cc2N(C)C)cc1[N+](=O)[O-] ZINC000268827334 1141002113 /nfs/dbraw/zinc/00/21/13/1141002113.db2.gz NPCDBAMWLAIHFO-GFCCVEGCSA-N 1 0 347.390 3.659 20 5 EHBDRO C[C@H](O)C[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000268983098 1141039935 /nfs/dbraw/zinc/03/99/35/1141039935.db2.gz DDKSWCOQGHMCDN-MPGHIAIKSA-N 1 0 328.412 3.800 20 5 EHBDRO CCc1nc(C)c([C@H](C)[N@H+](C)C[C@H](O)c2cccc([N+](=O)[O-])c2)s1 ZINC000269625587 1141128723 /nfs/dbraw/zinc/12/87/23/1141128723.db2.gz CJVFZWRAJVFQOA-WFASDCNBSA-N 1 0 349.456 3.649 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@H+](Cc2ccco2)C2CCCC2)c1 ZINC000269629387 1141130130 /nfs/dbraw/zinc/13/01/30/1141130130.db2.gz DUKDFKAULIORRT-GOSISDBHSA-N 1 0 330.384 3.666 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(CCO)CCCC2)cc1[N+](=O)[O-] ZINC000271127481 1141310231 /nfs/dbraw/zinc/31/02/31/1141310231.db2.gz KVFVIAMELXTRSY-CQSZACIVSA-N 1 0 336.432 3.587 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cn(C)nc1C ZINC000271131386 1141311472 /nfs/dbraw/zinc/31/14/72/1141311472.db2.gz MBAAYTPCXXODTN-GXTWGEPZSA-N 1 0 348.472 3.858 20 5 EHBDRO COC[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000271212200 1141327139 /nfs/dbraw/zinc/32/71/39/1141327139.db2.gz YRTTYOFBONBLNM-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1(CCOC)CC1 ZINC000271452584 1141370515 /nfs/dbraw/zinc/37/05/15/1141370515.db2.gz DXHYSYWQNIWRPP-AWEZNQCLSA-N 1 0 338.473 3.872 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCCc1nccs1 ZINC000271480080 1141377775 /nfs/dbraw/zinc/37/77/75/1141377775.db2.gz KEZLKEXDVRXDME-GDBMZVCRSA-N 1 0 345.468 3.985 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2CCC(O)(c3ccccc3)CC2)cs1 ZINC000273868872 1141436856 /nfs/dbraw/zinc/43/68/56/1141436856.db2.gz VSJCVXOMXMLLNZ-UHFFFAOYSA-N 1 0 332.425 3.576 20 5 EHBDRO Cc1nnc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000274238785 1141488547 /nfs/dbraw/zinc/48/85/47/1141488547.db2.gz QNIHOKAUECYERX-NJZAAPMLSA-N 1 0 346.456 3.817 20 5 EHBDRO CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCOC1 ZINC000339207633 1141528583 /nfs/dbraw/zinc/52/85/83/1141528583.db2.gz ZHQUANIWCLWRAI-CYBMUJFWSA-N 1 0 332.322 3.613 20 5 EHBDRO Cc1ccccc1[C@H](C)[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000246844044 1014259952 /nfs/dbraw/zinc/25/99/52/1014259952.db2.gz KNTSUMGVDXLVHI-LSDHHAIUSA-N 1 0 326.400 3.546 20 5 EHBDRO CO[C@H]1CCN(Cc2ccc(Oc3ccc(F)cc3)c([N+](=O)[O-])c2)C1 ZINC000536667497 1032090054 /nfs/dbraw/zinc/09/00/54/1032090054.db2.gz DSFVZGATEWAHJQ-INIZCTEOSA-N 1 0 346.358 3.747 20 5 EHBDRO CC[NH+](CC)CCN(CC(C)C)C(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000579820244 1014939937 /nfs/dbraw/zinc/93/99/37/1014939937.db2.gz DPGIPCWRBIXDBP-MRXNPFEDSA-N 1 0 349.475 3.525 20 5 EHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000117346966 1015072947 /nfs/dbraw/zinc/07/29/47/1015072947.db2.gz NTOQKCUDNVCIKN-OAHLLOKOSA-N 1 0 330.388 3.655 20 5 EHBDRO CC(C)(O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000274790796 1015152521 /nfs/dbraw/zinc/15/25/21/1015152521.db2.gz YJMSWZIDQYELBQ-UHFFFAOYSA-N 1 0 338.791 3.759 20 5 EHBDRO C[C@@]1([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CCO[C@@H]1C1CC1 ZINC000559150639 1015172772 /nfs/dbraw/zinc/17/27/72/1015172772.db2.gz YJRZYLLQKNMAIZ-HUUCEWRRSA-N 1 0 344.333 3.661 20 5 EHBDRO CN(Cc1cc[nH]n1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000536675527 1032112441 /nfs/dbraw/zinc/11/24/41/1032112441.db2.gz UFEZRCSCPLWMCH-UHFFFAOYSA-N 1 0 328.397 3.678 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCCC3)cccc1[N+](=O)[O-] ZINC000183266762 1125498296 /nfs/dbraw/zinc/49/82/96/1125498296.db2.gz FJFFCMLTHCZVKA-PLYYQAHHSA-N 1 0 330.428 3.902 20 5 EHBDRO C[C@@H]1CC[C@]2(CC[N@H+](Cc3nc(-c4ccc([N+](=O)[O-])cc4)no3)C2)C1 ZINC000359540982 1015777342 /nfs/dbraw/zinc/77/73/42/1015777342.db2.gz CTRUZSTVCRAMIK-ACJLOTCBSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001167226897 1016662701 /nfs/dbraw/zinc/66/27/01/1016662701.db2.gz DJIBNAFALYIQGT-WCQYABFASA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC23CCCCC3)c2c(c1)COCO2 ZINC000408009585 1016896442 /nfs/dbraw/zinc/89/64/42/1016896442.db2.gz LYEUOGFNJMBKBK-UHFFFAOYSA-N 1 0 332.400 3.760 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)O1 ZINC000414515916 1016949642 /nfs/dbraw/zinc/94/96/42/1016949642.db2.gz OCSJDXOHGSVJNY-UMVBOHGHSA-N 1 0 330.384 3.758 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@@H](CO)C2)s1 ZINC000414564495 1016961244 /nfs/dbraw/zinc/96/12/44/1016961244.db2.gz DPRUIMIXJSCWLJ-KGLIPLIRSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1c2ccccc2oc1[C@H]([NH2+]CCn1ccc([N+](=O)[O-])n1)C(C)C ZINC000538159945 1032181188 /nfs/dbraw/zinc/18/11/88/1032181188.db2.gz OCAVZHYDQOGSLR-QGZVFWFLSA-N 1 0 342.399 3.833 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1CCCC13CCOCC3)CCC2 ZINC000376986706 1017236806 /nfs/dbraw/zinc/23/68/06/1017236806.db2.gz TXKGEWDEJGRENK-ZWKOTPCHSA-N 1 0 330.428 3.911 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000538177285 1032197905 /nfs/dbraw/zinc/19/79/05/1032197905.db2.gz SGLWAZGZOQYRPO-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO O=C(CC[NH2+][C@@H]1CC[C@@H]2CCCC[C@@H]2C1)Nc1ccccc1[N+](=O)[O-] ZINC000548825369 1032251366 /nfs/dbraw/zinc/25/13/66/1032251366.db2.gz FRZUKDQNFGMSKJ-ARFHVFGLSA-N 1 0 345.443 3.872 20 5 EHBDRO CCc1ccc([C@H](COC)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])o1 ZINC000449152786 1032255732 /nfs/dbraw/zinc/25/57/32/1032255732.db2.gz HFUYDTHQZZSBAY-CJNGLKHVSA-N 1 0 332.400 3.659 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H]1CCOC2(CCSCC2)C1 ZINC000573107568 1017076726 /nfs/dbraw/zinc/07/67/26/1017076726.db2.gz YCUYTFUWXRCYGR-XJKSGUPXSA-N 1 0 348.468 3.617 20 5 EHBDRO COCC1(C)C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000459623516 1032336675 /nfs/dbraw/zinc/33/66/75/1032336675.db2.gz QIPULJUROKRKNT-UHFFFAOYSA-N 1 0 332.425 3.792 20 5 EHBDRO CC(C)[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000449223156 1032339731 /nfs/dbraw/zinc/33/97/31/1032339731.db2.gz JJFCNZVLJXUWHV-BLLLJJGKSA-N 1 0 344.415 3.773 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000449479360 1032604282 /nfs/dbraw/zinc/60/42/82/1032604282.db2.gz MDMBCUMWTIRXKC-OAHLLOKOSA-N 1 0 334.803 3.768 20 5 EHBDRO CC(C)n1cc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000449494381 1032658087 /nfs/dbraw/zinc/65/80/87/1032658087.db2.gz AOHBXNHZMDTMPE-QGZVFWFLSA-N 1 0 328.416 3.752 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@H]2/C=C/c2cccs2)c1 ZINC000543990651 1017117889 /nfs/dbraw/zinc/11/78/89/1017117889.db2.gz PLWRAYHAXWYARI-KIUWMYQTSA-N 1 0 346.456 3.811 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2ccc(Cl)c(Cl)c2)cc1 ZINC000754251760 1017321309 /nfs/dbraw/zinc/32/13/09/1017321309.db2.gz WTPIIBYLSJJRRG-HNNXBMFYSA-N 1 0 341.194 3.725 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095555 1017325745 /nfs/dbraw/zinc/32/57/45/1017325745.db2.gz GXGZCFZBSHKVNZ-QFBILLFUSA-N 1 0 339.395 3.727 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C[C@H]1C ZINC000449507234 1032691311 /nfs/dbraw/zinc/69/13/11/1032691311.db2.gz STLDSXKLSMUSKY-DYVFJYSZSA-N 1 0 330.384 3.712 20 5 EHBDRO C[C@H]([NH3+])[C@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000415014165 1017408921 /nfs/dbraw/zinc/40/89/21/1017408921.db2.gz LOHVRPDQLHDFHK-RYUDHWBXSA-N 1 0 349.818 3.866 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](C)c1ccccc1)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000177481589 1017678767 /nfs/dbraw/zinc/67/87/67/1017678767.db2.gz OKSOUZHUSCNGTL-ILXRZTDVSA-N 1 0 341.411 3.704 20 5 EHBDRO C[C@@H]1CC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H](C)C1 ZINC000119081513 1018121119 /nfs/dbraw/zinc/12/11/19/1018121119.db2.gz PFFDATDOPJMABB-ZIAGYGMSSA-N 1 0 329.400 3.913 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC(C2CCOCC2)CC1 ZINC000119531620 1018167655 /nfs/dbraw/zinc/16/76/55/1018167655.db2.gz SZSAHZYNBLUUNV-UHFFFAOYSA-N 1 0 338.835 3.887 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCc1ccc([C@@H](C)[NH3+])cc1 ZINC000415583179 1018252237 /nfs/dbraw/zinc/25/22/37/1018252237.db2.gz QLYXGRVQDZYEND-CYBMUJFWSA-N 1 0 342.399 3.553 20 5 EHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCNc1ccc([N+](=O)[O-])c2cnccc12 ZINC000341094352 1018532059 /nfs/dbraw/zinc/53/20/59/1018532059.db2.gz FNGORMOTMNCYLE-KBPBESRZSA-N 1 0 328.416 3.818 20 5 EHBDRO C[N@H+](CCCn1ccnc1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290364595 1018536282 /nfs/dbraw/zinc/53/62/82/1018536282.db2.gz HAPHZXYCBVFHSC-UHFFFAOYSA-N 1 0 340.383 3.573 20 5 EHBDRO CC(C)[C@@H](CNC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH+]1CCCCCC1 ZINC000602290169 1032772703 /nfs/dbraw/zinc/77/27/03/1032772703.db2.gz UXJCVKVMKXUNHZ-QGZVFWFLSA-N 1 0 348.447 3.617 20 5 EHBDRO Cc1cccc2nc(CC[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3C)cn21 ZINC000592404614 1032777064 /nfs/dbraw/zinc/77/70/64/1032777064.db2.gz UMJWNAFYXRRVGE-HNNXBMFYSA-N 1 0 338.411 3.753 20 5 EHBDRO C[N@H+](CCNc1ccc2ncccc2c1[N+](=O)[O-])Cc1ccccc1 ZINC000064916263 1018719883 /nfs/dbraw/zinc/71/98/83/1018719883.db2.gz CTHWDIUYCLVOTA-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cn2c(cccc2C)n1 ZINC000592402984 1032799326 /nfs/dbraw/zinc/79/93/26/1032799326.db2.gz JYGZZLVKGJIVCA-OAHLLOKOSA-N 1 0 338.411 3.753 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000610420391 1019009561 /nfs/dbraw/zinc/00/95/61/1019009561.db2.gz FMJCYKJSXTZWAZ-JKSUJKDBSA-N 1 0 325.412 3.772 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@H](n2ncc3ccccc32)C1 ZINC000513412991 1019644136 /nfs/dbraw/zinc/64/41/36/1019644136.db2.gz FQJGSDCNOXFQJS-MOTZXUDYSA-N 1 0 348.406 3.905 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](n3ncc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000513414843 1019647585 /nfs/dbraw/zinc/64/75/85/1019647585.db2.gz PJRGSOKSXPKDGE-QGZVFWFLSA-N 1 0 336.395 3.700 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@@H+]2C2CC2)cc1OC(F)F ZINC000433817116 1019654621 /nfs/dbraw/zinc/65/46/21/1019654621.db2.gz CIQGSHXPFIKJKU-CYBMUJFWSA-N 1 0 341.358 3.625 20 5 EHBDRO CC[C@H](C)[C@@H](O)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236980191 1020136847 /nfs/dbraw/zinc/13/68/47/1020136847.db2.gz DWBHLENVKLYQRD-LRDDRELGSA-N 1 0 334.441 3.820 20 5 EHBDRO CC(C)(C)[C@@H](CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000581282681 1020627030 /nfs/dbraw/zinc/62/70/30/1020627030.db2.gz LQOLWZFYLXABDF-QGZVFWFLSA-N 1 0 332.400 3.742 20 5 EHBDRO CCOC(CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)OCC ZINC000276291107 1020990496 /nfs/dbraw/zinc/99/04/96/1020990496.db2.gz ZPKYIGLVKFONAW-UHFFFAOYSA-N 1 0 348.399 3.734 20 5 EHBDRO C[C@@H]([NH2+]CC1CCN(C(=O)C(C)(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000187419893 1021090697 /nfs/dbraw/zinc/09/06/97/1021090697.db2.gz OZUOXSHZSFEBIM-CQSZACIVSA-N 1 0 347.459 3.530 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccsc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000610514224 1021151625 /nfs/dbraw/zinc/15/16/25/1021151625.db2.gz YRZVGGJSWTWORV-OAHLLOKOSA-N 1 0 347.440 3.914 20 5 EHBDRO COCC(C)(C)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000426314730 1021245252 /nfs/dbraw/zinc/24/52/52/1021245252.db2.gz QXMBJWVPRACZHO-SFHVURJKSA-N 1 0 328.412 3.946 20 5 EHBDRO CCC[C@H](CCO)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602560214 1032972815 /nfs/dbraw/zinc/97/28/15/1032972815.db2.gz XBJAMTIBIDCLBO-LLVKDONJSA-N 1 0 334.338 3.502 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](CCO)Cc1cccc(F)c1 ZINC000426368920 1021396420 /nfs/dbraw/zinc/39/64/20/1021396420.db2.gz CHRNBRSMMGTUMP-XNTDXEJSSA-N 1 0 344.386 3.632 20 5 EHBDRO COC[C@H](C)C[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000518780859 1021541061 /nfs/dbraw/zinc/54/10/61/1021541061.db2.gz CTMGPHOCYBKGSD-OAHLLOKOSA-N 1 0 343.427 3.735 20 5 EHBDRO CCCC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@H](C)CC ZINC000172895314 1033001024 /nfs/dbraw/zinc/00/10/24/1033001024.db2.gz HILLBUJZHDGFTR-CQSZACIVSA-N 1 0 331.420 3.711 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)cc1OC ZINC000090909806 1021691892 /nfs/dbraw/zinc/69/18/92/1021691892.db2.gz QBXFLMQNFQZGCJ-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CCOCCC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602580422 1032999092 /nfs/dbraw/zinc/99/90/92/1032999092.db2.gz GUKXLIRNSGOXIF-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO CC(C)(CCCO)C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602582224 1033002408 /nfs/dbraw/zinc/00/24/08/1033002408.db2.gz MNTXIFILFLODNI-UHFFFAOYSA-N 1 0 334.338 3.502 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000090920825 1021819516 /nfs/dbraw/zinc/81/95/16/1021819516.db2.gz BWEJWJDXYGWFEP-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCc2ccccc2C[NH+]2CCCC2)n1 ZINC000178154587 1021840093 /nfs/dbraw/zinc/84/00/93/1021840093.db2.gz HGBUIDFYUWXHNO-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1CCO[C@@H](C2CC2)C1 ZINC000602617028 1033010956 /nfs/dbraw/zinc/01/09/56/1033010956.db2.gz MYFBZVSDBZIPHS-UKRRQHHQSA-N 1 0 344.333 3.661 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2ccc3c(c2)CCO3)ccc1[N+](=O)[O-] ZINC000933489147 1021873367 /nfs/dbraw/zinc/87/33/67/1021873367.db2.gz PYVHPAIBGIAOHS-CYBMUJFWSA-N 1 0 342.395 3.779 20 5 EHBDRO Cn1ncc2c1CC(C)(C)CN(Cc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000828019541 1021935849 /nfs/dbraw/zinc/93/58/49/1021935849.db2.gz VUWJALUZCNDZOU-UHFFFAOYSA-N 1 0 348.834 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](C3CC3)C2)cc1C(F)(F)F ZINC000319812614 1021959867 /nfs/dbraw/zinc/95/98/67/1021959867.db2.gz PLIOLKAPZLNPNY-SNVBAGLBSA-N 1 0 329.322 3.510 20 5 EHBDRO CC1([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCC(F)(F)CC1 ZINC000602609446 1033026038 /nfs/dbraw/zinc/02/60/38/1033026038.db2.gz PTHWMOJQNUAAAT-UHFFFAOYSA-N 1 0 325.315 3.794 20 5 EHBDRO C[N@@H+]1CCCC[C@@H]1CCOC(=O)c1cc2cc([N+](=O)[O-])ccc2s1 ZINC000924365986 1022086701 /nfs/dbraw/zinc/08/67/01/1022086701.db2.gz MWULXJGHBLTKQO-CYBMUJFWSA-N 1 0 348.424 3.841 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)C1CC1 ZINC000602641397 1033031716 /nfs/dbraw/zinc/03/17/16/1033031716.db2.gz QWDQNUCXKIRLJX-CQSZACIVSA-N 1 0 332.322 3.518 20 5 EHBDRO [NH3+]CCc1cn(-c2cc3ccccc3c([N+](=O)[O-])c2)c2ccc(O)cc12 ZINC001167990400 1022261086 /nfs/dbraw/zinc/26/10/86/1022261086.db2.gz STQQKAPTUICNNV-UHFFFAOYSA-N 1 0 347.374 3.899 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])C[C@@H]1CCN(c2ccccc2)C1 ZINC000602652407 1033040315 /nfs/dbraw/zinc/04/03/15/1033040315.db2.gz YLNFYFOVOLVEOJ-KRWDZBQOSA-N 1 0 339.439 3.596 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@H](n2cnc3c2CCCC3)C1 ZINC000548336454 1022376060 /nfs/dbraw/zinc/37/60/60/1022376060.db2.gz JTMBQUVGXPWYQY-HUUCEWRRSA-N 1 0 340.427 3.678 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC000441419995 1022376433 /nfs/dbraw/zinc/37/64/33/1022376433.db2.gz KYJSXNHDOIWLOC-OAHLLOKOSA-N 1 0 344.411 3.545 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@H](OC)C3)o2)c([N+](=O)[O-])c1 ZINC000471819816 1022400886 /nfs/dbraw/zinc/40/08/86/1022400886.db2.gz DOLXHLMIUARDPE-OLZOCXBDSA-N 1 0 346.383 3.521 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468241 1033054025 /nfs/dbraw/zinc/05/40/25/1033054025.db2.gz UUHSYJINJVXCEZ-AAEUAGOBSA-N 1 0 339.823 3.697 20 5 EHBDRO CC[NH+](CC)Cc1ccc(CNc2cc(C)c([N+](=O)[O-])cn2)cc1 ZINC000074727194 1022469901 /nfs/dbraw/zinc/46/99/01/1022469901.db2.gz QGIVEBMRGDFVQN-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@@H](CC)c2cccc([N+](=O)[O-])c2)cc1 ZINC000156528402 1022513063 /nfs/dbraw/zinc/51/30/63/1022513063.db2.gz PRLKUVBDLRZHRA-SFHVURJKSA-N 1 0 341.411 3.585 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325508 1022669174 /nfs/dbraw/zinc/66/91/74/1022669174.db2.gz IVXIAYLPIPWLEZ-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])c(C)c2)[NH+](C)C)c1 ZINC000058940587 1033081823 /nfs/dbraw/zinc/08/18/23/1033081823.db2.gz UTANRYRFHVJXRH-GOSISDBHSA-N 1 0 329.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@@H+]3CC[C@H](c4cccc(F)c4)C3)c2c1 ZINC000729469538 1022860869 /nfs/dbraw/zinc/86/08/69/1022860869.db2.gz MNQSLYDASIWGEY-HNNXBMFYSA-N 1 0 340.358 3.531 20 5 EHBDRO CN(CC[N@H+](C)C1CCCCC1)c1ccc([N+](=O)[O-])c2cnccc21 ZINC000517950675 1022877773 /nfs/dbraw/zinc/87/77/73/1022877773.db2.gz TWAXURYVLGSZAK-UHFFFAOYSA-N 1 0 342.443 3.844 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@@H]1CCN2C(=O)c1c2ccccc2cc2ccccc21 ZINC001270376841 1022921706 /nfs/dbraw/zinc/92/17/06/1022921706.db2.gz KZUQRVLGIDTFLU-PMACEKPBSA-N 1 0 330.431 3.912 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@H]1O ZINC000249967906 1033098062 /nfs/dbraw/zinc/09/80/62/1033098062.db2.gz KEKKBGWERSCMSZ-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO O=[N+]([O-])c1cnc(NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)s1 ZINC000310199589 1023065812 /nfs/dbraw/zinc/06/58/12/1023065812.db2.gz BPHVEZMWXKODKW-OAHLLOKOSA-N 1 0 346.456 3.766 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Nc2ccccn2)CC1 ZINC000536368842 1023070023 /nfs/dbraw/zinc/07/00/23/1023070023.db2.gz ICZMHRBCTFISTO-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO CN(Cc1ccc([N+](=O)[O-])cc1)[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000509578246 1023074967 /nfs/dbraw/zinc/07/49/67/1023074967.db2.gz GUNLDIXIRXBCAC-FQEVSTJZSA-N 1 0 339.439 3.691 20 5 EHBDRO Cc1ccccc1[C@H]1CC[N@H+](CCOc2ccccc2[N+](=O)[O-])C1 ZINC000507178935 1023165363 /nfs/dbraw/zinc/16/53/63/1023165363.db2.gz JJZYWVALRDBIQE-INIZCTEOSA-N 1 0 326.396 3.772 20 5 EHBDRO CC[N@H+](CCOC)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000506476652 1023248839 /nfs/dbraw/zinc/24/88/39/1023248839.db2.gz HKVZEHYEABZRPX-UHFFFAOYSA-N 1 0 348.374 3.995 20 5 EHBDRO Cc1ccc(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)cc1[N+](=O)[O-] ZINC000458280931 1023849559 /nfs/dbraw/zinc/84/95/59/1023849559.db2.gz AREAJPPGBBKHQP-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([N@H+](C)Cc3cccc([N+](=O)[O-])c3)C2)c1 ZINC000449751759 1033166673 /nfs/dbraw/zinc/16/66/73/1033166673.db2.gz AOIMDNUSNCORFH-SAABIXHNSA-N 1 0 326.396 3.981 20 5 EHBDRO Cn1cc(C[NH2+][C@@H](CC2CCCC2)c2ccccc2)c([N+](=O)[O-])n1 ZINC000602803999 1033178069 /nfs/dbraw/zinc/17/80/69/1033178069.db2.gz FKIUSOXHZNZOBY-KRWDZBQOSA-N 1 0 328.416 3.740 20 5 EHBDRO CC(C)[C@H]([NH3+])CCN(C)C(=O)c1cc2ccccc2c2cccnc12 ZINC000236629473 1024053050 /nfs/dbraw/zinc/05/30/50/1024053050.db2.gz QTKOAOZIBHRKQL-LJQANCHMSA-N 1 0 335.451 3.833 20 5 EHBDRO CC(C)(C)C[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000449769840 1033184846 /nfs/dbraw/zinc/18/48/46/1033184846.db2.gz COYCVBHBQCCXKR-ZDUSSCGKSA-N 1 0 334.416 3.719 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)C(C)(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000074317050 1024075208 /nfs/dbraw/zinc/07/52/08/1024075208.db2.gz SRRBZZIBOOQJNI-SECBINFHSA-N 1 0 332.347 3.729 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1C[C@H]1C(F)(F)F ZINC000896859290 1024129918 /nfs/dbraw/zinc/12/99/18/1024129918.db2.gz DULUETQSENGZHK-WCBMZHEXSA-N 1 0 342.239 3.902 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000522298919 1024184950 /nfs/dbraw/zinc/18/49/50/1024184950.db2.gz LQZGSNVIGAHHSR-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCCC1 ZINC000434616602 1024203601 /nfs/dbraw/zinc/20/36/01/1024203601.db2.gz RDVRFBPDDGKHOY-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000119456187 1024249472 /nfs/dbraw/zinc/24/94/72/1024249472.db2.gz BKIHHQNVFDFWMQ-JMSVASOKSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](CC2CCCC2)c2ccccc2)n1 ZINC000342192903 1024358335 /nfs/dbraw/zinc/35/83/35/1024358335.db2.gz MUKMKQPYTQVPJA-KRWDZBQOSA-N 1 0 328.416 3.703 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CN1CC[C@H](OCCC(C)C)C1 ZINC000538735962 1024498142 /nfs/dbraw/zinc/49/81/42/1024498142.db2.gz QFGZNWNXYBDZSV-KRWDZBQOSA-N 1 0 336.432 3.631 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2CCCc3c(C)cccc32)c1[N+](=O)[O-] ZINC000895463150 1024534784 /nfs/dbraw/zinc/53/47/84/1024534784.db2.gz JMAAYRLWFDCXDS-MRXNPFEDSA-N 1 0 342.395 3.785 20 5 EHBDRO O=[N+]([O-])c1cnccc1S[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000425281076 1024623574 /nfs/dbraw/zinc/62/35/74/1024623574.db2.gz LGDSEZZBYMTZSW-HNNXBMFYSA-N 1 0 329.425 3.747 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1N(C)C ZINC000539070013 1024738856 /nfs/dbraw/zinc/73/88/56/1024738856.db2.gz DVERKVKNNXLVFP-OAHLLOKOSA-N 1 0 327.428 3.772 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000342293441 1024740058 /nfs/dbraw/zinc/74/00/58/1024740058.db2.gz GLMLJIDRUSTZEU-IVZVJUQRSA-N 1 0 346.814 3.975 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CCCO1 ZINC000281308157 1024873396 /nfs/dbraw/zinc/87/33/96/1024873396.db2.gz HUSLGUPQFZAQQS-QGZVFWFLSA-N 1 0 337.419 3.947 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC3(CCC3)[C@@H]2C2CCOCC2)c(F)c1 ZINC000425371688 1024895159 /nfs/dbraw/zinc/89/51/59/1024895159.db2.gz LSAGYKLOQSDPDT-KRWDZBQOSA-N 1 0 334.391 3.515 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000539217021 1024937394 /nfs/dbraw/zinc/93/73/94/1024937394.db2.gz ZYAYUZFKJZDMQQ-IBGZPJMESA-N 1 0 326.396 3.887 20 5 EHBDRO CCCCNC(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2C)CCCCC1 ZINC000428103464 1024982560 /nfs/dbraw/zinc/98/25/60/1024982560.db2.gz QOVDKZNNWQJBHV-UHFFFAOYSA-N 1 0 347.459 3.612 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)C2CCC(F)(F)CC2)cc1[N+](=O)[O-] ZINC000474023465 1024987050 /nfs/dbraw/zinc/98/70/50/1024987050.db2.gz MGTSPTPYYLVGLG-NSHDSACASA-N 1 0 328.359 3.907 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000474469847 1025001320 /nfs/dbraw/zinc/00/13/20/1025001320.db2.gz IDBSKZNUJIJDNX-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000897944856 1033254303 /nfs/dbraw/zinc/25/43/03/1033254303.db2.gz UHJMLJOLNBTYQM-ZDUSSCGKSA-N 1 0 331.416 3.991 20 5 EHBDRO Cc1ccccc1[C@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000515203793 1025087949 /nfs/dbraw/zinc/08/79/49/1025087949.db2.gz NNSTWEJVRMKVHE-OALUTQOASA-N 1 0 326.396 3.604 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@H](F)C3)o2)c([N+](=O)[O-])c1 ZINC000520879953 1025100954 /nfs/dbraw/zinc/10/09/54/1025100954.db2.gz ZPDJRGGKDXJBJS-RYUDHWBXSA-N 1 0 334.347 3.844 20 5 EHBDRO C[NH+](C)C[C@@H]1CCCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000892173111 1025188672 /nfs/dbraw/zinc/18/86/72/1025188672.db2.gz SOSKVECEFCEJCK-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO CO[C@@H](C)C[N@H+](Cc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000425421117 1025238622 /nfs/dbraw/zinc/23/86/22/1025238622.db2.gz QPYGMZJYFUWZQT-NSHDSACASA-N 1 0 345.237 3.603 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CCC(C)(C)C1CC1 ZINC000551296571 1025244861 /nfs/dbraw/zinc/24/48/61/1025244861.db2.gz LUPKQQDPFUAHRD-CYBMUJFWSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1cc(N2CCn3nc(C4CC4)cc3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000896219263 1025255420 /nfs/dbraw/zinc/25/54/20/1025255420.db2.gz CAEOPDNVWHAQLF-UHFFFAOYSA-N 1 0 349.394 3.546 20 5 EHBDRO COC(=O)[C@H](CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000425460235 1025364747 /nfs/dbraw/zinc/36/47/47/1025364747.db2.gz QPJRHSJKKDTYKY-KBXCAEBGSA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@H]1[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)CC[N@@H+]1Cc1ccccc1 ZINC000310399060 1025494276 /nfs/dbraw/zinc/49/42/76/1025494276.db2.gz UBVDILRTWNRYBB-BLLLJJGKSA-N 1 0 346.818 3.718 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2C[C@@H]3CC[C@@H](O)[C@H]3C2)s1 ZINC000544368702 1025508675 /nfs/dbraw/zinc/50/86/75/1025508675.db2.gz RUCXBYBMDPXONR-YLQAJVPDSA-N 1 0 344.436 3.526 20 5 EHBDRO CC1(C)CCC[C@H](C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)O1 ZINC000898048307 1033287501 /nfs/dbraw/zinc/28/75/01/1033287501.db2.gz IPFOSOKLCVKNSJ-GOSISDBHSA-N 1 0 347.459 3.501 20 5 EHBDRO C[N@H+](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C1CCCCC1 ZINC000436315351 1025577120 /nfs/dbraw/zinc/57/71/20/1025577120.db2.gz UAEVPQSULJIEFG-UHFFFAOYSA-N 1 0 346.353 3.685 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200903 1025642757 /nfs/dbraw/zinc/64/27/57/1025642757.db2.gz OGEPLPOIFJVRNC-SUMWQHHRSA-N 1 0 327.384 3.582 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1)N(C)C ZINC000443004431 1025656038 /nfs/dbraw/zinc/65/60/38/1025656038.db2.gz DCUCOYVGOFRNTM-UZLBHIALSA-N 1 0 341.455 3.993 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000443067262 1025683806 /nfs/dbraw/zinc/68/38/06/1025683806.db2.gz FHGZWFYMPSLDEI-KGLIPLIRSA-N 1 0 330.384 3.854 20 5 EHBDRO Cc1c(C[N@@H+](C)[C@@H](CO)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000451324670 1025826504 /nfs/dbraw/zinc/82/65/04/1025826504.db2.gz LPPMQIOITFIETQ-KRWDZBQOSA-N 1 0 334.803 3.722 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)ccc1[N+](=O)[O-] ZINC000451355442 1025860854 /nfs/dbraw/zinc/86/08/54/1025860854.db2.gz VCNMCLQGFCRNPC-LZLYRXPVSA-N 1 0 348.443 3.509 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548730851 1025916994 /nfs/dbraw/zinc/91/69/94/1025916994.db2.gz QXGRHFSAPVHZKC-GUYCJALGSA-N 1 0 334.416 3.862 20 5 EHBDRO CO[C@]1(C)C[C@@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C1(C)C ZINC000451490101 1026035801 /nfs/dbraw/zinc/03/58/01/1026035801.db2.gz OLPHBNZNNAQIGH-CRAIPNDOSA-N 1 0 345.399 3.543 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417610 1026075895 /nfs/dbraw/zinc/07/58/95/1026075895.db2.gz RAQBFCDBVOTHAZ-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000451552605 1026104080 /nfs/dbraw/zinc/10/40/80/1026104080.db2.gz WPZVSABDOJLQPZ-SFHVURJKSA-N 1 0 325.412 3.986 20 5 EHBDRO Cc1c(CNC2CC[NH+](C3CCCCC3)CC2)cccc1[N+](=O)[O-] ZINC000478486245 1026125655 /nfs/dbraw/zinc/12/56/55/1026125655.db2.gz FVOGZGANCLQOPD-UHFFFAOYSA-N 1 0 331.460 3.790 20 5 EHBDRO CCN(CCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)CC(F)(F)F ZINC000475148515 1026239072 /nfs/dbraw/zinc/23/90/72/1026239072.db2.gz KYSBIKRGTMDZKN-ZDUSSCGKSA-N 1 0 347.381 3.828 20 5 EHBDRO CCOC[C@H]1CCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000475197889 1026375929 /nfs/dbraw/zinc/37/59/29/1026375929.db2.gz ZEMZRSKYHAVLEH-IUODEOHRSA-N 1 0 346.349 3.908 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@@]3(CCSC3)C2)c(F)c1 ZINC000451959306 1026395189 /nfs/dbraw/zinc/39/51/89/1026395189.db2.gz ASKWNGZOUHHWCJ-OAHLLOKOSA-N 1 0 328.384 3.592 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000451957043 1026416129 /nfs/dbraw/zinc/41/61/29/1026416129.db2.gz OQOFGRNZAMMOLW-HNNXBMFYSA-N 1 0 336.432 3.562 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000452084552 1026484119 /nfs/dbraw/zinc/48/41/19/1026484119.db2.gz LEMCLDKTWFYKDN-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000479581134 1026709049 /nfs/dbraw/zinc/70/90/49/1026709049.db2.gz RGBALOZMLPGJPE-JKSUJKDBSA-N 1 0 326.824 3.932 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])CC1 ZINC000892285978 1027014118 /nfs/dbraw/zinc/01/41/18/1027014118.db2.gz BSSFWJQYYZHJFL-UHFFFAOYSA-N 1 0 348.834 3.763 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2[C@@H]3CCO[C@@H]3C23CCC3)cc1[N+](=O)[O-] ZINC000183229673 1027125392 /nfs/dbraw/zinc/12/53/92/1027125392.db2.gz LADHCOQOQBCUBU-GLFJAGTFSA-N 1 0 346.427 3.602 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2nc(-c3ccncc3)cs2)cs1 ZINC000344558071 1027237055 /nfs/dbraw/zinc/23/70/55/1027237055.db2.gz XKYLPGRDWNJGGR-UHFFFAOYSA-N 1 0 346.437 3.507 20 5 EHBDRO CN(C)C(C)(C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237079955 1027373152 /nfs/dbraw/zinc/37/31/52/1027373152.db2.gz VLZWLKMDNSTEES-UHFFFAOYSA-N 1 0 333.457 3.753 20 5 EHBDRO C[C@H]([NH3+])c1ccc(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])cc1 ZINC000420205285 1027388411 /nfs/dbraw/zinc/38/84/11/1027388411.db2.gz ISPFKMTZEUDFRN-VIFPVBQESA-N 1 0 340.305 3.640 20 5 EHBDRO C[C@@]1(O)C[NH2+][C@H](c2nc(-c3cc4ccccc4c4ccccc34)no2)C1 ZINC001211936010 1027604398 /nfs/dbraw/zinc/60/43/98/1027604398.db2.gz XWZMSCUIVYOREO-RXVVDRJESA-N 1 0 345.402 3.828 20 5 EHBDRO CC(C)c1nc(C2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)no1 ZINC000366647925 1027665159 /nfs/dbraw/zinc/66/51/59/1027665159.db2.gz YTLRFUOBQFRAJZ-UHFFFAOYSA-N 1 0 344.415 3.523 20 5 EHBDRO CC1(C)CC([NH3+])CC(C)(C)N1c1ccc2cnccc2c1[N+](=O)[O-] ZINC001167624526 1027909492 /nfs/dbraw/zinc/90/94/92/1027909492.db2.gz AHYRTQLZUPTBRF-UHFFFAOYSA-N 1 0 328.416 3.628 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CC[C@@H](C4CCCC4)C3)o2)cc1 ZINC000420963899 1027932407 /nfs/dbraw/zinc/93/24/07/1027932407.db2.gz OPERNAAHVNPTSL-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000909605991 1028055391 /nfs/dbraw/zinc/05/53/91/1028055391.db2.gz RVPWWPRDLDDXPR-CQSZACIVSA-N 1 0 341.411 3.707 20 5 EHBDRO C[NH2+]Cc1ccccc1NC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1 ZINC000237169281 1028115899 /nfs/dbraw/zinc/11/58/99/1028115899.db2.gz BIQUYXTUYKCVBG-UHFFFAOYSA-N 1 0 341.411 3.864 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CC2CCC(F)(F)CC2)n1 ZINC000503954300 1028260874 /nfs/dbraw/zinc/26/08/74/1028260874.db2.gz VEQBIYSSVUKBLE-KGLIPLIRSA-N 1 0 342.390 3.690 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2[N+](=O)[O-])C[C@]2(C[C@@H]3CC[C@H]2C3)O1 ZINC000440557824 1028276607 /nfs/dbraw/zinc/27/66/07/1028276607.db2.gz VORCNDRAMKLHHB-ALKREAHSSA-N 1 0 330.428 3.764 20 5 EHBDRO C[NH2+]C[C@H](C)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285347 1028323917 /nfs/dbraw/zinc/32/39/17/1028323917.db2.gz ZJWABFRPJBNPGT-QWHCGFSZSA-N 1 0 333.457 3.829 20 5 EHBDRO C[C@H](NCC1([NH3+])CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423318227 1028348848 /nfs/dbraw/zinc/34/88/48/1028348848.db2.gz DDRUNAKYKKDRCS-LBPRGKRZSA-N 1 0 331.441 3.855 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161920979 1028360110 /nfs/dbraw/zinc/36/01/10/1028360110.db2.gz MVFDDLNXNFJVDM-QGZVFWFLSA-N 1 0 342.395 3.997 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000572898103 1028365575 /nfs/dbraw/zinc/36/55/75/1028365575.db2.gz LFBMXHPQLLNHKW-YJYMSZOUSA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1cc(NCC2CC[NH+](C3CC3)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000444881460 1028370919 /nfs/dbraw/zinc/37/09/19/1028370919.db2.gz UEAVIDCSBUUZKL-UHFFFAOYSA-N 1 0 340.427 3.738 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H](C)CO ZINC000077423175 1028484840 /nfs/dbraw/zinc/48/48/40/1028484840.db2.gz RPAXQPVNVIJCBL-GHMZBOCLSA-N 1 0 338.791 3.615 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H]2CCc3ccccc3C2)cc1[N+](=O)[O-] ZINC000523701623 1028554662 /nfs/dbraw/zinc/55/46/62/1028554662.db2.gz MEWIXCOFALJUKY-KRWDZBQOSA-N 1 0 326.396 3.593 20 5 EHBDRO CCC[C@@H]([NH2+][C@@H]1CCCc2c1cnn2C)c1cccc([N+](=O)[O-])c1 ZINC000268838644 1028600846 /nfs/dbraw/zinc/60/08/46/1028600846.db2.gz SZOSBIKPZFXMPN-IAGOWNOFSA-N 1 0 328.416 3.837 20 5 EHBDRO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@@H]1CCC[N@H+](C)C1 ZINC000508529784 1028792892 /nfs/dbraw/zinc/79/28/92/1028792892.db2.gz TZQFSOFKJNXXLD-OAHLLOKOSA-N 1 0 343.427 3.628 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)c(Cl)c1 ZINC000228842856 1029138466 /nfs/dbraw/zinc/13/84/66/1029138466.db2.gz RPZZFRIKFQXCSR-NXEZZACHSA-N 1 0 330.215 3.940 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066369 1029235524 /nfs/dbraw/zinc/23/55/24/1029235524.db2.gz WSJVREGQZGKCNL-SUMWQHHRSA-N 1 0 334.416 3.862 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+](CCO)C3CCCC3)o2)c1 ZINC000505284693 1029441396 /nfs/dbraw/zinc/44/13/96/1029441396.db2.gz YAQWJPYMGJLHRD-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)CCC[C@@H]1C ZINC000533293611 1029586618 /nfs/dbraw/zinc/58/66/18/1029586618.db2.gz WASKHZUVYVWYTL-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[S@@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)C1 ZINC000162911545 1029679746 /nfs/dbraw/zinc/67/97/46/1029679746.db2.gz UHDQDNICDCNOQF-SONXGWPDSA-N 1 0 338.473 3.634 20 5 EHBDRO C[C@@H](CCc1ccccc1F)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446834450 1029815739 /nfs/dbraw/zinc/81/57/39/1029815739.db2.gz XEJJOXLNAPECLD-LBPRGKRZSA-N 1 0 342.374 3.721 20 5 EHBDRO CCC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000525409445 1029840284 /nfs/dbraw/zinc/84/02/84/1029840284.db2.gz ZWWZRGJZHAADCE-BMGDILEWSA-N 1 0 348.443 3.629 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@@H](C)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453238812 1029967370 /nfs/dbraw/zinc/96/73/70/1029967370.db2.gz SWDPPRQJDSXFRK-KUHUBIRLSA-N 1 0 346.427 3.838 20 5 EHBDRO CC[C@@H](O)CCC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000525697436 1030030632 /nfs/dbraw/zinc/03/06/32/1030030632.db2.gz ZTKHFEBAIINLRK-OAHLLOKOSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1ccc([C@H](C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000481956224 1030134106 /nfs/dbraw/zinc/13/41/06/1030134106.db2.gz CBDLHGSNLVKVCV-KXBFYZLASA-N 1 0 327.428 3.857 20 5 EHBDRO COc1ccc(OCC[N@H+](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000441246511 1030154354 /nfs/dbraw/zinc/15/43/54/1030154354.db2.gz PEJKAABIUQYTON-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccncc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453375883 1030198200 /nfs/dbraw/zinc/19/82/00/1030198200.db2.gz XNCMQKFMPIDPRC-QANKJYHBSA-N 1 0 327.384 3.561 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2cccc(Cl)c2)n1 ZINC000447519123 1030241781 /nfs/dbraw/zinc/24/17/81/1030241781.db2.gz XSZNLTNZEZWXHC-JKSUJKDBSA-N 1 0 348.834 3.761 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1 ZINC000447540197 1030275488 /nfs/dbraw/zinc/27/54/88/1030275488.db2.gz JCYHWBSIDUAFGK-IBGZPJMESA-N 1 0 325.412 3.828 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447589618 1030327405 /nfs/dbraw/zinc/32/74/05/1030327405.db2.gz YOKRNECKCDHKOX-GOSISDBHSA-N 1 0 325.412 3.828 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@]2(C1)OCc1ccccc12 ZINC000482383577 1030364655 /nfs/dbraw/zinc/36/46/55/1030364655.db2.gz YRDPTKGZIUOMDB-HXUWFJFHSA-N 1 0 338.407 3.925 20 5 EHBDRO COc1ccc(OC)c(C[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000532199049 1030472574 /nfs/dbraw/zinc/47/25/74/1030472574.db2.gz JSELAAFSZGQWQQ-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000482507536 1030486820 /nfs/dbraw/zinc/48/68/20/1030486820.db2.gz MPGQQWFGCQTBKU-CYBMUJFWSA-N 1 0 331.391 3.693 20 5 EHBDRO C[C@H]([NH2+][C@H](CNC(=O)OC(C)(C)C)C1CC1)c1ccc([N+](=O)[O-])cc1 ZINC000161832010 1030489978 /nfs/dbraw/zinc/48/99/78/1030489978.db2.gz FVSCFGWOOWITQI-BLLLJJGKSA-N 1 0 349.431 3.549 20 5 EHBDRO CCC[C@@H](C)[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267978 1030514969 /nfs/dbraw/zinc/51/49/69/1030514969.db2.gz PLWBTDCXRCYIBG-CXAGYDPISA-N 1 0 334.416 3.862 20 5 EHBDRO C[N@H+](CCc1nccs1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000093843892 1030683274 /nfs/dbraw/zinc/68/32/74/1030683274.db2.gz IYXCANXIOUUHRK-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000130520905 1030778741 /nfs/dbraw/zinc/77/87/41/1030778741.db2.gz BEWGPCRDPQMALN-YXJHDRRASA-N 1 0 332.444 3.711 20 5 EHBDRO [NH3+]CCC1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000568152630 1030868941 /nfs/dbraw/zinc/86/89/41/1030868941.db2.gz DDNDXHVHALESRC-UHFFFAOYSA-N 1 0 333.435 3.589 20 5 EHBDRO CN(C)c1cccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c1 ZINC000537659796 1030914349 /nfs/dbraw/zinc/91/43/49/1030914349.db2.gz RHTRPGLZJITJGS-JXMROGBWSA-N 1 0 325.412 3.806 20 5 EHBDRO CC[NH+]1CCC(N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000160673230 1030928753 /nfs/dbraw/zinc/92/87/53/1030928753.db2.gz IHAYONUCVMTYDJ-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO C[C@H](O)C[C@@H]1CCCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000448361713 1030985516 /nfs/dbraw/zinc/98/55/16/1030985516.db2.gz YCOTULQTZAPZBW-HOCLYGCPSA-N 1 0 344.411 3.980 20 5 EHBDRO CCC1(Cc2ccccc2)CC[NH+](CCn2ccc([N+](=O)[O-])n2)CC1 ZINC000483127944 1030987865 /nfs/dbraw/zinc/98/78/65/1030987865.db2.gz OHXCGWBNIYAWJP-UHFFFAOYSA-N 1 0 342.443 3.526 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)C1CCCCC1 ZINC000483739073 1031312946 /nfs/dbraw/zinc/31/29/46/1031312946.db2.gz FGCCXXRUUMGCOI-ZIAGYGMSSA-N 1 0 333.432 3.870 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)Cc1cccc(F)c1 ZINC000026223908 1031386488 /nfs/dbraw/zinc/38/64/88/1031386488.db2.gz IQFBRORHHPKLPI-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1 ZINC000477516038 1031625304 /nfs/dbraw/zinc/62/53/04/1031625304.db2.gz YDJVGTKOHKJVKL-INIZCTEOSA-N 1 0 326.352 3.661 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000926949167 1031804324 /nfs/dbraw/zinc/80/43/24/1031804324.db2.gz KNKRZUOTMTZMSL-ZMLRMANQSA-N 1 0 332.322 3.843 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H]2CCCN3CCCC[C@H]23)cc1[N+](=O)[O-] ZINC000594518712 1033424788 /nfs/dbraw/zinc/42/47/88/1033424788.db2.gz JHEYIISXIRJLLL-BHYGNILZSA-N 1 0 347.459 3.661 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](CC)[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594520871 1033426762 /nfs/dbraw/zinc/42/67/62/1033426762.db2.gz QQQJTYBNWIRYOJ-QRTARXTBSA-N 1 0 336.432 3.992 20 5 EHBDRO Cc1cc(N2CCC[C@@H](OC3CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000594595383 1033443911 /nfs/dbraw/zinc/44/39/11/1033443911.db2.gz WUHTVNUTHPIPOZ-MRXNPFEDSA-N 1 0 341.411 3.989 20 5 EHBDRO CCc1cnccc1[C@@H](C)[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000611941291 1033458971 /nfs/dbraw/zinc/45/89/71/1033458971.db2.gz NZWJYTOXJSOZLQ-CQSZACIVSA-N 1 0 329.400 3.672 20 5 EHBDRO [NH3+]C1(CNCc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCCC1 ZINC000594739253 1033510940 /nfs/dbraw/zinc/51/09/40/1033510940.db2.gz QTCAWNQSUDKFHZ-UHFFFAOYSA-N 1 0 349.818 3.869 20 5 EHBDRO CCS[C@H]1CCCC[N@H+](Cn2nc(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000761291522 1033540471 /nfs/dbraw/zinc/54/04/71/1033540471.db2.gz MZFMCFAZQHGMLU-HNNXBMFYSA-N 1 0 348.472 3.818 20 5 EHBDRO C[N@H+](CCOc1ccc([N+](=O)[O-])cc1)Cc1cc(F)c(F)c(F)c1 ZINC000537528745 1033580328 /nfs/dbraw/zinc/58/03/28/1033580328.db2.gz RKQZXUBNNFCLKR-UHFFFAOYSA-N 1 0 340.301 3.523 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000594992904 1033623639 /nfs/dbraw/zinc/62/36/39/1033623639.db2.gz ZZDRSVPLMRXHRN-OALUTQOASA-N 1 0 328.412 3.751 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H](c2ccccc2)[C@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000594992905 1033624297 /nfs/dbraw/zinc/62/42/97/1033624297.db2.gz ZZDRSVPLMRXHRN-RBUKOAKNSA-N 1 0 328.412 3.751 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](c1cccs1)N(C)C ZINC000595002906 1033627423 /nfs/dbraw/zinc/62/74/23/1033627423.db2.gz BEKHWQSRNHYPAX-WFASDCNBSA-N 1 0 349.456 3.618 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000595003509 1033629114 /nfs/dbraw/zinc/62/91/14/1033629114.db2.gz IDXREQFHGLQZFN-GFCCVEGCSA-N 1 0 335.448 3.563 20 5 EHBDRO CCOCc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000595008531 1033631130 /nfs/dbraw/zinc/63/11/30/1033631130.db2.gz UXUSVVRNYWFSAO-CQSZACIVSA-N 1 0 344.411 3.991 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CC2COC2)ccc1Oc1ccccc1Cl ZINC000599012157 1033645621 /nfs/dbraw/zinc/64/56/21/1033645621.db2.gz NKLUUESGGFVJGW-UHFFFAOYSA-N 1 0 348.786 3.777 20 5 EHBDRO C[C@H](CSCCF)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000595044127 1033662820 /nfs/dbraw/zinc/66/28/20/1033662820.db2.gz LBRBBQFFXDGMSZ-SECBINFHSA-N 1 0 340.342 3.794 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCCO1 ZINC000599044670 1033672962 /nfs/dbraw/zinc/67/29/62/1033672962.db2.gz RYDJUNZYWTUKPW-YGRLFVJLSA-N 1 0 332.322 3.661 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](n2cccn2)C(F)(F)F)cccc1[N+](=O)[O-] ZINC000599054981 1033690967 /nfs/dbraw/zinc/69/09/67/1033690967.db2.gz DWKBXCUQCFGNHK-FZMZJTMJSA-N 1 0 342.321 3.554 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595104919 1033691055 /nfs/dbraw/zinc/69/10/55/1033691055.db2.gz AETSHWYITOEDCG-UAOJZALGSA-N 1 0 340.423 3.726 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nccn1C ZINC000595108460 1033694550 /nfs/dbraw/zinc/69/45/50/1033694550.db2.gz QBQXWKHEEMIVBY-STQMWFEESA-N 1 0 334.445 3.550 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nccn1C ZINC000595108457 1033694696 /nfs/dbraw/zinc/69/46/96/1033694696.db2.gz QBQXWKHEEMIVBY-CHWSQXEVSA-N 1 0 334.445 3.550 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CC[N@@H+]2C2CCCC2)ccc2ncccc21 ZINC000599165774 1033781922 /nfs/dbraw/zinc/78/19/22/1033781922.db2.gz SJNAFDJOMJPFAM-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc2c(c1)OCCO2 ZINC000595414485 1033791020 /nfs/dbraw/zinc/79/10/20/1033791020.db2.gz KMUKXPWYRUSWTF-HNNXBMFYSA-N 1 0 346.358 3.746 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC3(CCOCC3)[C@@H]2c2ccco2)cc1 ZINC000595715488 1033959522 /nfs/dbraw/zinc/95/95/22/1033959522.db2.gz AKXRIPKPGVBMBX-SFHVURJKSA-N 1 0 342.395 3.584 20 5 EHBDRO O=[N+]([O-])c1ncccc1NC[C@@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000603850873 1033974715 /nfs/dbraw/zinc/97/47/15/1033974715.db2.gz GZNATEBKHKGRMB-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO CC[NH+](CC)CCOc1ccccc1CNc1ccc([N+](=O)[O-])cc1 ZINC000603856891 1033982606 /nfs/dbraw/zinc/98/26/06/1033982606.db2.gz BIIUCWLMJBGION-UHFFFAOYSA-N 1 0 343.427 3.928 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1cccc(F)c1)C1CC1 ZINC000603859150 1033983295 /nfs/dbraw/zinc/98/32/95/1033983295.db2.gz GSKVQSUUEMEMDI-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H](C4CCC4)C3)n2)cc1 ZINC000595837052 1034002438 /nfs/dbraw/zinc/00/24/38/1034002438.db2.gz OHFZYDNSGHXYIQ-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000596308350 1034164917 /nfs/dbraw/zinc/16/49/17/1034164917.db2.gz RDUWAESAKUDEEU-NSHDSACASA-N 1 0 343.374 3.729 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(Nc2ccccn2)CC1 ZINC000534127728 1034167587 /nfs/dbraw/zinc/16/75/87/1034167587.db2.gz BIGVYBXDYUPMAI-CQSZACIVSA-N 1 0 326.400 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCC[N@H+](CC3CC3)C2)c2ncccc12 ZINC000596571258 1034293254 /nfs/dbraw/zinc/29/32/54/1034293254.db2.gz RPXZJNRYONJDEO-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@H](c1ccc(-c2cc([N+](=O)[O-])ccc2CO)cc1)[NH+]1CCCC1 ZINC000596634950 1034337714 /nfs/dbraw/zinc/33/77/14/1034337714.db2.gz SNDKSXFQHFDTMX-CQSZACIVSA-N 1 0 326.396 3.911 20 5 EHBDRO C[C@H](N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000596650375 1034346494 /nfs/dbraw/zinc/34/64/94/1034346494.db2.gz PPJQLWYMQIALTI-MJXNMMHHSA-N 1 0 343.402 3.530 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@@H]3COC[C@H]3C2)s1 ZINC000597231205 1034614164 /nfs/dbraw/zinc/61/41/64/1034614164.db2.gz OHBOIKSYPMEDCS-ZIAGYGMSSA-N 1 0 344.436 3.792 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1[C@H]2Cc3cc(F)ccc3[C@@H]12 ZINC000597237398 1034619002 /nfs/dbraw/zinc/61/90/02/1034619002.db2.gz ZTFQSGMEPWLVJS-YXGIPWNTSA-N 1 0 340.398 3.983 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000450683049 1034682664 /nfs/dbraw/zinc/68/26/64/1034682664.db2.gz PEUVPRFNMWUCGM-ZOCIIQOWSA-N 1 0 328.412 3.800 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000450683046 1034682690 /nfs/dbraw/zinc/68/26/90/1034682690.db2.gz PEUVPRFNMWUCGM-JVPBZIDWSA-N 1 0 328.412 3.800 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](CCO)c2ccc(Cl)c(F)c2)c1 ZINC000601137002 1035019462 /nfs/dbraw/zinc/01/94/62/1035019462.db2.gz PIMZWJAEIQKMKY-INIZCTEOSA-N 1 0 338.766 3.601 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000365428384 1035071033 /nfs/dbraw/zinc/07/10/33/1035071033.db2.gz MZPUDLVOJAASSY-GFCCVEGCSA-N 1 0 331.338 3.534 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCO1 ZINC000581085213 1035472354 /nfs/dbraw/zinc/47/23/54/1035472354.db2.gz OYDJXRVYOKSGKH-KBPBESRZSA-N 1 0 332.322 3.661 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CC(OCc3ccccc3)C2)c(F)c1 ZINC000613283260 1035489315 /nfs/dbraw/zinc/48/93/15/1035489315.db2.gz BIUMSESHDNLMTB-UHFFFAOYSA-N 1 0 330.359 3.571 20 5 EHBDRO C[N@@H+]1CC[C@@H](NCc2c(Cl)cccc2[N+](=O)[O-])[C@H]1c1ccccc1 ZINC000571573351 1035538422 /nfs/dbraw/zinc/53/84/22/1035538422.db2.gz RJBZRLUDQCVAFT-SJLPKXTDSA-N 1 0 345.830 3.783 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCN(c2ccccc2)C1 ZINC000571580723 1035542202 /nfs/dbraw/zinc/54/22/02/1035542202.db2.gz ASAJBERRFHDOMN-HNAYVOBHSA-N 1 0 337.423 3.698 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000463527853 1035584311 /nfs/dbraw/zinc/58/43/11/1035584311.db2.gz UGLBIQOEGGZCQJ-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000122126462 1035598017 /nfs/dbraw/zinc/59/80/17/1035598017.db2.gz LOVOMKOMLCNGHY-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(CCC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000463081527 1035695216 /nfs/dbraw/zinc/69/52/16/1035695216.db2.gz FFNOWPRVELSGRP-GFCCVEGCSA-N 1 0 345.365 3.662 20 5 EHBDRO C[C@]12C[N@H+](Cc3nc4cc([N+](=O)[O-])ccc4o3)C[C@H]1[C@@H]1CC[C@H]2C1 ZINC000582401933 1035751602 /nfs/dbraw/zinc/75/16/02/1035751602.db2.gz PVUKRJFHFOXQEH-BKTMZONDSA-N 1 0 327.384 3.604 20 5 EHBDRO CC(C)C[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)ccc2[N+](=O)[O-])CCO1 ZINC000272015263 1035770841 /nfs/dbraw/zinc/77/08/41/1035770841.db2.gz QWTDCRFWHGJNQE-LSDHHAIUSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(N2CCCC2=O)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000122138113 1035814222 /nfs/dbraw/zinc/81/42/22/1035814222.db2.gz MQZVJWMHTOKLLU-CQSZACIVSA-N 1 0 339.395 3.572 20 5 EHBDRO CC(C)(C)Oc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1[N+](=O)[O-] ZINC000443422991 1035819214 /nfs/dbraw/zinc/81/92/14/1035819214.db2.gz AIPVKCZTZVDCHD-LSDHHAIUSA-N 1 0 333.432 3.811 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000174126303 1035861065 /nfs/dbraw/zinc/86/10/65/1035861065.db2.gz HTXIGTXILASGFG-KRWDZBQOSA-N 1 0 347.462 3.944 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccn(C)n1 ZINC000414170113 1035868283 /nfs/dbraw/zinc/86/82/83/1035868283.db2.gz BQRLWLJNMSYBOQ-QWHCGFSZSA-N 1 0 334.445 3.550 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]C2CCC(C(F)F)CC2)n1 ZINC000414190075 1035981145 /nfs/dbraw/zinc/98/11/45/1035981145.db2.gz RGEVELQGVNTUHN-PQAZSJQKSA-N 1 0 342.390 3.689 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1N[C@@H](C[NH+]1CCCC1)c1ccccc1 ZINC000492555365 1035999234 /nfs/dbraw/zinc/99/92/34/1035999234.db2.gz AVMOJMJFHPKYAX-KRWDZBQOSA-N 1 0 329.375 3.983 20 5 EHBDRO C[C@@H]([NH2+]C(C)(C)CNC(=O)c1ccc([N+](=O)[O-])s1)c1ccccc1 ZINC000609158419 1036035246 /nfs/dbraw/zinc/03/52/46/1036035246.db2.gz GIRSUOURFUDYMA-GFCCVEGCSA-N 1 0 347.440 3.516 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000414204106 1036053114 /nfs/dbraw/zinc/05/31/14/1036053114.db2.gz ZYNOUJYWGAZQSE-ZFWWWQNUSA-N 1 0 326.396 3.730 20 5 EHBDRO C[C@@H](NC(=O)[C@@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196820 1036138961 /nfs/dbraw/zinc/13/89/61/1036138961.db2.gz BYSRBXHYQHLBJS-QLFBSQMISA-N 1 0 341.411 3.511 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2c(Cl)cncc2[N+](=O)[O-])CC1 ZINC000589106404 1036253067 /nfs/dbraw/zinc/25/30/67/1036253067.db2.gz BLAWXSHQLGGNSN-UHFFFAOYSA-N 1 0 340.855 3.592 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@]1(C)OCCc2sccc21 ZINC000589325760 1036345707 /nfs/dbraw/zinc/34/57/07/1036345707.db2.gz UPOQMELLAHXQTC-KRWDZBQOSA-N 1 0 332.425 3.542 20 5 EHBDRO CCC(CC)[N@H+](Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CC1 ZINC000165380951 1036440834 /nfs/dbraw/zinc/44/08/34/1036440834.db2.gz NVFTVPHFOSOFJG-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000541571972 1036463500 /nfs/dbraw/zinc/46/35/00/1036463500.db2.gz YBDWZESRWQKGEH-GDBMZVCRSA-N 1 0 332.400 3.795 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@]2(C1)CCc1ccccc1O2 ZINC000589518868 1036488998 /nfs/dbraw/zinc/48/89/98/1036488998.db2.gz XERZGQCLGKBYTM-HXUWFJFHSA-N 1 0 338.407 3.873 20 5 EHBDRO CC[C@H](C)[C@@H](C)[NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000249741158 1036522939 /nfs/dbraw/zinc/52/29/39/1036522939.db2.gz IOVFAOAXMJXBQQ-HBNTYKKESA-N 1 0 327.812 3.599 20 5 EHBDRO CCOc1ccccc1OCC[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000180406109 1036781028 /nfs/dbraw/zinc/78/10/28/1036781028.db2.gz CMTSMRNBLYSJGI-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO C[C@@]1(C[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCOC1 ZINC000493173099 1036842450 /nfs/dbraw/zinc/84/24/50/1036842450.db2.gz CJYOKLHNHHAPCM-MOPGFXCFSA-N 1 0 326.396 3.700 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@@H](c2ccccc2)CO1 ZINC000464838372 1036853780 /nfs/dbraw/zinc/85/37/80/1036853780.db2.gz VLLSUFCBEVSJAC-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)n1 ZINC000541935855 1036862102 /nfs/dbraw/zinc/86/21/02/1036862102.db2.gz NAETWWQEKLWUHA-DOTOQJQBSA-N 1 0 340.427 3.854 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cnn(CC3CCC3)c2)cc1Cl ZINC000897431148 1036902553 /nfs/dbraw/zinc/90/25/53/1036902553.db2.gz APQOMBRNTIEOKH-UHFFFAOYSA-N 1 0 334.807 3.535 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@@H]2CCCc2ccccc2)c1 ZINC000443650937 1036942339 /nfs/dbraw/zinc/94/23/39/1036942339.db2.gz QMOOHGSHKQNFOO-GOSISDBHSA-N 1 0 342.443 3.669 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[C@H](C)C1 ZINC000452066942 1036975851 /nfs/dbraw/zinc/97/58/51/1036975851.db2.gz LYTJTMFRMMBTGV-AEGPPILISA-N 1 0 333.432 3.646 20 5 EHBDRO CCOc1ccc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)nc1 ZINC000590659572 1036996179 /nfs/dbraw/zinc/99/61/79/1036996179.db2.gz AOZGZINAIWZBDH-MRXNPFEDSA-N 1 0 341.411 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H](c3ccncc3)C2)cc1 ZINC000590741178 1037039653 /nfs/dbraw/zinc/03/96/53/1037039653.db2.gz ZURKGIDWRBDVNZ-KRWDZBQOSA-N 1 0 341.411 3.638 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000493240362 1037104421 /nfs/dbraw/zinc/10/44/21/1037104421.db2.gz VRIYWYIVEOOETC-CYBMUJFWSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1c(Cc2noc([C@H](C)[NH+]3[C@@H](C)CC[C@@H]3C)n2)cccc1[N+](=O)[O-] ZINC000443211340 1037130384 /nfs/dbraw/zinc/13/03/84/1037130384.db2.gz DNHIBTPKYBEHNG-OBJOEFQTSA-N 1 0 344.415 3.811 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(C(=O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000180752617 1037145972 /nfs/dbraw/zinc/14/59/72/1037145972.db2.gz HJQNXQZVVIOONX-UHFFFAOYSA-N 1 0 347.459 3.569 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000057838437 1037203288 /nfs/dbraw/zinc/20/32/88/1037203288.db2.gz LXIKRTVIXLZVNX-UHFFFAOYSA-N 1 0 331.338 3.580 20 5 EHBDRO CC[NH+]1CCC(CNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000321577177 1037206656 /nfs/dbraw/zinc/20/66/56/1037206656.db2.gz OMVQVXDXZVOGHX-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO C[C@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)[NH+]1[C@H](C)CC[C@H]1C ZINC000443217774 1037224488 /nfs/dbraw/zinc/22/44/88/1037224488.db2.gz DOOIJPBCNHJQAK-JHJVBQTASA-N 1 0 330.388 3.502 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000193024457 1037255140 /nfs/dbraw/zinc/25/51/40/1037255140.db2.gz CEVOBRLZLLUOEO-CVEARBPZSA-N 1 0 333.457 4.000 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(Cn2cccn2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000180888050 1037284754 /nfs/dbraw/zinc/28/47/54/1037284754.db2.gz BUJXNGGBVBRQRP-HNNXBMFYSA-N 1 0 336.395 3.690 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CCCC[N@H+](Cc3ccccc3)C2)cn1 ZINC000386376620 1037319991 /nfs/dbraw/zinc/31/99/91/1037319991.db2.gz SONDOXPHDAAXQS-QGZVFWFLSA-N 1 0 340.427 3.704 20 5 EHBDRO C[C@@H]([NH2+]Cc1cn(C)nc1-c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000181033638 1037401481 /nfs/dbraw/zinc/40/14/81/1037401481.db2.gz ULLBQGQGAUAUTG-CQSZACIVSA-N 1 0 336.395 3.846 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000532470204 1037413919 /nfs/dbraw/zinc/41/39/19/1037413919.db2.gz CFUNJGIUYAJXOM-OWQGQXMQSA-N 1 0 345.443 3.742 20 5 EHBDRO CCOc1cc(N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992814 1037430943 /nfs/dbraw/zinc/43/09/43/1037430943.db2.gz FZIHWPDOENKNNF-ZOBUZTSGSA-N 1 0 347.459 3.835 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccc2c(c1)OCCO2)C1CC1 ZINC000171128941 1037463590 /nfs/dbraw/zinc/46/35/90/1037463590.db2.gz QBOSJICQNUATGU-LJQANCHMSA-N 1 0 340.379 3.607 20 5 EHBDRO O=[N+]([O-])c1cccc(CNCc2c(F)cccc2N2CCCC2)c1 ZINC000271858016 1037516215 /nfs/dbraw/zinc/51/62/15/1037516215.db2.gz ICQKUBGQLUOCPN-UHFFFAOYSA-N 1 0 329.375 3.624 20 5 EHBDRO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000443790588 1037528421 /nfs/dbraw/zinc/52/84/21/1037528421.db2.gz PFZNVOGXPLJXBL-HBUWYVDXSA-N 1 0 344.411 3.836 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@H]2CCC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000493714459 1037575706 /nfs/dbraw/zinc/57/57/06/1037575706.db2.gz YUZRIMURXWZZDK-HOCLYGCPSA-N 1 0 336.432 3.631 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000532549794 1037592675 /nfs/dbraw/zinc/59/26/75/1037592675.db2.gz YPTPHKGLMZYRHC-INIZCTEOSA-N 1 0 336.338 3.993 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@H](C)CC1 ZINC000249836048 1037610643 /nfs/dbraw/zinc/61/06/43/1037610643.db2.gz RXSDBQYYTWVLNO-QWHCGFSZSA-N 1 0 330.388 3.828 20 5 EHBDRO C[NH2+]Cc1cccc(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000415916269 1037628226 /nfs/dbraw/zinc/62/82/26/1037628226.db2.gz BJLLVTHVSTYTAL-ZDUSSCGKSA-N 1 0 342.399 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCc3c2c(F)ccc3F)cc1 ZINC000540183210 1037666391 /nfs/dbraw/zinc/66/63/91/1037666391.db2.gz YTURRHSWQGGEBX-MRXNPFEDSA-N 1 0 334.322 3.529 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@H](CCSC)C(C)(C)O ZINC001168213677 1037677858 /nfs/dbraw/zinc/67/78/58/1037677858.db2.gz XTMXPOFGAORUFU-QGZVFWFLSA-N 1 0 325.542 3.587 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)N[C@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000415937550 1037681222 /nfs/dbraw/zinc/68/12/22/1037681222.db2.gz XBPIGSAHDVBQKC-CYBMUJFWSA-N 1 0 342.399 3.587 20 5 EHBDRO COc1ccc(C[N@H+](C)Cc2ccc(OC)c([N+](=O)[O-])c2)cc1C ZINC000103144478 1037774345 /nfs/dbraw/zinc/77/43/45/1037774345.db2.gz PDHNTTANFFEBPE-UHFFFAOYSA-N 1 0 330.384 3.552 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000540326443 1037824531 /nfs/dbraw/zinc/82/45/31/1037824531.db2.gz WXZGTDBLLWPRPV-YOEHRIQHSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@H](C[NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000897460710 1037846565 /nfs/dbraw/zinc/84/65/65/1037846565.db2.gz VCEZSLGTLBEKLY-DYVFJYSZSA-N 1 0 343.431 3.728 20 5 EHBDRO C[C@@H](C[NH2+][C@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000897460721 1037847584 /nfs/dbraw/zinc/84/75/84/1037847584.db2.gz VFYDQCNHPNURQJ-HOCLYGCPSA-N 1 0 325.412 3.631 20 5 EHBDRO C[C@H](C[NH2+][C@H]1Cc2[nH]c3ccccc3c2C1)c1ccccc1[N+](=O)[O-] ZINC000897465282 1037872876 /nfs/dbraw/zinc/87/28/76/1037872876.db2.gz VDQWEGONPSYVIE-ZIAGYGMSSA-N 1 0 335.407 3.937 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)c1ccccc1[N+](=O)[O-] ZINC000897466062 1037876096 /nfs/dbraw/zinc/87/60/96/1037876096.db2.gz NHYHXKZEESDOQK-XABYNWHXSA-N 1 0 338.498 3.668 20 5 EHBDRO Cc1nc2ccc(C[NH2+]CCc3cccc([N+](=O)[O-])c3)cc2s1 ZINC000494185128 1037884502 /nfs/dbraw/zinc/88/45/02/1037884502.db2.gz HOUZAVOMOKJLCN-UHFFFAOYSA-N 1 0 327.409 3.845 20 5 EHBDRO CC(C)CCC[C@@H](C)NC(=O)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000540378798 1037888098 /nfs/dbraw/zinc/88/80/98/1037888098.db2.gz DSISLHFZIBTWAR-CABCVRRESA-N 1 0 335.448 3.576 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1ccc([N+](=O)[O-])c(Cl)c1 ZINC001299196151 1038263448 /nfs/dbraw/zinc/26/34/48/1038263448.db2.gz OARSRKJPMZDVED-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC2(CC2)CC1 ZINC000378325675 1038464798 /nfs/dbraw/zinc/46/47/98/1038464798.db2.gz HCCQUONNWUIYPJ-GFCCVEGCSA-N 1 0 328.372 3.582 20 5 EHBDRO COc1ccc([C@H](OC)[C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000538966777 1038616745 /nfs/dbraw/zinc/61/67/45/1038616745.db2.gz DTTOHDIPUWORFE-AUUYWEPGSA-N 1 0 344.411 3.778 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000488052305 1038809334 /nfs/dbraw/zinc/80/93/34/1038809334.db2.gz CAAVDNCDDZIRIV-MAUKXSAKSA-N 1 0 347.459 3.591 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(C)C ZINC000479866937 1038845452 /nfs/dbraw/zinc/84/54/52/1038845452.db2.gz SZDJCBCRAVECDX-IZTUGPKFSA-N 1 0 334.416 3.566 20 5 EHBDRO CCN1CCCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711764 1038956675 /nfs/dbraw/zinc/95/66/75/1038956675.db2.gz NNQIXZIKRILCDB-OAHLLOKOSA-N 1 0 343.427 3.819 20 5 EHBDRO COc1ccc([C@H]2C[C@H]([NH2+]Cc3cccc([N+](=O)[O-])c3)C2)cc1F ZINC000500549855 1038957481 /nfs/dbraw/zinc/95/74/81/1038957481.db2.gz XOKMQYWVOSWVEL-SHTZXODSSA-N 1 0 330.359 3.778 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000552097446 1038984780 /nfs/dbraw/zinc/98/47/80/1038984780.db2.gz BXECPSGUEMJHER-AHCXZYCDSA-N 1 0 332.444 3.568 20 5 EHBDRO CC(C)[C@@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CS1 ZINC000488518035 1039252949 /nfs/dbraw/zinc/25/29/49/1039252949.db2.gz PLXXNMOXESPCHV-ZFWWWQNUSA-N 1 0 328.865 3.910 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668093 1039385172 /nfs/dbraw/zinc/38/51/72/1039385172.db2.gz ICUGJSLWRZBFEK-DOMZBBRYSA-N 1 0 346.818 3.891 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000728918108 1039392079 /nfs/dbraw/zinc/39/20/79/1039392079.db2.gz JEJBMXZAZXGMCD-RBUKOAKNSA-N 1 0 344.386 3.822 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)CC(=O)Nc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000478475779 1039482372 /nfs/dbraw/zinc/48/23/72/1039482372.db2.gz ADEOIYOCKFSYNH-GFCCVEGCSA-N 1 0 345.374 3.549 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)cccc1[N+](=O)[O-] ZINC000478497196 1039486953 /nfs/dbraw/zinc/48/69/53/1039486953.db2.gz ZPWJHMQGMDWMGM-ZDUSSCGKSA-N 1 0 331.391 3.959 20 5 EHBDRO CCN(CC)C(=O)CCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302859 1039643381 /nfs/dbraw/zinc/64/33/81/1039643381.db2.gz BZTPEUGSFNIMMK-GOSISDBHSA-N 1 0 347.459 3.601 20 5 EHBDRO CN(C)c1cccc(C[NH2+][C@@H]2CCCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000417313581 1039669895 /nfs/dbraw/zinc/66/98/95/1039669895.db2.gz WQLABOYEDPZAST-GOSISDBHSA-N 1 0 340.427 3.613 20 5 EHBDRO CCOCc1ccccc1C[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000566473382 1039711790 /nfs/dbraw/zinc/71/17/90/1039711790.db2.gz APISDCLVWJVGFM-GOSISDBHSA-N 1 0 326.396 3.908 20 5 EHBDRO COc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991066 1039763551 /nfs/dbraw/zinc/76/35/51/1039763551.db2.gz BOYFCGANNOVSKY-KBXCAEBGSA-N 1 0 345.374 3.600 20 5 EHBDRO COc1cc(N[C@H]2CC[N@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991070 1039764391 /nfs/dbraw/zinc/76/43/91/1039764391.db2.gz BOYFCGANNOVSKY-KSSFIOAISA-N 1 0 345.374 3.600 20 5 EHBDRO COc1ccccc1OC[C@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000478911443 1039806661 /nfs/dbraw/zinc/80/66/61/1039806661.db2.gz VPELEXMBERMGJM-CABCVRRESA-N 1 0 344.411 3.969 20 5 EHBDRO CC(C)[C@@H]1CN(C(=O)c2cc3ccccc3c3cccnc23)CC[N@@H+]1C ZINC000489388677 1039902651 /nfs/dbraw/zinc/90/26/51/1039902651.db2.gz JCBCIDDUTLDZEE-FQEVSTJZSA-N 1 0 347.462 3.800 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc2ccc(F)cc2[nH]1 ZINC000549806117 1039940680 /nfs/dbraw/zinc/94/06/80/1039940680.db2.gz QJZPSQUWIDDHGW-UHFFFAOYSA-N 1 0 327.359 3.890 20 5 EHBDRO COc1cc2c(cc1F)[nH+]ccc2N(C)Cc1ccccc1[N+](=O)[O-] ZINC000479372394 1040171944 /nfs/dbraw/zinc/17/19/44/1040171944.db2.gz QWWYXKOAGASIQW-UHFFFAOYSA-N 1 0 341.342 3.927 20 5 EHBDRO CC(C)CC[N@H+](C)[C@@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000053363721 1040241976 /nfs/dbraw/zinc/24/19/76/1040241976.db2.gz LMIYYZOFAIEHBZ-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC000128286907 1040290856 /nfs/dbraw/zinc/29/08/56/1040290856.db2.gz BAXAMESXXUOEJA-STQMWFEESA-N 1 0 337.395 3.573 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN(C)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000481041929 1040291839 /nfs/dbraw/zinc/29/18/39/1040291839.db2.gz BJVBEMKIBHFFBP-INIZCTEOSA-N 1 0 327.428 3.686 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031075 1040299293 /nfs/dbraw/zinc/29/92/93/1040299293.db2.gz NKLOBAOYFVQVLA-OAHLLOKOSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCN2CC=CCC2)c2ccccc2)c1 ZINC000479526426 1040323332 /nfs/dbraw/zinc/32/33/32/1040323332.db2.gz MJOWCBPRGPLYFH-FQEVSTJZSA-N 1 0 337.423 3.536 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000481104886 1040370963 /nfs/dbraw/zinc/37/09/63/1040370963.db2.gz JKNZKPKHIYCSBM-HIFRSBDPSA-N 1 0 333.432 3.646 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CC[C@H](C)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000481194428 1040471390 /nfs/dbraw/zinc/47/13/90/1040471390.db2.gz WALTYDWNKBGNKD-MYZSUADSSA-N 1 0 333.432 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc(N2CCCC2)nc1 ZINC000151044023 1040518201 /nfs/dbraw/zinc/51/82/01/1040518201.db2.gz VIEXRRFRGBYYKZ-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO COc1ccc(C[N@H+](C)CCc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000512687361 1040539768 /nfs/dbraw/zinc/53/97/68/1040539768.db2.gz QICDKEMJDAJRKL-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(NC(N)=O)cc2)cc1[N+](=O)[O-] ZINC000192847059 1040574695 /nfs/dbraw/zinc/57/46/95/1040574695.db2.gz LQPGOCDWAWMIPC-CHWSQXEVSA-N 1 0 342.399 3.806 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H](Nc3ccccc3)C2)c(F)c1 ZINC000490547913 1040587764 /nfs/dbraw/zinc/58/77/64/1040587764.db2.gz RICQBXKFDCFDEG-MRXNPFEDSA-N 1 0 329.375 3.810 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000614227379 1040764670 /nfs/dbraw/zinc/76/46/70/1040764670.db2.gz CBHODICLKBAHAL-QZTJIDSGSA-N 1 0 336.432 3.547 20 5 EHBDRO CC[C@H]1COCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796935 1040836030 /nfs/dbraw/zinc/83/60/30/1040836030.db2.gz FAVHCOGAYRRVFF-ZDUSSCGKSA-N 1 0 332.425 3.934 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N[C@H](C)C[NH+]1CCCCCC1 ZINC000481418691 1040879734 /nfs/dbraw/zinc/87/97/34/1040879734.db2.gz YPHZUEUFALLGQX-OAHLLOKOSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1cc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])cc(C)c1O ZINC000570886645 1040963795 /nfs/dbraw/zinc/96/37/95/1040963795.db2.gz BWEPBPKSHHHNAL-UHFFFAOYSA-N 1 0 334.803 3.903 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@H]2CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541559826 1040999027 /nfs/dbraw/zinc/99/90/27/1040999027.db2.gz KJPAUWAIEUROQN-LIRRHRJNSA-N 1 0 344.411 3.856 20 5 EHBDRO Cc1c(F)cccc1NC(=O)CC[N@@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000433278133 1041190263 /nfs/dbraw/zinc/19/02/63/1041190263.db2.gz FIAXOHDDULFLKU-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO CC(=O)c1cc(N2CCC[C@@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)ccc1[N+](=O)[O-] ZINC000587344414 1041216030 /nfs/dbraw/zinc/21/60/30/1041216030.db2.gz GSORBMUCFBLZHM-JKIFEVAISA-N 1 0 345.443 3.639 20 5 EHBDRO CC(C)(C)[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000111057347 1041719263 /nfs/dbraw/zinc/71/92/63/1041719263.db2.gz JLFQBAGJOBBNAN-KBPBESRZSA-N 1 0 333.432 3.728 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)c1[N+](=O)[O-] ZINC000893472362 1042213166 /nfs/dbraw/zinc/21/31/66/1042213166.db2.gz QZZDHWXFSILXTB-YVEFUNNKSA-N 1 0 342.395 3.641 20 5 EHBDRO Cc1nc2c(s1)[C@H]([N@H+](C)CCOc1ccccc1[N+](=O)[O-])CCC2 ZINC000111311635 1042261111 /nfs/dbraw/zinc/26/11/11/1042261111.db2.gz XPFUJEKIFQLAKF-OAHLLOKOSA-N 1 0 347.440 3.748 20 5 EHBDRO C[N@H+](Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@@H](CO)C(C)(C)C ZINC000093821754 1042544762 /nfs/dbraw/zinc/54/47/62/1042544762.db2.gz BCDXHMYCIYELMF-HNNXBMFYSA-N 1 0 349.456 3.557 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000184667491 1042594740 /nfs/dbraw/zinc/59/47/40/1042594740.db2.gz XIRRDDHYNDMOSV-SNVBAGLBSA-N 1 0 344.358 3.873 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072897482 1042764378 /nfs/dbraw/zinc/76/43/78/1042764378.db2.gz HYHHRJFHHWYJOS-ZIAGYGMSSA-N 1 0 329.400 3.913 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432328453 1042912042 /nfs/dbraw/zinc/91/20/42/1042912042.db2.gz XMRGZOISSQXTPL-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCO[C@@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000279094769 1043337246 /nfs/dbraw/zinc/33/72/46/1043337246.db2.gz NUQWYJCGCKHNAG-JEBQAFNWSA-N 1 0 330.428 3.864 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000512209998 1044161087 /nfs/dbraw/zinc/16/10/87/1044161087.db2.gz BQBYPBXYTWTOGL-FUHWJXTLSA-N 1 0 331.460 3.681 20 5 EHBDRO COCCC[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000512250678 1044399055 /nfs/dbraw/zinc/39/90/55/1044399055.db2.gz DLUUPMPCNVKTKH-UHFFFAOYSA-N 1 0 338.791 3.977 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2COc3ccc(F)cc3C2)cc1[N+](=O)[O-] ZINC000572402185 1044712044 /nfs/dbraw/zinc/71/20/44/1044712044.db2.gz YMOWEGUVYWWFAF-WBMJQRKESA-N 1 0 330.359 3.697 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CCO)CCCC2)o1 ZINC000072925797 1126933599 /nfs/dbraw/zinc/93/35/99/1126933599.db2.gz YUWJQNRDHPSZQI-UHFFFAOYSA-N 1 0 344.411 3.887 20 5 EHBDRO COc1cc(C)c(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000083474257 1127367431 /nfs/dbraw/zinc/36/74/31/1127367431.db2.gz YMJOSCDWYWLUCU-UHFFFAOYSA-N 1 0 344.411 3.945 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283258 1127473759 /nfs/dbraw/zinc/47/37/59/1127473759.db2.gz PFKBJQOHBYXWMX-NWDGAFQWSA-N 1 0 341.839 3.943 20 5 EHBDRO C[C@@H]1COCC[C@@H]1C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000552097447 1127578219 /nfs/dbraw/zinc/57/82/19/1127578219.db2.gz BXECPSGUEMJHER-ATLSCFEFSA-N 1 0 332.444 3.568 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+]1CCC[C@](CO)(C(C)C)C1 ZINC000552137790 1127619130 /nfs/dbraw/zinc/61/91/30/1127619130.db2.gz NAHXLJCRUSDESP-LZOLKVDOSA-N 1 0 332.444 3.729 20 5 EHBDRO CC(C)(C)c1cnc(N2C[C@H](CC[NH3+])c3ccccc32)c([N+](=O)[O-])c1 ZINC001168545489 1127680930 /nfs/dbraw/zinc/68/09/30/1127680930.db2.gz PESUPJQDSQQHIR-ZDUSSCGKSA-N 1 0 340.427 3.871 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@@H](O)c1cccc(F)c1 ZINC000273063601 1128438496 /nfs/dbraw/zinc/43/84/96/1128438496.db2.gz IBMNWEWMGDRDMM-QLJPJBMISA-N 1 0 338.766 3.599 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000153551752 1128448577 /nfs/dbraw/zinc/44/85/77/1128448577.db2.gz AXFMABNPLLVJSM-GUYCJALGSA-N 1 0 336.432 3.585 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506898 1128484222 /nfs/dbraw/zinc/48/42/22/1128484222.db2.gz CYWKYZJRUCPULH-KXBFYZLASA-N 1 0 325.412 3.917 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2CCC(c3ccccc3)CC2)cc1 ZINC000765844386 1128543621 /nfs/dbraw/zinc/54/36/21/1128543621.db2.gz GNRAQNSMCUHAHC-NLPFYKDJSA-N 1 0 340.423 3.944 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000542702557 1128548605 /nfs/dbraw/zinc/54/86/05/1128548605.db2.gz YQYKPJVCULCLOK-HXUWFJFHSA-N 1 0 340.423 3.737 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCCO)[C@@H]1CCc2ccccc21 ZINC000542702725 1128549583 /nfs/dbraw/zinc/54/95/83/1128549583.db2.gz RJVJZXPPFLWGSD-HXUWFJFHSA-N 1 0 340.423 3.775 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCO[C@@H](c2ccc(F)cc2)C1 ZINC000273502862 1128570562 /nfs/dbraw/zinc/57/05/62/1128570562.db2.gz POQQCRMTQAPXLJ-FUHWJXTLSA-N 1 0 330.359 3.744 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@]2(O)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765879838 1128637179 /nfs/dbraw/zinc/63/71/79/1128637179.db2.gz UJNOGAAQOBSQHQ-FOIQADDNSA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C(C)C ZINC000091350138 1128642379 /nfs/dbraw/zinc/64/23/79/1128642379.db2.gz NYDSDCZNPLVQHN-LJQANCHMSA-N 1 0 341.411 3.829 20 5 EHBDRO C[C@@H](Cn1ccnc1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000338716179 1128745439 /nfs/dbraw/zinc/74/54/39/1128745439.db2.gz MWLAMBRYZXEFTA-ZDUSSCGKSA-N 1 0 342.424 3.698 20 5 EHBDRO C[C@@H](c1ccccn1)N(C)Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000091702456 1128820663 /nfs/dbraw/zinc/82/06/63/1128820663.db2.gz UCBVIIROXFCOIZ-ZDUSSCGKSA-N 1 0 338.367 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1sccc1Br ZINC000148179881 1120196230 /nfs/dbraw/zinc/19/62/30/1120196230.db2.gz NAZZCLULYQYBJB-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO CCC[C@H](O)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000112377571 1128920839 /nfs/dbraw/zinc/92/08/39/1128920839.db2.gz YTPJCIXTKITHIK-HNNXBMFYSA-N 1 0 348.374 3.777 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494653212 1120719759 /nfs/dbraw/zinc/71/97/59/1120719759.db2.gz YMGVSARMSFTKBZ-HOCLYGCPSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1cc(C[NH2+]Cc2ccc(C3CCC3)cc2)c([N+](=O)[O-])cc1O ZINC000494851723 1120885869 /nfs/dbraw/zinc/88/58/69/1120885869.db2.gz SQEVIMAOKSNHKM-UHFFFAOYSA-N 1 0 342.395 3.866 20 5 EHBDRO CC(C)C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)CC(C)(C)C ZINC000761831864 1120975866 /nfs/dbraw/zinc/97/58/66/1120975866.db2.gz QJRFSBYIWLRGHS-UHFFFAOYSA-N 1 0 345.447 3.815 20 5 EHBDRO CC(C)C[C@@H](CNc1ccc([N+](=O)[O-])cn1)[NH2+][C@@H](C)c1ccccc1 ZINC000495320174 1121073644 /nfs/dbraw/zinc/07/36/44/1121073644.db2.gz YSVQTOKDVFMIEL-RDJZCZTQSA-N 1 0 342.443 3.589 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2CC(C)(C)OC2(C)C)cc1[N+](=O)[O-] ZINC000495427642 1121186797 /nfs/dbraw/zinc/18/67/97/1121186797.db2.gz SINPBWCHBDNUQE-WBMJQRKESA-N 1 0 336.432 3.990 20 5 EHBDRO CC(C)(C)c1ccc(CN2CCc3ncc([N+](=O)[O-])cc3C2)cc1 ZINC000495444864 1121210738 /nfs/dbraw/zinc/21/07/38/1121210738.db2.gz NHRFABRYMOVJAA-UHFFFAOYSA-N 1 0 325.412 3.846 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC[N@@H+]2CCc3ccccc3C2)c2ccncc21 ZINC000301073807 1121361098 /nfs/dbraw/zinc/36/10/98/1121361098.db2.gz MLYPESYPTODRTR-UHFFFAOYSA-N 1 0 348.406 3.613 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000153342798 1121747294 /nfs/dbraw/zinc/74/72/94/1121747294.db2.gz SJWHLWYGGHXBPY-CZUORRHYSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2ccccc2)CC1 ZINC000488070310 1122016075 /nfs/dbraw/zinc/01/60/75/1122016075.db2.gz VOZJIVNFZFSQLO-QGZVFWFLSA-N 1 0 339.439 3.516 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC1CC[NH+](CC2CCCC2)CC1 ZINC000301756452 1129033683 /nfs/dbraw/zinc/03/36/83/1129033683.db2.gz YIENVBGPZXSYRS-UHFFFAOYSA-N 1 0 338.839 3.710 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132036414 1129040535 /nfs/dbraw/zinc/04/05/35/1129040535.db2.gz KQXUYHGOIJCSDT-SWLSCSKDSA-N 1 0 337.395 3.621 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000301194357 1122451173 /nfs/dbraw/zinc/45/11/73/1122451173.db2.gz NJTYEBYHCJFNGF-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc(C(=O)OC)cc1 ZINC000556094110 1122809530 /nfs/dbraw/zinc/80/95/30/1122809530.db2.gz QCLCUVGCEAZBNL-KRWDZBQOSA-N 1 0 342.395 3.665 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000130425561 1122949829 /nfs/dbraw/zinc/94/98/29/1122949829.db2.gz FSPHGIZCNUXKPP-PKOBYXMFSA-N 1 0 328.412 3.629 20 5 EHBDRO O=C(Nc1ccc2cc[nH]c2c1)c1ccc(-n2ccnc2)c([N+](=O)[O-])c1 ZINC000194822306 1122972911 /nfs/dbraw/zinc/97/29/11/1122972911.db2.gz LMOUDYGNGCBWGT-UHFFFAOYSA-N 1 0 347.334 3.514 20 5 EHBDRO C[C@@H](CC(=O)OC(C)(C)C)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000498626789 1122997583 /nfs/dbraw/zinc/99/75/83/1122997583.db2.gz MQOULHDFSFUKLW-NSHDSACASA-N 1 0 342.823 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H](C2CCC2)[C@H]2CCOC2)cc1 ZINC000925464519 1123043524 /nfs/dbraw/zinc/04/35/24/1123043524.db2.gz DVSCLWOYCUFDKP-PKOBYXMFSA-N 1 0 332.444 3.712 20 5 EHBDRO CCC1CCC([N@H+](C)Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000921045887 1123458680 /nfs/dbraw/zinc/45/86/80/1123458680.db2.gz HDEVUTQHSIJFLU-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO CC1CC[NH+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)CC1 ZINC000195508979 1123494246 /nfs/dbraw/zinc/49/42/46/1123494246.db2.gz PSBQUWNVTUWOLF-UHFFFAOYSA-N 1 0 346.456 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCS[C@@H](c2ccccc2)C1 ZINC000609800297 1123664458 /nfs/dbraw/zinc/66/44/58/1123664458.db2.gz AARZVUOZDYHWAU-GOSISDBHSA-N 1 0 344.436 3.764 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000609916525 1123691821 /nfs/dbraw/zinc/69/18/21/1123691821.db2.gz WFJCXUNTEXNRFZ-CQSZACIVSA-N 1 0 332.350 3.938 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1ccccc1[N+](=O)[O-] ZINC000610133869 1123738841 /nfs/dbraw/zinc/73/88/41/1123738841.db2.gz BFANPTYLBITACB-QGZVFWFLSA-N 1 0 339.439 3.691 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1OCCc2ccccc21 ZINC000615724285 1123863892 /nfs/dbraw/zinc/86/38/92/1123863892.db2.gz YOASTLRVAMAYEU-HFZJLKNISA-N 1 0 338.407 3.902 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1nn(C)c2ccccc12 ZINC000615727583 1123864812 /nfs/dbraw/zinc/86/48/12/1123864812.db2.gz KFODWHWZJRYBLE-UVTDQMKNSA-N 1 0 336.395 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1ccnn1C)C(C)C ZINC000615967167 1123919454 /nfs/dbraw/zinc/91/94/54/1123919454.db2.gz PYKSNDOANDHORR-RHSMWYFYSA-N 1 0 330.432 3.727 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](C[C@H]3CCOC3)C2)ccc1[N+](=O)[O-] ZINC000617216825 1124100455 /nfs/dbraw/zinc/10/04/55/1124100455.db2.gz ZQJWZVYOHHMWIH-DOTOQJQBSA-N 1 0 348.443 3.632 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c3cnccc23)C1 ZINC000069064191 1124103102 /nfs/dbraw/zinc/10/31/02/1124103102.db2.gz ISWLZJNBDZWBRC-AWEZNQCLSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1cc(NC(C)(C)C[N@H+](C)Cc2ccccc2)ncc1[N+](=O)[O-] ZINC000301833838 1129168284 /nfs/dbraw/zinc/16/82/84/1129168284.db2.gz VDPCHPRDSYDVHM-UHFFFAOYSA-N 1 0 328.416 3.621 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301832637 1129173022 /nfs/dbraw/zinc/17/30/22/1129173022.db2.gz RNUWMXXDAVTEGA-LLVKDONJSA-N 1 0 331.338 3.757 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCCOCC2)s1 ZINC000181028481 1124487737 /nfs/dbraw/zinc/48/77/37/1124487737.db2.gz NZAOLWGJMWSSPK-ZDUSSCGKSA-N 1 0 332.425 3.982 20 5 EHBDRO Cc1cc(NC[C@@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)ncc1[N+](=O)[O-] ZINC000080605822 1124625250 /nfs/dbraw/zinc/62/52/50/1124625250.db2.gz IHNLBXWKZGOINZ-GUYCJALGSA-N 1 0 346.456 3.855 20 5 EHBDRO Cc1cc(N[C@@H]2CCOC3(CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272833447 1125046428 /nfs/dbraw/zinc/04/64/28/1125046428.db2.gz LJNCEBOJEVDPCP-CYBMUJFWSA-N 1 0 327.384 3.965 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000181968698 1125103727 /nfs/dbraw/zinc/10/37/27/1125103727.db2.gz CCOGCHKVWLSSJO-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2[C@@H]3CCO[C@@H]3C23CCC3)c2cc([N+](=O)[O-])ccc21 ZINC000618988422 1125262900 /nfs/dbraw/zinc/26/29/00/1125262900.db2.gz KJKBGWLUVALANL-RUGDWHBFSA-N 1 0 342.439 3.864 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)CCc1ccccc1)C1CC1 ZINC000182554127 1125333021 /nfs/dbraw/zinc/33/30/21/1125333021.db2.gz QCEKDTMXUVHHNW-IBGZPJMESA-N 1 0 340.423 3.553 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCCc2cc(F)ccc21 ZINC000182829158 1125373945 /nfs/dbraw/zinc/37/39/45/1125373945.db2.gz XPOWYLFMXPLFQO-QGZVFWFLSA-N 1 0 330.359 3.910 20 5 EHBDRO CO[C@@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000453212478 1129181386 /nfs/dbraw/zinc/18/13/86/1129181386.db2.gz HYINARBATSVLEE-UONOGXRCSA-N 1 0 344.333 3.661 20 5 EHBDRO C[C@@H]1CO[C@@H](c2ccccc2)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000066851865 1129216492 /nfs/dbraw/zinc/21/64/92/1129216492.db2.gz IFPUYHOMJJFCKJ-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000255902962 1129225632 /nfs/dbraw/zinc/22/56/32/1129225632.db2.gz TUXPZXDSCXWWDG-ZQMJAJRESA-N 1 0 326.396 3.877 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])[C@H]1C ZINC000255953225 1129237444 /nfs/dbraw/zinc/23/74/44/1129237444.db2.gz KASPWZFZLAGOTM-MDZLAQPJSA-N 1 0 339.823 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCCC[C@H]23)nc1-c1ccccc1 ZINC000301880121 1129252842 /nfs/dbraw/zinc/25/28/42/1129252842.db2.gz PCZQYXPTVMVTRD-HZPDHXFCSA-N 1 0 338.411 3.696 20 5 EHBDRO CC(C)[N@H+](CCCOCC(F)(F)F)Cc1ccc([N+](=O)[O-])cc1 ZINC000067458556 1129276060 /nfs/dbraw/zinc/27/60/60/1129276060.db2.gz BSJBWOVCGPCHHL-UHFFFAOYSA-N 1 0 334.338 3.774 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCO[C@H]1CCCCO1 ZINC000922232196 1129383384 /nfs/dbraw/zinc/38/33/84/1129383384.db2.gz KLNAEDLTTPYUSR-NZHZHZHDSA-N 1 0 334.416 3.521 20 5 EHBDRO CCOc1cc(N[C@H]2CC[N@H+](C)[C@@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971349 1129465264 /nfs/dbraw/zinc/46/52/64/1129465264.db2.gz GFQJSYWUWVDUKL-QFBILLFUSA-N 1 0 341.411 3.851 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466461847 1129468328 /nfs/dbraw/zinc/46/83/28/1129468328.db2.gz ANCHQWZWTXNCCJ-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO CC1([NH+]2CCCC2)CCC([NH2+]Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000922501822 1129555794 /nfs/dbraw/zinc/55/57/94/1129555794.db2.gz BRQDBKPEBYAURO-UHFFFAOYSA-N 1 0 335.423 3.621 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](COCc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000093684041 1129599489 /nfs/dbraw/zinc/59/94/89/1129599489.db2.gz ZIKOPFBZNSIWJH-LJQANCHMSA-N 1 0 340.423 3.942 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000156181226 1129702802 /nfs/dbraw/zinc/70/28/02/1129702802.db2.gz XNBROPWKTNXWJY-BEFAXECRSA-N 1 0 327.428 3.857 20 5 EHBDRO C[C@@H](CCNc1ccc([N+](=O)[O-])c2cnccc12)[NH+]1CCCCC1 ZINC000302124793 1129769108 /nfs/dbraw/zinc/76/91/08/1129769108.db2.gz FMQVDVQSBLXEJX-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@H](C[NH+]1CCCCCC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000302339298 1129775870 /nfs/dbraw/zinc/77/58/70/1129775870.db2.gz BLJVHVMGXLSNON-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO CCOC(=O)CC[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000162044414 1129796661 /nfs/dbraw/zinc/79/66/61/1129796661.db2.gz CNUYOTNLQMSFMT-GJZGRUSLSA-N 1 0 334.416 3.711 20 5 EHBDRO Cc1ccc(C)c(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000056196862 1129805743 /nfs/dbraw/zinc/80/57/43/1129805743.db2.gz FCTRYDTZNDVFSN-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056197053 1129805894 /nfs/dbraw/zinc/80/58/94/1129805894.db2.gz NIERJRYGWWOUAO-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC001168741710 1129835997 /nfs/dbraw/zinc/83/59/97/1129835997.db2.gz PEUVPRFNMWUCGM-ZMYBRWDISA-N 1 0 328.412 3.800 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)[C@H]2Oc3ccccc3[C@@H]2C)cccc1[N+](=O)[O-] ZINC000543542253 1129953252 /nfs/dbraw/zinc/95/32/52/1129953252.db2.gz ITJBVRWROMDGQW-KSMMKXTCSA-N 1 0 326.396 3.946 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)CCC(=O)N2)c1cccc([N+](=O)[O-])c1 ZINC000173328765 1130207962 /nfs/dbraw/zinc/20/79/62/1130207962.db2.gz YVWLGZGODDJRDQ-CHWSQXEVSA-N 1 0 339.395 3.891 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)cccc1[N+](=O)[O-] ZINC000246596470 1130394245 /nfs/dbraw/zinc/39/42/45/1130394245.db2.gz ZUSRWJPZZBESAI-VBQJREDUSA-N 1 0 336.457 3.609 20 5 EHBDRO C[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)[N@@H+]1CCCC[C@H]1C ZINC000731206203 1130779328 /nfs/dbraw/zinc/77/93/28/1130779328.db2.gz BHKMWMZJYNVBEX-NEPJUHHUSA-N 1 0 334.445 3.879 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1cccc(-n2ccnn2)c1 ZINC000348082830 1131150193 /nfs/dbraw/zinc/15/01/93/1131150193.db2.gz TZTHCZVPPGSGMK-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO [NH3+]Cc1cc2ccncc2n1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172899694 1131881977 /nfs/dbraw/zinc/88/19/77/1131881977.db2.gz DZOHRZXCRUYARZ-MRXNPFEDSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCCc3ncccc31)CC2 ZINC001172900826 1131883698 /nfs/dbraw/zinc/88/36/98/1131883698.db2.gz GCNHWJXULXJJOM-JXFKEZNVSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cccc3nccnc13)CC2 ZINC001172899991 1131883995 /nfs/dbraw/zinc/88/39/95/1131883995.db2.gz AXJJRXFSRWDTJS-QGZVFWFLSA-N 1 0 348.406 3.575 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)nc1 ZINC001172902534 1131884837 /nfs/dbraw/zinc/88/48/37/1131884837.db2.gz ZMBUAWKCVYDDKW-PBHICJAKSA-N 1 0 325.412 3.896 20 5 EHBDRO CC(C)([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccncc1 ZINC001172902570 1131885025 /nfs/dbraw/zinc/88/50/25/1131885025.db2.gz KSSJZMRFNDBIDS-QGZVFWFLSA-N 1 0 325.412 3.762 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCC(F)(F)[C@H](F)C1)CC2 ZINC001172902666 1131885208 /nfs/dbraw/zinc/88/52/08/1131885208.db2.gz BNIHHPWTUTVLRW-UKRRQHHQSA-N 1 0 328.334 3.521 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172905389 1131886298 /nfs/dbraw/zinc/88/62/98/1131886298.db2.gz RRBGIVNERGXJDI-SFHVURJKSA-N 1 0 340.423 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1C[C@H]3CC[C@@H](C1)C3(F)F)CC2 ZINC001172906353 1131887238 /nfs/dbraw/zinc/88/72/38/1131887238.db2.gz XIRAOEVUTMKXSE-XHSDSOJGSA-N 1 0 336.382 3.819 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)ccn1 ZINC001172905770 1131888217 /nfs/dbraw/zinc/88/82/17/1131888217.db2.gz KQMJHXYKYVKUFQ-GUYCJALGSA-N 1 0 341.411 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](c3cccnc3)C1)CC2 ZINC001172915535 1131903240 /nfs/dbraw/zinc/90/32/40/1131903240.db2.gz OPGPJTKXIRCVRN-OALUTQOASA-N 1 0 337.423 3.727 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2(c3ccccc3)CC2)c1F ZINC001173176473 1131991490 /nfs/dbraw/zinc/99/14/90/1131991490.db2.gz HJXFJAJTHAPVTN-ZDUSSCGKSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C(C)(C)c2ccccn2)c1F ZINC001173182114 1131994013 /nfs/dbraw/zinc/99/40/13/1131994013.db2.gz HLLMXMLFMBLCRK-LBPRGKRZSA-N 1 0 347.390 3.593 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2(C)CC(F)(F)C2)c1F ZINC001173190220 1131994739 /nfs/dbraw/zinc/99/47/39/1131994739.db2.gz WBPBJANKKMPBSH-JTQLQIEISA-N 1 0 346.349 3.699 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC3CCC(CC3)C2)c1F ZINC001173191718 1131995562 /nfs/dbraw/zinc/99/55/62/1131995562.db2.gz GPTMLSWOHLQYMH-HSBZDZAISA-N 1 0 336.407 3.796 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ccccc1)C1(O)CCC1 ZINC001173222290 1132004803 /nfs/dbraw/zinc/00/48/03/1132004803.db2.gz WAUOIXKZRWPRIX-DNVCBOLYSA-N 1 0 340.423 3.772 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001173222751 1132005501 /nfs/dbraw/zinc/00/55/01/1132005501.db2.gz VHDJQPAKVNXABD-HNAYVOBHSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCOC[C@@H]1c1ccccc1 ZINC001173222748 1132005567 /nfs/dbraw/zinc/00/55/67/1132005567.db2.gz VHDJQPAKVNXABD-DNVCBOLYSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(CC2CCC2)CCOCC1 ZINC001173224077 1132005704 /nfs/dbraw/zinc/00/57/04/1132005704.db2.gz LJLHMSUULGOZEO-HNNXBMFYSA-N 1 0 332.444 3.855 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1([C@H]2CCOC(C)(C)C2)CC1 ZINC001173224921 1132005811 /nfs/dbraw/zinc/00/58/11/1132005811.db2.gz IFVWBDPKMRAYDH-HOCLYGCPSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001173226134 1132006362 /nfs/dbraw/zinc/00/63/62/1132006362.db2.gz HUTWEKMCTRLATB-GFCCVEGCSA-N 1 0 331.803 3.633 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001173226388 1132006834 /nfs/dbraw/zinc/00/68/34/1132006834.db2.gz JIWICESRZUYSAP-DNVCBOLYSA-N 1 0 326.396 3.679 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H]1CCc2ccccc2O1 ZINC001173231053 1132008797 /nfs/dbraw/zinc/00/87/97/1132008797.db2.gz WVGURDWKNGHARN-KBXCAEBGSA-N 1 0 326.396 3.509 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC2(CCC(=O)CC2)CC1 ZINC001173233221 1132009854 /nfs/dbraw/zinc/00/98/54/1132009854.db2.gz USOSYTZOSSAKBW-OAHLLOKOSA-N 1 0 330.428 3.751 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173233362 1132010487 /nfs/dbraw/zinc/01/04/87/1132010487.db2.gz VTFBUPDVICOUTP-AWEZNQCLSA-N 1 0 326.396 3.593 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(=O)[C@@H](C)C12CCCC2 ZINC001173232496 1132010638 /nfs/dbraw/zinc/01/06/38/1132010638.db2.gz BSOOPMRUTNGUSX-HUUCEWRRSA-N 1 0 330.428 3.750 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CCCC(=O)c1cccnc1 ZINC001173232322 1132010946 /nfs/dbraw/zinc/01/09/46/1132010946.db2.gz FCTSOBXKKIMZOG-OAHLLOKOSA-N 1 0 341.411 3.516 20 5 EHBDRO CCOc1ccc(CC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173213591 1132014825 /nfs/dbraw/zinc/01/48/25/1132014825.db2.gz IXMAJCXIGCOSDC-OAHLLOKOSA-N 1 0 328.412 3.757 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2c(F)cccc21 ZINC001173214528 1132014954 /nfs/dbraw/zinc/01/49/54/1132014954.db2.gz OOUUPCLYLYWSIO-PXAZEXFGSA-N 1 0 330.359 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[N@H+](CCc3ccccc3)C3CC3)c2c1 ZINC000746022518 1132350016 /nfs/dbraw/zinc/35/00/16/1132350016.db2.gz CXXNHHKPOJTHTE-UHFFFAOYSA-N 1 0 336.395 3.609 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1cncc(C)c1 ZINC001174758292 1132466939 /nfs/dbraw/zinc/46/69/39/1132466939.db2.gz QLARVDJEEUJSFP-UHFFFAOYSA-N 1 0 344.418 3.947 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccccc2OCc2ccccc2)C1 ZINC001168977446 1132617394 /nfs/dbraw/zinc/61/73/94/1132617394.db2.gz JXKSUMCIPSFVQT-HKUYNNGSSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@H](OCc3ccccc3)CC2)C1 ZINC001168959981 1132620579 /nfs/dbraw/zinc/62/05/79/1132620579.db2.gz YLPXHEQNOYECPN-VJANTYMQSA-N 1 0 332.444 3.549 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)s1 ZINC001168966027 1132621232 /nfs/dbraw/zinc/62/12/32/1132621232.db2.gz FWBLGBCXOXSBIH-IVZWLZJFSA-N 1 0 333.251 3.607 20 5 EHBDRO CCc1ccccc1-c1nc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cs1 ZINC001169006394 1132630311 /nfs/dbraw/zinc/63/03/11/1132630311.db2.gz HPBKZQHOBZSZBO-UKRRQHHQSA-N 1 0 345.468 3.908 20 5 EHBDRO COc1cccc2c1CC[C@H](CCC[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)C2 ZINC001169006854 1132630611 /nfs/dbraw/zinc/63/06/11/1132630611.db2.gz ZLSLWNITDCDARV-LZLYRXPVSA-N 1 0 346.471 3.615 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2cccnc2C(F)(F)F)C2CC2)C1 ZINC001169009761 1132631173 /nfs/dbraw/zinc/63/11/73/1132631173.db2.gz XYEDGPZWIFABBB-SCDSUCTJSA-N 1 0 343.349 3.587 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(F)cc1Br ZINC001168990035 1132634578 /nfs/dbraw/zinc/63/45/78/1132634578.db2.gz AXRBPRCFKVUTJJ-NHCYSSNCSA-N 1 0 345.212 3.684 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@H](C[N+](=O)[O-])C3)cc2)cc1 ZINC001168986751 1132634655 /nfs/dbraw/zinc/63/46/55/1132634655.db2.gz YYYFULWHEGITOK-LPHOPBHVSA-N 1 0 340.423 3.897 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(c3noc4ccc(F)cc43)CC2)C1 ZINC001169038586 1132638257 /nfs/dbraw/zinc/63/82/57/1132638257.db2.gz ZTJHJHFURARBRN-IUODEOHRSA-N 1 0 347.390 3.592 20 5 EHBDRO CC1(C)C[C@@H](Nc2cnc(Cl)cc2[N+](=O)[O-])C[C@](C)(C[NH3+])C1 ZINC001169149088 1132677616 /nfs/dbraw/zinc/67/76/16/1132677616.db2.gz YWIZOFNPVRBGPH-BMIGLBTASA-N 1 0 326.828 3.599 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)c1ccc(F)cc1C ZINC001175990958 1132808676 /nfs/dbraw/zinc/80/86/76/1132808676.db2.gz ABIWYWTXKRSJPA-ZDUSSCGKSA-N 1 0 345.374 3.640 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc(N(C)C)cc1[N+](=O)[O-] ZINC001169689443 1132821337 /nfs/dbraw/zinc/82/13/37/1132821337.db2.gz DTINFORIXFVORP-MRXNPFEDSA-N 1 0 340.427 3.901 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ncc2cccc([N+](=O)[O-])c2n1 ZINC001169699084 1132826852 /nfs/dbraw/zinc/82/68/52/1132826852.db2.gz UTBCVKDFLDRIIU-OAHLLOKOSA-N 1 0 349.394 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC23CC[NH+](CC2)CC3)c(C(F)(F)F)c1 ZINC001169796674 1132861392 /nfs/dbraw/zinc/86/13/92/1132861392.db2.gz SIYXSXOSFPJQQU-UHFFFAOYSA-N 1 0 329.322 3.511 20 5 EHBDRO CC(C)CC[C@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765820 1133050629 /nfs/dbraw/zinc/05/06/29/1133050629.db2.gz PNXDKXPOYAXMQC-MRXNPFEDSA-N 1 0 343.431 3.711 20 5 EHBDRO CCSc1cccc(C[NH2+]CCOc2ccc([N+](=O)[O-])cc2)c1 ZINC001177683483 1133091487 /nfs/dbraw/zinc/09/14/87/1133091487.db2.gz FNZVRMRDJSUDOD-UHFFFAOYSA-N 1 0 332.425 3.875 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC001178304422 1133155488 /nfs/dbraw/zinc/15/54/88/1133155488.db2.gz GYJHXSDVWYRZIU-UGSOOPFHSA-N 1 0 332.375 3.908 20 5 EHBDRO CC(C)CSCC[NH2+]Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC001178412161 1133167496 /nfs/dbraw/zinc/16/74/96/1133167496.db2.gz DVTCXTFSIBMHEG-UHFFFAOYSA-N 1 0 334.388 3.675 20 5 EHBDRO CCC[C@@H](C)[C@H](CO)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC001179082353 1133227593 /nfs/dbraw/zinc/22/75/93/1133227593.db2.gz XLBQUFAJJXQODY-DYVFJYSZSA-N 1 0 332.400 3.742 20 5 EHBDRO COC1(OC)CC([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC001179640706 1133270023 /nfs/dbraw/zinc/27/00/23/1133270023.db2.gz AMTRXQFMKVXRJH-UHFFFAOYSA-N 1 0 348.424 3.564 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(Cl)c1N1CC[C@@H](C2CC[NH+](C)CC2)C1 ZINC000770132209 1133391395 /nfs/dbraw/zinc/39/13/95/1133391395.db2.gz OZBJFAFBLUGATD-CQSZACIVSA-N 1 0 337.851 3.725 20 5 EHBDRO CCCN(CC[NH+]1CCCCC1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC001181685738 1133507851 /nfs/dbraw/zinc/50/78/51/1133507851.db2.gz CAUGTFRGJCSGTE-UHFFFAOYSA-N 1 0 339.867 3.946 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1nccc2c1CCCC2 ZINC001181696904 1133518577 /nfs/dbraw/zinc/51/85/77/1133518577.db2.gz CYYLBDXQZNRYAS-UHFFFAOYSA-N 1 0 325.412 3.543 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](O)c1c(F)cccc1F)CCC2 ZINC000774249577 1133643336 /nfs/dbraw/zinc/64/33/36/1133643336.db2.gz BUIJDVPDHDRKSJ-SJORKVTESA-N 1 0 348.349 3.574 20 5 EHBDRO CC[C@H](C)C[C@@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519790 1133692373 /nfs/dbraw/zinc/69/23/73/1133692373.db2.gz BQHLDDXUVRMXNI-GWCFXTLKSA-N 1 0 334.338 3.500 20 5 EHBDRO CC[C@@H](C)C[C@H](CO)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC001182519796 1133692506 /nfs/dbraw/zinc/69/25/06/1133692506.db2.gz BQHLDDXUVRMXNI-ZWNOBZJWSA-N 1 0 334.338 3.500 20 5 EHBDRO COc1ccc(F)cc1CC[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001183811282 1133856229 /nfs/dbraw/zinc/85/62/29/1133856229.db2.gz HTYGKLCWMFUVKP-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2ccc([N+](=O)[O-])cc2C(C)=O)CC1 ZINC000786584218 1133871153 /nfs/dbraw/zinc/87/11/53/1133871153.db2.gz SUHFUQPOOWKCLZ-UHFFFAOYSA-N 1 0 347.459 3.746 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000786810994 1133909358 /nfs/dbraw/zinc/90/93/58/1133909358.db2.gz WXYWMRHKFKRCGN-FHLIRTJZSA-N 1 0 346.814 3.975 20 5 EHBDRO CC[N@H+](CCc1ccccn1)C/C(C)=C\c1cccc([N+](=O)[O-])c1 ZINC000787408104 1134003554 /nfs/dbraw/zinc/00/35/54/1134003554.db2.gz YNRDEGSOVCALKS-SSZFMOIBSA-N 1 0 325.412 3.958 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2F)cc1 ZINC000787986705 1134066388 /nfs/dbraw/zinc/06/63/88/1134066388.db2.gz JALMHCVNYVCVDP-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO CC(C)C[C@@H](CNc1c([N+](=O)[O-])cnn1C)[NH2+][C@H](C)c1ccccc1 ZINC001185338516 1134074381 /nfs/dbraw/zinc/07/43/81/1134074381.db2.gz LCONPRYTIGJKIE-ZBFHGGJFSA-N 1 0 345.447 3.506 20 5 EHBDRO C[NH+](C)CCN(CCCc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC001185621253 1134118624 /nfs/dbraw/zinc/11/86/24/1134118624.db2.gz RJABEBKVUHBPDY-UHFFFAOYSA-N 1 0 327.428 3.596 20 5 EHBDRO CCN(CCC[NH+](CC)CC)C(=O)/C=C(\C)c1ccc([N+](=O)[O-])cc1 ZINC000788535190 1134144889 /nfs/dbraw/zinc/14/48/89/1134144889.db2.gz ADPNEXIKZGHGRX-FOCLMDBBSA-N 1 0 347.459 3.579 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1 ZINC000788578521 1134147400 /nfs/dbraw/zinc/14/74/00/1134147400.db2.gz BAUJLTYBDKJIQD-MOPGFXCFSA-N 1 0 340.423 3.949 20 5 EHBDRO Cc1ccccc1C1(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CC1 ZINC000788586288 1134148079 /nfs/dbraw/zinc/14/80/79/1134148079.db2.gz AIVCMNKWCIAWNP-AWEZNQCLSA-N 1 0 325.412 3.868 20 5 EHBDRO Cc1ncc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)s1 ZINC000788591625 1134149056 /nfs/dbraw/zinc/14/90/56/1134149056.db2.gz IUIMGNCEUGPBBZ-MRXNPFEDSA-N 1 0 331.441 3.914 20 5 EHBDRO COCCC1(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCCCC1 ZINC000788756679 1134165892 /nfs/dbraw/zinc/16/58/92/1134165892.db2.gz YJOVHFFZCLJEEV-AWEZNQCLSA-N 1 0 335.448 3.815 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170299582 1134737976 /nfs/dbraw/zinc/73/79/76/1134737976.db2.gz UYIJCJWTYHVEJM-VXGBXAGGSA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170323405 1134747383 /nfs/dbraw/zinc/74/73/83/1134747383.db2.gz JMTSLPVMDWNQSC-RHSMWYFYSA-N 1 0 340.423 3.854 20 5 EHBDRO O=[N+]([O-])c1cccnc1N[C@@H]1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccccc1 ZINC001170330620 1134750364 /nfs/dbraw/zinc/75/03/64/1134750364.db2.gz CXOLOGVNABDPAQ-OSYLJGHBSA-N 1 0 338.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)CCc2cccs2)c([N+](=O)[O-])c1 ZINC001170344567 1134758530 /nfs/dbraw/zinc/75/85/30/1134758530.db2.gz CACMSPWHFXVWID-CYBMUJFWSA-N 1 0 334.441 3.770 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H](C(F)(F)F)C2)c([N+](=O)[O-])c1 ZINC001170340094 1134759100 /nfs/dbraw/zinc/75/91/00/1134759100.db2.gz DKJSTUQVEMFDHN-WCQYABFASA-N 1 0 346.349 3.809 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](C)NC(=O)OC(C)(C)C ZINC000793222784 1134876150 /nfs/dbraw/zinc/87/61/50/1134876150.db2.gz DPTBYHFZQVDCAQ-SSUFTNFISA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@@H+]2CCSC3(CCCCC3)C2)c1 ZINC001191465224 1134876120 /nfs/dbraw/zinc/87/61/20/1134876120.db2.gz YQIBMGJVPGAFCB-UHFFFAOYSA-N 1 0 336.457 3.725 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000775549869 1135061013 /nfs/dbraw/zinc/06/10/13/1135061013.db2.gz QKEJCUVAGAGOHR-UGSOOPFHSA-N 1 0 332.375 3.735 20 5 EHBDRO NC(=O)c1ccc(C[NH2+]C(C2CCCC2)C2CCCC2)c([N+](=O)[O-])c1 ZINC000775616890 1135332013 /nfs/dbraw/zinc/33/20/13/1135332013.db2.gz HQYUCULACVVBFB-UHFFFAOYSA-N 1 0 345.443 3.532 20 5 EHBDRO C[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCc2ccc(F)cc21 ZINC001195694377 1135456757 /nfs/dbraw/zinc/45/67/57/1135456757.db2.gz KRQQEUZHYKVUDO-AWEZNQCLSA-N 1 0 328.387 3.938 20 5 EHBDRO C[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@H]1CCO ZINC001195939168 1135486728 /nfs/dbraw/zinc/48/67/28/1135486728.db2.gz WXYJXKKZGOANJM-YGRLFVJLSA-N 1 0 347.242 3.885 20 5 EHBDRO CC1(C)C[N@H+](CCOc2ccccc2[N+](=O)[O-])CCc2ccccc21 ZINC001196024443 1135506807 /nfs/dbraw/zinc/50/68/07/1135506807.db2.gz ZGMIDMGNKJNERR-UHFFFAOYSA-N 1 0 340.423 3.810 20 5 EHBDRO C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@H]1CC[C@@H](C(F)(F)F)CC1 ZINC000808793773 1135738859 /nfs/dbraw/zinc/73/88/59/1135738859.db2.gz UCTKYVNUVRHIKP-VNHYZAJKSA-N 1 0 346.349 3.681 20 5 EHBDRO O=C(CC[NH2+]C1(C2CCCCC2)CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC001198539579 1135828735 /nfs/dbraw/zinc/82/87/35/1135828735.db2.gz CQICDFJFZNIISI-UHFFFAOYSA-N 1 0 349.406 3.765 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)cc1 ZINC001198563992 1135830996 /nfs/dbraw/zinc/83/09/96/1135830996.db2.gz VBIRAVMITANSFI-SJORKVTESA-N 1 0 348.443 3.502 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)ccc1Cl ZINC001198563867 1135831065 /nfs/dbraw/zinc/83/10/65/1135831065.db2.gz TXPOPYPMTOLTCL-HUUCEWRRSA-N 1 0 338.835 3.887 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)O[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)cc1[N+](=O)[O-] ZINC000810847383 1136014639 /nfs/dbraw/zinc/01/46/39/1136014639.db2.gz OHCIFOMJJGDRAO-HUUCEWRRSA-N 1 0 346.427 3.676 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(CO)CCCC1 ZINC000811491097 1136093472 /nfs/dbraw/zinc/09/34/72/1136093472.db2.gz ZVBXMJAFYSSFCE-UHFFFAOYSA-N 1 0 333.215 3.544 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCCOCC1CC1 ZINC000811472207 1136095031 /nfs/dbraw/zinc/09/50/31/1136095031.db2.gz AKLODTYWXRHPHN-UHFFFAOYSA-N 1 0 333.215 3.808 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280115 1136135296 /nfs/dbraw/zinc/13/52/96/1136135296.db2.gz ZVIKIQHRUIEEBB-RTBURBONSA-N 1 0 326.396 3.774 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1COC2(CCC2)C1 ZINC000850524900 1136277345 /nfs/dbraw/zinc/27/73/45/1136277345.db2.gz JNMJQAIXKVQGLC-UAGQMJEPSA-N 1 0 330.428 3.607 20 5 EHBDRO Cc1ccccc1C[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000776579096 1136443945 /nfs/dbraw/zinc/44/39/45/1136443945.db2.gz JAMYTFOPHLIZSL-LJQANCHMSA-N 1 0 326.396 3.601 20 5 EHBDRO Cc1ccccc1C[C@H]1CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585578 1136448345 /nfs/dbraw/zinc/44/83/45/1136448345.db2.gz XDJNZWMDQFOBOV-UXHICEINSA-N 1 0 340.423 3.644 20 5 EHBDRO O=C(CC[N@H+](CCC1CC1)CC1CC1)Nc1cc([N+](=O)[O-])ccc1F ZINC000852716722 1136479791 /nfs/dbraw/zinc/47/97/91/1136479791.db2.gz QTJLCLNTCWVNJW-UHFFFAOYSA-N 1 0 349.406 3.575 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-n2ccnc2)cs1 ZINC000338954958 1136512801 /nfs/dbraw/zinc/51/28/01/1136512801.db2.gz RXIVBXFCCJPWNG-UHFFFAOYSA-N 1 0 342.424 3.517 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cc2ccccc2o1)c1cccc([N+](=O)[O-])c1 ZINC000815081446 1136548579 /nfs/dbraw/zinc/54/85/79/1136548579.db2.gz DTGZEUOQXQJNES-MLGOLLRUSA-N 1 0 326.352 3.725 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000815559009 1136610564 /nfs/dbraw/zinc/61/05/64/1136610564.db2.gz URXKTPMVCKDUKW-LRDDRELGSA-N 1 0 329.400 3.988 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000815559008 1136610612 /nfs/dbraw/zinc/61/06/12/1136610612.db2.gz URXKTPMVCKDUKW-BLLLJJGKSA-N 1 0 329.400 3.988 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000815577292 1136613094 /nfs/dbraw/zinc/61/30/94/1136613094.db2.gz MAVAFKMOAPDNSM-KSSFIOAISA-N 1 0 342.443 3.964 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(C2CC2)c1 ZINC000815577024 1136613113 /nfs/dbraw/zinc/61/31/13/1136613113.db2.gz DZWBMATZAJEZNQ-BFUOFWGJSA-N 1 0 326.396 3.856 20 5 EHBDRO Cc1ccc(O[C@@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815583517 1136614055 /nfs/dbraw/zinc/61/40/55/1136614055.db2.gz HWEAKEUAUDPGPF-UONOGXRCSA-N 1 0 329.400 3.604 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818961492 1136892050 /nfs/dbraw/zinc/89/20/50/1136892050.db2.gz QPELBPNAKDMCSX-IRXDYDNUSA-N 1 0 344.411 3.833 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCCc2ccc(Cl)cc2)cc1 ZINC000818991230 1136897950 /nfs/dbraw/zinc/89/79/50/1136897950.db2.gz ZYWGAWFVXUKODL-QGZVFWFLSA-N 1 0 334.803 3.504 20 5 EHBDRO Cc1ccccc1C(C)(C)C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000818994602 1136898510 /nfs/dbraw/zinc/89/85/10/1136898510.db2.gz HKWHDIXRNWGTFZ-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO CC(C)(C[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1Cl ZINC000819013685 1136902747 /nfs/dbraw/zinc/90/27/47/1136902747.db2.gz XYTJDFOXIBQISB-KRWDZBQOSA-N 1 0 348.830 3.849 20 5 EHBDRO CC[C@H](CSc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819187748 1136921266 /nfs/dbraw/zinc/92/12/66/1136921266.db2.gz RXHVSROKYUESTF-CRAIPNDOSA-N 1 0 346.452 3.789 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2C[C@H](c3ccc(Cl)cc3)C2)c1 ZINC000819278114 1136930657 /nfs/dbraw/zinc/93/06/57/1136930657.db2.gz AHIWQNLLQPPYPT-QGPMSJSTSA-N 1 0 346.814 3.817 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCc3ccc(Cl)cc32)c([N+](=O)[O-])cc1O ZINC000858321119 1136958479 /nfs/dbraw/zinc/95/84/79/1136958479.db2.gz SMBOFIUJJUDCJD-AWEZNQCLSA-N 1 0 348.786 3.740 20 5 EHBDRO COc1ccc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(OC)c1 ZINC000858502105 1136974227 /nfs/dbraw/zinc/97/42/27/1136974227.db2.gz HGBYBFSTPBIWAK-NEPJUHHUSA-N 1 0 345.399 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@@H]3COCC[C@@H]32)c1 ZINC000339015680 1136995396 /nfs/dbraw/zinc/99/53/96/1136995396.db2.gz WPCFZVODFYIFHG-ABAIWWIYSA-N 1 0 344.333 3.615 20 5 EHBDRO C[C@H](C[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1)C(C)(C)C ZINC000780764766 1137017359 /nfs/dbraw/zinc/01/73/59/1137017359.db2.gz QLBRYPXKDTYYPJ-CJNGLKHVSA-N 1 0 330.432 3.690 20 5 EHBDRO CCCCSc1ccc([N+](=O)[O-])cc1C(=O)OCCn1ccnc1 ZINC000777232604 1137130330 /nfs/dbraw/zinc/13/03/30/1137130330.db2.gz VAWUCHNJSFLYMO-UHFFFAOYSA-N 1 0 349.412 3.541 20 5 EHBDRO Cc1c(F)nccc1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000862386279 1137141843 /nfs/dbraw/zinc/14/18/43/1137141843.db2.gz NWOGDGWHAHFELY-INIZCTEOSA-N 1 0 329.375 3.817 20 5 EHBDRO CC[C@@H](CCc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000863572001 1137192308 /nfs/dbraw/zinc/19/23/08/1137192308.db2.gz IIYLIVJEZJGWJE-HKUYNNGSSA-N 1 0 328.412 3.629 20 5 EHBDRO CC[C@](C)([NH2+]Cc1cc(C(=O)OC)ccc1[N+](=O)[O-])c1ccccc1 ZINC000844312867 1137208710 /nfs/dbraw/zinc/20/87/10/1137208710.db2.gz OMWJNZRYFCWKAS-IBGZPJMESA-N 1 0 342.395 3.796 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](O)c1ccccc1 ZINC000794615712 1137221077 /nfs/dbraw/zinc/22/10/77/1137221077.db2.gz YKNDHJGUHULSKO-ROUUACIJSA-N 1 0 332.375 3.582 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000120235012 1137245534 /nfs/dbraw/zinc/24/55/34/1137245534.db2.gz SKKHULZGXIPSKL-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000120469317 1137272055 /nfs/dbraw/zinc/27/20/55/1137272055.db2.gz SMWYEFKOTCRDRF-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(Cl)cc1N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000845492695 1137294758 /nfs/dbraw/zinc/29/47/58/1137294758.db2.gz WWGYRNKUZQIDOX-GFCCVEGCSA-N 1 0 341.814 3.842 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC[C@@]3(CC3(F)F)C2)c1 ZINC000846109300 1137333214 /nfs/dbraw/zinc/33/32/14/1137333214.db2.gz UMMAQHNLAIFJRI-CQSZACIVSA-N 1 0 348.296 3.817 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000866306986 1137343956 /nfs/dbraw/zinc/34/39/56/1137343956.db2.gz PSWXUMZMPCYTSE-XJKSGUPXSA-N 1 0 336.407 3.746 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000866367121 1137349837 /nfs/dbraw/zinc/34/98/37/1137349837.db2.gz GBSWSXCIAGZMMK-TVQRCGJNSA-N 1 0 335.206 3.838 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C1CCC(OC(F)F)CC1 ZINC000866370212 1137350201 /nfs/dbraw/zinc/35/02/01/1137350201.db2.gz TZUMVYCWJIKALL-GWMXKSKGSA-N 1 0 346.349 3.805 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](CC3(Br)CC3)C2)cc1 ZINC000846962413 1137379520 /nfs/dbraw/zinc/37/95/20/1137379520.db2.gz ZUVQQKSTCIJQSW-ZDUSSCGKSA-N 1 0 339.233 3.702 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1ccccc1Cl ZINC000773011003 1137459210 /nfs/dbraw/zinc/45/92/10/1137459210.db2.gz QQJVHGFYNSZALU-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO Cc1cccc(C)c1C[N@@H+](Cc1cn(C)nc1[N+](=O)[O-])CC(C)C ZINC001171456838 1137490294 /nfs/dbraw/zinc/49/02/94/1137490294.db2.gz IFMQZLMQUXORNW-UHFFFAOYSA-N 1 0 330.432 3.603 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872020793 1137565127 /nfs/dbraw/zinc/56/51/27/1137565127.db2.gz KKPINGGUGNTMOU-LSDHHAIUSA-N 1 0 343.402 3.911 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCC(C)(C)CO ZINC000872040278 1137567118 /nfs/dbraw/zinc/56/71/18/1137567118.db2.gz ZDCLUTCTUCOYQB-LBPRGKRZSA-N 1 0 326.462 3.766 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000872044046 1137567448 /nfs/dbraw/zinc/56/74/48/1137567448.db2.gz PUECNKNZWYUBFG-KSZJFAHPSA-N 1 0 336.457 3.925 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC)C(F)(F)F ZINC000872056871 1137568457 /nfs/dbraw/zinc/56/84/57/1137568457.db2.gz UXNOOXFUNQRORQ-PRHODGIISA-N 1 0 338.351 3.545 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+][C@H]3CCOC4(CCCC4)C3)c2c1 ZINC000872072565 1137569794 /nfs/dbraw/zinc/56/97/94/1137569794.db2.gz HHXWYGMVKYIFQP-HNNXBMFYSA-N 1 0 343.427 3.700 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)N(C)c1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000872129789 1137573075 /nfs/dbraw/zinc/57/30/75/1137573075.db2.gz TZLRSULDVHQSIH-LSDHHAIUSA-N 1 0 341.411 3.687 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000872132550 1137573224 /nfs/dbraw/zinc/57/32/24/1137573224.db2.gz IPLUKQGJPCMHKG-MRAWALMUSA-N 1 0 332.375 3.897 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nccnc1C ZINC000872133454 1137573461 /nfs/dbraw/zinc/57/34/61/1137573461.db2.gz MUJNYDNKMCBGII-KBPBESRZSA-N 1 0 346.456 3.915 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000872134414 1137573649 /nfs/dbraw/zinc/57/36/49/1137573649.db2.gz WBPWOYKQZUJVTH-SCTDSRPQSA-N 1 0 326.396 3.684 20 5 EHBDRO CCC(CC)(C[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000872226370 1137576053 /nfs/dbraw/zinc/57/60/53/1137576053.db2.gz IOURTAPEKRPVKU-CYBMUJFWSA-N 1 0 334.338 3.587 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H]2C[C@H](Sc3ccccc3)C2)c1 ZINC000872224851 1137576068 /nfs/dbraw/zinc/57/60/68/1137576068.db2.gz OMXSRHPGKIXPFN-WBAXXEDZSA-N 1 0 344.436 3.541 20 5 EHBDRO CSC1CCN(Cn2c3cc([N+](=O)[O-])ccc3oc2=S)CC1 ZINC000872626729 1137582043 /nfs/dbraw/zinc/58/20/43/1137582043.db2.gz MQCCRGUSZCMUBR-UHFFFAOYSA-N 1 0 339.442 3.657 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000873097789 1137590148 /nfs/dbraw/zinc/59/01/48/1137590148.db2.gz FZHGVGQKFVNBHC-BSEYFRJRSA-N 1 0 346.452 3.800 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCO[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000873108508 1137590349 /nfs/dbraw/zinc/59/03/49/1137590349.db2.gz YUCJKMHMXSZBDS-IEBWSBKVSA-N 1 0 326.396 3.913 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000124749060 1137608359 /nfs/dbraw/zinc/60/83/59/1137608359.db2.gz RROCBMYABDHJTK-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@@H]2[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876942072 1137665845 /nfs/dbraw/zinc/66/58/45/1137665845.db2.gz UHAINTUQHDFZTA-ZUEPYMLJSA-N 1 0 344.415 3.700 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(c3nc(C4CCC4)no3)CC2)cc1 ZINC000877736446 1137687341 /nfs/dbraw/zinc/68/73/41/1137687341.db2.gz ZSGXVBYOWJHQBI-UHFFFAOYSA-N 1 0 342.399 3.625 20 5 EHBDRO CC[C@H]1CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878045252 1137700593 /nfs/dbraw/zinc/70/05/93/1137700593.db2.gz HFMUOZCEGXIAIC-NSHDSACASA-N 1 0 336.779 3.673 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3[C@H](C)c2cccc([N+](=O)[O-])c2)no1 ZINC000879680689 1137755016 /nfs/dbraw/zinc/75/50/16/1137755016.db2.gz VZPJLUSFMLSQMH-GVZPALNKSA-N 1 0 342.399 3.758 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccc(C)c([N+](=O)[O-])c2)no1 ZINC000879684215 1137755133 /nfs/dbraw/zinc/75/51/33/1137755133.db2.gz UYNVGKXUXZZMBE-MQVJKMGUSA-N 1 0 342.399 3.505 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2nccs2)C1 ZINC000880316349 1137774721 /nfs/dbraw/zinc/77/47/21/1137774721.db2.gz DXOFQYBDETVKKM-CYBMUJFWSA-N 1 0 347.440 3.828 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@@H](c1ccc(F)cc1)C1CCOCC1 ZINC000883200699 1137848224 /nfs/dbraw/zinc/84/82/24/1137848224.db2.gz PHXYLWYPVKNNGG-IBGZPJMESA-N 1 0 344.386 3.991 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC(C)(C)C1 ZINC000112702266 1137909502 /nfs/dbraw/zinc/90/95/02/1137909502.db2.gz UPAWDMAJTXLQFP-GFCCVEGCSA-N 1 0 330.388 3.828 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000120324632 1137948667 /nfs/dbraw/zinc/94/86/67/1137948667.db2.gz FDNGOAAVGDLNBH-RDTXWAMCSA-N 1 0 344.411 3.686 20 5 EHBDRO COCC[C@@H]1CCC[C@H]1[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000282917917 1137955665 /nfs/dbraw/zinc/95/56/65/1137955665.db2.gz XSXUDWDXCVXYPH-SWLSCSKDSA-N 1 0 326.824 3.586 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000884716979 1137970821 /nfs/dbraw/zinc/97/08/21/1137970821.db2.gz ONLFMOMAAABXJV-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@@]2(CO[C@H](C)C2)O1)c1cccc([N+](=O)[O-])c1 ZINC000886761904 1138134022 /nfs/dbraw/zinc/13/40/22/1138134022.db2.gz MZYXBBVEIJDQEN-GRGSLBFTSA-N 1 0 348.443 3.752 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CC[C@@H]([C@@H]3CCCO3)C2)c1 ZINC000886818102 1138148749 /nfs/dbraw/zinc/14/87/49/1138148749.db2.gz ALHNLERLMDNSSR-ABAIWWIYSA-N 1 0 344.333 3.615 20 5 EHBDRO COCCOc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000123182040 1138267127 /nfs/dbraw/zinc/26/71/27/1138267127.db2.gz KCZABWNIMVDGFG-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO COCCOc1cc(C)ccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000125265766 1138304511 /nfs/dbraw/zinc/30/45/11/1138304511.db2.gz AZKGXGMHJBXANZ-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO C[C@@H]1C[C@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130655748 1138467386 /nfs/dbraw/zinc/46/73/86/1138467386.db2.gz LBYVWKSJWUEBNM-GDBMZVCRSA-N 1 0 343.427 3.769 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc([C@@H]2CCCO2)s1 ZINC000283026488 1138880070 /nfs/dbraw/zinc/88/00/70/1138880070.db2.gz MPWDMRZLMLBJGG-INIZCTEOSA-N 1 0 347.440 3.577 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000179135701 1139737691 /nfs/dbraw/zinc/73/76/91/1139737691.db2.gz QUZGOGAMNAHGMZ-SIIHOXLZSA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000179139902 1139738156 /nfs/dbraw/zinc/73/81/56/1139738156.db2.gz QSXLGQPTBGGAEI-JCKWVBRZSA-N 1 0 342.443 3.699 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000179135689 1139738288 /nfs/dbraw/zinc/73/82/88/1139738288.db2.gz QUZGOGAMNAHGMZ-JCKWVBRZSA-N 1 0 342.443 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)NC2CC[NH+](CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000179397957 1139753858 /nfs/dbraw/zinc/75/38/58/1139753858.db2.gz SHNKMKSFWUYOMM-HNNXBMFYSA-N 1 0 349.475 3.765 20 5 EHBDRO CC(C)Oc1cccc([C@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000179672464 1139773959 /nfs/dbraw/zinc/77/39/59/1139773959.db2.gz QBCDPPMJCBVRNE-IFXJQAMLSA-N 1 0 344.411 3.766 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCc2ccccn2)cc1[N+](=O)[O-] ZINC000181489982 1139910201 /nfs/dbraw/zinc/91/02/01/1139910201.db2.gz PGMVJHTVVZDCMT-AWEZNQCLSA-N 1 0 329.400 3.672 20 5 EHBDRO C[C@@H](C[N@H+](C)Cc1cc([N+](=O)[O-])ccc1Cl)c1nccs1 ZINC000183928838 1140066625 /nfs/dbraw/zinc/06/66/25/1140066625.db2.gz CXRAMNPHGDCVDV-JTQLQIEISA-N 1 0 325.821 3.940 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)c2nccs2)cc1[N+](=O)[O-] ZINC000186731976 1140219103 /nfs/dbraw/zinc/21/91/03/1140219103.db2.gz YGJRJHUWAACWGL-NEPJUHHUSA-N 1 0 335.429 3.904 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@@H](C)C1 ZINC000187991340 1140279671 /nfs/dbraw/zinc/27/96/71/1140279671.db2.gz LJGJAQVSCLQIHB-OLZOCXBDSA-N 1 0 330.388 3.828 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)N(C)CC[C@@H]1CCCC[N@@H+]1C ZINC000191358767 1140458341 /nfs/dbraw/zinc/45/83/41/1140458341.db2.gz QCTOHYTWOFEJFZ-HNNXBMFYSA-N 1 0 348.447 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000193623677 1140580703 /nfs/dbraw/zinc/58/07/03/1140580703.db2.gz SZKGFQNMFGWJEJ-ZDUSSCGKSA-N 1 0 333.369 3.902 20 5 EHBDRO COc1nc(C)cc(C)c1CN[C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000268834494 1141002639 /nfs/dbraw/zinc/00/26/39/1141002639.db2.gz LDGWJHVQWQLZBF-AWEZNQCLSA-N 1 0 329.400 3.774 20 5 EHBDRO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)[C@@H]1CCC[NH2+]C1 ZINC000269217093 1141080204 /nfs/dbraw/zinc/08/02/04/1141080204.db2.gz RADOEEXMFMZLDS-GDBMZVCRSA-N 1 0 333.435 3.506 20 5 EHBDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269635075 1141129427 /nfs/dbraw/zinc/12/94/27/1141129427.db2.gz AOPCBQVRUAMYFF-APPDUMDISA-N 1 0 336.338 3.599 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCc1c[nH]nc1C ZINC000271027958 1141296837 /nfs/dbraw/zinc/29/68/37/1141296837.db2.gz BJKSBBXBSKQNKE-OAHLLOKOSA-N 1 0 348.472 3.719 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CCCc1nccs1 ZINC000271480086 1141377636 /nfs/dbraw/zinc/37/76/36/1141377636.db2.gz KEZLKEXDVRXDME-HOCLYGCPSA-N 1 0 345.468 3.985 20 5 EHBDRO CC(C)[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@H]1CCOC1 ZINC000339207634 1141528454 /nfs/dbraw/zinc/52/84/54/1141528454.db2.gz ZHQUANIWCLWRAI-ZDUSSCGKSA-N 1 0 332.322 3.613 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCC2(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000349037209 1141626285 /nfs/dbraw/zinc/62/62/85/1141626285.db2.gz RBPZUPRDUISFJB-AWEZNQCLSA-N 1 0 344.358 3.526 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccccc2CNc2ncccc2[N+](=O)[O-])C1 ZINC000071954824 215979899 /nfs/dbraw/zinc/97/98/99/215979899.db2.gz LAUVKELLUGVSFX-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO COC(=O)[C@H]1CC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)[C@H]1C(C)C ZINC000430148980 1014426764 /nfs/dbraw/zinc/42/67/64/1014426764.db2.gz MEZXAAMPYOXFNE-WYTCUBLDSA-N 1 0 346.427 3.518 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN1CCSC[C@@H]1c1ccccc1 ZINC000430201944 1014887062 /nfs/dbraw/zinc/88/70/62/1014887062.db2.gz BTJQNJKVXDIRMB-QGZVFWFLSA-N 1 0 344.436 3.894 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCOc2ncc(Cl)cc2Cl)cs1 ZINC000134475821 1015557711 /nfs/dbraw/zinc/55/77/11/1015557711.db2.gz DZMIOTYGDBUGSW-UHFFFAOYSA-N 1 0 348.211 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3C[C@@H]4CCC[NH2+][C@@H]4C3)s2)cc1 ZINC000536678052 1032119569 /nfs/dbraw/zinc/11/95/69/1032119569.db2.gz UULLYYKQRIMCHN-WMLDXEAASA-N 1 0 343.452 3.507 20 5 EHBDRO C[C@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)[C@H]1C ZINC000246920383 1016049333 /nfs/dbraw/zinc/04/93/33/1016049333.db2.gz QAQHGOUQEAQKCA-KBPBESRZSA-N 1 0 329.400 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@H]4CCCC[C@@H]43)n2)cc1 ZINC000103266258 1016817596 /nfs/dbraw/zinc/81/75/96/1016817596.db2.gz MMCVKFGFNRHEQZ-CJNGLKHVSA-N 1 0 342.399 3.799 20 5 EHBDRO CCOc1cc(NC[C@H](c2cccs2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000080763405 1032194788 /nfs/dbraw/zinc/19/47/88/1032194788.db2.gz VXCNBTKGPBZUBJ-CQSZACIVSA-N 1 0 335.429 3.770 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000536838866 1032332234 /nfs/dbraw/zinc/33/22/34/1032332234.db2.gz LJCSEWKRVJAMCH-KXBFYZLASA-N 1 0 339.439 3.692 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000449478757 1032601929 /nfs/dbraw/zinc/60/19/29/1032601929.db2.gz KYZUVZMXIAMZGX-OBHPCNEJSA-N 1 0 330.428 3.937 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2[C@H]3CCO[C@@H]3C23CCCC3)cc1 ZINC000537307751 1032612914 /nfs/dbraw/zinc/61/29/14/1032612914.db2.gz QTDCFDCAGRSBST-QRVBRYPASA-N 1 0 344.455 3.855 20 5 EHBDRO C[C@H]1CCC[N@@H+]1Cc1cccc(-c2cc(CO)cc([N+](=O)[O-])c2)c1 ZINC000592984885 1032655062 /nfs/dbraw/zinc/65/50/62/1032655062.db2.gz BSOGBTWICDSVKL-AWEZNQCLSA-N 1 0 326.396 3.738 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cccc4c[nH]nc43)C2)cc1 ZINC000449495748 1032662587 /nfs/dbraw/zinc/66/25/87/1032662587.db2.gz DXYNWIPEKQZGQT-INIZCTEOSA-N 1 0 336.395 3.851 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@@H](C)[C@@H](C)c1ccccc1 ZINC000181533291 1017119322 /nfs/dbraw/zinc/11/93/22/1017119322.db2.gz BOHNFPCEUCZYCK-CABCVRRESA-N 1 0 341.411 3.624 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]([C@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000449505099 1032689329 /nfs/dbraw/zinc/68/93/29/1032689329.db2.gz JSIUNAXSRPMTGO-MJGOQNOKSA-N 1 0 332.444 3.605 20 5 EHBDRO Cc1cc(N2CC[C@@H](OCC(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302081971 1017481711 /nfs/dbraw/zinc/48/17/11/1017481711.db2.gz LVHJRYWNMWBDJB-OAHLLOKOSA-N 1 0 329.400 3.703 20 5 EHBDRO COc1cc(N2CCC[C@H](C[N@@H+]3CCCC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000302081757 1017705205 /nfs/dbraw/zinc/70/52/05/1017705205.db2.gz YATLHLGMSTZHQX-HZPDHXFCSA-N 1 0 347.459 3.694 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2(c3ccc4c(c3)OCO4)CC2)cc1[N+](=O)[O-] ZINC000537449324 1032737086 /nfs/dbraw/zinc/73/70/86/1032737086.db2.gz YBINANMRAQUDPK-ZDUSSCGKSA-N 1 0 340.379 3.972 20 5 EHBDRO C[C@@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316592 1018159453 /nfs/dbraw/zinc/15/94/53/1018159453.db2.gz CQFSGVYEVSFNEH-PBHICJAKSA-N 1 0 343.427 3.627 20 5 EHBDRO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCCCC2)C1 ZINC001167341524 1018313317 /nfs/dbraw/zinc/31/33/17/1018313317.db2.gz KHIJRYIDPYTKLL-HNNXBMFYSA-N 1 0 345.443 3.968 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610345669 1018360412 /nfs/dbraw/zinc/36/04/12/1018360412.db2.gz YGLVEXOWMUJLCN-GXTWGEPZSA-N 1 0 349.456 3.605 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000101595377 1018374832 /nfs/dbraw/zinc/37/48/32/1018374832.db2.gz XXPYTQGJBHDHNL-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NC[C@H]2CCC[C@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000415689172 1018399300 /nfs/dbraw/zinc/39/93/00/1018399300.db2.gz CQTOIBLONXCGCX-STQMWFEESA-N 1 0 348.447 3.531 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H](c2ccccc2)[NH+]2CCCC2)c(F)c1 ZINC000513087554 1018938560 /nfs/dbraw/zinc/93/85/60/1018938560.db2.gz FJCYQRQOXTWGFF-GOSISDBHSA-N 1 0 329.375 3.983 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000610420561 1019024638 /nfs/dbraw/zinc/02/46/38/1019024638.db2.gz RZCJLPGKCDXRCC-IUODEOHRSA-N 1 0 347.365 3.803 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCOc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000293664186 1019686165 /nfs/dbraw/zinc/68/61/65/1019686165.db2.gz JJRBQMWDDBNEAZ-BLLLJJGKSA-N 1 0 327.384 3.742 20 5 EHBDRO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCCO1 ZINC000594040396 1032860368 /nfs/dbraw/zinc/86/03/68/1032860368.db2.gz FLAVSUSGIZRYLN-IAGOWNOFSA-N 1 0 345.399 3.687 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@]3(C2)CCc2ccccc2O3)cc1[N+](=O)[O-] ZINC000581103328 1020433071 /nfs/dbraw/zinc/43/30/71/1020433071.db2.gz OJSMVNKARAUKBC-FQEVSTJZSA-N 1 0 338.407 3.873 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCO1 ZINC000602470972 1032905735 /nfs/dbraw/zinc/90/57/35/1032905735.db2.gz AGXRAOGXEAIXHZ-UHFFFAOYSA-N 1 0 332.322 3.615 20 5 EHBDRO C[NH+]1CCC(CCN[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000581255616 1020595467 /nfs/dbraw/zinc/59/54/67/1020595467.db2.gz KOQGFXHNXIEZEF-OAHLLOKOSA-N 1 0 345.365 3.520 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602495022 1032921231 /nfs/dbraw/zinc/92/12/31/1032921231.db2.gz AAXGUPHKHSIEBQ-UHFFFAOYSA-N 1 0 340.383 3.718 20 5 EHBDRO Cc1ccc(CN(C)[C@H]2CC[N@H+](Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000506495389 1021178779 /nfs/dbraw/zinc/17/87/79/1021178779.db2.gz LJEWIPBXNMKGSW-IBGZPJMESA-N 1 0 339.439 3.610 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2nnc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000426302949 1021222989 /nfs/dbraw/zinc/22/29/89/1021222989.db2.gz VIPCZSWALZHWOW-GFCCVEGCSA-N 1 0 334.445 3.771 20 5 EHBDRO CC[C@@](C)(O)C[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])cc1F ZINC000439256662 1021301060 /nfs/dbraw/zinc/30/10/60/1021301060.db2.gz HUYSAMRJZWCPLI-LJQANCHMSA-N 1 0 346.402 3.897 20 5 EHBDRO COc1cc(C[NH2+]C2CCC2)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000337338644 1021400434 /nfs/dbraw/zinc/40/04/34/1021400434.db2.gz NYJJHGLXLJNELP-UHFFFAOYSA-N 1 0 342.395 3.825 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])CCc1cccs1 ZINC000337337836 1021400559 /nfs/dbraw/zinc/40/05/59/1021400559.db2.gz PIQHSMLMBHRQRW-UHFFFAOYSA-N 1 0 347.440 3.550 20 5 EHBDRO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2Cc2cn(C)nc2[N+](=O)[O-])cc1 ZINC001167477786 1021459769 /nfs/dbraw/zinc/45/97/69/1021459769.db2.gz HVEYZHABZJGNCI-RHSMWYFYSA-N 1 0 328.416 3.610 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@H]3C[C@@H]3C3CCCCC3)CC2)cn1 ZINC000602590535 1032989281 /nfs/dbraw/zinc/98/92/81/1032989281.db2.gz VXEJFQUPNHIYIA-MSOLQXFVSA-N 1 0 344.459 3.517 20 5 EHBDRO COc1cc(C[N@@H+]2CC(C)(C)[C@@H]3CCC[C@@H]32)c([N+](=O)[O-])cc1OC ZINC000516670756 1021639475 /nfs/dbraw/zinc/63/94/75/1021639475.db2.gz RHBUNVPQVBMEIP-KGLIPLIRSA-N 1 0 334.416 3.623 20 5 EHBDRO C[N@@H+]1C[C@@H]2CCN(C(=O)c3cccc4cc5ccccc5cc43)[C@@H]2C1 ZINC001270531374 1021711713 /nfs/dbraw/zinc/71/17/13/1021711713.db2.gz JPEKYZMIJUYQLY-GHTZIAJQSA-N 1 0 330.431 3.769 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610538845 1021807649 /nfs/dbraw/zinc/80/76/49/1021807649.db2.gz VGXZBDQGBPPRER-SWLSCSKDSA-N 1 0 347.365 3.803 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCN(c2ccc(F)cc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000610538846 1021808137 /nfs/dbraw/zinc/80/81/37/1021808137.db2.gz VGXZBDQGBPPRER-WFASDCNBSA-N 1 0 347.365 3.803 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000517029115 1021957359 /nfs/dbraw/zinc/95/73/59/1021957359.db2.gz VNHCWVMZMBKYAI-NWDGAFQWSA-N 1 0 332.322 3.814 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3c(c2)CCO3)cc1[N+](=O)[O-] ZINC000178233262 1022245873 /nfs/dbraw/zinc/24/58/73/1022245873.db2.gz CFCBXOVQBPBJSD-AWEZNQCLSA-N 1 0 326.396 3.731 20 5 EHBDRO O=c1ccc2c([nH]1)CCC[C@@H]2[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000894449756 1022288075 /nfs/dbraw/zinc/28/80/75/1022288075.db2.gz PIZOFESKNDMEST-ZDUSSCGKSA-N 1 0 333.775 3.516 20 5 EHBDRO CCC[C@@H](NC1CC[NH+](CC2CC2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178255762 1022325231 /nfs/dbraw/zinc/32/52/31/1022325231.db2.gz QRIDFRMGAQRENN-LJQANCHMSA-N 1 0 331.460 3.900 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000156517302 1022496580 /nfs/dbraw/zinc/49/65/80/1022496580.db2.gz JNFJUGDBOSLXOX-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO C[C@H](CCC(F)(F)F)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000517618937 1022505655 /nfs/dbraw/zinc/50/56/55/1022505655.db2.gz CYRWJCSVTRWDPK-SNVBAGLBSA-N 1 0 329.322 3.939 20 5 EHBDRO C[C@H]1[C@H](CO)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000425989790 1022590686 /nfs/dbraw/zinc/59/06/86/1022590686.db2.gz UPMAWLYMMKCBOQ-JSGCOSHPSA-N 1 0 332.425 3.526 20 5 EHBDRO CC1(C)C[C@@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602686747 1033069987 /nfs/dbraw/zinc/06/99/87/1033069987.db2.gz HKQIGRADNKSLKA-NSHDSACASA-N 1 0 346.349 3.908 20 5 EHBDRO CC1=C(C)C[N@H+]([C@@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000280781526 1022707663 /nfs/dbraw/zinc/70/76/63/1022707663.db2.gz QCUGQSBAXMESCM-ZDUSSCGKSA-N 1 0 328.372 3.748 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000426073206 1022837626 /nfs/dbraw/zinc/83/76/26/1022837626.db2.gz AEEUILXDJRGTRN-AWEZNQCLSA-N 1 0 346.814 3.904 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@]1([NH+](C)C)CCC[C@@H](C)C1 ZINC000509572844 1023070494 /nfs/dbraw/zinc/07/04/94/1023070494.db2.gz RTKPSLLWLUBUHV-BEFAXECRSA-N 1 0 349.475 3.594 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)ccc1[N+](=O)[O-] ZINC000276828305 1023084683 /nfs/dbraw/zinc/08/46/83/1023084683.db2.gz ANNUHGPSIKTHBJ-GFCCVEGCSA-N 1 0 345.355 3.753 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCCC[C@@H]2/C=C\c2ccccc2)c1 ZINC000438563098 1023125460 /nfs/dbraw/zinc/12/54/60/1023125460.db2.gz SAFXHYSZZXACHI-RXQFDZFGSA-N 1 0 340.427 3.749 20 5 EHBDRO CCC1(C)CC[NH+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)CC1 ZINC000507197593 1023175545 /nfs/dbraw/zinc/17/55/45/1023175545.db2.gz RGDZDYHFLROIDE-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2csc3ccccc23)cc1 ZINC000518302376 1023206911 /nfs/dbraw/zinc/20/69/11/1023206911.db2.gz BIXMYEKPHQTKTA-UHFFFAOYSA-N 1 0 328.393 3.978 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2CCCC23CC3)cc1Br ZINC000602727570 1033114345 /nfs/dbraw/zinc/11/43/45/1033114345.db2.gz CXGBFVXPAGRRDW-SNVBAGLBSA-N 1 0 331.235 3.841 20 5 EHBDRO CCC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000548488235 1023502723 /nfs/dbraw/zinc/50/27/23/1023502723.db2.gz QDMBNENUXHYSIK-CABCVRRESA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1csc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)n1 ZINC000610799039 1023688366 /nfs/dbraw/zinc/68/83/66/1023688366.db2.gz VCBPBXWAMLFQKJ-HNNXBMFYSA-N 1 0 331.441 3.513 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+]1CCC[C@@H]1c1ccccc1Cl ZINC000602768223 1033163736 /nfs/dbraw/zinc/16/37/36/1033163736.db2.gz YCFYFOJAHQNBSX-OAHLLOKOSA-N 1 0 334.807 3.590 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@@H]2c2cccc3ccccc32)n1 ZINC000176217130 1023882973 /nfs/dbraw/zinc/88/29/73/1023882973.db2.gz XXRBMIMTBRMPFU-GOSISDBHSA-N 1 0 336.395 3.782 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(c3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000277159444 1023895004 /nfs/dbraw/zinc/89/50/04/1023895004.db2.gz KBGHOXDQOLHTAC-UHFFFAOYSA-N 1 0 341.411 3.768 20 5 EHBDRO CC(C)Cc1ccc([C@@H]([NH2+]Cc2cn(C)nc2[N+](=O)[O-])C2CC2)cc1 ZINC000602803533 1033175172 /nfs/dbraw/zinc/17/51/72/1033175172.db2.gz CNPYDJONOMFQGS-GOSISDBHSA-N 1 0 342.443 3.768 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH+]1CCC(c2ccncn2)CC1 ZINC000414473820 1024127287 /nfs/dbraw/zinc/12/72/87/1024127287.db2.gz WJACBSLIIBQEOG-RVDMUPIBSA-N 1 0 338.411 3.668 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C)C[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000443641875 1024302814 /nfs/dbraw/zinc/30/28/14/1024302814.db2.gz MRWWXEVIYQOYGL-KGLIPLIRSA-N 1 0 333.432 3.600 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccco1 ZINC000574822460 1024372069 /nfs/dbraw/zinc/37/20/69/1024372069.db2.gz HXLNCAWDZTWNGQ-WMZOPIPTSA-N 1 0 343.427 3.848 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])cc1C)c1ccccc1 ZINC000110039899 1024414757 /nfs/dbraw/zinc/41/47/57/1024414757.db2.gz KENCLFPOBWUGIG-QGZVFWFLSA-N 1 0 328.416 3.793 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H](CO)CC1CCCC1 ZINC000511010839 1024433269 /nfs/dbraw/zinc/43/32/69/1024433269.db2.gz KJIDANJTZLISEW-YTQUADARSA-N 1 0 346.471 3.837 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCOC[C@@H](C3CCC3)C2)cc1[N+](=O)[O-] ZINC000430131413 1024662851 /nfs/dbraw/zinc/66/28/51/1024662851.db2.gz LVYZMJDPWZVBKU-KRWDZBQOSA-N 1 0 332.444 3.967 20 5 EHBDRO CCSCc1cccnc1NCc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000895688793 1024721187 /nfs/dbraw/zinc/72/11/87/1024721187.db2.gz LMSDTAAZXMHFNA-UHFFFAOYSA-N 1 0 344.396 3.996 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000346404119 1024723369 /nfs/dbraw/zinc/72/33/69/1024723369.db2.gz PYLOXXMDCYNEQN-ZDUSSCGKSA-N 1 0 338.795 3.731 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@@H](CCCO)C2)s1 ZINC000449793071 1033237116 /nfs/dbraw/zinc/23/71/16/1033237116.db2.gz VPWVPXFNZVQOJH-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@H]([C@H]2CCCO2)C1 ZINC000895844051 1024891772 /nfs/dbraw/zinc/89/17/72/1024891772.db2.gz LOBOKPPTPOVYLV-SWLSCSKDSA-N 1 0 344.333 3.615 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)cc1 ZINC000602889921 1033243602 /nfs/dbraw/zinc/24/36/02/1033243602.db2.gz XAMPVCFOVPVQEF-INIZCTEOSA-N 1 0 334.379 3.528 20 5 EHBDRO CC[C@H]([NH2+]CCCc1nc(C(C)C)no1)c1cccc([N+](=O)[O-])c1 ZINC000178516337 1024907781 /nfs/dbraw/zinc/90/77/81/1024907781.db2.gz LKPDDQINLOJZFS-HNNXBMFYSA-N 1 0 332.404 3.775 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+]1CCC[C@@H]1CC(C)(C)C ZINC000435441720 1024928476 /nfs/dbraw/zinc/92/84/76/1024928476.db2.gz HJIQQKIJLYRHQZ-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO COCC1C[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000895971103 1025027411 /nfs/dbraw/zinc/02/74/11/1025027411.db2.gz KZTQAVNMUXJUOO-UHFFFAOYSA-N 1 0 336.775 3.586 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(CO)CCCC2)s1 ZINC000472139090 1025049770 /nfs/dbraw/zinc/04/97/70/1025049770.db2.gz WINVJWHCWDCSAD-UHFFFAOYSA-N 1 0 346.452 3.966 20 5 EHBDRO Cc1ccc(CNC[C@@H]2CCC[N@@H+]2C2CCCCC2)cc1[N+](=O)[O-] ZINC000435750527 1025111496 /nfs/dbraw/zinc/11/14/96/1025111496.db2.gz YGDOFEJPIDZJTG-SFHVURJKSA-N 1 0 331.460 3.790 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2C[C@H]3CCC[C@H]32)cc1Br ZINC000897958704 1033259591 /nfs/dbraw/zinc/25/95/91/1033259591.db2.gz MHSGWLQUHKNQQL-BCMRRPTOSA-N 1 0 331.235 3.697 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1Cc2ccccc2N(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435994652 1025280320 /nfs/dbraw/zinc/28/03/20/1025280320.db2.gz OTUUPMSRXARGMS-LSDHHAIUSA-N 1 0 325.412 3.554 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000515506208 1025317145 /nfs/dbraw/zinc/31/71/45/1025317145.db2.gz OZMQLTRNPRBWEU-AWEZNQCLSA-N 1 0 341.411 3.707 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@@H](c1ccccc1Cl)[NH+]1CCCC1 ZINC000024154237 1025328366 /nfs/dbraw/zinc/32/83/66/1025328366.db2.gz WIASUZMDGWNEHB-INIZCTEOSA-N 1 0 346.818 3.892 20 5 EHBDRO COC(=O)[C@H](CC[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000425461757 1025367476 /nfs/dbraw/zinc/36/74/76/1025367476.db2.gz SJOQELMWSYLMHX-WMLDXEAASA-N 1 0 342.395 3.592 20 5 EHBDRO Cc1cc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ncc1[N+](=O)[O-] ZINC000381433137 1025461271 /nfs/dbraw/zinc/46/12/71/1025461271.db2.gz IARGFXJEXFMPGI-DOTOQJQBSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@H]1CCC[C@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467893 1025466014 /nfs/dbraw/zinc/46/60/14/1025466014.db2.gz OHVOOXVKXRUJFQ-RYUDHWBXSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000026467880 1025466557 /nfs/dbraw/zinc/46/65/57/1025466557.db2.gz OHVOOXVKXRUJFQ-NWDGAFQWSA-N 1 0 339.823 3.697 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cc3c(cccc3F)[nH]2)cc1[N+](=O)[O-] ZINC000436239485 1025486776 /nfs/dbraw/zinc/48/67/76/1025486776.db2.gz GOCBXSJKEHPYLP-UHFFFAOYSA-N 1 0 329.331 3.514 20 5 EHBDRO C[C@@H](CNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC000436307286 1025573108 /nfs/dbraw/zinc/57/31/08/1025573108.db2.gz KIUPCLDMCZQHHO-QWRGUYRKSA-N 1 0 346.353 3.541 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)C1CCC(F)(F)CC1 ZINC000474038892 1025613320 /nfs/dbraw/zinc/61/33/20/1025613320.db2.gz RVNMTRMGTHXZQB-LLVKDONJSA-N 1 0 328.359 3.907 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347200892 1025641664 /nfs/dbraw/zinc/64/16/64/1025641664.db2.gz OGEPLPOIFJVRNC-CXAGYDPISA-N 1 0 327.384 3.582 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000474865732 1025717643 /nfs/dbraw/zinc/71/76/43/1025717643.db2.gz BAPKEVDHLXDMGE-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@@H](Nc2nc3ccccc3cc2[N+](=O)[O-])C1 ZINC000530384531 1025761271 /nfs/dbraw/zinc/76/12/71/1025761271.db2.gz NFUQYYUCZHKKKE-KRWDZBQOSA-N 1 0 334.379 3.742 20 5 EHBDRO C[C@@H](CNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[NH+]1CCCC1 ZINC000321384547 1025764294 /nfs/dbraw/zinc/76/42/94/1025764294.db2.gz NUAWVVOJGCGQRV-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](C/C=C/c1ccc(Cl)cc1)CC2 ZINC000469766725 1025789524 /nfs/dbraw/zinc/78/95/24/1025789524.db2.gz DYUNMKUXYHCTLB-OWOJBTEDSA-N 1 0 329.787 3.715 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCC[C@H]2c2ccc(Cl)cc2)n1 ZINC000451740298 1026255294 /nfs/dbraw/zinc/25/52/94/1026255294.db2.gz ZWGJAMMQEIBOSY-HNNXBMFYSA-N 1 0 334.807 3.672 20 5 EHBDRO CC(C)[C@@H](C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1)c1ccccc1 ZINC000475211809 1026390197 /nfs/dbraw/zinc/39/01/97/1026390197.db2.gz BFECLBHZJIWITH-GOSISDBHSA-N 1 0 342.443 3.868 20 5 EHBDRO C[NH+]1CCC2(CCN2c2c(Cl)cc([N+](=O)[O-])cc2Cl)CC1 ZINC000897132446 1026397185 /nfs/dbraw/zinc/39/71/85/1026397185.db2.gz POQBKVLBBDTOTD-UHFFFAOYSA-N 1 0 330.215 3.576 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccc(-n2cccn2)c(F)c1 ZINC000339427165 1026561182 /nfs/dbraw/zinc/56/11/82/1026561182.db2.gz FCXGMRJPZBQOOL-ZDUSSCGKSA-N 1 0 340.358 3.770 20 5 EHBDRO COc1cc(C[NH2+]C[C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])cc1OC ZINC000282002703 1026665464 /nfs/dbraw/zinc/66/54/64/1026665464.db2.gz MEOJPMISRMNMQB-LLVKDONJSA-N 1 0 344.358 3.527 20 5 EHBDRO COc1ncccc1CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000562090688 1026704950 /nfs/dbraw/zinc/70/49/50/1026704950.db2.gz BYPNNXNDRQSFDC-QGZVFWFLSA-N 1 0 341.411 3.553 20 5 EHBDRO CO[C@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000531240424 1026717059 /nfs/dbraw/zinc/71/70/59/1026717059.db2.gz RIFZLHGNHHFWFW-GJZGRUSLSA-N 1 0 347.440 3.621 20 5 EHBDRO C[N@H+](Cc1ccccc1[N+](=O)[O-])[C@H]1CCCN(c2ccccc2)C1 ZINC000531378700 1026848921 /nfs/dbraw/zinc/84/89/21/1026848921.db2.gz WWKMICAQNCWYCF-SFHVURJKSA-N 1 0 325.412 3.696 20 5 EHBDRO Cc1cc(F)ccc1[C@H](O)C[N@H+](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000135220196 1027041676 /nfs/dbraw/zinc/04/16/76/1027041676.db2.gz XOJBCGYXCVBRGI-LJQANCHMSA-N 1 0 344.386 3.740 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ncc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000413210527 1027283604 /nfs/dbraw/zinc/28/36/04/1027283604.db2.gz VSNZNISDCIJIHD-UHFFFAOYSA-N 1 0 346.353 3.541 20 5 EHBDRO COc1ccc(CNc2ccc(C[NH+](C)C)c(Cl)c2)cc1[N+](=O)[O-] ZINC000475557710 1027599049 /nfs/dbraw/zinc/59/90/49/1027599049.db2.gz BGOYFFPESRNZKA-UHFFFAOYSA-N 1 0 349.818 3.931 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@@H+](C(C)C)C1CCCCC1 ZINC000533371159 1027762950 /nfs/dbraw/zinc/76/29/50/1027762950.db2.gz MMRFARDBEGVXOB-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]([C@@H]3CCCc4ccccc43)C2)nc1 ZINC000440486074 1028065662 /nfs/dbraw/zinc/06/56/62/1028065662.db2.gz JBFKATVZRJARLJ-CRAIPNDOSA-N 1 0 338.411 3.554 20 5 EHBDRO Cc1cnc(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)c([N+](=O)[O-])c1 ZINC000078668100 1028067330 /nfs/dbraw/zinc/06/73/30/1028067330.db2.gz NRPXYXQGNBOLEV-CJNGLKHVSA-N 1 0 346.456 3.855 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612419784 1028078859 /nfs/dbraw/zinc/07/88/59/1028078859.db2.gz REYWNMPBCVUWDN-GUYCJALGSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@H]1CCCOC1 ZINC000503942117 1028247563 /nfs/dbraw/zinc/24/75/63/1028247563.db2.gz BOCVFLXNXOBZMN-UKRRQHHQSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CCCC[C@H]2OC(F)F)ccc1[N+](=O)[O-] ZINC000502482937 1028256726 /nfs/dbraw/zinc/25/67/26/1028256726.db2.gz GQVMSKHEHLARAR-TZMCWYRMSA-N 1 0 344.358 3.634 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H]1CC12CCSCC2 ZINC000421354188 1028296859 /nfs/dbraw/zinc/29/68/59/1028296859.db2.gz QZLVBIMWZIJZFT-CQSZACIVSA-N 1 0 336.457 3.616 20 5 EHBDRO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000421371231 1028328049 /nfs/dbraw/zinc/32/80/49/1028328049.db2.gz JHSQDIZYAWLMCW-CHWSQXEVSA-N 1 0 332.425 3.669 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCc3cccnc3CC2)cc1 ZINC000421841284 1028863254 /nfs/dbraw/zinc/86/32/54/1028863254.db2.gz INAIGAUBSRNURU-SFHVURJKSA-N 1 0 339.439 3.850 20 5 EHBDRO CCC[C@@H]([NH2+][C@H](C)C1(OC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000421877143 1028877794 /nfs/dbraw/zinc/87/77/94/1028877794.db2.gz LIOWBPMKMZCMMF-RHSMWYFYSA-N 1 0 336.432 3.610 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)c1ccccc1 ZINC000504894243 1029039299 /nfs/dbraw/zinc/03/92/99/1029039299.db2.gz KTBSIYZADHUFGO-CVEARBPZSA-N 1 0 346.452 3.789 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)N2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504912012 1029055364 /nfs/dbraw/zinc/05/53/64/1029055364.db2.gz OVGQBILFCUNYPI-JYJNAYRXSA-N 1 0 349.475 3.907 20 5 EHBDRO CC[C@@H]1CCC[N@H+](CCC(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000532976402 1029133481 /nfs/dbraw/zinc/13/34/81/1029133481.db2.gz IAZIZMINETVYKS-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533066366 1029236230 /nfs/dbraw/zinc/23/62/30/1029236230.db2.gz WSJVREGQZGKCNL-CXAGYDPISA-N 1 0 334.416 3.862 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@H]1CCCC[C@H]1O ZINC000897534341 1029397236 /nfs/dbraw/zinc/39/72/36/1029397236.db2.gz SQNFJVFQADDSTP-IAQYHMDHSA-N 1 0 346.349 3.644 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cn1 ZINC000513829354 1029525941 /nfs/dbraw/zinc/52/59/41/1029525941.db2.gz ARXPWZJOOOGCDH-DYVFJYSZSA-N 1 0 329.375 3.630 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513829990 1029528707 /nfs/dbraw/zinc/52/87/07/1029528707.db2.gz NPNCCIPNULMQMY-ZBFHGGJFSA-N 1 0 348.443 3.627 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CCN(Cc1ccc(OC(F)F)cc1)C2 ZINC000536001494 1029687676 /nfs/dbraw/zinc/68/76/76/1029687676.db2.gz CYHKJAVXZVTLEL-UHFFFAOYSA-N 1 0 334.322 3.755 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000152234976 1029802941 /nfs/dbraw/zinc/80/29/41/1029802941.db2.gz LVBXDOKODQBNNV-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO Cc1ccccc1C1CC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000446832522 1029816077 /nfs/dbraw/zinc/81/60/77/1029816077.db2.gz BVJWYELILKGHTO-UHFFFAOYSA-N 1 0 336.395 3.815 20 5 EHBDRO CCc1ccc(C[N@H+](C)CCOc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC000441181226 1029877073 /nfs/dbraw/zinc/87/70/73/1029877073.db2.gz HSBGSURREPSOGN-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1ccc(C(C)=O)cc1[N+](=O)[O-])c1ccco1 ZINC000343248210 1029883446 /nfs/dbraw/zinc/88/34/46/1029883446.db2.gz IVWJELPYHMRMLP-BLLLJJGKSA-N 1 0 345.399 3.932 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756599 1029905365 /nfs/dbraw/zinc/90/53/65/1029905365.db2.gz NBDYRMSMXFYLAL-HOCLYGCPSA-N 1 0 326.824 3.932 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H](c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453247601 1029975783 /nfs/dbraw/zinc/97/57/83/1029975783.db2.gz NZZISIABLYCWSY-CWRNSKLLSA-N 1 0 328.416 3.705 20 5 EHBDRO CC(C)[C@@H](CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525695928 1030027781 /nfs/dbraw/zinc/02/77/81/1030027781.db2.gz PCUZAWPTYZEASQ-OAHLLOKOSA-N 1 0 334.441 3.820 20 5 EHBDRO COc1ccc(C[NH+](C)C)cc1NCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000892341642 1030045166 /nfs/dbraw/zinc/04/51/66/1030045166.db2.gz YODZGNXUAIXKBZ-UHFFFAOYSA-N 1 0 349.818 3.931 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnccc1C ZINC000453330199 1030064583 /nfs/dbraw/zinc/06/45/83/1030064583.db2.gz SAMHSPMQUQPGSG-OAHLLOKOSA-N 1 0 331.441 3.959 20 5 EHBDRO C[C@H](CC(C)(C)O)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325781 1030109344 /nfs/dbraw/zinc/10/93/44/1030109344.db2.gz RQJFXFMWAADXJG-KDOFPFPSSA-N 1 0 328.412 3.823 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1OC ZINC000531955240 1030130795 /nfs/dbraw/zinc/13/07/95/1030130795.db2.gz LIKLAWMPCYOROW-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@@H+](C)[C@@H](C)C1CCCCC1 ZINC000447388357 1030156712 /nfs/dbraw/zinc/15/67/12/1030156712.db2.gz WNGOFNNJTIINHJ-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000482132817 1030218173 /nfs/dbraw/zinc/21/81/73/1030218173.db2.gz IIKHYZUXQTUNQN-CQSZACIVSA-N 1 0 326.396 3.986 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)N1CCCC1 ZINC000583604381 1030266055 /nfs/dbraw/zinc/26/60/55/1030266055.db2.gz MWXQUWDIQZVKFA-RTBURBONSA-N 1 0 331.460 3.682 20 5 EHBDRO CC(C)CC[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532013893 1030273598 /nfs/dbraw/zinc/27/35/98/1030273598.db2.gz ZEALOROLMXXQAH-MRXNPFEDSA-N 1 0 334.416 3.862 20 5 EHBDRO CCc1ccc(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447539783 1030273780 /nfs/dbraw/zinc/27/37/80/1030273780.db2.gz HKRXPMXYBWFWJM-MSOLQXFVSA-N 1 0 342.443 3.670 20 5 EHBDRO CCc1ccc(CC[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447539786 1030273794 /nfs/dbraw/zinc/27/37/94/1030273794.db2.gz HKRXPMXYBWFWJM-ROUUACIJSA-N 1 0 342.443 3.670 20 5 EHBDRO Cc1nc2ccccc2n1CCC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000159591171 1030276918 /nfs/dbraw/zinc/27/69/18/1030276918.db2.gz RJKJTAGHIPQMOM-AWEZNQCLSA-N 1 0 338.411 3.994 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2ccc(Cl)s2)n1 ZINC000447544707 1030277609 /nfs/dbraw/zinc/27/76/09/1030277609.db2.gz OXMQKYGMPLEIJT-VXGBXAGGSA-N 1 0 340.836 3.780 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)c(C)c1 ZINC000447545108 1030281100 /nfs/dbraw/zinc/28/11/00/1030281100.db2.gz XCOUAKWQQFUJQN-SJORKVTESA-N 1 0 328.416 3.682 20 5 EHBDRO Cc1ccsc1[C@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447583752 1030315474 /nfs/dbraw/zinc/31/54/74/1030315474.db2.gz CAXKLVPLOLAQHJ-CVEARBPZSA-N 1 0 332.425 3.665 20 5 EHBDRO C[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)C[NH+]1CCCCC1 ZINC000052488786 1030364037 /nfs/dbraw/zinc/36/40/37/1030364037.db2.gz BYGSAOHHMCLMBT-AWEZNQCLSA-N 1 0 328.416 3.677 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnn(CC(F)(F)F)c1 ZINC000532244604 1030509371 /nfs/dbraw/zinc/50/93/71/1030509371.db2.gz HDPJERSKVRAZAD-NSHDSACASA-N 1 0 342.321 3.513 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000160516136 1030803681 /nfs/dbraw/zinc/80/36/81/1030803681.db2.gz OXVVGTZQGCCFEM-CYBMUJFWSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@H]1[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)CCC[N@@H+]1C ZINC000343436011 1030867244 /nfs/dbraw/zinc/86/72/44/1030867244.db2.gz LJGSGCBFLROKBB-LIRRHRJNSA-N 1 0 333.435 3.601 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@H](CO)C(C)(C)C ZINC000537658643 1030885977 /nfs/dbraw/zinc/88/59/77/1030885977.db2.gz NLRUOQDKOIRFIG-QGZVFWFLSA-N 1 0 332.400 3.694 20 5 EHBDRO CC(C)C[NH+]1CCC(N[C@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192646173 1030924278 /nfs/dbraw/zinc/92/42/78/1030924278.db2.gz PAEWCZCBCGLIEM-IBGZPJMESA-N 1 0 331.460 3.682 20 5 EHBDRO COc1ccc(OCC[N@@H+]2C[C@H](C)[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000483073325 1030940512 /nfs/dbraw/zinc/94/05/12/1030940512.db2.gz XVXJDYUZOQPIGB-IFXJQAMLSA-N 1 0 342.395 3.675 20 5 EHBDRO CCn1cc([C@@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000296040889 1031223766 /nfs/dbraw/zinc/22/37/66/1031223766.db2.gz UJBOYHGLOUVBPC-SJKOYZFVSA-N 1 0 328.416 3.884 20 5 EHBDRO CCC[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000548160617 1031235424 /nfs/dbraw/zinc/23/54/24/1031235424.db2.gz BMDGXWHHBJPVNF-GOEBONIOSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1c(-c2noc([C@@H]3CC[C@H]4CCCC[C@@H]4[NH2+]3)n2)cccc1[N+](=O)[O-] ZINC000904123205 1031758879 /nfs/dbraw/zinc/75/88/79/1031758879.db2.gz JCLNCDXCTZQWRS-SNPRPXQTSA-N 1 0 342.399 3.937 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-] ZINC000594505829 1033406153 /nfs/dbraw/zinc/40/61/53/1033406153.db2.gz BPQJMDDVSWVTON-GXFFZTMASA-N 1 0 332.322 3.529 20 5 EHBDRO O=[N+]([O-])c1c(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)ccc2ncccc21 ZINC000594598789 1033447223 /nfs/dbraw/zinc/44/72/23/1033447223.db2.gz HYBMALIREUWTBL-DOTOQJQBSA-N 1 0 326.400 3.572 20 5 EHBDRO O=C(N[C@H]1CC[N@H+](CC2CC2)C1)c1cc2ccccc2c2cccnc12 ZINC000594647349 1033473276 /nfs/dbraw/zinc/47/32/76/1033473276.db2.gz VNVDJVDWXRYPJN-KRWDZBQOSA-N 1 0 345.446 3.602 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923939 1033547405 /nfs/dbraw/zinc/54/74/05/1033547405.db2.gz HADRBSBWYULAQS-LIRRHRJNSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](C)Cc1ccc(O)cc1 ZINC000595015577 1033607839 /nfs/dbraw/zinc/60/78/39/1033607839.db2.gz ZEVMRHQRCAKKKE-CHWSQXEVSA-N 1 0 330.384 3.591 20 5 EHBDRO CC1(C)OCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000594997153 1033623781 /nfs/dbraw/zinc/62/37/81/1033623781.db2.gz YPKFBZNZWIHCGI-ZDUSSCGKSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cccc(OC)c1C ZINC000594999448 1033625326 /nfs/dbraw/zinc/62/53/26/1033625326.db2.gz RYTDAVXPFLWCNR-UHFFFAOYSA-N 1 0 330.384 3.600 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)c1ccc2c(c1)OCO2 ZINC000595003905 1033628150 /nfs/dbraw/zinc/62/81/50/1033628150.db2.gz NBMOZFUBBVJREZ-NWDGAFQWSA-N 1 0 344.367 3.744 20 5 EHBDRO C[N@@H+]1CCCC[C@H](CNCc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000598993955 1033647214 /nfs/dbraw/zinc/64/72/14/1033647214.db2.gz FKTKLCFMKZGMSC-OAHLLOKOSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2C)C2CC2)cn1 ZINC000599019262 1033667554 /nfs/dbraw/zinc/66/75/54/1033667554.db2.gz CRKJYTFYSBBIOO-SFHVURJKSA-N 1 0 327.384 3.548 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C1CCC(OC(F)F)CC1 ZINC000595053648 1033667972 /nfs/dbraw/zinc/66/79/72/1033667972.db2.gz XFVWARWKBIPBEI-ZBOXLXRLSA-N 1 0 344.358 3.804 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](n2cccn2)C(F)(F)F)cc1[N+](=O)[O-] ZINC000599058419 1033695906 /nfs/dbraw/zinc/69/59/06/1033695906.db2.gz UKRDONKAWZSWKS-RISCZKNCSA-N 1 0 342.321 3.554 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2CCC(O)CC2)c2ccccc2)c1 ZINC000595092595 1033700932 /nfs/dbraw/zinc/70/09/32/1033700932.db2.gz LVKDYIVZMXJYEW-OAAAQFAESA-N 1 0 340.423 3.825 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@@H]1CCCOC1 ZINC000599055301 1033706889 /nfs/dbraw/zinc/70/68/89/1033706889.db2.gz DEJKBVYRMOMKDQ-GJZGRUSLSA-N 1 0 338.473 3.872 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN1C1CCCC1 ZINC000599073560 1033715160 /nfs/dbraw/zinc/71/51/60/1033715160.db2.gz KDKIHOYVMLLXSO-MAUKXSAKSA-N 1 0 331.460 3.522 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC000599073937 1033716489 /nfs/dbraw/zinc/71/64/89/1033716489.db2.gz NDPCZMGQGRPLNZ-YOEHRIQHSA-N 1 0 347.459 3.661 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@@H]2CCC[N@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599110645 1033740708 /nfs/dbraw/zinc/74/07/08/1033740708.db2.gz DZPFSVRVCMKMMY-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@H](C)c2ccc(C)cc2)c1 ZINC000593020574 1033823651 /nfs/dbraw/zinc/82/36/51/1033823651.db2.gz PCXXSNNNWDGPQB-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1cccs1 ZINC000595496244 1033831009 /nfs/dbraw/zinc/83/10/09/1033831009.db2.gz FNRSCGCCXRPHQR-HNNXBMFYSA-N 1 0 338.404 3.645 20 5 EHBDRO COc1ccc(C[NH+]2CCC(c3ccccc3)CC2)cc1[N+](=O)[O-] ZINC000603840883 1033984188 /nfs/dbraw/zinc/98/41/88/1033984188.db2.gz GQAYOJXMOWZWRE-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[N@@H+]3CCC[C@@H](CCF)C3)co2)cc1 ZINC000595755097 1033984404 /nfs/dbraw/zinc/98/44/04/1033984404.db2.gz GGYAWXWTPYVSAW-ZDUSSCGKSA-N 1 0 333.363 3.821 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC(F)CC1 ZINC000595819288 1033993366 /nfs/dbraw/zinc/99/33/66/1033993366.db2.gz NNZMFBZMRDLLKP-LKSINWNRSA-N 1 0 348.378 3.651 20 5 EHBDRO C[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC(F)CC1 ZINC000595818813 1033993872 /nfs/dbraw/zinc/99/38/72/1033993872.db2.gz JZRLFDXNJZLIAA-LKSINWNRSA-N 1 0 348.378 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@H]2Cc2cccc(F)c2)cc1 ZINC000603893068 1034015451 /nfs/dbraw/zinc/01/54/51/1034015451.db2.gz VOMBHHSLHQEWSV-IBGZPJMESA-N 1 0 328.387 3.984 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CC1(C)C ZINC000595909473 1034027146 /nfs/dbraw/zinc/02/71/46/1034027146.db2.gz OLRVGBRNXHMSRK-DGCLKSJQSA-N 1 0 330.388 3.684 20 5 EHBDRO COc1cc(NC[C@@H](c2ccco2)[NH+](C)C)c(Cl)cc1[N+](=O)[O-] ZINC000596055108 1034056540 /nfs/dbraw/zinc/05/65/40/1034056540.db2.gz SDBBMZPIDFKMOK-ZDUSSCGKSA-N 1 0 339.779 3.565 20 5 EHBDRO CC(C)[NH+]1CCC(Nc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596059560 1034056790 /nfs/dbraw/zinc/05/67/90/1034056790.db2.gz QDIGJJAKXNSUTL-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOCCF)o2)c(Cl)c1 ZINC000596056996 1034056975 /nfs/dbraw/zinc/05/69/75/1034056975.db2.gz DWQDSAYFCSDYCR-UHFFFAOYSA-N 1 0 342.754 3.584 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC2(O)CCC(C)CC2)cc1[N+](=O)[O-] ZINC000596095940 1034059645 /nfs/dbraw/zinc/05/96/45/1034059645.db2.gz RSILJEKPQGOTSO-TXKKKEFDSA-N 1 0 336.432 3.585 20 5 EHBDRO C[C@@H]([NH2+]Cc1cnccc1C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000596117811 1034082622 /nfs/dbraw/zinc/08/26/22/1034082622.db2.gz JPBVPFUNFZVVPB-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000596308486 1034165523 /nfs/dbraw/zinc/16/55/23/1034165523.db2.gz STONXNBSUVACKW-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC[C@@H]3CCC[N@H+](CC4CC4)C3)ccnc21 ZINC000596570740 1034293844 /nfs/dbraw/zinc/29/38/44/1034293844.db2.gz NHPKVAIXYLESQV-HNNXBMFYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC[C@H]3CCC[N@H+](CC4CC4)C3)ccnc21 ZINC000596570742 1034294756 /nfs/dbraw/zinc/29/47/56/1034294756.db2.gz NHPKVAIXYLESQV-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450419452 1034306519 /nfs/dbraw/zinc/30/65/19/1034306519.db2.gz OSYBXGLJETXGQK-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC(C)(C)OC(=O)N[C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000310512217 1034533927 /nfs/dbraw/zinc/53/39/27/1034533927.db2.gz PPYOKZJZQYQYAV-GJZGRUSLSA-N 1 0 349.431 3.520 20 5 EHBDRO C[C@]12COC[C@@H]1C[N@H+](Cc1ccc(-c3ccccc3[N+](=O)[O-])s1)C2 ZINC000597210921 1034593268 /nfs/dbraw/zinc/59/32/68/1034593268.db2.gz ITTOXXHLTGWVBJ-UGSOOPFHSA-N 1 0 344.436 3.792 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@](O)(C4CC4)C3)o2)c1 ZINC000597203874 1034608960 /nfs/dbraw/zinc/60/89/60/1034608960.db2.gz AFXJJBSCNKLITM-LJQANCHMSA-N 1 0 342.395 3.592 20 5 EHBDRO CO[C@@H](C[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1)c1ccc(Cl)cc1 ZINC000548917045 1034780710 /nfs/dbraw/zinc/78/07/10/1034780710.db2.gz ZECDAUVDNRQZSO-SFHVURJKSA-N 1 0 346.814 3.994 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)F ZINC000179873049 1034877589 /nfs/dbraw/zinc/87/75/89/1034877589.db2.gz WYQNWTWZCQTWCC-LLVKDONJSA-N 1 0 344.358 3.622 20 5 EHBDRO COc1cc(CC[NH2+]C/C(C)=C/c2cccc([N+](=O)[O-])c2)ccc1O ZINC000615724095 1034986209 /nfs/dbraw/zinc/98/62/09/1034986209.db2.gz MDAUTBZYALZLQA-GXDHUFHOSA-N 1 0 342.395 3.545 20 5 EHBDRO C[N@H+](CCCC(=O)c1ccccc1)CCc1ccccc1[N+](=O)[O-] ZINC000450973388 1034998205 /nfs/dbraw/zinc/99/82/05/1034998205.db2.gz JWRJVNVHNQVJBY-UHFFFAOYSA-N 1 0 326.396 3.732 20 5 EHBDRO CC[C@H](CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)[NH+]1CCCC1 ZINC000581315205 1035483806 /nfs/dbraw/zinc/48/38/06/1035483806.db2.gz VQPBSINOEVVULO-UKRRQHHQSA-N 1 0 345.365 3.662 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CC[C@@H](COCc3ccccc3)C2)cc1 ZINC000173979837 1035823833 /nfs/dbraw/zinc/82/38/33/1035823833.db2.gz DUPVWJQMFCRYBR-LJQANCHMSA-N 1 0 340.423 3.676 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC000588232660 1035832579 /nfs/dbraw/zinc/83/25/79/1035832579.db2.gz VBGFLRNHXHGODM-ZFWWWQNUSA-N 1 0 348.830 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC[C@H](CO)CC3)s2)cc1 ZINC000153154037 1035860613 /nfs/dbraw/zinc/86/06/13/1035860613.db2.gz FYPGCRFFWCGCFF-OTVXOJSOSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000443958078 1035949556 /nfs/dbraw/zinc/94/95/56/1035949556.db2.gz LNHWZFBNSZXQEK-UONOGXRCSA-N 1 0 348.447 3.596 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000414204105 1036052483 /nfs/dbraw/zinc/05/24/83/1036052483.db2.gz ZYNOUJYWGAZQSE-UKRRQHHQSA-N 1 0 326.396 3.730 20 5 EHBDRO CCC[C@H]([NH2+]C[C@](C)(O)c1cccs1)c1cccc([N+](=O)[O-])c1 ZINC000156968267 1036114401 /nfs/dbraw/zinc/11/44/01/1036114401.db2.gz ILJVOLLIARSDEQ-RDJZCZTQSA-N 1 0 334.441 3.995 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201741 1036140097 /nfs/dbraw/zinc/14/00/97/1036140097.db2.gz YEWDODNKXBSBLW-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113838 1036256277 /nfs/dbraw/zinc/25/62/77/1036256277.db2.gz ZOXJYGLTYCGZAP-SMDDNHRTSA-N 1 0 343.349 3.534 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H](O)C1CC1 ZINC000589197905 1036303233 /nfs/dbraw/zinc/30/32/33/1036303233.db2.gz APKPXVZOYXLAPY-INIZCTEOSA-N 1 0 332.425 3.526 20 5 EHBDRO Cc1ccccc1C[N@H+](C)CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000026224077 1036393992 /nfs/dbraw/zinc/39/39/92/1036393992.db2.gz SJDWNQXUXFTYFE-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO C[NH+](C)CCCOc1ccc(CNc2ccc([N+](=O)[O-])s2)cc1 ZINC000609132746 1036468126 /nfs/dbraw/zinc/46/81/26/1036468126.db2.gz DLAQAZWEKXYBKU-UHFFFAOYSA-N 1 0 335.429 3.599 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCO[C@H](CCc2ccccc2)C1 ZINC000541700136 1036576203 /nfs/dbraw/zinc/57/62/03/1036576203.db2.gz HXHWYXCCUWNHML-SJLPKXTDSA-N 1 0 340.423 3.989 20 5 EHBDRO COCC1CCC([NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000414307558 1036577914 /nfs/dbraw/zinc/57/79/14/1036577914.db2.gz HIYGDNQWNPGYDF-IUPXNIOVSA-N 1 0 332.444 3.711 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccc2c(c1)OCCO2)c1cccc([N+](=O)[O-])c1 ZINC000152751030 1036631702 /nfs/dbraw/zinc/63/17/02/1036631702.db2.gz GGOFEIYYJQXRFE-CHWSQXEVSA-N 1 0 328.368 3.778 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](C(C)C)[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000589820585 1036646033 /nfs/dbraw/zinc/64/60/33/1036646033.db2.gz WDQHRNSMJXLXDX-GJZGRUSLSA-N 1 0 348.365 3.756 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082352 1036734946 /nfs/dbraw/zinc/73/49/46/1036734946.db2.gz RZYNJDSXEPWDFB-KRWDZBQOSA-N 1 0 334.379 3.742 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccnc1 ZINC000414335545 1036749508 /nfs/dbraw/zinc/74/95/08/1036749508.db2.gz OLMBLCUDXJKQHO-GOSISDBHSA-N 1 0 325.412 3.935 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000414339782 1036793907 /nfs/dbraw/zinc/79/39/07/1036793907.db2.gz GBYWZGINMBZHKU-CZUORRHYSA-N 1 0 329.375 3.663 20 5 EHBDRO C[C@H]([NH2+]CCn1cccn1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000180435204 1036826024 /nfs/dbraw/zinc/82/60/24/1036826024.db2.gz MBBMKNPYZNISAW-ZDUSSCGKSA-N 1 0 342.424 3.871 20 5 EHBDRO Cn1cc(C[NH2+]CC(C2CC2)C2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000539529295 1036871428 /nfs/dbraw/zinc/87/14/28/1036871428.db2.gz LEIAPYPWHWCHLB-UHFFFAOYSA-N 1 0 340.427 3.521 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)[C@H](c2ccccc2)C1 ZINC000761511270 1037081456 /nfs/dbraw/zinc/08/14/56/1037081456.db2.gz PSDKBQLULNONRT-SFHVURJKSA-N 1 0 345.830 3.737 20 5 EHBDRO C[NH+](C)CC[C@@H](NCc1ccc([N+](=O)[O-])c(Cl)c1)C(C)(C)C ZINC000761525447 1037109950 /nfs/dbraw/zinc/10/99/50/1037109950.db2.gz KATZRSDCGYJXIR-OAHLLOKOSA-N 1 0 327.856 3.704 20 5 EHBDRO CC[C@H](O)C[N@H+](C/C=C/c1ccccc1[N+](=O)[O-])Cc1ccccc1 ZINC000539850726 1037280248 /nfs/dbraw/zinc/28/02/48/1037280248.db2.gz OVBWTWHPUMFJCJ-BEBFYNPSSA-N 1 0 340.423 3.881 20 5 EHBDRO C[C@H]1OCC[C@]1(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000542314673 1037281122 /nfs/dbraw/zinc/28/11/22/1037281122.db2.gz VKHIKGRWAXNFNI-PXAZEXFGSA-N 1 0 332.425 3.980 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CC[C@@H](O)C3)s2)cc1 ZINC000188808878 1037331771 /nfs/dbraw/zinc/33/17/71/1037331771.db2.gz JJUXJCVKBBVTCS-SWLSCSKDSA-N 1 0 332.425 3.574 20 5 EHBDRO CC[NH+](CC)CCC[C@H](C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000152893024 1037368769 /nfs/dbraw/zinc/36/87/69/1037368769.db2.gz SYJRFXFLXMGWIF-ZDUSSCGKSA-N 1 0 347.419 3.567 20 5 EHBDRO C[NH+](C)C(C)(C)CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491365648 1037422355 /nfs/dbraw/zinc/42/23/55/1037422355.db2.gz FIRDUYWBWCQLHS-SFHVURJKSA-N 1 0 327.428 3.614 20 5 EHBDRO CC[N@H+](CCC1CCN(c2nccc(C)c2[N+](=O)[O-])CC1)CC1CC1 ZINC000540023882 1037480307 /nfs/dbraw/zinc/48/03/07/1037480307.db2.gz BIZRSMXFSDVMMZ-UHFFFAOYSA-N 1 0 346.475 3.637 20 5 EHBDRO CC[N@H+](CCC1CC1)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000760883248 1037553146 /nfs/dbraw/zinc/55/31/46/1037553146.db2.gz BCSWVQAHHDNSMV-LLVKDONJSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOc1ccccc1F)C1CC1 ZINC000540171313 1037640330 /nfs/dbraw/zinc/64/03/30/1037640330.db2.gz QMLPSEVJHQQKHR-QGZVFWFLSA-N 1 0 344.386 3.724 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC3(C2)CCCCC3)cccc1[N+](=O)[O-] ZINC000532574623 1037678303 /nfs/dbraw/zinc/67/83/03/1037678303.db2.gz QWWUCAURGQMSOS-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CC1CCCC1)[C@H]1CC[C@H](O)CC1 ZINC000592130654 1037838868 /nfs/dbraw/zinc/83/88/68/1037838868.db2.gz HOKXYDNPCSGCTH-IYARVYRRSA-N 1 0 332.444 3.891 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12)c1ccccc1[N+](=O)[O-] ZINC000897466060 1037875906 /nfs/dbraw/zinc/87/59/06/1037875906.db2.gz NHYHXKZEESDOQK-OYNZBZHQSA-N 1 0 338.498 3.668 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)CC(=O)Nc1ccccc1)c1ccccc1[N+](=O)[O-] ZINC000897466230 1037879104 /nfs/dbraw/zinc/87/91/04/1037879104.db2.gz PYTDCEWVGOFHAB-GJZGRUSLSA-N 1 0 341.411 3.705 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](c1ccccc1)N(C)C ZINC000468647096 1038147898 /nfs/dbraw/zinc/14/78/98/1038147898.db2.gz HOIKSIXLXUUXPZ-ZRNYNZGJSA-N 1 0 339.439 3.891 20 5 EHBDRO CN(Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1([NH+](C)C)CCC1 ZINC000339112888 1038282087 /nfs/dbraw/zinc/28/20/87/1038282087.db2.gz WOJVTLFADVRSPH-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO COC(=O)CC[N@@H+](C/C(C)=C\c1cccc([N+](=O)[O-])c1)CC(C)C ZINC000470172486 1038426188 /nfs/dbraw/zinc/42/61/88/1038426188.db2.gz XJKZBBXQBHZXSE-GDNBJRDFSA-N 1 0 334.416 3.519 20 5 EHBDRO COc1ccccc1C(C)(C)[NH2+]Cc1ccc([N+](=O)[O-])c(OC)c1 ZINC000538708765 1038484023 /nfs/dbraw/zinc/48/40/23/1038484023.db2.gz ZZIBFSZDUIQFFR-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO C/C(=C/c1ccccc1)C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000538737318 1038500713 /nfs/dbraw/zinc/50/07/13/1038500713.db2.gz VVQCPKXQVUSWFV-HKBKRHGFSA-N 1 0 338.411 3.580 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341460946 1038593795 /nfs/dbraw/zinc/59/37/95/1038593795.db2.gz QPMCTTJVFQDLQG-CQSZACIVSA-N 1 0 334.395 3.735 20 5 EHBDRO Cc1cc(N2CCC([NH2+]C3CC3)CC2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461939055 1038687115 /nfs/dbraw/zinc/68/71/15/1038687115.db2.gz VWGPDMSITFQNAM-UHFFFAOYSA-N 1 0 343.349 3.643 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000461959429 1038696863 /nfs/dbraw/zinc/69/68/63/1038696863.db2.gz PLTVMAQXRFUFKC-YJBOKZPZSA-N 1 0 329.375 3.900 20 5 EHBDRO CC(C)([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc(F)c(F)c1 ZINC000539337313 1038787743 /nfs/dbraw/zinc/78/77/43/1038787743.db2.gz PFTZTNBCRZXZBG-UHFFFAOYSA-N 1 0 336.338 3.777 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H](C(C)C)[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000479941016 1038917185 /nfs/dbraw/zinc/91/71/85/1038917185.db2.gz NBEVOAINADMBDE-KRWDZBQOSA-N 1 0 333.432 3.720 20 5 EHBDRO C[C@@H](C[NH2+]C[C@H](O)c1ccc(Cl)cc1)c1ccccc1[N+](=O)[O-] ZINC000905644506 1039023831 /nfs/dbraw/zinc/02/38/31/1039023831.db2.gz RFKLEUVGHBJOOC-SJCJKPOMSA-N 1 0 334.803 3.675 20 5 EHBDRO C[C@@H](C[NH2+]C[C@@H](O)c1cccc(Cl)c1)c1ccccc1[N+](=O)[O-] ZINC000905643371 1039025857 /nfs/dbraw/zinc/02/58/57/1039025857.db2.gz LGJOPDWSSQEFEC-YVEFUNNKSA-N 1 0 334.803 3.675 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@H]2c2cccs2)c2c(c1)COCO2 ZINC000015301455 1039089216 /nfs/dbraw/zinc/08/92/16/1039089216.db2.gz SDTQVNIZJGDDFK-HNNXBMFYSA-N 1 0 346.408 3.860 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@H+](C)C[C@H](O)Cc1ccccc1 ZINC000552293345 1039164766 /nfs/dbraw/zinc/16/47/66/1039164766.db2.gz YZTYMNPUWAZWHW-MBNYPGIVSA-N 1 0 340.423 3.534 20 5 EHBDRO Cc1cc(N2CCOC[C@@H](C3CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000488735536 1039362670 /nfs/dbraw/zinc/36/26/70/1039362670.db2.gz NZRMMMVWXGOGDC-HNNXBMFYSA-N 1 0 341.411 3.704 20 5 EHBDRO CCC[NH+]1CCC(N[C@H]2CCCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000417320295 1039677676 /nfs/dbraw/zinc/67/76/76/1039677676.db2.gz JIBMJNZTKZKUDY-IBGZPJMESA-N 1 0 331.460 3.826 20 5 EHBDRO COc1ccncc1C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417353418 1039711404 /nfs/dbraw/zinc/71/14/04/1039711404.db2.gz XEUYLCXGNLCHLR-QGZVFWFLSA-N 1 0 327.384 3.556 20 5 EHBDRO COc1cc(N[C@@H]2CC[N@H+](C)[C@@H]2c2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000485991072 1039764229 /nfs/dbraw/zinc/76/42/29/1039764229.db2.gz BOYFCGANNOVSKY-RDTXWAMCSA-N 1 0 345.374 3.600 20 5 EHBDRO CSc1ccc(C(=O)Nc2ccccc2C[NH+](C)C)cc1[N+](=O)[O-] ZINC000024808255 1039813363 /nfs/dbraw/zinc/81/33/63/1039813363.db2.gz RDJKOUTZXOVDGO-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO CCn1c(SC[C@H](C)[NH+](C)C)nc2cc3ccccc3cc2c1=O ZINC000479229334 1040067199 /nfs/dbraw/zinc/06/71/99/1040067199.db2.gz YHDDNEWOUKZFMO-ZDUSSCGKSA-N 1 0 341.480 3.612 20 5 EHBDRO Cc1cccc(C[N@H+](C)CCC(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000428727988 1040107689 /nfs/dbraw/zinc/10/76/89/1040107689.db2.gz ZUVFDLFABHVDIQ-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO CC(C)C[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC000893320981 1040253072 /nfs/dbraw/zinc/25/30/72/1040253072.db2.gz WQJQPUKDDMFUKM-CABCVRRESA-N 1 0 326.824 3.932 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)ccc1[N+](=O)[O-] ZINC000490034292 1040301402 /nfs/dbraw/zinc/30/14/02/1040301402.db2.gz VBXTYPPEPKBEFF-RHSMWYFYSA-N 1 0 326.396 3.981 20 5 EHBDRO COCCCC[N@H+](C)Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000418128416 1040616642 /nfs/dbraw/zinc/61/66/42/1040616642.db2.gz BJZCPGUGJFHNNJ-UHFFFAOYSA-N 1 0 335.429 3.577 20 5 EHBDRO COc1cc(C[NH2+]CCC(C)(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491035452 1040878986 /nfs/dbraw/zinc/87/89/86/1040878986.db2.gz VQHZUHGQYVGION-UHFFFAOYSA-N 1 0 346.374 3.773 20 5 EHBDRO O=[N+]([O-])c1cccnc1N[C@H](C[NH+]1CCCCC1)c1ccccc1 ZINC000078333924 1041017382 /nfs/dbraw/zinc/01/73/82/1041017382.db2.gz QJADMPYURGXITO-MRXNPFEDSA-N 1 0 326.400 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c(F)c1 ZINC000433199005 1041049951 /nfs/dbraw/zinc/04/99/51/1041049951.db2.gz JDJHCSAEDDGPAL-HNNXBMFYSA-N 1 0 343.402 3.740 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCc3ccccc3[N+](=O)[O-])cccc21 ZINC000433205153 1041059881 /nfs/dbraw/zinc/05/98/81/1041059881.db2.gz BSEGZEBHZMDWOR-QGZVFWFLSA-N 1 0 327.384 3.592 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CSC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000512868903 1041138895 /nfs/dbraw/zinc/13/88/95/1041138895.db2.gz KCTQJDZXWLVRIP-NHYWBVRUSA-N 1 0 348.424 3.705 20 5 EHBDRO CCC[C@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCOC1 ZINC000512890744 1041180535 /nfs/dbraw/zinc/18/05/35/1041180535.db2.gz MIJVNJTXFCOKSQ-SFHVURJKSA-N 1 0 330.384 3.904 20 5 EHBDRO CC(C)C[C@H](CCO)C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433284384 1041234439 /nfs/dbraw/zinc/23/44/39/1041234439.db2.gz DZSWYMVCPGCLHK-KSSFIOAISA-N 1 0 334.460 3.952 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000150744372 1041257559 /nfs/dbraw/zinc/25/75/59/1041257559.db2.gz CGVCBAUCRFLLRF-CQSZACIVSA-N 1 0 330.388 3.799 20 5 EHBDRO CC(C)[C@@H](O)C[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000123826528 1041403868 /nfs/dbraw/zinc/40/38/68/1041403868.db2.gz CVFONNKHCCEONE-DOMZBBRYSA-N 1 0 334.441 3.991 20 5 EHBDRO CC(C)(C)[C@H]1CCCC[C@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000111057352 1041714504 /nfs/dbraw/zinc/71/45/04/1041714504.db2.gz JLFQBAGJOBBNAN-UONOGXRCSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000107071092 1041815102 /nfs/dbraw/zinc/81/51/02/1041815102.db2.gz WIEMDAXVWDXFQZ-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1cnc([C@H](C)C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])s1 ZINC000893576977 1042734648 /nfs/dbraw/zinc/73/46/48/1042734648.db2.gz WEZCDXIERJYZOL-SECBINFHSA-N 1 0 325.821 3.906 20 5 EHBDRO COc1c(C)cnc(CN(C)[C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000067226842 1042774641 /nfs/dbraw/zinc/77/46/41/1042774641.db2.gz DWRMDDDGBOMJGN-AWEZNQCLSA-N 1 0 329.400 3.808 20 5 EHBDRO C[C@@H]1CC([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H](C)O1 ZINC000128713871 1042869525 /nfs/dbraw/zinc/86/95/25/1042869525.db2.gz AZYCNJAXBFQCSM-VXGBXAGGSA-N 1 0 347.440 3.764 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCc2ccc3c[nH]nc3c2)cc1[N+](=O)[O-] ZINC000585743471 1043018376 /nfs/dbraw/zinc/01/83/76/1043018376.db2.gz XEHGZWGPMOMWBH-UHFFFAOYSA-N 1 0 338.411 3.927 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542807 1044207692 /nfs/dbraw/zinc/20/76/92/1044207692.db2.gz QGJDBLKZLRGOQZ-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H](Cc1cccs1)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000764774708 1127532805 /nfs/dbraw/zinc/53/28/05/1127532805.db2.gz QPQCMUGRFCLJJV-CQSZACIVSA-N 1 0 345.468 3.846 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN(C(=O)OC(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000272956517 1128217890 /nfs/dbraw/zinc/21/78/90/1128217890.db2.gz FKHMXULIYQXTGM-KBPBESRZSA-N 1 0 349.431 3.502 20 5 EHBDRO Cc1cnc(NCC(C)(C)[NH2+][C@@H](C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000301468201 1128436676 /nfs/dbraw/zinc/43/66/76/1128436676.db2.gz YZAQFXIVXIQNEU-AWEZNQCLSA-N 1 0 328.416 3.840 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000153551904 1128448477 /nfs/dbraw/zinc/44/84/77/1128448477.db2.gz AXFMABNPLLVJSM-SUMWQHHRSA-N 1 0 336.432 3.585 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc3cc([N+](=O)[O-])ccc3n2)C1 ZINC000301604782 1128516394 /nfs/dbraw/zinc/51/63/94/1128516394.db2.gz MBHKVWZMQVUBKR-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO CCN(CC)C(=O)C1([NH2+]Cc2ccc([N+](=O)[O-])cc2C)CCCCC1 ZINC000542699471 1128546383 /nfs/dbraw/zinc/54/63/83/1128546383.db2.gz IRYRZMWSOQYSDZ-UHFFFAOYSA-N 1 0 347.459 3.564 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cc(F)ccc1F ZINC000765846232 1128550139 /nfs/dbraw/zinc/55/01/39/1128550139.db2.gz WKNYNNZKOFQCNA-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000273535792 1128584291 /nfs/dbraw/zinc/58/42/91/1128584291.db2.gz WFFRCXXCXMZRMG-FUHWJXTLSA-N 1 0 330.359 3.744 20 5 EHBDRO COC(=O)c1oc([C@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847844 1128716049 /nfs/dbraw/zinc/71/60/49/1128716049.db2.gz GDQKFPSWKAVNOK-ZDUSSCGKSA-N 1 0 346.383 3.518 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCOC1 ZINC000494449501 1120562477 /nfs/dbraw/zinc/56/24/77/1120562477.db2.gz YMDIRVKLBWDJIC-BXUZGUMPSA-N 1 0 332.322 3.518 20 5 EHBDRO CC[N@H+](CCOc1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(O)c1 ZINC000494544614 1120590259 /nfs/dbraw/zinc/59/02/59/1120590259.db2.gz DUFOVEJCQGEDCZ-AWEZNQCLSA-N 1 0 330.384 3.762 20 5 EHBDRO CCOC(=O)C[C@](C)([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C(C)C ZINC000494647225 1120712610 /nfs/dbraw/zinc/71/26/10/1120712610.db2.gz HNQHBNXERLGDMX-INIZCTEOSA-N 1 0 342.823 3.706 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H](O)c2ccc(F)cc2F)C2CC2)c1 ZINC000153327201 1120965496 /nfs/dbraw/zinc/96/54/96/1120965496.db2.gz RHDZMKZRDSJDBW-SFHVURJKSA-N 1 0 348.349 3.571 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH2+][C@@H](Cc2ccccc2)C2CC2)c1 ZINC000495517199 1121245854 /nfs/dbraw/zinc/24/58/54/1121245854.db2.gz QJTJIMXPYNPKPA-IBGZPJMESA-N 1 0 326.396 3.585 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2CC[C@@H]3SCCS[C@H]23)c1 ZINC000762613010 1121382069 /nfs/dbraw/zinc/38/20/69/1121382069.db2.gz GPJVEMOVJVUEEB-HZSPNIEDSA-N 1 0 344.889 3.717 20 5 EHBDRO C[C@H](C[C@H]1CCCO1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333109 1129002574 /nfs/dbraw/zinc/00/25/74/1129002574.db2.gz WGRUHMROZABVMO-MLGOLLRUSA-N 1 0 347.440 3.766 20 5 EHBDRO CCc1nocc1CN(C)c1cc(C)[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000338785572 1129003965 /nfs/dbraw/zinc/00/39/65/1129003965.db2.gz YPVLVRHWHKAJGN-UHFFFAOYSA-N 1 0 326.356 3.638 20 5 EHBDRO COc1ccc([C@H]([NH2+]CCOc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000194015871 1121753200 /nfs/dbraw/zinc/75/32/00/1121753200.db2.gz MRMAJWHQSSGXNB-LJQANCHMSA-N 1 0 342.395 3.723 20 5 EHBDRO C[C@H]1CCCC[C@H]1[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143323 1121784825 /nfs/dbraw/zinc/78/48/25/1121784825.db2.gz OXLCSTUULHJZSO-SWLSCSKDSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]3CCCC[C@H]23)cc1C(F)(F)F ZINC000301117820 1121946816 /nfs/dbraw/zinc/94/68/16/1121946816.db2.gz WIJNNLUEHXPMQI-GXTWGEPZSA-N 1 0 329.322 3.652 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1CCN(c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000090801274 1122232850 /nfs/dbraw/zinc/23/28/50/1122232850.db2.gz CBMLIIQJNYBVLZ-FUHWJXTLSA-N 1 0 340.427 3.700 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@H]1CCCC[C@@H]1O ZINC000497144532 1122351240 /nfs/dbraw/zinc/35/12/40/1122351240.db2.gz KMWNSQBAZLRDGV-QAPCUYQASA-N 1 0 344.411 3.838 20 5 EHBDRO Cc1ccc(N2CCC[N@H+](Cc3cccc([N+](=O)[O-])c3C)CC2)cc1 ZINC000917089830 1122487065 /nfs/dbraw/zinc/48/70/65/1122487065.db2.gz NRSVLLMJBIZWCD-UHFFFAOYSA-N 1 0 339.439 3.924 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@H]1CCC[N@H+](Cc2cccs2)C1 ZINC000301205685 1122510812 /nfs/dbraw/zinc/51/08/12/1122510812.db2.gz SJGMADBFODAHQL-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)c1 ZINC000154523782 1122684573 /nfs/dbraw/zinc/68/45/73/1122684573.db2.gz YUPFFDOWCOLJII-MOPGFXCFSA-N 1 0 344.386 3.898 20 5 EHBDRO Cc1ccccc1C[NH+]1CCC(Nc2ncc([N+](=O)[O-])cc2C)CC1 ZINC000301210323 1122711857 /nfs/dbraw/zinc/71/18/57/1122711857.db2.gz WDXDEGBMFHIMAS-UHFFFAOYSA-N 1 0 340.427 3.683 20 5 EHBDRO COc1ccc(C[NH2+]CCOc2ccc(C(C)C)cc2)cc1[N+](=O)[O-] ZINC000609287731 1122939665 /nfs/dbraw/zinc/93/96/65/1122939665.db2.gz XVOGEQAHSBWAHL-UHFFFAOYSA-N 1 0 344.411 3.895 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2c1cccc2O ZINC000130687299 1123179396 /nfs/dbraw/zinc/17/93/96/1123179396.db2.gz CFCCYPOJOJQQPR-CXAGYDPISA-N 1 0 326.396 3.899 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1c(F)cncc1F ZINC000556916375 1123201135 /nfs/dbraw/zinc/20/11/35/1123201135.db2.gz IDLJTEXNDQOAPZ-VXGBXAGGSA-N 1 0 335.354 3.940 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000301800288 1129109647 /nfs/dbraw/zinc/10/96/47/1129109647.db2.gz SRKPNMFSZWXCPJ-UHFFFAOYSA-N 1 0 343.374 3.729 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccc(C[NH+](CC)CC)cc1 ZINC000195339084 1123369676 /nfs/dbraw/zinc/36/96/76/1123369676.db2.gz KDKUCVVQNQNZOP-UHFFFAOYSA-N 1 0 345.447 3.574 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNC(=O)Nc2cccc([N+](=O)[O-])c2)C1 ZINC000609545272 1123608285 /nfs/dbraw/zinc/60/82/85/1123608285.db2.gz KXAMFFXYCHGJMJ-AWEZNQCLSA-N 1 0 348.447 3.617 20 5 EHBDRO COCC[N@H+](CCc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000609705395 1123647894 /nfs/dbraw/zinc/64/78/94/1123647894.db2.gz YYMOSPJSWIUMON-UHFFFAOYSA-N 1 0 348.830 3.939 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)C(C)(C)O ZINC000609707304 1123647984 /nfs/dbraw/zinc/64/79/84/1123647984.db2.gz DYTIGFLYCWVUKH-JTQLQIEISA-N 1 0 338.791 3.757 20 5 EHBDRO Cc1ccc(OC2CC[NH+](CCc3ccc([N+](=O)[O-])cc3)CC2)cc1 ZINC000609739561 1123657835 /nfs/dbraw/zinc/65/78/35/1123657835.db2.gz MGKCERPHFLXQLZ-UHFFFAOYSA-N 1 0 340.423 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCS[C@H](c3ccccc3)C2)cc1 ZINC000609800457 1123664424 /nfs/dbraw/zinc/66/44/24/1123664424.db2.gz IAUKTFPEVYRCJR-SFHVURJKSA-N 1 0 344.436 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H](CCCO)c1ccccc1 ZINC000179736568 1123839761 /nfs/dbraw/zinc/83/97/61/1123839761.db2.gz HKJRWCAMOJDRKI-INIZCTEOSA-N 1 0 334.803 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCC[NH+]3Cc4ccccc4C3)ccc2c1 ZINC000068321486 1123917392 /nfs/dbraw/zinc/91/73/92/1123917392.db2.gz JLLLQDITTLMVJE-UHFFFAOYSA-N 1 0 334.379 3.571 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)c(C)s1 ZINC000182751888 1125360599 /nfs/dbraw/zinc/36/05/99/1125360599.db2.gz ICUYUFNPWPWPFT-LBPRGKRZSA-N 1 0 347.440 3.871 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000619569537 1125363825 /nfs/dbraw/zinc/36/38/25/1125363825.db2.gz GGUGPPOWGDJJQL-HYEGPXJVSA-N 1 0 332.444 3.746 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569530 1125364135 /nfs/dbraw/zinc/36/41/35/1125364135.db2.gz FMHJDRJJZXLORY-FDPIWHGQSA-N 1 0 332.444 3.746 20 5 EHBDRO CC1CCC([N@H+](C)CC(=O)Nc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000198202628 1125402639 /nfs/dbraw/zinc/40/26/39/1125402639.db2.gz YLMGSRYWXSSGRK-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO C[C@H](c1ccco1)[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000131028831 1129376404 /nfs/dbraw/zinc/37/64/04/1129376404.db2.gz LFKDUFYHOQTXNI-CYBMUJFWSA-N 1 0 340.383 3.781 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000301938963 1129388690 /nfs/dbraw/zinc/38/86/90/1129388690.db2.gz XQZDCIBXUHPQOP-KGLIPLIRSA-N 1 0 328.416 3.675 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2C[C@H](c3ccccc3C)C2)cc1[N+](=O)[O-] ZINC000466408273 1129430439 /nfs/dbraw/zinc/43/04/39/1129430439.db2.gz YZJYMVPVCIRZFG-WKILWMFISA-N 1 0 326.396 3.948 20 5 EHBDRO CC(C)[C@H]1CCCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000117349717 1129435116 /nfs/dbraw/zinc/43/51/16/1129435116.db2.gz NKWUWLWPRFYDSB-OAHLLOKOSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1ccc(CNc2ccc(Cl)c(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000466419169 1129439231 /nfs/dbraw/zinc/43/92/31/1129439231.db2.gz HMSJDCHMMZWHRH-UHFFFAOYSA-N 1 0 349.818 3.931 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@](C)(O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402054 1129462114 /nfs/dbraw/zinc/46/21/14/1129462114.db2.gz CQRNSIXWRXWOBL-ROUUACIJSA-N 1 0 332.400 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ccco2)c2ccccc2)cc1 ZINC000543423499 1129480503 /nfs/dbraw/zinc/48/05/03/1129480503.db2.gz XATUBPPPVIWHJN-IBGZPJMESA-N 1 0 338.363 3.946 20 5 EHBDRO CC(C)(C)c1ccc(Oc2ccc(C[NH2+]CCO)cc2[N+](=O)[O-])cc1 ZINC000499948376 1129587841 /nfs/dbraw/zinc/58/78/41/1129587841.db2.gz UXYZRJOVRCPGGN-UHFFFAOYSA-N 1 0 344.411 3.767 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H]2C)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000124338182 1129598839 /nfs/dbraw/zinc/59/88/39/1129598839.db2.gz BVZZSCMLHHMPPR-SNVBAGLBSA-N 1 0 348.321 3.529 20 5 EHBDRO CC[C@H]([NH2+]CCCN(CC)CC(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC001168733172 1129640535 /nfs/dbraw/zinc/64/05/35/1129640535.db2.gz GCXXHKDXVSBEPV-HNNXBMFYSA-N 1 0 347.381 3.910 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(C(=O)N(C)C(C)C)CC1 ZINC000330738181 1129644301 /nfs/dbraw/zinc/64/43/01/1129644301.db2.gz ZBKKHNNNDSBRBC-HNNXBMFYSA-N 1 0 347.459 3.543 20 5 EHBDRO Cc1nc2ccccc2n1CCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000155899135 1129676838 /nfs/dbraw/zinc/67/68/38/1129676838.db2.gz OIUPYAMLBHEWQN-AWEZNQCLSA-N 1 0 338.411 3.994 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000156181477 1129702993 /nfs/dbraw/zinc/70/29/93/1129702993.db2.gz XNBROPWKTNXWJY-DNVCBOLYSA-N 1 0 327.428 3.857 20 5 EHBDRO COc1cccc([C@H](CNc2cccc(C)c2[N+](=O)[O-])[NH+](C)C)c1 ZINC000302483915 1129779935 /nfs/dbraw/zinc/77/99/35/1129779935.db2.gz HKNDJPDRFLDMEA-KRWDZBQOSA-N 1 0 329.400 3.627 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000056196394 1129805692 /nfs/dbraw/zinc/80/56/92/1129805692.db2.gz QFQBOBCLDYJMOH-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)n1 ZINC000355213552 1129947531 /nfs/dbraw/zinc/94/75/31/1129947531.db2.gz FIADPWBTKCTYPK-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(C(=O)OC)cc1 ZINC000557328931 1129990460 /nfs/dbraw/zinc/99/04/60/1129990460.db2.gz AGNWNRORRTXHGM-GOSISDBHSA-N 1 0 342.395 3.665 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173418557 1130228516 /nfs/dbraw/zinc/22/85/16/1130228516.db2.gz HQDQPLPGHUAJFS-DOTOQJQBSA-N 1 0 325.412 3.914 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@@H]2OCC[C@@H]21 ZINC000245551287 1130235776 /nfs/dbraw/zinc/23/57/76/1130235776.db2.gz OZUKGUZJUILZFB-SEEKVXKWSA-N 1 0 344.455 3.853 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH2+][C@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000174146396 1130337444 /nfs/dbraw/zinc/33/74/44/1130337444.db2.gz BVEBATMNHSYBEI-ZIAGYGMSSA-N 1 0 333.432 3.789 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@H]2CCC[C@H](O)C2)s1 ZINC000174430216 1130358842 /nfs/dbraw/zinc/35/88/42/1130358842.db2.gz URHCMONPJMGGMU-KBPBESRZSA-N 1 0 346.452 3.964 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000766194721 1131161614 /nfs/dbraw/zinc/16/16/14/1131161614.db2.gz WBDPDQBIQDNFMX-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000738059332 1131462074 /nfs/dbraw/zinc/46/20/74/1131462074.db2.gz XKSQBTZGXBOLFE-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO CC[C@H](C)[C@H]1CCCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000738057481 1131462097 /nfs/dbraw/zinc/46/20/97/1131462097.db2.gz RJVNCKDXBOWOOH-WMLDXEAASA-N 1 0 343.431 3.711 20 5 EHBDRO C[NH+](C)CCOc1cc(NCCC2=CCCCC2)ccc1[N+](=O)[O-] ZINC001168772404 1131593050 /nfs/dbraw/zinc/59/30/50/1131593050.db2.gz UVYOEQKNJPHZQV-UHFFFAOYSA-N 1 0 333.432 3.838 20 5 EHBDRO C[C@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1CCCCCC1 ZINC000741932114 1131670745 /nfs/dbraw/zinc/67/07/45/1131670745.db2.gz QTVWNYRXXUFWIA-GFCCVEGCSA-N 1 0 340.807 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCc1cc(F)cc(F)c1)CC2 ZINC001172898402 1131882291 /nfs/dbraw/zinc/88/22/91/1131882291.db2.gz AJFTUMCGYVSZGZ-GOSISDBHSA-N 1 0 346.377 3.953 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1cc(F)cc(F)c1)CC2 ZINC001172898403 1131882659 /nfs/dbraw/zinc/88/26/59/1131882659.db2.gz AJFTUMCGYVSZGZ-SFHVURJKSA-N 1 0 346.377 3.953 20 5 EHBDRO CCCN(CCC)CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898655 1131882737 /nfs/dbraw/zinc/88/27/37/1131882737.db2.gz IICGKHYDHRKBMP-GOSISDBHSA-N 1 0 333.476 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cccc(F)c1F)CC2 ZINC001172899584 1131883078 /nfs/dbraw/zinc/88/30/78/1131883078.db2.gz ARVVHEGDUGKCTO-HNNXBMFYSA-N 1 0 332.350 3.910 20 5 EHBDRO Cc1cc2c(cn1)[C@H]([NH2+][C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172903764 1131885859 /nfs/dbraw/zinc/88/58/59/1131885859.db2.gz IEQQJRXLHRKYNX-FXAWDEMLSA-N 1 0 337.423 3.823 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1cc(F)cc(F)c1)CC2 ZINC001172895947 1131902044 /nfs/dbraw/zinc/90/20/44/1131902044.db2.gz JYJSCOTWQJDDMH-QGZVFWFLSA-N 1 0 332.350 3.910 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH+]1CCC3(CCCOC3)CC1)CC2 ZINC001172919807 1131903956 /nfs/dbraw/zinc/90/39/56/1131903956.db2.gz HPBGYFMQYUGYBL-GOSISDBHSA-N 1 0 344.455 3.735 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000743386508 1131907136 /nfs/dbraw/zinc/90/71/36/1131907136.db2.gz IXPAVGQUQFQKJR-GOSISDBHSA-N 1 0 328.416 3.928 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173015191 1131936151 /nfs/dbraw/zinc/93/61/51/1131936151.db2.gz LFGSABICPCNFGD-GFCCVEGCSA-N 1 0 339.386 3.716 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@H]3CC3(Cl)Cl)CC2)cc1 ZINC000743862452 1131990223 /nfs/dbraw/zinc/99/02/23/1131990223.db2.gz DEMKCYQEUKGLHB-LLVKDONJSA-N 1 0 345.226 3.632 20 5 EHBDRO Cc1ncccc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173218375 1132003654 /nfs/dbraw/zinc/00/36/54/1132003654.db2.gz ANOMXACYSIRVLM-DJJJIMSYSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](Oc2ccccc2)C1 ZINC001173226389 1132006589 /nfs/dbraw/zinc/00/65/89/1132006589.db2.gz JIWICESRZUYSAP-HNAYVOBHSA-N 1 0 326.396 3.679 20 5 EHBDRO CCCCCC[NH+]1CCN([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173226402 1132007197 /nfs/dbraw/zinc/00/71/97/1132007197.db2.gz JRVJHLHPMMUFQN-QGZVFWFLSA-N 1 0 333.476 3.724 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCO[C@H](c2ccccc2)C1 ZINC001173227871 1132008466 /nfs/dbraw/zinc/00/84/66/1132008466.db2.gz SFKVVKZDQFDNCA-BEFAXECRSA-N 1 0 326.396 3.599 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)Cc1nc2ccccc2o1 ZINC001173231721 1132008946 /nfs/dbraw/zinc/00/89/46/1132008946.db2.gz CMKYGZACFCBLNC-ZDUSSCGKSA-N 1 0 325.368 3.799 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1C[C@H]([NH3+])C2 ZINC001173235493 1132010694 /nfs/dbraw/zinc/01/06/94/1132010694.db2.gz UDUVRFHFIPPALM-UKRRQHHQSA-N 1 0 335.407 3.779 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cc(C(F)(F)F)ccn1 ZINC001173235412 1132010848 /nfs/dbraw/zinc/01/08/48/1132010848.db2.gz SPBUUJBMBTVSLK-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)c1ccc2c(c1)OCCO2 ZINC001173210062 1132012907 /nfs/dbraw/zinc/01/29/07/1132012907.db2.gz HKSYQPFEJRHBTL-KBPBESRZSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC001173214430 1132014769 /nfs/dbraw/zinc/01/47/69/1132014769.db2.gz BUMKEZVDIZHFOB-HNNXBMFYSA-N 1 0 336.395 3.501 20 5 EHBDRO CCC[N@@H+](Cc1ccc(F)cc1)Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000746034548 1132351113 /nfs/dbraw/zinc/35/11/13/1132351113.db2.gz UTSCXCRAKHIRGE-UHFFFAOYSA-N 1 0 342.374 3.953 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@H]2CCc3c2cccc3OC(F)(F)F)C1 ZINC001168978233 1132618089 /nfs/dbraw/zinc/61/80/89/1132618089.db2.gz QCYBTWKFCAAHMJ-GYSYKLTISA-N 1 0 344.333 3.608 20 5 EHBDRO CC(C)([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1Br ZINC001168978658 1132618515 /nfs/dbraw/zinc/61/85/15/1132618515.db2.gz UBCHZXFDNJQYBD-NWDGAFQWSA-N 1 0 341.249 3.719 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccncc1 ZINC001168958867 1132620223 /nfs/dbraw/zinc/62/02/23/1132620223.db2.gz QNBHUNSISRCSCI-KVSKMBFKSA-N 1 0 325.412 3.514 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC001168970164 1132622610 /nfs/dbraw/zinc/62/26/10/1132622610.db2.gz GUJNUFAWTACHMM-NWDGAFQWSA-N 1 0 334.363 3.834 20 5 EHBDRO [NH2+]=C(N[C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1cc(C(F)(F)F)ccc1Cl ZINC001168997905 1132627808 /nfs/dbraw/zinc/62/78/08/1132627808.db2.gz GJIPVCRLXAKHFC-PSASIEDQSA-N 1 0 349.740 3.719 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC3(CCCc4ccccc43)CC2)C1 ZINC001169010051 1132631632 /nfs/dbraw/zinc/63/16/32/1132631632.db2.gz AOABSPZCUPCVTO-FUHWJXTLSA-N 1 0 328.456 3.802 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CC[C@@H](C[N+](=O)[O-])C3)cc2)cc1 ZINC001168986750 1132633641 /nfs/dbraw/zinc/63/36/41/1132633641.db2.gz YYYFULWHEGITOK-APWZRJJASA-N 1 0 340.423 3.897 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccccc1C(F)(F)F ZINC001168990402 1132634471 /nfs/dbraw/zinc/63/44/71/1132634471.db2.gz CIQAIXNNSIHELO-RYUDHWBXSA-N 1 0 330.350 3.976 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3c2cccc3F)C1 ZINC001169042039 1132637960 /nfs/dbraw/zinc/63/79/60/1132637960.db2.gz CQNGNDFPYPTFBP-DZGCQCFKSA-N 1 0 345.418 3.865 20 5 EHBDRO CC[N@H+](Cc1ccc(C(F)(F)F)cc1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169046721 1132641636 /nfs/dbraw/zinc/64/16/36/1132641636.db2.gz MGIQHAOMOMFCIQ-UKRRQHHQSA-N 1 0 330.350 3.973 20 5 EHBDRO C[C@@H](c1ccc(Br)cc1)[N@H+](C)[C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001169055405 1132644446 /nfs/dbraw/zinc/64/44/46/1132644446.db2.gz PXDFNMORLFYEOR-HUBLWGQQSA-N 1 0 341.249 3.887 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1OC ZINC001175522106 1132698252 /nfs/dbraw/zinc/69/82/52/1132698252.db2.gz CUQJUJZJEGGHOW-QGZVFWFLSA-N 1 0 344.411 3.895 20 5 EHBDRO CCC1(CC)CC[NH+]([C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169430841 1132761638 /nfs/dbraw/zinc/76/16/38/1132761638.db2.gz IHMOGCWKBHOUSB-CQSZACIVSA-N 1 0 333.432 3.824 20 5 EHBDRO COc1cc([N+](=O)[O-])c(N2CCC[C@H]([NH3+])c3cc(C)ccc32)cc1F ZINC001169697595 1132823875 /nfs/dbraw/zinc/82/38/75/1132823875.db2.gz OBCXJLZNDJVWIS-AWEZNQCLSA-N 1 0 345.374 3.983 20 5 EHBDRO COc1ccc(Nc2c[nH+]ccc2N2CCCCC2)cc1[N+](=O)[O-] ZINC001176363860 1132922297 /nfs/dbraw/zinc/92/22/97/1132922297.db2.gz RKDLBDJWPHAVDB-UHFFFAOYSA-N 1 0 328.372 3.732 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc(N)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000804345769 1132928527 /nfs/dbraw/zinc/92/85/27/1132928527.db2.gz NIOZNFQGVWGSAO-KRWDZBQOSA-N 1 0 342.443 3.542 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cn1nc(C)c2cc([N+](=O)[O-])cnc21 ZINC000767762593 1133049022 /nfs/dbraw/zinc/04/90/22/1133049022.db2.gz IZLCKWBJZUCAEW-BLLLJJGKSA-N 1 0 331.420 3.506 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000767943608 1133074012 /nfs/dbraw/zinc/07/40/12/1133074012.db2.gz ZPZLAXRSWLCVHC-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@@H](C[C@H]2CCOC2)C1 ZINC000773699594 1133091128 /nfs/dbraw/zinc/09/11/28/1133091128.db2.gz IAJNUQAHLUBJJK-UONOGXRCSA-N 1 0 338.835 3.887 20 5 EHBDRO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc1F ZINC000768199347 1133105858 /nfs/dbraw/zinc/10/58/58/1133105858.db2.gz HEWGQNBZEWLRCY-FNORWQNLSA-N 1 0 330.359 3.888 20 5 EHBDRO Cc1cc(Br)ccc1C[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC001178611419 1133185552 /nfs/dbraw/zinc/18/55/52/1133185552.db2.gz ZFDDWPLZUHUBMX-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@H](CO)c1ccc(Cl)cc1 ZINC001179507083 1133257529 /nfs/dbraw/zinc/25/75/29/1133257529.db2.gz OLFQYPDINKLUJB-HNNXBMFYSA-N 1 0 348.830 3.731 20 5 EHBDRO CCOc1ccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC001179685325 1133270556 /nfs/dbraw/zinc/27/05/56/1133270556.db2.gz KCHOAXIPXZNWHK-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO COc1c(O)ccc(CN2CCC[C@@H]2c2ccc(F)cc2)c1[N+](=O)[O-] ZINC001180513298 1133379971 /nfs/dbraw/zinc/37/99/71/1133379971.db2.gz BOCMBFSSJLVOBS-OAHLLOKOSA-N 1 0 346.358 3.785 20 5 EHBDRO CCC[NH+](CCC)CCCC(=O)N1CCc2cc(C)c([N+](=O)[O-])cc21 ZINC000773996049 1133586893 /nfs/dbraw/zinc/58/68/93/1133586893.db2.gz IKIILYPOXOCQAK-UHFFFAOYSA-N 1 0 347.459 3.695 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@H](O)c1cccc(F)c1 ZINC000774258980 1133647411 /nfs/dbraw/zinc/64/74/11/1133647411.db2.gz PLIQGSZWYIZHLP-RQUSPXKASA-N 1 0 344.386 3.823 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1COC2(CCCC2)O1)c1cccc([N+](=O)[O-])c1 ZINC000774480629 1133687275 /nfs/dbraw/zinc/68/72/75/1133687275.db2.gz WXGIIFHFKJWFPD-SJORKVTESA-N 1 0 334.416 3.711 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000774517570 1133702748 /nfs/dbraw/zinc/70/27/48/1133702748.db2.gz HNBGPFDUYJUPOT-DAYGRLMNSA-N 1 0 347.459 3.583 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COc2cc(F)ccc2C1 ZINC001182960480 1133752055 /nfs/dbraw/zinc/75/20/55/1133752055.db2.gz RZDYKXUBHWXLEI-GUYCJALGSA-N 1 0 344.386 3.648 20 5 EHBDRO C[C@H](CCNCc1ccc(-c2ccccc2[N+](=O)[O-])s1)[NH+](C)C ZINC001203270810 1133899972 /nfs/dbraw/zinc/89/99/72/1133899972.db2.gz OZHYQBVAOMWFHJ-CYBMUJFWSA-N 1 0 333.457 3.753 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925739 1134006443 /nfs/dbraw/zinc/00/64/43/1134006443.db2.gz CVJODBUBEIIZLT-KKUMJFAQSA-N 1 0 335.423 3.884 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c([N+](=O)[O-])c1 ZINC000774886693 1134099725 /nfs/dbraw/zinc/09/97/25/1134099725.db2.gz WQZYZXGKELZWTA-KRWDZBQOSA-N 1 0 331.372 3.825 20 5 EHBDRO C[C@@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788542548 1134140138 /nfs/dbraw/zinc/14/01/38/1134140138.db2.gz NVGOWGSOJQDHFE-GFCCVEGCSA-N 1 0 329.375 3.699 20 5 EHBDRO Cc1ccc(OCCCC[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788541491 1134140429 /nfs/dbraw/zinc/14/04/29/1134140429.db2.gz DJTSJMRLBCWPQW-HNNXBMFYSA-N 1 0 343.427 3.995 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000788575969 1134146856 /nfs/dbraw/zinc/14/68/56/1134146856.db2.gz INPGIBXGHYKTFB-ZWKOTPCHSA-N 1 0 326.396 3.640 20 5 EHBDRO CC(C)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000788795628 1134170217 /nfs/dbraw/zinc/17/02/17/1134170217.db2.gz AOYODKVMERTDQM-AGRHKRQWSA-N 1 0 343.427 3.586 20 5 EHBDRO CC(C)Oc1ccccc1[C@@H](C)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774981596 1134176431 /nfs/dbraw/zinc/17/64/31/1134176431.db2.gz RASXMRULHYRVOE-KDOFPFPSSA-N 1 0 344.411 3.766 20 5 EHBDRO Nc1cc(CCCCNc2ccc3ncccc3c2[N+](=O)[O-])cc[nH+]1 ZINC001187739751 1134378612 /nfs/dbraw/zinc/37/86/12/1134378612.db2.gz HSXCCMBVSWLOPM-UHFFFAOYSA-N 1 0 337.383 3.555 20 5 EHBDRO CCOCOc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000791000423 1134491100 /nfs/dbraw/zinc/49/11/00/1134491100.db2.gz VMMXGQNBYLKPBD-UHFFFAOYSA-N 1 0 330.384 3.566 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1cccc(C)c1)CC(C)C ZINC001190559726 1134718799 /nfs/dbraw/zinc/71/87/99/1134718799.db2.gz CLUJQILFNFKWEJ-UHFFFAOYSA-N 1 0 330.432 3.566 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297961 1134737897 /nfs/dbraw/zinc/73/78/97/1134737897.db2.gz WVCQDKLENOLGFN-FZKQIMNGSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C)c(C)c2)c([N+](=O)[O-])c1 ZINC001170298567 1134738324 /nfs/dbraw/zinc/73/83/24/1134738324.db2.gz MMHCICLDYIRFDU-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2cccnc2)C2CC2)c([N+](=O)[O-])c1 ZINC001170318946 1134746231 /nfs/dbraw/zinc/74/62/31/1134746231.db2.gz SYCITEZXIIWNRJ-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC001170316945 1134746675 /nfs/dbraw/zinc/74/66/75/1134746675.db2.gz AMZDNGISFFZBMG-CYBMUJFWSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CC[C@H](C)C(F)(F)CC2)c([N+](=O)[O-])c1 ZINC001170326685 1134748568 /nfs/dbraw/zinc/74/85/68/1134748568.db2.gz BOOOAQJSJARJMU-STQMWFEESA-N 1 0 342.386 3.902 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170352653 1134753764 /nfs/dbraw/zinc/75/37/64/1134753764.db2.gz PLYQPANNDFNPRP-CYBMUJFWSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc(C[C@H](C)[N@H+](C)CCc2cccs2)c([N+](=O)[O-])c1 ZINC001170344568 1134758857 /nfs/dbraw/zinc/75/88/57/1134758857.db2.gz CACMSPWHFXVWID-ZDUSSCGKSA-N 1 0 334.441 3.770 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069303 1134786545 /nfs/dbraw/zinc/78/65/45/1134786545.db2.gz GLVOZPMMMNVWSN-VXGBXAGGSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@]2(C)[C@@H](C1)C2(Cl)Cl ZINC000793617788 1134973671 /nfs/dbraw/zinc/97/36/71/1134973671.db2.gz SJJYBPHZGGRKIO-KGLIPLIRSA-N 1 0 329.227 3.919 20 5 EHBDRO C[NH+](C)CCOc1ccccc1CNc1cc(Cl)ccc1[N+](=O)[O-] ZINC000804393324 1135054347 /nfs/dbraw/zinc/05/43/47/1135054347.db2.gz HXHBHPUPFACEIO-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000804784284 1135200541 /nfs/dbraw/zinc/20/05/41/1135200541.db2.gz ZMCVOHGOQVPRDR-SMDDNHRTSA-N 1 0 348.359 3.637 20 5 EHBDRO CCCCCC[NH+]1CCN(c2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC001193989032 1135211819 /nfs/dbraw/zinc/21/18/19/1135211819.db2.gz JMKPTIWQFMNBJO-UHFFFAOYSA-N 1 0 335.448 3.696 20 5 EHBDRO C[C@H](C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)CO)c1ccccc1 ZINC000805820425 1135335429 /nfs/dbraw/zinc/33/54/29/1135335429.db2.gz MWUOZQFAGVZJGL-CABCVRRESA-N 1 0 346.402 3.720 20 5 EHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC001196175108 1135527202 /nfs/dbraw/zinc/52/72/02/1135527202.db2.gz FPEAMPJZLSRXNM-HUUCEWRRSA-N 1 0 333.432 3.742 20 5 EHBDRO C[N@H+]1CC=C(CNc2cc(Cl)c(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000775700242 1135532513 /nfs/dbraw/zinc/53/25/13/1135532513.db2.gz JHYRHIGITRUNBV-UHFFFAOYSA-N 1 0 349.740 3.941 20 5 EHBDRO C[N@@H+](C/C=C/c1ccccc1[N+](=O)[O-])CCc1ccccc1[N+](=O)[O-] ZINC000809689320 1135871759 /nfs/dbraw/zinc/87/17/59/1135871759.db2.gz XPMSDRWAVJGPJO-RMKNXTFCSA-N 1 0 341.367 3.691 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCN(c3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC001201635124 1136045306 /nfs/dbraw/zinc/04/53/06/1136045306.db2.gz YQUMPCOBWRDQQU-INIZCTEOSA-N 1 0 345.830 3.925 20 5 EHBDRO CC(C)[C@H]1C[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001201692458 1136057185 /nfs/dbraw/zinc/05/71/85/1136057185.db2.gz AJVSCKVJEGZGCQ-GDBMZVCRSA-N 1 0 326.824 3.584 20 5 EHBDRO CC[C@H](C)[C@@](C)(O)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811479552 1136097619 /nfs/dbraw/zinc/09/76/19/1136097619.db2.gz HVRXDBQZIDHSQR-XPTSAGLGSA-N 1 0 335.231 3.788 20 5 EHBDRO C[N@@H+](Cc1ccc2ccccc2c1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271500 1136121493 /nfs/dbraw/zinc/12/14/93/1136121493.db2.gz LQTHGYVYBRJBAR-FQEVSTJZSA-N 1 0 336.391 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCc2ccc3ccccc3c2)cc1 ZINC000776273958 1136128304 /nfs/dbraw/zinc/12/83/04/1136128304.db2.gz BSRXMAJMDJDVCD-FQEVSTJZSA-N 1 0 336.391 3.614 20 5 EHBDRO CC(C)[C@H](C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000776274505 1136129478 /nfs/dbraw/zinc/12/94/78/1136129478.db2.gz DMQNEWCOWRLMOS-RBUKOAKNSA-N 1 0 328.412 3.658 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000776280110 1136135326 /nfs/dbraw/zinc/13/53/26/1136135326.db2.gz ZVIKIQHRUIEEBB-MOPGFXCFSA-N 1 0 326.396 3.774 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H](C)[C@H](O)c1ccccc1 ZINC000812847510 1136259720 /nfs/dbraw/zinc/25/97/20/1136259720.db2.gz DSJZYOMGWITDER-ACJLOTCBSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812851549 1136261171 /nfs/dbraw/zinc/26/11/71/1136261171.db2.gz SMMDYKIBYGWRCN-ACJLOTCBSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[C@@H]1c2ccccc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776582926 1136442480 /nfs/dbraw/zinc/44/24/80/1136442480.db2.gz DHHYJAJJTFQEHK-MOPGFXCFSA-N 1 0 326.396 3.638 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H](Cc3ccccc3)C2)cc1 ZINC000776582423 1136442591 /nfs/dbraw/zinc/44/25/91/1136442591.db2.gz QAGBUAICFGHAOT-PXNSSMCTSA-N 1 0 340.423 3.583 20 5 EHBDRO CC[C@H](C)[N@@H+](Cc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579239 1136444208 /nfs/dbraw/zinc/44/42/08/1136444208.db2.gz KAYKLDLKDFZHPI-KXBFYZLASA-N 1 0 328.412 3.929 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000776591249 1136451171 /nfs/dbraw/zinc/45/11/71/1136451171.db2.gz IETFKUXXOIPIBY-MOPGFXCFSA-N 1 0 344.386 3.995 20 5 EHBDRO COc1cc(C[NH2+][C@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000217094899 1136487682 /nfs/dbraw/zinc/48/76/82/1136487682.db2.gz KESMQSQQKAEEOT-PWSUYJOCSA-N 1 0 344.358 3.873 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666337 1136491818 /nfs/dbraw/zinc/49/18/18/1136491818.db2.gz GMGJIIKVNURMBM-QAPCUYQASA-N 1 0 346.814 3.771 20 5 EHBDRO C[C@@H]1CCCN(c2ccc(C(F)F)cc2[N+](=O)[O-])[C@@H]1CCC[NH3+] ZINC000853015617 1136498653 /nfs/dbraw/zinc/49/86/53/1136498653.db2.gz AIWOSSPBINPGTK-DGCLKSJQSA-N 1 0 327.375 3.876 20 5 EHBDRO Cc1cccc2c1CCC[C@H]2[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000853126084 1136512452 /nfs/dbraw/zinc/51/24/52/1136512452.db2.gz AHALUVLNYBODHI-RTBURBONSA-N 1 0 326.396 3.604 20 5 EHBDRO C[C@H]([NH2+]CCCO[C@@H](C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815554508 1136609827 /nfs/dbraw/zinc/60/98/27/1136609827.db2.gz AXNXQLBBGFINOV-GJZGRUSLSA-N 1 0 343.427 3.996 20 5 EHBDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCCC1 ZINC000815589591 1136615949 /nfs/dbraw/zinc/61/59/49/1136615949.db2.gz YAEMOCKQNIJNAA-CQSZACIVSA-N 1 0 335.448 3.815 20 5 EHBDRO CCc1cccc2c1OCC[C@@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815591287 1136615959 /nfs/dbraw/zinc/61/59/59/1136615959.db2.gz BZVHHWIDHYAFIU-SJCJKPOMSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@H]([NH2+]Cc1cc2c(s1)CCCC2)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570303 1136617407 /nfs/dbraw/zinc/61/74/07/1136617407.db2.gz YPMHLHKKHDMPEA-NSHDSACASA-N 1 0 331.441 3.968 20 5 EHBDRO COc1ccccc1C(C)(C)C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815572010 1136617937 /nfs/dbraw/zinc/61/79/37/1136617937.db2.gz RZLBMBZRSXUKDA-CYBMUJFWSA-N 1 0 343.427 3.814 20 5 EHBDRO Cc1nn(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCCC[C@@H]32)cc1[N+](=O)[O-] ZINC000776774782 1136661190 /nfs/dbraw/zinc/66/11/90/1136661190.db2.gz OKJBUSBDADPSKT-KURKYZTESA-N 1 0 340.427 3.715 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2ncsc2c1 ZINC000776816417 1136706997 /nfs/dbraw/zinc/70/69/97/1136706997.db2.gz RRZVSGOMBMMOPG-BDJLRTHQSA-N 1 0 343.408 3.589 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN(c2ccccc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173316999 1136745501 /nfs/dbraw/zinc/74/55/01/1136745501.db2.gz KIVYZPGADGTVRD-JKSUJKDBSA-N 1 0 325.412 3.772 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818985156 1136897312 /nfs/dbraw/zinc/89/73/12/1136897312.db2.gz PODMFJGNJIXXTF-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1cccc(C(C)(C)C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818985155 1136897350 /nfs/dbraw/zinc/89/73/50/1136897350.db2.gz PODMFJGNJIXXTF-GOSISDBHSA-N 1 0 328.412 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1COC2(CCCCCC2)O1 ZINC000776958652 1136904494 /nfs/dbraw/zinc/90/44/94/1136904494.db2.gz FACJCYFDVFYDIU-NBEHIINDSA-N 1 0 346.427 3.664 20 5 EHBDRO Cc1oc2ccccc2c1CC[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819234729 1136927443 /nfs/dbraw/zinc/92/74/43/1136927443.db2.gz ZXJCTHPAIIEUAH-SFHVURJKSA-N 1 0 340.379 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@@H]2c2ccccc2)cc1 ZINC000819340209 1136932871 /nfs/dbraw/zinc/93/28/71/1136932871.db2.gz SXMNPHMNWVZHPT-DFQSSKMNSA-N 1 0 340.423 3.802 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000819314503 1136934454 /nfs/dbraw/zinc/93/44/54/1136934454.db2.gz DJEOPHMBJKCWQK-OALUTQOASA-N 1 0 326.396 3.604 20 5 EHBDRO C[NH+]1CCC2(CCN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)C2)CC1 ZINC000820580689 1136998267 /nfs/dbraw/zinc/99/82/67/1136998267.db2.gz AZIKMAMYRDWULT-UHFFFAOYSA-N 1 0 344.242 3.824 20 5 EHBDRO Cc1ccc([C@@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822232 1137006026 /nfs/dbraw/zinc/00/60/26/1137006026.db2.gz IKQVZAQEQWCJJD-PNFOFYCQSA-N 1 0 329.444 3.712 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CCC[C@](O)(c2ccccc2)C1 ZINC000859585273 1137021473 /nfs/dbraw/zinc/02/14/73/1137021473.db2.gz MMZIJTMMDVNQFC-HNAYVOBHSA-N 1 0 326.396 3.639 20 5 EHBDRO C[N@@H+]1CCCC[C@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481995 1137146443 /nfs/dbraw/zinc/14/64/43/1137146443.db2.gz CFEWSYSUCVMEJH-LLVKDONJSA-N 1 0 346.258 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)c1 ZINC000824696055 1137148767 /nfs/dbraw/zinc/14/87/67/1137148767.db2.gz GWWMZPCYPOIPOE-DJIMGWMZSA-N 1 0 338.835 3.764 20 5 EHBDRO CC(C)[C@H]1C[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)CCO1 ZINC000824798235 1137152760 /nfs/dbraw/zinc/15/27/60/1137152760.db2.gz ACBNPYFEJVQBBT-MLGOLLRUSA-N 1 0 326.824 3.789 20 5 EHBDRO Cc1cc([N+](=O)[O-])cc(-n2c3ccccc3c3c2C[C@H]([NH3+])CC3)c1F ZINC001171097883 1137194539 /nfs/dbraw/zinc/19/45/39/1137194539.db2.gz DTPYWJWRLMFAJK-GFCCVEGCSA-N 1 0 339.370 3.802 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2CCO[C@H]2c2ccccc2)ccc1Cl ZINC000865650357 1137301550 /nfs/dbraw/zinc/30/15/50/1137301550.db2.gz JBZOLQFVUAOBGQ-WBVHZDCISA-N 1 0 332.787 3.868 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CCCCNc1ccccn1 ZINC000866255885 1137340113 /nfs/dbraw/zinc/34/01/13/1137340113.db2.gz DDNCMLCZHFASSQ-AWEZNQCLSA-N 1 0 346.406 3.542 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H](C)[C@@](C)(O)c2ccccc2)cc1[N+](=O)[O-] ZINC000846187188 1137340804 /nfs/dbraw/zinc/34/08/04/1137340804.db2.gz JSDZWXNSMNFWTE-QMTMVMCOSA-N 1 0 328.412 3.850 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@](C)(O)c1ccccc1 ZINC000846191804 1137340964 /nfs/dbraw/zinc/34/09/64/1137340964.db2.gz ZGZPNLMXKPDQDD-KHYOSLBOSA-N 1 0 328.412 3.850 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(F)c1 ZINC000866473630 1137357738 /nfs/dbraw/zinc/35/77/38/1137357738.db2.gz OWTXNGLTQMGKBO-CYBMUJFWSA-N 1 0 335.404 3.789 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC12CCOCC2 ZINC000866528893 1137361554 /nfs/dbraw/zinc/36/15/54/1137361554.db2.gz JZWWLRHKCSKTEZ-RDJZCZTQSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1CCC12CCOCC2)C1CC1 ZINC000866529749 1137361619 /nfs/dbraw/zinc/36/16/19/1137361619.db2.gz SABPYSWBBKYHBH-QZTJIDSGSA-N 1 0 344.455 3.712 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])cc1[N+](=O)[O-] ZINC000866539927 1137363231 /nfs/dbraw/zinc/36/32/31/1137363231.db2.gz HVLMJEMTQACRIA-HNNXBMFYSA-N 1 0 327.340 3.589 20 5 EHBDRO C[C@@H]1CC[C@](CO)([N@H+](C)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339100776 1137484639 /nfs/dbraw/zinc/48/46/39/1137484639.db2.gz VCGUXVDPVGHTRM-ABAIWWIYSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]C2(c3ccccc3F)CCC2)cc1 ZINC001171523459 1137496295 /nfs/dbraw/zinc/49/62/95/1137496295.db2.gz OUTYEUWQIHUWGM-UHFFFAOYSA-N 1 0 330.359 3.782 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038695 1137566951 /nfs/dbraw/zinc/56/69/51/1137566951.db2.gz OZMBRPKQGUDYRT-UKRRQHHQSA-N 1 0 332.375 3.551 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCC(C)(C)CO ZINC000872040276 1137567120 /nfs/dbraw/zinc/56/71/20/1137567120.db2.gz ZDCLUTCTUCOYQB-GFCCVEGCSA-N 1 0 326.462 3.766 20 5 EHBDRO Cc1ccc([C@H](O)[C@@H](C)[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])cc1 ZINC000872071396 1137569537 /nfs/dbraw/zinc/56/95/37/1137569537.db2.gz OLXMXHOWNFZBJX-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1c(C[NH2+][C@@H](c2ccccc2)[C@H]2CCCO2)cccc1[N+](=O)[O-] ZINC000873028435 1137588429 /nfs/dbraw/zinc/58/84/29/1137588429.db2.gz MGCBEJVKDQHJFV-MOPGFXCFSA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](C[C@H](C)O)c2ccccc2)cccc1[N+](=O)[O-] ZINC000873080050 1137589654 /nfs/dbraw/zinc/58/96/54/1137589654.db2.gz ZYNNZZSBBDWYOS-KBXCAEBGSA-N 1 0 328.412 3.548 20 5 EHBDRO COc1cc(C[N@H+](C)Cc2c(C)ccc([N+](=O)[O-])c2C)ccc1O ZINC000876562760 1137655520 /nfs/dbraw/zinc/65/55/20/1137655520.db2.gz SQIOYNNZKZOGEZ-UHFFFAOYSA-N 1 0 330.384 3.558 20 5 EHBDRO CC(C)C[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000876884518 1137664597 /nfs/dbraw/zinc/66/45/97/1137664597.db2.gz KQAARQFBVSYENR-HTWSVDAQSA-N 1 0 328.416 3.872 20 5 EHBDRO Cc1c2ccccc2oc1[C@H](C)[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000876944488 1137665908 /nfs/dbraw/zinc/66/59/08/1137665908.db2.gz MGCQGRHTMRBYLJ-HSBZDZAISA-N 1 0 340.383 3.900 20 5 EHBDRO CC[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1F ZINC000877050987 1137668759 /nfs/dbraw/zinc/66/87/59/1137668759.db2.gz QFFAKHAXDSRZQY-ZEPSKSRBSA-N 1 0 336.342 3.514 20 5 EHBDRO CC1CCC([N@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1 ZINC000877919713 1137695727 /nfs/dbraw/zinc/69/57/27/1137695727.db2.gz VEKAOGWYJQYAER-UHFFFAOYSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@@H]2C2CCCC2)o1 ZINC000877986061 1137698432 /nfs/dbraw/zinc/69/84/32/1137698432.db2.gz KILVPSYZPCFXLG-OAHLLOKOSA-N 1 0 342.399 3.799 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878124654 1137703439 /nfs/dbraw/zinc/70/34/39/1137703439.db2.gz JUPLQOMQXSOAII-ZDUSSCGKSA-N 1 0 330.388 3.799 20 5 EHBDRO C[C@@H]1C[C@H](C)C[N@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878127042 1137703463 /nfs/dbraw/zinc/70/34/63/1137703463.db2.gz XFIXYFZREWFYDK-VHSXEESVSA-N 1 0 336.779 3.529 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])ccc1C ZINC000878372665 1137713301 /nfs/dbraw/zinc/71/33/01/1137713301.db2.gz FSARKKVCOVCAGD-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878428000 1137715461 /nfs/dbraw/zinc/71/54/61/1137715461.db2.gz PLTZDNDLXKBKFI-ZDUSSCGKSA-N 1 0 330.388 3.799 20 5 EHBDRO CC[C@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CC1(C)C ZINC000878717752 1137726100 /nfs/dbraw/zinc/72/61/00/1137726100.db2.gz HMOVDFAQZNHOBT-OLZOCXBDSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CC1(C)C ZINC000878717753 1137726232 /nfs/dbraw/zinc/72/62/32/1137726232.db2.gz HMOVDFAQZNHOBT-QWHCGFSZSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[C@H]([NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1)C1CC1 ZINC000878950671 1137733305 /nfs/dbraw/zinc/73/33/05/1137733305.db2.gz XIEBKVKEQRMEPN-LBPRGKRZSA-N 1 0 336.779 3.576 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@@]12C[C@@H]1CCCC2 ZINC000879262970 1137742819 /nfs/dbraw/zinc/74/28/19/1137742819.db2.gz KPKSDKMCMVFANR-XAYKYTGQSA-N 1 0 342.399 3.703 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012606 1137765474 /nfs/dbraw/zinc/76/54/74/1137765474.db2.gz VQNXSDMAYHSVMH-AWEZNQCLSA-N 1 0 347.440 3.748 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC000882818053 1137835055 /nfs/dbraw/zinc/83/50/55/1137835055.db2.gz ZTPLSCOKVVMCET-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])cc2C(F)F)CC1 ZINC000884716628 1137970791 /nfs/dbraw/zinc/97/07/91/1137970791.db2.gz DHRDJKVKSSYVJH-UHFFFAOYSA-N 1 0 339.386 3.987 20 5 EHBDRO CC[N@@H+](Cc1ccc(Cl)s1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136891825 1138043918 /nfs/dbraw/zinc/04/39/18/1138043918.db2.gz LSQYWOWBFJVGMB-AWEZNQCLSA-N 1 0 340.832 3.865 20 5 EHBDRO C[C@H](c1ccccc1Cl)[N@H+](C)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136962748 1138044482 /nfs/dbraw/zinc/04/44/82/1138044482.db2.gz DWOLRLGBZNDWPL-PXAZEXFGSA-N 1 0 334.803 3.975 20 5 EHBDRO C[C@@H]1CS(=O)(=O)C[C@@H]1[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000886295743 1138064967 /nfs/dbraw/zinc/06/49/67/1138064967.db2.gz KBPPNKAQGRBPDJ-VLIAUNLRSA-N 1 0 339.460 3.516 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000886710556 1138122164 /nfs/dbraw/zinc/12/21/64/1138122164.db2.gz AFIHJUNNKYKULV-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO COc1cc(C[NH2+]C2(C3CC3)CCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000887145271 1138222373 /nfs/dbraw/zinc/22/23/73/1138222373.db2.gz WEAMCNJQJFABFQ-UHFFFAOYSA-N 1 0 342.342 3.627 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CCOCC1 ZINC000130521122 1138459967 /nfs/dbraw/zinc/45/99/67/1138459967.db2.gz BEWGPCRDPQMALN-QGPMSJSTSA-N 1 0 332.444 3.711 20 5 EHBDRO CC[N@@H+]1CCCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000264645663 1138589459 /nfs/dbraw/zinc/58/94/59/1138589459.db2.gz RKEBGKYWYYDEBL-UHFFFAOYSA-N 1 0 333.435 3.556 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC(C)=C(c2ccco2)C1 ZINC000338358432 1138854463 /nfs/dbraw/zinc/85/44/63/1138854463.db2.gz NVPBOSFAYMPADU-UHFFFAOYSA-N 1 0 328.368 3.876 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000152548763 1139097500 /nfs/dbraw/zinc/09/75/00/1139097500.db2.gz YUAZSTFBXLDNTQ-LBPRGKRZSA-N 1 0 344.367 3.573 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152567520 1139098569 /nfs/dbraw/zinc/09/85/69/1139098569.db2.gz DLFSYRJRHSKTGE-CVEARBPZSA-N 1 0 325.412 3.772 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCn2nc(C)cc2C)cc1[N+](=O)[O-] ZINC000152597553 1139099465 /nfs/dbraw/zinc/09/94/65/1139099465.db2.gz OASWTTVLSVSBGM-HNNXBMFYSA-N 1 0 346.431 3.548 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccccc2COC)cc1[N+](=O)[O-] ZINC000152715179 1139105206 /nfs/dbraw/zinc/10/52/06/1139105206.db2.gz XIOKMLNQACDYAB-AWEZNQCLSA-N 1 0 344.411 3.991 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000152743557 1139106120 /nfs/dbraw/zinc/10/61/20/1139106120.db2.gz NXZPLSONPVDFBG-PXAZEXFGSA-N 1 0 348.374 3.517 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccccc2O)cc1[N+](=O)[O-] ZINC000153484479 1139138608 /nfs/dbraw/zinc/13/86/08/1139138608.db2.gz GAKUPQFLZNYFCK-CYBMUJFWSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H](O)C[C@H]1CCC[N@@H+]1Cc1cc(=O)oc2ccc3ccccc3c12 ZINC000179102193 1139734933 /nfs/dbraw/zinc/73/49/33/1139734933.db2.gz VGSZZPLDRXVUBH-WMLDXEAASA-N 1 0 337.419 3.682 20 5 EHBDRO COC(=O)CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000180674088 1139855192 /nfs/dbraw/zinc/85/51/92/1139855192.db2.gz VNTNPQGYUWNCSN-KDOFPFPSSA-N 1 0 342.395 3.940 20 5 EHBDRO C[C@H](O)[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867720 1139869266 /nfs/dbraw/zinc/86/92/66/1139869266.db2.gz XWODQLCQXLMUMB-JSGCOSHPSA-N 1 0 332.425 3.526 20 5 EHBDRO CC(C)OC(=O)C[C@@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000181821567 1139934460 /nfs/dbraw/zinc/93/44/60/1139934460.db2.gz LKDYKKHEAURBDG-GOSISDBHSA-N 1 0 342.395 3.767 20 5 EHBDRO COC(=O)c1cccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181839746 1139935672 /nfs/dbraw/zinc/93/56/72/1139935672.db2.gz VMYSLTYSMIPTCK-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO CC1(C)OCc2cc(C[NH2+]Cc3ccccc3[N+](=O)[O-])ccc2O1 ZINC000186366971 1140200334 /nfs/dbraw/zinc/20/03/34/1140200334.db2.gz STEGDYIFNMXADM-UHFFFAOYSA-N 1 0 328.368 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCSC2(CCOCC2)C1 ZINC000186841767 1140224662 /nfs/dbraw/zinc/22/46/62/1140224662.db2.gz VCGIJHWYDLYQTO-AWEZNQCLSA-N 1 0 336.457 3.562 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2cc(F)ccc2[N+](=O)[O-])cc1 ZINC000188381318 1140294557 /nfs/dbraw/zinc/29/45/57/1140294557.db2.gz WOJNMTIWVKFDQQ-UHFFFAOYSA-N 1 0 345.374 3.828 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)C(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000189718067 1140360092 /nfs/dbraw/zinc/36/00/92/1140360092.db2.gz SBPWSUXBNIKUCE-UHFFFAOYSA-N 1 0 348.447 3.551 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000190553325 1140409445 /nfs/dbraw/zinc/40/94/45/1140409445.db2.gz AUBFMBURHFLTLN-UHFFFAOYSA-N 1 0 341.411 3.618 20 5 EHBDRO C[C@H]1CSCC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000190848402 1140421176 /nfs/dbraw/zinc/42/11/76/1140421176.db2.gz AEMSJYNWRJMCDZ-GFCCVEGCSA-N 1 0 349.481 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@H]2c2ccc(F)c(F)c2)cc1 ZINC000192133607 1140505495 /nfs/dbraw/zinc/50/54/95/1140505495.db2.gz RPRSQONPXYFASI-MSOLQXFVSA-N 1 0 348.349 3.535 20 5 EHBDRO CCc1noc(CC)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192945526 1140556690 /nfs/dbraw/zinc/55/66/90/1140556690.db2.gz GCAYHNFEAKBSGW-KRWDZBQOSA-N 1 0 329.400 3.875 20 5 EHBDRO COc1cccc(N2CC[C@H]([NH2+][C@H](C)c3cccc([N+](=O)[O-])c3)C2)c1 ZINC000266851053 1140729969 /nfs/dbraw/zinc/72/99/69/1140729969.db2.gz IWGLTNNEVBNLQB-ZBFHGGJFSA-N 1 0 341.411 3.533 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1C[C@@H](O)c1cccs1 ZINC000267441945 1140791723 /nfs/dbraw/zinc/79/17/23/1140791723.db2.gz IDZVVRPXWQOADD-GOEBONIOSA-N 1 0 332.425 3.744 20 5 EHBDRO CNC(=O)CCC[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268815390 1140998438 /nfs/dbraw/zinc/99/84/38/1140998438.db2.gz KDFCQQANTFLFCX-LBPRGKRZSA-N 1 0 347.440 3.500 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000270020758 1141168569 /nfs/dbraw/zinc/16/85/69/1141168569.db2.gz OKTHIYRHTOCWCI-QGPMSJSTSA-N 1 0 344.411 3.531 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2csc(C)n2)cc1[N+](=O)[O-] ZINC000271113271 1141308854 /nfs/dbraw/zinc/30/88/54/1141308854.db2.gz HSTYUAFARXGNAS-NSHDSACASA-N 1 0 335.429 3.652 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1c(C)noc1C ZINC000271202082 1141324821 /nfs/dbraw/zinc/32/48/21/1141324821.db2.gz ZMRQFEVSIXCTMA-ZDUSSCGKSA-N 1 0 335.429 3.860 20 5 EHBDRO C[C@H](CO)[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)CC1CCC1 ZINC000339144508 1141509414 /nfs/dbraw/zinc/50/94/14/1141509414.db2.gz HFIFWBONYLYJSG-LLVKDONJSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(Br)s2)cc1 ZINC000038018726 213192020 /nfs/dbraw/zinc/19/20/20/213192020.db2.gz DABLPCREFAJWMA-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@H+](CCc2cccc(F)c2)C2CC2)cc1 ZINC000078704983 217105676 /nfs/dbraw/zinc/10/56/76/217105676.db2.gz LEDRJGVTYXKHDM-UHFFFAOYSA-N 1 0 328.387 3.984 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000339408845 1014372362 /nfs/dbraw/zinc/37/23/62/1014372362.db2.gz DTSGLDSPVLBPST-ZIAGYGMSSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc(-n2ccnn2)cc1 ZINC000339408827 1014373428 /nfs/dbraw/zinc/37/34/28/1014373428.db2.gz DTSGLDSPVLBPST-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO CCOc1cc(NC[C@@H](Cc2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471241466 1016011722 /nfs/dbraw/zinc/01/17/22/1016011722.db2.gz PZYHVWKPPBDODM-QGZVFWFLSA-N 1 0 343.427 3.578 20 5 EHBDRO CCOc1cc(NC[C@@H](C2CCCCC2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471254183 1016145152 /nfs/dbraw/zinc/14/51/52/1016145152.db2.gz RPXIKMTWHSPWFY-KRWDZBQOSA-N 1 0 335.448 3.916 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153731 1016506561 /nfs/dbraw/zinc/50/65/61/1016506561.db2.gz BKZUJMQUUZUVBB-KBXCAEBGSA-N 1 0 341.411 3.971 20 5 EHBDRO CC[C@H](C)[N@H+](CCc1ccccc1F)Cc1onc(C)c1[N+](=O)[O-] ZINC001167244549 1016739947 /nfs/dbraw/zinc/73/99/47/1016739947.db2.gz UPZJFGDOCVSHMD-LBPRGKRZSA-N 1 0 335.379 3.874 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])Nc1ccc(C[NH+](C)C)cc1F ZINC000414493588 1016940180 /nfs/dbraw/zinc/94/01/80/1016940180.db2.gz CGDQVMGVMPYARG-ZDUSSCGKSA-N 1 0 331.391 3.839 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCCC13CCOCC3)CCC2 ZINC000376986698 1017236984 /nfs/dbraw/zinc/23/69/84/1017236984.db2.gz TXKGEWDEJGRENK-MSOLQXFVSA-N 1 0 330.428 3.911 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000449092741 1032202092 /nfs/dbraw/zinc/20/20/92/1032202092.db2.gz UBKMEZABGSLWHQ-ZIAGYGMSSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC000449129755 1032225050 /nfs/dbraw/zinc/22/50/50/1032225050.db2.gz WIRISMSYGUVHBJ-LSDHHAIUSA-N 1 0 328.412 3.842 20 5 EHBDRO C[C@@H](CCc1ccc(O)cc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449129753 1032226118 /nfs/dbraw/zinc/22/61/18/1032226118.db2.gz WIRISMSYGUVHBJ-GJZGRUSLSA-N 1 0 328.412 3.842 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N[C@@H](C)CCCC(C)C)cc1[N+](=O)[O-] ZINC000538276640 1032265454 /nfs/dbraw/zinc/26/54/54/1032265454.db2.gz LHNNXHWUCZCBSQ-HOTGVXAUSA-N 1 0 349.475 3.885 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449178101 1032272848 /nfs/dbraw/zinc/27/28/48/1032272848.db2.gz TZRJLHMDEJCFRG-SCLBCKFNSA-N 1 0 332.375 3.642 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593522 1032314395 /nfs/dbraw/zinc/31/43/95/1032314395.db2.gz VOYBOPWMXNVOAE-FZKQIMNGSA-N 1 0 334.416 3.710 20 5 EHBDRO C[C@@H]1CCC[C@@H](C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237496175 1032319136 /nfs/dbraw/zinc/31/91/36/1032319136.db2.gz JTFULGTVBDAEMT-HUUCEWRRSA-N 1 0 342.443 3.911 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cccc(OC)c1 ZINC000536857632 1032354775 /nfs/dbraw/zinc/35/47/75/1032354775.db2.gz JAGPHNWIGRDAHU-SFHVURJKSA-N 1 0 330.384 3.723 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC1 ZINC000459790224 1032476008 /nfs/dbraw/zinc/47/60/08/1032476008.db2.gz GKYKHMIHYKOPKK-OAHLLOKOSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C1(C[NH+](C)C)CCCCC1 ZINC000597667872 1032600251 /nfs/dbraw/zinc/60/02/51/1032600251.db2.gz UEZXLZKZJODIBV-UHFFFAOYSA-N 1 0 333.432 3.662 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)C[C@@H](c1ccccc1)[NH+](C)C ZINC000597668730 1032602766 /nfs/dbraw/zinc/60/27/66/1032602766.db2.gz YTSYLWLSFUXIOO-KRWDZBQOSA-N 1 0 341.411 3.843 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@@H]2CSc3ccccc3O2)c1 ZINC000592372586 1032673868 /nfs/dbraw/zinc/67/38/68/1032673868.db2.gz AEYFUDSNZLSMHQ-OAHLLOKOSA-N 1 0 330.409 3.628 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CCCC3CCOCC3)C2)cc1 ZINC000449501928 1032677431 /nfs/dbraw/zinc/67/74/31/1032677431.db2.gz QKOZPRKALCSZSO-GOSISDBHSA-N 1 0 332.444 3.981 20 5 EHBDRO COc1cc(C)nc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000449504365 1032687131 /nfs/dbraw/zinc/68/71/31/1032687131.db2.gz VVKRQVCHBJSLLK-INIZCTEOSA-N 1 0 341.411 3.686 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2cc(N)ccc21 ZINC000414920345 1017313881 /nfs/dbraw/zinc/31/38/81/1017313881.db2.gz XKHHNEKLWKQPSB-SFHVURJKSA-N 1 0 341.411 3.743 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@H](c2ncc[nH]2)C2CCCCC2)cc1 ZINC000574062114 1032709115 /nfs/dbraw/zinc/70/91/15/1032709115.db2.gz IAISOWFPBSIYNV-KRWDZBQOSA-N 1 0 328.416 3.772 20 5 EHBDRO Cc1cnc(N[C@@H](C[NH+]2CCCCC2)c2ccccc2)c([N+](=O)[O-])c1 ZINC000610284254 1017622049 /nfs/dbraw/zinc/62/20/49/1017622049.db2.gz DWBMCJURVYCAOS-KRWDZBQOSA-N 1 0 340.427 3.937 20 5 EHBDRO CCS[C@@H]1CCCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)C1 ZINC000083171883 1017759089 /nfs/dbraw/zinc/75/90/89/1017759089.db2.gz SBEGXBRTBCSJMD-CYBMUJFWSA-N 1 0 335.429 3.844 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@]1(C)CCO[C@@H]1C1CC1 ZINC000468585258 1017790726 /nfs/dbraw/zinc/79/07/26/1017790726.db2.gz KDPFHVLVXITTGH-AZRNIUEDSA-N 1 0 330.428 3.793 20 5 EHBDRO CC(C)(C)OC1CC[NH+](CCCOc2ccc([N+](=O)[O-])cc2)CC1 ZINC000162294764 1018436084 /nfs/dbraw/zinc/43/60/84/1018436084.db2.gz IZGWJYCNULNRJK-UHFFFAOYSA-N 1 0 336.432 3.643 20 5 EHBDRO CO[C@@H]1CCCC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000593071430 1032766182 /nfs/dbraw/zinc/76/61/82/1032766182.db2.gz WSNPZWPBPLZNLE-ZIAGYGMSSA-N 1 0 332.322 3.661 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)[C@H](C)c2ccccc2)c1[N+](=O)[O-] ZINC000893099339 1018470010 /nfs/dbraw/zinc/47/00/10/1018470010.db2.gz LPSCNUHECWEEGT-QWHCGFSZSA-N 1 0 330.384 3.591 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CC[C@@H](C)C(C)(C)C2)cccc1[N+](=O)[O-] ZINC000545418692 1018534287 /nfs/dbraw/zinc/53/42/87/1018534287.db2.gz PVRXWCUZNLVWMK-CYBMUJFWSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccc([C@H](C)N[C@@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404508 1032776762 /nfs/dbraw/zinc/77/67/62/1032776762.db2.gz ZARRCMMRNNKBKZ-GUYCJALGSA-N 1 0 332.375 3.817 20 5 EHBDRO O=[N+]([O-])c1cnccc1NC[C@@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000310910799 1019090309 /nfs/dbraw/zinc/09/03/09/1019090309.db2.gz QRYXRPZQBONTSX-KRWDZBQOSA-N 1 0 340.427 3.704 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000473513222 1019106001 /nfs/dbraw/zinc/10/60/01/1019106001.db2.gz LMTYGORRDUOODB-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCCOCC(F)(F)F)c2cc([N+](=O)[O-])ccc21 ZINC000580395016 1019262234 /nfs/dbraw/zinc/26/22/34/1019262234.db2.gz XHFMHBZVZOUGFK-CQSZACIVSA-N 1 0 346.349 3.876 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c2nccn21 ZINC000449572025 1032828431 /nfs/dbraw/zinc/82/84/31/1032828431.db2.gz MMCPLGSGKAHPQD-OHFALNGGSA-N 1 0 340.427 3.798 20 5 EHBDRO C[NH2+]CCC1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000261993094 1019510556 /nfs/dbraw/zinc/51/05/56/1019510556.db2.gz FFQAETOPWWSNDI-UHFFFAOYSA-N 1 0 347.462 3.850 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000182954356 1019852724 /nfs/dbraw/zinc/85/27/24/1019852724.db2.gz BYTQEMRZIVYFDS-GHMZBOCLSA-N 1 0 339.823 3.601 20 5 EHBDRO C[NH2+][C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000262022131 1019866575 /nfs/dbraw/zinc/86/65/75/1019866575.db2.gz NGAUOMYJJHHJHS-ZDUSSCGKSA-N 1 0 331.441 3.507 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2ccccc2-n2cccn2)cccc1[N+](=O)[O-] ZINC000183163376 1020430555 /nfs/dbraw/zinc/43/05/55/1020430555.db2.gz NLHYTGGYPRFDKH-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3F)C2)c1 ZINC000449619970 1032906670 /nfs/dbraw/zinc/90/66/70/1032906670.db2.gz RTZZRKMMZIYNOZ-SHTZXODSSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])c(C)c1OC ZINC000513698148 1020489043 /nfs/dbraw/zinc/48/90/43/1020489043.db2.gz XEBSBVIHDMIFCG-ZDUSSCGKSA-N 1 0 344.411 3.641 20 5 EHBDRO CC(C)C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCC1 ZINC000501155486 1020732889 /nfs/dbraw/zinc/73/28/89/1020732889.db2.gz VCPMLIYAYRNBSX-UHFFFAOYSA-N 1 0 333.432 3.824 20 5 EHBDRO O=C(CC[N@@H+]1CC[C@@H]1c1cccc(F)c1)Nc1ccccc1[N+](=O)[O-] ZINC000610505058 1020859395 /nfs/dbraw/zinc/85/93/95/1020859395.db2.gz XLUBLBAQYOOJAF-MRXNPFEDSA-N 1 0 343.358 3.510 20 5 EHBDRO Cc1nn(C[N@H+]2CCCC[C@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000760409290 1032938923 /nfs/dbraw/zinc/93/89/23/1032938923.db2.gz QNKKLZLJXPWFSX-HNNXBMFYSA-N 1 0 345.447 3.896 20 5 EHBDRO CC[C@H](O)[C@H](CC)[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000449639298 1032942864 /nfs/dbraw/zinc/94/28/64/1032942864.db2.gz OJMZBZVGQPRZAW-RDJZCZTQSA-N 1 0 348.399 3.503 20 5 EHBDRO COc1cccc(COCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000090806557 1021090423 /nfs/dbraw/zinc/09/04/23/1021090423.db2.gz NCIMVPFIDVRXRV-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO CC(C)(C)[C@H]1OCCC[C@@H]1C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602549540 1032957383 /nfs/dbraw/zinc/95/73/83/1032957383.db2.gz DKFQMDQCTKHNJU-PXAZEXFGSA-N 1 0 347.415 3.667 20 5 EHBDRO C[N@@H+]1CCCC12CCN(c1c(Cl)cc(Cl)cc1[N+](=O)[O-])CC2 ZINC000518505564 1021254065 /nfs/dbraw/zinc/25/40/65/1021254065.db2.gz UKEIOKSUGKOUFE-UHFFFAOYSA-N 1 0 344.242 3.966 20 5 EHBDRO C[C@@H]1Oc2cc(F)ccc2[C@H]1[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000518606312 1021367350 /nfs/dbraw/zinc/36/73/50/1021367350.db2.gz JWACGEYOHVPWHR-LNVPTUOQSA-N 1 0 328.343 3.859 20 5 EHBDRO CCO[C@@H](CC[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)C1CCCC1 ZINC000602564270 1032975708 /nfs/dbraw/zinc/97/57/08/1032975708.db2.gz KOPVCKTVRCFTEW-INIZCTEOSA-N 1 0 347.415 3.811 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CCCN(C)c3ccccc32)cc1[N+](=O)[O-] ZINC000449655596 1032985557 /nfs/dbraw/zinc/98/55/57/1032985557.db2.gz ZMGANZQYYILTON-QGZVFWFLSA-N 1 0 325.412 3.964 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437103029 1021576834 /nfs/dbraw/zinc/57/68/34/1021576834.db2.gz IGIASPIITUVAHT-CABCVRRESA-N 1 0 325.412 3.554 20 5 EHBDRO COc1cccc2c1CCC[C@H]2[NH2+]CCc1ccccc1[N+](=O)[O-] ZINC000519682863 1021619321 /nfs/dbraw/zinc/61/93/21/1021619321.db2.gz KWFXCTYXIYOQPT-QGZVFWFLSA-N 1 0 326.396 3.813 20 5 EHBDRO C[C@H]([NH2+][C@H](Cn1cccn1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610538628 1021819984 /nfs/dbraw/zinc/81/99/84/1021819984.db2.gz YBKGZFPMCCXXRY-HNAYVOBHSA-N 1 0 336.395 3.883 20 5 EHBDRO Cc1cc(NC2CC[NH+](Cc3ccccc3)CC2)ccc1[N+](=O)[O-] ZINC000058871402 1033023039 /nfs/dbraw/zinc/02/30/39/1033023039.db2.gz TYUPVHQCPGDNJH-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000506801527 1022035108 /nfs/dbraw/zinc/03/51/08/1022035108.db2.gz ZVGIDJCNDFHYLZ-UHFFFAOYSA-N 1 0 339.439 3.740 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCC[C@H]1CCOC1 ZINC000449680398 1033031936 /nfs/dbraw/zinc/03/19/36/1033031936.db2.gz GLEFPZNWSAPRML-XYJFISCASA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)C(C)(C)C[NH2+][C@H](c1nccn1C)c1cccc([N+](=O)[O-])c1 ZINC000574300445 1033032816 /nfs/dbraw/zinc/03/28/16/1033032816.db2.gz HXKYDGOMEXTYLT-INIZCTEOSA-N 1 0 330.432 3.690 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000341542791 1022220133 /nfs/dbraw/zinc/22/01/33/1022220133.db2.gz FFARSGHQFQPSPP-LBPRGKRZSA-N 1 0 349.460 3.666 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@H]3CCC4(CCCCC4)O3)nc2c1 ZINC000602631086 1033041741 /nfs/dbraw/zinc/04/17/41/1033041741.db2.gz OMDIWRPKWVPHDQ-CQSZACIVSA-N 1 0 345.399 3.708 20 5 EHBDRO CCOc1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1C)CCO2 ZINC000187544490 1022332250 /nfs/dbraw/zinc/33/22/50/1022332250.db2.gz FSNWBENIBXBWQK-SFHVURJKSA-N 1 0 342.395 3.915 20 5 EHBDRO CCC[N@H+](CCc1ccccn1)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000602654594 1033053832 /nfs/dbraw/zinc/05/38/32/1033053832.db2.gz DEGCHNLSWOIEHR-UHFFFAOYSA-N 1 0 340.383 3.586 20 5 EHBDRO CC(F)(F)CC[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602673335 1033051871 /nfs/dbraw/zinc/05/18/71/1033051871.db2.gz SJFPSDWWYFHGFY-UHFFFAOYSA-N 1 0 329.166 3.554 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000602656828 1033056922 /nfs/dbraw/zinc/05/69/22/1033056922.db2.gz YNZXFUBVIRLZCU-UKRRQHHQSA-N 1 0 344.333 3.757 20 5 EHBDRO C[C@@H]1[C@@H](CO)CC[N@@H+]1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000425968574 1022521074 /nfs/dbraw/zinc/52/10/74/1022521074.db2.gz SNCIJFJQJCVWMF-CHWSQXEVSA-N 1 0 332.425 3.526 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]Cc2cccc([N+](=O)[O-])c2C)C1 ZINC000550211589 1022763548 /nfs/dbraw/zinc/76/35/48/1022763548.db2.gz HJBRODFURDXPMS-WBVHZDCISA-N 1 0 348.443 3.895 20 5 EHBDRO CN(C)[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000237172693 1022888765 /nfs/dbraw/zinc/88/87/65/1022888765.db2.gz IVDSPPCALIDVAQ-KRWDZBQOSA-N 1 0 345.468 3.753 20 5 EHBDRO CC[C@]1(C)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072803159 1022965684 /nfs/dbraw/zinc/96/56/84/1022965684.db2.gz AZVOCWVVGYFKJF-QGZVFWFLSA-N 1 0 330.388 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2cccc(C[NH+]3CCCCCC3)c2)nc1 ZINC000060862794 1033095499 /nfs/dbraw/zinc/09/54/99/1033095499.db2.gz BNYOGYUJWYGQJC-UHFFFAOYSA-N 1 0 340.427 3.978 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000507007820 1023073951 /nfs/dbraw/zinc/07/39/51/1023073951.db2.gz QJQGRMXYQGBGPK-CZUORRHYSA-N 1 0 329.375 3.981 20 5 EHBDRO COc1ccc(OCC[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c([N+](=O)[O-])c1 ZINC000441476439 1023097543 /nfs/dbraw/zinc/09/75/43/1023097543.db2.gz POUOFLFSBIRUEM-IIAWOOMASA-N 1 0 334.416 3.635 20 5 EHBDRO Cc1ccccc1[C@H]1CC[N@H+](CCOc2cccc([N+](=O)[O-])c2)C1 ZINC000507178791 1023166407 /nfs/dbraw/zinc/16/64/07/1023166407.db2.gz IYODXWPTBAAAJQ-INIZCTEOSA-N 1 0 326.396 3.772 20 5 EHBDRO CCC(CC)[C@@H](CNCc1ccc(C)c([N+](=O)[O-])c1)[NH+]1CCCC1 ZINC000518269846 1023180583 /nfs/dbraw/zinc/18/05/83/1023180583.db2.gz ORLHNEQVZRMQFK-LJQANCHMSA-N 1 0 333.476 3.893 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000506475577 1023240560 /nfs/dbraw/zinc/24/05/60/1023240560.db2.gz XZOSWXDIZVTYQY-JKSUJKDBSA-N 1 0 349.450 3.820 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000548486540 1023494736 /nfs/dbraw/zinc/49/47/36/1023494736.db2.gz PVMQKAXYMRJARI-MLGOLLRUSA-N 1 0 334.416 3.766 20 5 EHBDRO CC[C@H]([NH2+]CCN1Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000610805567 1023685889 /nfs/dbraw/zinc/68/58/89/1023685889.db2.gz AFZDRRKMAWGCOT-IBGZPJMESA-N 1 0 325.412 3.651 20 5 EHBDRO C[C@@H]([NH2+]CCN1CCCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000610805534 1023693709 /nfs/dbraw/zinc/69/37/09/1023693709.db2.gz UBQKXSDIRIFKBS-OAHLLOKOSA-N 1 0 325.412 3.698 20 5 EHBDRO COc1cc2c(c(C[NH2+]Cc3cccc([N+](=O)[O-])c3C)c1)O[C@H](C)C2 ZINC000480502675 1033158642 /nfs/dbraw/zinc/15/86/42/1033158642.db2.gz WVHLBLKFLXHQHY-GFCCVEGCSA-N 1 0 342.395 3.525 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+][C@@H]1CCCC2(CC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000897773692 1033160617 /nfs/dbraw/zinc/16/06/17/1033160617.db2.gz LKMJKFXDHKUQCB-NVXWUHKLSA-N 1 0 340.427 3.730 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[N@H+](CCn1ccc([N+](=O)[O-])n1)C1CC1 ZINC000176214674 1023883046 /nfs/dbraw/zinc/88/30/46/1023883046.db2.gz RDNQYOPNYMKOKK-LBPRGKRZSA-N 1 0 334.807 3.670 20 5 EHBDRO CCC[C@@H]([NH2+]CCn1c(C)ncc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000602806432 1033181501 /nfs/dbraw/zinc/18/15/01/1033181501.db2.gz SPGSCCQPYFOSDM-OAHLLOKOSA-N 1 0 338.358 3.509 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC000897797406 1033181872 /nfs/dbraw/zinc/18/18/72/1033181872.db2.gz HEUHZHQODBYPSQ-OAHLLOKOSA-N 1 0 349.500 3.827 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@H]2CC[C@H](O)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000474105946 1024225555 /nfs/dbraw/zinc/22/55/55/1024225555.db2.gz MFKNMYFWSRVABI-IYJAJMOOSA-N 1 0 344.411 3.590 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CC[C@@H](OCc2ccncc2)C1 ZINC000280899666 1024411731 /nfs/dbraw/zinc/41/17/31/1024411731.db2.gz DSUPKIIDKRLVOC-CRAIPNDOSA-N 1 0 341.411 3.650 20 5 EHBDRO C[NH+](C)[C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000277291271 1024478564 /nfs/dbraw/zinc/47/85/64/1024478564.db2.gz ZOCPCMBHZZKRAZ-LLVKDONJSA-N 1 0 331.338 3.534 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CC[C@H](c2nccs2)C1 ZINC000895581235 1024637634 /nfs/dbraw/zinc/63/76/34/1024637634.db2.gz MNEWZKZQSMPCEW-GLNPCMGASA-N 1 0 329.425 3.944 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@H+](Cc1ccco1)C(C)C ZINC000346313279 1024638577 /nfs/dbraw/zinc/63/85/77/1024638577.db2.gz LVBTWNVMASBHJR-UHFFFAOYSA-N 1 0 345.399 3.735 20 5 EHBDRO COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000538966780 1024642449 /nfs/dbraw/zinc/64/24/49/1024642449.db2.gz DTTOHDIPUWORFE-LIRRHRJNSA-N 1 0 344.411 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2COc3ccccc3C2)cc1 ZINC000550700327 1024666671 /nfs/dbraw/zinc/66/66/71/1024666671.db2.gz FJIOKHXBLRCCEW-KRWDZBQOSA-N 1 0 326.396 3.511 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000514761224 1024719951 /nfs/dbraw/zinc/71/99/51/1024719951.db2.gz IPJIXDIDVYTIPM-CVAIRZPRSA-N 1 0 340.423 3.720 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310338872 1024850299 /nfs/dbraw/zinc/85/02/99/1024850299.db2.gz CGQRSWDKDLUIQU-KRWDZBQOSA-N 1 0 325.412 3.837 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@@H](O)CC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346608293 1024949711 /nfs/dbraw/zinc/94/97/11/1024949711.db2.gz PEWDRAOJZHFCDF-YJBOKZPZSA-N 1 0 332.400 3.590 20 5 EHBDRO C[NH+](C)C[C@@H]1CCCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892173560 1025183378 /nfs/dbraw/zinc/18/33/78/1025183378.db2.gz YRACYVSWORABQE-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC[C@@]2(CC(F)(F)C2(F)F)C1 ZINC000896227660 1025261693 /nfs/dbraw/zinc/26/16/93/1025261693.db2.gz NUNQXHYFWUEOTB-LYKUJDHUSA-N 1 0 344.308 3.974 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000602952348 1033275331 /nfs/dbraw/zinc/27/53/31/1033275331.db2.gz UMEGVZXMJGILDR-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO COC(=O)[C@@H](CC[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000425460237 1025364895 /nfs/dbraw/zinc/36/48/95/1025364895.db2.gz QPJRHSJKKDTYKY-KSSFIOAISA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000137 1025381829 /nfs/dbraw/zinc/38/18/29/1025381829.db2.gz WDUWNJURNCTRCJ-XLNTUCKNSA-N 1 0 346.471 3.789 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]Cc1cc2c(cccc2F)[nH]1 ZINC000436232343 1025500399 /nfs/dbraw/zinc/50/03/99/1025500399.db2.gz NTNYWWRNJPMJQE-UHFFFAOYSA-N 1 0 329.331 3.514 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+][C@H]2C[C@H](c3ccccc3)C2)n1 ZINC000436298999 1025564050 /nfs/dbraw/zinc/56/40/50/1025564050.db2.gz DXHVPPJNCAKQBQ-BRSBDYLESA-N 1 0 340.427 3.811 20 5 EHBDRO CSc1ccccc1[C@H](C)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000281834553 1025578357 /nfs/dbraw/zinc/57/83/57/1025578357.db2.gz YAJSZAADHYBZRL-BLLLJJGKSA-N 1 0 332.425 3.701 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000185673839 1025584660 /nfs/dbraw/zinc/58/46/60/1025584660.db2.gz HTMFUXLZDZNUQL-DNVCBOLYSA-N 1 0 327.428 3.684 20 5 EHBDRO CN1C[C@H](C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])Cc2ccccc21 ZINC000436413280 1025692410 /nfs/dbraw/zinc/69/24/10/1025692410.db2.gz NPGYEZUDWMFCEY-FSNWXROXSA-N 1 0 337.423 3.506 20 5 EHBDRO Cn1cc(CC[NH2+]Cc2ccccc2[N+](=O)[O-])c2ccc(F)cc21 ZINC000185746135 1025749440 /nfs/dbraw/zinc/74/94/40/1025749440.db2.gz MOVCOIMIGCPCPS-UHFFFAOYSA-N 1 0 327.359 3.558 20 5 EHBDRO Cn1cc(CC[NH2+]Cc2cccc([N+](=O)[O-])c2)c2ccc(F)cc21 ZINC000185749485 1025749553 /nfs/dbraw/zinc/74/95/53/1025749553.db2.gz FZJYLLICHDCIPZ-UHFFFAOYSA-N 1 0 327.359 3.558 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC(C(C)C)CC1 ZINC000444208490 1025923026 /nfs/dbraw/zinc/92/30/26/1025923026.db2.gz ANRWQIWMLWUXIK-UHFFFAOYSA-N 1 0 333.432 3.600 20 5 EHBDRO C[C@@]1(CO)CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000530495483 1025945941 /nfs/dbraw/zinc/94/59/41/1025945941.db2.gz QDPZCEGLPGBSJD-KRWDZBQOSA-N 1 0 332.425 3.670 20 5 EHBDRO CCC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C(C)(C)C ZINC000451442254 1025974895 /nfs/dbraw/zinc/97/48/95/1025974895.db2.gz UZOBGQJVAQSSGK-AWEZNQCLSA-N 1 0 332.404 3.949 20 5 EHBDRO CCOc1cccc(N2CCC[C@H]([NH+]3[C@@H](C)CC[C@@H]3C)C2)c1[N+](=O)[O-] ZINC000516124720 1026015305 /nfs/dbraw/zinc/01/53/05/1026015305.db2.gz WAQVJFVLUFAXMC-JYJNAYRXSA-N 1 0 347.459 3.835 20 5 EHBDRO CCO[C@@H]1CC[N@H+](Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000451549068 1026099327 /nfs/dbraw/zinc/09/93/27/1026099327.db2.gz VTWDQYHDNCRGML-WMLDXEAASA-N 1 0 336.432 3.629 20 5 EHBDRO Cc1cnc([C@@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)cn1 ZINC000451553125 1026105526 /nfs/dbraw/zinc/10/55/26/1026105526.db2.gz XKWYEGNAIJXXGW-GDBMZVCRSA-N 1 0 326.400 3.634 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626635 1026151224 /nfs/dbraw/zinc/15/12/24/1026151224.db2.gz RBJIOJOUNJMIRW-SNVBAGLBSA-N 1 0 344.358 3.825 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@@H](C)CC2(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000530626632 1026151439 /nfs/dbraw/zinc/15/14/39/1026151439.db2.gz RBJIOJOUNJMIRW-JTQLQIEISA-N 1 0 344.358 3.825 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000475150855 1026255138 /nfs/dbraw/zinc/25/51/38/1026255138.db2.gz KWNQTXFVBNBOMB-IBGZPJMESA-N 1 0 328.412 3.593 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H](c2ccco2)[NH+]2CCCCC2)n1 ZINC000119810045 1026298499 /nfs/dbraw/zinc/29/84/99/1026298499.db2.gz XOOBFPGJZKPKNM-OAHLLOKOSA-N 1 0 330.388 3.530 20 5 EHBDRO C[C@H](O)C[C@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704825 1026355555 /nfs/dbraw/zinc/35/55/55/1026355555.db2.gz XSIABJYVBMFKRT-XJKSGUPXSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](OCCCc3ccccc3)C2)c1 ZINC000530972509 1026448739 /nfs/dbraw/zinc/44/87/39/1026448739.db2.gz SBTIILVQOPBQOE-FQEVSTJZSA-N 1 0 340.423 3.819 20 5 EHBDRO CC(C)[C@H](CO)[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1 ZINC000531405954 1026886429 /nfs/dbraw/zinc/88/64/29/1026886429.db2.gz OEPLDILRPDAXEX-IBGZPJMESA-N 1 0 328.412 3.614 20 5 EHBDRO C[C@H]([NH2+]CCc1cnn(-c2ccccc2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000178641304 1026991174 /nfs/dbraw/zinc/99/11/74/1026991174.db2.gz MBGGUVOCMCBGAQ-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)C[N@@H+]1CCCC[C@@H]1CNc1ncnc2sc([N+](=O)[O-])cc21 ZINC000342784005 1027031556 /nfs/dbraw/zinc/03/15/56/1027031556.db2.gz REOUDPZQZNTFTO-GFCCVEGCSA-N 1 0 349.460 3.522 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000413179891 1027202592 /nfs/dbraw/zinc/20/25/92/1027202592.db2.gz CTDGMWKASYSXQC-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)c1OC ZINC000531701243 1027225961 /nfs/dbraw/zinc/22/59/61/1027225961.db2.gz QIBUTGDBVVXLKM-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(c2ccccn2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000121359630 1027330992 /nfs/dbraw/zinc/33/09/92/1027330992.db2.gz VPFRYAARLUZHMG-GOSISDBHSA-N 1 0 340.427 3.700 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000323832337 1027465954 /nfs/dbraw/zinc/46/59/54/1027465954.db2.gz IHIBYFHFRUWGNA-MOPGFXCFSA-N 1 0 327.428 3.938 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2C[C@H](C)N(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000310663384 1027580622 /nfs/dbraw/zinc/58/06/22/1027580622.db2.gz FKFXORYIULODQB-HNAYVOBHSA-N 1 0 339.439 3.656 20 5 EHBDRO Cc1nn(C(C)C)c(C)c1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000894271438 1027681128 /nfs/dbraw/zinc/68/11/28/1027681128.db2.gz GTQKBJJVCBJRJK-UHFFFAOYSA-N 1 0 330.432 3.664 20 5 EHBDRO C[C@@H]1C[NH+](Cc2cccc(Nc3ccccc3[N+](=O)[O-])c2)C[C@@H](C)O1 ZINC000523113352 1027764467 /nfs/dbraw/zinc/76/44/67/1027764467.db2.gz MGZUXELTCHZHPQ-HUUCEWRRSA-N 1 0 341.411 3.948 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(C(C)(C)O)cc1 ZINC000924954184 1027769117 /nfs/dbraw/zinc/76/91/17/1027769117.db2.gz FWERFKAMTKPYKQ-AWEZNQCLSA-N 1 0 328.412 3.716 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[N@H+](C)CC1CCCC1 ZINC000533398448 1027769714 /nfs/dbraw/zinc/76/97/14/1027769714.db2.gz QIVBLYKMLMNCBN-LLVKDONJSA-N 1 0 339.823 3.697 20 5 EHBDRO CC(C)c1ccc(C(=O)Nc2ccc3c(c2)C[NH2+]CC3)cc1[N+](=O)[O-] ZINC000422839972 1027980670 /nfs/dbraw/zinc/98/06/70/1027980670.db2.gz RQEPEJVPPGXGLE-UHFFFAOYSA-N 1 0 339.395 3.616 20 5 EHBDRO CC(C)[N@H+](CC(=O)N1CCc2cc([N+](=O)[O-])ccc21)C1CCCCC1 ZINC000532692287 1028166053 /nfs/dbraw/zinc/16/60/53/1028166053.db2.gz KBCGWROCDOPRJV-UHFFFAOYSA-N 1 0 345.443 3.527 20 5 EHBDRO COc1ccc(C[C@@](C)([NH3+])CNc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000533631492 1028197990 /nfs/dbraw/zinc/19/79/90/1028197990.db2.gz KUSDDTYWWXUXMD-QGZVFWFLSA-N 1 0 349.818 3.629 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000444764382 1028250886 /nfs/dbraw/zinc/25/08/86/1028250886.db2.gz BCZFQVPXPINLHX-CQSZACIVSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H](NC[C@@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246329 1028305800 /nfs/dbraw/zinc/30/58/00/1028305800.db2.gz ZDHNCBILQWSZOZ-STQMWFEESA-N 1 0 331.441 3.726 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CCCC1(O)CCC1 ZINC000421374930 1028334542 /nfs/dbraw/zinc/33/45/42/1028334542.db2.gz FTLVGGRZHRHOSS-DOTOQJQBSA-N 1 0 332.444 3.591 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000573137674 1028550913 /nfs/dbraw/zinc/55/09/13/1028550913.db2.gz VZVXNSSXPJGLSO-GUYCJALGSA-N 1 0 341.386 3.590 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C1CCCCC1 ZINC000523855637 1028664371 /nfs/dbraw/zinc/66/43/71/1028664371.db2.gz RIEFTSYSBYPSIW-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnccc1OC ZINC000340401604 1028784693 /nfs/dbraw/zinc/78/46/93/1028784693.db2.gz XEMJSFGOYVOMCF-AWEZNQCLSA-N 1 0 347.440 3.659 20 5 EHBDRO CN(Cc1ccccc1[N+](=O)[O-])C(=O)CC[C@H]([NH3+])CC1CCCCC1 ZINC000424083238 1028789554 /nfs/dbraw/zinc/78/95/54/1028789554.db2.gz CSMCWLXGWCBWOS-KRWDZBQOSA-N 1 0 347.459 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCC2(O)CCC2)c2ccccc2)c1 ZINC000421851280 1028837545 /nfs/dbraw/zinc/83/75/45/1028837545.db2.gz FQDVQVOOQQXXEP-IBGZPJMESA-N 1 0 340.423 3.969 20 5 EHBDRO Cc1ccc(CN2C[C@@H](c3ccccc3)OC[C@@H]2C)cc1[N+](=O)[O-] ZINC000513761749 1029005484 /nfs/dbraw/zinc/00/54/84/1029005484.db2.gz OEVMLIBODNLMKU-KXBFYZLASA-N 1 0 326.396 3.865 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC[C@@H](O)C1 ZINC000504905769 1029050456 /nfs/dbraw/zinc/05/04/56/1029050456.db2.gz NOWMLWQNYGYDFE-RBSFLKMASA-N 1 0 338.473 3.606 20 5 EHBDRO Cc1cc(C[NH3+])cc(NC(=O)N[C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000424435593 1029075689 /nfs/dbraw/zinc/07/56/89/1029075689.db2.gz LBKYKYXQXRHAHF-ZDUSSCGKSA-N 1 0 342.399 3.553 20 5 EHBDRO Cc1cnc(NCc2ccccc2C[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000078627263 1029403479 /nfs/dbraw/zinc/40/34/79/1029403479.db2.gz UTVHWVAKPQVIEB-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO Cc1cccc(C[N@H+](C)CCC(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000533242738 1029502828 /nfs/dbraw/zinc/50/28/28/1029502828.db2.gz LCIMNXZKOWYFLO-UHFFFAOYSA-N 1 0 341.411 3.672 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513825677 1029523907 /nfs/dbraw/zinc/52/39/07/1029523907.db2.gz HPNKTRREZDITDW-SZVBFZGTSA-N 1 0 339.439 3.922 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000533287917 1029579482 /nfs/dbraw/zinc/57/94/82/1029579482.db2.gz HXCXQPCZHWCHCZ-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@H](C)CCC[C@H]1C ZINC000533293612 1029587617 /nfs/dbraw/zinc/58/76/17/1029587617.db2.gz WASKHZUVYVWYTL-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCOc2cccc(C(F)(F)F)c2)cs1 ZINC000237850816 1029667104 /nfs/dbraw/zinc/66/71/04/1029667104.db2.gz KRNDJOXGDFYEOJ-UHFFFAOYSA-N 1 0 346.330 3.844 20 5 EHBDRO Cc1ccc(CC[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446837777 1029808010 /nfs/dbraw/zinc/80/80/10/1029808010.db2.gz ARAVZJNGJIJXJX-AWEZNQCLSA-N 1 0 338.411 3.890 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000446895410 1029844493 /nfs/dbraw/zinc/84/44/93/1029844493.db2.gz CCQWWLHMSDHFRB-OAHLLOKOSA-N 1 0 339.439 3.980 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000052357627 1029849259 /nfs/dbraw/zinc/84/92/59/1029849259.db2.gz WIWVSBZKMOZMRK-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCO[C@@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453340610 1030124552 /nfs/dbraw/zinc/12/45/52/1030124552.db2.gz HTONLBSJZHMMRX-YTQUADARSA-N 1 0 341.411 3.951 20 5 EHBDRO Cc1cccc(C[NH+]2CCN([C@H](C)c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000441263287 1030159672 /nfs/dbraw/zinc/15/96/72/1030159672.db2.gz QQAYEBKEFGMGAX-QGZVFWFLSA-N 1 0 339.439 3.782 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C/C=C/c2ccccc2)n1 ZINC000447530373 1030252172 /nfs/dbraw/zinc/25/21/72/1030252172.db2.gz MLEHNONCUYVXRM-RUZMYDRRSA-N 1 0 326.400 3.578 20 5 EHBDRO CCc1ccc(C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)s1 ZINC000447546232 1030279658 /nfs/dbraw/zinc/27/96/58/1030279658.db2.gz UGOLLQOSVMTLOR-LSDHHAIUSA-N 1 0 334.445 3.689 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+][C@H]2CCSC2)cc1[N+](=O)[O-] ZINC000525997684 1030293511 /nfs/dbraw/zinc/29/35/11/1030293511.db2.gz QWWHOOGYQNSOHF-HNNXBMFYSA-N 1 0 343.452 3.958 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC000532202643 1030475746 /nfs/dbraw/zinc/47/57/46/1030475746.db2.gz QBCQJCSTPJMDNC-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1N(C)C ZINC000482507538 1030485876 /nfs/dbraw/zinc/48/58/76/1030485876.db2.gz MPGQQWFGCQTBKU-ZDUSSCGKSA-N 1 0 331.391 3.693 20 5 EHBDRO C[N@H+](Cc1c2ccccc2cc2ccccc21)[C@H]1CCS(=O)(=O)C1 ZINC000157607146 1030658198 /nfs/dbraw/zinc/65/81/98/1030658198.db2.gz QGZBUYVUAYAOIH-KRWDZBQOSA-N 1 0 339.460 3.612 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+]2CCC[C@@H](CC(C)C)C2)cccc1[N+](=O)[O-] ZINC001168147750 1030926222 /nfs/dbraw/zinc/92/62/22/1030926222.db2.gz XGVHKKZJMOUKEW-INIZCTEOSA-N 1 0 347.459 3.990 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)CCS2 ZINC000343447345 1030936052 /nfs/dbraw/zinc/93/60/52/1030936052.db2.gz SODSRKOGNGCWHB-QGZVFWFLSA-N 1 0 344.436 3.973 20 5 EHBDRO CCOc1ncccc1CN[C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192652250 1030954764 /nfs/dbraw/zinc/95/47/64/1030954764.db2.gz FVXDWUDBADRPCB-KRWDZBQOSA-N 1 0 327.384 3.556 20 5 EHBDRO CCn1cc([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000296040895 1031222213 /nfs/dbraw/zinc/22/22/13/1031222213.db2.gz UJBOYHGLOUVBPC-YVEFUNNKSA-N 1 0 328.416 3.884 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc([N+](=O)[O-])cc1Cl)[NH+](C)C ZINC000007979197 1031288219 /nfs/dbraw/zinc/28/82/19/1031288219.db2.gz SDGBNIFAVWOLPO-MRXNPFEDSA-N 1 0 349.818 3.972 20 5 EHBDRO COC1CCC(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000484274070 1031514274 /nfs/dbraw/zinc/51/42/74/1031514274.db2.gz CZKIXYSQSIQXDR-IUPXNIOVSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1cc(CSCC[NH+](C(C)C)C(C)C)ccc1[N+](=O)[O-] ZINC000484542255 1031706123 /nfs/dbraw/zinc/70/61/23/1031706123.db2.gz MLAFAGBJBSYJOL-UHFFFAOYSA-N 1 0 326.462 3.955 20 5 EHBDRO CO[C@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000584126591 1031768755 /nfs/dbraw/zinc/76/87/55/1031768755.db2.gz NJJQFDQGYJGRRB-MRXNPFEDSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@H](C)C[C@H](C)[C@H]1C ZINC000475744577 1031834682 /nfs/dbraw/zinc/83/46/82/1031834682.db2.gz RBVXSTGVJDEZRJ-VHDGCEQUSA-N 1 0 333.432 3.598 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000537771233 1031907371 /nfs/dbraw/zinc/90/73/71/1031907371.db2.gz HSDXGJFPZTUPLC-ZIAGYGMSSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1ccc([C@H](C)NC[C@H]2CCC[N@@H+](CC(C)C)C2)cc1[N+](=O)[O-] ZINC000537950662 1032036521 /nfs/dbraw/zinc/03/65/21/1032036521.db2.gz HTEWZVLQVWMNJN-DLBZAZTESA-N 1 0 333.476 3.922 20 5 EHBDRO CC(C)Oc1ccc([C@@H](O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173422242 1033314929 /nfs/dbraw/zinc/31/49/29/1033314929.db2.gz HGABEKULIADHPE-KUHUBIRLSA-N 1 0 344.411 3.766 20 5 EHBDRO COc1nc(C)cc(C)c1CN(C)[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000598651013 1033366520 /nfs/dbraw/zinc/36/65/20/1033366520.db2.gz ZZJDOPLQBXMCQH-CQSZACIVSA-N 1 0 329.400 3.808 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)[C@H]1CCCCO1 ZINC000594510181 1033416090 /nfs/dbraw/zinc/41/60/90/1033416090.db2.gz HYIYBPVVVGLGRP-ZMYBRWDISA-N 1 0 332.444 3.853 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ncc(C)cc2C)cc1[N+](=O)[O-] ZINC000594509716 1033416137 /nfs/dbraw/zinc/41/61/37/1033416137.db2.gz LLNSFGWDSHOYCZ-OAHLLOKOSA-N 1 0 343.427 3.899 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCC[N@@H+]4CCCC[C@H]34)c2c1 ZINC000594599887 1033445621 /nfs/dbraw/zinc/44/56/21/1033445621.db2.gz KAYVLJIRRCHUNT-IAGOWNOFSA-N 1 0 326.400 3.572 20 5 EHBDRO Nc1cccc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c1 ZINC000594737196 1033509644 /nfs/dbraw/zinc/50/96/44/1033509644.db2.gz YRHDQUKMWQRQKQ-QAPCUYQASA-N 1 0 325.412 3.678 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1OCCc2ccccc21 ZINC000595020171 1033612809 /nfs/dbraw/zinc/61/28/09/1033612809.db2.gz VJRHPSRTIHJJPJ-BFUOFWGJSA-N 1 0 342.395 3.568 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000595021001 1033614836 /nfs/dbraw/zinc/61/48/36/1033614836.db2.gz WIGLJFOYVGJDML-KBPBESRZSA-N 1 0 342.395 3.820 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H]1Cc2ccccc2CO1 ZINC000598989759 1033616575 /nfs/dbraw/zinc/61/65/75/1033616575.db2.gz SWCSBNUIWIWZCX-WKSDAVQWSA-N 1 0 338.407 3.729 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCC12CCOCC2 ZINC000282026201 1033620383 /nfs/dbraw/zinc/62/03/83/1033620383.db2.gz KOKQLNTXHFIBEP-SFHVURJKSA-N 1 0 348.443 3.821 20 5 EHBDRO COCc1ccccc1C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595003961 1033629122 /nfs/dbraw/zinc/62/91/22/1033629122.db2.gz OFNKRUAEDYUPEE-CYBMUJFWSA-N 1 0 330.384 3.601 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1c[nH]c2ccccc12 ZINC000595005843 1033630194 /nfs/dbraw/zinc/63/01/94/1033630194.db2.gz DTJNDCUWKONXFU-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC2(CC1)C(F)(F)C2(F)F ZINC000593658759 1033635563 /nfs/dbraw/zinc/63/55/63/1033635563.db2.gz VNWPQMBHVHXKES-UHFFFAOYSA-N 1 0 332.297 3.770 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CO[C@@H](C3CC3)C2)o1 ZINC000599006856 1033641726 /nfs/dbraw/zinc/64/17/26/1033641726.db2.gz LNXHIIRFKQMHOX-SCLBCKFNSA-N 1 0 328.368 3.512 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000595066248 1033644718 /nfs/dbraw/zinc/64/47/18/1033644718.db2.gz HBGCPSHQOOIUKG-KDOFPFPSSA-N 1 0 344.411 3.950 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)c1cccc(OC)c1 ZINC000595069809 1033647262 /nfs/dbraw/zinc/64/72/62/1033647262.db2.gz SGRBXTQTUJZJGD-IFXJQAMLSA-N 1 0 344.411 3.950 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](C)c1c(C)noc1C ZINC000595035037 1033654970 /nfs/dbraw/zinc/65/49/70/1033654970.db2.gz GMLKMSHAFHKRJQ-MNOVXSKESA-N 1 0 333.388 3.663 20 5 EHBDRO CC[C@H](OCC[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1 ZINC000593664441 1033663879 /nfs/dbraw/zinc/66/38/79/1033663879.db2.gz NHOPSASMRHBLDO-SFHVURJKSA-N 1 0 344.411 3.861 20 5 EHBDRO Cn1cc(C[NH2+]C[C@@H]2CCCC23CC3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000599016050 1033665491 /nfs/dbraw/zinc/66/54/91/1033665491.db2.gz IQAVMISMYJAZCR-INIZCTEOSA-N 1 0 340.427 3.665 20 5 EHBDRO CO[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000599016060 1033666066 /nfs/dbraw/zinc/66/60/66/1033666066.db2.gz IYSGJCAEWBZCNW-JNSHFYNHSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CCc1noc2ccccc21 ZINC000595050114 1033667295 /nfs/dbraw/zinc/66/72/95/1033667295.db2.gz PLGPHWQBLHQARB-CQSZACIVSA-N 1 0 339.395 3.889 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595049775 1033667654 /nfs/dbraw/zinc/66/76/54/1033667654.db2.gz OOKIDOZVLLJRFO-KGLIPLIRSA-N 1 0 329.400 3.843 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H]1CC(=O)N(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595105926 1033691254 /nfs/dbraw/zinc/69/12/54/1033691254.db2.gz URJXTFQERVEXMG-PBHICJAKSA-N 1 0 347.459 3.673 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000595103626 1033691459 /nfs/dbraw/zinc/69/14/59/1033691459.db2.gz NFWLVERKDCCDOM-HNAYVOBHSA-N 1 0 325.412 3.520 20 5 EHBDRO COCc1csc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])c1 ZINC000595079316 1033695567 /nfs/dbraw/zinc/69/55/67/1033695567.db2.gz WDJGTSAZDKKGOP-CYBMUJFWSA-N 1 0 334.441 3.914 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@H](O)C23CCC3)c2ccccc2)c1 ZINC000595088856 1033697984 /nfs/dbraw/zinc/69/79/84/1033697984.db2.gz DYDPPYUBRFPYHZ-CEXWTWQISA-N 1 0 338.407 3.577 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]C[C@@H](CO)CC2CC2)c2ccccc2)c1 ZINC000595089275 1033698342 /nfs/dbraw/zinc/69/83/42/1033698342.db2.gz NBWMPSDUGGHEPQ-JXFKEZNVSA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H](O)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000599083288 1033721398 /nfs/dbraw/zinc/72/13/98/1033721398.db2.gz XIWGPWMQKZDHDE-RWMBFGLXSA-N 1 0 332.425 3.745 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C2CC2)cn1 ZINC000599094655 1033730080 /nfs/dbraw/zinc/73/00/80/1033730080.db2.gz XKEPDUOLVVCCGR-KPZWWZAWSA-N 1 0 327.384 3.800 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595329288 1033730255 /nfs/dbraw/zinc/73/02/55/1033730255.db2.gz PNKBPDJKGXXKPE-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@H](Cc2ccc(F)cc2)C(C)C)c1[N+](=O)[O-] ZINC000595331247 1033731626 /nfs/dbraw/zinc/73/16/26/1033731626.db2.gz SWUNBSREQFIVFR-OAHLLOKOSA-N 1 0 335.379 3.729 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCSc3ccccc32)c1[N+](=O)[O-] ZINC000892415218 1033756470 /nfs/dbraw/zinc/75/64/70/1033756470.db2.gz DHHLLUJZKLTVKJ-ZDUSSCGKSA-N 1 0 346.408 3.636 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(O)c(OC)c1[N+](=O)[O-])c1ccc(OC)cc1 ZINC000892416372 1033769871 /nfs/dbraw/zinc/76/98/71/1033769871.db2.gz WSCAIRKTIULZTJ-HNNXBMFYSA-N 1 0 346.383 3.559 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000595419951 1033792663 /nfs/dbraw/zinc/79/26/63/1033792663.db2.gz BGYPHHUKHVUSMR-GJZGRUSLSA-N 1 0 347.459 3.530 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(CN2CCC[C@@H](c3ccccn3)C2)c(F)c1 ZINC000595500411 1033830230 /nfs/dbraw/zinc/83/02/30/1033830230.db2.gz CKCYQGUNTKFHIK-GFCCVEGCSA-N 1 0 333.338 3.648 20 5 EHBDRO COc1cc(CN2CCC[C@@H](c3ccccn3)C2)c([N+](=O)[O-])cc1F ZINC000595500874 1033832017 /nfs/dbraw/zinc/83/20/17/1033832017.db2.gz GFYKFSJRKBQROL-CYBMUJFWSA-N 1 0 345.374 3.517 20 5 EHBDRO C[C@H]([NH2+][C@@H](CO)CCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000593718987 1033832036 /nfs/dbraw/zinc/83/20/36/1033832036.db2.gz SGMMQYCLNAVCLZ-NWDGAFQWSA-N 1 0 338.404 3.694 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cnc4ccccc4n3)C2)cc1 ZINC000595520809 1033839793 /nfs/dbraw/zinc/83/97/93/1033839793.db2.gz FEWPTOIXMKXSEP-MRXNPFEDSA-N 1 0 348.406 3.918 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H](CCO)c1ccco1 ZINC000249046055 1033886463 /nfs/dbraw/zinc/88/64/63/1033886463.db2.gz VWRANQPEIKFCGD-BHYGNILZSA-N 1 0 344.411 3.612 20 5 EHBDRO CC(C)C[C@@H](CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1)[NH+](C)C ZINC000608835673 1033909516 /nfs/dbraw/zinc/90/95/16/1033909516.db2.gz IJGRDQFGSHKPHB-KRWDZBQOSA-N 1 0 345.443 3.921 20 5 EHBDRO CC1CC[NH+](Cc2ccccc2CNc2cccnc2[N+](=O)[O-])CC1 ZINC000603858771 1033982884 /nfs/dbraw/zinc/98/28/84/1033982884.db2.gz YAPZEMNEHWRLKA-UHFFFAOYSA-N 1 0 340.427 3.834 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccccc1CNc1cccnc1[N+](=O)[O-] ZINC000603859491 1033983109 /nfs/dbraw/zinc/98/31/09/1033983109.db2.gz CILHSLDGXYRRLB-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO O=C(C[N@@H+]1CCC[C@H]1C1CCCCC1)Nc1ccccc1[N+](=O)[O-] ZINC000603896346 1034003697 /nfs/dbraw/zinc/00/36/97/1034003697.db2.gz OOMSGTDZLFPLKM-INIZCTEOSA-N 1 0 331.416 3.578 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000059893812 1034041323 /nfs/dbraw/zinc/04/13/23/1034041323.db2.gz HHKLEMYEGIUAQN-NSHDSACASA-N 1 0 331.338 3.756 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NCC1CC[NH+](C2CC2)CC1 ZINC000596212751 1034120468 /nfs/dbraw/zinc/12/04/68/1034120468.db2.gz LDFMPBQSPJNDNM-UHFFFAOYSA-N 1 0 325.359 3.819 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1NC1CC[NH+](C2CCC2)CC1 ZINC000596257961 1034152587 /nfs/dbraw/zinc/15/25/87/1034152587.db2.gz DQTIXQBXCPLXOM-UHFFFAOYSA-N 1 0 325.359 3.961 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000179375578 1034257805 /nfs/dbraw/zinc/25/78/05/1034257805.db2.gz GTKIOQYBLLGLSL-NWDGAFQWSA-N 1 0 347.440 3.951 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406799 1034279778 /nfs/dbraw/zinc/27/97/78/1034279778.db2.gz LUEIYBIKKWIFHM-UONOGXRCSA-N 1 0 344.411 3.898 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2NCC1CC[NH+](CC2CC2)CC1 ZINC000596561404 1034289231 /nfs/dbraw/zinc/28/92/31/1034289231.db2.gz AMAWTJPTPHXFAM-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2NCC1CC[NH+](CC2CC2)CC1 ZINC000596563964 1034290491 /nfs/dbraw/zinc/29/04/91/1034290491.db2.gz XFAUXIQPKMYDJW-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@H+]2CCC[C@@H]2c2ccc(O)cc2)cc1 ZINC000604484205 1034388539 /nfs/dbraw/zinc/38/85/39/1034388539.db2.gz FGHYIMXUQKUYBW-GOSISDBHSA-N 1 0 328.368 3.516 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)c1 ZINC000604536850 1034416301 /nfs/dbraw/zinc/41/63/01/1034416301.db2.gz UAAQGRPZALWRTG-UHFFFAOYSA-N 1 0 336.338 3.837 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC4(COC4)C3)o2)c(Cl)c1 ZINC000597228641 1034611107 /nfs/dbraw/zinc/61/11/07/1034611107.db2.gz FNWCAWHXAVDXTJ-UHFFFAOYSA-N 1 0 348.786 3.731 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](c1ccccc1)[C@H](C)O ZINC000597249324 1034641393 /nfs/dbraw/zinc/64/13/93/1034641393.db2.gz QAVZZQKVXUXAJO-FRECMFIJSA-N 1 0 326.396 3.710 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)c1cccc(C[NH+]2CCCC2)c1 ZINC000060551358 1034726829 /nfs/dbraw/zinc/72/68/29/1034726829.db2.gz NEKKKFVWYASDBZ-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO CC(C)N(C)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236652772 1035029601 /nfs/dbraw/zinc/02/96/01/1035029601.db2.gz WZIQSRJREKSWDN-UHFFFAOYSA-N 1 0 333.457 3.753 20 5 EHBDRO COc1ccc2[nH]cc(CC[NH2+]Cc3ccc([N+](=O)[O-])cc3C)c2c1 ZINC000612580327 1035076987 /nfs/dbraw/zinc/07/69/87/1035076987.db2.gz UJGYSYVLMMPGKK-UHFFFAOYSA-N 1 0 339.395 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)c(F)c1 ZINC000612593291 1035084536 /nfs/dbraw/zinc/08/45/36/1035084536.db2.gz ZMXSRVXWQQCWNQ-QAPCUYQASA-N 1 0 348.349 3.883 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCn2ccnc2)c2ccccc2)c1 ZINC000179963792 1035095661 /nfs/dbraw/zinc/09/56/61/1035095661.db2.gz BWPUXWHXTTXJFX-IBGZPJMESA-N 1 0 336.395 3.561 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+]C(C)(C)c1ccccc1[N+](=O)[O-])CC2 ZINC000492224211 1035512298 /nfs/dbraw/zinc/51/22/98/1035512298.db2.gz IWMRQGRIWLOKJO-MRXNPFEDSA-N 1 0 340.423 3.986 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1[C@H]3CCO[C@H]3C13CCC3)CCC2 ZINC000248753911 1035536777 /nfs/dbraw/zinc/53/67/77/1035536777.db2.gz CHCJRZSZSMLRPZ-VDHUWJSZSA-N 1 0 328.412 3.519 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](CO)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000588232397 1035832919 /nfs/dbraw/zinc/83/29/19/1035832919.db2.gz DFBNJBUEYFRTNI-IUODEOHRSA-N 1 0 334.803 3.675 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccco1)N1CCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000122135213 1035866951 /nfs/dbraw/zinc/86/69/51/1035866951.db2.gz CNMRHKJZMPPCFJ-PBHICJAKSA-N 1 0 329.400 3.676 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1 ZINC000460347895 1035928081 /nfs/dbraw/zinc/92/80/81/1035928081.db2.gz DPGHDAVUPQMRLR-RHSMWYFYSA-N 1 0 333.432 3.506 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C1CCC(OC(C)C)CC1 ZINC000130202838 1035954252 /nfs/dbraw/zinc/95/42/52/1035954252.db2.gz RZKZAAXUHVXEQN-UHFFFAOYSA-N 1 0 336.432 3.819 20 5 EHBDRO COc1cc(C)c([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000171128003 1035981810 /nfs/dbraw/zinc/98/18/10/1035981810.db2.gz MGCLZNCPVKUBRM-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589110893 1036257040 /nfs/dbraw/zinc/25/70/40/1036257040.db2.gz OYADUEDEZYTIQZ-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)[C@@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000492814353 1036332457 /nfs/dbraw/zinc/33/24/57/1036332457.db2.gz AOFHCMASMMHQGR-CJNGLKHVSA-N 1 0 342.395 3.648 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)Cc1cc(C(=O)OC)ccc1[N+](=O)[O-] ZINC000589494408 1036437171 /nfs/dbraw/zinc/43/71/71/1036437171.db2.gz GJOXNQYCPDSULA-UHFFFAOYSA-N 1 0 342.395 3.794 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)s1 ZINC000609132754 1036468155 /nfs/dbraw/zinc/46/81/55/1036468155.db2.gz GWLUVZYZCURWSU-OAHLLOKOSA-N 1 0 331.441 3.633 20 5 EHBDRO CCOc1cccc([C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000493005837 1036513566 /nfs/dbraw/zinc/51/35/66/1036513566.db2.gz ANSJUNUMBNREEZ-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO CC[NH+](CC)CCOc1ccccc1CNc1ccsc1[N+](=O)[O-] ZINC000589559682 1036524128 /nfs/dbraw/zinc/52/41/28/1036524128.db2.gz MBAPAMOLQALLFO-UHFFFAOYSA-N 1 0 349.456 3.989 20 5 EHBDRO Cc1ccccc1[C@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(N)c1F)[NH+](C)C ZINC000589600658 1036544525 /nfs/dbraw/zinc/54/45/25/1036544525.db2.gz CUBVXLHZDNAUHU-SGTLLEGYSA-N 1 0 346.406 3.728 20 5 EHBDRO C[N@H+]1Cc2ccccc2[C@H](Nc2ccnc3c2cccc3[N+](=O)[O-])C1 ZINC000590082353 1036735894 /nfs/dbraw/zinc/73/58/94/1036735894.db2.gz RZYNJDSXEPWDFB-QGZVFWFLSA-N 1 0 334.379 3.742 20 5 EHBDRO Cc1cc(NC(=O)c2ccc(Cl)cc2[N+](=O)[O-])ccc1C[NH+](C)C ZINC001299188621 1036811660 /nfs/dbraw/zinc/81/16/60/1036811660.db2.gz WGUCHSGLHOBUJZ-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO C[C@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[NH+]1[C@H](C)CC[C@H]1C ZINC000783775820 1036812671 /nfs/dbraw/zinc/81/26/71/1036812671.db2.gz IULOMQVTLBHQSY-IJLUTSLNSA-N 1 0 340.807 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@H]2Cc2ccccc2)c1 ZINC000026233088 1036838856 /nfs/dbraw/zinc/83/88/56/1036838856.db2.gz XBHVZMWIYTWYAC-KRWDZBQOSA-N 1 0 336.395 3.609 20 5 EHBDRO C[C@@H](CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000180469562 1036873174 /nfs/dbraw/zinc/87/31/74/1036873174.db2.gz MWVWBTBHKHNSBR-MGPUTAFESA-N 1 0 339.439 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCN(c3ccccc3)CC2)cc1Cl ZINC000761506880 1037076685 /nfs/dbraw/zinc/07/66/85/1037076685.db2.gz OOSYWODRWOOCER-UHFFFAOYSA-N 1 0 345.830 3.961 20 5 EHBDRO C[C@@](CO)([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCCCC1 ZINC000761528106 1037105243 /nfs/dbraw/zinc/10/52/43/1037105243.db2.gz ZKUDWNYXNHONGE-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCCCC[C@@H]2/C=C/c2cccs2)n1 ZINC000542131642 1037107242 /nfs/dbraw/zinc/10/72/42/1037107242.db2.gz NKZDUSHJMZKCTR-MVGZEHJDSA-N 1 0 346.456 3.811 20 5 EHBDRO CCOc1cc(NCC[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000386746339 1037347501 /nfs/dbraw/zinc/34/75/01/1037347501.db2.gz ZSKQQAYCNNWDFJ-UHFFFAOYSA-N 1 0 329.400 3.537 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462783693 1037386782 /nfs/dbraw/zinc/38/67/82/1037386782.db2.gz UIVJKGMAYLSYSQ-LLVKDONJSA-N 1 0 342.237 3.644 20 5 EHBDRO CC[N@H+](Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1)CC(C)(C)C ZINC000462830801 1037453722 /nfs/dbraw/zinc/45/37/22/1037453722.db2.gz GCNCJJZEBVRYNB-UHFFFAOYSA-N 1 0 330.432 3.863 20 5 EHBDRO CC(C)[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCOC1 ZINC000462877889 1037507403 /nfs/dbraw/zinc/50/74/03/1037507403.db2.gz RKQVJPVFCDRHSG-INIZCTEOSA-N 1 0 330.384 3.854 20 5 EHBDRO C[C@@H](O)[C@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000443786892 1037536507 /nfs/dbraw/zinc/53/65/07/1037536507.db2.gz GTABYMUDLFIOSS-HBUWYVDXSA-N 1 0 344.411 3.836 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCOc3c(C)cccc32)cc1[N+](=O)[O-] ZINC000188882851 1037545339 /nfs/dbraw/zinc/54/53/39/1037545339.db2.gz YUOIBBPPTNZXMZ-OAHLLOKOSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000532518771 1037560841 /nfs/dbraw/zinc/56/08/41/1037560841.db2.gz UWNOFEHWLFBNRQ-HUUCEWRRSA-N 1 0 341.411 3.657 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CC[N@H+](CC3CCCC3)C2)ccc2ncccc21 ZINC000462947329 1037574039 /nfs/dbraw/zinc/57/40/39/1037574039.db2.gz LGLHZCYKGHYWAR-OAHLLOKOSA-N 1 0 340.427 3.819 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cn(C)nc1C(F)(F)F ZINC000540148647 1037605925 /nfs/dbraw/zinc/60/59/25/1037605925.db2.gz XOUXVLAURLIKEV-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](CC)c2c(C)nn(C)c2C)ccc1[N+](=O)[O-] ZINC000491677905 1037615623 /nfs/dbraw/zinc/61/56/23/1037615623.db2.gz RENJVXMTTVTLNO-HNNXBMFYSA-N 1 0 346.431 3.585 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000493905412 1037703299 /nfs/dbraw/zinc/70/32/99/1037703299.db2.gz HSKMWFRRLCYJRU-CQSZACIVSA-N 1 0 337.851 3.699 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2ccc(F)cc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480907364 1037708832 /nfs/dbraw/zinc/70/88/32/1037708832.db2.gz ZJXIWTBXRVXBED-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]CCc2ccc(Br)s2)cs1 ZINC000225588002 1037840601 /nfs/dbraw/zinc/84/06/01/1037840601.db2.gz BSIBIVFSGWUOOI-UHFFFAOYSA-N 1 0 347.259 3.813 20 5 EHBDRO C[C@H](C[NH2+]C[C@H]1CCN(c2ccccc2)C1)c1ccccc1[N+](=O)[O-] ZINC000897461718 1037847716 /nfs/dbraw/zinc/84/77/16/1037847716.db2.gz WETWORGXQVMWQX-IAGOWNOFSA-N 1 0 339.439 3.814 20 5 EHBDRO CCc1ccc([C@@H]([NH2+][C@@H](CC)CCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000542475099 1037889580 /nfs/dbraw/zinc/88/95/80/1037889580.db2.gz PVAGFZCISSCSPP-KSSFIOAISA-N 1 0 332.400 3.590 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000540397871 1037914439 /nfs/dbraw/zinc/91/44/39/1037914439.db2.gz JZZMGCHSWVCINY-KNIMUDFMSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]Cc1ccc(CO)cc1 ZINC000592392858 1037934286 /nfs/dbraw/zinc/93/42/86/1037934286.db2.gz AADBUJSDBJPUSJ-PKOBYXMFSA-N 1 0 340.423 3.588 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117027 1038156437 /nfs/dbraw/zinc/15/64/37/1038156437.db2.gz QFPHWJQJMOTNLO-IUODEOHRSA-N 1 0 344.415 3.949 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H]1CCN(C2CCCC2)C1 ZINC000468656246 1038397104 /nfs/dbraw/zinc/39/71/04/1038397104.db2.gz TZECUIVPKGFSDV-JMPLCFMRSA-N 1 0 329.444 3.605 20 5 EHBDRO CC(C)C[C@@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538731133 1038497080 /nfs/dbraw/zinc/49/70/80/1038497080.db2.gz DLSYTFNKWOQISM-HNNXBMFYSA-N 1 0 342.443 3.863 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000538760042 1038509738 /nfs/dbraw/zinc/50/97/38/1038509738.db2.gz NPJDZVPOWSSHTC-GJZGRUSLSA-N 1 0 347.459 3.513 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCC[NH+]1[C@H](C)CCC[C@H]1C ZINC000538745615 1038511083 /nfs/dbraw/zinc/51/10/83/1038511083.db2.gz KFBXSKVIODDLME-HUUCEWRRSA-N 1 0 347.459 3.513 20 5 EHBDRO CCc1nc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000192804722 1038555271 /nfs/dbraw/zinc/55/52/71/1038555271.db2.gz PGMZHUZZKLVJEH-MRXNPFEDSA-N 1 0 331.441 3.823 20 5 EHBDRO CC[NH+]1CCN(c2cccc(Nc3sccc3[N+](=O)[O-])c2)CC1 ZINC000613704712 1038607135 /nfs/dbraw/zinc/60/71/35/1038607135.db2.gz MEHLPYWGYIOMEV-UHFFFAOYSA-N 1 0 332.429 3.542 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)[C@@H]2CCOC2)c(F)c1 ZINC000539297939 1038764994 /nfs/dbraw/zinc/76/49/94/1038764994.db2.gz XAJLFOUHCSCRHV-CRAIPNDOSA-N 1 0 330.359 3.601 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000479863146 1038839968 /nfs/dbraw/zinc/83/99/68/1038839968.db2.gz QVIPTSWMEUZCKY-SJLPKXTDSA-N 1 0 341.455 3.727 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](CCCc3ccc(Cl)cc3)CC2)n1 ZINC000365823764 1038947406 /nfs/dbraw/zinc/94/74/06/1038947406.db2.gz WIROACZDRQVRID-UHFFFAOYSA-N 1 0 348.834 3.714 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@](C)(CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000477861704 1038972095 /nfs/dbraw/zinc/97/20/95/1038972095.db2.gz NDTWNOJKLIIYPE-OXQOHEQNSA-N 1 0 342.439 3.795 20 5 EHBDRO COc1cc(C[N@H+](C)[C@H]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000485453220 1039085840 /nfs/dbraw/zinc/08/58/40/1039085840.db2.gz RSTCWGCEQUDMLA-KRWDZBQOSA-N 1 0 326.396 3.593 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C[C@H]2CCc3ccccc32)n1 ZINC000570154644 1039155007 /nfs/dbraw/zinc/15/50/07/1039155007.db2.gz JUDNQLUTGQWWJO-BPQIPLTHSA-N 1 0 340.427 3.595 20 5 EHBDRO Cc1cccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000905852327 1039157599 /nfs/dbraw/zinc/15/75/99/1039157599.db2.gz IDRXKWXRBADGGO-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CC[C@H](O)C23CCCC3)o1 ZINC000552316902 1039201698 /nfs/dbraw/zinc/20/16/98/1039201698.db2.gz RXOQSCQKQBJZOH-SFHVURJKSA-N 1 0 342.395 3.734 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])[nH]1 ZINC000488465425 1039206179 /nfs/dbraw/zinc/20/61/79/1039206179.db2.gz OHIZDSVDFHALTP-MELADBBJSA-N 1 0 345.447 3.898 20 5 EHBDRO Cc1cc(N2CCOC[C@H](C3CCC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000488735538 1039362999 /nfs/dbraw/zinc/36/29/99/1039362999.db2.gz NZRMMMVWXGOGDC-OAHLLOKOSA-N 1 0 341.411 3.704 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CCO[C@H](C4CC4)C3)s2)cc1 ZINC000485686072 1039423392 /nfs/dbraw/zinc/42/33/92/1039423392.db2.gz RNRFIWFGDWMQCK-KRWDZBQOSA-N 1 0 344.436 3.934 20 5 EHBDRO C[C@@H]1C[C@H](CCNc2ncccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000511603751 1039430452 /nfs/dbraw/zinc/43/04/52/1039430452.db2.gz MDGPRTLCQXQBDV-WBVHZDCISA-N 1 0 340.427 3.702 20 5 EHBDRO C[C@H]1C[C@H](CCNc2ncccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000511603749 1039431113 /nfs/dbraw/zinc/43/11/13/1039431113.db2.gz MDGPRTLCQXQBDV-RDJZCZTQSA-N 1 0 340.427 3.702 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)CC(=O)Nc2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000478475780 1039480984 /nfs/dbraw/zinc/48/09/84/1039480984.db2.gz ADEOIYOCKFSYNH-LBPRGKRZSA-N 1 0 345.374 3.549 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)Cc1ccc2c(c1)OCO2 ZINC000485738640 1039491087 /nfs/dbraw/zinc/49/10/87/1039491087.db2.gz OUYPIWTXIXEYJE-CYBMUJFWSA-N 1 0 328.368 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(CCO)CCCC3)o2)cc1 ZINC000512497031 1039520328 /nfs/dbraw/zinc/52/03/28/1039520328.db2.gz PWNIVVCEMNPVSI-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO COc1ccc2oc(C[NH2+]Cc3cccc([N+](=O)[O-])c3C)cc2c1 ZINC000480485547 1039590447 /nfs/dbraw/zinc/59/04/47/1039590447.db2.gz DAILZNVPBKUECC-UHFFFAOYSA-N 1 0 326.352 3.948 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000417299053 1039641056 /nfs/dbraw/zinc/64/10/56/1039641056.db2.gz LWWQGSVIOKMSFY-MSOLQXFVSA-N 1 0 343.427 3.848 20 5 EHBDRO CCN(CC)C(=O)CCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302860 1039643673 /nfs/dbraw/zinc/64/36/73/1039643673.db2.gz BZTPEUGSFNIMMK-SFHVURJKSA-N 1 0 347.459 3.601 20 5 EHBDRO CCOc1ncccc1C[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417333884 1039692885 /nfs/dbraw/zinc/69/28/85/1039692885.db2.gz ZKSBBAVYUKELPY-SFHVURJKSA-N 1 0 341.411 3.946 20 5 EHBDRO CCc1ccc([C@@H](NCC2([NH+](C)C)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000417357839 1039715974 /nfs/dbraw/zinc/71/59/74/1039715974.db2.gz SGGXAWBEICPAAZ-SFHVURJKSA-N 1 0 343.427 3.523 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@@H](C)C[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000480700920 1039924719 /nfs/dbraw/zinc/92/47/19/1039924719.db2.gz RYZCYCWYQFVSDN-JKSUJKDBSA-N 1 0 349.475 3.909 20 5 EHBDRO C[NH+](C)[C@H](CNc1ncnc2sc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000553277088 1039930567 /nfs/dbraw/zinc/93/05/67/1039930567.db2.gz ZKUWTMFKYJCTIA-CYBMUJFWSA-N 1 0 349.460 3.522 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](Cc2ccccc2)CN(C)C)cc1[N+](=O)[O-] ZINC000480877122 1040124530 /nfs/dbraw/zinc/12/45/30/1040124530.db2.gz KMWMXUFDXYZVLE-APWZRJJASA-N 1 0 341.455 3.727 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@@H]2C)ccc1[N+](=O)[O-] ZINC000490034293 1040300711 /nfs/dbraw/zinc/30/07/11/1040300711.db2.gz VBXTYPPEPKBEFF-WMLDXEAASA-N 1 0 326.396 3.981 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000105448284 1040316849 /nfs/dbraw/zinc/31/68/49/1040316849.db2.gz MXUFEIHSKSICQU-UHFFFAOYSA-N 1 0 336.395 3.626 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)CCC(C)(C)C)cc1[N+](=O)[O-] ZINC000479528423 1040325129 /nfs/dbraw/zinc/32/51/29/1040325129.db2.gz QRGOWKLVFZUNFO-UKRRQHHQSA-N 1 0 338.448 3.831 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@H]1C ZINC000481086642 1040342054 /nfs/dbraw/zinc/34/20/54/1040342054.db2.gz DNUXTIPTLKYEBG-HIFRSBDPSA-N 1 0 333.432 3.646 20 5 EHBDRO CCC[C@@H](C)[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069280 1040431462 /nfs/dbraw/zinc/43/14/62/1040431462.db2.gz GNHRALPPEIRXMF-ZBFHGGJFSA-N 1 0 333.432 3.824 20 5 EHBDRO Cc1ccc(NC(=O)C[C@H](c2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000433110117 1040770738 /nfs/dbraw/zinc/77/07/38/1040770738.db2.gz OBGLTUGDGHBSMS-QGZVFWFLSA-N 1 0 327.384 3.535 20 5 EHBDRO C[C@@H](CO)[C@H](C)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000123266657 1040788980 /nfs/dbraw/zinc/78/89/80/1040788980.db2.gz LPXUHNSKPJQWKN-STQMWFEESA-N 1 0 348.374 3.633 20 5 EHBDRO CC1CC[NH+](C[C@@H]2CCCN(Cc3ccc([N+](=O)[O-])cc3F)C2)CC1 ZINC000491082031 1040889019 /nfs/dbraw/zinc/88/90/19/1040889019.db2.gz ZJGWCSSBLSKPTQ-INIZCTEOSA-N 1 0 349.450 3.678 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc(C(=O)N(C)C)cc1 ZINC000292119141 1040950381 /nfs/dbraw/zinc/95/03/81/1040950381.db2.gz KSTLENUJNSBPGU-ZIAGYGMSSA-N 1 0 341.411 3.708 20 5 EHBDRO C[NH+](C)[C@H]1CCOc2c(NCc3cccc([N+](=O)[O-])c3)cccc21 ZINC000433205132 1041060494 /nfs/dbraw/zinc/06/04/94/1041060494.db2.gz JPWGXMFBLVWCCO-KRWDZBQOSA-N 1 0 327.384 3.592 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2cc(N)ccc2[N+](=O)[O-])[C@H]1c1cccs1 ZINC000249363858 1041132043 /nfs/dbraw/zinc/13/20/43/1041132043.db2.gz VIVDZQFUMHBLJW-SJCJKPOMSA-N 1 0 346.456 3.734 20 5 EHBDRO CC(C)C[C@@H](CCO)C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433284386 1041233796 /nfs/dbraw/zinc/23/37/96/1041233796.db2.gz DZSWYMVCPGCLHK-RDTXWAMCSA-N 1 0 334.460 3.952 20 5 EHBDRO CC(=O)c1cc(NCCCC[N@H+]2CCC[C@H](C)C2)ccc1[N+](=O)[O-] ZINC000341520192 1041256124 /nfs/dbraw/zinc/25/61/24/1041256124.db2.gz ACZOJNISNHTZQC-AWEZNQCLSA-N 1 0 333.432 3.721 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(-c3cc[nH]n3)o2)cc1[N+](=O)[O-] ZINC000433325263 1041301740 /nfs/dbraw/zinc/30/17/40/1041301740.db2.gz IBFCRBBQVXUTFE-LBPRGKRZSA-N 1 0 326.356 3.737 20 5 EHBDRO C[C@@H](CCNc1ccnc2c1cccc2[N+](=O)[O-])[NH+]1CCCCC1 ZINC000432166824 1041676954 /nfs/dbraw/zinc/67/69/54/1041676954.db2.gz NLOITTQRHAQHPR-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000125513761 1042250305 /nfs/dbraw/zinc/25/03/05/1042250305.db2.gz FSZHYAAOAMYHLE-LBPRGKRZSA-N 1 0 341.367 3.505 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C/C=C/c1ccc(F)c(F)c1 ZINC000511942006 1042466273 /nfs/dbraw/zinc/46/62/73/1042466273.db2.gz KEDURZAHCHYIRL-NSCUHMNNSA-N 1 0 334.322 3.685 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCNc2cc[nH+]c3cc(F)ccc23)cc1 ZINC000500445799 1042877447 /nfs/dbraw/zinc/87/74/47/1042877447.db2.gz FATRRINBHPHCIW-UHFFFAOYSA-N 1 0 326.331 3.806 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CC[NH+](C4CCCCC4)CC3)ccnc21 ZINC000432333974 1042968031 /nfs/dbraw/zinc/96/80/31/1042968031.db2.gz DIEVXUGAEAJBJY-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1COc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000344017317 1043105357 /nfs/dbraw/zinc/10/53/57/1043105357.db2.gz FCFDHXCRKGXJIM-DOTOQJQBSA-N 1 0 330.359 3.778 20 5 EHBDRO CCC[C@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421086 1043157830 /nfs/dbraw/zinc/15/78/30/1043157830.db2.gz FSRYGANXJJIWEW-APWZRJJASA-N 1 0 349.475 3.527 20 5 EHBDRO COc1ccc2nc(C[NH2+]CCc3ccccc3[N+](=O)[O-])sc2c1 ZINC000344061796 1043186475 /nfs/dbraw/zinc/18/64/75/1043186475.db2.gz JKGBFFRBRRSEOJ-UHFFFAOYSA-N 1 0 343.408 3.545 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)CCO2 ZINC000344100621 1043250376 /nfs/dbraw/zinc/25/03/76/1043250376.db2.gz GQCNEQWFPWUJHX-SJKOYZFVSA-N 1 0 328.368 3.778 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1O ZINC000279113730 1043372446 /nfs/dbraw/zinc/37/24/46/1043372446.db2.gz PKEATXGIDIEHAQ-INIZCTEOSA-N 1 0 342.395 3.821 20 5 EHBDRO CC[C@@H](O)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000344916508 1044681793 /nfs/dbraw/zinc/68/17/93/1044681793.db2.gz JOYGLQBNBJDHQJ-QGZVFWFLSA-N 1 0 343.427 3.613 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1nc(C)c(C)s1 ZINC000344969573 1044751524 /nfs/dbraw/zinc/75/15/24/1044751524.db2.gz AKEPIWPQCVNGSQ-FMIVXFBMSA-N 1 0 331.441 3.904 20 5 EHBDRO CCCC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)C1CCC1 ZINC000184884721 1126706453 /nfs/dbraw/zinc/70/64/53/1126706453.db2.gz TWXAJPGDOBXAPC-KRWDZBQOSA-N 1 0 334.416 3.910 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000185879366 1127181795 /nfs/dbraw/zinc/18/17/95/1127181795.db2.gz FQGOENCPHFAELZ-AWEZNQCLSA-N 1 0 349.431 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)c2cccc(Cl)c2)C2CC2)cc1 ZINC000764491630 1127498855 /nfs/dbraw/zinc/49/88/55/1127498855.db2.gz DLYJTQIFZXOEDH-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ncc([N+](=O)[O-])cc1Cl ZINC000301283644 1127729577 /nfs/dbraw/zinc/72/95/77/1127729577.db2.gz PLKPZHMCJXXQEG-LBPRGKRZSA-N 1 0 326.828 3.710 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cn2)CC1 ZINC000301313467 1127736784 /nfs/dbraw/zinc/73/67/84/1127736784.db2.gz KCTOBMKWAVQPLD-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO C[C@@H]1C[C@H](CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000273187570 1128447740 /nfs/dbraw/zinc/44/77/40/1128447740.db2.gz GBBUOSBGWPYMFG-RKVPGOIHSA-N 1 0 332.444 3.711 20 5 EHBDRO CCCOc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765849375 1128573035 /nfs/dbraw/zinc/57/30/35/1128573035.db2.gz PSXURBSZZYBFME-KUHUBIRLSA-N 1 0 344.411 3.768 20 5 EHBDRO CCOc1cc(NC[C@@H]2CC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698825 1128729998 /nfs/dbraw/zinc/72/99/98/1128729998.db2.gz UXRHJYUBBJYQNO-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](c1ccccc1)C(C)(C)CO ZINC000554867370 1128742047 /nfs/dbraw/zinc/74/20/47/1128742047.db2.gz OCHLLROXDHDDEN-SFHVURJKSA-N 1 0 328.412 3.753 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2cnn(CC3CCC3)c2)cc1[N+](=O)[O-] ZINC000921818794 1128786781 /nfs/dbraw/zinc/78/67/81/1128786781.db2.gz QWSLMVPXAVEGJK-CQSZACIVSA-N 1 0 328.416 3.751 20 5 EHBDRO Cc1nc(NCc2ccccc2C[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000301644230 1128839169 /nfs/dbraw/zinc/83/91/69/1128839169.db2.gz NDZAAWMSFCSRTM-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc(NCCCCC[NH+]2CCCC2)c2ncccc12 ZINC000338753294 1128857405 /nfs/dbraw/zinc/85/74/05/1128857405.db2.gz BZCLUYJZNUIHET-UHFFFAOYSA-N 1 0 328.416 3.821 20 5 EHBDRO C[C@@H](C1CC[NH+](C)CC1)N(C)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000542506318 1120837041 /nfs/dbraw/zinc/83/70/41/1120837041.db2.gz ODJXPTYVWTZMOC-NSHDSACASA-N 1 0 345.365 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC(C3CCOCC3)CC2)cc1 ZINC000153327497 1120962389 /nfs/dbraw/zinc/96/23/89/1120962389.db2.gz GIQRIJCHLWZOET-UHFFFAOYSA-N 1 0 348.443 3.502 20 5 EHBDRO O=c1[nH]c2ccccc2cc1C[N@@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000130580246 1121097900 /nfs/dbraw/zinc/09/79/00/1121097900.db2.gz MUYCZWNXWVWQPU-UHFFFAOYSA-N 1 0 349.390 3.601 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCCn2cnc3ccccc32)cccc1[N+](=O)[O-] ZINC000161556429 1128965292 /nfs/dbraw/zinc/96/52/92/1128965292.db2.gz MQLRBHOMIKYPCX-HNNXBMFYSA-N 1 0 338.411 3.994 20 5 EHBDRO Cc1cnc(N[C@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311039588 1128977134 /nfs/dbraw/zinc/97/71/34/1128977134.db2.gz DWZQUFWAEDXCEL-WBVHZDCISA-N 1 0 340.427 3.621 20 5 EHBDRO CC(C)c1ccc(CN2CCC[C@H]2[C@H](O)C(F)(F)F)cc1[N+](=O)[O-] ZINC000123715773 1121616373 /nfs/dbraw/zinc/61/63/73/1121616373.db2.gz MFDSOGXBBCIMBD-ZFWWWQNUSA-N 1 0 346.349 3.606 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N1CCN(C/C=C/c2ccccc2)CC1 ZINC000301100848 1121692516 /nfs/dbraw/zinc/69/25/16/1121692516.db2.gz OIRKZNIQPGXCHA-VMPITWQZSA-N 1 0 341.386 3.569 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000272575235 1121731871 /nfs/dbraw/zinc/73/18/71/1121731871.db2.gz WZRWMWFRLPBNDG-FRFSOERESA-N 1 0 328.416 3.586 20 5 EHBDRO Cc1ncc([C@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c(C)n1 ZINC000272600548 1121767756 /nfs/dbraw/zinc/76/77/56/1121767756.db2.gz IWGAOZHTNCZVQE-JTQLQIEISA-N 1 0 334.807 3.548 20 5 EHBDRO Cc1c(C[N@@H+]2CCCO[C@@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000609233632 1121836916 /nfs/dbraw/zinc/83/69/16/1121836916.db2.gz FMCLMZOGDWGEHI-LJQANCHMSA-N 1 0 326.396 3.867 20 5 EHBDRO CC(=O)c1c(NC[C@H](c2cccc(F)c2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207099 1121876634 /nfs/dbraw/zinc/87/66/34/1121876634.db2.gz QOOVDTRCUQBLTP-QGZVFWFLSA-N 1 0 345.374 3.651 20 5 EHBDRO Cc1ccc(NC(=O)/C=C\c2ccccc2[N+](=O)[O-])c(C[NH+](C)C)c1 ZINC000255131908 1129023326 /nfs/dbraw/zinc/02/33/26/1129023326.db2.gz VANZXQXZSRHDCF-LUAWRHEFSA-N 1 0 339.395 3.617 20 5 EHBDRO C[C@@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000301741628 1129028354 /nfs/dbraw/zinc/02/83/54/1129028354.db2.gz LGKAYTGFHMYRCF-LBPRGKRZSA-N 1 0 346.818 3.502 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000917073206 1122478324 /nfs/dbraw/zinc/47/83/24/1122478324.db2.gz ITROXJYTLRLKGM-ZDUSSCGKSA-N 1 0 336.392 3.570 20 5 EHBDRO C[N@@H+](Cc1cc2ccccc2o1)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154394320 1122596432 /nfs/dbraw/zinc/59/64/32/1122596432.db2.gz LYNXKZWHWHWQPB-KRWDZBQOSA-N 1 0 326.352 3.506 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H](c2ccccc2)C2CCC2)c1 ZINC000154523150 1122684455 /nfs/dbraw/zinc/68/44/55/1122684455.db2.gz VRTMSMSSAABKJP-MOPGFXCFSA-N 1 0 326.396 3.759 20 5 EHBDRO O=C(NCCCCCCC[NH+]1CCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000920258480 1123344502 /nfs/dbraw/zinc/34/45/02/1123344502.db2.gz VFKLPVCXSWVXSI-UHFFFAOYSA-N 1 0 348.447 3.763 20 5 EHBDRO CC(C)([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C(=O)Nc1ccccc1 ZINC000609392923 1123563931 /nfs/dbraw/zinc/56/39/31/1123563931.db2.gz BEEXVNZBEPTFFE-NTMALXAHSA-N 1 0 339.395 3.615 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609672699 1123641673 /nfs/dbraw/zinc/64/16/73/1123641673.db2.gz XXCWCCCRXYAPRV-WBVHZDCISA-N 1 0 326.396 3.852 20 5 EHBDRO C[C@@H](c1ccccc1)[NH+]1CCC(Nc2cccnc2[N+](=O)[O-])CC1 ZINC000609704130 1123647612 /nfs/dbraw/zinc/64/76/12/1123647612.db2.gz BHWZARRWMUJYIE-AWEZNQCLSA-N 1 0 326.400 3.627 20 5 EHBDRO CCCCC[N@H+](CCCn1c(=O)oc2ccc([N+](=O)[O-])cc21)C(C)C ZINC000609766483 1123663663 /nfs/dbraw/zinc/66/36/63/1123663663.db2.gz VCQTUKMDXSCDDB-UHFFFAOYSA-N 1 0 349.431 3.793 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc([N+](=O)[O-])cc2F)C1 ZINC000301249648 1123752477 /nfs/dbraw/zinc/75/24/77/1123752477.db2.gz CTPDUXWRMYUOHR-GJZGRUSLSA-N 1 0 335.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCCCO3)s2)cc1 ZINC000237989378 1123940406 /nfs/dbraw/zinc/94/04/06/1123940406.db2.gz VMRRVUYPSWWDQQ-HNNXBMFYSA-N 1 0 332.425 3.982 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCc2cnn(C(C)C)c2C1 ZINC000616357541 1123988414 /nfs/dbraw/zinc/98/84/14/1123988414.db2.gz ZPYKIGFYIWANDY-ZBFHGGJFSA-N 1 0 342.443 3.889 20 5 EHBDRO C[C@@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1cccc([N+](=O)[O-])c1 ZINC000180453828 1124008299 /nfs/dbraw/zinc/00/82/99/1124008299.db2.gz JERVWGFHVKLXLF-CYBMUJFWSA-N 1 0 345.355 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1OCCc3ccccc31)CCC2 ZINC000618571749 1125120102 /nfs/dbraw/zinc/12/01/02/1125120102.db2.gz VZQSWZPHMWSYOJ-UXHICEINSA-N 1 0 338.407 3.876 20 5 EHBDRO COc1cccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c1F ZINC000619715461 1125388198 /nfs/dbraw/zinc/38/81/98/1125388198.db2.gz JFDODWMGVLIGPQ-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2ccc(Br)cc2)cc1[N+](=O)[O-] ZINC000314265521 1129249400 /nfs/dbraw/zinc/24/94/00/1129249400.db2.gz BPNNDAFLWCHVGH-UHFFFAOYSA-N 1 0 349.228 3.998 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2ccc3c(c2)OCCO3)C2CC2)c1 ZINC000079924158 1129307112 /nfs/dbraw/zinc/30/71/12/1129307112.db2.gz SXHPVHUTPYKPBU-LJQANCHMSA-N 1 0 340.379 3.607 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1ccccc1)Nc1ncc(Cl)cc1[N+](=O)[O-] ZINC000301993132 1129505548 /nfs/dbraw/zinc/50/55/48/1129505548.db2.gz GRVFUSKWVFTLFV-GFCCVEGCSA-N 1 0 334.807 3.576 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2CC[NH+](Cc3cccs3)CC2)n1 ZINC000123506994 1129531896 /nfs/dbraw/zinc/53/18/96/1129531896.db2.gz ZEFYYSHSHHYQNE-UHFFFAOYSA-N 1 0 346.456 3.684 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(C/C=C/c2ccccc2[N+](=O)[O-])CC1 ZINC000092219300 1129537318 /nfs/dbraw/zinc/53/73/18/1129537318.db2.gz NKZDWXMFJHATEU-SOFGYWHQSA-N 1 0 331.460 3.662 20 5 EHBDRO Cc1cc(CO)cc(C)c1C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000922560760 1129570459 /nfs/dbraw/zinc/57/04/59/1129570459.db2.gz LWMPJZTYJQFVHR-ALCCZGGFSA-N 1 0 326.396 3.507 20 5 EHBDRO CC1CCC([NH+]2CCN(C/C=C/c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000093386926 1129586386 /nfs/dbraw/zinc/58/63/86/1129586386.db2.gz AQEJTWWCXNGERZ-GQCTYLIASA-N 1 0 343.471 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCc1nc2c(s1)CCC2 ZINC000922715873 1129638558 /nfs/dbraw/zinc/63/85/58/1129638558.db2.gz XKISMYIYPKFNBL-UHFFFAOYSA-N 1 0 337.832 3.526 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2ccccc2)cn1 ZINC000390865323 1129638857 /nfs/dbraw/zinc/63/88/57/1129638857.db2.gz NXGAXCJFZZGTTQ-AYHJJNSGSA-N 1 0 338.411 3.597 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@@H](C(=O)NC(C)C)C2)cccc1[N+](=O)[O-] ZINC000331177678 1129655799 /nfs/dbraw/zinc/65/57/99/1129655799.db2.gz QKVUGRDRFCSEPD-ARFHVFGLSA-N 1 0 347.459 3.637 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H](C(=O)NC(C)C)C2)cccc1[N+](=O)[O-] ZINC000331177679 1129655879 /nfs/dbraw/zinc/65/58/79/1129655879.db2.gz QKVUGRDRFCSEPD-XHSDSOJGSA-N 1 0 347.459 3.637 20 5 EHBDRO Cc1cc(N2CC(C)(C)OC(C)(C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302688270 1129785942 /nfs/dbraw/zinc/78/59/42/1129785942.db2.gz ULPOZXIDECYDMC-UHFFFAOYSA-N 1 0 329.400 3.845 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000131409858 1129793392 /nfs/dbraw/zinc/79/33/92/1129793392.db2.gz DBLQHSMRPDNLFB-AZUAARDMSA-N 1 0 340.423 3.893 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccccc1 ZINC000029873801 1129904501 /nfs/dbraw/zinc/90/45/01/1129904501.db2.gz HYXYYQFKDDERPU-SFHVURJKSA-N 1 0 336.395 3.858 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN1CCc2sccc2C1 ZINC000132868623 1129905686 /nfs/dbraw/zinc/90/56/86/1129905686.db2.gz KLSYRVAPOLNORZ-CQSZACIVSA-N 1 0 345.468 3.674 20 5 EHBDRO Cc1nc(NCc2cccc(C[NH+]3CCCC3)c2)ccc1[N+](=O)[O-] ZINC000133052698 1129929847 /nfs/dbraw/zinc/92/98/47/1129929847.db2.gz YJIKGQRLAKAPDC-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO COc1cccc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000355408454 1129950766 /nfs/dbraw/zinc/95/07/66/1129950766.db2.gz BJYGBUWTZIKBRN-CQSZACIVSA-N 1 0 329.400 3.536 20 5 EHBDRO O=C(C[N@H+](CC1CCCCC1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000059409080 1129987498 /nfs/dbraw/zinc/98/74/98/1129987498.db2.gz MMNHAPGMKJFKJN-UHFFFAOYSA-N 1 0 331.416 3.578 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCCC[C@@H]1C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000171414167 1130054960 /nfs/dbraw/zinc/05/49/60/1130054960.db2.gz QCLLMALIXMXFJB-SLEUVZQESA-N 1 0 330.388 3.874 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccc(F)cc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000173349634 1130214011 /nfs/dbraw/zinc/21/40/11/1130214011.db2.gz OVBJWZXNLIPIMY-CABCVRRESA-N 1 0 343.402 3.911 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)C1 ZINC000245518110 1130228306 /nfs/dbraw/zinc/22/83/06/1130228306.db2.gz HJXJVCGQFUZNQS-UONOGXRCSA-N 1 0 334.416 3.628 20 5 EHBDRO C[C@@H](C[NH+]1CCCCC1)Nc1ccc(Br)cc1[N+](=O)[O-] ZINC000042322223 1130383880 /nfs/dbraw/zinc/38/38/80/1130383880.db2.gz LBFVWCUVCYRIOB-NSHDSACASA-N 1 0 342.237 3.644 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000733794890 1131082758 /nfs/dbraw/zinc/08/27/58/1131082758.db2.gz HITFVLDUVBCBSW-CVEARBPZSA-N 1 0 349.450 3.820 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000733992029 1131180482 /nfs/dbraw/zinc/18/04/82/1131180482.db2.gz LNCZXIRPJQYIKR-SFHVURJKSA-N 1 0 326.400 3.724 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2nc3ccc([N+](=O)[O-])cc3s2)C[C@@H]1C ZINC000740870791 1131550808 /nfs/dbraw/zinc/55/08/08/1131550808.db2.gz IMMFFGIVLRDOKA-NWDGAFQWSA-N 1 0 334.445 3.514 20 5 EHBDRO CCc1ccc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000737414164 1131575944 /nfs/dbraw/zinc/57/59/44/1131575944.db2.gz FLXWGCLRXROLDE-UHFFFAOYSA-N 1 0 331.441 3.541 20 5 EHBDRO Cc1cccc(C2(O)CC[NH+](Cc3ccccc3[N+](=O)[O-])CC2)c1C ZINC000741803869 1131652735 /nfs/dbraw/zinc/65/27/35/1131652735.db2.gz HTGDHXDFGMDOCK-UHFFFAOYSA-N 1 0 340.423 3.695 20 5 EHBDRO C[N@H+](CCC1CCCCC1)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000742147883 1131691011 /nfs/dbraw/zinc/69/10/11/1131691011.db2.gz KALOZTPVCGBJEY-UHFFFAOYSA-N 1 0 343.431 3.713 20 5 EHBDRO C[C@@H]1CCCN1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000742388059 1131713643 /nfs/dbraw/zinc/71/36/43/1131713643.db2.gz QQCPLLFDPFWQKI-CQSZACIVSA-N 1 0 345.468 3.897 20 5 EHBDRO CC[NH+]1CCC(CCNc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000742415573 1131720905 /nfs/dbraw/zinc/72/09/05/1131720905.db2.gz ZOPQHVXTZZSLOZ-UHFFFAOYSA-N 1 0 334.445 3.738 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000742420128 1131721958 /nfs/dbraw/zinc/72/19/58/1131721958.db2.gz ZGHRLRWKKKDEEM-LBPRGKRZSA-N 1 0 334.445 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cnc(Cl)s1)CC2 ZINC001172897232 1131880893 /nfs/dbraw/zinc/88/08/93/1131880893.db2.gz YGCQRCHKGRMJBH-LBPRGKRZSA-N 1 0 337.832 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCSCc1ccco1)CC2 ZINC001172899598 1131882965 /nfs/dbraw/zinc/88/29/65/1131882965.db2.gz OJMCVBCTQMNHCP-MRXNPFEDSA-N 1 0 346.452 3.958 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(N)cc1 ZINC001172901392 1131884211 /nfs/dbraw/zinc/88/42/11/1131884211.db2.gz IBDIWNOQBZUCMD-ACJLOTCBSA-N 1 0 325.412 3.775 20 5 EHBDRO Cc1nc(C)c(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)s1 ZINC001172901592 1131885015 /nfs/dbraw/zinc/88/50/15/1131885015.db2.gz OHFMTZIITAPKQF-HNNXBMFYSA-N 1 0 331.441 3.705 20 5 EHBDRO CCOC1CCC([NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172903761 1131886262 /nfs/dbraw/zinc/88/62/62/1131886262.db2.gz ICUCQASFHASXKB-MUYFXNHWSA-N 1 0 332.444 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@@H](F)C(F)(F)CC1)CC2 ZINC001172907902 1131887911 /nfs/dbraw/zinc/88/79/11/1131887911.db2.gz JJPLPXJAMUCTLY-GDBMZVCRSA-N 1 0 342.361 3.911 20 5 EHBDRO Cc1nc2c(s1)C[N@@H+]([C@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172914833 1131902558 /nfs/dbraw/zinc/90/25/58/1131902558.db2.gz JTUPKBDAYNEGCL-HNNXBMFYSA-N 1 0 343.452 3.665 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013795 1131935726 /nfs/dbraw/zinc/93/57/26/1131935726.db2.gz FXUFAQPXBPSZKY-LBPRGKRZSA-N 1 0 339.386 3.716 20 5 EHBDRO CCC1([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CCC1 ZINC001173009138 1131935857 /nfs/dbraw/zinc/93/58/57/1131935857.db2.gz SMPKTFZCYJPUGJ-UHFFFAOYSA-N 1 0 339.386 3.764 20 5 EHBDRO CCCC[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173014625 1131936138 /nfs/dbraw/zinc/93/61/38/1131936138.db2.gz VDCKVEXSGCAKLF-UHFFFAOYSA-N 1 0 327.375 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CC2(CC3CC3)CC2)c1F ZINC001173181928 1131993522 /nfs/dbraw/zinc/99/35/22/1131993522.db2.gz XIMOWPULUXZSJB-LBPRGKRZSA-N 1 0 336.407 3.843 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H]2CCCC(F)(F)C2)c1F ZINC001173187397 1131993735 /nfs/dbraw/zinc/99/37/35/1131993735.db2.gz FEJPJSABGBFMBO-WDEREUQCSA-N 1 0 346.349 3.841 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@H+](C)Cc2ccsc2)c1F ZINC001173195169 1131995778 /nfs/dbraw/zinc/99/57/78/1131995778.db2.gz CSZNIQRMHFHAIG-LLVKDONJSA-N 1 0 338.404 3.867 20 5 EHBDRO Cc1ccccc1O[C@H]1CC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173226689 1132006526 /nfs/dbraw/zinc/00/65/26/1132006526.db2.gz KWGPDJQXFPUFSZ-LPHOPBHVSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC001173229726 1132008558 /nfs/dbraw/zinc/00/85/58/1132008558.db2.gz PRZFBWBOAHXKOW-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC001173231906 1132009601 /nfs/dbraw/zinc/00/96/01/1132009601.db2.gz DMDFPERPPXTMGB-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO CSc1ccc(OCC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234074 1132010519 /nfs/dbraw/zinc/01/05/19/1132010519.db2.gz MAOQGLUTAVFWSW-CQSZACIVSA-N 1 0 346.452 3.916 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001173232493 1132010627 /nfs/dbraw/zinc/01/06/27/1132010627.db2.gz BSOOPMRUTNGUSX-CABCVRRESA-N 1 0 330.428 3.750 20 5 EHBDRO CCCC[N@H+](Cn1c2cc([N+](=O)[O-])ccc2oc1=O)C1CCCCC1 ZINC000746044210 1132352534 /nfs/dbraw/zinc/35/25/34/1132352534.db2.gz KITSPWGKKRMOCP-UHFFFAOYSA-N 1 0 347.415 3.895 20 5 EHBDRO CC(C)(C)OC(=O)CCCC[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000773427515 1132507399 /nfs/dbraw/zinc/50/73/99/1132507399.db2.gz NDKFHPDUJXHMRG-UHFFFAOYSA-N 1 0 342.823 3.850 20 5 EHBDRO COc1ccc([C@@H]([NH2+]CCOc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC001168785299 1132535347 /nfs/dbraw/zinc/53/53/47/1132535347.db2.gz KYKODYIIUGMDEL-IBGZPJMESA-N 1 0 344.411 3.969 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]CCCc2ccc(Cl)cc2Cl)C1 ZINC001168972690 1132623533 /nfs/dbraw/zinc/62/35/33/1132623533.db2.gz ASNOPXWTWRJFRY-SMDDNHRTSA-N 1 0 331.243 3.961 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2cncc(C(F)(F)F)c2)C2CC2)C1 ZINC001168999790 1132627639 /nfs/dbraw/zinc/62/76/39/1132627639.db2.gz VTGPUVKMMMXEMB-ONERCXAPSA-N 1 0 343.349 3.587 20 5 EHBDRO CCOc1cc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)ccc1[N+](=O)[O-] ZINC001169151496 1132678561 /nfs/dbraw/zinc/67/85/61/1132678561.db2.gz KIWOCIHNAZLBCC-KDOFPFPSSA-N 1 0 335.448 3.949 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1NCC1CCC2(CCC(=O)N2)CC1 ZINC001169296285 1132723264 /nfs/dbraw/zinc/72/32/64/1132723264.db2.gz QMDDROUTEWFYQY-UHFFFAOYSA-O 1 0 344.523 3.534 20 5 EHBDRO Nc1ccc(NCc2ccc(C[NH+]3CCCCC3)cc2)c([N+](=O)[O-])c1 ZINC000804333329 1132819304 /nfs/dbraw/zinc/81/93/04/1132819304.db2.gz HRIVRKPUXIQAAS-UHFFFAOYSA-N 1 0 340.427 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(OCC2CC2)nc1 ZINC001177608286 1133086453 /nfs/dbraw/zinc/08/64/53/1133086453.db2.gz UUZCQFJVELRPIQ-UHFFFAOYSA-N 1 0 341.411 3.685 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCNc2ccccc2)cc1[N+](=O)[O-] ZINC000768106417 1133095385 /nfs/dbraw/zinc/09/53/85/1133095385.db2.gz IWTWXBHHJRKPJJ-AWEZNQCLSA-N 1 0 329.400 3.756 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCc2nc(C)sc21 ZINC001178285811 1133153190 /nfs/dbraw/zinc/15/31/90/1133153190.db2.gz UAVDNWVGVFRJSA-AWEZNQCLSA-N 1 0 347.440 3.926 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CCN2C2CCCC2)cc1[N+](=O)[O-] ZINC001179314805 1133243695 /nfs/dbraw/zinc/24/36/95/1133243695.db2.gz FCUVWNXOXZATPU-QGZVFWFLSA-N 1 0 331.460 3.825 20 5 EHBDRO Cc1ccc(CN2CC[C@H]([NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)C2)cc1 ZINC001179405519 1133247241 /nfs/dbraw/zinc/24/72/41/1133247241.db2.gz DJPUVFYYCXZJIH-IBGZPJMESA-N 1 0 339.439 3.576 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000769445590 1133291639 /nfs/dbraw/zinc/29/16/39/1133291639.db2.gz HIBAJQPRQOVEEL-QGZVFWFLSA-N 1 0 341.411 3.583 20 5 EHBDRO C[N@H+](Cc1c2ccccc2c(Cl)c2ccccc21)[C@@H]1CCNC1=O ZINC000770378155 1133416268 /nfs/dbraw/zinc/41/62/68/1133416268.db2.gz DPPZPTDFHGZLGY-GOSISDBHSA-N 1 0 338.838 3.967 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1Cc2ccccc2O[C@@H](C)C1 ZINC001182127293 1133574931 /nfs/dbraw/zinc/57/49/31/1133574931.db2.gz MLFFGXFDULBYJD-AWEZNQCLSA-N 1 0 326.396 3.995 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@@H]1CC[C@@H](C2CC2)O1 ZINC001184056391 1133891516 /nfs/dbraw/zinc/89/15/16/1133891516.db2.gz POGKVHYCZSAZBK-JSGCOSHPSA-N 1 0 345.226 3.949 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1cccc(C)c1 ZINC000786815944 1133910055 /nfs/dbraw/zinc/91/00/55/1133910055.db2.gz OTQMEARQUJESOZ-XKSYAXFZSA-N 1 0 326.396 3.630 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](CCO)c1cccs1 ZINC000786816015 1133910436 /nfs/dbraw/zinc/91/04/36/1133910436.db2.gz VEQWRPPVOMSCPU-QSOAKEGCSA-N 1 0 332.425 3.773 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCCC[C@H]([C@H]2CCOC2)C1 ZINC001184252508 1133915418 /nfs/dbraw/zinc/91/54/18/1133915418.db2.gz QEIBLZXQABJSQE-IRXDYDNUSA-N 1 0 332.444 3.850 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)OC(=O)[C@@H]1CCC[N@@H+]1C1CCCC1 ZINC000786880483 1133922889 /nfs/dbraw/zinc/92/28/89/1133922889.db2.gz QSCMDQWVTXCZKY-KDOFPFPSSA-N 1 0 346.427 3.914 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000746671276 1133989765 /nfs/dbraw/zinc/98/97/65/1133989765.db2.gz CBGLDUXAIQHNRI-HNNXBMFYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@H](C[NH+]1CCCCC1)Nc1cccc(C(F)(F)F)c1[N+](=O)[O-] ZINC001184801978 1133992805 /nfs/dbraw/zinc/99/28/05/1133992805.db2.gz FAGBUUVJEDFYEM-LLVKDONJSA-N 1 0 331.338 3.900 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC[NH+]2CCCCC2)nc1-c1ccc(F)cc1 ZINC001184840271 1133996673 /nfs/dbraw/zinc/99/66/73/1133996673.db2.gz XVTVQSVCPNZRCA-UHFFFAOYSA-N 1 0 344.390 3.694 20 5 EHBDRO CC[N@H+](CCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774835269 1134037789 /nfs/dbraw/zinc/03/77/89/1134037789.db2.gz ZQIRKAZSBHSBEK-UHFFFAOYSA-N 1 0 329.356 3.568 20 5 EHBDRO C[NH+](C)CCN(Cc1ccccc1)c1ccc([N+](=O)[O-])cc1Cl ZINC001185691495 1134120522 /nfs/dbraw/zinc/12/05/22/1134120522.db2.gz CBYGIQFJTGCEFF-UHFFFAOYSA-N 1 0 333.819 3.816 20 5 EHBDRO COc1ccc(CC[C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788568887 1134146526 /nfs/dbraw/zinc/14/65/26/1134146526.db2.gz FDZMUIKYTPBUBN-KGLIPLIRSA-N 1 0 343.427 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc(NCc2ccc3c[nH+]cn3c2)cc1C(F)(F)F ZINC001186662539 1134243493 /nfs/dbraw/zinc/24/34/93/1134243493.db2.gz WSLROFQHIDYEGI-UHFFFAOYSA-N 1 0 336.273 3.873 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@@H](CO)CC3CCCC3)o2)c1 ZINC000509455861 1134601293 /nfs/dbraw/zinc/60/12/93/1134601293.db2.gz RBBADIBXYMGSNH-MRXNPFEDSA-N 1 0 344.411 3.886 20 5 EHBDRO CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@@H](C)c1ccccc1OC ZINC001190582184 1134722732 /nfs/dbraw/zinc/72/27/32/1134722732.db2.gz ROVKIAYDYONYFZ-AWEZNQCLSA-N 1 0 346.431 3.582 20 5 EHBDRO CCCN1CC[C@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC001203236103 1134734212 /nfs/dbraw/zinc/73/42/12/1134734212.db2.gz XWIKVDFWNJCUBS-AWEZNQCLSA-N 1 0 345.468 3.897 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC001170293036 1134735404 /nfs/dbraw/zinc/73/54/04/1134735404.db2.gz JIRUDYIVBZBGDT-LBPRGKRZSA-N 1 0 334.803 3.978 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](c2ccccn2)C(C)C)c([N+](=O)[O-])c1 ZINC001170304333 1134738987 /nfs/dbraw/zinc/73/89/87/1134738987.db2.gz BQCRQNZAZIBMTA-LIRRHRJNSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]CCOc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170305854 1134740057 /nfs/dbraw/zinc/74/00/57/1134740057.db2.gz QWSRZZRFGZXIQD-OAHLLOKOSA-N 1 0 344.411 3.511 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170306572 1134751968 /nfs/dbraw/zinc/75/19/68/1134751968.db2.gz XRQKWBSCTSNVDU-KSSFIOAISA-N 1 0 340.423 3.682 20 5 EHBDRO CC(C)C1CCC([NH+]2CCN(Cc3ccccc3[N+](=O)[O-])CC2)CC1 ZINC001191438034 1134867917 /nfs/dbraw/zinc/86/79/17/1134867917.db2.gz XRXAFRLMEOZJAN-UHFFFAOYSA-N 1 0 345.487 3.927 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(C)=O)c1ccco1 ZINC000804386903 1135052015 /nfs/dbraw/zinc/05/20/15/1135052015.db2.gz JEABHZYAEOFGIL-KRWDZBQOSA-N 1 0 345.399 3.885 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc(N)cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000804394361 1135054188 /nfs/dbraw/zinc/05/41/88/1135054188.db2.gz GVRSUJVMRFELOW-IBGZPJMESA-N 1 0 340.427 3.734 20 5 EHBDRO C[C@@H](C[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@@H](C)CO)c1ccccc1 ZINC000805820426 1135335393 /nfs/dbraw/zinc/33/53/93/1135335393.db2.gz MWUOZQFAGVZJGL-GJZGRUSLSA-N 1 0 346.402 3.720 20 5 EHBDRO COc1cc(C[NH2+]C(C)C)c([N+](=O)[O-])cc1OCc1ccccc1 ZINC000101588715 1135356210 /nfs/dbraw/zinc/35/62/10/1135356210.db2.gz AXTQYVAWPTVMKU-UHFFFAOYSA-N 1 0 330.384 3.680 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])C1CC(C)(C)C1 ZINC001195084308 1135366735 /nfs/dbraw/zinc/36/67/35/1135366735.db2.gz OERAYSNPTUKYSQ-UHFFFAOYSA-N 1 0 339.823 3.697 20 5 EHBDRO Cc1cccc2c1CC(C)(C)[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC001170502254 1135416842 /nfs/dbraw/zinc/41/68/42/1135416842.db2.gz YWSJCSDMZMZRKM-IBGZPJMESA-N 1 0 340.423 3.774 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3ccc(F)cc3)CC2)cc1 ZINC001197021503 1135642577 /nfs/dbraw/zinc/64/25/77/1135642577.db2.gz XRBFILSSERPNIE-UHFFFAOYSA-N 1 0 344.386 3.992 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2C[C@H]3C[C@@]3(c3ccccc3)C2)cc1 ZINC001197720236 1135730155 /nfs/dbraw/zinc/73/01/55/1135730155.db2.gz QUZLEYIOOQHJTB-XLIONFOSSA-N 1 0 338.407 3.637 20 5 EHBDRO C[C@H](COCC1CCCCC1)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC001197992437 1135765080 /nfs/dbraw/zinc/76/50/80/1135765080.db2.gz YOVNTJWUZFNERP-OAHLLOKOSA-N 1 0 336.432 3.549 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H](C2CCCC2)C1 ZINC001198707215 1135851568 /nfs/dbraw/zinc/85/15/68/1135851568.db2.gz SRNCGIFDTBMSOU-GOEBONIOSA-N 1 0 345.443 3.824 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]CCN1CCCOCC1 ZINC000809750613 1135885147 /nfs/dbraw/zinc/88/51/47/1135885147.db2.gz BNAOGCPUBBXMCT-UHFFFAOYSA-N 1 0 334.463 3.805 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@H](O)c1ccccc1 ZINC000809748600 1135885344 /nfs/dbraw/zinc/88/53/44/1135885344.db2.gz WBTKNBZFPLJKHC-LJQBUTKESA-N 1 0 326.396 3.711 20 5 EHBDRO C[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000809975180 1135907519 /nfs/dbraw/zinc/90/75/19/1135907519.db2.gz AAWOQJIXWJIIMF-UWVGGRQHSA-N 1 0 333.215 3.806 20 5 EHBDRO Cc1nn(-c2ccc(C)cc2)cc1C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC001199582091 1135912739 /nfs/dbraw/zinc/91/27/39/1135912739.db2.gz JWJANGUDZHJCLX-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO CCC[C@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCOC1 ZINC000810017345 1135914427 /nfs/dbraw/zinc/91/44/27/1135914427.db2.gz VDAUJGPYDMANLI-AWEZNQCLSA-N 1 0 333.215 3.950 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1c(C)cccc1C ZINC001201025117 1135974137 /nfs/dbraw/zinc/97/41/37/1135974137.db2.gz BXWKVVGKAXLGOQ-UHFFFAOYSA-N 1 0 328.412 3.943 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1ccc(F)c(F)c1 ZINC001201692891 1136057372 /nfs/dbraw/zinc/05/73/72/1136057372.db2.gz IPQVRGNDNQCEDS-UHFFFAOYSA-N 1 0 326.730 3.859 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CCO[C@@H](C4CC4)C3)o2)cc1 ZINC001201910624 1136074297 /nfs/dbraw/zinc/07/42/97/1136074297.db2.gz HTPNTPMMZMDIRY-DNVCBOLYSA-N 1 0 342.395 3.902 20 5 EHBDRO C[C@H]1C[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[N@@H+]1C1CC1 ZINC000811484365 1136091895 /nfs/dbraw/zinc/09/18/95/1136091895.db2.gz VJUBXPBZFORUOO-CABZTGNLSA-N 1 0 344.242 3.616 20 5 EHBDRO CO[C@H]1CCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811486136 1136092545 /nfs/dbraw/zinc/09/25/45/1136092545.db2.gz JXDGWMPEMBYPSY-RNCFNFMXSA-N 1 0 333.215 3.806 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CNCCC[NH+]1CCCCC1 ZINC000811473211 1136095433 /nfs/dbraw/zinc/09/54/33/1136095433.db2.gz YLFKJVGUKLKLKW-UHFFFAOYSA-N 1 0 346.258 3.867 20 5 EHBDRO C[N@H+](C[C@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H]1CCCc2ccccc21 ZINC000776270561 1136123870 /nfs/dbraw/zinc/12/38/70/1136123870.db2.gz CTNWEHDRUXFYBE-MOPGFXCFSA-N 1 0 326.396 3.638 20 5 EHBDRO CC[C@@H]1c2ccsc2CC[N@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776275026 1136129141 /nfs/dbraw/zinc/12/91/41/1136129141.db2.gz FOMIBXORJSPDOV-CVEARBPZSA-N 1 0 332.425 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)cc1 ZINC000776279706 1136134848 /nfs/dbraw/zinc/13/48/48/1136134848.db2.gz XENNFJNEXIYUNE-ZWKOTPCHSA-N 1 0 330.359 3.604 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]2COc2ccccc2)cc1[N+](=O)[O-] ZINC001170650429 1136154574 /nfs/dbraw/zinc/15/45/74/1136154574.db2.gz LYHYKUVYSKVQRK-KRWDZBQOSA-N 1 0 326.396 3.947 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2C[C@@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850371580 1136243878 /nfs/dbraw/zinc/24/38/78/1136243878.db2.gz KWOOMYAXINGONG-IEBWSBKVSA-N 1 0 326.396 3.986 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COC2(CCC2)C1 ZINC000850525556 1136277936 /nfs/dbraw/zinc/27/79/36/1136277936.db2.gz OMWHNYKOJJDJSC-UONOGXRCSA-N 1 0 336.457 3.767 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC1SCCS1 ZINC000850560947 1136285877 /nfs/dbraw/zinc/28/58/77/1136285877.db2.gz PMIYEERPANCOIN-NSHDSACASA-N 1 0 344.527 3.861 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000852034817 1136428634 /nfs/dbraw/zinc/42/86/34/1136428634.db2.gz JFHDHUVTBJXUFX-ROUUACIJSA-N 1 0 332.375 3.582 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H](c2ccc(F)cc2)C2CCC2)cc1 ZINC000776593708 1136454149 /nfs/dbraw/zinc/45/41/49/1136454149.db2.gz WPQSEXMAZMXUNJ-OALUTQOASA-N 1 0 344.386 3.898 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446121 1136456554 /nfs/dbraw/zinc/45/65/54/1136456554.db2.gz DJTQCZWZZCYTOG-ZWKOTPCHSA-N 1 0 332.375 3.754 20 5 EHBDRO CCC(CC)[N@H+](CC)CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1 ZINC001170754433 1136484219 /nfs/dbraw/zinc/48/42/19/1136484219.db2.gz BPWCEHRNVNDVBI-UHFFFAOYSA-N 1 0 327.812 3.697 20 5 EHBDRO CC1(C)C[C@@]1([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000852772708 1136484945 /nfs/dbraw/zinc/48/49/45/1136484945.db2.gz QAHNOMXCYZZGJW-PKOBYXMFSA-N 1 0 326.396 3.543 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccc2c(c1)CCCO2 ZINC000852779363 1136485721 /nfs/dbraw/zinc/48/57/21/1136485721.db2.gz DTJVBSPKENRENK-GFCCVEGCSA-N 1 0 330.359 3.910 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[N@@H+]2CCC[C@H](c3ccccc3)C2)c1 ZINC000814641796 1136488477 /nfs/dbraw/zinc/48/84/77/1136488477.db2.gz LEGZXNDZYLDQDG-PKOBYXMFSA-N 1 0 326.396 3.508 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815554953 1136610183 /nfs/dbraw/zinc/61/01/83/1136610183.db2.gz MXCOANZENPHHGS-RYUDHWBXSA-N 1 0 345.399 3.606 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1OCC1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815582703 1136614439 /nfs/dbraw/zinc/61/44/39/1136614439.db2.gz NNYRFGCZXXBTIF-CYBMUJFWSA-N 1 0 341.411 3.817 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(Cl)c1 ZINC000815589084 1136615415 /nfs/dbraw/zinc/61/54/15/1136615415.db2.gz IGPDAVHZNSNFNK-LLVKDONJSA-N 1 0 349.818 3.732 20 5 EHBDRO CC(C)[N@@H+]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000338959989 1136616113 /nfs/dbraw/zinc/61/61/13/1136616113.db2.gz IGAGXKTVMGTBOG-UHFFFAOYSA-N 1 0 345.365 3.530 20 5 EHBDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccccc2F)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815622346 1136620459 /nfs/dbraw/zinc/62/04/59/1136620459.db2.gz SDONHKYZRIIPGQ-MRVWCRGKSA-N 1 0 329.375 3.913 20 5 EHBDRO CC[N@H+](CC(=O)Nc1ccc(Cl)c([N+](=O)[O-])c1)[C@@H](C)C(C)C ZINC000112659428 1136644059 /nfs/dbraw/zinc/64/40/59/1136644059.db2.gz RMHVWJFCUJPNRJ-NSHDSACASA-N 1 0 327.812 3.553 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000776820371 1136701484 /nfs/dbraw/zinc/70/14/84/1136701484.db2.gz DKWGQXSDSUCMPO-DZKIICNBSA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]([NH3+])CCNc1ccc2ccc3ccc(Br)nc3c2n1 ZINC001170891402 1136866270 /nfs/dbraw/zinc/86/62/70/1136866270.db2.gz YGVLHQWHNZPJAY-SNVBAGLBSA-N 1 0 345.244 3.695 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961853 1136891185 /nfs/dbraw/zinc/89/11/85/1136891185.db2.gz VVOIPONRXYOYGE-IAGOWNOFSA-N 1 0 344.411 3.833 20 5 EHBDRO CCC[C@@H](Cc1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819013547 1136902970 /nfs/dbraw/zinc/90/29/70/1136902970.db2.gz WEMVDLBGFPPGNJ-HKUYNNGSSA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1oc2ccccc2c1CC[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819231771 1136927053 /nfs/dbraw/zinc/92/70/53/1136927053.db2.gz APNMEAADGCFWIW-SFHVURJKSA-N 1 0 340.379 3.515 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)CCC2 ZINC000819327395 1136931939 /nfs/dbraw/zinc/93/19/39/1136931939.db2.gz DJEOPHMBJKCWQK-RTBURBONSA-N 1 0 326.396 3.604 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2C[C@H](c3ccccc3Cl)C2)cc1 ZINC000819333375 1136932404 /nfs/dbraw/zinc/93/24/04/1136932404.db2.gz NBLBOSVXTRODAR-DEYYWGMASA-N 1 0 346.814 3.817 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@@H]2c2ccccc2)c1 ZINC000819338974 1136932575 /nfs/dbraw/zinc/93/25/75/1136932575.db2.gz FMUKDXVDKJTRGJ-DFQSSKMNSA-N 1 0 340.423 3.802 20 5 EHBDRO Cc1ccc(C2(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)CC2)c(C)c1 ZINC000819339053 1136932680 /nfs/dbraw/zinc/93/26/80/1136932680.db2.gz KIHNDWWKCBGCDI-IBGZPJMESA-N 1 0 340.423 3.566 20 5 EHBDRO C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C[C@](C)(O)c1ccccc1 ZINC000822516263 1137064135 /nfs/dbraw/zinc/06/41/35/1137064135.db2.gz JNBNMGQVXPBUIW-KRWDZBQOSA-N 1 0 334.803 3.588 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H]1CCc2ccc(O)cc2C1 ZINC001171031483 1137113554 /nfs/dbraw/zinc/11/35/54/1137113554.db2.gz FAEXPHJRNBFDLV-LJQANCHMSA-O 1 0 325.476 3.958 20 5 EHBDRO C[C@@H]1CCC[N@H+](Cc2ccccc2CNc2ccc([N+](=O)[O-])nc2)C1 ZINC000339032784 1137127160 /nfs/dbraw/zinc/12/71/60/1137127160.db2.gz IOGRPSCRPZBSQM-OAHLLOKOSA-N 1 0 340.427 3.834 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H]1CCC12CCOCC2 ZINC000865778866 1137310916 /nfs/dbraw/zinc/31/09/16/1137310916.db2.gz ZKIBUCBPHUIEPO-JBXOJTMHSA-N 1 0 330.428 3.795 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000846039071 1137328976 /nfs/dbraw/zinc/32/89/76/1137328976.db2.gz STQWQHDCVDXXNE-LSDHHAIUSA-N 1 0 330.787 3.788 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000846190124 1137340742 /nfs/dbraw/zinc/34/07/42/1137340742.db2.gz SKPHYQWOVYZHOT-JVPBZIDWSA-N 1 0 328.412 3.932 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@@](C)(O)c1ccccc1 ZINC000846191301 1137341014 /nfs/dbraw/zinc/34/10/14/1137341014.db2.gz XOIADQDQWYXZBL-PNHOKKKMSA-N 1 0 340.423 3.858 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CCO1 ZINC000866367129 1137349902 /nfs/dbraw/zinc/34/99/02/1137349902.db2.gz GECGNVLQYNOQAE-GLJUWKHASA-N 1 0 338.423 3.706 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000866367752 1137350031 /nfs/dbraw/zinc/35/00/31/1137350031.db2.gz OHFGTQBAFBLNSJ-KGLIPLIRSA-N 1 0 336.407 3.604 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000866394344 1137351523 /nfs/dbraw/zinc/35/15/23/1137351523.db2.gz VWMIESWRAOCHIV-GXSJLCMTSA-N 1 0 335.206 3.838 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2C[C@H]2C2CCOCC2)cc1[N+](=O)[O-] ZINC000866538559 1137362942 /nfs/dbraw/zinc/36/29/42/1137362942.db2.gz SVSKCHXFUJWBHJ-COXVUDFISA-N 1 0 348.443 3.707 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccccc1OC ZINC000772978156 1137397977 /nfs/dbraw/zinc/39/79/77/1137397977.db2.gz CHADVERGQAEHGN-KRWDZBQOSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cccc3c2OCCO3)cccc1[N+](=O)[O-] ZINC000772984050 1137412492 /nfs/dbraw/zinc/41/24/92/1137412492.db2.gz MHOFTNVWXAFVCJ-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)[C@@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000773048556 1137461893 /nfs/dbraw/zinc/46/18/93/1137461893.db2.gz RKHNTROEEIGFHV-UYHISHBKSA-N 1 0 332.375 3.897 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@H]23)cc1[N+](=O)[O-] ZINC000773134442 1137467591 /nfs/dbraw/zinc/46/75/91/1137467591.db2.gz JJMKOPUAKZLINO-KSZJFAHPSA-N 1 0 338.498 3.933 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1C[C@@H](NC(=O)OC(C)(C)C)C1)c1ccccc1[N+](=O)[O-] ZINC000715136099 1137476248 /nfs/dbraw/zinc/47/62/48/1137476248.db2.gz HUJGRDXJHQJXNC-MELADBBJSA-N 1 0 349.431 3.549 20 5 EHBDRO CCC(=O)c1ccc(N2CCC(CCC[NH+](C)C)CC2)c([N+](=O)[O-])c1 ZINC000795128685 1137498124 /nfs/dbraw/zinc/49/81/24/1137498124.db2.gz JDPIDBKLXKRVAQ-UHFFFAOYSA-N 1 0 347.459 3.746 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1ccc(Cl)cc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872019548 1137564935 /nfs/dbraw/zinc/56/49/35/1137564935.db2.gz WSBBIQQDKAHOTF-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1csc(C)n1 ZINC000872020017 1137565038 /nfs/dbraw/zinc/56/50/38/1137565038.db2.gz BXHCORWZPWCFFY-SNVBAGLBSA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@H]([NH2+][C@H](Cn1ccnc1)C(C)(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872023188 1137565362 /nfs/dbraw/zinc/56/53/62/1137565362.db2.gz CZOGVNCIGOVAAH-SWLSCSKDSA-N 1 0 334.395 3.696 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCn1ccnc1 ZINC000872023516 1137565603 /nfs/dbraw/zinc/56/56/03/1137565603.db2.gz IFULKMVADLFPJQ-CYBMUJFWSA-N 1 0 334.445 3.644 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](C)Cn1ccnc1C ZINC000872030725 1137566262 /nfs/dbraw/zinc/56/62/62/1137566262.db2.gz BCSVSEVUDWRDDI-QWHCGFSZSA-N 1 0 348.472 3.809 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1c(C)noc1C ZINC000872035549 1137566786 /nfs/dbraw/zinc/56/67/86/1137566786.db2.gz WXAREGONOJWKLI-JTQLQIEISA-N 1 0 335.429 3.815 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1ccc(C)o1 ZINC000872038451 1137566972 /nfs/dbraw/zinc/56/69/72/1137566972.db2.gz NQLHLVJMWZTTFF-SMDDNHRTSA-N 1 0 336.413 3.602 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000872039619 1137566994 /nfs/dbraw/zinc/56/69/94/1137566994.db2.gz UNLNMZFROVSPAH-PBXWNFIWSA-N 1 0 336.457 3.781 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC[NH+](C(C)C)CC1 ZINC000872045786 1137567541 /nfs/dbraw/zinc/56/75/41/1137567541.db2.gz BIPUMCZYQOSUJH-CYBMUJFWSA-N 1 0 337.489 3.840 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000872051183 1137568083 /nfs/dbraw/zinc/56/80/83/1137568083.db2.gz IGGJNRZVGWKIKO-XPGAZNKBSA-N 1 0 342.461 3.764 20 5 EHBDRO C[C@@H]([NH2+]CC1([C@@H](O)c2ccccc2)CC1)c1c(F)cccc1[N+](=O)[O-] ZINC000872052591 1137568292 /nfs/dbraw/zinc/56/82/92/1137568292.db2.gz PJFCIJCSPRBKJE-ACJLOTCBSA-N 1 0 344.386 3.898 20 5 EHBDRO C[C@H]([NH2+]CCc1nn(C)c2ccccc12)c1c(F)cccc1[N+](=O)[O-] ZINC000872062060 1137569029 /nfs/dbraw/zinc/56/90/29/1137569029.db2.gz CLEKBINAMMXCSB-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCOC1 ZINC000872065715 1137569383 /nfs/dbraw/zinc/56/93/83/1137569383.db2.gz AIQIVWMAACTFSS-DOMZBBRYSA-N 1 0 346.349 3.908 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-])CC2 ZINC000872067616 1137569515 /nfs/dbraw/zinc/56/95/15/1137569515.db2.gz ZSUOUTRZRMOIPS-JSGCOSHPSA-N 1 0 346.406 3.719 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000872129505 1137573113 /nfs/dbraw/zinc/57/31/13/1137573113.db2.gz FLWYICUGCOJWNH-NSCUQIJASA-N 1 0 332.425 3.744 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@H](C)c1ccccc1[N+](=O)[O-] ZINC000872131254 1137573271 /nfs/dbraw/zinc/57/32/71/1137573271.db2.gz YXPGREOAGBOLEB-CHWSQXEVSA-N 1 0 345.374 3.802 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nccnc1C ZINC000872133457 1137573368 /nfs/dbraw/zinc/57/33/68/1137573368.db2.gz MUJNYDNKMCBGII-ZIAGYGMSSA-N 1 0 346.456 3.915 20 5 EHBDRO CCC(CC)(C[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000872226625 1137576014 /nfs/dbraw/zinc/57/60/14/1137576014.db2.gz QGVYPNAWDNJOSG-CYBMUJFWSA-N 1 0 334.338 3.587 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H](OC3CCC3)CC2)ccc1[N+](=O)[O-] ZINC000872279229 1137577672 /nfs/dbraw/zinc/57/76/72/1137577672.db2.gz CXBDOVCVHGONNY-QGZVFWFLSA-N 1 0 348.443 3.917 20 5 EHBDRO COCc1cc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)ccc1F ZINC000873047753 1137588800 /nfs/dbraw/zinc/58/88/00/1137588800.db2.gz BPOWXOGJTYJIBV-UHFFFAOYSA-N 1 0 332.375 3.787 20 5 EHBDRO COCCOc1cc(C)ccc1C[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000873074794 1137589470 /nfs/dbraw/zinc/58/94/70/1137589470.db2.gz QJASCEAKCGEWCT-UHFFFAOYSA-N 1 0 344.411 3.527 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1 ZINC000873126577 1137590788 /nfs/dbraw/zinc/59/07/88/1137590788.db2.gz USGRDCQGFCILBQ-UHFFFAOYSA-N 1 0 343.383 3.680 20 5 EHBDRO Cc1c(C[NH2+]CCc2cc(C(F)(F)F)ccn2)cccc1[N+](=O)[O-] ZINC000873128021 1137590797 /nfs/dbraw/zinc/59/07/97/1137590797.db2.gz AAXVIDFZYCEPMS-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2ccccc2)[C@H](O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138765 1137591221 /nfs/dbraw/zinc/59/12/21/1137591221.db2.gz MPVLWTWLLQXQRF-RTBURBONSA-N 1 0 328.412 3.751 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](O)c1ccc(F)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000124748604 1137608371 /nfs/dbraw/zinc/60/83/71/1137608371.db2.gz RROCBMYABDHJTK-IRXDYDNUSA-N 1 0 336.338 3.647 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CCC[C@@H](c4ccccc4)C3)C2)c1 ZINC000877475088 1137677623 /nfs/dbraw/zinc/67/76/23/1137677623.db2.gz LTLUYUICJAVZAL-VEZWFGLTSA-N 1 0 340.427 3.811 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H]3CC[C@@H](c4ccc(F)cc4)C3)C2)c1 ZINC000877488236 1137678243 /nfs/dbraw/zinc/67/82/43/1137678243.db2.gz CTLYJBYPWZDEIF-XNGJBWTFSA-N 1 0 344.390 3.560 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC000877804831 1137690506 /nfs/dbraw/zinc/69/05/06/1137690506.db2.gz FAPDISZVZOJNPL-XEGUGMAKSA-N 1 0 344.333 3.661 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H]2C2CCCC2)o1 ZINC000877986060 1137698468 /nfs/dbraw/zinc/69/84/68/1137698468.db2.gz KILVPSYZPCFXLG-HNNXBMFYSA-N 1 0 342.399 3.799 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C[N@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878128345 1137703580 /nfs/dbraw/zinc/70/35/80/1137703580.db2.gz CNZLIJAJKLBCMY-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2C3CCCC2CCC3)o1 ZINC000878135276 1137703906 /nfs/dbraw/zinc/70/39/06/1137703906.db2.gz WJBVFIIFCLXRDW-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(OC2CC[NH+](C[C@@H]3CCC4(CCC4)O3)CC2)cc1 ZINC000878148261 1137704455 /nfs/dbraw/zinc/70/44/55/1137704455.db2.gz FXGRXUUQUGJNBL-SFHVURJKSA-N 1 0 346.427 3.540 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878351735 1137712171 /nfs/dbraw/zinc/71/21/71/1137712171.db2.gz YYYORIHGIMNKLG-ATCWAGBWSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)C1 ZINC000878447310 1137716403 /nfs/dbraw/zinc/71/64/03/1137716403.db2.gz LKKDUMIJSFZSMP-DYEKYZERSA-N 1 0 330.388 3.559 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)C ZINC000878670272 1137724441 /nfs/dbraw/zinc/72/44/41/1137724441.db2.gz TUVCKZIDAUKTHE-CQSZACIVSA-N 1 0 332.404 3.949 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066647 1137736850 /nfs/dbraw/zinc/73/68/50/1137736850.db2.gz QMBGXUOBVWUHQV-BAABZTOOSA-N 1 0 342.399 3.823 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879672186 1137754742 /nfs/dbraw/zinc/75/47/42/1137754742.db2.gz PDWUTUJGEANJKT-CHWSQXEVSA-N 1 0 330.306 3.590 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](c3nc(C)cs3)C2)ccc1[N+](=O)[O-] ZINC000880012607 1137765425 /nfs/dbraw/zinc/76/54/25/1137765425.db2.gz VQNXSDMAYHSVMH-CQSZACIVSA-N 1 0 347.440 3.748 20 5 EHBDRO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCOC1 ZINC000880469364 1137779646 /nfs/dbraw/zinc/77/96/46/1137779646.db2.gz KEDDAQTURDFCBJ-WMLDXEAASA-N 1 0 345.399 3.545 20 5 EHBDRO C[C@H](CC(=O)Nc1cccc([N+](=O)[O-])c1)[NH2+]CC(C)(C)CC(F)F ZINC000883258980 1137851019 /nfs/dbraw/zinc/85/10/19/1137851019.db2.gz XJIUSWZFMHLURD-LLVKDONJSA-N 1 0 343.374 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]C1CCC2(COC2)CC1 ZINC000883379559 1137858273 /nfs/dbraw/zinc/85/82/73/1137858273.db2.gz FXJCJBFEXLYRAV-MAUKXSAKSA-N 1 0 344.455 3.855 20 5 EHBDRO Cc1csc([C@@H]2CCC[N@H+](Cc3ccc([N+](=O)[O-])cc3F)C2)n1 ZINC000332259982 1137937526 /nfs/dbraw/zinc/93/75/26/1137937526.db2.gz DSVVMPPUJKPYIU-CYBMUJFWSA-N 1 0 335.404 3.878 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+]1CCC[C@H]1C[C@H](O)c1ccc(F)cc1 ZINC000134777162 1137960655 /nfs/dbraw/zinc/96/06/55/1137960655.db2.gz BVODMWWGHIFQFK-HKUYNNGSSA-N 1 0 344.386 3.822 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@@H](O)c1cccc(Cl)c1)C1CC1 ZINC000135223625 1137964777 /nfs/dbraw/zinc/96/47/77/1137964777.db2.gz RKVNVYNQSYAVRC-GOSISDBHSA-N 1 0 346.814 3.946 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000885969513 1138029270 /nfs/dbraw/zinc/02/92/70/1138029270.db2.gz UQGDZZJAFQVBKN-OAHLLOKOSA-N 1 0 334.416 3.575 20 5 EHBDRO Cc1c(NC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cccc1[N+](=O)[O-] ZINC000045960116 1138041415 /nfs/dbraw/zinc/04/14/15/1138041415.db2.gz FYJRAFOHKAXQOD-AWEZNQCLSA-N 1 0 348.447 3.537 20 5 EHBDRO C[N@@H+](Cc1cccc2ccccc21)C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136954631 1138044375 /nfs/dbraw/zinc/04/43/75/1138044375.db2.gz MGOMJPBEDNMVDL-FQEVSTJZSA-N 1 0 336.391 3.913 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1cc(C2CC2)no1)C1CC1 ZINC000886684679 1138115119 /nfs/dbraw/zinc/11/51/19/1138115119.db2.gz PVOHXFACGYNXCT-MRXNPFEDSA-N 1 0 327.384 3.571 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC2(CCC2)C1 ZINC000123520293 1138271075 /nfs/dbraw/zinc/27/10/75/1138271075.db2.gz GLQGHIJUJPCACI-LBPRGKRZSA-N 1 0 328.372 3.582 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000263737561 1138353463 /nfs/dbraw/zinc/35/34/63/1138353463.db2.gz ZRMSYGNZRVQAOK-KRWDZBQOSA-N 1 0 328.368 3.702 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2C)o1 ZINC000131131051 1138497863 /nfs/dbraw/zinc/49/78/63/1138497863.db2.gz CCDBFGWVJDRDRE-KRWDZBQOSA-N 1 0 330.384 3.980 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283034164 1138942292 /nfs/dbraw/zinc/94/22/92/1138942292.db2.gz HVISBOMKWSLRIK-NSHDSACASA-N 1 0 334.395 3.845 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(c3cccc(F)c3)CCOCC2)c1 ZINC000174647037 1139433540 /nfs/dbraw/zinc/43/35/40/1139433540.db2.gz OONAHYVJEJPKGZ-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO O=C(Nc1ccc([N+](=O)[O-])cc1)NC1CC[NH+](C2CCCCC2)CC1 ZINC000177027823 1139593383 /nfs/dbraw/zinc/59/33/83/1139593383.db2.gz LHZNJSJBZGCHAA-UHFFFAOYSA-N 1 0 346.431 3.513 20 5 EHBDRO CC[C@H]([NH2+]C1CCN(C(=O)CC(C)C)CC1)c1cccc([N+](=O)[O-])c1 ZINC000178083207 1139668435 /nfs/dbraw/zinc/66/84/35/1139668435.db2.gz PXXXYJHGZIECHJ-SFHVURJKSA-N 1 0 347.459 3.673 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc3c(c2)OCCO3)cccc1[N+](=O)[O-] ZINC000178209552 1139679523 /nfs/dbraw/zinc/67/95/23/1139679523.db2.gz HRCMHCKTEVKIQS-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO CCOc1ccc([C@H](C)NC2CC[NH+](CC3CC3)CC2)cc1[N+](=O)[O-] ZINC000179403405 1139754824 /nfs/dbraw/zinc/75/48/24/1139754824.db2.gz CFUWTVMBURUROH-AWEZNQCLSA-N 1 0 347.459 3.519 20 5 EHBDRO Cc1c([C@H](C)Nc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)cnn1C ZINC000181451328 1139907720 /nfs/dbraw/zinc/90/77/20/1139907720.db2.gz OPDHUTBHMUCMIE-NSHDSACASA-N 1 0 325.372 3.666 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC2(CC2)C1 ZINC000186994851 1140231237 /nfs/dbraw/zinc/23/12/37/1140231237.db2.gz ILOUAYYCHRRKGB-GFCCVEGCSA-N 1 0 328.372 3.582 20 5 EHBDRO COCC1=CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000187614141 1140264472 /nfs/dbraw/zinc/26/44/72/1140264472.db2.gz KSVNVFSYCKCDBG-UHFFFAOYSA-N 1 0 328.368 3.633 20 5 EHBDRO COCc1ccccc1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192632648 1140541974 /nfs/dbraw/zinc/54/19/74/1140541974.db2.gz NSSSMMMSRWWAOY-LJQANCHMSA-N 1 0 326.396 3.908 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCOC1 ZINC000266142197 1140646980 /nfs/dbraw/zinc/64/69/80/1140646980.db2.gz HKKXRLHCJUEFLC-QWHCGFSZSA-N 1 0 332.425 3.838 20 5 EHBDRO COc1cccc(N2CC[C@H]([NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000267453775 1140792927 /nfs/dbraw/zinc/79/29/27/1140792927.db2.gz SFJVIVCRBJBIJM-ZBFHGGJFSA-N 1 0 341.411 3.533 20 5 EHBDRO CNC(=O)CCC[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268815389 1140997905 /nfs/dbraw/zinc/99/79/05/1140997905.db2.gz KDFCQQANTFLFCX-GFCCVEGCSA-N 1 0 347.440 3.500 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CCOC2(CCSCC2)C1 ZINC000269310399 1141091894 /nfs/dbraw/zinc/09/18/94/1141091894.db2.gz FVHFUUPMNVBXEU-LLCTXKFZSA-N 1 0 348.468 3.642 20 5 EHBDRO C[N@@H+](Cc1cc(=O)oc2ccc3ccccc3c12)C[C@@H]1CCC[C@@H]1O ZINC000270170613 1141187923 /nfs/dbraw/zinc/18/79/23/1141187923.db2.gz UGPBAVRPUOMXHN-YJBOKZPZSA-N 1 0 337.419 3.539 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)C1CCOCC1 ZINC000271167031 1141317214 /nfs/dbraw/zinc/31/72/14/1141317214.db2.gz SWPQOAPNEPCVSP-ZFWWWQNUSA-N 1 0 338.473 3.870 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](CCO)CC(C)C)cc1[N+](=O)[O-] ZINC000271199147 1141323852 /nfs/dbraw/zinc/32/38/52/1141323852.db2.gz ZAOGXJHFACVVPJ-LSDHHAIUSA-N 1 0 338.448 3.689 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)Cc1cc(C)n[nH]1 ZINC000271482967 1141378417 /nfs/dbraw/zinc/37/84/17/1141378417.db2.gz JFHSMLHENLXTFT-JSGCOSHPSA-N 1 0 348.472 3.718 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@H]1CCOC2(CCC2)C1 ZINC000271508840 1141383484 /nfs/dbraw/zinc/38/34/84/1141383484.db2.gz NLKOLUBNTNPXFC-SZMVWBNQSA-N 1 0 344.455 3.997 20 5 EHBDRO CCC[C@@H]([NH2+]CCc1cn2c(n1)SCC2)c1cccc([N+](=O)[O-])c1 ZINC000274355826 1141502231 /nfs/dbraw/zinc/50/22/31/1141502231.db2.gz HGGVLVOFNNOOKM-MRXNPFEDSA-N 1 0 346.456 3.571 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+][C@@H]1CCCc2[nH]c(=O)ccc21 ZINC000348933315 1141611504 /nfs/dbraw/zinc/61/15/04/1141611504.db2.gz IJHKYDYNXBETFK-JIIJFUIFSA-N 1 0 339.395 3.766 20 5 EHBDRO C[C@@H]1C[N@H+](C)[C@@H](C)CN1c1ccc2ccc3ccc(Cl)nc3c2n1 ZINC001164643637 719204449 /nfs/dbraw/zinc/20/44/49/719204449.db2.gz ZVADVIGMJFPKTK-QWHCGFSZSA-N 1 0 340.858 3.965 20 5 EHBDRO CN(CC1CC[NH+](C)CC1)c1cc(Cl)nc2ccc([N+](=O)[O-])cc21 ZINC001165043229 721937078 /nfs/dbraw/zinc/93/70/78/721937078.db2.gz RMXJJFXWPOMNPH-UHFFFAOYSA-N 1 0 348.834 3.574 20 5 EHBDRO C[C@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)Oc1ccccc1 ZINC000537985415 1032062244 /nfs/dbraw/zinc/06/22/44/1032062244.db2.gz AYHRIGKVTKKBNO-BEFAXECRSA-N 1 0 340.423 3.973 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)CC[C@H]([NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000237611347 1030501290 /nfs/dbraw/zinc/50/12/90/1030501290.db2.gz HTGICRXFOQBYEK-YOEHRIQHSA-N 1 0 341.411 3.561 20 5 EHBDRO COc1cc(C[NH2+]C[C@@]2(C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000339445879 1014500213 /nfs/dbraw/zinc/50/02/13/1014500213.db2.gz SOUWWHOEGVXOIB-HNAYVOBHSA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc([S@](C)=O)cc1 ZINC000339503476 1014601694 /nfs/dbraw/zinc/60/16/94/1014601694.db2.gz BRMDSBXTLIXBTL-AOKXMQKFSA-N 1 0 344.436 3.696 20 5 EHBDRO CC[N@H+](C)C[C@H]1CCN(c2c(Cl)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302048240 1015036137 /nfs/dbraw/zinc/03/61/37/1015036137.db2.gz WBNDXYWYDRTLAO-SNVBAGLBSA-N 1 0 332.231 3.680 20 5 EHBDRO CC(C)[C@@H]([NH2+]Cc1c(Cl)cccc1[N+](=O)[O-])C1(CO)CCC1 ZINC000339727277 1015608917 /nfs/dbraw/zinc/60/89/17/1015608917.db2.gz JVLDCZPXCUNRPF-OAHLLOKOSA-N 1 0 326.824 3.525 20 5 EHBDRO CCOC[C@@H]([NH2+]Cc1ccc(Br)cc1[N+](=O)[O-])C(C)C ZINC000233734364 1015759371 /nfs/dbraw/zinc/75/93/71/1015759371.db2.gz DHTSDAMBZSUIDT-CYBMUJFWSA-N 1 0 345.237 3.508 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCC[C@H]1CCO ZINC000275145601 1016094542 /nfs/dbraw/zinc/09/45/42/1016094542.db2.gz UGNYDZRTFKUALJ-ZNMIVQPWSA-N 1 0 338.473 3.606 20 5 EHBDRO C[C@]1(CNCc2ccccc2[N+](=O)[O-])CC[N@H+](Cc2ccccc2)C1 ZINC000311216155 1016392002 /nfs/dbraw/zinc/39/20/02/1016392002.db2.gz RVNBSEBBQMFLNT-HXUWFJFHSA-N 1 0 339.439 3.597 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)c1ccccc1 ZINC000181520283 1017023073 /nfs/dbraw/zinc/02/30/73/1017023073.db2.gz VWSBSWCPKBGUDX-CABCVRRESA-N 1 0 341.411 3.705 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3ccc(C4CC4)cc3)CC2)n1 ZINC000459520012 1032241199 /nfs/dbraw/zinc/24/11/99/1032241199.db2.gz QGNWGHKIMYNQJL-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO COC[C@@H](NCc1ccc(Cl)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000538281151 1032268061 /nfs/dbraw/zinc/26/80/61/1032268061.db2.gz YHZGRJILQCQTPQ-OAHLLOKOSA-N 1 0 338.766 3.865 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000449202799 1032329272 /nfs/dbraw/zinc/32/92/72/1032329272.db2.gz GRBCIRBDSKUREC-CDEUHXGRSA-N 1 0 346.452 3.614 20 5 EHBDRO C[C@H]1CCCC[C@@]1(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459620314 1032332471 /nfs/dbraw/zinc/33/24/71/1032332471.db2.gz VORGGMARBNDKMV-MEDUHNTESA-N 1 0 339.823 3.745 20 5 EHBDRO COCC[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000449228050 1032345342 /nfs/dbraw/zinc/34/53/42/1032345342.db2.gz RSRNOMNZSPFIKB-CZUORRHYSA-N 1 0 332.400 3.795 20 5 EHBDRO CC[N@H+](CCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1)CC(C)C ZINC000536896054 1032407000 /nfs/dbraw/zinc/40/70/00/1032407000.db2.gz IEYFSIYDGCMCBU-UHFFFAOYSA-N 1 0 348.491 3.883 20 5 EHBDRO C[C@@H](CCCO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000088762860 1032508795 /nfs/dbraw/zinc/50/87/95/1032508795.db2.gz UHVPIMGRRXPGNU-NSHDSACASA-N 1 0 338.791 3.759 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)CC[N@@H+](C)C1CCCCC1 ZINC000597666718 1032600556 /nfs/dbraw/zinc/60/05/56/1032600556.db2.gz LLJJFEAIEHLTQH-UHFFFAOYSA-N 1 0 333.432 3.805 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000449487514 1032642916 /nfs/dbraw/zinc/64/29/16/1032642916.db2.gz YUCLCLRDWQKVAQ-GOSISDBHSA-N 1 0 342.443 3.978 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](CNC(=O)OC(C)(C)C)C1 ZINC000075680406 1032651598 /nfs/dbraw/zinc/65/15/98/1032651598.db2.gz UYUQMSWONFHLRB-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO COc1ccc(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3C)CC2)nc1 ZINC000593041480 1032676704 /nfs/dbraw/zinc/67/67/04/1032676704.db2.gz QIBGRFRUWUMKKG-UHFFFAOYSA-N 1 0 341.411 3.686 20 5 EHBDRO C[C@@H]([NH3+])[C@@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000415013064 1017409740 /nfs/dbraw/zinc/40/97/40/1017409740.db2.gz JYXHIEIEDDZFGA-VXGBXAGGSA-N 1 0 349.818 3.866 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cc(-c2ccccc2)no1 ZINC000549170409 1017486915 /nfs/dbraw/zinc/48/69/15/1017486915.db2.gz CFKJODGLSSNZFP-UHFFFAOYSA-N 1 0 337.379 3.924 20 5 EHBDRO CCC[C@H]([NH2+]CCC(=O)NC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000360153130 1017810215 /nfs/dbraw/zinc/81/02/15/1017810215.db2.gz DBNVOPARPWDJDQ-SFHVURJKSA-N 1 0 347.459 3.865 20 5 EHBDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000190064360 1017973717 /nfs/dbraw/zinc/97/37/17/1017973717.db2.gz NANVFCRWJOEMKS-IUODEOHRSA-N 1 0 335.429 3.890 20 5 EHBDRO Cc1cnn([C@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)c1 ZINC000365625075 1018087851 /nfs/dbraw/zinc/08/78/51/1018087851.db2.gz UMNYUCVKRUSUPP-INIZCTEOSA-N 1 0 328.416 3.670 20 5 EHBDRO CC(C)c1ccc(CN(C)C2C[C@H]3CC[C@@H](C2)[N@H+]3C)cc1[N+](=O)[O-] ZINC000377629214 1018090564 /nfs/dbraw/zinc/09/05/64/1018090564.db2.gz RBWYVMAPJKTSIY-SJPCQFCGSA-N 1 0 331.460 3.775 20 5 EHBDRO C[C@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316600 1018144553 /nfs/dbraw/zinc/14/45/53/1018144553.db2.gz CQFSGVYEVSFNEH-YOEHRIQHSA-N 1 0 343.427 3.627 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371728 1018548898 /nfs/dbraw/zinc/54/88/98/1018548898.db2.gz KNYDTKVMPGRTCO-WBVHZDCISA-N 1 0 338.473 3.970 20 5 EHBDRO C[C@@H]1CN(C)CC[C@@H]1[N@H+](C)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000290399509 1018581951 /nfs/dbraw/zinc/58/19/51/1018581951.db2.gz JGULALVSRFBCNA-KDOFPFPSSA-N 1 0 343.427 3.627 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](CCc1ccccc1)[C@H]1CCOC1 ZINC000542702556 1019064113 /nfs/dbraw/zinc/06/41/13/1019064113.db2.gz YQYKPJVCULCLOK-FQEVSTJZSA-N 1 0 340.423 3.737 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCC[C@@H]1O ZINC000322473398 1019119375 /nfs/dbraw/zinc/11/93/75/1019119375.db2.gz PFBGZDFNODWRKA-VMGRFDJRSA-N 1 0 338.835 3.764 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(Nc3ccc(F)cc3[N+](=O)[O-])cc2)CC1 ZINC001210953499 1019127773 /nfs/dbraw/zinc/12/77/73/1019127773.db2.gz LETOIYFUXMIIDT-UHFFFAOYSA-N 1 0 345.374 3.951 20 5 EHBDRO C[NH+](C)CCCNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000237101691 1019327949 /nfs/dbraw/zinc/32/79/49/1019327949.db2.gz XQHDVZNGLRCTTJ-UHFFFAOYSA-N 1 0 337.807 3.550 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c2nccn21 ZINC000449572024 1032825771 /nfs/dbraw/zinc/82/57/71/1032825771.db2.gz MMCPLGSGKAHPQD-JHNDHUHGSA-N 1 0 340.427 3.798 20 5 EHBDRO C[C@H]([NH2+]Cc1cnn(C)c1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000151144327 1019377896 /nfs/dbraw/zinc/37/78/96/1019377896.db2.gz VYWYNTZOYSGXFA-LBPRGKRZSA-N 1 0 342.424 3.908 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])c2nccn21 ZINC000449572026 1032829497 /nfs/dbraw/zinc/82/94/97/1032829497.db2.gz MMCPLGSGKAHPQD-SRABZTEZSA-N 1 0 340.427 3.798 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CC[NH+](C2CCCCC2)CC1 ZINC000255635592 1019738065 /nfs/dbraw/zinc/73/80/65/1019738065.db2.gz SAKRFGZOYLPXFL-VURMDHGXSA-N 1 0 329.444 3.558 20 5 EHBDRO C[C@H]([NH3+])c1ccc(NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cc1 ZINC000602436383 1032886537 /nfs/dbraw/zinc/88/65/37/1032886537.db2.gz ZQQTWGXGXPBCIQ-ZDUSSCGKSA-N 1 0 339.395 3.675 20 5 EHBDRO C[C@@H]([NH3+])c1ccc(NC(=O)C2(c3ccc([N+](=O)[O-])cc3)CCC2)cc1 ZINC000602436380 1032887244 /nfs/dbraw/zinc/88/72/44/1032887244.db2.gz ZQQTWGXGXPBCIQ-CYBMUJFWSA-N 1 0 339.395 3.675 20 5 EHBDRO COc1cc2c(cc1OC)[C@H]([N@H+](C)Cc1ccccc1[N+](=O)[O-])CC2 ZINC000602438215 1032890905 /nfs/dbraw/zinc/89/09/05/1032890905.db2.gz CDWBHRQKKYCWQB-QGZVFWFLSA-N 1 0 342.395 3.731 20 5 EHBDRO CCC[C@@H]([NH2+]CC[C@H](OC)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000345497718 1020319971 /nfs/dbraw/zinc/31/99/71/1020319971.db2.gz ZVLLIPJWAGXFTG-KGLIPLIRSA-N 1 0 334.338 3.993 20 5 EHBDRO Cc1ccc([C@@H]2[C@H](C)CCCN2Cc2c([N+](=O)[O-])ncn2C)cc1 ZINC000610476442 1020397609 /nfs/dbraw/zinc/39/76/09/1020397609.db2.gz JCFNLZBHRGCOHT-PBHICJAKSA-N 1 0 328.416 3.610 20 5 EHBDRO CCC1(C[NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000513697665 1020475416 /nfs/dbraw/zinc/47/54/16/1020475416.db2.gz QKQWTQRLFJQKDZ-KRWDZBQOSA-N 1 0 342.443 3.978 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000280577322 1020481387 /nfs/dbraw/zinc/48/13/87/1020481387.db2.gz SMIFVZKJEVKUKJ-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO C[C@H]1CC[C@H]([NH2+][C@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000513698241 1020487647 /nfs/dbraw/zinc/48/76/47/1020487647.db2.gz YCIDRNROHROWBT-QRTARXTBSA-N 1 0 328.416 3.586 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C(=O)N(CC[NH+]1CCCCCC1)C(C)C ZINC000345898398 1020595868 /nfs/dbraw/zinc/59/58/68/1020595868.db2.gz DEUTVMRMSMGNSG-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393853552 1021078839 /nfs/dbraw/zinc/07/88/39/1021078839.db2.gz XBVIWQYUTFVSBC-RDJZCZTQSA-N 1 0 325.412 3.917 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCN(C)[C@@H]1c1ccccc1 ZINC000581562244 1021091977 /nfs/dbraw/zinc/09/19/77/1021091977.db2.gz DYRWXNATBCUCIS-CWFSZBLJSA-N 1 0 339.439 3.999 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516020 1021171419 /nfs/dbraw/zinc/17/14/19/1021171419.db2.gz VJHPYSSOWHHLOI-UKRRQHHQSA-N 1 0 331.441 3.979 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCN(c3ccccc3F)C2)cc1[N+](=O)[O-] ZINC000426308140 1021227246 /nfs/dbraw/zinc/22/72/46/1021227246.db2.gz UVHWLXQKYWGESB-GOEBONIOSA-N 1 0 343.402 3.972 20 5 EHBDRO Cc1ccc(C[C@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000602559266 1032973468 /nfs/dbraw/zinc/97/34/68/1032973468.db2.gz XNJQINIUHKOCNS-JTQLQIEISA-N 1 0 331.397 3.827 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602580791 1033001758 /nfs/dbraw/zinc/00/17/58/1033001758.db2.gz HBQNNVNIJZWIEC-GHMZBOCLSA-N 1 0 332.322 3.518 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000437342875 1021755731 /nfs/dbraw/zinc/75/57/31/1021755731.db2.gz BMODEHJZMVSWDL-CABCVRRESA-N 1 0 334.416 3.540 20 5 EHBDRO C[C@H]([NH2+][C@@H](Cn1cccn1)c1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000610538629 1021819556 /nfs/dbraw/zinc/81/95/56/1021819556.db2.gz YBKGZFPMCCXXRY-KXBFYZLASA-N 1 0 336.395 3.883 20 5 EHBDRO Cc1ccc(CN2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)cc1[N+](=O)[O-] ZINC000510467894 1021879288 /nfs/dbraw/zinc/87/92/88/1021879288.db2.gz UEEZFDTZUUCHJV-NUJGCVRESA-N 1 0 331.460 3.740 20 5 EHBDRO CC(C)N(C)c1ccc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cn1 ZINC000276664502 1022066828 /nfs/dbraw/zinc/06/68/28/1022066828.db2.gz XCJFMSUXRVYJCF-AWEZNQCLSA-N 1 0 328.416 3.685 20 5 EHBDRO Cc1cc(C)cc([C@H](C)[NH2+]CC(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000178205665 1022142841 /nfs/dbraw/zinc/14/28/41/1022142841.db2.gz BUPCDQVQJGKZEH-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2cc(-n3ccnc3)cs2)c(Cl)c1 ZINC000341556213 1022308870 /nfs/dbraw/zinc/30/88/70/1022308870.db2.gz SFGMGVFSUAPIGF-UHFFFAOYSA-N 1 0 348.815 3.785 20 5 EHBDRO NC(=[NH2+])N(c1ccc(F)cc1)c1ccc([N+](=O)[O-])cc1C(F)(F)F ZINC001167993436 1022348621 /nfs/dbraw/zinc/34/86/21/1022348621.db2.gz WWWLGTDVVFWTCY-UHFFFAOYSA-N 1 0 342.252 3.784 20 5 EHBDRO CCC(O)(CC)CC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000471819230 1022403136 /nfs/dbraw/zinc/40/31/36/1022403136.db2.gz GTWYRHXBUZSULG-UHFFFAOYSA-N 1 0 349.456 3.749 20 5 EHBDRO Cc1cc(NC[C@@H](c2ccccc2)[NH+]2CCCC2)ncc1[N+](=O)[O-] ZINC000074725970 1022472188 /nfs/dbraw/zinc/47/21/88/1022472188.db2.gz DYXDMTCNGLPMPG-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2C[C@H]2c2ccco2)cc1Br ZINC000602690969 1033072062 /nfs/dbraw/zinc/07/20/62/1033072062.db2.gz BNWCYNDYJNHQND-PSASIEDQSA-N 1 0 343.202 3.658 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@@H]1C[C@H]1c1ccco1 ZINC000602694364 1033073511 /nfs/dbraw/zinc/07/35/11/1033073511.db2.gz QUDSDXMSDZMWTH-VXGBXAGGSA-N 1 0 326.274 3.852 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CC1 ZINC000602677781 1033081517 /nfs/dbraw/zinc/08/15/17/1033081517.db2.gz UKUKOUWYPVZKRM-AWEZNQCLSA-N 1 0 332.322 3.518 20 5 EHBDRO Cc1ncc([C@H](C)[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684816 1033085963 /nfs/dbraw/zinc/08/59/63/1033085963.db2.gz IQIBPTJSJWHWRW-WMLDXEAASA-N 1 0 340.427 3.942 20 5 EHBDRO C[C@H]1C[NH2+]CC[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414942855 1022928430 /nfs/dbraw/zinc/92/84/30/1022928430.db2.gz NCOKEUMGQYQKJU-MEDUHNTESA-N 1 0 349.818 3.596 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1N[C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294274938 1022999262 /nfs/dbraw/zinc/99/92/62/1022999262.db2.gz MBCVAPKITFRWCY-CYBMUJFWSA-N 1 0 328.416 3.720 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCC([NH+]2CCCCC2)CC1 ZINC000506368538 1023021919 /nfs/dbraw/zinc/02/19/19/1023021919.db2.gz IYIGOEPWJZWXTA-VURMDHGXSA-N 1 0 329.444 3.558 20 5 EHBDRO O=C(C[C@@H]1CCC[N@H+]1CCc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000431002492 1023098682 /nfs/dbraw/zinc/09/86/82/1023098682.db2.gz ZFKSRTKKPUJPJE-INIZCTEOSA-N 1 0 344.436 3.936 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc(-n3cccn3)c2)C2CC2)cc1 ZINC000507155636 1023162396 /nfs/dbraw/zinc/16/23/96/1023162396.db2.gz PQLRBNVNDNLDJX-UHFFFAOYSA-N 1 0 348.406 3.945 20 5 EHBDRO CCCN(Cc1cccc([N+](=O)[O-])c1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000507315832 1023240474 /nfs/dbraw/zinc/24/04/74/1023240474.db2.gz KRCYFDRZHFAFSE-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO Cc1oc2ccccc2c1C[NH2+][C@](C)(CO)c1cccc([N+](=O)[O-])c1 ZINC000602731502 1033120837 /nfs/dbraw/zinc/12/08/37/1033120837.db2.gz KYIIVWWXPNDUIR-LJQANCHMSA-N 1 0 340.379 3.647 20 5 EHBDRO COCC1(C2CC2)C[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000602733749 1033124040 /nfs/dbraw/zinc/12/40/40/1033124040.db2.gz VGNNWCGCYIGMNX-UHFFFAOYSA-N 1 0 342.395 3.713 20 5 EHBDRO COc1ccc(C[NH+]2CCC3(CCSCC3)CC2)cc1[N+](=O)[O-] ZINC000602734374 1033124276 /nfs/dbraw/zinc/12/42/76/1033124276.db2.gz GNOCXVFGKIPLET-UHFFFAOYSA-N 1 0 336.457 3.713 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)N(C)CCCC[NH+]1CCCCC1 ZINC000602758156 1033127710 /nfs/dbraw/zinc/12/77/10/1033127710.db2.gz XNVOZLGCPYZUIK-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO C[C@@](O)(C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1Cl ZINC000588467870 1023562237 /nfs/dbraw/zinc/56/22/37/1023562237.db2.gz VLGACNPOZVBGRN-XOWYPZSQSA-N 1 0 346.814 3.759 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000342051337 1023804364 /nfs/dbraw/zinc/80/43/64/1023804364.db2.gz SIZFQDAPMZQEKY-AEFFLSMTSA-N 1 0 334.416 3.525 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1COc2c(C)cccc2C1 ZINC000574444249 1033171194 /nfs/dbraw/zinc/17/11/94/1033171194.db2.gz ZCVHFXRXRINQRB-GOEBONIOSA-N 1 0 326.396 3.866 20 5 EHBDRO CC(C)C[C@H]([NH2+]Cc1cn(C)nc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000602807564 1033180361 /nfs/dbraw/zinc/18/03/61/1033180361.db2.gz WGDXCDRJBXAFFV-HNNXBMFYSA-N 1 0 336.823 3.859 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1cc2ccccc2s1 ZINC000602807590 1033181086 /nfs/dbraw/zinc/18/10/86/1033181086.db2.gz BLQZJIWTUUMLTF-NSHDSACASA-N 1 0 330.413 3.665 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CCS1 ZINC000897797404 1033182151 /nfs/dbraw/zinc/18/21/51/1033182151.db2.gz HEUHZHQODBYPSQ-HNNXBMFYSA-N 1 0 349.500 3.827 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000514176643 1024201157 /nfs/dbraw/zinc/20/11/57/1024201157.db2.gz SQNCQEZVSKNKDW-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@H](C1CCCCC1)[NH+](C)C ZINC000509622833 1024205099 /nfs/dbraw/zinc/20/50/99/1024205099.db2.gz WUAYAVGELRPGGX-GOSISDBHSA-N 1 0 349.475 3.594 20 5 EHBDRO CCC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000441640571 1024276805 /nfs/dbraw/zinc/27/68/05/1024276805.db2.gz ASHNKZOPIAWWTJ-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000441641878 1024278407 /nfs/dbraw/zinc/27/84/07/1024278407.db2.gz FJEVRPNSCBBTTO-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H]1C ZINC000248552675 1024341251 /nfs/dbraw/zinc/34/12/51/1024341251.db2.gz JDODQEOSTWJJNY-XUJVJEKNSA-N 1 0 330.388 3.559 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@H]2c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000434980406 1024535563 /nfs/dbraw/zinc/53/55/63/1024535563.db2.gz DPMBWIHZICMKBJ-IBGZPJMESA-N 1 0 348.406 3.942 20 5 EHBDRO COc1ccccc1N1CC[C@@H]([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000119616908 1024548776 /nfs/dbraw/zinc/54/87/76/1024548776.db2.gz QPKHYCVZTDYLAN-GOEBONIOSA-N 1 0 341.411 3.533 20 5 EHBDRO CCC[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@H]1CCCCO1 ZINC000435057619 1024586923 /nfs/dbraw/zinc/58/69/23/1024586923.db2.gz QEWHBKSHKKXRQG-CQSZACIVSA-N 1 0 333.388 3.517 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1ccncc1 ZINC000278777451 1033224908 /nfs/dbraw/zinc/22/49/08/1033224908.db2.gz UNOQKSWEOHISDZ-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO COc1c(O)ccc(C[NH2+]C2(c3ccc(C)cc3)CCC2)c1[N+](=O)[O-] ZINC000895123976 1024623322 /nfs/dbraw/zinc/62/33/22/1024623322.db2.gz FQGCYSBUHPFFSL-UHFFFAOYSA-N 1 0 342.395 3.786 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])cc1O ZINC000277346212 1024710161 /nfs/dbraw/zinc/71/01/61/1024710161.db2.gz YPXVZEDZTXRNBX-KBPBESRZSA-N 1 0 344.411 3.981 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1C)c1cccc([N+](=O)[O-])c1 ZINC000342285715 1024729516 /nfs/dbraw/zinc/72/95/16/1024729516.db2.gz MNRCSERHCISGMR-QGZVFWFLSA-N 1 0 341.411 3.891 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)C1 ZINC000435372447 1024857542 /nfs/dbraw/zinc/85/75/42/1024857542.db2.gz RHEHSJHGXYMHCN-NEPJUHHUSA-N 1 0 349.818 3.677 20 5 EHBDRO CC(C)c1ccc(C(=O)NCCCCC[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000508100237 1024898174 /nfs/dbraw/zinc/89/81/74/1024898174.db2.gz MXHBRISHIOWTFC-UHFFFAOYSA-N 1 0 347.459 3.714 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@@H](C)[C@H](c2ccccc2)[NH+](C)C)n1 ZINC000557675228 1025039382 /nfs/dbraw/zinc/03/93/82/1025039382.db2.gz JLGDIRFDUXTVNZ-WMLDXEAASA-N 1 0 328.416 3.710 20 5 EHBDRO CCC(C)(C)[NH+]1CCN(C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)CC1 ZINC000594101211 1033256393 /nfs/dbraw/zinc/25/63/93/1033256393.db2.gz XCQXVRAQJABQIV-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc(C[NH+](C)C)c(C)c2)c1C ZINC000897963392 1033262146 /nfs/dbraw/zinc/26/21/46/1033262146.db2.gz YHULTIHFVYFDFB-UHFFFAOYSA-N 1 0 341.411 3.834 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)[C@H](c1ccccc1)N(C)C ZINC000248621792 1025193997 /nfs/dbraw/zinc/19/39/97/1025193997.db2.gz AVCUQWUMTZAXCC-QMTMVMCOSA-N 1 0 327.428 3.937 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C2CCN(c3nccs3)CC2)cccc1[N+](=O)[O-] ZINC000281565707 1025219334 /nfs/dbraw/zinc/21/93/34/1025219334.db2.gz KBQBGBHVBGLVOR-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO CC[C@H]1CCC[N@@H+](C(C)(C)CNCc2ccc(C)c([N+](=O)[O-])c2)C1 ZINC000521174813 1025249491 /nfs/dbraw/zinc/24/94/91/1025249491.db2.gz MXGLGVITLYKVHV-INIZCTEOSA-N 1 0 333.476 3.893 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CC2(CO)CCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000346882443 1025253422 /nfs/dbraw/zinc/25/34/22/1025253422.db2.gz XXPOQIDYRWACFT-GOSISDBHSA-N 1 0 344.411 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1ccccc1Cn1ccnc1 ZINC000574530521 1033276032 /nfs/dbraw/zinc/27/60/32/1033276032.db2.gz BORYFPCPGXLAQG-IBGZPJMESA-N 1 0 348.406 3.617 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH+]3CCC4(CCSCC4)CC3)nc2c1 ZINC000602952361 1033275271 /nfs/dbraw/zinc/27/52/71/1033275271.db2.gz UPTJUBKXGXBOEY-UHFFFAOYSA-N 1 0 346.456 3.580 20 5 EHBDRO COc1cc(C[NH+]2CCC3(CCSCC3)CC2)ccc1[N+](=O)[O-] ZINC000602950153 1033275569 /nfs/dbraw/zinc/27/55/69/1033275569.db2.gz KNSVDQUPIFMGHL-UHFFFAOYSA-N 1 0 336.457 3.713 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@H]1CCC[C@@H]2C[C@@H]21 ZINC000425466110 1025382456 /nfs/dbraw/zinc/38/24/56/1025382456.db2.gz AUIRZAUHSKLWKL-ICCXJUOJSA-N 1 0 325.206 3.636 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1CC[C@@H](C(=O)OCC)C1)c1cccc([N+](=O)[O-])c1 ZINC000436311834 1025573831 /nfs/dbraw/zinc/57/38/31/1025573831.db2.gz ISTSACOSZZYPHM-VYDXJSESSA-N 1 0 334.416 3.757 20 5 EHBDRO CC(C)[NH+](CCN(C)c1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(C)C ZINC000436353991 1025613090 /nfs/dbraw/zinc/61/30/90/1025613090.db2.gz OLMRGGPIWMXECM-UHFFFAOYSA-N 1 0 348.369 3.564 20 5 EHBDRO Cc1ccccc1CC[N@@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000451166170 1025625044 /nfs/dbraw/zinc/62/50/44/1025625044.db2.gz FSXFDZBXJWCOEL-UHFFFAOYSA-N 1 0 325.368 3.719 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)C1 ZINC000443067264 1025683976 /nfs/dbraw/zinc/68/39/76/1025683976.db2.gz FHGZWFYMPSLDEI-ZIAGYGMSSA-N 1 0 330.384 3.854 20 5 EHBDRO Cc1cn2cc(NC(=O)c3c(C)cc(Cl)cc3[N+](=O)[O-])ccc2n1 ZINC000439105331 1025743119 /nfs/dbraw/zinc/74/31/19/1025743119.db2.gz CQPSXRDJMZFZGZ-UHFFFAOYSA-N 1 0 344.758 3.765 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)[C@@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000439128821 1025792633 /nfs/dbraw/zinc/79/26/33/1025792633.db2.gz PKKNKPZHMUKKLE-YJYMSZOUSA-N 1 0 341.411 3.901 20 5 EHBDRO C[C@@H](c1nc(Cc2ccccc2[N+](=O)[O-])no1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000443217779 1025820903 /nfs/dbraw/zinc/82/09/03/1025820903.db2.gz DOOIJPBCNHJQAK-XQQFMLRXSA-N 1 0 330.388 3.502 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncccc1F ZINC000530471562 1025879999 /nfs/dbraw/zinc/87/99/99/1025879999.db2.gz IMYYDMDZZFEISU-GFCCVEGCSA-N 1 0 335.404 3.789 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]CC1=Cc2ccccc2OC1 ZINC000478249113 1026036822 /nfs/dbraw/zinc/03/68/22/1026036822.db2.gz CEIRHJPQWGOYSV-UHFFFAOYSA-N 1 0 344.798 3.856 20 5 EHBDRO Cc1c(-c2nc(-c3ccc(C[NH+](C)C)cc3)no2)cccc1[N+](=O)[O-] ZINC000530632904 1026139418 /nfs/dbraw/zinc/13/94/18/1026139418.db2.gz AFXWBOUSGROLRF-UHFFFAOYSA-N 1 0 338.367 3.682 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2cc(OC)ccc2[N+](=O)[O-])CC1 ZINC000530669264 1026185547 /nfs/dbraw/zinc/18/55/47/1026185547.db2.gz FRXZFBNJOJMOLG-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@H]1C ZINC000530901690 1026387505 /nfs/dbraw/zinc/38/75/05/1026387505.db2.gz QALZDDPMZPDKGL-WBVHZDCISA-N 1 0 349.475 3.687 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c(F)cn1 ZINC000562077628 1026509258 /nfs/dbraw/zinc/50/92/58/1026509258.db2.gz HDJIBYGPKRLCGP-CYBMUJFWSA-N 1 0 347.390 3.811 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](COC)Cc1ccccc1 ZINC000531104374 1026573693 /nfs/dbraw/zinc/57/36/93/1026573693.db2.gz VMTAVDHFEGGELK-LJQANCHMSA-N 1 0 328.412 3.674 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@@H](c3ccccc3)[C@H]2C)cc1[N+](=O)[O-] ZINC000531202477 1026684418 /nfs/dbraw/zinc/68/44/18/1026684418.db2.gz ZPWOFXDEQVNEJP-RHSMWYFYSA-N 1 0 326.396 3.981 20 5 EHBDRO CCOC(=O)N1CCC([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000186435576 1026888029 /nfs/dbraw/zinc/88/80/29/1026888029.db2.gz HUIPULZLAVBCSN-KGLIPLIRSA-N 1 0 349.431 3.502 20 5 EHBDRO COc1ccccc1OCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000531692812 1027244305 /nfs/dbraw/zinc/24/43/05/1027244305.db2.gz IHCGPVSXKWDFNP-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO CCC[C@@H]([NH2+]CC1(O)Cc2ccccc2C1)c1cccc([N+](=O)[O-])c1 ZINC000531720924 1027269162 /nfs/dbraw/zinc/26/91/62/1027269162.db2.gz VXVBGBOFPLSVIH-LJQANCHMSA-N 1 0 340.423 3.556 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)Nc1ncc([N+](=O)[O-])cc1F)[NH+](C)C ZINC000413292034 1027454023 /nfs/dbraw/zinc/45/40/23/1027454023.db2.gz LFQKDRSSFBFVBL-BLLLJJGKSA-N 1 0 332.379 3.541 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])n1 ZINC000503262919 1027693855 /nfs/dbraw/zinc/69/38/55/1027693855.db2.gz IBOFHPGLLLEHHQ-VQHVLOKHSA-N 1 0 341.411 3.970 20 5 EHBDRO C[C@@H]1C[N@@H+](Cc2cccc(Nc3ccccc3[N+](=O)[O-])c2)C[C@H](C)O1 ZINC000523113350 1027764530 /nfs/dbraw/zinc/76/45/30/1027764530.db2.gz MGZUXELTCHZHPQ-GASCZTMLSA-N 1 0 341.411 3.948 20 5 EHBDRO Cc1nc(N[C@@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781588 1027787069 /nfs/dbraw/zinc/78/70/69/1027787069.db2.gz BQOJWUNUAQKKFM-WMLDXEAASA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)NC2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000178682065 1027871991 /nfs/dbraw/zinc/87/19/91/1027871991.db2.gz UKFYRGGLGSHUPF-QJKCGZJTSA-N 1 0 347.459 3.637 20 5 EHBDRO CC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)[C@H]1CCCC[C@@H]1C ZINC000444667683 1028140193 /nfs/dbraw/zinc/14/01/93/1028140193.db2.gz YYNKLRLIPJNARU-YOEHRIQHSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1ccc(C[C@](C)([NH3+])CNc2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000533631489 1028197492 /nfs/dbraw/zinc/19/74/92/1028197492.db2.gz KUSDDTYWWXUXMD-KRWDZBQOSA-N 1 0 349.818 3.629 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000421377683 1028337782 /nfs/dbraw/zinc/33/77/82/1028337782.db2.gz HSVCSHJXXMBRQN-HPBDAGMYSA-N 1 0 332.444 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H]2CC23CCSCC3)c(Cl)c1 ZINC000421378910 1028339053 /nfs/dbraw/zinc/33/90/53/1028339053.db2.gz KYKJBSJHQSMLPF-LBPRGKRZSA-N 1 0 326.849 3.871 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CC[C@@H](C[NH3+])C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423513805 1028490868 /nfs/dbraw/zinc/49/08/68/1028490868.db2.gz RNQSIBIAACHOPK-ZXYWRSMDSA-N 1 0 343.427 3.557 20 5 EHBDRO CN(c1ccccc1)c1ccc(C[NH2+]CCCCCO)cc1[N+](=O)[O-] ZINC000583004726 1028523674 /nfs/dbraw/zinc/52/36/74/1028523674.db2.gz ZAGMFWNPVXFNMZ-UHFFFAOYSA-N 1 0 343.427 3.615 20 5 EHBDRO C[N@H+](CCCCN[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)C1CC1 ZINC000583029555 1028593343 /nfs/dbraw/zinc/59/33/43/1028593343.db2.gz UVGVCLYAVUVATF-HNNXBMFYSA-N 1 0 345.365 3.662 20 5 EHBDRO CC(C)(C)OC(=O)C(C)(C)CC[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000424187902 1028875812 /nfs/dbraw/zinc/87/58/12/1028875812.db2.gz KNHDPRLILMYGMB-UHFFFAOYSA-N 1 0 340.395 3.582 20 5 EHBDRO Cc1ccccc1C[NH2+]Cc1ccc(Br)cc1[N+](=O)[O-] ZINC000162134776 1029465223 /nfs/dbraw/zinc/46/52/23/1029465223.db2.gz CEZCWLSGNNHKME-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000533262050 1029542152 /nfs/dbraw/zinc/54/21/52/1029542152.db2.gz WTPZFAQEKCRRIG-HUUCEWRRSA-N 1 0 341.411 3.657 20 5 EHBDRO CC(C)[C@@H](COCc1ccccc1)[NH2+]Cc1ccccc1[N+](=O)[O-] ZINC000446922665 1029854775 /nfs/dbraw/zinc/85/47/75/1029854775.db2.gz NIEWFPZHVATVPO-GOSISDBHSA-N 1 0 328.412 3.926 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@H](c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453247593 1029974470 /nfs/dbraw/zinc/97/44/70/1029974470.db2.gz NZZISIABLYCWSY-BPUTZDHNSA-N 1 0 328.416 3.705 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000453263921 1029998965 /nfs/dbraw/zinc/99/89/65/1029998965.db2.gz VFCKEGIKTONELZ-AAEUAGOBSA-N 1 0 334.338 3.911 20 5 EHBDRO CCC[C@H]([NH2+]CCc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000124217239 1030028314 /nfs/dbraw/zinc/02/83/14/1030028314.db2.gz FUUPJCRQGAPLHU-SFHVURJKSA-N 1 0 330.432 3.619 20 5 EHBDRO C[C@H](CCO)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000525708324 1030046601 /nfs/dbraw/zinc/04/66/01/1030046601.db2.gz HKWFVNIJUZZQJE-CYBMUJFWSA-N 1 0 348.374 3.634 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[NH+]2CCC(c3ccc(O)cc3)CC2)c1 ZINC000052467483 1030284020 /nfs/dbraw/zinc/28/40/20/1030284020.db2.gz CLJMSELSFDAOQN-UHFFFAOYSA-N 1 0 342.395 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1ncccc1Cl)CCC2 ZINC000447585437 1030318010 /nfs/dbraw/zinc/31/80/10/1030318010.db2.gz KGVJANWPVGOUDC-MRXNPFEDSA-N 1 0 347.802 3.689 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCOc1ccc(Cl)cn1)CCC2 ZINC000447589346 1030325319 /nfs/dbraw/zinc/32/53/19/1030325319.db2.gz XQWLVFSGUOTBEL-INIZCTEOSA-N 1 0 347.802 3.689 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)N1CCc2ccccc21 ZINC000532210596 1030480700 /nfs/dbraw/zinc/48/07/00/1030480700.db2.gz HIBGJRWMLJVOTB-CABCVRRESA-N 1 0 325.412 3.697 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448122 1030503341 /nfs/dbraw/zinc/50/33/41/1030503341.db2.gz GDUPUWUVPYTMNF-NWDGAFQWSA-N 1 0 331.372 3.506 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccc(OC(C)C)nc2)cc1[N+](=O)[O-] ZINC000160060658 1030515961 /nfs/dbraw/zinc/51/59/61/1030515961.db2.gz JXYVOZZMCNELMU-AWEZNQCLSA-N 1 0 329.400 3.936 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCC[C@@H](C(F)(F)F)C1 ZINC000129721547 1030534084 /nfs/dbraw/zinc/53/40/84/1030534084.db2.gz KVVBBJBNAKBJKK-VXGBXAGGSA-N 1 0 332.322 3.814 20 5 EHBDRO C[C@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000192623408 1030793311 /nfs/dbraw/zinc/79/33/11/1030793311.db2.gz AFUFJFGCNGIEKP-NHYWBVRUSA-N 1 0 339.823 3.697 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])ccn1 ZINC000550916479 1030796183 /nfs/dbraw/zinc/79/61/83/1030796183.db2.gz GXDJKMSNGADKAK-LLVKDONJSA-N 1 0 335.791 3.545 20 5 EHBDRO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247154673 1030917345 /nfs/dbraw/zinc/91/73/45/1030917345.db2.gz LVNYKBKOEYOYGB-DYVFJYSZSA-N 1 0 328.416 3.843 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@H]2CCC(C)(C)C2)cccc1[N+](=O)[O-] ZINC000483110858 1030974438 /nfs/dbraw/zinc/97/44/38/1030974438.db2.gz MJJITIVEZMLVCQ-AWEZNQCLSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)Oc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000192682394 1031124419 /nfs/dbraw/zinc/12/44/19/1031124419.db2.gz XXWVRJSWMHVGNA-GOSISDBHSA-N 1 0 341.411 3.944 20 5 EHBDRO C[C@@H](CC(=O)N(C)c1ccccc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000296040317 1031166978 /nfs/dbraw/zinc/16/69/78/1031166978.db2.gz NZGVUYYVBBOFGS-GJZGRUSLSA-N 1 0 341.411 3.687 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCC[C@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC000926916527 1031273389 /nfs/dbraw/zinc/27/33/89/1031273389.db2.gz QDUBSAUDZWPPOT-MISXGVKJSA-N 1 0 332.322 3.745 20 5 EHBDRO COc1cc(CN2CCc3cc(C)ccc3C2)c([N+](=O)[O-])cc1F ZINC000484011051 1031423908 /nfs/dbraw/zinc/42/39/08/1031423908.db2.gz HNNMPNFNCURSSS-UHFFFAOYSA-N 1 0 330.359 3.609 20 5 EHBDRO [NH3+]CC1CCC(CNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000343590390 1031522257 /nfs/dbraw/zinc/52/22/57/1031522257.db2.gz HSUATSRXZDZROE-UHFFFAOYSA-N 1 0 347.462 3.883 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@H](CO)CC1CCCC1)CCC2 ZINC000343590935 1031524428 /nfs/dbraw/zinc/52/44/28/1031524428.db2.gz HNCSSTBRWKMDBG-DNVCBOLYSA-N 1 0 332.444 3.751 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN(C)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000484480024 1031631665 /nfs/dbraw/zinc/63/16/65/1031631665.db2.gz KBFSPYPAQDFRIZ-HNNXBMFYSA-N 1 0 345.418 3.825 20 5 EHBDRO CC[C@@H]([NH2+]CC[C@@H](N(C)C)C(F)(F)F)c1cccc([N+](=O)[O-])c1 ZINC000926959801 1031980358 /nfs/dbraw/zinc/98/03/58/1031980358.db2.gz CWRSFOZZUPZUEL-ZIAGYGMSSA-N 1 0 333.354 3.518 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]CCCc1nc2ccccc2[nH]1 ZINC000594501986 1033404254 /nfs/dbraw/zinc/40/42/54/1033404254.db2.gz ADYLITDIUSYFGT-OAHLLOKOSA-N 1 0 336.395 3.681 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])n1cc(C[N@H+](C)C2CCCCC2)nn1 ZINC000603220881 1033438358 /nfs/dbraw/zinc/43/83/58/1033438358.db2.gz WNFWWTWQOAGCLH-AWEZNQCLSA-N 1 0 343.431 3.560 20 5 EHBDRO CCC(=O)c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@H]23)c([N+](=O)[O-])c1 ZINC000594597637 1033444031 /nfs/dbraw/zinc/44/40/31/1033444031.db2.gz DGOHZZQYLWFVPN-GDBMZVCRSA-N 1 0 331.416 3.616 20 5 EHBDRO CCCC[N@H+](CC)Cc1cccc(CNc2ncc([N+](=O)[O-])s2)c1 ZINC000409724616 1033446888 /nfs/dbraw/zinc/44/68/88/1033446888.db2.gz CTWIUCPWFNQVHB-UHFFFAOYSA-N 1 0 348.472 3.707 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2ccc(C(F)(F)F)s2)cc1 ZINC000515197593 1033477346 /nfs/dbraw/zinc/47/73/46/1033477346.db2.gz MAMIESPIAACTGB-UHFFFAOYSA-N 1 0 346.330 3.844 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(O[C@@H]2CCOC2)cc1)c1cccc([N+](=O)[O-])c1 ZINC000594923935 1033547552 /nfs/dbraw/zinc/54/75/52/1033547552.db2.gz HADRBSBWYULAQS-IFXJQAMLSA-N 1 0 342.395 3.613 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](CCO)C1CCCCC1 ZINC000595021053 1033614854 /nfs/dbraw/zinc/61/48/54/1033614854.db2.gz OKEXZXPSPOSRQL-GUYCJALGSA-N 1 0 336.432 3.585 20 5 EHBDRO C[N@@H+]1CC[C@H](NCc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CC1(C)C ZINC000598973346 1033618684 /nfs/dbraw/zinc/61/86/84/1033618684.db2.gz WHVICIUZGFIXBE-ZDUSSCGKSA-N 1 0 345.365 3.576 20 5 EHBDRO CC1(C)[C@H](C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)C1(F)F ZINC000594990792 1033621426 /nfs/dbraw/zinc/62/14/26/1033621426.db2.gz ADRJUQLDFIHKAP-NSHDSACASA-N 1 0 336.285 3.577 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](c1cccs1)N(C)C ZINC000595002903 1033628981 /nfs/dbraw/zinc/62/89/81/1033628981.db2.gz BEKHWQSRNHYPAX-DOMZBBRYSA-N 1 0 349.456 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CO[C@@H](C4CC4)C3)o2)cc1 ZINC000599007609 1033640177 /nfs/dbraw/zinc/64/01/77/1033640177.db2.gz QPLRZCUXFOCPRO-KBXCAEBGSA-N 1 0 328.368 3.512 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+][C@H]3CO[C@@H](C4CC4)C3)o2)c1 ZINC000599006393 1033640252 /nfs/dbraw/zinc/64/02/52/1033640252.db2.gz HTWYBDMZTYYTAF-RDTXWAMCSA-N 1 0 328.368 3.512 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccnc1N1CCCC1 ZINC000595064143 1033641572 /nfs/dbraw/zinc/64/15/72/1033641572.db2.gz DNGGJHVWPYTUKQ-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000595074708 1033644131 /nfs/dbraw/zinc/64/41/31/1033644131.db2.gz UJDPOKHRCKERSR-LJQANCHMSA-N 1 0 325.412 3.898 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](c2ccccn2)C2CCC2)cc1[N+](=O)[O-] ZINC000598993030 1033647642 /nfs/dbraw/zinc/64/76/42/1033647642.db2.gz IINVMCVBJXRBSV-GOSISDBHSA-N 1 0 327.384 3.629 20 5 EHBDRO Cc1ccncc1CC[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000595073567 1033648548 /nfs/dbraw/zinc/64/85/48/1033648548.db2.gz NKJXZUQIOQCOQS-VQIMIIECSA-N 1 0 339.439 3.842 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@H](CNc2ccc3cnccc3c2[N+](=O)[O-])C1 ZINC000599035742 1033663693 /nfs/dbraw/zinc/66/36/93/1033663693.db2.gz NDHSKZNZGQIULZ-CQSZACIVSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1noc2ccccc21 ZINC000595051567 1033667784 /nfs/dbraw/zinc/66/77/84/1033667784.db2.gz WASAWWNZPOYBNT-CYBMUJFWSA-N 1 0 325.368 3.938 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1noc2ccccc21 ZINC000595051569 1033667939 /nfs/dbraw/zinc/66/79/39/1033667939.db2.gz WASAWWNZPOYBNT-ZDUSSCGKSA-N 1 0 325.368 3.938 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CO[C@@H](C3CC3)C2)c2ccccc2)c1 ZINC000599085127 1033723799 /nfs/dbraw/zinc/72/37/99/1033723799.db2.gz NEHJSEGGHLAPDA-MISYRCLQSA-N 1 0 338.407 3.841 20 5 EHBDRO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000595330860 1033728110 /nfs/dbraw/zinc/72/81/10/1033728110.db2.gz MZJZNLQYGHSMGD-DJIMGWMZSA-N 1 0 336.407 3.759 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000593682579 1033753260 /nfs/dbraw/zinc/75/32/60/1033753260.db2.gz WEYFWKKHPRRIDQ-CYBMUJFWSA-N 1 0 330.384 3.760 20 5 EHBDRO COc1cccc(C[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000089512137 1033772784 /nfs/dbraw/zinc/77/27/84/1033772784.db2.gz AGSTXSVJHYLUHL-GOSISDBHSA-N 1 0 326.396 3.714 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000595419295 1033791958 /nfs/dbraw/zinc/79/19/58/1033791958.db2.gz KDVWPSDHBQVCGR-RDTXWAMCSA-N 1 0 344.386 3.991 20 5 EHBDRO Cc1noc(C[N@@H+]2C[C@H](c3ccccc3)[C@H]3CCC[C@H]32)c1[N+](=O)[O-] ZINC000595489382 1033812309 /nfs/dbraw/zinc/81/23/09/1033812309.db2.gz ABBHJUKMPPXTFV-BZUAXINKSA-N 1 0 327.384 3.659 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cnc(C(F)(F)F)nc1)c1cccc([N+](=O)[O-])c1 ZINC000593017844 1033816732 /nfs/dbraw/zinc/81/67/32/1033816732.db2.gz CELXTKLRPGLQRV-CYBMUJFWSA-N 1 0 340.305 3.645 20 5 EHBDRO Cc1noc(C[N@H+]2[C@@H]3CC[C@H]2C[C@@H](c2ccccc2)C3)c1[N+](=O)[O-] ZINC000595477907 1033824401 /nfs/dbraw/zinc/82/44/01/1033824401.db2.gz WFJHCHFEPHOGFE-MUJYYYPQSA-N 1 0 327.384 3.802 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)C2CCC(F)CC2)c([N+](=O)[O-])cc1F ZINC000595819331 1033993637 /nfs/dbraw/zinc/99/36/37/1033993637.db2.gz OFYNOLUTJDVTHZ-XSRFYTQQSA-N 1 0 328.359 3.749 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]([C@@H]2CCCCO2)C1 ZINC000595791010 1034002894 /nfs/dbraw/zinc/00/28/94/1034002894.db2.gz SJIJELZLWRGSCJ-YJBOKZPZSA-N 1 0 348.443 3.775 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000603905620 1034023967 /nfs/dbraw/zinc/02/39/67/1034023967.db2.gz JRYAVEBKPNFMDJ-RYQLBKOJSA-N 1 0 337.423 3.724 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000595868058 1034030810 /nfs/dbraw/zinc/03/08/10/1034030810.db2.gz RGXYGGLFIPCEMS-GXTWGEPZSA-N 1 0 330.388 3.798 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625115 1034072829 /nfs/dbraw/zinc/07/28/29/1034072829.db2.gz FZZHRHYDQOAXFV-QOBXEIRBSA-N 1 0 332.322 3.515 20 5 EHBDRO O=[N+]([O-])c1cc(N[C@@H]2CC[N@@H+]3CCC[C@@H]3C2)ccc1C(F)(F)F ZINC000596082051 1034074786 /nfs/dbraw/zinc/07/47/86/1034074786.db2.gz FIWGYAYUNMGDTK-VXGBXAGGSA-N 1 0 329.322 3.652 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cnccc1C(F)(F)F ZINC000596118299 1034081293 /nfs/dbraw/zinc/08/12/93/1034081293.db2.gz VTMDYEKFCLBENL-AWEZNQCLSA-N 1 0 337.301 3.786 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000450364062 1034178511 /nfs/dbraw/zinc/17/85/11/1034178511.db2.gz XIYQVCLNETXNLZ-OAHLLOKOSA-N 1 0 346.456 3.639 20 5 EHBDRO CC[C@@H]([NH2+]CCN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310054807 1034210171 /nfs/dbraw/zinc/21/01/71/1034210171.db2.gz YOVLQJVXBNVUMT-OAHLLOKOSA-N 1 0 337.420 3.502 20 5 EHBDRO C/C(=C/C(=O)Nc1ccccc1C[NH+](C)C)c1ccc([N+](=O)[O-])cc1 ZINC000785216469 1034296342 /nfs/dbraw/zinc/29/63/42/1034296342.db2.gz CTDIWOINISGOGC-OWBHPGMISA-N 1 0 339.395 3.698 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1NC1CC[NH+](Cc2ccccn2)CC1 ZINC000076836217 1034308647 /nfs/dbraw/zinc/30/86/47/1034308647.db2.gz XHOQEQZYJKNZCS-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)CCOCc2ccccc2)cc1[N+](=O)[O-] ZINC000389940440 1034308857 /nfs/dbraw/zinc/30/88/57/1034308857.db2.gz MJLCSFBRBSKXQI-MRXNPFEDSA-N 1 0 328.412 3.988 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]Cc2cccc3[nH]ccc32)n1 ZINC000601320998 1034451739 /nfs/dbraw/zinc/45/17/39/1034451739.db2.gz MQXQDGNQYZGNKK-DLBZAZTESA-N 1 0 339.399 3.546 20 5 EHBDRO CC[N@H+](CCCNC(=O)c1c(C)cccc1[N+](=O)[O-])C1CCCCC1 ZINC000593251240 1034478720 /nfs/dbraw/zinc/47/87/20/1034478720.db2.gz RGCHFZJHCQMYPA-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO C[C@H](O)C1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000597233838 1034613857 /nfs/dbraw/zinc/61/38/57/1034613857.db2.gz AWPJQNJHRGUXBV-JTQLQIEISA-N 1 0 336.775 3.511 20 5 EHBDRO C[N@@H+]1CCC[C@H]1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000534608010 1034723109 /nfs/dbraw/zinc/72/31/09/1034723109.db2.gz MCTAGQANPXKBBT-NSHDSACASA-N 1 0 345.262 3.934 20 5 EHBDRO CCOc1cc(N(C)CCC[N@H+](C)Cc2ccco2)ccc1[N+](=O)[O-] ZINC000343818135 1034787152 /nfs/dbraw/zinc/78/71/52/1034787152.db2.gz ZFEQSTXNXSGKFR-UHFFFAOYSA-N 1 0 347.415 3.545 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](c2cccs2)C2CC2)c1[N+](=O)[O-] ZINC000892488330 1034813983 /nfs/dbraw/zinc/81/39/83/1034813983.db2.gz KXOFCUHKCOKOBY-AWEZNQCLSA-N 1 0 334.397 3.611 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+](C)[C@@H]1CCCc2c1cnn2C ZINC000615835123 1035027903 /nfs/dbraw/zinc/02/79/03/1035027903.db2.gz PURRORKVIFRPAP-RXEWJAMOSA-N 1 0 340.427 3.741 20 5 EHBDRO CC(C)CC1(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CC1 ZINC000236677107 1035052791 /nfs/dbraw/zinc/05/27/91/1035052791.db2.gz CBHDXSQEBCRRGG-UHFFFAOYSA-N 1 0 342.443 3.911 20 5 EHBDRO C[C@@H]1C[C@H](Oc2c(Br)cc(Cl)cc2[N+](=O)[O-])CC[NH2+]1 ZINC001218053674 1035481389 /nfs/dbraw/zinc/48/13/89/1035481389.db2.gz SPXHWPFTRCALEL-VXNVDRBHSA-N 1 0 349.612 3.530 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000581778700 1035552437 /nfs/dbraw/zinc/55/24/37/1035552437.db2.gz OIIPHZWXRPJCOM-LLVKDONJSA-N 1 0 337.326 3.750 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCN(C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000164554236 1035666976 /nfs/dbraw/zinc/66/69/76/1035666976.db2.gz CQQVUZMRQVZUCV-HOCLYGCPSA-N 1 0 349.431 3.645 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]C2CCC(C(F)F)CC2)n1 ZINC000414190061 1035982313 /nfs/dbraw/zinc/98/23/13/1035982313.db2.gz RGEVELQGVNTUHN-CLRIEMFWSA-N 1 0 342.390 3.689 20 5 EHBDRO CCOc1cc(C[N@H+](CCc2nccs2)C(C)C)ccc1[N+](=O)[O-] ZINC000492584127 1036031696 /nfs/dbraw/zinc/03/16/96/1036031696.db2.gz UDVUWSIZOYYEIQ-UHFFFAOYSA-N 1 0 349.456 3.903 20 5 EHBDRO CCOc1cc(CN2CCOC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000492651043 1036134496 /nfs/dbraw/zinc/13/44/96/1036134496.db2.gz JDZXZNIPNGHKCP-UHFFFAOYSA-N 1 0 334.416 3.529 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000056201740 1036139432 /nfs/dbraw/zinc/13/94/32/1036139432.db2.gz YEWDODNKXBSBLW-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc([C@H](C)[N@H+](C)C[C@@H](O)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000749687386 1036242398 /nfs/dbraw/zinc/24/23/98/1036242398.db2.gz JCIPZARFMLWMOV-HNAYVOBHSA-N 1 0 328.412 3.938 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCS[C@H]3CCCC[C@H]32)ccc1[N+](=O)[O-] ZINC000492788766 1036294209 /nfs/dbraw/zinc/29/42/09/1036294209.db2.gz JSJPVKUBHRQZLY-WBVHZDCISA-N 1 0 336.457 3.854 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@H](C3CC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000589209659 1036311711 /nfs/dbraw/zinc/31/17/11/1036311711.db2.gz QFBIVFKFHBHRAE-INIZCTEOSA-N 1 0 340.427 3.617 20 5 EHBDRO CC(C)[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)Cc1ccccn1 ZINC000056495182 1036328930 /nfs/dbraw/zinc/32/89/30/1036328930.db2.gz WRAQLAIXUBQLRJ-UHFFFAOYSA-N 1 0 329.400 3.669 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)[C@H]2COc3ccccc32)ccc1[N+](=O)[O-] ZINC000492814355 1036333576 /nfs/dbraw/zinc/33/35/76/1036333576.db2.gz AOFHCMASMMHQGR-XJKSGUPXSA-N 1 0 342.395 3.648 20 5 EHBDRO Cc1c(NC(=O)[C@@H](C)[NH+]2CCC(C)(C3CC3)CC2)cccc1[N+](=O)[O-] ZINC000589287052 1036341358 /nfs/dbraw/zinc/34/13/58/1036341358.db2.gz DJCHXDDZBHZQTC-CQSZACIVSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])c1csnn1 ZINC000414293532 1036494852 /nfs/dbraw/zinc/49/48/52/1036494852.db2.gz CYPFUKIPSPWTGU-SGMGOOAPSA-N 1 0 332.429 3.508 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](C)[C@@H]1Oc2ccccc2[C@H]1C ZINC000541691065 1036562452 /nfs/dbraw/zinc/56/24/52/1036562452.db2.gz URABNAIBUJMKBI-VLXJIEOASA-N 1 0 342.395 3.646 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH+]2CCC([C@@H]3CCCCO3)CC2)cc1 ZINC000595788404 1036638794 /nfs/dbraw/zinc/63/87/94/1036638794.db2.gz NHTZZAKHQPAASM-IBGZPJMESA-N 1 0 348.443 3.645 20 5 EHBDRO CC[C@H]([NH2+]C[C@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414317893 1036642811 /nfs/dbraw/zinc/64/28/11/1036642811.db2.gz WTKPVGJUUBZBGQ-QAPCUYQASA-N 1 0 332.375 3.551 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCC[C@@H](CO)C1 ZINC000414337136 1036743924 /nfs/dbraw/zinc/74/39/24/1036743924.db2.gz KMTHLFMWDLVAMN-RBSFLKMASA-N 1 0 338.473 3.606 20 5 EHBDRO CC[C@@]1(C)CCC[N@@H+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000464777048 1036770295 /nfs/dbraw/zinc/77/02/95/1036770295.db2.gz OMTNRTNBKAGCSV-KDOFPFPSSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](CCO)C1(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000539509357 1036848388 /nfs/dbraw/zinc/84/83/88/1036848388.db2.gz JOSOUODNYXFZNU-CRAIPNDOSA-N 1 0 346.471 3.694 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N[C@H](C[NH+]2CCCC2)c2ccccc2)n1 ZINC000541933352 1036857274 /nfs/dbraw/zinc/85/72/74/1036857274.db2.gz OKNJPWVWSBQFGN-QGZVFWFLSA-N 1 0 340.427 3.856 20 5 EHBDRO CCOc1cccc(N[C@H]2CC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000310831174 1036913336 /nfs/dbraw/zinc/91/33/36/1036913336.db2.gz YXIIDBRCVPPYJT-INIZCTEOSA-N 1 0 341.411 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3nc4c(s3)CCC4)C2)cc1 ZINC000590659583 1036996330 /nfs/dbraw/zinc/99/63/30/1036996330.db2.gz JUMNDNOVBOZRCR-CQSZACIVSA-N 1 0 343.452 3.920 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3noc4c3CCCC4)C2)cc1 ZINC000590757333 1037027324 /nfs/dbraw/zinc/02/73/24/1037027324.db2.gz SOUKDKVUWYAJFS-OAHLLOKOSA-N 1 0 341.411 3.841 20 5 EHBDRO COc1cc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2C)C2CC2)ccc1O ZINC000191511418 1037167961 /nfs/dbraw/zinc/16/79/61/1037167961.db2.gz RWRYKJZYYULQRA-UHFFFAOYSA-N 1 0 342.395 3.782 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2c(Cl)cccc2[N+](=O)[O-])C[C@@H]1C ZINC000493282111 1037218086 /nfs/dbraw/zinc/21/80/86/1037218086.db2.gz SDXYCQBBINWWBQ-QWHCGFSZSA-N 1 0 325.840 3.553 20 5 EHBDRO CC(C)C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000170908568 1037263970 /nfs/dbraw/zinc/26/39/70/1037263970.db2.gz HFSIMOHOFIENMC-UHFFFAOYSA-N 1 0 329.400 3.913 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](SC)C(C)(C)C ZINC000542315659 1037282017 /nfs/dbraw/zinc/28/20/17/1037282017.db2.gz UJUWOJIACNVBET-OAHLLOKOSA-N 1 0 326.462 3.861 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000193042376 1037297962 /nfs/dbraw/zinc/29/79/62/1037297962.db2.gz VUUBRQOPDPFNOA-SFHVURJKSA-N 1 0 341.411 3.689 20 5 EHBDRO CC[N@@H+]1CC[C@H]2CC[C@@H](C1)N2Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000539891521 1037313280 /nfs/dbraw/zinc/31/32/80/1037313280.db2.gz ORDHHUFNZVLPDS-SJORKVTESA-N 1 0 331.460 3.777 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)cc1 ZINC000171128214 1037470087 /nfs/dbraw/zinc/47/00/87/1037470087.db2.gz NVDXSNQQSKPHTQ-ZDUSSCGKSA-N 1 0 328.368 3.621 20 5 EHBDRO CC1CC[NH+](CCCNc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000462926108 1037552244 /nfs/dbraw/zinc/55/22/44/1037552244.db2.gz JBUQYJMOUCKAFE-UHFFFAOYSA-N 1 0 343.374 3.730 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2cnn(CC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000532538725 1037569144 /nfs/dbraw/zinc/56/91/44/1037569144.db2.gz BOPLGACKKMBYKU-NSHDSACASA-N 1 0 342.321 3.513 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCOc2ccc(F)cc2F)cccc1[N+](=O)[O-] ZINC000532550078 1037593562 /nfs/dbraw/zinc/59/35/62/1037593562.db2.gz QOYPDBNTNGTYEW-LBPRGKRZSA-N 1 0 336.338 3.911 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCN(C)[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000540154106 1037626324 /nfs/dbraw/zinc/62/63/24/1037626324.db2.gz VYHSENHDAXVHBO-QSFXBCCZSA-N 1 0 339.439 3.999 20 5 EHBDRO Cc1cc(N[C@@H]2CCO[C@@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541191199 1037658744 /nfs/dbraw/zinc/65/87/44/1037658744.db2.gz SGXFLCQYBDUSOX-FZKQIMNGSA-N 1 0 343.427 3.879 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000046037860 1037729390 /nfs/dbraw/zinc/72/93/90/1037729390.db2.gz PLKDVUQYJARRFF-QGZVFWFLSA-N 1 0 342.395 3.949 20 5 EHBDRO COc1cncc(/C=C\CC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])c1 ZINC000592122786 1037835522 /nfs/dbraw/zinc/83/55/22/1037835522.db2.gz PFSAAINEZICWHP-VURMDHGXSA-N 1 0 341.411 3.927 20 5 EHBDRO CC1(C[N@H+](Cc2ccccc2[N+](=O)[O-])[C@H]2CC[C@H](O)CC2)CCC1 ZINC000592132186 1037844053 /nfs/dbraw/zinc/84/40/53/1037844053.db2.gz AGBFGEJIZHZZDE-QAQDUYKDSA-N 1 0 332.444 3.891 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cnc([C@H]2CCCO2)s1)c1ccccc1[N+](=O)[O-] ZINC000897466201 1037879243 /nfs/dbraw/zinc/87/92/43/1037879243.db2.gz PRAYJKVXJYJGAT-BLLLJJGKSA-N 1 0 347.440 3.796 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@@H](C)C1 ZINC000251926359 1037882893 /nfs/dbraw/zinc/88/28/93/1037882893.db2.gz STHCQQPZNJQXQX-WMLDXEAASA-N 1 0 347.459 3.521 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1c(F)cccc1F ZINC000341286205 1037884424 /nfs/dbraw/zinc/88/44/24/1037884424.db2.gz JVXBPPYCRDTKOV-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@H]1CCN(c2ccccc2F)C1 ZINC000492039875 1037914493 /nfs/dbraw/zinc/91/44/93/1037914493.db2.gz DEMYBWITHUHYAB-YERXGYGTSA-N 1 0 341.386 3.616 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000492039873 1037914684 /nfs/dbraw/zinc/91/46/84/1037914684.db2.gz DEMYBWITHUHYAB-GMNBZTITSA-N 1 0 341.386 3.616 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1csc(C)c1 ZINC000592188870 1037926430 /nfs/dbraw/zinc/92/64/30/1037926430.db2.gz QSFFRWACRZLTSY-MRXNPFEDSA-N 1 0 347.440 3.668 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCCC[C@H]3C3CCC3)n2)cc1 ZINC000592198939 1037943713 /nfs/dbraw/zinc/94/37/13/1037943713.db2.gz MTWLXNQUWKXYPE-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCOc2ncccc2Cl)cc1[N+](=O)[O-] ZINC000090408294 1038055442 /nfs/dbraw/zinc/05/54/42/1038055442.db2.gz MOYCORZASYGXEI-LBPRGKRZSA-N 1 0 335.791 3.681 20 5 EHBDRO COCCOc1cccc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])c1 ZINC000897469154 1038060442 /nfs/dbraw/zinc/06/04/42/1038060442.db2.gz FCTVKHNNJBZJRS-HNNXBMFYSA-N 1 0 344.411 3.513 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000120200628 1038109568 /nfs/dbraw/zinc/10/95/68/1038109568.db2.gz WGBRXNBEXNKUIF-HNAYVOBHSA-N 1 0 327.428 3.857 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000120200156 1038125151 /nfs/dbraw/zinc/12/51/51/1038125151.db2.gz WGBRXNBEXNKUIF-BEFAXECRSA-N 1 0 327.428 3.857 20 5 EHBDRO CC[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCO1 ZINC000511540508 1038362270 /nfs/dbraw/zinc/36/22/70/1038362270.db2.gz HZQZSCOMOVGRDH-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1cc(N2CC[N@@H+]3CCCC[C@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461781478 1038608138 /nfs/dbraw/zinc/60/81/38/1038608138.db2.gz XMWHSSFSZXAHMN-LBPRGKRZSA-N 1 0 343.349 3.597 20 5 EHBDRO Cc1cc(N2CC[N@@H+]3CCCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461781477 1038608437 /nfs/dbraw/zinc/60/84/37/1038608437.db2.gz XMWHSSFSZXAHMN-GFCCVEGCSA-N 1 0 343.349 3.597 20 5 EHBDRO CCc1oc(CNC(C)(C)c2ccc([N+](=O)[O-])cc2)cc1C(=O)OC ZINC000569942513 1038775438 /nfs/dbraw/zinc/77/54/38/1038775438.db2.gz PALSIJBWFCEVSS-UHFFFAOYSA-N 1 0 346.383 3.562 20 5 EHBDRO c1ccc2c(c1)cc(-c1nc(CC3CC[NH2+]CC3)no1)c1ncccc21 ZINC000905312515 1038789539 /nfs/dbraw/zinc/78/95/39/1038789539.db2.gz AOTMAKDDMNSVAN-UHFFFAOYSA-N 1 0 344.418 3.980 20 5 EHBDRO CCOC(=O)C[C@@](C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])C(C)C ZINC000479866939 1038846901 /nfs/dbraw/zinc/84/69/01/1038846901.db2.gz SZDJCBCRAVECDX-XSFOEPMVSA-N 1 0 334.416 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(OCc3ccccc3F)CC2)cc1 ZINC000091863040 1039072807 /nfs/dbraw/zinc/07/28/07/1039072807.db2.gz VSWUXABJRQGPDH-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO Cc1ccc([C@H]2[C@H](C)CCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)cc1 ZINC000478036464 1039138670 /nfs/dbraw/zinc/13/86/70/1039138670.db2.gz KXFXPUSGZAADQS-CRAIPNDOSA-N 1 0 328.416 3.573 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC[C@@H]1C ZINC000517722936 1039225324 /nfs/dbraw/zinc/22/53/24/1039225324.db2.gz HWCUTLJXQGKXTL-RRFJBIMHSA-N 1 0 338.473 3.728 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2C[C@H]2c2ccccc2)n1 ZINC000570189654 1039259746 /nfs/dbraw/zinc/25/97/46/1039259746.db2.gz FKBQORGHIHZAQX-WNRNVDISSA-N 1 0 340.427 3.668 20 5 EHBDRO COC[C@@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000554374778 1039287480 /nfs/dbraw/zinc/28/74/80/1039287480.db2.gz ZRGNCKYNOCTHBK-MRXNPFEDSA-N 1 0 334.803 3.768 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C(C)(C)O ZINC000480463957 1039570596 /nfs/dbraw/zinc/57/05/96/1039570596.db2.gz DAEVIGHKZBSNEK-KRWDZBQOSA-N 1 0 332.400 3.740 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc(OC(F)F)c(F)c2)cccc1[N+](=O)[O-] ZINC000480456977 1039576013 /nfs/dbraw/zinc/57/60/13/1039576013.db2.gz VEFCPFGANBIPMB-UHFFFAOYSA-N 1 0 340.301 3.934 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](C1CC1)[N@H+](C)Cc1ccccc1 ZINC000480527915 1039666371 /nfs/dbraw/zinc/66/63/71/1039666371.db2.gz PKSSLRCHZYSYQU-SFHVURJKSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COCc2ccccc21 ZINC000417355448 1039714149 /nfs/dbraw/zinc/71/41/49/1039714149.db2.gz DJCIIKRFWDSVQR-KDOFPFPSSA-N 1 0 326.396 3.777 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)nc1 ZINC000417358500 1039719812 /nfs/dbraw/zinc/71/98/12/1039719812.db2.gz HZCNPQQKKYMBCF-IBGZPJMESA-N 1 0 325.412 3.898 20 5 EHBDRO Cc1cc(NCC2=CC[N@H+](C)CC2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000555158259 1040242366 /nfs/dbraw/zinc/24/23/66/1040242366.db2.gz DTGFLKDAPHBJAI-UHFFFAOYSA-N 1 0 329.322 3.596 20 5 EHBDRO CCC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000053377057 1040266957 /nfs/dbraw/zinc/26/69/57/1040266957.db2.gz XJDSEGNWFUZDMC-GFCCVEGCSA-N 1 0 330.388 3.828 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000481117030 1040363459 /nfs/dbraw/zinc/36/34/59/1040363459.db2.gz QFPHWJQJMOTNLO-WFASDCNBSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@H](CCc1ccco1)[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000500060914 1040406168 /nfs/dbraw/zinc/40/61/68/1040406168.db2.gz FCHUXLKDFNTTHJ-ZIAGYGMSSA-N 1 0 345.399 3.516 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000481168576 1040422689 /nfs/dbraw/zinc/42/26/89/1040422689.db2.gz MOGMJKQNBMWHFU-YOEHRIQHSA-N 1 0 333.432 3.790 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500069278 1040430498 /nfs/dbraw/zinc/43/04/98/1040430498.db2.gz GNHRALPPEIRXMF-GOEBONIOSA-N 1 0 333.432 3.824 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1ccccc1[N+](=O)[O-] ZINC000512677953 1040497099 /nfs/dbraw/zinc/49/70/99/1040497099.db2.gz NJHWUTKDBDNDDS-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@H]1CCCC[C@H]1O ZINC000555420385 1040556121 /nfs/dbraw/zinc/55/61/21/1040556121.db2.gz GXVWRWVKWOIUED-IAQYHMDHSA-N 1 0 346.349 3.597 20 5 EHBDRO Cc1c(C[NH2+]Cc2cnc(-c3ccco3)s2)cccc1[N+](=O)[O-] ZINC000487199442 1040784196 /nfs/dbraw/zinc/78/41/96/1040784196.db2.gz LKOMLYCWEHCHAW-UHFFFAOYSA-N 1 0 329.381 3.910 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@H](C(=O)OC(C)(C)C)[C@@H](C)C1 ZINC000600197038 1040811675 /nfs/dbraw/zinc/81/16/75/1040811675.db2.gz QDSCQURWABUJNA-YOEHRIQHSA-N 1 0 348.443 3.703 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2ccc([S@@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000080344673 1040928314 /nfs/dbraw/zinc/92/83/14/1040928314.db2.gz APGRTSZCNIKMDQ-DEOSSOPVSA-N 1 0 346.452 3.745 20 5 EHBDRO C[C@@H](COCC(F)(F)F)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433165009 1040953350 /nfs/dbraw/zinc/95/33/50/1040953350.db2.gz HCNAUDOAGVEAFI-IINYFYTJSA-N 1 0 346.349 3.874 20 5 EHBDRO CCN(CC)C(=O)CCC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433175620 1040979189 /nfs/dbraw/zinc/97/91/89/1040979189.db2.gz MPTMXRSOLXZZDI-QGZVFWFLSA-N 1 0 347.459 3.555 20 5 EHBDRO C[C@H](C1CCCCC1)[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000566666687 1041093776 /nfs/dbraw/zinc/09/37/76/1041093776.db2.gz WYYOLKVIMCONRR-CQSZACIVSA-N 1 0 333.432 3.824 20 5 EHBDRO C[C@@H]1CSC[C@@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000512864749 1041113706 /nfs/dbraw/zinc/11/37/06/1041113706.db2.gz OXLZQUYAIBSLPA-YGRLFVJLSA-N 1 0 335.454 3.559 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CSC[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000512868902 1041138262 /nfs/dbraw/zinc/13/82/62/1041138262.db2.gz KCTQJDZXWLVRIP-IAQYHMDHSA-N 1 0 348.424 3.705 20 5 EHBDRO C[C@@H](Cc1ccncc1)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433280786 1041193791 /nfs/dbraw/zinc/19/37/91/1041193791.db2.gz FHJKDPPLJPTQPI-UGSOOPFHSA-N 1 0 325.412 3.933 20 5 EHBDRO COc1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000150985560 1041231097 /nfs/dbraw/zinc/23/10/97/1041231097.db2.gz ASMJIMCYOFWZBB-GOSISDBHSA-N 1 0 326.396 3.714 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)[C@@H]1CC1(C)C ZINC000419314402 1041270250 /nfs/dbraw/zinc/27/02/50/1041270250.db2.gz HYVWIHKXJYFOEK-WCQYABFASA-N 1 0 339.823 3.601 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC3CC([NH+]4CCCCC4)C3)ccnc21 ZINC000432149122 1041655573 /nfs/dbraw/zinc/65/55/73/1041655573.db2.gz SCFQMQYRIROGMF-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000164977344 1042580913 /nfs/dbraw/zinc/58/09/13/1042580913.db2.gz AMCNDAGWSQBHCU-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(CO)c(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000279091600 1043341133 /nfs/dbraw/zinc/34/11/33/1043341133.db2.gz NLGZBBCEIPPECT-SFHVURJKSA-N 1 0 344.386 3.738 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2cc([N+](=O)[O-])ccc21 ZINC000279118018 1043380246 /nfs/dbraw/zinc/38/02/46/1043380246.db2.gz PVMVCVNBTGCICP-CVEARBPZSA-N 1 0 326.400 3.708 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H]2CCCc3cn[nH]c32)c2cc([N+](=O)[O-])ccc21 ZINC000279118026 1043380874 /nfs/dbraw/zinc/38/08/74/1043380874.db2.gz PVMVCVNBTGCICP-JKSUJKDBSA-N 1 0 326.400 3.708 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCCc3sccc32)c1[N+](=O)[O-] ZINC000893641317 1043388546 /nfs/dbraw/zinc/38/85/46/1043388546.db2.gz UQQIWRNCIQKDKG-LBPRGKRZSA-N 1 0 334.397 3.538 20 5 EHBDRO Cn1cc(C[NH2+][C@H]2CCc3ccccc32)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000279174828 1043504663 /nfs/dbraw/zinc/50/46/63/1043504663.db2.gz RCRQTVQLESIGJN-IBGZPJMESA-N 1 0 348.406 3.772 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cc(F)cc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000279542810 1044209134 /nfs/dbraw/zinc/20/91/34/1044209134.db2.gz QGJDBLKZLRGOQZ-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO CO[C@H](CC[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1)C(F)(F)F ZINC000344865640 1044555104 /nfs/dbraw/zinc/55/51/04/1044555104.db2.gz MYPYQLJTQXWILU-CQSZACIVSA-N 1 0 334.338 3.775 20 5 EHBDRO Cc1ccccc1C[C@H](CO)[NH2+]Cc1ccc(C(C)C)c([N+](=O)[O-])c1 ZINC000466918991 1126094338 /nfs/dbraw/zinc/09/43/38/1126094338.db2.gz WSJLYKWLMJBWQE-GOSISDBHSA-N 1 0 342.439 3.720 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](Cc3ccc(C(F)F)cc3)CC2)cc1 ZINC000763806932 1126870557 /nfs/dbraw/zinc/87/05/57/1126870557.db2.gz JJZXCAWMCGHEIB-UHFFFAOYSA-N 1 0 347.365 3.855 20 5 EHBDRO C[C@H]1C[NH+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H](C)S1 ZINC000072771189 1126877794 /nfs/dbraw/zinc/87/77/94/1126877794.db2.gz DGRNNWVMYOGKEA-STQMWFEESA-N 1 0 347.440 3.618 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@@H]3C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461788566 1127148108 /nfs/dbraw/zinc/14/81/08/1127148108.db2.gz XRQODSBVBBMGEA-NWDGAFQWSA-N 1 0 343.349 3.961 20 5 EHBDRO CCC[C@@H]1CCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000185879348 1127182278 /nfs/dbraw/zinc/18/22/78/1127182278.db2.gz FQGOENCPHFAELZ-CQSZACIVSA-N 1 0 349.431 3.587 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](Cn2ccnc2)C(C)(C)C)cccc1[N+](=O)[O-] ZINC000765251228 1127588489 /nfs/dbraw/zinc/58/84/89/1127588489.db2.gz MXILNQPPUJXVMP-WMLDXEAASA-N 1 0 330.432 3.865 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@@H](C)c1cccc([N+](=O)[O-])c1)NC(=O)OC(C)(C)C ZINC000785438419 1127743982 /nfs/dbraw/zinc/74/39/82/1127743982.db2.gz HRVTZKZLNKTKDS-STQMWFEESA-N 1 0 337.420 3.501 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@H]1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC001168553468 1127751201 /nfs/dbraw/zinc/75/12/01/1127751201.db2.gz RLBZXSKKQMDBOO-VNQPRFMTSA-N 1 0 334.416 3.533 20 5 EHBDRO Cc1cc(NCc2ccc(C[NH+]3CCCCC3)cc2)ncc1[N+](=O)[O-] ZINC000301436872 1127889870 /nfs/dbraw/zinc/88/98/70/1127889870.db2.gz SHZDHVJSERFGIW-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N2CC[C@@H](C[NH+]3CCCC3)C2)c(Cl)c1 ZINC000302320068 1127890912 /nfs/dbraw/zinc/89/09/12/1127890912.db2.gz WFNMFKFIAFGOPY-NSHDSACASA-N 1 0 344.242 3.824 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](C)[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000347571449 1128105249 /nfs/dbraw/zinc/10/52/49/1128105249.db2.gz REQQJRMIDGTPNJ-WDEREUQCSA-N 1 0 344.358 3.683 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccnc(OCC2CC2)c1 ZINC001649101687 1128249727 /nfs/dbraw/zinc/24/97/27/1128249727.db2.gz MSUARXSJXLRNSA-UHFFFAOYSA-N 1 0 341.411 3.685 20 5 EHBDRO CNC(=O)[C@@H]1CCC[C@@H]1[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000765798007 1128380113 /nfs/dbraw/zinc/38/01/13/1128380113.db2.gz UFYBVNIKSQIHOM-CTNGQTDRSA-N 1 0 332.447 3.997 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ncc1[N+](=O)[O-] ZINC000301508530 1128483921 /nfs/dbraw/zinc/48/39/21/1128483921.db2.gz AQIKWZGFWHYRPZ-RDJZCZTQSA-N 1 0 340.427 3.763 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000153592642 1128486797 /nfs/dbraw/zinc/48/67/97/1128486797.db2.gz NYXOQKVRNBKTMV-KBPBESRZSA-N 1 0 344.411 3.981 20 5 EHBDRO CO[C@@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000542725225 1128563102 /nfs/dbraw/zinc/56/31/02/1128563102.db2.gz ZOPHUXMGXXLCBB-FZKQIMNGSA-N 1 0 332.375 3.908 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](CO)c2ccccc2Cl)cc1[N+](=O)[O-] ZINC000554358209 1128640729 /nfs/dbraw/zinc/64/07/29/1128640729.db2.gz BFPGJRZUJXIBSH-DZGCQCFKSA-N 1 0 348.830 3.983 20 5 EHBDRO C[C@@H](O)[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819741 1128661392 /nfs/dbraw/zinc/66/13/92/1128661392.db2.gz AQBUEXDDIUHGNW-UKRRQHHQSA-N 1 0 346.452 3.916 20 5 EHBDRO CCCN(CC[NH+]1CCCCCC1)C(=O)c1ccc([N+](=O)[O-])c(C)c1 ZINC000554802427 1128692406 /nfs/dbraw/zinc/69/24/06/1128692406.db2.gz NKTLMYQUVGJURU-UHFFFAOYSA-N 1 0 347.459 3.631 20 5 EHBDRO CCc1nc2c(s1)[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000123229748 1128702442 /nfs/dbraw/zinc/70/24/42/1128702442.db2.gz NAHCAPPWECHFFG-AWEZNQCLSA-N 1 0 331.441 3.823 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2ccc3c(c2)OCCO3)cc1[N+](=O)[O-] ZINC000327310348 1128767325 /nfs/dbraw/zinc/76/73/25/1128767325.db2.gz QGBFKKVIDVCWII-AWEZNQCLSA-N 1 0 342.395 3.568 20 5 EHBDRO Cc1nc(NC[C@H](c2cccs2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301657100 1128846785 /nfs/dbraw/zinc/84/67/85/1128846785.db2.gz SFMXKZMFXFREEX-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO C[C@]1(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])CCCS1 ZINC000162205736 1120198665 /nfs/dbraw/zinc/19/86/65/1120198665.db2.gz LHTHXZZXZAGYSA-CYBMUJFWSA-N 1 0 345.262 3.733 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494653210 1120719402 /nfs/dbraw/zinc/71/94/02/1120719402.db2.gz YMGVSARMSFTKBZ-GOEBONIOSA-N 1 0 326.824 3.932 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000494653214 1120719908 /nfs/dbraw/zinc/71/99/08/1120719908.db2.gz YMGVSARMSFTKBZ-ZBFHGGJFSA-N 1 0 326.824 3.932 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccc(F)cc1 ZINC000495045873 1120939871 /nfs/dbraw/zinc/93/98/71/1120939871.db2.gz MPAOHLUTQJDKSN-KBXCAEBGSA-N 1 0 344.386 3.991 20 5 EHBDRO CC1(C)CC[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)O1 ZINC000495165378 1120973441 /nfs/dbraw/zinc/97/34/41/1120973441.db2.gz DTVMSKXWZPOMJG-INIZCTEOSA-N 1 0 330.384 3.902 20 5 EHBDRO CC(C)C[C@H](CNc1ccc([N+](=O)[O-])cn1)[NH2+][C@@H](C)c1ccccc1 ZINC000495320172 1121073788 /nfs/dbraw/zinc/07/37/88/1121073788.db2.gz YSVQTOKDVFMIEL-DOTOQJQBSA-N 1 0 342.443 3.589 20 5 EHBDRO COc1cnccc1[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000193329032 1121114352 /nfs/dbraw/zinc/11/43/52/1121114352.db2.gz ZHJXEFBNHUXVMP-PXAZEXFGSA-N 1 0 327.384 3.727 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000193630414 1121514606 /nfs/dbraw/zinc/51/46/06/1121514606.db2.gz XAYUXTXJKAYUDV-QGZVFWFLSA-N 1 0 341.411 3.973 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCCC[C@H]23)cc1C(F)(F)F ZINC000301117823 1121952334 /nfs/dbraw/zinc/95/23/34/1121952334.db2.gz WIJNNLUEHXPMQI-TZMCWYRMSA-N 1 0 329.322 3.652 20 5 EHBDRO C[C@H](CNc1ncc(Cl)cc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000301741627 1129026025 /nfs/dbraw/zinc/02/60/25/1129026025.db2.gz LGKAYTGFHMYRCF-GFCCVEGCSA-N 1 0 346.818 3.502 20 5 EHBDRO C[N@@H+]1CCN(C/C=C\c2ccccc2[N+](=O)[O-])C2(CCCCC2)C1 ZINC000255210802 1129046159 /nfs/dbraw/zinc/04/61/59/1129046159.db2.gz GOLUCJWDQHUKSH-CLFYSBASSA-N 1 0 329.444 3.558 20 5 EHBDRO Cc1c(C[NH2+]Cc2cn(C)nc2C2CCCC2)cccc1[N+](=O)[O-] ZINC000922048237 1129059020 /nfs/dbraw/zinc/05/90/20/1129059020.db2.gz CIQVFRMGGMPDBE-UHFFFAOYSA-N 1 0 328.416 3.584 20 5 EHBDRO CCCC(=O)Nc1cccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)c1 ZINC000917136921 1122530831 /nfs/dbraw/zinc/53/08/31/1122530831.db2.gz AGWKZXVOJNYNRF-UHFFFAOYSA-N 1 0 341.411 3.932 20 5 EHBDRO CCCC(=O)Nc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000917137375 1122531123 /nfs/dbraw/zinc/53/11/23/1122531123.db2.gz MBAOFRNXDDCAKX-UHFFFAOYSA-N 1 0 341.411 3.932 20 5 EHBDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154339023 1122564575 /nfs/dbraw/zinc/56/45/75/1122564575.db2.gz VMMZNGBALPVJJB-AZOIQLNYSA-N 1 0 344.386 3.645 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+]C1(c2ccccc2)CCC1 ZINC000194554228 1122739562 /nfs/dbraw/zinc/73/95/62/1122739562.db2.gz GOXCKXCXYMZWLJ-UHFFFAOYSA-N 1 0 339.395 3.511 20 5 EHBDRO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000556896393 1123173427 /nfs/dbraw/zinc/17/34/27/1123173427.db2.gz VWVFKWYFGVRFAG-KBAYOESNSA-N 1 0 332.444 3.929 20 5 EHBDRO C[NH+](C)[C@@H](CNc1c(F)cc([N+](=O)[O-])cc1F)c1cccs1 ZINC000301807420 1129106717 /nfs/dbraw/zinc/10/67/17/1129106717.db2.gz WLPAMTSKAMWAMW-LBPRGKRZSA-N 1 0 327.356 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@@H]([NH+]3CCCC3)C2)c(C(F)(F)F)c1 ZINC000301226289 1123370128 /nfs/dbraw/zinc/37/01/28/1123370128.db2.gz BVHILHXZIAKTMI-CYBMUJFWSA-N 1 0 343.349 3.678 20 5 EHBDRO COc1cccc2c1OCC[C@@H]2[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000609599060 1123619440 /nfs/dbraw/zinc/61/94/40/1123619440.db2.gz HCFXYZAEADOEAC-HNNXBMFYSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672477 1123636441 /nfs/dbraw/zinc/63/64/41/1123636441.db2.gz CGFYWZZDTLYOOJ-NVXWUHKLSA-N 1 0 326.396 3.852 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609672476 1123636577 /nfs/dbraw/zinc/63/65/77/1123636577.db2.gz CGFYWZZDTLYOOJ-DOTOQJQBSA-N 1 0 326.396 3.852 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH+]1CCC2(CCCC2)CC1 ZINC000610004509 1123711962 /nfs/dbraw/zinc/71/19/62/1123711962.db2.gz PVNVVIFUXRCCSC-UHFFFAOYSA-N 1 0 345.443 3.888 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cccnc1OC(C)C ZINC000615722609 1123863698 /nfs/dbraw/zinc/86/36/98/1123863698.db2.gz QRQAXWRDOZECMI-GDNBJRDFSA-N 1 0 341.411 3.970 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCOCC2(CCCC2)C1 ZINC000615838774 1123885239 /nfs/dbraw/zinc/88/52/39/1123885239.db2.gz CHYYPNGXYRDDJB-LFIBNONCSA-N 1 0 330.428 3.891 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@]3(CC=CCC3)C2)c2c(c1)COCO2 ZINC000114495130 1129152391 /nfs/dbraw/zinc/15/23/91/1129152391.db2.gz HYQAVVSNOJZACN-LJQANCHMSA-N 1 0 344.411 3.784 20 5 EHBDRO C[C@@H](O)C[C@@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000543063782 1129175641 /nfs/dbraw/zinc/17/56/41/1129175641.db2.gz OZFWUVGHQFHNPH-HUUCEWRRSA-N 1 0 343.427 3.612 20 5 EHBDRO CSC1(CNc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)CCOCC1 ZINC000272802772 1124634562 /nfs/dbraw/zinc/63/45/62/1124634562.db2.gz DZXUDWMNTQLAAT-UHFFFAOYSA-N 1 0 347.440 3.776 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@@H](C)c1ccsc1 ZINC000619783152 1125404212 /nfs/dbraw/zinc/40/42/12/1125404212.db2.gz OXEBECVTTRICMQ-LBPRGKRZSA-N 1 0 333.413 3.644 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2cc(F)ccc2[N+](=O)[O-])C1 ZINC000735493207 1131353717 /nfs/dbraw/zinc/35/37/17/1131353717.db2.gz YGTATWMVBNCDRH-VBQJREDUSA-N 1 0 335.423 3.571 20 5 EHBDRO C[C@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@H]1C1CC1 ZINC000543242501 1129366748 /nfs/dbraw/zinc/36/67/48/1129366748.db2.gz QWYHRVXJECBNQF-OALUTQOASA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3C[C@@H]4CC[C@H](O)[C@@H]4C3)s2)cc1 ZINC000543413226 1129473482 /nfs/dbraw/zinc/47/34/82/1129473482.db2.gz ZUKMGJDZOAPXOS-XKQJLSEDSA-N 1 0 344.436 3.526 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1ccc([N+](=O)[O-])cc1 ZINC000922538655 1129565861 /nfs/dbraw/zinc/56/58/61/1129565861.db2.gz VAUCWBYOZWSEAL-CQSZACIVSA-N 1 0 342.395 3.997 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@@H]2C[C@H]2c2ccccc2)cc1[N+](=O)[O-] ZINC000555189493 1129573815 /nfs/dbraw/zinc/57/38/15/1129573815.db2.gz XCQSTELADUGXNG-JQFCIGGWSA-N 1 0 326.396 3.885 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[N@H+](C)C/C=C/c1ccccc1[N+](=O)[O-] ZINC000093324611 1129584822 /nfs/dbraw/zinc/58/48/22/1129584822.db2.gz TUXPZXDSCXWWDG-KEDPEKRHSA-N 1 0 326.396 3.877 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CN(Cc3ccccc3)C[C@H]2C)cccc1[N+](=O)[O-] ZINC000389826712 1129591065 /nfs/dbraw/zinc/59/10/65/1129591065.db2.gz RTMDDHFJTJUPFC-BEFAXECRSA-N 1 0 339.439 3.513 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)N(C)C)c1 ZINC000154971514 1129602555 /nfs/dbraw/zinc/60/25/55/1129602555.db2.gz SXKUKTHZPGPJSM-IFXJQAMLSA-N 1 0 343.427 3.557 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)C(=O)Nc2cc(C)c([N+](=O)[O-])cc2C)C[C@@H]1C ZINC000331075871 1129652743 /nfs/dbraw/zinc/65/27/43/1129652743.db2.gz WDVWGTMYWVFDSU-LSDHHAIUSA-N 1 0 348.447 3.548 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000156504622 1129720853 /nfs/dbraw/zinc/72/08/53/1129720853.db2.gz KTUTUMXTTWYIFW-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@@H]3OCC[C@H]32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092623 1129767703 /nfs/dbraw/zinc/76/77/03/1129767703.db2.gz QIXFPNXJCPLHQS-JOQOYGCGSA-N 1 0 327.384 3.821 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3c(Cl)cc([N+](=O)[O-])cc3Cl)CC[C@H]21 ZINC000302268887 1129774843 /nfs/dbraw/zinc/77/48/43/1129774843.db2.gz GPNOAGSTHSFZQL-IINYFYTJSA-N 1 0 344.242 3.822 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302718247 1129787739 /nfs/dbraw/zinc/78/77/39/1129787739.db2.gz YZAXAGQYCRPKEZ-CYBMUJFWSA-N 1 0 325.840 3.725 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1c(F)cccc1F)c1cccc([N+](=O)[O-])c1 ZINC000056196505 1129805541 /nfs/dbraw/zinc/80/55/41/1129805541.db2.gz UUEJOIWTNDOEBG-MNOVXSKESA-N 1 0 349.337 3.551 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl ZINC000056196900 1129805590 /nfs/dbraw/zinc/80/55/90/1129805590.db2.gz FJZVWWJBUHAAIJ-NWDGAFQWSA-N 1 0 347.802 3.926 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccc(Cl)cc1 ZINC000056197305 1129806076 /nfs/dbraw/zinc/80/60/76/1129806076.db2.gz HPESGXKJIMDFPN-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO CCCCN(C)C(=O)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000075642415 1129854045 /nfs/dbraw/zinc/85/40/45/1129854045.db2.gz CWUDTLRNYIAYPY-HNNXBMFYSA-N 1 0 347.459 3.626 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000133557519 1129952538 /nfs/dbraw/zinc/95/25/38/1129952538.db2.gz PKKCKBBZCSEPPF-FZKQIMNGSA-N 1 0 331.391 3.687 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc([N+](=O)[O-])cc3C(F)(F)F)CC[C@@H]21 ZINC000133587954 1129953758 /nfs/dbraw/zinc/95/37/58/1129953758.db2.gz NDFLOTNZLVAZKD-RISCZKNCSA-N 1 0 343.349 3.534 20 5 EHBDRO Cn1cc(C[NH2+]C/C=C/c2ccccc2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000171841559 1130091857 /nfs/dbraw/zinc/09/18/57/1130091857.db2.gz IEXMXWHEIKZOFN-VMPITWQZSA-N 1 0 348.406 3.798 20 5 EHBDRO CC[C@H](C)[C@H](C)[NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000142113611 1130167518 /nfs/dbraw/zinc/16/75/18/1130167518.db2.gz IOVFAOAXMJXBQQ-DCAQKATOSA-N 1 0 327.812 3.599 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CN(C)C(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000701878121 1130178552 /nfs/dbraw/zinc/17/85/52/1130178552.db2.gz JYAIVDKNIFZNSQ-QWHCGFSZSA-N 1 0 337.420 3.501 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCC[C@@H](Cc2nccn2C)C1 ZINC000245528183 1130230454 /nfs/dbraw/zinc/23/04/54/1130230454.db2.gz QJIXSGDGBJIGTC-CVEARBPZSA-N 1 0 342.443 3.652 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])cnn1C ZINC000245553959 1130237812 /nfs/dbraw/zinc/23/78/12/1130237812.db2.gz QUZGOGAMNAHGMZ-DHSIGJKJSA-N 1 0 342.443 3.699 20 5 EHBDRO C[C@@H]1CC([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@@H](C)C1 ZINC000766107777 1130322971 /nfs/dbraw/zinc/32/29/71/1130322971.db2.gz JMCYNWUYSIYBBU-GJZGRUSLSA-N 1 0 331.460 3.978 20 5 EHBDRO C[C@@H](C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C[C@H](C)O ZINC000246055817 1130338876 /nfs/dbraw/zinc/33/88/76/1130338876.db2.gz YRPNWGWIWNQGAB-ZRGWGRIASA-N 1 0 328.412 3.681 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000738417611 1131469186 /nfs/dbraw/zinc/46/91/86/1131469186.db2.gz RAQBFCDBVOTHAZ-SJORKVTESA-N 1 0 336.338 3.647 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)o1 ZINC000741261503 1131591103 /nfs/dbraw/zinc/59/11/03/1131591103.db2.gz OFMQUXPOUQDKNG-MRXNPFEDSA-N 1 0 342.351 3.579 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+]Cc1ccc(CSC(F)F)o1 ZINC000742379909 1131718437 /nfs/dbraw/zinc/71/84/37/1131718437.db2.gz FYCOIUHZGMMZGK-UHFFFAOYSA-N 1 0 342.367 3.976 20 5 EHBDRO CN(CC[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172897619 1131881745 /nfs/dbraw/zinc/88/17/45/1131881745.db2.gz BHGCOEVLKAOMAB-GOSISDBHSA-N 1 0 339.439 3.568 20 5 EHBDRO [NH2+]=C(N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(Cl)nc1 ZINC001172900469 1131883564 /nfs/dbraw/zinc/88/35/64/1131883564.db2.gz UCYHQPIKJOJREJ-AWEZNQCLSA-N 1 0 344.802 3.506 20 5 EHBDRO [NH3+]Cc1ccc2ncn([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c2c1 ZINC001172902035 1131884775 /nfs/dbraw/zinc/88/47/75/1131884775.db2.gz UDDFKRACXCSUMM-INIZCTEOSA-N 1 0 336.395 3.523 20 5 EHBDRO CC(C)(C)CN1CC[C@H]([NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)C1 ZINC001172903024 1131884916 /nfs/dbraw/zinc/88/49/16/1131884916.db2.gz DCOFKCSMMRVBIO-MSOLQXFVSA-N 1 0 345.487 3.552 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)nc1 ZINC001172902535 1131885260 /nfs/dbraw/zinc/88/52/60/1131885260.db2.gz ZMBUAWKCVYDDKW-RHSMWYFYSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC[C@@H](O)c1ccccc1)CC2 ZINC001172901878 1131885682 /nfs/dbraw/zinc/88/56/82/1131885682.db2.gz QOLPDNAGAJYPET-UYAOXDASSA-N 1 0 340.423 3.556 20 5 EHBDRO [NH3+]Cc1ccc(N[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1F ZINC001172905281 1131886340 /nfs/dbraw/zinc/88/63/40/1131886340.db2.gz HSNUXVBADPVGOX-OAHLLOKOSA-N 1 0 329.375 3.552 20 5 EHBDRO Cc1cc([C@H]2CCC[N@@H+]2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)no1 ZINC001172910419 1131916973 /nfs/dbraw/zinc/91/69/73/1131916973.db2.gz ZFIDFAGNRXRWQF-VQIMIIECSA-N 1 0 341.411 3.976 20 5 EHBDRO CO[C@H]1CCC[C@@H]2C[N@@H+]([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)C[C@@H]21 ZINC001172910548 1131917125 /nfs/dbraw/zinc/91/71/25/1131917125.db2.gz LVERWRJPTAWPSX-JYBIWHBTSA-N 1 0 344.455 3.589 20 5 EHBDRO CC(C)(C)CC[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173006799 1131934233 /nfs/dbraw/zinc/93/42/33/1131934233.db2.gz CCGPLDDTCRZWOS-UHFFFAOYSA-N 1 0 341.402 3.868 20 5 EHBDRO CC(C)[NH+](C(C)C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173013927 1131935259 /nfs/dbraw/zinc/93/52/59/1131935259.db2.gz HTJOBHLSWAIUNB-UHFFFAOYSA-N 1 0 341.402 3.961 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccc(F)cc2)c1F ZINC001173174906 1131991692 /nfs/dbraw/zinc/99/16/92/1131991692.db2.gz FXBMUSOCRGZHSA-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CC[C@@H]3CCC[C@@H]32)c1F ZINC001173188981 1131994622 /nfs/dbraw/zinc/99/46/22/1131994622.db2.gz MTDADAKOGDWGAR-ABHRYQDASA-N 1 0 336.407 3.842 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC(c3ccccc3)C2)c1F ZINC001173194956 1131994959 /nfs/dbraw/zinc/99/49/59/1131994959.db2.gz BCUHXMLYIMWAMT-ZDUSSCGKSA-N 1 0 344.386 3.773 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC1(CC2CC2)CCOCC1 ZINC001173223032 1132005360 /nfs/dbraw/zinc/00/53/60/1132005360.db2.gz GNRONVPSCIUEGY-OAHLLOKOSA-N 1 0 332.444 3.712 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173223216 1132005420 /nfs/dbraw/zinc/00/54/20/1132005420.db2.gz HCUPIZMRRLGNJW-DJJJIMSYSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](C(=O)OC(C)(C)C)C1 ZINC001173228225 1132007959 /nfs/dbraw/zinc/00/79/59/1132007959.db2.gz UQFRABYZHQUGCF-ZBFHGGJFSA-N 1 0 348.443 3.580 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1ccc(Cl)cc1 ZINC001173231570 1132009072 /nfs/dbraw/zinc/00/90/72/1132009072.db2.gz AUXOYWDLJZYAKW-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1cccc2ccoc21 ZINC001173230863 1132009295 /nfs/dbraw/zinc/00/92/95/1132009295.db2.gz VQXUXZKTWQSAQQ-AWEZNQCLSA-N 1 0 340.379 3.941 20 5 EHBDRO COc1ccc2c(c1)c(C[NH3+])cn2[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234575 1132009936 /nfs/dbraw/zinc/00/99/36/1132009936.db2.gz POMRDAIVYUGIMF-CYBMUJFWSA-N 1 0 339.395 3.821 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC(=O)[C@H](C)C12CCCC2 ZINC001173232495 1132010499 /nfs/dbraw/zinc/01/04/99/1132010499.db2.gz BSOOPMRUTNGUSX-GJZGRUSLSA-N 1 0 330.428 3.750 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](CO)c1cccc(Cl)c1 ZINC001173235879 1132010603 /nfs/dbraw/zinc/01/06/03/1132010603.db2.gz VPVOLCZOKGKZGN-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO COc1ccc(Cl)cc1C[NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173212562 1132013709 /nfs/dbraw/zinc/01/37/09/1132013709.db2.gz AXFDKOYZYNMILE-GFCCVEGCSA-N 1 0 334.803 3.978 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2c(F)cccc21 ZINC001173214532 1132015001 /nfs/dbraw/zinc/01/50/01/1132015001.db2.gz OOUUPCLYLYWSIO-YVEFUNNKSA-N 1 0 330.359 3.778 20 5 EHBDRO CC[N@H+](Cc1ccc2c(c1)OCO2)[C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173236659 1132025695 /nfs/dbraw/zinc/02/56/95/1132025695.db2.gz DQVIUSGKYFOMKW-AWEZNQCLSA-N 1 0 342.395 3.777 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2-c1conc1C ZINC001212724102 1132064026 /nfs/dbraw/zinc/06/40/26/1132064026.db2.gz YQGSNZBUFVCZLR-UHFFFAOYSA-N 1 0 334.379 3.540 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCNc1ccccc1)C1CC1 ZINC000766515792 1132584578 /nfs/dbraw/zinc/58/45/78/1132584578.db2.gz QOQPTIYQDRXIOA-GOSISDBHSA-N 1 0 325.412 3.618 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168991820 1132626026 /nfs/dbraw/zinc/62/60/26/1132626026.db2.gz CERNDIOBGIMJKF-SJCJKPOMSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC3(CCCc4ccccc43)CC2)C1 ZINC001169010053 1132631573 /nfs/dbraw/zinc/63/15/73/1132631573.db2.gz AOABSPZCUPCVTO-SJLPKXTDSA-N 1 0 328.456 3.802 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2ccccn2)C1 ZINC001169009403 1132631834 /nfs/dbraw/zinc/63/18/34/1132631834.db2.gz WCMXKLXGHJCEBU-HKUYNNGSSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH+]2CCC(Oc3ccc(Cl)cc3)CC2)C1 ZINC001169014416 1132632790 /nfs/dbraw/zinc/63/27/90/1132632790.db2.gz ZLICRSIWJAYVBF-UKRRQHHQSA-N 1 0 338.835 3.629 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCSC[C@H]2c2cccc(Cl)c2)C1 ZINC001169037128 1132636705 /nfs/dbraw/zinc/63/67/05/1132636705.db2.gz JBPHTXISHRIDJD-WQVCFCJDSA-N 1 0 340.876 3.875 20 5 EHBDRO CC[N@H+](Cc1cccc(Br)c1)[C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001169035072 1132637380 /nfs/dbraw/zinc/63/73/80/1132637380.db2.gz ADLOSRCAFXEMDG-UKRRQHHQSA-N 1 0 341.249 3.716 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CC[C@@H](c3ccc(C(F)(F)F)cc3)C2)C1 ZINC001169038402 1132638211 /nfs/dbraw/zinc/63/82/11/1132638211.db2.gz YLFGDRTXIUVSHS-XNRPHZJLSA-N 1 0 342.361 3.940 20 5 EHBDRO Cc1ccc2c(c1)C1(CC2)CC[NH+]([C@@H]2CC[C@@H](C[N+](=O)[O-])C2)CC1 ZINC001169024903 1132640338 /nfs/dbraw/zinc/64/03/38/1132640338.db2.gz SHPVFCHEDHPRNL-SJLPKXTDSA-N 1 0 328.456 3.720 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(Oc3cccc(Cl)c3)CC2)C1 ZINC001169023865 1132640870 /nfs/dbraw/zinc/64/08/70/1132640870.db2.gz FYEXZXNOQFOOQL-DZGCQCFKSA-N 1 0 338.835 3.629 20 5 EHBDRO CN(C)c1ccc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)c([N+](=O)[O-])c1 ZINC001169153780 1132680365 /nfs/dbraw/zinc/68/03/65/1132680365.db2.gz UDZIWIWSKNTQST-FZKQIMNGSA-N 1 0 334.464 3.616 20 5 EHBDRO C[NH+](C)CCOc1cc(N[C@H]2CCCC(F)(F)C2)ccc1[N+](=O)[O-] ZINC001169218509 1132698662 /nfs/dbraw/zinc/69/86/62/1132698662.db2.gz KZKKALOLSYJSSL-ZDUSSCGKSA-N 1 0 343.374 3.525 20 5 EHBDRO [NH3+]Cc1ccc2c(n1)N(c1ccc([N+](=O)[O-])c3ccccc31)CCC2 ZINC001169590767 1132790239 /nfs/dbraw/zinc/79/02/39/1132790239.db2.gz NINMECXDOGWMEL-UHFFFAOYSA-N 1 0 334.379 3.686 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1ccc(N(C)C)cc1[N+](=O)[O-] ZINC001169689442 1132821869 /nfs/dbraw/zinc/82/18/69/1132821869.db2.gz DTINFORIXFVORP-INIZCTEOSA-N 1 0 340.427 3.901 20 5 EHBDRO Cc1ccc2c(c1)[C@@H]([NH3+])CCCN2c1nc(Cl)ccc1[N+](=O)[O-] ZINC001169695563 1132822293 /nfs/dbraw/zinc/82/22/93/1132822293.db2.gz GWRSFKIHFDGSSY-LBPRGKRZSA-N 1 0 332.791 3.883 20 5 EHBDRO CC(C)[C@](O)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC001176036382 1132825815 /nfs/dbraw/zinc/82/58/15/1132825815.db2.gz LCKDBRAELFVWQO-HNAYVOBHSA-N 1 0 328.412 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccccc2)nc1NCC12CC[NH+](CC1)CC2 ZINC001169794859 1132860349 /nfs/dbraw/zinc/86/03/49/1132860349.db2.gz ZJYXFTPFWDMNBM-UHFFFAOYSA-N 1 0 338.411 3.555 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CCC[C@@H](c3nc4c(s3)CCC4)C2)c1 ZINC001176234819 1132883608 /nfs/dbraw/zinc/88/36/08/1132883608.db2.gz IOYLJBAHHHHOKK-CQSZACIVSA-N 1 0 343.452 3.920 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1N1CCC[C@@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000804357268 1133007742 /nfs/dbraw/zinc/00/77/42/1133007742.db2.gz BPCRBLZVQBMDJU-JKIFEVAISA-N 1 0 345.443 3.639 20 5 EHBDRO C[NH+](C)CCOc1ccc(CNc2cc(Cl)ccc2[N+](=O)[O-])cc1 ZINC000804356851 1133010779 /nfs/dbraw/zinc/01/07/79/1133010779.db2.gz RGKUGPDSNWBYTG-UHFFFAOYSA-N 1 0 349.818 3.801 20 5 EHBDRO CC(C)CC[C@H]1CCC[N@@H+]1Cn1cnc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000767766834 1133050017 /nfs/dbraw/zinc/05/00/17/1133050017.db2.gz XWISEZADOXSUPF-MRXNPFEDSA-N 1 0 343.431 3.711 20 5 EHBDRO COc1ccc(OCCC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001177453693 1133064136 /nfs/dbraw/zinc/06/41/36/1133064136.db2.gz CYPLQLXZHSIBQM-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNCc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC001177541961 1133079357 /nfs/dbraw/zinc/07/93/57/1133079357.db2.gz GYRNHKJGWYSPAE-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@@](C)(O)c1cccc(Cl)c1 ZINC001178426284 1133168670 /nfs/dbraw/zinc/16/86/70/1133168670.db2.gz ZOBREJYDGZYPBG-GOSISDBHSA-N 1 0 348.830 3.862 20 5 EHBDRO CCC[C@@H](O)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC001179701683 1133274680 /nfs/dbraw/zinc/27/46/80/1133274680.db2.gz VRWCXPPHQBDGDN-OAHLLOKOSA-N 1 0 334.441 3.964 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(C3(C)OCCO3)CC2)cc1[N+](=O)[O-] ZINC000769400267 1133277235 /nfs/dbraw/zinc/27/72/35/1133277235.db2.gz NYNGLXOJUCCKJH-UHFFFAOYSA-N 1 0 348.443 3.693 20 5 EHBDRO C[N@H+](CC(=O)Nc1cc2cccnc2c2ncccc12)C1CCCC1 ZINC001180628791 1133400893 /nfs/dbraw/zinc/40/08/93/1133400893.db2.gz AOWBKDGKWUKVDU-UHFFFAOYSA-N 1 0 334.423 3.596 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1C[C@@H]2C[C@H]1CN2c1ccccc1 ZINC001183909634 1133876569 /nfs/dbraw/zinc/87/65/69/1133876569.db2.gz PNYLEVBGJWHODZ-ROUUACIJSA-N 1 0 337.423 3.675 20 5 EHBDRO CC(C)[N@H+](C)Cc1ccccc1CNc1ccc(N)cc1[N+](=O)[O-] ZINC000786574959 1133876594 /nfs/dbraw/zinc/87/65/94/1133876594.db2.gz HFASKOKOUWQNAD-UHFFFAOYSA-N 1 0 328.416 3.629 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@](C)(O)c1cc(C)oc1C ZINC000786812122 1133910043 /nfs/dbraw/zinc/91/00/43/1133910043.db2.gz GTKCNORSQXJEQB-BNOPAZPUSA-N 1 0 344.411 3.705 20 5 EHBDRO CC1(C)CCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC(C)(C)[NH2+]1 ZINC001184375159 1133932636 /nfs/dbraw/zinc/93/26/36/1133932636.db2.gz UKUBVXAORTWKDL-UHFFFAOYSA-N 1 0 325.840 3.601 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1cc(Cl)ccc1[N+](=O)[O-])C1CCCCC1 ZINC000746667671 1133988441 /nfs/dbraw/zinc/98/84/41/1133988441.db2.gz ZVXRSWFEJTYKPH-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO C[C@@H](CNc1ncc([N+](=O)[O-])cc1C(F)(F)F)[N@@H+]1CCCC[C@@H]1C ZINC001184856780 1133999540 /nfs/dbraw/zinc/99/95/40/1133999540.db2.gz LQXLJTGQOXGAQO-QWRGUYRKSA-N 1 0 346.353 3.683 20 5 EHBDRO CC(C)[C@@H](C[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-])c1ccnn1C ZINC000788077487 1134077285 /nfs/dbraw/zinc/07/72/85/1134077285.db2.gz VSZLZBLDSBFPSM-CQSZACIVSA-N 1 0 336.823 3.511 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000788479728 1134130669 /nfs/dbraw/zinc/13/06/69/1134130669.db2.gz AAOQNCBNVAVBAF-RDJZCZTQSA-N 1 0 349.450 3.820 20 5 EHBDRO C[C@H]([NH2+]CC1(c2ccc(F)cc2)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788542549 1134140305 /nfs/dbraw/zinc/14/03/05/1134140305.db2.gz NVGOWGSOJQDHFE-LBPRGKRZSA-N 1 0 329.375 3.699 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)COCc1ccccc1 ZINC000788568807 1134146564 /nfs/dbraw/zinc/14/65/64/1134146564.db2.gz DGKJJOJCADTMCP-GJZGRUSLSA-N 1 0 343.427 3.681 20 5 EHBDRO CCN(CC)[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccco1 ZINC000788576369 1134147225 /nfs/dbraw/zinc/14/72/25/1134147225.db2.gz ZJAZAJNQHNTTTO-CXAGYDPISA-N 1 0 346.431 3.504 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H]2CSCCS2)c2cc([N+](=O)[O-])ccc21 ZINC000788584569 1134148272 /nfs/dbraw/zinc/14/82/72/1134148272.db2.gz KGSRLCOBPLUXDX-SWLSCSKDSA-N 1 0 338.498 3.755 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631773 1134153768 /nfs/dbraw/zinc/15/37/68/1134153768.db2.gz MWZZSBBOSVDGHN-BDJLRTHQSA-N 1 0 327.384 3.524 20 5 EHBDRO C[C@H]([NH2+][C@H](Cc1ccccc1)C1CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788640411 1134154438 /nfs/dbraw/zinc/15/44/38/1134154438.db2.gz AGJLPDXEBWDKTC-SCLBCKFNSA-N 1 0 325.412 3.849 20 5 EHBDRO O=[N+]([O-])c1c(NCc2ccc3c[nH+]cn3c2)cccc1C(F)(F)F ZINC001186661969 1134243585 /nfs/dbraw/zinc/24/35/85/1134243585.db2.gz PPXQKXRBBMYBGC-UHFFFAOYSA-N 1 0 336.273 3.873 20 5 EHBDRO CCOC(=O)C1(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])CCCC1 ZINC000792195480 1134666351 /nfs/dbraw/zinc/66/63/51/1134666351.db2.gz MXXVGDUBMUZKHM-HNNXBMFYSA-N 1 0 348.443 3.629 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297604 1134736997 /nfs/dbraw/zinc/73/69/97/1134736997.db2.gz QPHNAKGPHUIHCJ-ZYHUDNBSSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3ccccc32)c([N+](=O)[O-])c1 ZINC001170297962 1134738035 /nfs/dbraw/zinc/73/80/35/1134738035.db2.gz WVCQDKLENOLGFN-SCLBCKFNSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2ccc(C)c(F)c2)c([N+](=O)[O-])c1 ZINC001170297836 1134738298 /nfs/dbraw/zinc/73/82/98/1134738298.db2.gz UAHLLGFEKDYPTK-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C(C)(C)Cc2cccnc2)c([N+](=O)[O-])c1 ZINC001170325887 1134748269 /nfs/dbraw/zinc/74/82/69/1134748269.db2.gz BNEMCXRUBFNXNJ-CQSZACIVSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3c(C)cccc3C2)c([N+](=O)[O-])c1 ZINC001170330108 1134749788 /nfs/dbraw/zinc/74/97/88/1134749788.db2.gz YVPDKJGSVZBVNA-HNNXBMFYSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCc3cccnc32)c([N+](=O)[O-])c1 ZINC001170306556 1134752076 /nfs/dbraw/zinc/75/20/76/1134752076.db2.gz XLUXCPQRLRANMU-CXAGYDPISA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H](C(F)F)C2)c([N+](=O)[O-])c1 ZINC001170344944 1134758192 /nfs/dbraw/zinc/75/81/92/1134758192.db2.gz FSOCCLMTBDCXFX-WCQYABFASA-N 1 0 328.359 3.512 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](Cc2ccccc2)C2CC2)c([N+](=O)[O-])c1 ZINC000792877260 1134810609 /nfs/dbraw/zinc/81/06/09/1134810609.db2.gz RPBBQVNEJUZWCH-QGZVFWFLSA-N 1 0 341.367 3.614 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+]1CC=C(c2ccc(Cl)cc2)CC1 ZINC001191821515 1134930465 /nfs/dbraw/zinc/93/04/65/1134930465.db2.gz NYJCRNZHEWKYCZ-UHFFFAOYSA-N 1 0 346.818 3.542 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ccc([N+](=O)[O-])cc1C(C)=O)c1ccco1 ZINC000804386904 1135051816 /nfs/dbraw/zinc/05/18/16/1135051816.db2.gz JEABHZYAEOFGIL-QGZVFWFLSA-N 1 0 345.399 3.885 20 5 EHBDRO CC[N@H+](CCCNC(=O)c1ccc([N+](=O)[O-])cc1C)C1CCCCC1 ZINC001130589312 1135425146 /nfs/dbraw/zinc/42/51/46/1135425146.db2.gz UTTUHJDYHIWMET-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO C[C@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939165 1135486755 /nfs/dbraw/zinc/48/67/55/1135486755.db2.gz WXYJXKKZGOANJM-IINYFYTJSA-N 1 0 347.242 3.885 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC001196254034 1135536220 /nfs/dbraw/zinc/53/62/20/1135536220.db2.gz JBBYXFMZQSIDIE-MRXNPFEDSA-N 1 0 345.443 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cnc4ccccc4c3)c2c1 ZINC000808451026 1135670255 /nfs/dbraw/zinc/67/02/55/1135670255.db2.gz FOXATGVVIYGLND-UHFFFAOYSA-N 1 0 346.390 3.957 20 5 EHBDRO CC(C)c1ccc2c(c1)CC[N@@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C2 ZINC001198845364 1135859930 /nfs/dbraw/zinc/85/99/30/1135859930.db2.gz ZKYHRQHJZABMAR-HXUWFJFHSA-N 1 0 340.423 3.810 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CNCCC[NH+]1C[C@@H](C)C[C@H](C)C1 ZINC001199329620 1135898235 /nfs/dbraw/zinc/89/82/35/1135898235.db2.gz XFHLEPUDEJFXGD-GJZGRUSLSA-N 1 0 333.476 3.669 20 5 EHBDRO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CC[N@@H+](C2CC2)C1 ZINC000809946435 1135903499 /nfs/dbraw/zinc/90/34/99/1135903499.db2.gz DOMZWWIBEFOCJG-ZDUSSCGKSA-N 1 0 344.242 3.570 20 5 EHBDRO CC[C@@](C)(CC(=O)OC)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809964505 1135904216 /nfs/dbraw/zinc/90/42/16/1135904216.db2.gz MKKSOCQKNFWGBI-AWEZNQCLSA-N 1 0 349.214 3.723 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@H](c2ccccc2)C2CCCCC2)n1 ZINC000776005003 1135915611 /nfs/dbraw/zinc/91/56/11/1135915611.db2.gz AREJHRYPWKFGOD-GOSISDBHSA-N 1 0 328.416 3.703 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CCc3cscn3)o2)c1 ZINC001201140856 1135988127 /nfs/dbraw/zinc/98/81/27/1135988127.db2.gz QACWSBBUEZZPIM-UHFFFAOYSA-N 1 0 329.381 3.644 20 5 EHBDRO C[C@H]1CC([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C[C@H](C)O1 ZINC000811485782 1136092404 /nfs/dbraw/zinc/09/24/04/1136092404.db2.gz AUFPXDPRQORTPH-IUCAKERBSA-N 1 0 333.215 3.947 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C2 ZINC000811518393 1136098229 /nfs/dbraw/zinc/09/82/29/1136098229.db2.gz MQJXFMPTCOVTNG-AWEZNQCLSA-N 1 0 332.787 3.650 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1OC)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812853798 1136261909 /nfs/dbraw/zinc/26/19/09/1136261909.db2.gz KGVWDAXGXDUWDJ-LIRRHRJNSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC[C@@](C)(O)c1ccccc1 ZINC000850462394 1136264241 /nfs/dbraw/zinc/26/42/41/1136264241.db2.gz NYKQYMIBXZROPK-AUUYWEPGSA-N 1 0 344.411 3.552 20 5 EHBDRO Cc1ccc(CN2CCN(c3cccc(F)c3)C[C@@H]2C)cc1[N+](=O)[O-] ZINC001170722915 1136395414 /nfs/dbraw/zinc/39/54/14/1136395414.db2.gz MQMOGJQBBQIKJN-HNNXBMFYSA-N 1 0 343.402 3.753 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@H]1[C@H](O)c1ccccc1 ZINC000851832828 1136412193 /nfs/dbraw/zinc/41/21/93/1136412193.db2.gz DXRBVBHQSGKEDX-PKOBYXMFSA-N 1 0 344.386 3.822 20 5 EHBDRO CCC[N@@H+](Cc1ccc(C)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575495 1136438758 /nfs/dbraw/zinc/43/87/58/1136438758.db2.gz RODRITJXFKKGNT-IBGZPJMESA-N 1 0 328.412 3.849 20 5 EHBDRO Cc1ccccc1C1CC[NH+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776582537 1136442424 /nfs/dbraw/zinc/44/24/24/1136442424.db2.gz RZNVJMSBPBBWCB-FQEVSTJZSA-N 1 0 340.423 3.816 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@H+](C2CC2)[C@@H]2CCc3ccccc32)cc1 ZINC000776586828 1136449049 /nfs/dbraw/zinc/44/90/49/1136449049.db2.gz ISDGNUZBTPJYCA-UXHICEINSA-N 1 0 338.407 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]C2(c3cccc(Cl)c3)CC2)cc1 ZINC000776604830 1136468646 /nfs/dbraw/zinc/46/86/46/1136468646.db2.gz HTUMYYUIKDLWTE-INIZCTEOSA-N 1 0 332.787 3.561 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(O)CCCC3)s2)cc1 ZINC000111385279 1136540344 /nfs/dbraw/zinc/54/03/44/1136540344.db2.gz XZFSKHAIVALGBD-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO Cc1c(COC(=O)[C@@H]2CCCC[N@@H+]2C2CCCC2)cccc1[N+](=O)[O-] ZINC000815445468 1136596297 /nfs/dbraw/zinc/59/62/97/1136596297.db2.gz ZJWBRMGIBOBACX-SFHVURJKSA-N 1 0 346.427 3.744 20 5 EHBDRO COc1ccc(OC)c([C@@H](C)[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815554952 1136609648 /nfs/dbraw/zinc/60/96/48/1136609648.db2.gz MXCOANZENPHHGS-NWDGAFQWSA-N 1 0 345.399 3.606 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CSCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815571057 1136617520 /nfs/dbraw/zinc/61/75/20/1136617520.db2.gz SQWRCTJLNGTEQO-MEDUHNTESA-N 1 0 329.425 3.816 20 5 EHBDRO CCC(CC)[C@@H]1C[C@H]([NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)CCO1 ZINC000815614703 1136619000 /nfs/dbraw/zinc/61/90/00/1136619000.db2.gz ZBQGPGFZFQCPTH-DWQUBVKVSA-N 1 0 335.448 3.811 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776752139 1136634537 /nfs/dbraw/zinc/63/45/37/1136634537.db2.gz ISUITBWLGWBVMB-YCPHGPKFSA-N 1 0 349.431 3.502 20 5 EHBDRO CCC1(CC)CC[NH+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000776770799 1136659308 /nfs/dbraw/zinc/65/93/08/1136659308.db2.gz DGPKYTCQBZXEPR-UHFFFAOYSA-N 1 0 343.431 3.713 20 5 EHBDRO C[N@H+](CCCCNc1cccc(Br)c1[N+](=O)[O-])C1CC1 ZINC000856763651 1136808099 /nfs/dbraw/zinc/80/80/99/1136808099.db2.gz HGKLSNVOCXWPGU-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO CCCCOc1cccc(C[NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000818960195 1136891530 /nfs/dbraw/zinc/89/15/30/1136891530.db2.gz DVUGZQJAJXEFOJ-IBGZPJMESA-N 1 0 344.411 3.597 20 5 EHBDRO C[C@@H](CC(C)(C)c1ccccc1)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818979453 1136895924 /nfs/dbraw/zinc/89/59/24/1136895924.db2.gz MPHGTZHUYQACBY-KXBFYZLASA-N 1 0 342.439 3.974 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C[C@@H]2CCC[C@H]2c2ccccc2)cc1 ZINC000819340211 1136932681 /nfs/dbraw/zinc/93/26/81/1136932681.db2.gz SXMNPHMNWVZHPT-YSIASYRMSA-N 1 0 340.423 3.802 20 5 EHBDRO C[C@@H]1[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)CCS1(=O)=O ZINC000858282515 1136955208 /nfs/dbraw/zinc/95/52/08/1136955208.db2.gz ZQPQGBGDFBANIJ-JLTOFOAXSA-N 1 0 339.460 3.658 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CC[C@@H]4C[C@@H]4C3)CC2)cc1 ZINC000858442042 1136967838 /nfs/dbraw/zinc/96/78/38/1136967838.db2.gz CKWCAFNBDOQTBR-OAGGEKHMSA-N 1 0 329.444 3.589 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@](O)(c2ccccc2)C1 ZINC000859586367 1137021424 /nfs/dbraw/zinc/02/14/24/1137021424.db2.gz NNUFMVNEJLHNMS-BEFAXECRSA-N 1 0 326.396 3.639 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)Cc1cc(F)ccc1[N+](=O)[O-] ZINC000859995732 1137040049 /nfs/dbraw/zinc/04/00/49/1137040049.db2.gz VZEHMIIAOWGKKZ-UHFFFAOYSA-N 1 0 345.418 3.818 20 5 EHBDRO Cc1cccnc1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001202504871 1137083781 /nfs/dbraw/zinc/08/37/81/1137083781.db2.gz KPMCREFKOINZNA-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1cccc([N+](=O)[O-])c1 ZINC000173454640 1137138507 /nfs/dbraw/zinc/13/85/07/1137138507.db2.gz CDUOFHJIJHTLHM-SECBINFHSA-N 1 0 345.346 3.963 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CC[C@@H](c3ccc(O)cc3)C2)c1 ZINC000862540693 1137149036 /nfs/dbraw/zinc/14/90/36/1137149036.db2.gz JWBRSHJWBYJPBM-CYBMUJFWSA-N 1 0 332.787 3.943 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000794707003 1137239250 /nfs/dbraw/zinc/23/92/50/1137239250.db2.gz SBKSBRWXHGQUMZ-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000120481289 1137275915 /nfs/dbraw/zinc/27/59/15/1137275915.db2.gz PDQDPJRXHWBGLF-PXAZEXFGSA-N 1 0 334.803 3.941 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc([N+](=O)[O-])cc1C(F)F)c1ccco1 ZINC000865406453 1137280465 /nfs/dbraw/zinc/28/04/65/1137280465.db2.gz UORBQJDPJISULD-ZDUSSCGKSA-N 1 0 325.315 3.840 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(C[NH+]3CCCC3)CC2)c(C(F)F)c1 ZINC000865446899 1137284623 /nfs/dbraw/zinc/28/46/23/1137284623.db2.gz DDKXGQDEEBNCKN-UHFFFAOYSA-N 1 0 339.386 3.845 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)cc1[N+](=O)[O-] ZINC000865831985 1137314969 /nfs/dbraw/zinc/31/49/69/1137314969.db2.gz FQYVHXLQALZZDO-VXGBXAGGSA-N 1 0 330.306 3.590 20 5 EHBDRO C[NH+]1CCC2(CCN(c3nc4ccc([N+](=O)[O-])cc4s3)CC2)CC1 ZINC000866055123 1137326959 /nfs/dbraw/zinc/32/69/59/1137326959.db2.gz OMZCLKPQMZOVRP-UHFFFAOYSA-N 1 0 346.456 3.517 20 5 EHBDRO CCc1nc(CC[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cs1 ZINC000866254121 1137339784 /nfs/dbraw/zinc/33/97/84/1137339784.db2.gz LYALPTDYUBAOJI-NSHDSACASA-N 1 0 337.420 3.516 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1COCc2ccccc21 ZINC000866377095 1137350451 /nfs/dbraw/zinc/35/04/51/1137350451.db2.gz SEAVQSCHZHYFFR-YVEFUNNKSA-N 1 0 330.359 3.526 20 5 EHBDRO C[C@@H]([NH2+]C1CCC(OC(C)(C)C)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866450584 1137355902 /nfs/dbraw/zinc/35/59/02/1137355902.db2.gz IWNWNLSKNSUALY-LRVUVFPRSA-N 1 0 335.448 3.954 20 5 EHBDRO Cc1ncc([C@@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000866454825 1137356171 /nfs/dbraw/zinc/35/61/71/1137356171.db2.gz QTLKNAHNBDJEMU-GFCCVEGCSA-N 1 0 346.456 3.679 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCC23CCOCC3)cc1[N+](=O)[O-] ZINC000866528782 1137361473 /nfs/dbraw/zinc/36/14/73/1137361473.db2.gz JYAVZEAZZRDVIP-GDBMZVCRSA-N 1 0 348.443 3.851 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2nonc2c1 ZINC000846783286 1137365405 /nfs/dbraw/zinc/36/54/05/1137365405.db2.gz NKSDQUGAOSGJNB-UHFFFAOYSA-N 1 0 326.356 3.542 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cccc2c1OCCO2 ZINC000772982504 1137408385 /nfs/dbraw/zinc/40/83/85/1137408385.db2.gz JHCZGDCSFNSLSU-ZDUSSCGKSA-N 1 0 328.368 3.525 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCc3ccccc3OC2)c(Cl)c1 ZINC000509444570 1137467823 /nfs/dbraw/zinc/46/78/23/1137467823.db2.gz RUIYQDBIJOXMDA-CQSZACIVSA-N 1 0 332.787 3.732 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@@]1(O)CCc2ccccc21 ZINC001171436730 1137483221 /nfs/dbraw/zinc/48/32/21/1137483221.db2.gz XJCLRUNKBJJLEO-SFHVURJKSA-N 1 0 346.814 3.514 20 5 EHBDRO O=C(NC[C@H]1C[C@H]2CC[C@@H](C1)[NH2+]2)c1cc2ccccc2c2cccnc12 ZINC000870976023 1137516857 /nfs/dbraw/zinc/51/68/57/1137516857.db2.gz MPNMWBKKIPUPLG-ACHSLPGTSA-N 1 0 345.446 3.648 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)NC1CC[NH+](C2CC2)CC1 ZINC000872018665 1137564825 /nfs/dbraw/zinc/56/48/25/1137564825.db2.gz OGQFIDCFFDMDCM-LBPRGKRZSA-N 1 0 335.473 3.594 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1CC[NH+](CC2CC2)CC1 ZINC000872025907 1137565958 /nfs/dbraw/zinc/56/59/58/1137565958.db2.gz VOPZPBHVDHVLST-CYBMUJFWSA-N 1 0 349.500 3.842 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1cn(C)nc1C ZINC000872030719 1137566401 /nfs/dbraw/zinc/56/64/01/1137566401.db2.gz BBSPXCQHEHIJOQ-GHMZBOCLSA-N 1 0 334.445 3.770 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCO[C@@H](C2CC2)C1 ZINC000872060797 1137568816 /nfs/dbraw/zinc/56/88/16/1137568816.db2.gz ABDVUMCBDLBNHG-DETPVDSQSA-N 1 0 336.457 3.925 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872060487 1137568897 /nfs/dbraw/zinc/56/88/97/1137568897.db2.gz QNSLLYCXFQRXLY-CHWSQXEVSA-N 1 0 336.363 3.625 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)NC1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000872076607 1137569986 /nfs/dbraw/zinc/56/99/86/1137569986.db2.gz OCKAUYOBVUEJJG-RLAWYHOSSA-N 1 0 335.473 3.593 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C[C@H]1C ZINC000872128316 1137572946 /nfs/dbraw/zinc/57/29/46/1137572946.db2.gz KNPALFQYKYCGHW-CBBWQLFWSA-N 1 0 334.416 3.613 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1N1CCC(C)([NH+]2CCCCC2)CC1 ZINC000872662260 1137582443 /nfs/dbraw/zinc/58/24/43/1137582443.db2.gz HGKUPIYNCQKMJP-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCO[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000873108509 1137590353 /nfs/dbraw/zinc/59/03/53/1137590353.db2.gz YUCJKMHMXSZBDS-MJGOQNOKSA-N 1 0 326.396 3.913 20 5 EHBDRO Cc1c(CNc2cccc3c2OCC[C@H]3[NH+](C)C)cccc1[N+](=O)[O-] ZINC000873116408 1137590489 /nfs/dbraw/zinc/59/04/89/1137590489.db2.gz DTOFAVSYIHVEBZ-GOSISDBHSA-N 1 0 341.411 3.901 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)cccc1[N+](=O)[O-] ZINC000873129938 1137590980 /nfs/dbraw/zinc/59/09/80/1137590980.db2.gz VMCPJZDWWDUBEC-GDBMZVCRSA-N 1 0 332.425 3.975 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H](O)c2ccc(F)c(F)c2)cc1[N+](=O)[O-] ZINC000124746062 1137608319 /nfs/dbraw/zinc/60/83/19/1137608319.db2.gz HJDYQJLKPRJTHQ-DIFFPNOSSA-N 1 0 336.338 3.566 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000124848985 1137611061 /nfs/dbraw/zinc/61/10/61/1137611061.db2.gz VGWVFTCNMXKBMF-MSOLQXFVSA-N 1 0 332.375 3.898 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)s1 ZINC000876964487 1137666450 /nfs/dbraw/zinc/66/64/50/1137666450.db2.gz GXTAGIYQSPEZGN-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO CC1(C)CC[C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000877021093 1137667874 /nfs/dbraw/zinc/66/78/74/1137667874.db2.gz OTUZFAMOJBOZIL-JRSKDTKFSA-N 1 0 340.427 3.897 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c2ccccc21 ZINC000877099156 1137670187 /nfs/dbraw/zinc/67/01/87/1137670187.db2.gz IVZUYRKIHGNKIM-FVKWTLKZSA-N 1 0 326.400 3.507 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1nc(Cl)cs1 ZINC000877164563 1137672085 /nfs/dbraw/zinc/67/20/85/1137672085.db2.gz ARAGPIQASMSAGL-UHFFFAOYSA-N 1 0 332.212 3.690 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C[C@@H]3CCC[C@H]3c3ccccc3)C2)c1 ZINC000877559305 1137681313 /nfs/dbraw/zinc/68/13/13/1137681313.db2.gz USAXMGAUYQXHCH-LOTPSLMQSA-N 1 0 340.427 3.668 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@@H]1CCSC1 ZINC000877661523 1137684765 /nfs/dbraw/zinc/68/47/65/1137684765.db2.gz CTWDSBWZBQYMPG-SNVBAGLBSA-N 1 0 334.363 3.846 20 5 EHBDRO CC[C@@H]1CCC[N@@H+]1Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878045251 1137700587 /nfs/dbraw/zinc/70/05/87/1137700587.db2.gz HFMUOZCEGXIAIC-LLVKDONJSA-N 1 0 336.779 3.673 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCCC23CCCCC3)o1 ZINC000878306459 1137710533 /nfs/dbraw/zinc/71/05/33/1137710533.db2.gz AXALMBYFYOYHKT-UHFFFAOYSA-N 1 0 342.399 3.944 20 5 EHBDRO COC(=O)c1cc(C[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])ccc1C ZINC000878372666 1137713371 /nfs/dbraw/zinc/71/33/71/1137713371.db2.gz FSARKKVCOVCAGD-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878699151 1137725610 /nfs/dbraw/zinc/72/56/10/1137725610.db2.gz NYOQHZFUAZQRBJ-PXAZEXFGSA-N 1 0 330.388 3.703 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000880093807 1137768029 /nfs/dbraw/zinc/76/80/29/1137768029.db2.gz LJTZBTSEYUDTTD-UHFFFAOYSA-N 1 0 330.388 3.799 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000130372582 1137836560 /nfs/dbraw/zinc/83/65/60/1137836560.db2.gz UPFVSCMSDZTCOX-QZTJIDSGSA-N 1 0 332.375 3.898 20 5 EHBDRO CC(=O)Oc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000131010191 1137844969 /nfs/dbraw/zinc/84/49/69/1137844969.db2.gz QDJDAOLZGKQCBL-UHFFFAOYSA-N 1 0 340.379 3.685 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]C1CCC2(COC2)CC1 ZINC000883379560 1137858215 /nfs/dbraw/zinc/85/82/15/1137858215.db2.gz FXJCJBFEXLYRAV-QAPCUYQASA-N 1 0 344.455 3.855 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]C1CCC2(COC2)CC1 ZINC000883379558 1137858247 /nfs/dbraw/zinc/85/82/47/1137858247.db2.gz FXJCJBFEXLYRAV-CRAIPNDOSA-N 1 0 344.455 3.855 20 5 EHBDRO O=S1(=O)CCC[C@@H]1C[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000131693614 1137859174 /nfs/dbraw/zinc/85/91/74/1137859174.db2.gz JNJSFHRPOCLXIY-QGZVFWFLSA-N 1 0 339.460 3.660 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000119294021 1137940223 /nfs/dbraw/zinc/94/02/23/1137940223.db2.gz BGBCEWOBSFEVDY-ZDUSSCGKSA-N 1 0 344.390 3.766 20 5 EHBDRO COc1ccc(C[NH+]2CCC(OC3CCCC3)CC2)cc1[N+](=O)[O-] ZINC000121134698 1137955390 /nfs/dbraw/zinc/95/53/90/1137955390.db2.gz INJXGRVFGPABMC-UHFFFAOYSA-N 1 0 334.416 3.527 20 5 EHBDRO COc1ccc(C[N@H+](Cc2cccnc2[N+](=O)[O-])[C@H](C)C2CC2)cc1 ZINC000885964927 1138029004 /nfs/dbraw/zinc/02/90/04/1138029004.db2.gz GVCHCHBAVVKSOQ-CQSZACIVSA-N 1 0 341.411 3.799 20 5 EHBDRO Cc1cccc([C@H]2CCC[N@@H+]2C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000136983647 1138044926 /nfs/dbraw/zinc/04/49/26/1138044926.db2.gz FIMICOGEEJEPRP-MOPGFXCFSA-N 1 0 326.396 3.774 20 5 EHBDRO Cc1c(NC(=O)c2cccc(C[NH+]3CCCC3)c2)cccc1[N+](=O)[O-] ZINC000060551548 1138067147 /nfs/dbraw/zinc/06/71/47/1138067147.db2.gz BQMGKOWZKSVPRU-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO C[C@@H](O)C[NH2+]Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000061011972 1138067302 /nfs/dbraw/zinc/06/73/02/1138067302.db2.gz NSGRTNJVWWUZJD-LLVKDONJSA-N 1 0 336.775 3.511 20 5 EHBDRO Cc1[nH]c(C2CCN(Cc3cc([N+](=O)[O-])ccc3Cl)CC2)[nH+]c1C ZINC000886665671 1138111436 /nfs/dbraw/zinc/11/14/36/1138111436.db2.gz DMFQNYBNYZLARV-UHFFFAOYSA-N 1 0 348.834 3.968 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])cc1 ZINC000079324890 1138155132 /nfs/dbraw/zinc/15/51/32/1138155132.db2.gz MBNRSNNKAQZDDM-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NC1CC[NH+](C(C)(C)C)CC1 ZINC000127773209 1138370410 /nfs/dbraw/zinc/37/04/10/1138370410.db2.gz FREWZANDDKPVDH-UHFFFAOYSA-N 1 0 348.447 3.596 20 5 EHBDRO O=C(CC[N@H+](Cc1ccccc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000336961494 1138435499 /nfs/dbraw/zinc/43/54/99/1138435499.db2.gz DAHYUTKMFWRNTK-UHFFFAOYSA-N 1 0 339.395 3.588 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC000337212630 1138496978 /nfs/dbraw/zinc/49/69/78/1138496978.db2.gz BEPTXQIQLQPFGB-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO CC[N@H+](CCNC(=O)c1cc2ccccc2c2cccnc12)C1CC1 ZINC000338447898 1138919513 /nfs/dbraw/zinc/91/95/13/1138919513.db2.gz LSISROOMSAFSDN-UHFFFAOYSA-N 1 0 333.435 3.602 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C2CCN(CC(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000178366923 1139689390 /nfs/dbraw/zinc/68/93/90/1139689390.db2.gz UNONYDLHTUPSCG-LBPRGKRZSA-N 1 0 345.365 3.581 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc([S@@](C)=O)cc1 ZINC000178686222 1139711667 /nfs/dbraw/zinc/71/16/67/1139711667.db2.gz ABTVUTXBCLRPPT-HEWAKGLMSA-N 1 0 332.425 3.744 20 5 EHBDRO COCC1=CC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000185847466 1140173890 /nfs/dbraw/zinc/17/38/90/1140173890.db2.gz SUJRPOABSQBBJE-UHFFFAOYSA-N 1 0 335.403 3.725 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCc1ccccc1C[N@H+](C)C(C)C ZINC000192499825 1140535741 /nfs/dbraw/zinc/53/57/41/1140535741.db2.gz QBXJDCLSDVUENW-UHFFFAOYSA-N 1 0 345.447 3.572 20 5 EHBDRO C[C@@H]1C[C@@H](Nc2cc(N)ccc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000193466571 1140577253 /nfs/dbraw/zinc/57/72/53/1140577253.db2.gz QSFUNHPZOXRQHC-PBHICJAKSA-N 1 0 340.427 3.642 20 5 EHBDRO CC[N@H+](Cc1cc(=O)oc2ccc3ccccc3c12)CC(C)(C)O ZINC000270684892 1141255772 /nfs/dbraw/zinc/25/57/72/1141255772.db2.gz APUNQUVTMCVNGC-UHFFFAOYSA-N 1 0 325.408 3.539 20 5 EHBDRO CCOc1ccc([C@H](C)NC2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000271025749 1141296629 /nfs/dbraw/zinc/29/66/29/1141296629.db2.gz BCQKHZXNUIZQRZ-AWEZNQCLSA-N 1 0 347.459 3.661 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000271159270 1141316246 /nfs/dbraw/zinc/31/62/46/1141316246.db2.gz RTKCOQDRUMMRLA-CYBMUJFWSA-N 1 0 330.384 3.592 20 5 EHBDRO CCOCCC1(C[NH2+][C@H](C)c2ccc(OCC)c([N+](=O)[O-])c2)CC1 ZINC000271551739 1141395809 /nfs/dbraw/zinc/39/58/09/1141395809.db2.gz VAENYYACNCBKAS-CQSZACIVSA-N 1 0 336.432 3.851 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCc2cn[nH]c21 ZINC000271558778 1141397294 /nfs/dbraw/zinc/39/72/94/1141397294.db2.gz WIBDAPHEKCVWEI-KGLIPLIRSA-N 1 0 346.456 3.856 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCOC2(CCSCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000271565769 1141398991 /nfs/dbraw/zinc/39/89/91/1141398991.db2.gz XQTXKYVTAMGYOC-DZGCQCFKSA-N 1 0 336.457 3.690 20 5 EHBDRO C[NH+](C)Cc1cnc(/C=C/c2ccc3c(cccc3[N+](=O)[O-])n2)s1 ZINC000349113697 1141641429 /nfs/dbraw/zinc/64/14/29/1141641429.db2.gz STKYXEVTJDWZQX-VQHVLOKHSA-N 1 0 340.408 3.832 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000055448935 214324165 /nfs/dbraw/zinc/32/41/65/214324165.db2.gz AETHVUGYKZYFNS-CYBMUJFWSA-N 1 0 343.383 3.815 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000068838342 215340461 /nfs/dbraw/zinc/34/04/61/215340461.db2.gz JQAJMTMZUYPWGM-MRXNPFEDSA-N 1 0 333.363 3.966 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)c1cc[nH]c(=O)c1 ZINC000339457977 1014520981 /nfs/dbraw/zinc/52/09/81/1014520981.db2.gz JTJGRLKUUKYZNW-LBPRGKRZSA-N 1 0 339.351 3.806 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](c1cccc(F)c1)N(C)C ZINC000449062938 1032106726 /nfs/dbraw/zinc/10/67/26/1032106726.db2.gz KZMMOTIOEWSUTI-KUHUBIRLSA-N 1 0 345.418 3.557 20 5 EHBDRO COc1ccc(C[N@@H+]2C[C@H](c3ccccc3)C[C@H]2C)cc1[N+](=O)[O-] ZINC000536672115 1032107148 /nfs/dbraw/zinc/10/71/48/1032107148.db2.gz ABRRICAXJBPNFX-RHSMWYFYSA-N 1 0 326.396 3.981 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1Oc1ccc(C[N@H+]2CC[C@H](O)C2)cc1 ZINC000157668299 1015183869 /nfs/dbraw/zinc/18/38/69/1015183869.db2.gz FNKYSVFIBUGZAY-AWEZNQCLSA-N 1 0 348.786 3.607 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](O)c1ccc(Cl)cc1 ZINC000120481121 1015268172 /nfs/dbraw/zinc/26/81/72/1015268172.db2.gz YPXZMERCPGVOHX-YVEFUNNKSA-N 1 0 334.803 3.941 20 5 EHBDRO CC[C@](C)(CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000134472196 1015549878 /nfs/dbraw/zinc/54/98/78/1015549878.db2.gz JSTMFGQEXRDGTH-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO CC(=O)N1CC[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000339762410 1015658402 /nfs/dbraw/zinc/65/84/02/1015658402.db2.gz HUNQPRZUTPSSSP-SCLBCKFNSA-N 1 0 339.395 3.743 20 5 EHBDRO CC1=C[C@@H](C)C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000430273574 1015691159 /nfs/dbraw/zinc/69/11/59/1015691159.db2.gz BBBOWWIAFRGCBM-CYBMUJFWSA-N 1 0 327.384 3.690 20 5 EHBDRO COCCC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)CCCCC1 ZINC000189147026 1016440557 /nfs/dbraw/zinc/44/05/57/1016440557.db2.gz CAJWCHPECPTXMD-UHFFFAOYSA-N 1 0 336.432 3.680 20 5 EHBDRO CC(C)C[NH+]1CCC(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)CC1 ZINC000189305718 1016502942 /nfs/dbraw/zinc/50/29/42/1016502942.db2.gz BPSSGHOEHBXTDB-UHFFFAOYSA-N 1 0 347.459 3.568 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000189475882 1016520511 /nfs/dbraw/zinc/52/05/11/1016520511.db2.gz WFCKXBZQHBOFTH-OAHLLOKOSA-N 1 0 347.459 3.568 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ccccn2)CC1 ZINC000348513266 1016618562 /nfs/dbraw/zinc/61/85/62/1016618562.db2.gz WLIKJDDUDMKRIV-CQSZACIVSA-N 1 0 327.384 3.594 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CS[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414497273 1016943156 /nfs/dbraw/zinc/94/31/56/1016943156.db2.gz FPIXFXBTZIONCE-RYUDHWBXSA-N 1 0 348.424 3.847 20 5 EHBDRO CC(C)[C@@H]1[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)CC12CCOCC2 ZINC000414537033 1016963752 /nfs/dbraw/zinc/96/37/52/1016963752.db2.gz KNQIXLGXFHHONB-INIZCTEOSA-N 1 0 338.835 3.885 20 5 EHBDRO CC(=O)Nc1cccc([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449071759 1032160494 /nfs/dbraw/zinc/16/04/94/1032160494.db2.gz OMYSDCWDVJKJLL-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCOCC34CCCC4)o2)cc1 ZINC000536708595 1032184228 /nfs/dbraw/zinc/18/42/28/1032184228.db2.gz IEBQKBKBXODGIH-UHFFFAOYSA-N 1 0 342.395 4.000 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCC(=O)N2 ZINC000538198640 1032214628 /nfs/dbraw/zinc/21/46/28/1032214628.db2.gz RNHZBLYSZYJBIB-STQMWFEESA-N 1 0 339.395 3.891 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCCO)c1ccccc1 ZINC000449162841 1032279543 /nfs/dbraw/zinc/27/95/43/1032279543.db2.gz UGKSJSHBTNVALU-MAUKXSAKSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCc1cc(F)c(F)c(F)c1 ZINC000449231331 1032349778 /nfs/dbraw/zinc/34/97/78/1032349778.db2.gz OLBZEQFZCQGESK-NSHDSACASA-N 1 0 338.329 3.775 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1ccccc1 ZINC000485201333 1032377100 /nfs/dbraw/zinc/37/71/00/1032377100.db2.gz GVLLDSHRXYYJKJ-INIZCTEOSA-N 1 0 341.411 3.973 20 5 EHBDRO COc1cc2c(cc1F)CC[C@H]2[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449316678 1032448775 /nfs/dbraw/zinc/44/87/75/1032448775.db2.gz ZWWHSAWWOKHUNZ-SJKOYZFVSA-N 1 0 344.386 3.951 20 5 EHBDRO Cc1csc(N2CCC([NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)CC2)n1 ZINC000449346608 1032462323 /nfs/dbraw/zinc/46/23/23/1032462323.db2.gz BPWYROICTHRTEU-ZDUSSCGKSA-N 1 0 346.456 3.679 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@H](c2ccc(F)cc2)C2CC2)cc1 ZINC000537014625 1032484347 /nfs/dbraw/zinc/48/43/47/1032484347.db2.gz VFNCYAWIBSPFGG-SFHVURJKSA-N 1 0 330.359 3.854 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)NCCCC1CCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000537074363 1032507833 /nfs/dbraw/zinc/50/78/33/1032507833.db2.gz FLBACMRQNGENOP-OAHLLOKOSA-N 1 0 347.459 3.722 20 5 EHBDRO Cc1cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc(N2CCCC2)n1 ZINC000289868480 1032516800 /nfs/dbraw/zinc/51/68/00/1032516800.db2.gz RHZMGUGVEBARHF-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2noc3ccccc32)cc1[N+](=O)[O-] ZINC000593970863 1032648939 /nfs/dbraw/zinc/64/89/39/1032648939.db2.gz PKOANVABXYRCCO-CYBMUJFWSA-N 1 0 325.368 3.938 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2noc3ccccc32)cc1[N+](=O)[O-] ZINC000593970867 1032650474 /nfs/dbraw/zinc/65/04/74/1032650474.db2.gz PKOANVABXYRCCO-ZDUSSCGKSA-N 1 0 325.368 3.938 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@H]1C ZINC000449494101 1032659978 /nfs/dbraw/zinc/65/99/78/1032659978.db2.gz GFXIFHWQHFFRBN-DYVFJYSZSA-N 1 0 330.384 3.712 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)c2ccccc2C)c1 ZINC000593031370 1032668895 /nfs/dbraw/zinc/66/88/95/1032668895.db2.gz FGUNYDOBDHYREP-UHFFFAOYSA-N 1 0 342.395 3.715 20 5 EHBDRO Cc1ccc(NC(=O)N[C@H](CCC[NH3+])c2ccccc2)cc1[N+](=O)[O-] ZINC000414666459 1017114407 /nfs/dbraw/zinc/11/44/07/1017114407.db2.gz WLMYBPQHQNLOMF-MRXNPFEDSA-N 1 0 342.399 3.505 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)Cc1cccs1 ZINC000472649754 1017202840 /nfs/dbraw/zinc/20/28/40/1017202840.db2.gz VEJONHNFBAZHSC-NUEKZKHPSA-N 1 0 348.472 3.805 20 5 EHBDRO CO[C@@H]1CC[N@H+](Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C[C@@H]1C ZINC000449509977 1032696636 /nfs/dbraw/zinc/69/66/36/1032696636.db2.gz WZTLOCVPCRFTSB-BLLLJJGKSA-N 1 0 347.440 3.575 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2c[nH]c3ncccc23)CC1 ZINC000118837630 1017627038 /nfs/dbraw/zinc/62/70/38/1017627038.db2.gz BNAZDKOAJDMBSY-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO COc1cc(NC[C@@H](c2ccsc2)[NH+](C)C)c([N+](=O)[O-])cc1F ZINC000343842140 1017674422 /nfs/dbraw/zinc/67/44/22/1017674422.db2.gz KCICLGTZMLNBAV-AWEZNQCLSA-N 1 0 339.392 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)nccc2N1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000593461361 1032717509 /nfs/dbraw/zinc/71/75/09/1032717509.db2.gz KQVCTBAYWRRUGT-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)c2cccc(C)c2C)c1[N+](=O)[O-] ZINC000892949547 1017918608 /nfs/dbraw/zinc/91/86/08/1017918608.db2.gz YIHLIPSEUTZOKI-ZDUSSCGKSA-N 1 0 330.384 3.777 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1N1CCC[C@@H](c2ncc3n2CCCC3)C1 ZINC000336928834 1017958601 /nfs/dbraw/zinc/95/86/01/1017958601.db2.gz NYNQEPGNVZYHIS-OAHLLOKOSA-N 1 0 340.427 3.820 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1COc2ccccc21)C1CC1 ZINC000290318004 1018137361 /nfs/dbraw/zinc/13/73/61/1018137361.db2.gz OCUSVULIGUWJPJ-SJLPKXTDSA-N 1 0 338.407 3.682 20 5 EHBDRO C[C@H]1CN(C)CC[C@H]1[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000290316598 1018146977 /nfs/dbraw/zinc/14/69/77/1018146977.db2.gz CQFSGVYEVSFNEH-WMLDXEAASA-N 1 0 343.427 3.627 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000592399267 1032755559 /nfs/dbraw/zinc/75/55/59/1032755559.db2.gz WUCIPHAGDBZHFZ-IDHHARJASA-N 1 0 341.411 3.869 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000616484803 1018430826 /nfs/dbraw/zinc/43/08/26/1018430826.db2.gz FVAUPWWGHNBIMJ-XTKXOIQPSA-N 1 0 340.427 3.533 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH+]1CCC2(CC2(F)F)CC1 ZINC000593072676 1032769864 /nfs/dbraw/zinc/76/98/64/1032769864.db2.gz KPOCBSHESXTGLK-UHFFFAOYSA-N 1 0 326.343 3.615 20 5 EHBDRO Cc1ccc(-c2csc([C@H]3C[N@@H+]4CCC[C@@H]4CO3)n2)cc1[N+](=O)[O-] ZINC000102662598 1018571618 /nfs/dbraw/zinc/57/16/18/1018571618.db2.gz KCCPFLCSZRECDA-CZUORRHYSA-N 1 0 345.424 3.562 20 5 EHBDRO Cc1cc(N2CCC[C@H](OC(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000593486566 1032786076 /nfs/dbraw/zinc/78/60/76/1032786076.db2.gz AOPCDLVGZDETQK-HNNXBMFYSA-N 1 0 329.400 3.845 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(c2ccc3cccnc3n2)CC1 ZINC000594019128 1032790506 /nfs/dbraw/zinc/79/05/06/1032790506.db2.gz HFTHVBFNPVEYIO-UHFFFAOYSA-N 1 0 348.406 3.918 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1NCc1ccccc1[N+](=O)[O-] ZINC000398190851 1018989348 /nfs/dbraw/zinc/98/93/48/1018989348.db2.gz MNHFIYNNJLNKRB-LPHOPBHVSA-N 1 0 339.439 3.595 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2cn3c(cccc3C)n2)cc1[N+](=O)[O-] ZINC000592403017 1032800238 /nfs/dbraw/zinc/80/02/38/1032800238.db2.gz KJYVIDYVHHPLDR-OAHLLOKOSA-N 1 0 338.411 3.753 20 5 EHBDRO CSCC[C@@H](C)[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093558564 1019044652 /nfs/dbraw/zinc/04/46/52/1019044652.db2.gz NYOJIZGKLVMDLU-CYBMUJFWSA-N 1 0 348.472 3.569 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2nc3ccccc3cc2[N+](=O)[O-])CC1 ZINC000473510386 1019099100 /nfs/dbraw/zinc/09/91/00/1019099100.db2.gz PYAPRRPVCFNNOJ-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000182339979 1019327844 /nfs/dbraw/zinc/32/78/44/1019327844.db2.gz SLYCGHQRPUNIKW-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO CC1([NH3+])CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CC1 ZINC000592431571 1032836376 /nfs/dbraw/zinc/83/63/76/1032836376.db2.gz KBZCDDHKAHPCPT-UHFFFAOYSA-N 1 0 349.818 3.821 20 5 EHBDRO C[C@@H]1C[C@H](N(C)Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000602476363 1032897922 /nfs/dbraw/zinc/89/79/22/1032897922.db2.gz OLGYSPIGJQYKQT-BXUZGUMPSA-N 1 0 345.365 3.528 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)[C@@H]2CCCC[C@H]2C)cccc1[N+](=O)[O-] ZINC000255959093 1020404533 /nfs/dbraw/zinc/40/45/33/1020404533.db2.gz SXGIJDZJSXCZNN-CZUORRHYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC(C)[NH2+]C1CCN(Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000602462446 1032901004 /nfs/dbraw/zinc/90/10/04/1032901004.db2.gz GUTOVQYLLLQVAC-UHFFFAOYSA-N 1 0 345.365 3.576 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCO[C@@H](c3cccs3)C2)cc1[N+](=O)[O-] ZINC000449620486 1032912715 /nfs/dbraw/zinc/91/27/15/1032912715.db2.gz FGOUKMDFUAXLJG-CZUORRHYSA-N 1 0 348.424 3.675 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@H]2CCCC[C@@H]2O)cccc1[N+](=O)[O-] ZINC000326000039 1020667919 /nfs/dbraw/zinc/66/79/19/1020667919.db2.gz FPJKKVDKPRFDTG-QRQLOZEOSA-N 1 0 332.444 3.809 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1CC1 ZINC000449627035 1032923021 /nfs/dbraw/zinc/92/30/21/1032923021.db2.gz FOKDNRWCYAKQKN-SGTLLEGYSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000360875586 1020846417 /nfs/dbraw/zinc/84/64/17/1020846417.db2.gz XDGKIXCRSZLXRC-PBHICJAKSA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)o1 ZINC000602510725 1032948013 /nfs/dbraw/zinc/94/80/13/1032948013.db2.gz MFWPKZNKKXKTIK-UHFFFAOYSA-N 1 0 345.218 3.653 20 5 EHBDRO C[C@@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393853550 1021078036 /nfs/dbraw/zinc/07/80/36/1021078036.db2.gz XBVIWQYUTFVSBC-NVXWUHKLSA-N 1 0 325.412 3.917 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1ccc([N+](=O)[O-])cc1 ZINC000426299877 1021214008 /nfs/dbraw/zinc/21/40/08/1021214008.db2.gz ZMKVTYDRORUUKR-HIFRSBDPSA-N 1 0 329.375 3.663 20 5 EHBDRO Cc1cnc(N2CCC(CC[N@H+]3CCCC[C@H]3C)CC2)c([N+](=O)[O-])c1 ZINC000477169458 1021223205 /nfs/dbraw/zinc/22/32/05/1021223205.db2.gz JRBHEIVLXXTWDH-MRXNPFEDSA-N 1 0 346.475 3.779 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633533 1032966239 /nfs/dbraw/zinc/96/62/39/1032966239.db2.gz ULVVFSATIJVLKE-SGTLLEGYSA-N 1 0 330.384 3.758 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000120889372 1021478107 /nfs/dbraw/zinc/47/81/07/1021478107.db2.gz UIYKGCGAQAASDV-CYBMUJFWSA-N 1 0 330.388 3.657 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2Cc3ccccc3N(C)C2)cccc1[N+](=O)[O-] ZINC000437080626 1021532286 /nfs/dbraw/zinc/53/22/86/1021532286.db2.gz UGFPQWMDSSMTDG-CVEARBPZSA-N 1 0 339.439 3.863 20 5 EHBDRO C[NH+](C)C1(CN[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000437113681 1021569158 /nfs/dbraw/zinc/56/91/58/1021569158.db2.gz KGOJNLPCTFNNBF-LJQANCHMSA-N 1 0 339.439 3.758 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1cccc([N+](=O)[O-])c1 ZINC000437103030 1021577367 /nfs/dbraw/zinc/57/73/67/1021577367.db2.gz IGIASPIITUVAHT-GJZGRUSLSA-N 1 0 325.412 3.554 20 5 EHBDRO CCOC1CC([N@H+](C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000516603619 1021581337 /nfs/dbraw/zinc/58/13/37/1021581337.db2.gz DPAIMNNLETXMMA-UHFFFAOYSA-N 1 0 330.384 3.854 20 5 EHBDRO CCCC[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)[C@@H](C)CC ZINC000172895307 1033001105 /nfs/dbraw/zinc/00/11/05/1033001105.db2.gz HILLBUJZHDGFTR-AWEZNQCLSA-N 1 0 331.420 3.711 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c(OC)c1 ZINC000090909899 1021686937 /nfs/dbraw/zinc/68/69/37/1021686937.db2.gz MHWIGBOIVREVCE-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CO[C@@H]1CCC[C@H]1C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602582218 1033001746 /nfs/dbraw/zinc/00/17/46/1033001746.db2.gz MFRCTUALILCRFT-SMDDNHRTSA-N 1 0 332.322 3.518 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)c2cc([N+](=O)[O-])ccc21 ZINC000519861143 1021734807 /nfs/dbraw/zinc/73/48/07/1021734807.db2.gz IOHLRIHRTFBUPX-ZSGPHXLJSA-N 1 0 330.428 3.864 20 5 EHBDRO CC[C@@]1(CO)CCC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000602625563 1033018117 /nfs/dbraw/zinc/01/81/17/1033018117.db2.gz STADXSWOUYYPLC-OAHLLOKOSA-N 1 0 346.349 3.598 20 5 EHBDRO CC1(C)CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])nc3)CC2)C1 ZINC000602627801 1033043396 /nfs/dbraw/zinc/04/33/96/1033043396.db2.gz UEGBORHSBBPXHK-OAHLLOKOSA-N 1 0 332.448 3.517 20 5 EHBDRO CC(C)OC(=O)C[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184454900 1022340887 /nfs/dbraw/zinc/34/08/87/1022340887.db2.gz JWGNADFEJGZPTM-LSDHHAIUSA-N 1 0 334.416 3.710 20 5 EHBDRO Cc1ccc(C2CC[NH+](Cc3ccc(C)c([N+](=O)[O-])c3)CC2)cn1 ZINC000341562948 1022345279 /nfs/dbraw/zinc/34/52/79/1022345279.db2.gz LDPCRIHDHKXCFX-UHFFFAOYSA-N 1 0 325.412 3.986 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CNCC[NH+]3CCCCCC3)o2)c1 ZINC000517538920 1022421913 /nfs/dbraw/zinc/42/19/13/1022421913.db2.gz SROIPPNRAYBWSO-UHFFFAOYSA-N 1 0 343.427 3.820 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])CC(F)F ZINC000602698639 1033077941 /nfs/dbraw/zinc/07/79/41/1033077941.db2.gz DSMIHYJMIDMTGR-QMMMGPOBSA-N 1 0 326.265 3.995 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cnn(C4CCC4)c3)C2)cc1 ZINC000894719610 1022791074 /nfs/dbraw/zinc/79/10/74/1022791074.db2.gz PEHRBYNKUVQWSP-KRWDZBQOSA-N 1 0 340.427 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3ccnn3C3CCC3)C2)cc1 ZINC000894719946 1022791092 /nfs/dbraw/zinc/79/10/92/1022791092.db2.gz QYVIVXNNYSPANS-MRXNPFEDSA-N 1 0 340.427 3.896 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCO[C@@H](c2ccncc2)C1 ZINC000894737636 1022816913 /nfs/dbraw/zinc/81/69/13/1022816913.db2.gz AYOCSIRDIZWTCN-NVXWUHKLSA-N 1 0 347.802 3.653 20 5 EHBDRO CCO[C@H]1CC[N@H+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000602685390 1033085190 /nfs/dbraw/zinc/08/51/90/1033085190.db2.gz NWZHCOYIIBFXBL-ABAIWWIYSA-N 1 0 346.349 3.861 20 5 EHBDRO COc1cc(C[NH2+]CC(C)C)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000098081499 1022882544 /nfs/dbraw/zinc/88/25/44/1022882544.db2.gz NJUDPLSNLWDLDQ-UHFFFAOYSA-N 1 0 344.411 3.928 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)C1CCN(c2ccccc2)CC1 ZINC000439010415 1023205716 /nfs/dbraw/zinc/20/57/16/1023205716.db2.gz ZTPRAZLYYYGWFE-UHFFFAOYSA-N 1 0 339.439 3.738 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+][C@H]1COc2c1cccc2Cl ZINC000610707621 1023280016 /nfs/dbraw/zinc/28/00/16/1023280016.db2.gz OKBMJADMTFFZCD-VOKGJARPSA-N 1 0 330.771 3.985 20 5 EHBDRO Cc1cc(Cc2noc([C@H](C)[N@H+]3[C@H](C)CC[C@@H]3C)n2)ccc1[N+](=O)[O-] ZINC000276957899 1023475933 /nfs/dbraw/zinc/47/59/33/1023475933.db2.gz RLZMSMCAIJCYDB-MJBXVCDLSA-N 1 0 344.415 3.811 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CO)CC2CCCC2)cc1[N+](=O)[O-] ZINC000510944348 1023525638 /nfs/dbraw/zinc/52/56/38/1023525638.db2.gz JLORAVFSXGDMRL-CJNGLKHVSA-N 1 0 336.432 3.585 20 5 EHBDRO COc1ccc(OCC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000610798234 1023656265 /nfs/dbraw/zinc/65/62/65/1023656265.db2.gz GPGFPNBGJXNVLR-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO O=C(C[NH2+][C@H](CC1CC1)c1ccccc1)Nc1ccccc1[N+](=O)[O-] ZINC000610831071 1023780635 /nfs/dbraw/zinc/78/06/35/1023780635.db2.gz LZACGELWXJJKGE-QGZVFWFLSA-N 1 0 339.395 3.664 20 5 EHBDRO COCC[C@H](c1ccccc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000535822705 1023787119 /nfs/dbraw/zinc/78/71/19/1023787119.db2.gz PSQAVTCVVWMLOY-LJQANCHMSA-N 1 0 326.396 3.731 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+]Cc3ccc(C(F)(F)F)cc3[N+](=O)[O-])C2)CO1 ZINC000897776528 1033162273 /nfs/dbraw/zinc/16/22/73/1033162273.db2.gz SBLKVCYWIXMNPM-ZZJLNTIPSA-N 1 0 344.333 3.661 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H](C)CC2)c([N+](=O)[O-])cc1OC(F)F ZINC000063308445 1033201325 /nfs/dbraw/zinc/20/13/25/1033201325.db2.gz XQXZAWKQNIDBOJ-NSHDSACASA-N 1 0 344.358 3.827 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]Cc3ccc4c(c3)CCCC4)nc2c1 ZINC000430080512 1024338552 /nfs/dbraw/zinc/33/85/52/1024338552.db2.gz VDSALCIQZMJSBE-UHFFFAOYSA-N 1 0 336.395 3.640 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NCCCCC[NH+]1CCCCC1 ZINC000474148169 1024414323 /nfs/dbraw/zinc/41/43/23/1024414323.db2.gz BCMIFVDONCASSZ-UHFFFAOYSA-N 1 0 335.448 3.809 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCOc1cc(C)cc(C)c1 ZINC000507958373 1024786986 /nfs/dbraw/zinc/78/69/86/1024786986.db2.gz ZUCDFUXBIKMQEV-UHFFFAOYSA-N 1 0 344.411 3.779 20 5 EHBDRO COc1cc(C[NH2+]CC[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1O ZINC000507942995 1024788949 /nfs/dbraw/zinc/78/89/49/1024788949.db2.gz WLTKSPGRPPBJBI-CYBMUJFWSA-N 1 0 330.384 3.592 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000310338873 1024849343 /nfs/dbraw/zinc/84/93/43/1024849343.db2.gz CGQRSWDKDLUIQU-QGZVFWFLSA-N 1 0 325.412 3.837 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000514980463 1024941300 /nfs/dbraw/zinc/94/13/00/1024941300.db2.gz OEHJBWOEESSDBK-AWEZNQCLSA-N 1 0 338.411 3.592 20 5 EHBDRO Cc1c2ccccc2oc1[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)C(C)C ZINC000539260077 1025004322 /nfs/dbraw/zinc/00/43/22/1025004322.db2.gz IGHNEUCZJKWLHM-QGZVFWFLSA-N 1 0 342.399 3.833 20 5 EHBDRO CC(C)c1nccn1CCNc1ncc([N+](=O)[O-])c2ccccc21 ZINC000895988995 1025046612 /nfs/dbraw/zinc/04/66/12/1025046612.db2.gz IEAORFYYNIMJQK-UHFFFAOYSA-N 1 0 325.372 3.575 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000346804357 1025125588 /nfs/dbraw/zinc/12/55/88/1025125588.db2.gz XOVYJEWDURJWPL-SFHVURJKSA-N 1 0 342.395 3.779 20 5 EHBDRO C[NH+](C)C[C@H]1CCCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892173559 1025183647 /nfs/dbraw/zinc/18/36/47/1025183647.db2.gz YRACYVSWORABQE-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCn2c(C)ncc2[N+](=O)[O-])C(C)C)cc1 ZINC000611573620 1025184720 /nfs/dbraw/zinc/18/47/20/1025184720.db2.gz KPSSLPHZQDPRMJ-SFHVURJKSA-N 1 0 330.432 3.649 20 5 EHBDRO CSc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000281557581 1025228954 /nfs/dbraw/zinc/22/89/54/1025228954.db2.gz XYZVMMJEPKWGLS-YVEFUNNKSA-N 1 0 332.425 3.701 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N(C)CC[C@H]1CCCC[N@@H+]1C ZINC000119819467 1025267558 /nfs/dbraw/zinc/26/75/58/1025267558.db2.gz MZLDCUQMVJTIIJ-OAHLLOKOSA-N 1 0 348.447 3.550 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)Cc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000346933794 1025325812 /nfs/dbraw/zinc/32/58/12/1025325812.db2.gz CHCUDDXEEFWGOF-ROUUACIJSA-N 1 0 348.830 3.893 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CCC(CO)CC1 ZINC000515557202 1025352373 /nfs/dbraw/zinc/35/23/73/1025352373.db2.gz UIOGPLBIZOTJMD-UHFFFAOYSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000135 1025381487 /nfs/dbraw/zinc/38/14/87/1025381487.db2.gz WDUWNJURNCTRCJ-XCLNPWKQSA-N 1 0 346.471 3.789 20 5 EHBDRO CC1(C)CCCC[C@@H]1[NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000119927085 1025434169 /nfs/dbraw/zinc/43/41/69/1025434169.db2.gz PAUMYXIDGBLDIK-AWEZNQCLSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@H](Cc3nccs3)C2)c(Cl)c1 ZINC000934332848 1025483938 /nfs/dbraw/zinc/48/39/38/1025483938.db2.gz MDKXFJSKDUIWGR-NSHDSACASA-N 1 0 337.832 3.769 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000347077329 1025497038 /nfs/dbraw/zinc/49/70/38/1025497038.db2.gz VKAZDDPBVQESRX-SUMWQHHRSA-N 1 0 329.400 3.557 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2Cc3[nH]c4ccccc4c3C2)c(Cl)c1 ZINC000442852937 1025550049 /nfs/dbraw/zinc/55/00/49/1025550049.db2.gz YRXFWRUYQIPMEV-LBPRGKRZSA-N 1 0 341.798 3.987 20 5 EHBDRO CCOc1ccccc1OCC[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451103623 1025567843 /nfs/dbraw/zinc/56/78/43/1025567843.db2.gz ILGGPUJOSAYUAM-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO C[NH+](C)C1(CNC(=O)c2cc3ccccc3c3cccnc23)CCCC1 ZINC000515772864 1025582418 /nfs/dbraw/zinc/58/24/18/1025582418.db2.gz GNOPUMMYJYROPQ-UHFFFAOYSA-N 1 0 347.462 3.992 20 5 EHBDRO Cn1cc(C[NH2+]CC2(C3CC3)CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000127505039 1026026423 /nfs/dbraw/zinc/02/64/23/1026026423.db2.gz UNFJKCVTMTUOIR-UHFFFAOYSA-N 1 0 340.427 3.665 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)C1 ZINC000338747786 1026178765 /nfs/dbraw/zinc/17/87/65/1026178765.db2.gz VAJZKJMYIIKJPS-OAHLLOKOSA-N 1 0 343.349 3.536 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1C ZINC000475150856 1026255911 /nfs/dbraw/zinc/25/59/11/1026255911.db2.gz KWNQTXFVBNBOMB-LJQANCHMSA-N 1 0 328.412 3.593 20 5 EHBDRO Cc1ccn(-c2ccccc2C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)n1 ZINC000127667985 1026279298 /nfs/dbraw/zinc/27/92/98/1026279298.db2.gz NQIPIHDFIPLOFR-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1ccccc1OC[C@@H](C)C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000478911444 1026365011 /nfs/dbraw/zinc/36/50/11/1026365011.db2.gz VPELEXMBERMGJM-GJZGRUSLSA-N 1 0 344.411 3.969 20 5 EHBDRO Cc1cc(N2CCC23CC[NH+](C)CC3)c([N+](=O)[O-])cc1C(F)(F)F ZINC000897133802 1026396635 /nfs/dbraw/zinc/39/66/35/1026396635.db2.gz QJKNMGYLZUTYNI-UHFFFAOYSA-N 1 0 343.349 3.597 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@@H](C[NH+]3CCCCCC3)C2)c1 ZINC000530940749 1026421135 /nfs/dbraw/zinc/42/11/35/1026421135.db2.gz QYERFQMHFCFSMU-INIZCTEOSA-N 1 0 347.459 3.696 20 5 EHBDRO CO[C@]1(C)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000475289815 1026446564 /nfs/dbraw/zinc/44/65/64/1026446564.db2.gz DRFHGDJKNPVPDK-GOSISDBHSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000475356532 1026510211 /nfs/dbraw/zinc/51/02/11/1026510211.db2.gz ZMYKMRKJASMWQK-CQSZACIVSA-N 1 0 331.416 3.675 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)c([N+](=O)[O-])c1 ZINC000347318100 1026580957 /nfs/dbraw/zinc/58/09/57/1026580957.db2.gz RKXZWMLXMKUJCN-CQSZACIVSA-N 1 0 341.411 3.730 20 5 EHBDRO COc1cccc(N2CCC[C@H](C[NH+]3CCCCCC3)C2)c1[N+](=O)[O-] ZINC000475429865 1026613974 /nfs/dbraw/zinc/61/39/74/1026613974.db2.gz UGSVHPXOGLNIHG-MRXNPFEDSA-N 1 0 347.459 3.696 20 5 EHBDRO CO[C@@H]1C[C@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000531240426 1026716515 /nfs/dbraw/zinc/71/65/15/1026716515.db2.gz RIFZLHGNHHFWFW-LSDHHAIUSA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@@]1(CO)CCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000237478358 1027034464 /nfs/dbraw/zinc/03/44/64/1027034464.db2.gz QHJPJQVJCUMEGX-MSOLQXFVSA-N 1 0 346.452 3.964 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1cccc(F)c1)N(C)C ZINC000531677956 1027201638 /nfs/dbraw/zinc/20/16/38/1027201638.db2.gz QMHBKMOOJRCTIN-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CC[C@@H]2CCC[C@@H]2C1 ZINC000531724497 1027271968 /nfs/dbraw/zinc/27/19/68/1027271968.db2.gz FIUAGSLUNASCLI-JYYAWHABSA-N 1 0 345.443 3.870 20 5 EHBDRO C[NH+](C)[C@@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)c1cccs1 ZINC000729629835 1027369723 /nfs/dbraw/zinc/36/97/23/1027369723.db2.gz GFDZWPMVINMMMT-LBPRGKRZSA-N 1 0 348.453 3.981 20 5 EHBDRO [NH3+]C1C[C@H]2CC[C@@H](C1)C2Nc1nc(-c2ccc([N+](=O)[O-])cc2)cs1 ZINC000420294881 1027436097 /nfs/dbraw/zinc/43/60/97/1027436097.db2.gz ZWGUAYPVPNEKJT-ZAQWFSBCSA-N 1 0 344.440 3.646 20 5 EHBDRO [NH3+]C1C[C@H]2CC[C@@H](C1)C2Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000420281786 1027440473 /nfs/dbraw/zinc/44/04/73/1027440473.db2.gz MRFZEFSXPKEVFJ-HZNSRWLBSA-N 1 0 329.322 3.541 20 5 EHBDRO COc1ccc(COCCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178653447 1027603306 /nfs/dbraw/zinc/60/33/06/1027603306.db2.gz ZSPZCQDLJCDRMM-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO Cc1ccc2[nH+]ccc(N3CCOc4ccc([N+](=O)[O-])cc4C3)c2c1 ZINC000582757980 1027607052 /nfs/dbraw/zinc/60/70/52/1027607052.db2.gz AVQATDLPAVYNHD-UHFFFAOYSA-N 1 0 335.363 3.850 20 5 EHBDRO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)C(=O)c1ccc([C@H](C)[NH3+])cc1 ZINC000423076838 1028167123 /nfs/dbraw/zinc/16/71/23/1028167123.db2.gz ZXNKAHQVEYGBPN-AWEZNQCLSA-N 1 0 341.411 3.665 20 5 EHBDRO COc1ccc(OCC[N@H+](C)Cc2ccc(F)c(C)c2)c([N+](=O)[O-])c1 ZINC000444739467 1028226611 /nfs/dbraw/zinc/22/66/11/1028226611.db2.gz RSMQBVRLWQWGHY-UHFFFAOYSA-N 1 0 348.374 3.562 20 5 EHBDRO C[C@@H](NC[C@H]1CCC[NH2+]1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423246326 1028307184 /nfs/dbraw/zinc/30/71/84/1028307184.db2.gz ZDHNCBILQWSZOZ-CHWSQXEVSA-N 1 0 331.441 3.726 20 5 EHBDRO CC[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000421377682 1028337959 /nfs/dbraw/zinc/33/79/59/1028337959.db2.gz HSVCSHJXXMBRQN-DZOHQFGASA-N 1 0 332.444 3.853 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc2c(c1)OCCCO2)c1cccc([N+](=O)[O-])c1 ZINC000161920849 1028360070 /nfs/dbraw/zinc/36/00/70/1028360070.db2.gz MVFDDLNXNFJVDM-KRWDZBQOSA-N 1 0 342.395 3.997 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@H](CCO)CC2)o1 ZINC000421391202 1028366296 /nfs/dbraw/zinc/36/62/96/1028366296.db2.gz AANQSGQXYLPFKY-HNNXBMFYSA-N 1 0 344.411 3.839 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(-n2cccn2)cc1 ZINC000178734094 1028474836 /nfs/dbraw/zinc/47/48/36/1028474836.db2.gz KXLFPEKOHXLQSV-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO C[C@H]([NH2+]CCCN1CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000324127480 1028521975 /nfs/dbraw/zinc/52/19/75/1028521975.db2.gz HSMSIXDDYBUJGC-HNNXBMFYSA-N 1 0 325.412 3.698 20 5 EHBDRO COc1cccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1OC(C)C ZINC000105448318 1028678747 /nfs/dbraw/zinc/67/87/47/1028678747.db2.gz LYGWGTDQUXDIGZ-UHFFFAOYSA-N 1 0 344.411 3.723 20 5 EHBDRO O=[N+]([O-])c1cccc(SCc2ccc(CN3CCOCC3)cc2)c1 ZINC000421833743 1028823295 /nfs/dbraw/zinc/82/32/95/1028823295.db2.gz BAPCKZQZEMYKNS-UHFFFAOYSA-N 1 0 344.436 3.719 20 5 EHBDRO CCCC[N@@H+]1CCCC[C@H]1CNc1ncc([N+](=O)[O-])cc1Cl ZINC000524236645 1029014953 /nfs/dbraw/zinc/01/49/53/1029014953.db2.gz YZWNNPKZDZPTHA-LBPRGKRZSA-N 1 0 326.828 3.710 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C)N(C)C1CC1 ZINC000504899159 1029027780 /nfs/dbraw/zinc/02/77/80/1029027780.db2.gz BLUJULSVVANRKO-ZIAGYGMSSA-N 1 0 337.489 3.538 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@](C)(O)CCC(C)C)cc1[N+](=O)[O-] ZINC000504900220 1029027840 /nfs/dbraw/zinc/02/78/40/1029027840.db2.gz UDQIPQIYWRMXJB-KDOFPFPSSA-N 1 0 338.448 3.831 20 5 EHBDRO C[C@H]1CCSCCN1Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000191819312 1029028535 /nfs/dbraw/zinc/02/85/35/1029028535.db2.gz KZUZSGRDVWVGFU-JTQLQIEISA-N 1 0 332.372 3.524 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](CC)C2CCOCC2)cc1[N+](=O)[O-] ZINC000504918772 1029043308 /nfs/dbraw/zinc/04/33/08/1029043308.db2.gz IPDWGOHTSZZCIF-CZUORRHYSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1cccc(CN[C@H](CO)c2c(Cl)cccc2Cl)c1 ZINC000475634738 1029093528 /nfs/dbraw/zinc/09/35/28/1029093528.db2.gz NSSLPEBNQHPWIO-CQSZACIVSA-N 1 0 341.194 3.725 20 5 EHBDRO CC[NH+](CC)C[C@H](C)Oc1cc(C)c(Br)cc1[N+](=O)[O-] ZINC001227999678 1029229843 /nfs/dbraw/zinc/22/98/43/1029229843.db2.gz GOGABVWAKLTWHD-NSHDSACASA-N 1 0 345.237 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](CC(C)C)C1CCCC1 ZINC000533254748 1029534073 /nfs/dbraw/zinc/53/40/73/1029534073.db2.gz BOGUALFFKPREFA-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+](C)C[C@@H](C)c1ccccc1 ZINC000533263476 1029563881 /nfs/dbraw/zinc/56/38/81/1029563881.db2.gz HVAQPCMSVJZZHV-HUUCEWRRSA-N 1 0 341.411 3.657 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1cn2cc(C)ccc2n1 ZINC000583295209 1029576749 /nfs/dbraw/zinc/57/67/49/1029576749.db2.gz TWTRUMSCXBLOAA-NVNXTCNLSA-N 1 0 336.395 3.744 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](c2ccccc2)C2CC2)c2c(c1)COCO2 ZINC000192501998 1029714431 /nfs/dbraw/zinc/71/44/31/1029714431.db2.gz MXTSZELMHJXYRT-GOSISDBHSA-N 1 0 340.379 3.702 20 5 EHBDRO Nc1ccc2c(c1)CCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000841059220 1029717206 /nfs/dbraw/zinc/71/72/06/1029717206.db2.gz NKXIQNYIEXCQFD-MRXNPFEDSA-N 1 0 331.803 3.998 20 5 EHBDRO CN(C)c1cccc([C@@H]2CCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)c1 ZINC000525271802 1029767483 /nfs/dbraw/zinc/76/74/83/1029767483.db2.gz RUVNFWYNTYLZFP-IBGZPJMESA-N 1 0 325.412 3.998 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2ccccc2-n2ccnc2)cc1[N+](=O)[O-] ZINC000152235065 1029802701 /nfs/dbraw/zinc/80/27/01/1029802701.db2.gz LVBXDOKODQBNNV-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc(F)cc1 ZINC000446854915 1029833883 /nfs/dbraw/zinc/83/38/83/1029833883.db2.gz DLTGUWHXOVFNBT-LLVKDONJSA-N 1 0 328.347 3.504 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CCC[C@H]2c2ccsc2)c([N+](=O)[O-])c1 ZINC000441190317 1029916832 /nfs/dbraw/zinc/91/68/32/1029916832.db2.gz RKPGYEMODUMNJM-HNNXBMFYSA-N 1 0 348.424 3.881 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H](c2ccnn2C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000453247609 1029976044 /nfs/dbraw/zinc/97/60/44/1029976044.db2.gz NZZISIABLYCWSY-IMJJTQAJSA-N 1 0 328.416 3.705 20 5 EHBDRO CC(C)(CO)CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453268787 1030004928 /nfs/dbraw/zinc/00/49/28/1030004928.db2.gz BHUMIOVHGVZULW-SFHVURJKSA-N 1 0 328.412 3.682 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H](CCCc3ccccc3)C2)n1 ZINC000441221586 1030011410 /nfs/dbraw/zinc/01/14/10/1030011410.db2.gz AIBBNIOIHWYCCE-SFHVURJKSA-N 1 0 342.443 3.526 20 5 EHBDRO CC[C@H](C)[NH2+][C@H](CNc1ncc([N+](=O)[O-])cc1Cl)c1ccco1 ZINC000343272884 1030037181 /nfs/dbraw/zinc/03/71/81/1030037181.db2.gz VXJHWFBFDQRZTJ-GXFFZTMASA-N 1 0 338.795 3.778 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CC(C)(C)O ZINC000453320120 1030100648 /nfs/dbraw/zinc/10/06/48/1030100648.db2.gz NEAHLVLENUZGGF-QWHCGFSZSA-N 1 0 326.462 3.605 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453340607 1030124771 /nfs/dbraw/zinc/12/47/71/1030124771.db2.gz HTONLBSJZHMMRX-NEWSRXKRSA-N 1 0 341.411 3.951 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000531955764 1030133098 /nfs/dbraw/zinc/13/30/98/1030133098.db2.gz GMZHJWRJDIUZQN-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO COc1ccccc1C1(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000482132816 1030219099 /nfs/dbraw/zinc/21/90/99/1030219099.db2.gz IIKHYZUXQTUNQN-AWEZNQCLSA-N 1 0 326.396 3.986 20 5 EHBDRO Cc1ccc(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)nc1 ZINC000453413625 1030226088 /nfs/dbraw/zinc/22/60/88/1030226088.db2.gz HZYLLNNWEHNHEQ-SFHVURJKSA-N 1 0 325.412 3.853 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000531993684 1030242030 /nfs/dbraw/zinc/24/20/30/1030242030.db2.gz VTISKKHYAUCHDG-WBVHZDCISA-N 1 0 328.412 3.812 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2ccc(Cl)s2)n1 ZINC000447544704 1030278184 /nfs/dbraw/zinc/27/81/84/1030278184.db2.gz OXMQKYGMPLEIJT-NEPJUHHUSA-N 1 0 340.836 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCOc1ccc(Cl)cn1)CCC2 ZINC000447589348 1030326912 /nfs/dbraw/zinc/32/69/12/1030326912.db2.gz XQWLVFSGUOTBEL-MRXNPFEDSA-N 1 0 347.802 3.689 20 5 EHBDRO C[C@H](C(=O)Nc1cc([N+](=O)[O-])ccc1Cl)[N@H+](C)CC1CCCC1 ZINC000064021343 1030397072 /nfs/dbraw/zinc/39/70/72/1030397072.db2.gz LYOBQJFISICCKL-LLVKDONJSA-N 1 0 339.823 3.697 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCOc1ccccc1)C1CC1 ZINC000532201994 1030475177 /nfs/dbraw/zinc/47/51/77/1030475177.db2.gz APVHJAJGDXRTSG-IBGZPJMESA-N 1 0 340.423 3.975 20 5 EHBDRO CCNC(=O)c1cccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c1 ZINC000160181562 1030583298 /nfs/dbraw/zinc/58/32/98/1030583298.db2.gz MDCOSCLJTGQOAN-CQSZACIVSA-N 1 0 341.411 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCOCC3CC3)s2)cc1 ZINC000237988933 1030710423 /nfs/dbraw/zinc/71/04/23/1030710423.db2.gz JGPDLURPZDSOEA-UHFFFAOYSA-N 1 0 332.425 3.840 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1ccc2c(c1)OCCCO2 ZINC000161886969 1030773238 /nfs/dbraw/zinc/77/32/38/1030773238.db2.gz BGVRUYFXPRPRJQ-CQSZACIVSA-N 1 0 342.395 3.915 20 5 EHBDRO C[C@H](O)[C@](C)(C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000249247044 1030888470 /nfs/dbraw/zinc/88/84/70/1030888470.db2.gz BCXDKHVPXRUYSK-FTRWYGJKSA-N 1 0 342.439 3.875 20 5 EHBDRO CC(C)C[NH+]1CCC(N[C@@H]2CCCc3ccc([N+](=O)[O-])cc32)CC1 ZINC000192646153 1030924831 /nfs/dbraw/zinc/92/48/31/1030924831.db2.gz PAEWCZCBCGLIEM-LJQANCHMSA-N 1 0 331.460 3.682 20 5 EHBDRO C[N@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000343480812 1031060608 /nfs/dbraw/zinc/06/06/08/1031060608.db2.gz ZWIBCAIETKYGFA-AWEZNQCLSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000161142299 1031358726 /nfs/dbraw/zinc/35/87/26/1031358726.db2.gz KDGYYZQTPVQUGZ-GFCCVEGCSA-N 1 0 345.365 3.782 20 5 EHBDRO C[C@@H]([NH3+])C1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000178848725 1031736776 /nfs/dbraw/zinc/73/67/76/1031736776.db2.gz DIAHQDCFVBKRTM-CQSZACIVSA-N 1 0 333.435 3.587 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](c2nc(C)no2)C1 ZINC000347365245 1031902105 /nfs/dbraw/zinc/90/21/05/1031902105.db2.gz SZUBITLGGQRBPE-RCBBPTIPSA-N 1 0 342.399 3.569 20 5 EHBDRO COc1ccccc1OC[C@@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000537941103 1032026596 /nfs/dbraw/zinc/02/65/96/1032026596.db2.gz IETJNCYFKUTPCW-GJZGRUSLSA-N 1 0 344.411 3.969 20 5 EHBDRO COc1ccc2c(c1)OC[C@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000537946251 1032053849 /nfs/dbraw/zinc/05/38/49/1032053849.db2.gz WCIFIMXJFHWAOJ-CZUORRHYSA-N 1 0 342.395 3.566 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CC[C@@H](Cc2nccs2)C1 ZINC000898067667 1033310690 /nfs/dbraw/zinc/31/06/90/1033310690.db2.gz HGHGPALUTAZFCT-AWEZNQCLSA-N 1 0 331.441 3.733 20 5 EHBDRO CCOc1cncc(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000598674994 1033391446 /nfs/dbraw/zinc/39/14/46/1033391446.db2.gz BRYXSGJKSNZOLS-KRWDZBQOSA-N 1 0 341.411 3.768 20 5 EHBDRO COC(=O)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000594500741 1033401790 /nfs/dbraw/zinc/40/17/90/1033401790.db2.gz AUYBRKPVCFDWQP-SFHVURJKSA-N 1 0 340.379 3.549 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2cc3cnccc3o2)cc1 ZINC000593601521 1033413656 /nfs/dbraw/zinc/41/36/56/1033413656.db2.gz KJJQHLFYXVPICX-UHFFFAOYSA-N 1 0 325.368 3.849 20 5 EHBDRO C[C@H](Cc1ccccn1)[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000594515330 1033423084 /nfs/dbraw/zinc/42/30/84/1033423084.db2.gz NVDXIIWDWBHGQH-GJYPPUQNSA-N 1 0 339.439 3.922 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)n1cc(C[N@H+](C)C2CCCCC2)nn1 ZINC000603185809 1033424835 /nfs/dbraw/zinc/42/48/35/1033424835.db2.gz NPYSGVIYFRXQIF-AWEZNQCLSA-N 1 0 343.431 3.560 20 5 EHBDRO CC(C)[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000460350126 1033529282 /nfs/dbraw/zinc/52/92/82/1033529282.db2.gz UWKZVLKNBSREBN-HOTGVXAUSA-N 1 0 344.415 3.949 20 5 EHBDRO CCC1([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCOCC1 ZINC000537508597 1033537378 /nfs/dbraw/zinc/53/73/78/1033537378.db2.gz XIXOTUPDUCSMOP-UHFFFAOYSA-N 1 0 347.440 3.767 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]Cc2cc(C(F)(F)F)nn2C)cc1[N+](=O)[O-] ZINC000594935838 1033585437 /nfs/dbraw/zinc/58/54/37/1033585437.db2.gz HTCUTNKSXKSWOO-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC1(O)CCC(F)(F)CC1 ZINC000595000450 1033626762 /nfs/dbraw/zinc/62/67/62/1033626762.db2.gz MIWOGVYDOSMBLX-LCYFTJDESA-N 1 0 340.370 3.528 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)c1cccc(OC)c1 ZINC000595066249 1033644085 /nfs/dbraw/zinc/64/40/85/1033644085.db2.gz HBGCPSHQOOIUKG-KSSFIOAISA-N 1 0 344.411 3.950 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@H]1CCN1C1CCCCC1 ZINC000598992028 1033645278 /nfs/dbraw/zinc/64/52/78/1033645278.db2.gz JQPCZTQHQCRJDA-XOWYPZSQSA-N 1 0 329.444 3.605 20 5 EHBDRO CCO[C@H]1C[C@H]([NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000595071432 1033645990 /nfs/dbraw/zinc/64/59/90/1033645990.db2.gz ZBLQSUIHUACVBM-BHIYHBOVSA-N 1 0 326.396 3.841 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H]1CCCC12CCOCC2 ZINC000595037852 1033658589 /nfs/dbraw/zinc/65/85/89/1033658589.db2.gz DMSDNZPJJIAVOL-SUMWQHHRSA-N 1 0 334.416 3.603 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C1CC1)[C@@H]1CCCCO1 ZINC000595044488 1033662572 /nfs/dbraw/zinc/66/25/72/1033662572.db2.gz ALYJPADQFRQXRL-ULFGMLNVSA-N 1 0 334.416 3.602 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CC12CCSCC2 ZINC000595046447 1033663636 /nfs/dbraw/zinc/66/36/36/1033663636.db2.gz ZNDPIRPPDUHMIX-STQMWFEESA-N 1 0 336.457 3.787 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2noc3ccccc32)cccc1[N+](=O)[O-] ZINC000595050636 1033667130 /nfs/dbraw/zinc/66/71/30/1033667130.db2.gz SUEZOCDBGNQPFW-CYBMUJFWSA-N 1 0 325.368 3.938 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H](C)c2ccccn2)cc1[N+](=O)[O-] ZINC000595049774 1033667925 /nfs/dbraw/zinc/66/79/25/1033667925.db2.gz OOKIDOZVLLJRFO-KBPBESRZSA-N 1 0 329.400 3.843 20 5 EHBDRO COC1CC(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])C1 ZINC000595051527 1033668048 /nfs/dbraw/zinc/66/80/48/1033668048.db2.gz VTHXCDHEGYXAJY-QZOMQWOVSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C[C@@H]1CCN1C1CCCCC1 ZINC000599064279 1033703889 /nfs/dbraw/zinc/70/38/89/1033703889.db2.gz LXEGXCNRDGFZFE-YJBOKZPZSA-N 1 0 329.444 3.579 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1CCN1C1CCCC1)C1CC1 ZINC000599073227 1033714913 /nfs/dbraw/zinc/71/49/13/1033714913.db2.gz FZISCXQZCBIZTK-MOPGFXCFSA-N 1 0 343.471 3.522 20 5 EHBDRO CC[C@H]1C[N@H+](Cc2onc(C)c2[N+](=O)[O-])CC[C@H]1c1ccccc1 ZINC000595330988 1033729319 /nfs/dbraw/zinc/72/93/19/1033729319.db2.gz GXUWIPXFDQODRF-GOEBONIOSA-N 1 0 329.400 3.907 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+](CCc1ccccc1)[C@@H]1CCOC1 ZINC000595340931 1033731575 /nfs/dbraw/zinc/73/15/75/1033731575.db2.gz ZFYGJECLAFRVSL-GOSISDBHSA-N 1 0 344.386 3.568 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H]2CC[N@@H+]2C2CCCCC2)c([N+](=O)[O-])c1 ZINC000599126248 1033744933 /nfs/dbraw/zinc/74/49/33/1033744933.db2.gz FERUDIXYDRCYLP-INIZCTEOSA-N 1 0 331.416 3.616 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@H]1O ZINC000595467665 1033822170 /nfs/dbraw/zinc/82/21/70/1033822170.db2.gz SPTZADJTEBLXAR-LZLYRXPVSA-N 1 0 336.407 3.640 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(c3ccco3)CC2)ccc1[N+](=O)[O-] ZINC000595616178 1033927819 /nfs/dbraw/zinc/92/78/19/1033927819.db2.gz PWOBZRPAVRFRNN-UHFFFAOYSA-N 1 0 330.384 3.966 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+](Cc2cccc(F)c2)C2CC2)c1 ZINC000603859173 1033982742 /nfs/dbraw/zinc/98/27/42/1033982742.db2.gz JCGKWRKYHIIEFE-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@H]([C@@H]4CCCCO4)C3)nc2c1 ZINC000595788870 1033998966 /nfs/dbraw/zinc/99/89/66/1033998966.db2.gz KLCBQPZGWDYROW-BBRMVZONSA-N 1 0 345.399 3.517 20 5 EHBDRO C[N@@H+](Cc1nc2cc([N+](=O)[O-])ccc2o1)C[C@@H]1CCc2ccccc21 ZINC000595881793 1034017723 /nfs/dbraw/zinc/01/77/23/1034017723.db2.gz WSSMANCLKGFVCX-AWEZNQCLSA-N 1 0 337.379 3.898 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])CC1 ZINC000603942746 1034058241 /nfs/dbraw/zinc/05/82/41/1034058241.db2.gz UTWIFRPBNQLNEP-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])c3cccnc32)CC1 ZINC000603942733 1034058684 /nfs/dbraw/zinc/05/86/84/1034058684.db2.gz QZMFXDPCBLUIBP-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000599688047 1034114916 /nfs/dbraw/zinc/11/49/16/1034114916.db2.gz BNGUZGQGSJRJAW-PYLYLYNFSA-N 1 0 342.399 3.823 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000179371728 1034162475 /nfs/dbraw/zinc/16/24/75/1034162475.db2.gz IKVWHXWNEZJVGS-NEPJUHHUSA-N 1 0 347.440 3.951 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c(C)s1 ZINC000179371757 1034163734 /nfs/dbraw/zinc/16/37/34/1034163734.db2.gz IKVWHXWNEZJVGS-NWDGAFQWSA-N 1 0 347.440 3.951 20 5 EHBDRO COc1cc(NC[C@@H]2CC[N@@H+](C(C)(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596308839 1034165980 /nfs/dbraw/zinc/16/59/80/1034165980.db2.gz WMXKRKQTIDMZNB-NSHDSACASA-N 1 0 341.839 3.789 20 5 EHBDRO COc1ccc(C[C@@H](C)C[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000537620060 1034196503 /nfs/dbraw/zinc/19/65/03/1034196503.db2.gz OTKPILRHYDIZJA-OAHLLOKOSA-N 1 0 328.412 3.914 20 5 EHBDRO CO[C@H]1CC[N@H+](Cc2ccc(N(C)c3ccccc3)c([N+](=O)[O-])c2)C1 ZINC000537623513 1034243396 /nfs/dbraw/zinc/24/33/96/1034243396.db2.gz HIBAJQPRQOVEEL-KRWDZBQOSA-N 1 0 341.411 3.583 20 5 EHBDRO CC(C)[C@H]([NH3+])CCN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000596655693 1034330731 /nfs/dbraw/zinc/33/07/31/1034330731.db2.gz XFFNHLNLTDIJGW-MOPGFXCFSA-N 1 0 327.428 3.647 20 5 EHBDRO C[N@@H+]1CCN(c2ccc3ncccc3c2[N+](=O)[O-])[C@@H](c2ccccc2)C1 ZINC000534270985 1034333425 /nfs/dbraw/zinc/33/34/25/1034333425.db2.gz KHFSMFYMFUGRCN-LJQANCHMSA-N 1 0 348.406 3.636 20 5 EHBDRO C[C@@H](N[C@@H]1C[NH2+]CC[C@@H]1c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000596650376 1034346775 /nfs/dbraw/zinc/34/67/75/1034346775.db2.gz PPJQLWYMQIALTI-UPRAQXHNSA-N 1 0 343.402 3.530 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2COc3ccccc3C2)cc1[N+](=O)[O-] ZINC000604532603 1034416383 /nfs/dbraw/zinc/41/63/83/1034416383.db2.gz AVTABHBGZFQFOJ-MRXNPFEDSA-N 1 0 326.396 3.812 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@H]1CCCSCC1 ZINC000692479934 1034593829 /nfs/dbraw/zinc/59/38/29/1034593829.db2.gz WXMYGMIBJQTURG-LBPRGKRZSA-N 1 0 345.262 3.733 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@@H]1CCCSCC1 ZINC000692479932 1034594062 /nfs/dbraw/zinc/59/40/62/1034594062.db2.gz WXMYGMIBJQTURG-GFCCVEGCSA-N 1 0 345.262 3.733 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1CNc2ccccc2C1)C1CC1 ZINC000593319687 1034657941 /nfs/dbraw/zinc/65/79/41/1034657941.db2.gz OLJIRYDTIMSCIM-PKOBYXMFSA-N 1 0 337.423 3.542 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411282934 1034851399 /nfs/dbraw/zinc/85/13/99/1034851399.db2.gz JYDPLLREBZSANA-CQSZACIVSA-N 1 0 349.431 3.587 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C2CCOCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612407822 1034889812 /nfs/dbraw/zinc/88/98/12/1034889812.db2.gz TZWHRLHKQSHFCP-GOSISDBHSA-N 1 0 330.384 3.608 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2c(F)cccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000167458762 1034902326 /nfs/dbraw/zinc/90/23/26/1034902326.db2.gz YBJDYWWERUDXLV-OCCSQVGLSA-N 1 0 347.365 3.803 20 5 EHBDRO CC(C)N(Cc1ccc([N+](=O)[O-])cc1)Cn1ccc(C(F)(F)F)n1 ZINC000065941950 1034980241 /nfs/dbraw/zinc/98/02/41/1034980241.db2.gz QEVMVQPBVCMGSF-UHFFFAOYSA-N 1 0 342.321 3.678 20 5 EHBDRO CN(c1ccccc1)C1CC[NH+](CCc2ccc([N+](=O)[O-])cc2)CC1 ZINC000065956283 1035009569 /nfs/dbraw/zinc/00/95/69/1035009569.db2.gz TWXDJFXWOGFUPU-UHFFFAOYSA-N 1 0 339.439 3.738 20 5 EHBDRO CC(C)([NH2+]C[C@@H]1CCOc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000613042874 1035370052 /nfs/dbraw/zinc/37/00/52/1035370052.db2.gz ZSTFKLWSAYPJFY-AWEZNQCLSA-N 1 0 326.396 3.986 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000414102276 1035508702 /nfs/dbraw/zinc/50/87/02/1035508702.db2.gz XGTXPPDAUZMEML-UONOGXRCSA-N 1 0 329.400 3.589 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000492223242 1035511585 /nfs/dbraw/zinc/51/15/85/1035511585.db2.gz KJPKBMVZVVPMOW-RBUKOAKNSA-N 1 0 328.412 3.825 20 5 EHBDRO C[NH+](C)C1CCC(N[C@@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000581948252 1035655719 /nfs/dbraw/zinc/65/57/19/1035655719.db2.gz DJRYUHDMZXDRFI-PIMMBPRGSA-N 1 0 345.365 3.661 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1Cc2ccccc2O1)C1CC1 ZINC000540766981 1035660278 /nfs/dbraw/zinc/66/02/78/1035660278.db2.gz LVYCGEZHKXEZOP-MSOLQXFVSA-N 1 0 338.407 3.509 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@H](Nc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000492510718 1035921419 /nfs/dbraw/zinc/92/14/19/1035921419.db2.gz HYUZUTOLYGEGJX-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO C[C@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[NH+]1CCC2(CCCC2)CC1 ZINC000582633116 1036069319 /nfs/dbraw/zinc/06/93/19/1036069319.db2.gz LNXKPRWRNIGHPK-CQSZACIVSA-N 1 0 331.416 3.578 20 5 EHBDRO CO[C@H]1c2ccccc2C[C@H]1[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000414225462 1036164701 /nfs/dbraw/zinc/16/47/01/1036164701.db2.gz TZAOVMKYENGPHC-XVSDVWIESA-N 1 0 326.396 3.866 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000541571973 1036463075 /nfs/dbraw/zinc/46/30/75/1036463075.db2.gz YBDWZESRWQKGEH-GOEBONIOSA-N 1 0 332.400 3.795 20 5 EHBDRO CC(C)[C@@H](O)CC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050286 1036580055 /nfs/dbraw/zinc/58/00/55/1036580055.db2.gz BKIQFWBDZJERCU-OALUTQOASA-N 1 0 328.412 3.681 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@]1(C)CC[N@H+](Cc2ccccc2)C1 ZINC000310892210 1036694302 /nfs/dbraw/zinc/69/43/02/1036694302.db2.gz KXYIFINVRKEYLD-IBGZPJMESA-N 1 0 340.427 3.622 20 5 EHBDRO COc1ccc(COCC[NH2+]C(C)(C)c2ccccc2[N+](=O)[O-])cc1 ZINC000590020173 1036706990 /nfs/dbraw/zinc/70/69/90/1036706990.db2.gz FOYVASZWPSVVFB-UHFFFAOYSA-N 1 0 344.411 3.645 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000180394588 1036773198 /nfs/dbraw/zinc/77/31/98/1036773198.db2.gz NVLXTTURXQLASK-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)c1cccnc1 ZINC000414341120 1036785000 /nfs/dbraw/zinc/78/50/00/1036785000.db2.gz VEFWKVPKECLYJO-OAHLLOKOSA-N 1 0 327.428 3.878 20 5 EHBDRO C[C@@H]([NH2+]CCn1cccn1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000180435225 1036824633 /nfs/dbraw/zinc/82/46/33/1036824633.db2.gz MBBMKNPYZNISAW-CYBMUJFWSA-N 1 0 342.424 3.871 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCN(C2CCCCC2)C1=O)c1cccc([N+](=O)[O-])c1 ZINC000443079946 1036911877 /nfs/dbraw/zinc/91/18/77/1036911877.db2.gz POGBIIRXJQUZNM-RDTXWAMCSA-N 1 0 345.443 3.569 20 5 EHBDRO CC[C@H](C)[C@@H](O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180531562 1036922784 /nfs/dbraw/zinc/92/27/84/1036922784.db2.gz OSXQVIVIVROWSG-JVPBZIDWSA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CCCc4ccccc4C3)nc2c1 ZINC000590652459 1036992443 /nfs/dbraw/zinc/99/24/43/1036992443.db2.gz BDTUKVRNXWLADA-HNNXBMFYSA-N 1 0 336.395 3.508 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2nc(-c3ccc([N+](=O)[O-])cc3)cs2)C1 ZINC000590687367 1037006890 /nfs/dbraw/zinc/00/68/90/1037006890.db2.gz HASMQINBZOAREA-CQSZACIVSA-N 1 0 346.456 3.685 20 5 EHBDRO COc1ccccc1CC[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761512792 1037086377 /nfs/dbraw/zinc/08/63/77/1037086377.db2.gz XECGQDBPGNRQBR-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO C[C@H](CNCc1ccc([N+](=O)[O-])c(Cl)c1)[N@@H+]1CCCC[C@@H]1C ZINC000761520404 1037097533 /nfs/dbraw/zinc/09/75/33/1037097533.db2.gz FAYVCUCMLRBQLX-QWHCGFSZSA-N 1 0 325.840 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H]2[C@@H]3c4ccccc4C[C@H]23)cc1Cl ZINC000761528211 1037104867 /nfs/dbraw/zinc/10/48/67/1037104867.db2.gz OSWWPFWOTWCLQM-IIDMSEBBSA-N 1 0 328.799 3.924 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]cc(CC[NH2+]Cc3cccc4cccnc43)c2c1 ZINC000573040686 1037167007 /nfs/dbraw/zinc/16/70/07/1037167007.db2.gz LMXHQUVLXJMSQP-UHFFFAOYSA-N 1 0 346.390 3.957 20 5 EHBDRO C[C@H]1OCC[C@@]1(C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000542315262 1037281277 /nfs/dbraw/zinc/28/12/77/1037281277.db2.gz CWVVFDHHRVQJTG-SJKOYZFVSA-N 1 0 332.425 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](c1ccc(F)cc1)N(C)C ZINC000532449024 1037302153 /nfs/dbraw/zinc/30/21/53/1037302153.db2.gz RKAVVSDRKJIKFX-AUUYWEPGSA-N 1 0 345.418 3.996 20 5 EHBDRO C[C@H]([NH2+]CCCOCCc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000532447858 1037309994 /nfs/dbraw/zinc/30/99/94/1037309994.db2.gz FSVFLTOLDCOGGA-INIZCTEOSA-N 1 0 328.412 3.895 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CCC[C@H]3COCC[C@H]32)o1 ZINC000539891719 1037315712 /nfs/dbraw/zinc/31/57/12/1037315712.db2.gz ZJAGFPLPTUJVIX-WMLDXEAASA-N 1 0 342.395 3.856 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@H]1Cc1ccccc1 ZINC000462751803 1037364690 /nfs/dbraw/zinc/36/46/90/1037364690.db2.gz CFKAMZYKGYEIPL-QAPCUYQASA-N 1 0 326.396 3.714 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)Nc2ccc([N+](=O)[O-])cc2C)c1 ZINC000452098088 1037366694 /nfs/dbraw/zinc/36/66/94/1037366694.db2.gz ZABIJKJGIGGSKA-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO CC(C)CC[C@H]1CCC[C@H]1[NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000472612224 1037387054 /nfs/dbraw/zinc/38/70/54/1037387054.db2.gz QTZWBQQEVYRCHA-HUUCEWRRSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](CO)Cc1ccc(F)cc1 ZINC000532470079 1037405647 /nfs/dbraw/zinc/40/56/47/1037405647.db2.gz VGVSRXJLZACGDT-GDBMZVCRSA-N 1 0 346.402 3.544 20 5 EHBDRO C[C@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@@H+]1C1CC1 ZINC000177185160 1037410523 /nfs/dbraw/zinc/41/05/23/1037410523.db2.gz CRTWYUFDTRZXTO-GOEBONIOSA-N 1 0 345.446 3.743 20 5 EHBDRO CCOc1cc(N2CCC[C@H]([NH+]3[C@H](C)CC[C@H]3C)C2)ccc1[N+](=O)[O-] ZINC000539992812 1037431114 /nfs/dbraw/zinc/43/11/14/1037431114.db2.gz FZIHWPDOENKNNF-INMHGKMJSA-N 1 0 347.459 3.835 20 5 EHBDRO CC[N@@H+]1CCC[C@H]1CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000491423959 1037451158 /nfs/dbraw/zinc/45/11/58/1037451158.db2.gz QGJNIIPLHOMHMM-VQTJNVASSA-N 1 0 339.439 3.758 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCN(C)Cc1ccccc1 ZINC000532477032 1037501645 /nfs/dbraw/zinc/50/16/45/1037501645.db2.gz HJLSPGUVETYEHD-MRXNPFEDSA-N 1 0 327.428 3.686 20 5 EHBDRO CC(C)[NH2+]CCCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000591577296 1037515812 /nfs/dbraw/zinc/51/58/12/1037515812.db2.gz MULQTVPQRGEWFU-LJQANCHMSA-N 1 0 327.428 3.662 20 5 EHBDRO C[C@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789392 1037536749 /nfs/dbraw/zinc/53/67/49/1037536749.db2.gz MCQOUCOXQPPUKP-GLJUWKHASA-N 1 0 344.411 3.836 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000462907930 1037538714 /nfs/dbraw/zinc/53/87/14/1037538714.db2.gz WHJINFVLHTUERJ-GOSISDBHSA-N 1 0 330.384 3.760 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000591733829 1037572389 /nfs/dbraw/zinc/57/23/89/1037572389.db2.gz RAXZQIDMIBNLBW-INIZCTEOSA-N 1 0 341.411 3.534 20 5 EHBDRO Cc1cc(-c2noc([C@H](CC(C)C)n3ccnc3)n2)cc([N+](=O)[O-])c1 ZINC000924092254 1037604294 /nfs/dbraw/zinc/60/42/94/1037604294.db2.gz AKODBMDQNGPMGT-HNNXBMFYSA-N 1 0 341.371 3.785 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCO[C@@H]1C1CC1 ZINC000540151693 1037622647 /nfs/dbraw/zinc/62/26/47/1037622647.db2.gz STQMMJBKVPULMZ-CKEIUWERSA-N 1 0 336.457 3.623 20 5 EHBDRO CCOc1cc(CN[C@H](c2ncc(C)s2)C2CC2)ccc1[N+](=O)[O-] ZINC000491667716 1037627369 /nfs/dbraw/zinc/62/73/69/1037627369.db2.gz LRYZGDJTHCYKGE-INIZCTEOSA-N 1 0 347.440 3.999 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCC[C@@H]3CCCCO3)CC2)cc1 ZINC000760907728 1037704258 /nfs/dbraw/zinc/70/42/58/1037704258.db2.gz RZZGXESQFCWSII-IBGZPJMESA-N 1 0 347.459 3.503 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000157659102 1037796229 /nfs/dbraw/zinc/79/62/29/1037796229.db2.gz CCTQZLLSPLHGJU-QZTJIDSGSA-N 1 0 332.375 3.898 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000540328650 1037825089 /nfs/dbraw/zinc/82/50/89/1037825089.db2.gz OWBCTZQYDFUUMM-BBRMVZONSA-N 1 0 347.440 3.623 20 5 EHBDRO CCOc1cc(C[NH2+]C[C@H](C)c2ccccc2[N+](=O)[O-])ccc1O ZINC000897464865 1037873803 /nfs/dbraw/zinc/87/38/03/1037873803.db2.gz PMSNCGLXTZPIMC-ZDUSSCGKSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2ccccc2)C2(CO)CC=CC2)c1 ZINC000592175282 1037915937 /nfs/dbraw/zinc/91/59/37/1037915937.db2.gz JSJQRTIGKRVTGE-IBGZPJMESA-N 1 0 338.407 3.754 20 5 EHBDRO COc1cc(C[NH+]2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000058452157 1037919459 /nfs/dbraw/zinc/91/94/59/1037919459.db2.gz DRRSURSTSGYQBE-GHMZBOCLSA-N 1 0 344.358 3.683 20 5 EHBDRO CC[C@H](C)C[C@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000592375085 1037924296 /nfs/dbraw/zinc/92/42/96/1037924296.db2.gz QAYJXFDGLQVHIT-GXTWGEPZSA-N 1 0 349.456 3.605 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1csc(C)c1 ZINC000592187684 1037926157 /nfs/dbraw/zinc/92/61/57/1037926157.db2.gz KQZUASCXRBVBCD-AWEZNQCLSA-N 1 0 347.440 3.953 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-])c1csc(C)c1 ZINC000592187688 1037927222 /nfs/dbraw/zinc/92/72/22/1037927222.db2.gz KQZUASCXRBVBCD-CQSZACIVSA-N 1 0 347.440 3.953 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCS[C@H]3C)o2)c([N+](=O)[O-])c1 ZINC000592379940 1037951187 /nfs/dbraw/zinc/95/11/87/1037951187.db2.gz BFIWMJJAQVIIJE-NHYWBVRUSA-N 1 0 348.424 3.847 20 5 EHBDRO CC(C)C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000592387665 1037953413 /nfs/dbraw/zinc/95/34/13/1037953413.db2.gz CSNQFPZGLHRHPG-SFHVURJKSA-N 1 0 329.400 3.746 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@H]2Cc2ccccc2Cl)c1[N+](=O)[O-] ZINC000595296304 1037955611 /nfs/dbraw/zinc/95/56/11/1037955611.db2.gz ZRPKGWABZNXCHB-ZDUSSCGKSA-N 1 0 335.791 3.752 20 5 EHBDRO COc1ccc(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000897469704 1038135762 /nfs/dbraw/zinc/13/57/62/1038135762.db2.gz PBPXWTVPLZMLDS-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CC[C@@H]1CCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000104673458 1038451322 /nfs/dbraw/zinc/45/13/22/1038451322.db2.gz GLUFCWJTGIKWFU-CQSZACIVSA-N 1 0 329.400 3.914 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)Cc1ccc2c(c1)OCCO2 ZINC000538703346 1038476987 /nfs/dbraw/zinc/47/69/87/1038476987.db2.gz CHGRVUMKJLFKTJ-AWEZNQCLSA-N 1 0 342.395 3.867 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000549424132 1038522007 /nfs/dbraw/zinc/52/20/07/1038522007.db2.gz AGOXOXJZAQVCDL-UHFFFAOYSA-N 1 0 348.443 3.847 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](CC(C)(C)C)c1ccc(F)cc1 ZINC000341460940 1038587747 /nfs/dbraw/zinc/58/77/47/1038587747.db2.gz QPMCTTJVFQDLQG-AWEZNQCLSA-N 1 0 334.395 3.735 20 5 EHBDRO Cc1ccc([C@@H](C)NC(=O)[C@@H](C(C)C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000488052303 1038811119 /nfs/dbraw/zinc/81/11/19/1038811119.db2.gz CAAVDNCDDZIRIV-CRAIPNDOSA-N 1 0 347.459 3.591 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN(CC[NH+](C)C)Cc1ccco1 ZINC000569969329 1038830226 /nfs/dbraw/zinc/83/02/26/1038830226.db2.gz ZAZQNSCHUDKDFK-FOWTUZBSSA-N 1 0 343.427 3.655 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852336 1039156760 /nfs/dbraw/zinc/15/67/60/1039156760.db2.gz IIBVOHNXKMBGOF-ZIAGYGMSSA-N 1 0 327.384 3.581 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@](C)(CO)c2ccccc2)cc1[N+](=O)[O-] ZINC000236658565 1039233993 /nfs/dbraw/zinc/23/39/93/1039233993.db2.gz GAOHIJDTTSCGJD-IBGZPJMESA-N 1 0 328.412 3.716 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001168370451 1039392086 /nfs/dbraw/zinc/39/20/86/1039392086.db2.gz OXJJZVBJMVWVCX-OAHLLOKOSA-N 1 0 345.374 3.803 20 5 EHBDRO CC(C)(C[NH2+]Cc1csc([N+](=O)[O-])c1)Oc1cc(F)cc(F)c1 ZINC000512511525 1039553682 /nfs/dbraw/zinc/55/36/82/1039553682.db2.gz IODJGFUXMVDBOE-UHFFFAOYSA-N 1 0 342.367 3.882 20 5 EHBDRO C[N@H+](CCNc1ccc2ncccc2c1[N+](=O)[O-])C1CCCCC1 ZINC000480483740 1039587573 /nfs/dbraw/zinc/58/75/73/1039587573.db2.gz NJYBOOMTRWVWFR-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CS[C@@H]1CCC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C1 ZINC000129406090 1039768047 /nfs/dbraw/zinc/76/80/47/1039768047.db2.gz IECRKCPWFORBFN-CRAIPNDOSA-N 1 0 349.500 3.827 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CC[C@H]([NH+]2CCCC2)[C@@H]1C ZINC000554874912 1039873767 /nfs/dbraw/zinc/87/37/67/1039873767.db2.gz OIXQBOQELHDBFT-YQFFJRNJSA-N 1 0 329.444 3.557 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H](Cc2ccccc2)CN(C)C)cccc1[N+](=O)[O-] ZINC000480884733 1040131415 /nfs/dbraw/zinc/13/14/15/1040131415.db2.gz UUZLWSGVTWUBHR-AEFFLSMTSA-N 1 0 341.455 3.727 20 5 EHBDRO CC(=O)c1cc(NC[C@@H]2CCCC[N@H+]2CC(C)C)ccc1[N+](=O)[O-] ZINC000553506518 1040132713 /nfs/dbraw/zinc/13/27/13/1040132713.db2.gz CQGUTUMOCDJUQP-INIZCTEOSA-N 1 0 333.432 3.720 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)CC1CCC1 ZINC000479555396 1040374857 /nfs/dbraw/zinc/37/48/57/1040374857.db2.gz OOWBPPURTXKPNW-CABCVRRESA-N 1 0 338.473 3.606 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N1CCc2ccccc2C1)c1ccc([N+](=O)[O-])cc1 ZINC000481130209 1040387060 /nfs/dbraw/zinc/38/70/60/1040387060.db2.gz ZZIIZQGBWGAPDX-HZPDHXFCSA-N 1 0 339.439 3.692 20 5 EHBDRO CSc1ccc(C(=O)Nc2cccc(C[NH+](C)C)c2)cc1[N+](=O)[O-] ZINC000192839952 1040437899 /nfs/dbraw/zinc/43/78/99/1040437899.db2.gz FKEHTDVDYDROLA-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H]1CCC(C)C ZINC000486805190 1040474015 /nfs/dbraw/zinc/47/40/15/1040474015.db2.gz YWIPFGDGGREUQI-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(CN(CCO)[C@@H]2CCCc3ccccc32)c(F)c1 ZINC000490376008 1040530924 /nfs/dbraw/zinc/53/09/24/1040530924.db2.gz VVPSSOWETBSLDK-LJQANCHMSA-N 1 0 344.386 3.606 20 5 EHBDRO C[N@@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C[C@@H]1CCCC[C@H]1O ZINC000555420388 1040557211 /nfs/dbraw/zinc/55/72/11/1040557211.db2.gz GXVWRWVKWOIUED-XHDPSFHLSA-N 1 0 346.349 3.597 20 5 EHBDRO CC[C@@H]([NH2+][C@@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848835 1040573291 /nfs/dbraw/zinc/57/32/91/1040573291.db2.gz JRULVDWBAONMII-YVEFUNNKSA-N 1 0 342.399 3.887 20 5 EHBDRO C[C@H]([C@@H]1Cc2ccccc2O1)N(C)Cc1ccc([N+](=O)[O-])cc1F ZINC000490593286 1040620825 /nfs/dbraw/zinc/62/08/25/1040620825.db2.gz VJJPCHYUCBINMU-XIKOKIGWSA-N 1 0 330.359 3.558 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](CO)c2ccc(F)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433286164 1041220927 /nfs/dbraw/zinc/22/09/27/1041220927.db2.gz UFRXWXZZOMGPSC-QZTJIDSGSA-N 1 0 344.386 3.780 20 5 EHBDRO C[C@H](C[N@H+](C)Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000066854519 1041241830 /nfs/dbraw/zinc/24/18/30/1041241830.db2.gz QCVNWMDOXGJSKO-CQSZACIVSA-N 1 0 342.395 3.697 20 5 EHBDRO O=[N+]([O-])c1cccnc1NCc1ccc(C[NH+]2CCCCC2)cc1 ZINC000015117566 1041249027 /nfs/dbraw/zinc/24/90/27/1041249027.db2.gz YZOYEYZJUBKYES-UHFFFAOYSA-N 1 0 326.400 3.588 20 5 EHBDRO CC[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)[C@@H]1CC1(C)C ZINC000419313681 1041249533 /nfs/dbraw/zinc/24/95/33/1041249533.db2.gz GNHFZXJFHWBANZ-KBPBESRZSA-N 1 0 330.388 3.559 20 5 EHBDRO C[NH+](C)Cc1ccccc1NC(=O)c1ccc([N+](=O)[O-])cc1Cl ZINC000024643617 1041572007 /nfs/dbraw/zinc/57/20/07/1041572007.db2.gz MXTYREGKCQHMKB-UHFFFAOYSA-N 1 0 333.775 3.562 20 5 EHBDRO CC[NH+](CC)[C@@H](C(=O)Nc1ccc(C)c([N+](=O)[O-])c1)c1ccccc1 ZINC000111034301 1041704170 /nfs/dbraw/zinc/70/41/70/1041704170.db2.gz ARWMWLMUTWFEGU-GOSISDBHSA-N 1 0 341.411 3.925 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2ccco2)N2CCCC2)cc1[N+](=O)[O-] ZINC000120315906 1042390194 /nfs/dbraw/zinc/39/01/94/1042390194.db2.gz HXSFQSJUXLYBPP-YJBOKZPZSA-N 1 0 343.427 3.984 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[C@H](C)[NH+]1CCCCC1 ZINC000120359869 1042652196 /nfs/dbraw/zinc/65/21/96/1042652196.db2.gz OFFZRTWSXOHCNJ-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO CC[S@@](=O)[C@@H]1CCC[C@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000162910650 1042714032 /nfs/dbraw/zinc/71/40/32/1042714032.db2.gz LLNSEAKZWSTOLP-JMUMZBBYSA-N 1 0 338.473 3.634 20 5 EHBDRO O=[N+]([O-])c1cccc(Cl)c1NC1CCN(c2ccccn2)CC1 ZINC000432337516 1042970790 /nfs/dbraw/zinc/97/07/90/1042970790.db2.gz RMCPGPJRSRCBAM-UHFFFAOYSA-N 1 0 332.791 3.724 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)C(C)(C)c1ccccc1 ZINC000585754533 1043024805 /nfs/dbraw/zinc/02/48/05/1043024805.db2.gz QJWBLISGUBEADL-UHFFFAOYSA-N 1 0 341.411 3.709 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000278991276 1043150941 /nfs/dbraw/zinc/15/09/41/1043150941.db2.gz DVGVTYNJLSPQTK-QZTJIDSGSA-N 1 0 326.396 3.640 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cc1O ZINC000279113733 1043372227 /nfs/dbraw/zinc/37/22/27/1043372227.db2.gz PKEATXGIDIEHAQ-MRXNPFEDSA-N 1 0 342.395 3.821 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cnn1C ZINC000279209477 1043570717 /nfs/dbraw/zinc/57/07/17/1043570717.db2.gz YAJHMCQRQPFBNY-APPDUMDISA-N 1 0 328.416 3.710 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2cnn(C[N@@H+]3CC[C@H](c4ccccc4)C3)c2)cc1 ZINC000728899653 1043716102 /nfs/dbraw/zinc/71/61/02/1043716102.db2.gz KJHDMFZDWITBAS-SFHVURJKSA-N 1 0 348.406 3.905 20 5 EHBDRO Cc1ccc([C@@H]2OCCC[C@@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000072756344 1126874991 /nfs/dbraw/zinc/87/49/91/1126874991.db2.gz BQZRLDMKRMGCIG-OALUTQOASA-N 1 0 326.396 3.913 20 5 EHBDRO O=c1cc(C[N@@H+]2CCC3(C2)CCOCC3)c2c(ccc3ccccc32)o1 ZINC000072898870 1126917032 /nfs/dbraw/zinc/91/70/32/1126917032.db2.gz BUFVMITTWJKEPB-UHFFFAOYSA-N 1 0 349.430 3.949 20 5 EHBDRO Cc1cc(N(C)Cc2nccn2C(F)F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000272881301 1127077637 /nfs/dbraw/zinc/07/76/37/1127077637.db2.gz VMIAYJDXWOOCII-UHFFFAOYSA-N 1 0 347.325 3.679 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c(C)c1OC ZINC000552061531 1127550336 /nfs/dbraw/zinc/55/03/36/1127550336.db2.gz PDJKDTNTWAANBT-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCc2cccc([N+](=O)[O-])c2)c(C)c1OC ZINC000552061530 1127551680 /nfs/dbraw/zinc/55/16/80/1127551680.db2.gz PDJKDTNTWAANBT-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])cc1Cl)N1CCc2ccccc2C1 ZINC000301283645 1127729644 /nfs/dbraw/zinc/72/96/44/1127729644.db2.gz PLLCCRPPRQEKQR-GFCCVEGCSA-N 1 0 346.818 3.502 20 5 EHBDRO C[C@H]1C[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC[N@@H+]1C ZINC000301398460 1127740804 /nfs/dbraw/zinc/74/08/04/1127740804.db2.gz ARWFIRQVVHLYJM-CMPLNLGQSA-N 1 0 331.338 3.533 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@@H]1C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC001168553466 1127751312 /nfs/dbraw/zinc/75/13/12/1127751312.db2.gz RLBZXSKKQMDBOO-FVQBIDKESA-N 1 0 334.416 3.533 20 5 EHBDRO CC(C)C[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccs1 ZINC000347616707 1128144556 /nfs/dbraw/zinc/14/45/56/1128144556.db2.gz SDJJYWUGAVCPQO-AWEZNQCLSA-N 1 0 347.440 3.632 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc(O)cc2)cc1[N+](=O)[O-] ZINC000153592692 1128486685 /nfs/dbraw/zinc/48/66/85/1128486685.db2.gz NYXOQKVRNBKTMV-ZIAGYGMSSA-N 1 0 344.411 3.981 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC[C@@H](c1cccs1)[NH+]1CCCC1 ZINC000301553668 1128497039 /nfs/dbraw/zinc/49/70/39/1128497039.db2.gz WBHHQCRTJIBFBZ-AWEZNQCLSA-N 1 0 332.429 3.609 20 5 EHBDRO CC(C)[C@H](Cc1ccc(F)cc1)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000765848597 1128559620 /nfs/dbraw/zinc/55/96/20/1128559620.db2.gz ICAUTYRTXMLRHE-RBUKOAKNSA-N 1 0 346.402 3.624 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCC1CCC(OC)CC1 ZINC000542691464 1128540888 /nfs/dbraw/zinc/54/08/88/1128540888.db2.gz UEPGFCMWRQCALT-UHFFFAOYSA-N 1 0 336.432 3.678 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(C(=O)NC)cc1)c1cccc([N+](=O)[O-])c1 ZINC000327011371 1128583820 /nfs/dbraw/zinc/58/38/20/1128583820.db2.gz MOGNSGDGCMHPNB-SFHVURJKSA-N 1 0 341.411 3.585 20 5 EHBDRO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[N@H+](C)C1CC1 ZINC000057707640 1128661756 /nfs/dbraw/zinc/66/17/56/1128661756.db2.gz FAIMQMJLLYBQMJ-AWEZNQCLSA-N 1 0 333.435 3.601 20 5 EHBDRO Cc1cc(C(=O)NC(C)(C)CC[NH+]2CCCCCC2)cc([N+](=O)[O-])c1 ZINC001128130908 1128687168 /nfs/dbraw/zinc/68/71/68/1128687168.db2.gz DAKBVQANIFOJOQ-UHFFFAOYSA-N 1 0 347.459 3.678 20 5 EHBDRO COC(=O)c1oc([C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)cc1C ZINC000554847836 1128717040 /nfs/dbraw/zinc/71/70/40/1128717040.db2.gz GDQKFPSWKAVNOK-CYBMUJFWSA-N 1 0 346.383 3.518 20 5 EHBDRO CC[NH+](CC)CC1CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC000542933084 1128866299 /nfs/dbraw/zinc/86/62/99/1128866299.db2.gz IRYBXCZDJFDYHU-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000301673405 1128898258 /nfs/dbraw/zinc/89/82/58/1128898258.db2.gz RJWAONUPVYSHLT-YOEHRIQHSA-N 1 0 340.427 3.763 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2cccc([N+](=O)[O-])c2)C1 ZINC000252212274 1120819370 /nfs/dbraw/zinc/81/93/70/1120819370.db2.gz WRRBBFCFKMLGID-AEFFLSMTSA-N 1 0 331.460 3.681 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)C(C)(C)C(=O)N2 ZINC000089513253 1121277423 /nfs/dbraw/zinc/27/74/23/1121277423.db2.gz KTLBDBCFRUGLAA-LBPRGKRZSA-N 1 0 339.395 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](C3CCCCC3)CC2)c2ncccc12 ZINC000301719422 1128983417 /nfs/dbraw/zinc/98/34/17/1128983417.db2.gz PHXDBVPMDJAOQI-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H](NCc1ccccc1[N+](=O)[O-])[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000272380207 1121597821 /nfs/dbraw/zinc/59/78/21/1121597821.db2.gz BRNLJXUGSOIIOA-QFBILLFUSA-N 1 0 339.439 3.595 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc(C(F)(F)F)cc3[N+](=O)[O-])CC[C@H]21 ZINC000301735107 1129014440 /nfs/dbraw/zinc/01/44/40/1129014440.db2.gz ZPKKDYFANIYQHD-WCQYABFASA-N 1 0 343.349 3.534 20 5 EHBDRO CC(=O)c1ccc(NCCC[N@H+]2C[C@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000301111355 1121964839 /nfs/dbraw/zinc/96/48/39/1121964839.db2.gz RMMYBHUUNGWJCV-OKILXGFUSA-N 1 0 333.432 3.577 20 5 EHBDRO CC1CC[NH+](C[C@H]2CCCN(c3ccc(F)cc3[N+](=O)[O-])C2)CC1 ZINC000301121518 1122013424 /nfs/dbraw/zinc/01/34/24/1122013424.db2.gz QWWVJYMTRQROHG-OAHLLOKOSA-N 1 0 335.423 3.682 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C[C@@H]1CCCC[C@@H]1O ZINC000497144533 1122351332 /nfs/dbraw/zinc/35/13/32/1122351332.db2.gz KMWNSQBAZLRDGV-YJBOKZPZSA-N 1 0 344.411 3.838 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(NC2CC[NH+](Cc3ccccc3)CC2)c(F)c1 ZINC000301784284 1129074292 /nfs/dbraw/zinc/07/42/92/1129074292.db2.gz KXDTXJPNCVFJBE-UHFFFAOYSA-N 1 0 347.365 3.950 20 5 EHBDRO COCc1cc([C@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000194619863 1122789452 /nfs/dbraw/zinc/78/94/52/1122789452.db2.gz UWVUSCQZYQSPQU-ZDUSSCGKSA-N 1 0 330.384 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccc(Br)s2)cc1 ZINC000037500175 1122956512 /nfs/dbraw/zinc/95/65/12/1122956512.db2.gz NQGPUIYNEZNPPO-UHFFFAOYSA-N 1 0 327.203 3.709 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1c(F)cncc1F ZINC000556916373 1123201143 /nfs/dbraw/zinc/20/11/43/1123201143.db2.gz IDLJTEXNDQOAPZ-NWDGAFQWSA-N 1 0 335.354 3.940 20 5 EHBDRO COCC[N@H+](CCCc1ccccc1)Cc1ccc([N+](=O)[O-])cc1 ZINC000065958746 1129115484 /nfs/dbraw/zinc/11/54/84/1129115484.db2.gz CMIXAUDSMNPHAB-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO O=[N+]([O-])c1c(N[C@@H]2CC[N@@H+](C3CCCC3)C2)ccc2ncccc21 ZINC000301235808 1123602304 /nfs/dbraw/zinc/60/23/04/1123602304.db2.gz LTGRFQPKRPTWTE-CYBMUJFWSA-N 1 0 326.400 3.572 20 5 EHBDRO C[C@@](O)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000609564520 1123609557 /nfs/dbraw/zinc/60/95/57/1123609557.db2.gz OBBSVNDSKXVKSX-QGZVFWFLSA-N 1 0 332.425 3.574 20 5 EHBDRO CC[C@@H]1c2ccccc2CC[N@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC000609625623 1123628200 /nfs/dbraw/zinc/62/82/00/1123628200.db2.gz CXKDLVUASJAOFQ-QGZVFWFLSA-N 1 0 326.396 3.983 20 5 EHBDRO O=C(CCCn1ccnc1)N(c1cccc([N+](=O)[O-])c1)C1CCCC1 ZINC000609859235 1123677673 /nfs/dbraw/zinc/67/76/73/1123677673.db2.gz SCWFGFBQNSVMMP-UHFFFAOYSA-N 1 0 342.399 3.547 20 5 EHBDRO C[C@H]1c2ccc(F)cc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610003991 1123711562 /nfs/dbraw/zinc/71/15/62/1123711562.db2.gz WXJLZTDKVMKZEJ-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc(Cl)cc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301245064 1123739483 /nfs/dbraw/zinc/73/94/83/1123739483.db2.gz ZRKLYZZASFFNQU-QGZVFWFLSA-N 1 0 349.818 3.972 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000237805170 1123866138 /nfs/dbraw/zinc/86/61/38/1123866138.db2.gz UKLIXMZLMHKCSA-IBGZPJMESA-N 1 0 339.439 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@@H](C[NH+]3CCCCC3)C2)c(Cl)c1 ZINC000182192151 1125194833 /nfs/dbraw/zinc/19/48/33/1125194833.db2.gz JHYMGVYSNVDLQE-AWEZNQCLSA-N 1 0 337.851 3.556 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](c2ccc(Cl)cc2)C2CCC2)n1 ZINC000182566866 1125331722 /nfs/dbraw/zinc/33/17/22/1125331722.db2.gz UYMRMJWKYVWDJG-MRXNPFEDSA-N 1 0 334.807 3.576 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@H](C)C2CCCCC2)cccc1[N+](=O)[O-] ZINC000182937348 1125406432 /nfs/dbraw/zinc/40/64/32/1125406432.db2.gz SSUUSRGATPSHPV-CQSZACIVSA-N 1 0 333.432 3.790 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301886395 1129261988 /nfs/dbraw/zinc/26/19/88/1129261988.db2.gz QDLXAORJQGXZPF-HNNXBMFYSA-N 1 0 340.427 3.801 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+](CCCO)[C@H]2CCCc3ccccc32)cs1 ZINC000081549066 1129428020 /nfs/dbraw/zinc/42/80/20/1129428020.db2.gz ZDZIGQODDDUZTL-KRWDZBQOSA-N 1 0 346.452 3.918 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(n3ccnc3)CC2)cc1[N+](=O)[O-] ZINC000092648688 1129555120 /nfs/dbraw/zinc/55/51/20/1129555120.db2.gz VACKDIKCNGCUDJ-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO C[C@H](N[C@@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955481 1129593584 /nfs/dbraw/zinc/59/35/84/1129593584.db2.gz YJLYJYGKEMUJSL-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000155064278 1129610090 /nfs/dbraw/zinc/61/00/90/1129610090.db2.gz DKXCNFMJRDSZBC-HNNXBMFYSA-N 1 0 342.395 3.602 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390545297 1129622539 /nfs/dbraw/zinc/62/25/39/1129622539.db2.gz UCPWKIGVAKWULJ-UZLBHIALSA-N 1 0 339.439 3.910 20 5 EHBDRO C[C@H]1C[C@@H](C(=O)Nc2ccc(C(C)(C)C)c([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000330631492 1129642207 /nfs/dbraw/zinc/64/22/07/1129642207.db2.gz POCOBDQWDGNPKD-STQMWFEESA-N 1 0 333.432 3.561 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCCC[C@@H]1C(C)C ZINC000331055543 1129651934 /nfs/dbraw/zinc/65/19/34/1129651934.db2.gz KRXXFRBYACFKCV-CABCVRRESA-N 1 0 333.432 3.646 20 5 EHBDRO COc1ccccc1[C@H](CNc1sccc1[N+](=O)[O-])[NH+]1CCCC1 ZINC000302006019 1129762745 /nfs/dbraw/zinc/76/27/45/1129762745.db2.gz VJJIGLWTZNBYIO-HNNXBMFYSA-N 1 0 347.440 3.914 20 5 EHBDRO Cc1cnc(CCN(C)c2cc(C)[nH+]c3ccc([N+](=O)[O-])cc32)s1 ZINC000302070797 1129766435 /nfs/dbraw/zinc/76/64/35/1129766435.db2.gz GPOPUBANRKZMQL-UHFFFAOYSA-N 1 0 342.424 3.895 20 5 EHBDRO Cc1cc(NC[C@H](O)c2ccccc2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302135182 1129769483 /nfs/dbraw/zinc/76/94/83/1129769483.db2.gz DAFAAMSGLJSWBV-IBGZPJMESA-N 1 0 337.379 3.905 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(-c3ccn4c[nH+]cc4c3)no2)c(Cl)c1 ZINC000351071036 1129798537 /nfs/dbraw/zinc/79/85/37/1129798537.db2.gz CCFRVBBLSZSGKC-UHFFFAOYSA-N 1 0 341.714 3.613 20 5 EHBDRO Cc1cccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1C ZINC000056196233 1129805768 /nfs/dbraw/zinc/80/57/68/1129805768.db2.gz QBDOCWXEWJGZFW-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056197056 1129806262 /nfs/dbraw/zinc/80/62/62/1129806262.db2.gz NIERJRYGWWOUAO-KGLIPLIRSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H](C)c1cccc(Cl)c1 ZINC000008196838 1130038728 /nfs/dbraw/zinc/03/87/28/1130038728.db2.gz IZZBSIXQVWVRDD-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO C[C@H](c1c(F)cccc1F)N1CC[C@@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000245446253 1130208341 /nfs/dbraw/zinc/20/83/41/1130208341.db2.gz KZVOWUFJBFCTGU-VXGBXAGGSA-N 1 0 348.353 3.515 20 5 EHBDRO COc1ccc(COCCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000173377575 1130220843 /nfs/dbraw/zinc/22/08/43/1130220843.db2.gz GXGKODZILIEBPV-HNNXBMFYSA-N 1 0 344.411 3.861 20 5 EHBDRO CC[C@](C)([NH2+]CCOc1cccc([N+](=O)[O-])c1)c1nc(C)cs1 ZINC000173940632 1130325436 /nfs/dbraw/zinc/32/54/36/1130325436.db2.gz YUOKCYJJACPWTG-INIZCTEOSA-N 1 0 335.429 3.654 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C[C@@H](C)C1 ZINC000246802489 1130414385 /nfs/dbraw/zinc/41/43/85/1130414385.db2.gz SUSAXAMKTUKPHK-STQMWFEESA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cccc1[N+](=O)[O-] ZINC000766191910 1131083155 /nfs/dbraw/zinc/08/31/55/1131083155.db2.gz IFCFMOHQMBIBDI-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@H+](Cc3cccc(C(F)F)c3)C2)nc1 ZINC000348061576 1131145707 /nfs/dbraw/zinc/14/57/07/1131145707.db2.gz TYYXWDPXRVDKHY-CQSZACIVSA-N 1 0 348.353 3.614 20 5 EHBDRO C[C@@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[NH+]1[C@H](C)CC[C@H]1C ZINC000741021680 1131570323 /nfs/dbraw/zinc/57/03/23/1131570323.db2.gz FOXUNYQISOMGJG-UTUOFQBUSA-N 1 0 340.807 3.553 20 5 EHBDRO C[C@@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[NH+]1[C@H](C)CC[C@H]1C ZINC000741021846 1131570771 /nfs/dbraw/zinc/57/07/71/1131570771.db2.gz QGCGTCIVXUNFRA-UTUOFQBUSA-N 1 0 340.807 3.553 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)cn1 ZINC001172899169 1131882109 /nfs/dbraw/zinc/88/21/09/1131882109.db2.gz LNCAFJVIYCCKFD-BLLLJJGKSA-N 1 0 329.375 3.727 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172902372 1131885517 /nfs/dbraw/zinc/88/55/17/1131885517.db2.gz XTGBLMHVJCFABP-YOEHRIQHSA-N 1 0 325.412 3.896 20 5 EHBDRO COCc1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172904073 1131885801 /nfs/dbraw/zinc/88/58/01/1131885801.db2.gz KWNORTNTMRWBES-IBGZPJMESA-N 1 0 340.423 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCCC(F)(F)[C@H](F)C1)CC2 ZINC001172905331 1131886922 /nfs/dbraw/zinc/88/69/22/1131886922.db2.gz RFKALELCSMBZLM-GDBMZVCRSA-N 1 0 342.361 3.911 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1ccc(F)c(F)c1)CC2 ZINC001172912751 1131918320 /nfs/dbraw/zinc/91/83/20/1131918320.db2.gz PAPBAYLAWHVBGL-INIZCTEOSA-N 1 0 346.377 3.953 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@@H]3C=CCCC3)CC2)c(F)c1 ZINC001173013209 1131935170 /nfs/dbraw/zinc/93/51/70/1131935170.db2.gz QHQKDXCPPXMVEK-GFCCVEGCSA-N 1 0 337.370 3.540 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[NH+](CCC3CC3)CC2)c(C(F)(F)F)c1 ZINC000743845857 1131984241 /nfs/dbraw/zinc/98/42/41/1131984241.db2.gz SQFCWWAWKKQWAL-UHFFFAOYSA-N 1 0 343.349 3.536 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]C2CCC(F)CC2)c1F ZINC001173174910 1131990571 /nfs/dbraw/zinc/99/05/71/1131990571.db2.gz FZQQPFFDMNGIJP-UNXYVOJBSA-N 1 0 328.359 3.544 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C[C@@H]2CCC(F)(F)C2)c1F ZINC001173177588 1131992904 /nfs/dbraw/zinc/99/29/04/1131992904.db2.gz VRJLECJOKBHYQW-GHMZBOCLSA-N 1 0 346.349 3.699 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2ccc(N)cc2)c1F ZINC001173194230 1131995696 /nfs/dbraw/zinc/99/56/96/1131995696.db2.gz YVTRNBMZEFBYPD-RYUDHWBXSA-N 1 0 347.390 3.607 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCCOc1ccc(F)cc1 ZINC001173215226 1132000897 /nfs/dbraw/zinc/00/08/97/1132000897.db2.gz UPIZAGBDGJMKIS-CQSZACIVSA-N 1 0 332.375 3.724 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](O)c1cccc(Cl)c1 ZINC001173220093 1132003307 /nfs/dbraw/zinc/00/33/07/1132003307.db2.gz TYSASVRCXGDNTF-SJKOYZFVSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H](OCc2ccccc2)C1 ZINC001173225454 1132006236 /nfs/dbraw/zinc/00/62/36/1132006236.db2.gz CGAYBEKHFCWWEH-JXFKEZNVSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)C(C)(C)O ZINC001173225638 1132006401 /nfs/dbraw/zinc/00/64/01/1132006401.db2.gz UALBIAKTFKIDJG-KSSFIOAISA-N 1 0 328.412 3.628 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H]1COCc1ccccc1 ZINC001173225936 1132006812 /nfs/dbraw/zinc/00/68/12/1132006812.db2.gz GTJQWEGJIAHDJY-OXJNMPFZSA-N 1 0 340.423 3.817 20 5 EHBDRO CCOC(=O)C1(CC)CC[NH+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173229788 1132007916 /nfs/dbraw/zinc/00/79/16/1132007916.db2.gz ACDVWNHKSRRTOV-OAHLLOKOSA-N 1 0 348.443 3.581 20 5 EHBDRO CCOC(=O)C1(CC)CC[NH+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173229787 1132007925 /nfs/dbraw/zinc/00/79/25/1132007925.db2.gz ACDVWNHKSRRTOV-HNNXBMFYSA-N 1 0 348.443 3.581 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)o1 ZINC001173227523 1132008110 /nfs/dbraw/zinc/00/81/10/1132008110.db2.gz GSWSFFZSVHEIKV-JTQLQIEISA-N 1 0 328.290 3.927 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cncc1-c1ccc(C[NH3+])cc1 ZINC001173230656 1132009698 /nfs/dbraw/zinc/00/96/98/1132009698.db2.gz SSMBTKSOMAOPQP-AWEZNQCLSA-N 1 0 336.395 3.721 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230904 1132009711 /nfs/dbraw/zinc/00/97/11/1132009711.db2.gz WDFMINFXIBWBOR-HUUCEWRRSA-N 1 0 328.412 3.755 20 5 EHBDRO COc1cc2c(cc1C)C[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C2 ZINC001173234336 1132010917 /nfs/dbraw/zinc/01/09/17/1132010917.db2.gz OEPDJNZOCKTGJP-KSSFIOAISA-N 1 0 340.423 3.600 20 5 EHBDRO C[C@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@@H](O)c1c(F)cccc1Cl ZINC000744448182 1132102370 /nfs/dbraw/zinc/10/23/70/1132102370.db2.gz PGKYKERJFNQIJK-RMLUDKJBSA-N 1 0 344.795 3.661 20 5 EHBDRO COCCn1cc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cn1 ZINC001174551273 1132414567 /nfs/dbraw/zinc/41/45/67/1132414567.db2.gz ADELUXNCRQUNFA-UHFFFAOYSA-N 1 0 333.395 3.557 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cc(Cl)cc(C(F)(F)F)c2)C1 ZINC001168976227 1132616760 /nfs/dbraw/zinc/61/67/60/1132616760.db2.gz ZWIDGGLBZCTULX-ZANVPECISA-N 1 0 336.741 3.894 20 5 EHBDRO COc1cccc([C@H]([NH2+][C@H]2CC[C@@H](C[N+](=O)[O-])C2)c2ccccc2)c1 ZINC001168985312 1132619458 /nfs/dbraw/zinc/61/94/58/1132619458.db2.gz DGLXKHFOSGJOFO-MOXGXCLJSA-N 1 0 340.423 3.820 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001168972672 1132624107 /nfs/dbraw/zinc/62/41/07/1132624107.db2.gz NQULLJBABBLTDH-GXSJLCMTSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@@H](c2ncccc2C(F)(F)F)C2CC2)C1 ZINC001168997010 1132627269 /nfs/dbraw/zinc/62/72/69/1132627269.db2.gz AYSWGBJOOQIPNQ-SCDSUCTJSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCc3ccc(C(F)(F)F)cc32)C1 ZINC001168997598 1132627831 /nfs/dbraw/zinc/62/78/31/1132627831.db2.gz DVMIGJLCBANAIO-WDBKCZKBSA-N 1 0 328.334 3.728 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](CC2CCOCC2)c2ccccc2)C1 ZINC001169003527 1132630564 /nfs/dbraw/zinc/63/05/64/1132630564.db2.gz NWMUHWHRCGLSIZ-QRQLOZEOSA-N 1 0 332.444 3.579 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009703 1132631513 /nfs/dbraw/zinc/63/15/13/1132631513.db2.gz XHOMEXLSPXELQL-OALUTQOASA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCSC[C@@H]2c2cccc(Cl)c2)C1 ZINC001169037127 1132636639 /nfs/dbraw/zinc/63/66/39/1132636639.db2.gz JBPHTXISHRIDJD-UHOFOFEASA-N 1 0 340.876 3.875 20 5 EHBDRO CC(C)[C@H]1CN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CC[N@@H+]1C ZINC001175473735 1132676474 /nfs/dbraw/zinc/67/64/74/1132676474.db2.gz XGPJMNKQNFZMSY-CQSZACIVSA-N 1 0 346.258 3.674 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@@H](C[NH+]2CCCCC2)c2ccccc2)cs1 ZINC001169188538 1132686855 /nfs/dbraw/zinc/68/68/55/1132686855.db2.gz XYXHBAFGAPDNTI-KRWDZBQOSA-N 1 0 345.468 3.973 20 5 EHBDRO C[NH+](C)CCCOc1ccc(Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC001175734676 1132747622 /nfs/dbraw/zinc/74/76/22/1132747622.db2.gz AMPYQGGYLUSAFD-UHFFFAOYSA-N 1 0 333.363 3.808 20 5 EHBDRO CC(=O)c1cc([N+](=O)[O-])ccc1NC[C@H](c1cccc(F)c1)[NH+](C)C ZINC000804326548 1132765813 /nfs/dbraw/zinc/76/58/13/1132765813.db2.gz XTWXDBQPLGNNEB-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO CC1([NH+]2CCCCC2)CCN(Cc2ccc([N+](=O)[O-])cc2F)CC1 ZINC001175966010 1132803392 /nfs/dbraw/zinc/80/33/92/1132803392.db2.gz WHARXIGNLQFMTD-UHFFFAOYSA-N 1 0 335.423 3.574 20 5 EHBDRO Cc1cc(NC(C)(C)CC[NH+](C)C)nc(-c2cccc([N+](=O)[O-])c2)n1 ZINC001169715995 1132833851 /nfs/dbraw/zinc/83/38/51/1132833851.db2.gz NTCOQTJEIKWVQK-UHFFFAOYSA-N 1 0 343.431 3.502 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](CO)[NH2+]Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000766967251 1132924487 /nfs/dbraw/zinc/92/44/87/1132924487.db2.gz IGQNOMCBQIYNBI-LRDDRELGSA-N 1 0 334.803 3.502 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C1CCCCC1 ZINC000768542363 1133153516 /nfs/dbraw/zinc/15/35/16/1133153516.db2.gz VOVFQTGBSGTCHM-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@](C)(O)c1cccc(Cl)c1 ZINC001178426285 1133168650 /nfs/dbraw/zinc/16/86/50/1133168650.db2.gz ZOBREJYDGZYPBG-SFHVURJKSA-N 1 0 348.830 3.862 20 5 EHBDRO COc1cccc([C@H]2C[C@H]([NH2+]Cc3cccc([N+](=O)[O-])c3C)C2)c1 ZINC001178724163 1133191576 /nfs/dbraw/zinc/19/15/76/1133191576.db2.gz XHZIHBQRWBQQRS-QAQDUYKDSA-N 1 0 326.396 3.948 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1cccc2c1NCCC2 ZINC001180349980 1133359918 /nfs/dbraw/zinc/35/99/18/1133359918.db2.gz RTONIMOXGIKLNX-UHFFFAOYSA-N 1 0 345.830 3.939 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954223 1133365213 /nfs/dbraw/zinc/36/52/13/1133365213.db2.gz QJRIHCWEQBEFPK-NQCMUKECSA-N 1 0 344.386 3.775 20 5 EHBDRO Cc1cc([C@@H]([NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C2CC2)ccc1F ZINC000774408216 1133672349 /nfs/dbraw/zinc/67/23/49/1133672349.db2.gz GBNNORLFGDLCMQ-MOPGFXCFSA-N 1 0 344.386 3.817 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000774411538 1133674251 /nfs/dbraw/zinc/67/42/51/1133674251.db2.gz PYCAKLJFAKDCLH-RTBURBONSA-N 1 0 326.396 3.678 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1noc2cc(F)ccc12 ZINC001183481175 1133812463 /nfs/dbraw/zinc/81/24/63/1133812463.db2.gz FDEFQFSFQOUVNI-GFCCVEGCSA-N 1 0 343.358 3.986 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@@](C)(O)c1ccccc1 ZINC000786820005 1133911430 /nfs/dbraw/zinc/91/14/30/1133911430.db2.gz GLCMDCAWWQZLLR-MQMQVCBVSA-N 1 0 340.423 3.886 20 5 EHBDRO COc1cc(NC[C@H](C(C)C)[NH+]2CCCC2)c(Cl)cc1[N+](=O)[O-] ZINC001184739484 1133985378 /nfs/dbraw/zinc/98/53/78/1133985378.db2.gz GRYCOOVDUNJRST-OAHLLOKOSA-N 1 0 341.839 3.789 20 5 EHBDRO C[C@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C)C1 ZINC001184839180 1133996427 /nfs/dbraw/zinc/99/64/27/1133996427.db2.gz DIWOTZCYRAENNB-ZIAGYGMSSA-N 1 0 328.416 3.675 20 5 EHBDRO C[C@@H](CNc1ccc2cnccc2c1[N+](=O)[O-])[N@@H+]1CCC[C@H](C)C1 ZINC001184839177 1133996769 /nfs/dbraw/zinc/99/67/69/1133996769.db2.gz DIWOTZCYRAENNB-KBPBESRZSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@H]2CC[N@H+](CCc3ccccc3)C2)c1 ZINC001185263140 1134058838 /nfs/dbraw/zinc/05/88/38/1134058838.db2.gz LXVIANAKTNOSBS-SFHVURJKSA-N 1 0 339.439 3.880 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)C12CCCC2 ZINC000788608987 1134145514 /nfs/dbraw/zinc/14/55/14/1134145514.db2.gz HMUQSLISTCORTG-CSMYWGQOSA-N 1 0 333.432 3.565 20 5 EHBDRO CC(C)[N@H+](C)C[C@H](C)Nc1ccc([N+](=O)[O-])c(-c2ccc(F)cc2)n1 ZINC001186626164 1134237887 /nfs/dbraw/zinc/23/78/87/1134237887.db2.gz FGFKTXMKUVWROY-ZDUSSCGKSA-N 1 0 346.406 3.937 20 5 EHBDRO C[NH+](C)[C@@H]1C[C@H](Nc2ccc([N+](=O)[O-])cc2C(F)F)C12CCC2 ZINC001187025454 1134283828 /nfs/dbraw/zinc/28/38/28/1134283828.db2.gz PVGAHOHRINWYND-UONOGXRCSA-N 1 0 325.359 3.817 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789584988 1134299047 /nfs/dbraw/zinc/29/90/47/1134299047.db2.gz UKPYNFTYIXXTTK-MRXNPFEDSA-N 1 0 348.830 3.938 20 5 EHBDRO COc1ccc(C[C@H](C)n2ccc3cc(C[NH3+])ccc32)c([N+](=O)[O-])c1 ZINC001170298410 1134737955 /nfs/dbraw/zinc/73/79/55/1134737955.db2.gz LCHUHODKDUDERF-ZDUSSCGKSA-N 1 0 339.395 3.821 20 5 EHBDRO C=Cc1ccc(C[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170304241 1134738806 /nfs/dbraw/zinc/73/88/06/1134738806.db2.gz AICAYPGERXZBJB-CQSZACIVSA-N 1 0 326.396 3.967 20 5 EHBDRO C=Cc1ccc(C[NH2+][C@@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170304240 1134738992 /nfs/dbraw/zinc/73/89/92/1134738992.db2.gz AICAYPGERXZBJB-AWEZNQCLSA-N 1 0 326.396 3.967 20 5 EHBDRO CO[C@@H]1[C@@H](C)[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1(C)C ZINC001170397972 1134763964 /nfs/dbraw/zinc/76/39/64/1134763964.db2.gz BWVPFEYDSAIGLM-JCURWCKSSA-N 1 0 336.432 3.531 20 5 EHBDRO C[C@@H]1c2ccccc2CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001191477519 1134870283 /nfs/dbraw/zinc/87/02/83/1134870283.db2.gz YKELYKGMQXSLFG-CQSZACIVSA-N 1 0 339.395 3.543 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H](O)c1ccccc1 ZINC000793239053 1134885694 /nfs/dbraw/zinc/88/56/94/1134885694.db2.gz QJWPSNUTAPMPAD-MSOLQXFVSA-N 1 0 332.375 3.726 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000793238117 1134893687 /nfs/dbraw/zinc/89/36/87/1134893687.db2.gz NQLJAJYQNXFRNO-LPHOPBHVSA-N 1 0 344.411 3.595 20 5 EHBDRO CCC[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](O)c1ccccc1 ZINC000793238119 1134894054 /nfs/dbraw/zinc/89/40/54/1134894054.db2.gz NQLJAJYQNXFRNO-QFBILLFUSA-N 1 0 344.411 3.595 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000793238115 1134894168 /nfs/dbraw/zinc/89/41/68/1134894168.db2.gz NQLJAJYQNXFRNO-APWZRJJASA-N 1 0 344.411 3.595 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(C)c(F)c1 ZINC001192565344 1135030782 /nfs/dbraw/zinc/03/07/82/1135030782.db2.gz LUHAFTKAYWYDLA-MSOLQXFVSA-N 1 0 332.375 3.817 20 5 EHBDRO C[C@H]([NH2+]Cc1cccnc1[N+](=O)[O-])C1(c2ccccc2)CCCC1 ZINC001193509015 1135148062 /nfs/dbraw/zinc/14/80/62/1135148062.db2.gz SXYIKFUCLPTKLB-HNNXBMFYSA-N 1 0 325.412 3.980 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC001194162527 1135236109 /nfs/dbraw/zinc/23/61/09/1135236109.db2.gz FGGHRSRLSHPTES-CDMJZVDBSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCCC[C@@H]2CC(=O)OC(C)(C)C)cc1[N+](=O)[O-] ZINC001195795708 1135470562 /nfs/dbraw/zinc/47/05/62/1135470562.db2.gz AJWWFPGEQATJEB-MRXNPFEDSA-N 1 0 348.443 3.990 20 5 EHBDRO CC(C)(O)[C@@H]1CCCN1Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809965234 1135904209 /nfs/dbraw/zinc/90/42/09/1135904209.db2.gz FUGYVOLCQFZBPS-LBPRGKRZSA-N 1 0 333.215 3.637 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000809975182 1135907230 /nfs/dbraw/zinc/90/72/30/1135907230.db2.gz AAWOQJIXWJIIMF-ZJUUUORDSA-N 1 0 333.215 3.806 20 5 EHBDRO Cc1cccc(N(CC[NH3+])C23CC4CC(CC(C4)C2)C3)c1[N+](=O)[O-] ZINC001170624833 1136040599 /nfs/dbraw/zinc/04/05/99/1136040599.db2.gz NXJSZQAVLQEYSO-UHFFFAOYSA-N 1 0 329.444 3.637 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCN(c3ccc(Cl)cc3)C2)cccc1[N+](=O)[O-] ZINC001201635126 1136045222 /nfs/dbraw/zinc/04/52/22/1136045222.db2.gz YQUMPCOBWRDQQU-MRXNPFEDSA-N 1 0 345.830 3.925 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)C[C@@H](O)c1ccc(F)cc1 ZINC001201788357 1136066973 /nfs/dbraw/zinc/06/69/73/1136066973.db2.gz YLRVVLMOBXXPTP-BFUOFWGJSA-N 1 0 346.402 3.953 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1cc(C)ccc1F ZINC001202426711 1136140665 /nfs/dbraw/zinc/14/06/65/1136140665.db2.gz MADFACPFIHTMAR-UHFFFAOYSA-N 1 0 332.375 3.773 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2c(F)cccc2-n2cccn2)cc1[N+](=O)[O-] ZINC001202426948 1136140769 /nfs/dbraw/zinc/14/07/69/1136140769.db2.gz MKCUAKSTKWPIMI-UHFFFAOYSA-N 1 0 340.358 3.518 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCCCc3ccccc32)cc1 ZINC000747815218 1136247941 /nfs/dbraw/zinc/24/79/41/1136247941.db2.gz KJNVNUYBCRZIPY-RBUKOAKNSA-N 1 0 326.396 3.686 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc3c(c2)CCCO3)cc1[N+](=O)[O-] ZINC000850429906 1136257821 /nfs/dbraw/zinc/25/78/21/1136257821.db2.gz HAEOUKUBAQRKAP-ZDUSSCGKSA-N 1 0 342.395 3.779 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2COC3(CCC3)C2)c2ccccc2)c1 ZINC000850523824 1136277628 /nfs/dbraw/zinc/27/76/28/1136277628.db2.gz DCNYGJDPJQFVHV-IEBWSBKVSA-N 1 0 338.407 3.985 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCC1SCCS1)C1CC1 ZINC000850569850 1136288387 /nfs/dbraw/zinc/28/83/87/1136288387.db2.gz CRVRMHASGBHSKV-CQSZACIVSA-N 1 0 338.498 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCN(c3ccccc3F)C2)c1 ZINC000813792243 1136363118 /nfs/dbraw/zinc/36/31/18/1136363118.db2.gz TYWOMUKTMOOBSO-ZDUSSCGKSA-N 1 0 349.793 3.756 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C1(CO)CCC1 ZINC000814169702 1136415036 /nfs/dbraw/zinc/41/50/36/1136415036.db2.gz MEGJEUVESOMRNS-HNNXBMFYSA-N 1 0 326.824 3.525 20 5 EHBDRO CC(C)[C@@H](c1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581322 1136444563 /nfs/dbraw/zinc/44/45/63/1136444563.db2.gz CLIOXAAXPCXIEO-MOPGFXCFSA-N 1 0 328.412 3.957 20 5 EHBDRO CC1(C)C[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)[C@H]1c1ccccc1 ZINC000776591401 1136453426 /nfs/dbraw/zinc/45/34/26/1136453426.db2.gz MECOHKIAHSLRCG-ROUUACIJSA-N 1 0 326.396 3.711 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Cl ZINC000776604313 1136466202 /nfs/dbraw/zinc/46/62/02/1136466202.db2.gz BJXARYKNWFNZHX-BONVTDFDSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000852566979 1136467174 /nfs/dbraw/zinc/46/71/74/1136467174.db2.gz JVTUAHXLUGDTJN-MAUKXSAKSA-N 1 0 325.412 3.799 20 5 EHBDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776606605 1136470591 /nfs/dbraw/zinc/47/05/91/1136470591.db2.gz YJSCDWIOZNNSBX-KBXCAEBGSA-N 1 0 344.411 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2C[C@]34COC[C@@]3(C2)CCCC4)c1 ZINC000852759604 1136483948 /nfs/dbraw/zinc/48/39/48/1136483948.db2.gz QJTVHSLOYQVZGB-CALCHBBNSA-N 1 0 336.819 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](c3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000814641927 1136488327 /nfs/dbraw/zinc/48/83/27/1136488327.db2.gz MGISQZGIWNSWHZ-HNNXBMFYSA-N 1 0 341.367 3.883 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(F)cc1OCc1cccc2c1CC[NH2+]C2 ZINC000853135867 1136513269 /nfs/dbraw/zinc/51/32/69/1136513269.db2.gz LQKSMOYDZTWSEI-UHFFFAOYSA-N 1 0 336.750 3.612 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555003 1136610148 /nfs/dbraw/zinc/61/01/48/1136610148.db2.gz NRBNNKZABYORFG-QWHCGFSZSA-N 1 0 329.400 3.906 20 5 EHBDRO CC(C)OCc1ccccc1C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815566136 1136611909 /nfs/dbraw/zinc/61/19/09/1136611909.db2.gz JRVHDKWZJLNKDI-AWEZNQCLSA-N 1 0 343.427 3.953 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000815584965 1136614496 /nfs/dbraw/zinc/61/44/96/1136614496.db2.gz UANRRLXVYMJSSA-QWRGUYRKSA-N 1 0 335.354 3.910 20 5 EHBDRO COc1ccc(C[C@H](C)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000815598757 1136616868 /nfs/dbraw/zinc/61/68/68/1136616868.db2.gz BMYHVWQQVAVYMH-UONOGXRCSA-N 1 0 343.427 3.715 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1COC2(CCC(C)CC2)O1)c1ccc([N+](=O)[O-])cc1 ZINC000776740094 1136620033 /nfs/dbraw/zinc/62/00/33/1136620033.db2.gz IEXHTURWYJIJHP-HGDQPMEPSA-N 1 0 334.416 3.567 20 5 EHBDRO C[C@@H]([NH2+][C@H]1C[C@H](c2ccc(F)cc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815632519 1136621784 /nfs/dbraw/zinc/62/17/84/1136621784.db2.gz PNRDZLPSELPRKX-DJSGYFEHSA-N 1 0 329.375 3.913 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCCC1(O)CCC1 ZINC000817413807 1136806274 /nfs/dbraw/zinc/80/62/74/1136806274.db2.gz ALVBUWRMYMNWDM-UHFFFAOYSA-N 1 0 333.215 3.686 20 5 EHBDRO CC[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO1 ZINC000817414681 1136806737 /nfs/dbraw/zinc/80/67/37/1136806737.db2.gz ICZMXEJNNGWRTH-RYUDHWBXSA-N 1 0 333.215 3.949 20 5 EHBDRO Cc1cc2c(o1)CC(C)(C)C[C@H]2[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818961855 1136891549 /nfs/dbraw/zinc/89/15/49/1136891549.db2.gz VVOIPONRXYOYGE-SJORKVTESA-N 1 0 344.411 3.833 20 5 EHBDRO CC[C@H](Cc1ccc(Cl)cc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000819079433 1136911865 /nfs/dbraw/zinc/91/18/65/1136911865.db2.gz ADLLOTSGZCVUBX-AEFFLSMTSA-N 1 0 348.830 3.893 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000819177132 1136919713 /nfs/dbraw/zinc/91/97/13/1136919713.db2.gz APHVAWIGOBKMGI-ZWKOTPCHSA-N 1 0 326.396 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CC[C@H](c3cccc(F)c3)C2)cc1 ZINC000819280255 1136930592 /nfs/dbraw/zinc/93/05/92/1136930592.db2.gz ZOKISBNTIPDZIO-KVSKMBFKSA-N 1 0 344.386 3.693 20 5 EHBDRO CC[C@H](CCc1ccccc1)[NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000858363326 1136961895 /nfs/dbraw/zinc/96/18/95/1136961895.db2.gz SOENBGMELSHLOS-MJGOQNOKSA-N 1 0 328.412 3.629 20 5 EHBDRO CC(C)[C@H]1C[C@@H](C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)CCO1 ZINC000824799386 1137152807 /nfs/dbraw/zinc/15/28/07/1137152807.db2.gz NFBYTSLDLSPAGB-XJKSGUPXSA-N 1 0 326.824 3.789 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@H]2CCO[C@H](c3ccncc3)C2)c1 ZINC000824949074 1137158990 /nfs/dbraw/zinc/15/89/90/1137158990.db2.gz XGIRVTLZIPFVQN-YOEHRIQHSA-N 1 0 347.802 3.653 20 5 EHBDRO Cc1c([N+](=O)[O-])cc(F)cc1-n1c2ccccc2c2c1C[C@@H]([NH3+])CC2 ZINC001171096440 1137189629 /nfs/dbraw/zinc/18/96/29/1137189629.db2.gz WHEVSOOJBFBAOD-ZDUSSCGKSA-N 1 0 339.370 3.802 20 5 EHBDRO C[C@@H]([NH2+]CC[C@@H]1CCc2ccccc2N1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000844925527 1137263146 /nfs/dbraw/zinc/26/31/46/1137263146.db2.gz QZAVDOHYRDNRPG-CJNGLKHVSA-N 1 0 340.427 3.645 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000846039068 1137329124 /nfs/dbraw/zinc/32/91/24/1137329124.db2.gz STQWQHDCVDXXNE-CABCVRRESA-N 1 0 330.787 3.788 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000866278180 1137342069 /nfs/dbraw/zinc/34/20/69/1137342069.db2.gz WHSNQPQCIHHSCV-NHYWBVRUSA-N 1 0 336.363 3.544 20 5 EHBDRO Cc1noc(C)c1[C@H](C)C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866309506 1137344272 /nfs/dbraw/zinc/34/42/72/1137344272.db2.gz PKRSJWQCDFUTHW-GHMZBOCLSA-N 1 0 335.379 3.663 20 5 EHBDRO COCC[C@H]([NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccco1 ZINC000866338157 1137346855 /nfs/dbraw/zinc/34/68/55/1137346855.db2.gz YBJGDFPWWZXRJV-DOMZBBRYSA-N 1 0 336.363 3.625 20 5 EHBDRO COCC(C)(C)CCC[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866355982 1137348874 /nfs/dbraw/zinc/34/88/74/1137348874.db2.gz IDBPKNPABAECDP-CYBMUJFWSA-N 1 0 326.412 3.707 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCC13CCOCC3)CCC2 ZINC000866531414 1137361816 /nfs/dbraw/zinc/36/18/16/1137361816.db2.gz QDXRQXZYOCYEJU-QAPCUYQASA-N 1 0 330.428 3.769 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1C[C@H]1C1CCOCC1)C1CC1 ZINC000866538572 1137362890 /nfs/dbraw/zinc/36/28/90/1137362890.db2.gz SWCAVXRQTVFMHB-GBESFXJTSA-N 1 0 344.455 3.568 20 5 EHBDRO COCCc1nc(C)c([C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000866539815 1137363240 /nfs/dbraw/zinc/36/32/40/1137363240.db2.gz HNFHHZUVJBGYNQ-GFCCVEGCSA-N 1 0 349.456 3.708 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2cn(C)c3ncccc23)cccc1[N+](=O)[O-] ZINC000866570165 1137365873 /nfs/dbraw/zinc/36/58/73/1137365873.db2.gz DPIDNLDYQMUZNB-CQSZACIVSA-N 1 0 338.411 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](CC3(Br)CC3)C2)cc1 ZINC000846962410 1137379449 /nfs/dbraw/zinc/37/94/49/1137379449.db2.gz ZUVQQKSTCIJQSW-CYBMUJFWSA-N 1 0 339.233 3.702 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccsc1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017903 1137564758 /nfs/dbraw/zinc/56/47/58/1137564758.db2.gz GUWQZFMHHLPXOD-IAQYHMDHSA-N 1 0 337.420 3.749 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](C)Cn1ccnc1C ZINC000872030723 1137566314 /nfs/dbraw/zinc/56/63/14/1137566314.db2.gz BCSVSEVUDWRDDI-CHWSQXEVSA-N 1 0 348.472 3.809 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC(C)(C)C[C@H](C)O ZINC000872050225 1137567941 /nfs/dbraw/zinc/56/79/41/1137567941.db2.gz XMUJDNJEAXBTDP-NWDGAFQWSA-N 1 0 326.462 3.764 20 5 EHBDRO C[C@H](NC[C@H]1CCC[N@H+](CC2CC2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086663 1137570575 /nfs/dbraw/zinc/57/05/75/1137570575.db2.gz BNHWWAMYWLCMDV-DZGCQCFKSA-N 1 0 335.423 3.507 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N1CCC(C)([NH+]2CCCCC2)CC1 ZINC000872665076 1137582699 /nfs/dbraw/zinc/58/26/99/1137582699.db2.gz OEOPZTWEUFXYEV-UHFFFAOYSA-N 1 0 347.459 3.586 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000873052270 1137588986 /nfs/dbraw/zinc/58/89/86/1137588986.db2.gz NHJURIWXGZHRDF-IBGZPJMESA-N 1 0 344.411 3.514 20 5 EHBDRO Cc1c(C[NH2+]C[C@]2(C)OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000873127705 1137590809 /nfs/dbraw/zinc/59/08/09/1137590809.db2.gz UEPPWOZSQWROOU-KRWDZBQOSA-N 1 0 332.425 3.542 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2[C@H]1CCN2C(=O)c1cc2ccccc2c2cccnc12 ZINC000874842446 1137624621 /nfs/dbraw/zinc/62/46/21/1137624621.db2.gz HMSGIULCUUKMML-WOJBJXKFSA-N 1 0 345.446 3.697 20 5 EHBDRO CC(C)c1ccc(C[C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877117846 1137670624 /nfs/dbraw/zinc/67/06/24/1137670624.db2.gz ZSYJGZHEVWFAKK-RWBZWWBESA-N 1 0 342.443 3.839 20 5 EHBDRO C[C@@H]1CCCc2ccccc2[C@@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877373594 1137674900 /nfs/dbraw/zinc/67/49/00/1137674900.db2.gz FCECDFSYWRBJQK-BECUHMJXSA-N 1 0 340.427 3.798 20 5 EHBDRO CC(C)(O)C1CC[NH+](Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000877752497 1137687914 /nfs/dbraw/zinc/68/79/14/1137687914.db2.gz SGWRDHUEGFOXAA-UHFFFAOYSA-N 1 0 346.349 3.597 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]1C ZINC000878446543 1137716407 /nfs/dbraw/zinc/71/64/07/1137716407.db2.gz GNYSIRQZZLGKCH-BZPMIXESSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@H+](CC2CC2)CC2CCC2)o1 ZINC000878544200 1137719494 /nfs/dbraw/zinc/71/94/94/1137719494.db2.gz NVKQQTOZYXQJBM-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@H](O)c2ccc(F)cc2F)C2CC2)cc1 ZINC000130557162 1137839243 /nfs/dbraw/zinc/83/92/43/1137839243.db2.gz HYSFHKBOVBXGQV-SFHVURJKSA-N 1 0 348.349 3.571 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2CCC3(CCOCC3)CO2)cccc1[N+](=O)[O-] ZINC000883261780 1137851133 /nfs/dbraw/zinc/85/11/33/1137851133.db2.gz MNCJKUHMSKMGNO-HZPDHXFCSA-N 1 0 348.443 3.530 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C2CCC3(COC3)CC2)cc1[N+](=O)[O-] ZINC000883380288 1137858280 /nfs/dbraw/zinc/85/82/80/1137858280.db2.gz HEUXWILOYREJDX-CYBMUJFWSA-N 1 0 334.416 3.603 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CCc4ccccc4C3)o2)c1 ZINC000104661113 1137878930 /nfs/dbraw/zinc/87/89/30/1137878930.db2.gz QLNDYRJYVOCYDH-UHFFFAOYSA-N 1 0 349.390 3.851 20 5 EHBDRO CC[NH2+]Cc1cccc(NC(=O)c2c(C)c(C)ccc2[N+](=O)[O-])c1 ZINC000884014648 1137892858 /nfs/dbraw/zinc/89/28/58/1137892858.db2.gz SUDRFAXIWHKAIR-UHFFFAOYSA-N 1 0 327.384 3.573 20 5 EHBDRO CC[NH+](CC)CCCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113310893 1137912626 /nfs/dbraw/zinc/91/26/26/1137912626.db2.gz UNAIOFZRXDXUJF-UHFFFAOYSA-N 1 0 348.472 3.540 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN(C)Cc1ccccc1SC ZINC000348303071 1137921692 /nfs/dbraw/zinc/92/16/92/1137921692.db2.gz CMGBBDQGQVPFTE-UHFFFAOYSA-N 1 0 332.425 3.957 20 5 EHBDRO CCCC[NH+]1CCC(NC(=O)Nc2cc([N+](=O)[O-])c(C)cc2C)CC1 ZINC000119817760 1137944527 /nfs/dbraw/zinc/94/45/27/1137944527.db2.gz IBQRUMJNOYASDG-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO CC(C)(C)C[C@@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000121323326 1137956890 /nfs/dbraw/zinc/95/68/90/1137956890.db2.gz KSDMBMXGQQVSES-ZDUSSCGKSA-N 1 0 349.456 3.605 20 5 EHBDRO O=[N+]([O-])c1ncccc1C[NH+]1CCC(c2cc3ccccc3[nH]2)CC1 ZINC000885966659 1138029301 /nfs/dbraw/zinc/02/93/01/1138029301.db2.gz BFPVUOLTGUYYBZ-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO C[N@@H+](Cc1cccnc1[N+](=O)[O-])C[C@@H]1CCCO[C@H]1c1ccccc1 ZINC000885973469 1138029495 /nfs/dbraw/zinc/02/94/95/1138029495.db2.gz SXRSJVMZDUQPHW-WMZOPIPTSA-N 1 0 341.411 3.590 20 5 EHBDRO Cc1cc(NCc2ccccc2C[NH+]2CCCC2)ncc1[N+](=O)[O-] ZINC000074727279 1138123522 /nfs/dbraw/zinc/12/35/22/1138123522.db2.gz LDMFXLFOIFGRHE-UHFFFAOYSA-N 1 0 326.400 3.506 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000089580875 1138201890 /nfs/dbraw/zinc/20/18/90/1138201890.db2.gz DDPXDURRZJZSDJ-CYBMUJFWSA-N 1 0 346.431 3.584 20 5 EHBDRO CCC[C@@H]([NH2+]CC1(SC)CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000090112047 1138209559 /nfs/dbraw/zinc/20/95/59/1138209559.db2.gz WMSQJJCKRZKIMA-MRXNPFEDSA-N 1 0 338.473 3.938 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130656186 1138467636 /nfs/dbraw/zinc/46/76/36/1138467636.db2.gz LBYVWKSJWUEBNM-ZBFHGGJFSA-N 1 0 343.427 3.769 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccnc(N2CCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000131447856 1138518398 /nfs/dbraw/zinc/51/83/98/1138518398.db2.gz CPWCDIKZCJLAHW-GOSISDBHSA-N 1 0 340.427 3.831 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[NH+]3C[C@H]4CCC[C@@H]4C3)o2)c1 ZINC000153288548 1139130401 /nfs/dbraw/zinc/13/04/01/1139130401.db2.gz QSONWKMQLUSOQA-HUUCEWRRSA-N 1 0 327.384 3.524 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H]2COC3(CCC(C)CC3)O2)cccc1[N+](=O)[O-] ZINC000777311264 1139567696 /nfs/dbraw/zinc/56/76/96/1139567696.db2.gz AYOJDMNMENZCKH-BYGOXVSRSA-N 1 0 348.443 3.876 20 5 EHBDRO CCCO[C@@H]1CCC[N@H+](Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000177064655 1139595839 /nfs/dbraw/zinc/59/58/39/1139595839.db2.gz IQOLHRSGUBKRQP-CQSZACIVSA-N 1 0 333.388 3.517 20 5 EHBDRO Cc1c([C@@H](C)Nc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)cnn1C ZINC000181451345 1139907344 /nfs/dbraw/zinc/90/73/44/1139907344.db2.gz OPDHUTBHMUCMIE-LLVKDONJSA-N 1 0 325.372 3.666 20 5 EHBDRO CCCC(=O)NC[C@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182736962 1139989242 /nfs/dbraw/zinc/98/92/42/1139989242.db2.gz ZFPVKUUNPBDOFW-JKSUJKDBSA-N 1 0 347.459 3.593 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C[S@](C)=O)c1ccccc1 ZINC000183176774 1140018757 /nfs/dbraw/zinc/01/87/57/1140018757.db2.gz ZLAKVNTXIXQVGM-AXMJJZENSA-N 1 0 346.452 3.674 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccc3c(c1)OCCO3)CCC2 ZINC000192603336 1140539502 /nfs/dbraw/zinc/53/95/02/1140539502.db2.gz XHPAQZLIABUUGE-QGZVFWFLSA-N 1 0 340.379 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000192971815 1140557857 /nfs/dbraw/zinc/55/78/57/1140557857.db2.gz GMEYZHYOCAGJKJ-MRXNPFEDSA-N 1 0 327.340 3.670 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000266187485 1140653055 /nfs/dbraw/zinc/65/30/55/1140653055.db2.gz XJAKRYRGLMBLSV-JSGCOSHPSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@@H]1CCOC1 ZINC000266187484 1140653282 /nfs/dbraw/zinc/65/32/82/1140653282.db2.gz XJAKRYRGLMBLSV-GXTWGEPZSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc2c(c1)CC(=O)N2C)c1ccc([N+](=O)[O-])cc1 ZINC000267460866 1140793892 /nfs/dbraw/zinc/79/38/92/1140793892.db2.gz VBFIZNNVCDHYPJ-STQMWFEESA-N 1 0 339.395 3.526 20 5 EHBDRO CC(C)C[C@H](CCO)C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268998704 1141042879 /nfs/dbraw/zinc/04/28/79/1141042879.db2.gz UIVKENVXZYNXNC-YJBOKZPZSA-N 1 0 334.460 3.550 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCCC[C@@H]2c2ccco2)c1 ZINC000269633877 1141130146 /nfs/dbraw/zinc/13/01/46/1141130146.db2.gz GNBCBKDESGSINQ-SJORKVTESA-N 1 0 330.384 3.839 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccccc2F)cc1[N+](=O)[O-] ZINC000271025740 1141296507 /nfs/dbraw/zinc/29/65/07/1141296507.db2.gz BBXDJHABSSFHEL-YVEFUNNKSA-N 1 0 348.374 3.517 20 5 EHBDRO C[C@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000271262811 1141335696 /nfs/dbraw/zinc/33/56/96/1141335696.db2.gz AVOJDITZKHEIDE-UONOGXRCSA-N 1 0 330.384 3.760 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2cccc(F)c2)cccc1[N+](=O)[O-] ZINC000271427359 1141363306 /nfs/dbraw/zinc/36/33/06/1141363306.db2.gz BICFHHVWECBMQF-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO COc1cc([C@H](C)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000348753146 1141575569 /nfs/dbraw/zinc/57/55/69/1141575569.db2.gz HXBNLKXPGRVFAN-YVEFUNNKSA-N 1 0 327.384 3.727 20 5 EHBDRO CN(CCC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-])Cc1ccco1 ZINC000348819053 1141587175 /nfs/dbraw/zinc/58/71/75/1141587175.db2.gz VRAGQUXJJOLYPR-UITAMQMPSA-N 1 0 343.427 3.655 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])o2)cc1 ZINC000055448938 214324400 /nfs/dbraw/zinc/32/44/00/214324400.db2.gz AETHVUGYKZYFNS-ZDUSSCGKSA-N 1 0 343.383 3.815 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(C)cc1 ZINC000340153734 1016507679 /nfs/dbraw/zinc/50/76/79/1016507679.db2.gz BKZUJMQUUZUVBB-KDOFPFPSSA-N 1 0 341.411 3.971 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCC[C@H]2CCO)s1 ZINC000189977570 1016819925 /nfs/dbraw/zinc/81/99/25/1016819925.db2.gz FBGZJOKKGZLXHE-BBRMVZONSA-N 1 0 346.452 3.964 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)c1ccc(F)cc1 ZINC000414526131 1016953516 /nfs/dbraw/zinc/95/35/16/1016953516.db2.gz KOHRHRNZCQJVBF-RKCSUWQLSA-N 1 0 344.386 3.503 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCc1nc2ccccc2[nH]1 ZINC000449103420 1032181235 /nfs/dbraw/zinc/18/12/35/1032181235.db2.gz QFMIAMJIVMDBDK-CQSZACIVSA-N 1 0 338.411 3.625 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000538177286 1032197987 /nfs/dbraw/zinc/19/79/87/1032197987.db2.gz SGLWAZGZOQYRPO-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO Cc1cc(NCc2ccccc2C[N@@H+](C)C(C)C)ncc1[N+](=O)[O-] ZINC000074740897 1032214562 /nfs/dbraw/zinc/21/45/62/1032214562.db2.gz BDEUITYUIRQYBK-UHFFFAOYSA-N 1 0 328.416 3.751 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCOc2ccccc21 ZINC000449150218 1032251768 /nfs/dbraw/zinc/25/17/68/1032251768.db2.gz ZCOGRDQEYSNKTM-GOEBONIOSA-N 1 0 326.396 3.682 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])[C@H]1CCCO1 ZINC000536829272 1032309082 /nfs/dbraw/zinc/30/90/82/1032309082.db2.gz XFFYDYISCIDNHO-NOCIGQNYSA-N 1 0 332.444 3.853 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])C1CCCCC1 ZINC000538390210 1032334435 /nfs/dbraw/zinc/33/44/35/1032334435.db2.gz OLSBDYNCDYJTMM-MRXNPFEDSA-N 1 0 333.432 3.532 20 5 EHBDRO COCC[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000278750294 1032337073 /nfs/dbraw/zinc/33/70/73/1032337073.db2.gz NXLKRPVWGIRNRB-IRXDYDNUSA-N 1 0 330.384 3.933 20 5 EHBDRO COc1ccc2c(c1)OC[C@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000536842919 1032339017 /nfs/dbraw/zinc/33/90/17/1032339017.db2.gz BDCZPCICLMFIKW-UKRRQHHQSA-N 1 0 342.395 3.566 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1nc2c(s1)CCC2 ZINC000459645385 1032367728 /nfs/dbraw/zinc/36/77/28/1032367728.db2.gz GKDWITWLUBHBKE-VXGBXAGGSA-N 1 0 331.441 3.822 20 5 EHBDRO C[C@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1nc2c(s1)CCC2 ZINC000459651214 1032375048 /nfs/dbraw/zinc/37/50/48/1032375048.db2.gz OWOFNCQZZAXCHM-HWPRWLFBSA-N 1 0 329.425 3.904 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc3c(c2)OCCCCO3)cccc1[N+](=O)[O-] ZINC000449278515 1032397188 /nfs/dbraw/zinc/39/71/88/1032397188.db2.gz JYECANFEFYKLBI-UHFFFAOYSA-N 1 0 342.395 3.744 20 5 EHBDRO COC[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000449480954 1032608248 /nfs/dbraw/zinc/60/82/48/1032608248.db2.gz QBADUICOUUHIAX-HNNXBMFYSA-N 1 0 334.803 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CC2(CCOCC2)[C@@H]2CCC[C@@H]21 ZINC000449517447 1032708255 /nfs/dbraw/zinc/70/82/55/1032708255.db2.gz KFUMKZKARGBSIE-LRSLKPCPSA-N 1 0 342.439 3.889 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)[C@@H](C)c1ccccc1 ZINC000177479449 1017679361 /nfs/dbraw/zinc/67/93/61/1017679361.db2.gz YSCUYAHJWPQHCF-KFWWJZLASA-N 1 0 341.411 3.704 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCC(F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000592399040 1032752535 /nfs/dbraw/zinc/75/25/35/1032752535.db2.gz MEXQELXGJQMAQQ-PUJMQQBBSA-N 1 0 346.406 3.536 20 5 EHBDRO C[N@H+](CCNc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1CCCC1 ZINC000321670461 1018424905 /nfs/dbraw/zinc/42/49/05/1018424905.db2.gz UMJBALHJWDMUMP-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)ccc1O ZINC000560899821 1018637688 /nfs/dbraw/zinc/63/76/88/1018637688.db2.gz JUZMLZYKZJFGGO-ZDUSSCGKSA-N 1 0 330.384 3.858 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(Cc2cc(F)ccc2[N+](=O)[O-])CC1 ZINC000052210054 1018869603 /nfs/dbraw/zinc/86/96/03/1018869603.db2.gz XEGOKKMQJRUAIK-UHFFFAOYSA-N 1 0 337.439 3.678 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccncc3)CC2)c(Cl)c1 ZINC000052447702 1018954140 /nfs/dbraw/zinc/95/41/40/1018954140.db2.gz MRCFVGQGBNEROE-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2ccc(N3CCCC3)nc2)cccc1[N+](=O)[O-] ZINC000151044268 1019056086 /nfs/dbraw/zinc/05/60/86/1019056086.db2.gz IDMYMHIVNJCVMD-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](c2cccs2)N(C)C)cc1[N+](=O)[O-] ZINC000120626717 1019111430 /nfs/dbraw/zinc/11/14/30/1019111430.db2.gz ODWWHPJCYKWMRK-BBRMVZONSA-N 1 0 333.457 3.918 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)cc1[N+](=O)[O-] ZINC000120627019 1019112130 /nfs/dbraw/zinc/11/21/30/1019112130.db2.gz ODWWHPJCYKWMRK-XJKSGUPXSA-N 1 0 333.457 3.918 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000182339995 1019327743 /nfs/dbraw/zinc/32/77/43/1019327743.db2.gz SLYCGHQRPUNIKW-HNNXBMFYSA-N 1 0 341.411 3.891 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](Oc2ccc(Br)c([N+](=O)[O-])c2)C1 ZINC001225505376 1019452946 /nfs/dbraw/zinc/45/29/46/1019452946.db2.gz KSYIMZUPVAVYDS-GFCCVEGCSA-N 1 0 343.221 3.609 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CCC2(CC[NH2+]C2)CC1 ZINC000261918663 1019495368 /nfs/dbraw/zinc/49/53/68/1019495368.db2.gz YMHUAOUSUQFZJQ-UHFFFAOYSA-N 1 0 345.446 3.604 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C1CCSCC1 ZINC000580597559 1019716265 /nfs/dbraw/zinc/71/62/65/1019716265.db2.gz AYIDOGFTNZEMMH-LBPRGKRZSA-N 1 0 333.457 3.740 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1CN(CC[NH+](C)C)Cc1cccc(F)c1 ZINC000580679397 1019842149 /nfs/dbraw/zinc/84/21/49/1019842149.db2.gz VOYMWDHMDMWDGR-UHFFFAOYSA-N 1 0 345.418 3.606 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)C1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000182955989 1019851949 /nfs/dbraw/zinc/85/19/49/1019851949.db2.gz NQERNQCGGRZCJV-VXGBXAGGSA-N 1 0 330.388 3.559 20 5 EHBDRO CCOC(CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)OCC ZINC000276083812 1020584919 /nfs/dbraw/zinc/58/49/19/1020584919.db2.gz GWTHPCVAAQUXHL-UHFFFAOYSA-N 1 0 348.399 3.734 20 5 EHBDRO Cc1c(C[N@@H+]2CCCC[C@@H]2[C@@H]2CCCC[C@H]2O)cccc1[N+](=O)[O-] ZINC000326000042 1020667407 /nfs/dbraw/zinc/66/74/07/1020667407.db2.gz FPJKKVDKPRFDTG-QXAKKESOSA-N 1 0 332.444 3.809 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](n2ncc3ccccc32)C1 ZINC000510403173 1020767301 /nfs/dbraw/zinc/76/73/01/1020767301.db2.gz UDIOURXSBPUGRQ-RDTXWAMCSA-N 1 0 336.395 3.953 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2CC[NH+](Cc3ccccc3)CC2)n1 ZINC000360670316 1020767737 /nfs/dbraw/zinc/76/77/37/1020767737.db2.gz VKNMFTBKUMGTQB-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)n1 ZINC000360875588 1020846714 /nfs/dbraw/zinc/84/67/14/1020846714.db2.gz XDGKIXCRSZLXRC-WMLDXEAASA-N 1 0 340.427 3.621 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CC[C@H]2c2cccc(F)c2)cc1 ZINC000610505563 1020869105 /nfs/dbraw/zinc/86/91/05/1020869105.db2.gz PKUINJYQCACINJ-SFHVURJKSA-N 1 0 330.359 3.950 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CCc2ccsc2)cc1Br ZINC000602511582 1032947365 /nfs/dbraw/zinc/94/73/65/1032947365.db2.gz OZSJLJIMSMDYCC-UHFFFAOYSA-N 1 0 347.259 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCC3CCCCC3)CC2)cn1 ZINC000602512747 1032950389 /nfs/dbraw/zinc/95/03/89/1032950389.db2.gz TZGYIBHAMOPZFB-UHFFFAOYSA-N 1 0 332.448 3.519 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC(C)(C)[C@H]1CCCCO1 ZINC000610717407 1021085973 /nfs/dbraw/zinc/08/59/73/1021085973.db2.gz FUYBKVCAOJSUTC-QGZVFWFLSA-N 1 0 336.432 3.678 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCN(C)[C@H]1c1ccccc1 ZINC000581562243 1021091460 /nfs/dbraw/zinc/09/14/60/1021091460.db2.gz DYRWXNATBCUCIS-BEVDRBHNSA-N 1 0 339.439 3.999 20 5 EHBDRO CC[N@H+](CCOc1ccccc1OC)Cc1cccc([N+](=O)[O-])c1 ZINC000051086032 1021116745 /nfs/dbraw/zinc/11/67/45/1021116745.db2.gz WYYCNTZEPOWULT-UHFFFAOYSA-N 1 0 330.384 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CC[C@H]4CCC[C@H]4C3)CC2)cn1 ZINC000602555414 1032971190 /nfs/dbraw/zinc/97/11/90/1032971190.db2.gz HMKWHFGXXWDWTI-HLLBOEOZSA-N 1 0 344.459 3.517 20 5 EHBDRO C[C@@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)[C@@H](C)[C@H](C)O1 ZINC000438365681 1021358026 /nfs/dbraw/zinc/35/80/26/1021358026.db2.gz CUVSAQUJKCCMJB-RDBSUJKOSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc(C[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)s1 ZINC000602559275 1032973760 /nfs/dbraw/zinc/97/37/60/1032973760.db2.gz XNJQINIUHKOCNS-SNVBAGLBSA-N 1 0 331.397 3.827 20 5 EHBDRO CC(C)(CO)[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000581698863 1021554149 /nfs/dbraw/zinc/55/41/49/1021554149.db2.gz ZPRHNDUMJXOJJV-GOSISDBHSA-N 1 0 344.411 3.742 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H](c2cccs2)[NH+]2CCCC2)n1 ZINC000178150583 1021794083 /nfs/dbraw/zinc/79/40/83/1021794083.db2.gz KRGYHAIJHXCZBF-CQSZACIVSA-N 1 0 332.429 3.609 20 5 EHBDRO Cc1nn(C(C)C)c(C)c1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000894392415 1021837588 /nfs/dbraw/zinc/83/75/88/1021837588.db2.gz YMAUDTNVNXOZIM-UHFFFAOYSA-N 1 0 330.432 3.664 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+][C@H]1CCO[C@H](C2CC2)C1 ZINC000602617029 1033010973 /nfs/dbraw/zinc/01/09/73/1033010973.db2.gz MYFBZVSDBZIPHS-ZFWWWQNUSA-N 1 0 344.333 3.661 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc3c(c2)CCO3)cc1[N+](=O)[O-] ZINC000178233244 1022245976 /nfs/dbraw/zinc/24/59/76/1022245976.db2.gz CFCBXOVQBPBJSD-CQSZACIVSA-N 1 0 326.396 3.731 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000026468218 1033055116 /nfs/dbraw/zinc/05/51/16/1033055116.db2.gz UUHSYJINJVXCEZ-DGCLKSJQSA-N 1 0 339.823 3.697 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000550098074 1022427497 /nfs/dbraw/zinc/42/74/97/1022427497.db2.gz WIDQXLYWRWYVIR-HOCLYGCPSA-N 1 0 334.416 3.587 20 5 EHBDRO COC(=O)CCC[C@H]1CCC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000550098075 1022427856 /nfs/dbraw/zinc/42/78/56/1022427856.db2.gz WIDQXLYWRWYVIR-ZBFHGGJFSA-N 1 0 334.416 3.587 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCCO1 ZINC000602656826 1033056644 /nfs/dbraw/zinc/05/66/44/1033056644.db2.gz YNZXFUBVIRLZCU-HIFRSBDPSA-N 1 0 344.333 3.757 20 5 EHBDRO CCNC(=O)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000156517217 1022495558 /nfs/dbraw/zinc/49/55/58/1022495558.db2.gz JNFJUGDBOSLXOX-AWEZNQCLSA-N 1 0 341.411 3.504 20 5 EHBDRO CCS[C@@H]1CC[C@H]([N@H+](C)Cc2cc(OC)c(F)cc2[N+](=O)[O-])C1 ZINC000184226093 1022587579 /nfs/dbraw/zinc/58/75/79/1022587579.db2.gz WFRQDXZGIGODBT-QWHCGFSZSA-N 1 0 342.436 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC3(C4CCC4)CCC3)CC2)cn1 ZINC000602686752 1033068488 /nfs/dbraw/zinc/06/84/88/1033068488.db2.gz HRBDNDIRMDBRIV-UHFFFAOYSA-N 1 0 344.459 3.519 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCC[C@H](C4CC4)C3)CC2)cn1 ZINC000602692304 1033073062 /nfs/dbraw/zinc/07/30/62/1033073062.db2.gz KLRPKNPIKHOBGC-DOTOQJQBSA-N 1 0 344.459 3.517 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@H]1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000430828657 1022747371 /nfs/dbraw/zinc/74/73/71/1022747371.db2.gz CABBDKZTFJCNOH-NVXWUHKLSA-N 1 0 347.459 3.534 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](CO)C1CCCCC1 ZINC000550276373 1022954251 /nfs/dbraw/zinc/95/42/51/1022954251.db2.gz LGFUJVLFMAICLS-QWSHFYNQSA-N 1 0 332.444 3.777 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000248392859 1023015634 /nfs/dbraw/zinc/01/56/34/1023015634.db2.gz DKNFGLYDYGIMST-ZOBUZTSGSA-N 1 0 331.460 3.898 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CC[C@H]1CCCOC1 ZINC000602720247 1033104859 /nfs/dbraw/zinc/10/48/59/1033104859.db2.gz FRRBUOCBJWIPMT-LLVKDONJSA-N 1 0 332.322 3.520 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(OC3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000276834514 1023131540 /nfs/dbraw/zinc/13/15/40/1023131540.db2.gz BNAGNIJSRNAENO-UHFFFAOYSA-N 1 0 348.443 3.917 20 5 EHBDRO C[C@H]([NH2+]CCc1csc(N2CCCC2)n1)c1ccc([N+](=O)[O-])cc1 ZINC000129533342 1023152555 /nfs/dbraw/zinc/15/25/55/1023152555.db2.gz HEEYMWXZIJZDSR-ZDUSSCGKSA-N 1 0 346.456 3.545 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccccc2C)C1 ZINC000507180880 1023165647 /nfs/dbraw/zinc/16/56/47/1023165647.db2.gz OSZLZQVJNGERBD-HNNXBMFYSA-N 1 0 326.396 3.901 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2ccccc2C)C1 ZINC000507180881 1023165736 /nfs/dbraw/zinc/16/57/36/1023165736.db2.gz OSZLZQVJNGERBD-OAHLLOKOSA-N 1 0 326.396 3.901 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@H](c1ccc(Cl)cc1)C1CCC1 ZINC000341741236 1023228823 /nfs/dbraw/zinc/22/88/23/1023228823.db2.gz JCOVTGJWMNHUJM-HNNXBMFYSA-N 1 0 334.807 3.613 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000506471011 1023232549 /nfs/dbraw/zinc/23/25/49/1023232549.db2.gz OVPOHBGFOKIVKP-IEBWSBKVSA-N 1 0 345.487 3.724 20 5 EHBDRO COc1cccc2c1OC[C@H]([NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000610809816 1023701298 /nfs/dbraw/zinc/70/12/98/1023701298.db2.gz LUZCWPXXQLFFGF-XJKSGUPXSA-N 1 0 342.395 3.566 20 5 EHBDRO COc1ccc(C[N@H+](CCOc2ccc([N+](=O)[O-])cc2)C2CC2)cc1 ZINC000065208954 1023916338 /nfs/dbraw/zinc/91/63/38/1023916338.db2.gz ZBXRBUHLZKPNGF-UHFFFAOYSA-N 1 0 342.395 3.647 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCOC(F)(F)F ZINC000474060855 1023963529 /nfs/dbraw/zinc/96/35/29/1023963529.db2.gz RRFSJPDAXAIDQA-JTQLQIEISA-N 1 0 338.351 3.592 20 5 EHBDRO CC1=NO[C@@H](C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000895311373 1024268460 /nfs/dbraw/zinc/26/84/60/1024268460.db2.gz PPBMEMBZOGWEDB-CQSZACIVSA-N 1 0 331.397 3.578 20 5 EHBDRO CCC(C)(C)[C@@H]1CCC[N@@H+]1CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000441640570 1024277115 /nfs/dbraw/zinc/27/71/15/1024277115.db2.gz ASHNKZOPIAWWTJ-INIZCTEOSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1c(CN(c2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)cccc1[N+](=O)[O-] ZINC000895116068 1024530982 /nfs/dbraw/zinc/53/09/82/1024530982.db2.gz RJPBPMWMLFSMFO-QAQDUYKDSA-N 1 0 340.427 3.575 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH+]2CCC(c3ccccc3)CC2)cc1 ZINC000065534807 1024663583 /nfs/dbraw/zinc/66/35/83/1024663583.db2.gz PVYMHTIQDSYXPO-UHFFFAOYSA-N 1 0 326.396 3.853 20 5 EHBDRO Cc1cc(N2CCC[C@H]2c2ccnn2C)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000895720283 1024764856 /nfs/dbraw/zinc/76/48/56/1024764856.db2.gz VHFZOFCXDHPNKX-KRWDZBQOSA-N 1 0 337.383 3.526 20 5 EHBDRO CCC[C@@H]1CCC[N@H+](CC(=O)Nc2ccc(Cl)c([N+](=O)[O-])c2)C1 ZINC001167958631 1024771823 /nfs/dbraw/zinc/77/18/23/1024771823.db2.gz KQMBHQGZCRUYLR-GFCCVEGCSA-N 1 0 339.823 3.699 20 5 EHBDRO C[NH2+]C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC1 ZINC000435368669 1024851199 /nfs/dbraw/zinc/85/11/99/1024851199.db2.gz BHNWPZLUIXRPRZ-UHFFFAOYSA-N 1 0 331.441 3.507 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2cnn(C)c2c1 ZINC000514980465 1024941017 /nfs/dbraw/zinc/94/10/17/1024941017.db2.gz OEHJBWOEESSDBK-CQSZACIVSA-N 1 0 338.411 3.592 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CC[C@@H](F)C3)o2)c([N+](=O)[O-])c1 ZINC000520879954 1025101313 /nfs/dbraw/zinc/10/13/13/1025101313.db2.gz ZPDJRGGKDXJBJS-VXGBXAGGSA-N 1 0 334.347 3.844 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000327416138 1025167383 /nfs/dbraw/zinc/16/73/83/1025167383.db2.gz YHGYIRZRRDAIJV-UHFFFAOYSA-N 1 0 343.402 3.853 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1Cc2ccccc2N(C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000435994650 1025281100 /nfs/dbraw/zinc/28/11/00/1025281100.db2.gz OTUUPMSRXARGMS-GJZGRUSLSA-N 1 0 325.412 3.554 20 5 EHBDRO CCCCN(C)C(=O)C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000053241432 1025290615 /nfs/dbraw/zinc/29/06/15/1025290615.db2.gz VUWHTVOYBQEUFM-HNNXBMFYSA-N 1 0 347.459 3.626 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC([NH2+]C2CCC2)CC1 ZINC000897980987 1033276134 /nfs/dbraw/zinc/27/61/34/1033276134.db2.gz HMYHCNYBUPHXSY-QINSGFPZSA-N 1 0 329.444 3.605 20 5 EHBDRO C[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)Oc1ccc(Cl)cc1 ZINC000237396404 1025468377 /nfs/dbraw/zinc/46/83/77/1025468377.db2.gz PWLBDXSAJFVREA-JTQLQIEISA-N 1 0 326.805 3.867 20 5 EHBDRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451104127 1025567358 /nfs/dbraw/zinc/56/73/58/1025567358.db2.gz KDOCUGVTWCEVHD-UONOGXRCSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cncc(F)c1 ZINC000521674926 1025578482 /nfs/dbraw/zinc/57/84/82/1025578482.db2.gz UQSPHHCNXJXDSL-LLVKDONJSA-N 1 0 328.347 3.504 20 5 EHBDRO CCN(CCC[NH+](CC)CC)c1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436361571 1025621794 /nfs/dbraw/zinc/62/17/94/1025621794.db2.gz IFGATTYTBBTSRE-UHFFFAOYSA-N 1 0 348.369 3.567 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCCOCC(F)(F)F ZINC000530326358 1025664116 /nfs/dbraw/zinc/66/41/16/1025664116.db2.gz PCPFZHWRNPFPPG-WQLSENKSSA-N 1 0 332.322 3.557 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000127077193 1025680145 /nfs/dbraw/zinc/68/01/45/1025680145.db2.gz VTGPNKKCOKUGPG-OAHLLOKOSA-N 1 0 343.427 3.812 20 5 EHBDRO CCOC(C)(C)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000436414181 1025695019 /nfs/dbraw/zinc/69/50/19/1025695019.db2.gz QJOXJFLEQKFQNW-UHFFFAOYSA-N 1 0 348.399 3.768 20 5 EHBDRO Cc1cc(NC[C@@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302161328 1025795406 /nfs/dbraw/zinc/79/54/06/1025795406.db2.gz JXKIVLIEOZGPKL-GOSISDBHSA-N 1 0 341.342 3.736 20 5 EHBDRO CC(=O)c1ccc(NC[C@@H](c2ccccc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000007982542 1025952934 /nfs/dbraw/zinc/95/29/34/1025952934.db2.gz MLBYRBOPKNQJJG-SFHVURJKSA-N 1 0 327.384 3.512 20 5 EHBDRO C/C=C/C[C@@H](CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000185825318 1025967054 /nfs/dbraw/zinc/96/70/54/1025967054.db2.gz VOELQGUETPTUJC-IBUXWKBASA-N 1 0 332.425 3.740 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C(C)(C)C ZINC000451427333 1025968279 /nfs/dbraw/zinc/96/82/79/1025968279.db2.gz WYEZLQISHKJEBA-CQSZACIVSA-N 1 0 332.404 3.949 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH2+][C@H]1CCC12CCCC2 ZINC000451456907 1025982231 /nfs/dbraw/zinc/98/22/31/1025982231.db2.gz MEJSDTJQMWJBKF-INIZCTEOSA-N 1 0 331.416 3.544 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000522136708 1026016227 /nfs/dbraw/zinc/01/62/27/1026016227.db2.gz OSUKRNVGFBQCRQ-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO C[C@@H](CCCc1cccnc1)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840775538 1026148850 /nfs/dbraw/zinc/14/88/50/1026148850.db2.gz QGPSJWAUCZXWGE-KBPBESRZSA-N 1 0 328.416 3.634 20 5 EHBDRO Cc1cccc(CC[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000475284236 1026440799 /nfs/dbraw/zinc/44/07/99/1026440799.db2.gz WEKCWWGMHXPTLX-QFBILLFUSA-N 1 0 339.439 3.842 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)cc1O ZINC000562081244 1026523864 /nfs/dbraw/zinc/52/38/64/1026523864.db2.gz LHXJUNVNHSGBBB-AWEZNQCLSA-N 1 0 344.411 3.983 20 5 EHBDRO COC1(C[NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCCCC1 ZINC000479418915 1026626735 /nfs/dbraw/zinc/62/67/35/1026626735.db2.gz GVTKJNPOTOVXKL-UHFFFAOYSA-N 1 0 344.358 3.635 20 5 EHBDRO Cc1cccc2c1OC[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])C2 ZINC000582636347 1026833515 /nfs/dbraw/zinc/83/35/15/1026833515.db2.gz JHFDRTMZHKQOSI-QAPCUYQASA-N 1 0 340.423 3.818 20 5 EHBDRO Cc1cccc([C@@H]2CCCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)c1 ZINC000472239346 1026889616 /nfs/dbraw/zinc/88/96/16/1026889616.db2.gz IHTKVTNXNINRMI-SFHVURJKSA-N 1 0 328.416 3.717 20 5 EHBDRO C[C@@H](NC(=O)c1cc2ccccc2c2cccnc12)C1=CC[N@H+](C)CC1 ZINC000272949628 1027192170 /nfs/dbraw/zinc/19/21/70/1027192170.db2.gz MRAIMZSQIOPHEJ-OAHLLOKOSA-N 1 0 345.446 3.768 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@@H]([NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000531725935 1027246469 /nfs/dbraw/zinc/24/64/69/1027246469.db2.gz LLNSEAKZWSTOLP-WRJNIWILSA-N 1 0 338.473 3.634 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000127704610 1027345929 /nfs/dbraw/zinc/34/59/29/1027345929.db2.gz XSIABJYVBMFKRT-CJNGLKHVSA-N 1 0 330.384 3.590 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000729630400 1027357134 /nfs/dbraw/zinc/35/71/34/1027357134.db2.gz JOBWWDKAYLYMAF-UHFFFAOYSA-N 1 0 334.445 3.514 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000302755987 1027454183 /nfs/dbraw/zinc/45/41/83/1027454183.db2.gz GDPGUKBJAMHOOU-OAHLLOKOSA-N 1 0 331.803 3.935 20 5 EHBDRO C[NH+](C)[C@H]1CC[C@H](Oc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC001225610593 1027613901 /nfs/dbraw/zinc/61/39/01/1027613901.db2.gz QUFATESRGCWHCA-XYPYZODXSA-N 1 0 343.221 3.609 20 5 EHBDRO C[NH+](C)C1CCC(Nc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CC1 ZINC000420628108 1027652052 /nfs/dbraw/zinc/65/20/52/1027652052.db2.gz PBLRHHZSHHCJJC-UHFFFAOYSA-N 1 0 331.338 3.898 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CC2(c3ccccc3)CCCC2)c1 ZINC000016849078 1027785629 /nfs/dbraw/zinc/78/56/29/1027785629.db2.gz QYIXIGQINWZTLH-LJQANCHMSA-N 1 0 340.423 3.730 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(N2CCc3ccccc32)CC1 ZINC000502308976 1028109301 /nfs/dbraw/zinc/10/93/01/1028109301.db2.gz HZBFEHNUGCCFKD-UHFFFAOYSA-N 1 0 337.423 3.622 20 5 EHBDRO CCC[N@H+](CCc1cccs1)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444684048 1028154881 /nfs/dbraw/zinc/15/48/81/1028154881.db2.gz KDCNKWCAJNRVTK-UHFFFAOYSA-N 1 0 344.440 3.987 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H]3CCC[C@H]3c3ccccc3)nc2c1 ZINC000444684581 1028156671 /nfs/dbraw/zinc/15/66/71/1028156671.db2.gz NDPWTPLOQVIPRX-HOTGVXAUSA-N 1 0 336.395 3.897 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000137212414 1028198250 /nfs/dbraw/zinc/19/82/50/1028198250.db2.gz OQWNRBCHTACTGF-LLVKDONJSA-N 1 0 333.775 3.538 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000423484127 1028474757 /nfs/dbraw/zinc/47/47/57/1028474757.db2.gz TZJAXMFUCKRMCZ-SFHVURJKSA-N 1 0 325.412 3.596 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-n2ccnc2)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000153673379 1028556240 /nfs/dbraw/zinc/55/62/40/1028556240.db2.gz KOEJXIZSDLLPNI-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CCc2cccnc2CC1 ZINC000421835788 1028827571 /nfs/dbraw/zinc/82/75/71/1028827571.db2.gz FXJWHQKOGNXIOE-MRXNPFEDSA-N 1 0 345.830 3.723 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)C1 ZINC000475630563 1028924591 /nfs/dbraw/zinc/92/45/91/1028924591.db2.gz GVUDRGNISXPOED-HNNXBMFYSA-N 1 0 334.416 3.719 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000504899740 1029042007 /nfs/dbraw/zinc/04/20/07/1029042007.db2.gz LISZDSVWIXGMLD-GOEBONIOSA-N 1 0 337.464 3.620 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)c1ccccc1 ZINC000504919525 1029045716 /nfs/dbraw/zinc/04/57/16/1029045716.db2.gz KTBSIYZADHUFGO-JKSUJKDBSA-N 1 0 346.452 3.789 20 5 EHBDRO CC[C@@](C)(CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000152173186 1029296769 /nfs/dbraw/zinc/29/67/69/1029296769.db2.gz YXQMYLCESIEVPF-INIZCTEOSA-N 1 0 338.791 3.759 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+]C[C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000237450600 1029309046 /nfs/dbraw/zinc/30/90/46/1029309046.db2.gz OJVHXNQSEAXIIR-CQSZACIVSA-N 1 0 346.452 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+](CCO)C3CCCC3)o2)cc1 ZINC000505276153 1029432690 /nfs/dbraw/zinc/43/26/90/1029432690.db2.gz AUBPHYUKLRRJLO-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO CC[C@H](C)[C@](C)(O)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513821043 1029522209 /nfs/dbraw/zinc/52/22/09/1029522209.db2.gz AXEMMGWPMLGEHO-MFWIUYSUSA-N 1 0 334.460 3.693 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)s1 ZINC000525122505 1029694980 /nfs/dbraw/zinc/69/49/80/1029694980.db2.gz IIDXBUDFIRTVRO-CYBMUJFWSA-N 1 0 349.456 3.994 20 5 EHBDRO COC[C@@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(C)C ZINC000525194882 1029739493 /nfs/dbraw/zinc/73/94/93/1029739493.db2.gz IKKMSRVULBVBGG-MRXNPFEDSA-N 1 0 348.399 3.624 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NCCC[NH+]1CCCCCC1 ZINC000475645555 1029830513 /nfs/dbraw/zinc/83/05/13/1029830513.db2.gz CTVICEXEFDPVOQ-UHFFFAOYSA-N 1 0 348.447 3.599 20 5 EHBDRO CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000525409896 1029839695 /nfs/dbraw/zinc/83/96/95/1029839695.db2.gz WRJHQJGHRPQAEU-KZNAEPCWSA-N 1 0 332.444 3.663 20 5 EHBDRO CCOC(=O)[C@]1(C(C)C)CC[N@H+](C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000446890942 1029842287 /nfs/dbraw/zinc/84/22/87/1029842287.db2.gz RKEAYSJBNSWOIL-GXVATQTDSA-N 1 0 346.427 3.519 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cc1[N+](=O)[O-] ZINC000385119475 1029860260 /nfs/dbraw/zinc/86/02/60/1029860260.db2.gz CKCBDJQYNWBZLV-VQIMIIECSA-N 1 0 339.439 3.828 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CC[C@H](Cc3ccccc3)C2)cc1 ZINC000525634474 1029986141 /nfs/dbraw/zinc/98/61/41/1029986141.db2.gz WYMAJKACHXSDHN-QGZVFWFLSA-N 1 0 326.396 3.538 20 5 EHBDRO CC[C@H](COCC(F)(F)F)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000453255097 1029986279 /nfs/dbraw/zinc/98/62/79/1029986279.db2.gz KLAHAFJFFJMIAM-IUODEOHRSA-N 1 0 346.349 3.919 20 5 EHBDRO Cc1nn(C)c(C)c1C[C@@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192902788 1030013105 /nfs/dbraw/zinc/01/31/05/1030013105.db2.gz ZRMNDWGNGOGSDT-BLVKFPJESA-N 1 0 342.443 3.543 20 5 EHBDRO CCc1ccc([C@@H](NC[C@H]2CCCO2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453294042 1030039567 /nfs/dbraw/zinc/03/95/67/1030039567.db2.gz WBHJMPLYWWQCEY-AEFFLSMTSA-N 1 0 330.384 3.608 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000572975213 1030100217 /nfs/dbraw/zinc/10/02/17/1030100217.db2.gz OPNVPFILTZFTEL-ZAAXVRCTSA-N 1 0 338.407 3.950 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCC(C)CC1 ZINC000481971115 1030141622 /nfs/dbraw/zinc/14/16/22/1030141622.db2.gz FZJNZOJECPVUPP-LPHOPBHVSA-N 1 0 345.487 3.626 20 5 EHBDRO CC[NH+](CC)CCSCc1ccc(Br)c([N+](=O)[O-])c1 ZINC000159469255 1030227352 /nfs/dbraw/zinc/22/73/52/1030227352.db2.gz YCCIFDLBHPBNPP-UHFFFAOYSA-N 1 0 347.278 3.932 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CCc2ccc(Cl)cc2)n1 ZINC000447518592 1030241119 /nfs/dbraw/zinc/24/11/19/1030241119.db2.gz OBXPBFHSRWQPSL-JKSUJKDBSA-N 1 0 348.834 3.761 20 5 EHBDRO COc1ccc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447522391 1030244096 /nfs/dbraw/zinc/24/40/96/1030244096.db2.gz YMNAMIWPKCAPCU-IBGZPJMESA-N 1 0 326.396 3.813 20 5 EHBDRO CC(C)(C[NH2+][C@@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccs1 ZINC000447529087 1030250455 /nfs/dbraw/zinc/25/04/55/1030250455.db2.gz LBMPAUBUZRGHTB-ZIAGYGMSSA-N 1 0 348.472 3.904 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C/C=C/c2ccccc2)n1 ZINC000447530370 1030252210 /nfs/dbraw/zinc/25/22/10/1030252210.db2.gz MLEHNONCUYVXRM-QOCAVEGASA-N 1 0 326.400 3.578 20 5 EHBDRO CC(C)[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1nccs1 ZINC000159864658 1030396855 /nfs/dbraw/zinc/39/68/55/1030396855.db2.gz SICKNUQXQUKTKG-UHFFFAOYSA-N 1 0 349.456 3.773 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H](c2ccc(Cl)cc2)[NH+](C)C)n1 ZINC000532217626 1030485888 /nfs/dbraw/zinc/48/58/88/1030485888.db2.gz BKWBTXMKZLTMFI-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO CCC[C@H](C)[C@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000532267981 1030514633 /nfs/dbraw/zinc/51/46/33/1030514633.db2.gz PLWBTDCXRCYIBG-SUMWQHHRSA-N 1 0 334.416 3.862 20 5 EHBDRO CCn1nc(C)c(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)c1C ZINC000527038641 1030586903 /nfs/dbraw/zinc/58/69/03/1030586903.db2.gz RBOYTODWGFNRQX-LCYFTJDESA-N 1 0 328.416 3.621 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCO1 ZINC000160559187 1030852469 /nfs/dbraw/zinc/85/24/69/1030852469.db2.gz JFFNETKOKOLSJX-AWEZNQCLSA-N 1 0 330.384 3.902 20 5 EHBDRO Cc1nn(C)c(C)c1[C@H]1CCC[N@H+]1[C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000247154662 1030917291 /nfs/dbraw/zinc/91/72/91/1030917291.db2.gz LVNYKBKOEYOYGB-CXAGYDPISA-N 1 0 328.416 3.843 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC2(O)CCC2)s1 ZINC000551234971 1031149161 /nfs/dbraw/zinc/14/91/61/1031149161.db2.gz JHMNVMLXOLZJAK-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2)cc1[N+](=O)[O-] ZINC000161104498 1031319220 /nfs/dbraw/zinc/31/92/20/1031319220.db2.gz JADVHWSIPTVMAQ-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO CC1(C)C[N@H+](CCOc2ccccc2[N+](=O)[O-])CC[C@H]1C(F)(F)F ZINC000484359536 1031543886 /nfs/dbraw/zinc/54/38/86/1031543886.db2.gz WACYWFRJKSSSNJ-CQSZACIVSA-N 1 0 346.349 3.884 20 5 EHBDRO C[C@@H](NCc1ccc(C(F)(F)F)cn1)c1ccccc1[N+](=O)[O-] ZINC000278616980 1031666089 /nfs/dbraw/zinc/66/60/89/1031666089.db2.gz FUJVGHDNSJNOCV-SNVBAGLBSA-N 1 0 325.290 3.859 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](c2nc(C)no2)C1 ZINC000347365246 1031900158 /nfs/dbraw/zinc/90/01/58/1031900158.db2.gz SZUBITLGGQRBPE-WQMJKPAKSA-N 1 0 342.399 3.569 20 5 EHBDRO COc1ccc(OC)c([C@H](C)[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000594489568 1033394700 /nfs/dbraw/zinc/39/47/00/1033394700.db2.gz DBLAHPLPVKHPGT-SJCJKPOMSA-N 1 0 342.395 3.950 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCc3ccccc3NC2=O)cccc1[N+](=O)[O-] ZINC000594511761 1033415553 /nfs/dbraw/zinc/41/55/53/1033415553.db2.gz OHMDYVIFFFRNFH-DYVFJYSZSA-N 1 0 339.395 3.507 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ncc(C)cc2C)cc1[N+](=O)[O-] ZINC000594509715 1033415716 /nfs/dbraw/zinc/41/57/16/1033415716.db2.gz LLNSFGWDSHOYCZ-HNNXBMFYSA-N 1 0 343.427 3.899 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H](C2CC2)[C@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000594512884 1033417521 /nfs/dbraw/zinc/41/75/21/1033417521.db2.gz SKUPXPACVHQJSS-BKTGTZMESA-N 1 0 348.443 3.992 20 5 EHBDRO CN(Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)CC(C)(C)[NH3+] ZINC000594736901 1033510709 /nfs/dbraw/zinc/51/07/09/1033510709.db2.gz XQWFZULJEXESKG-UHFFFAOYSA-N 1 0 347.390 3.695 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC1(CCO)CCCCC1 ZINC000595018399 1033610933 /nfs/dbraw/zinc/61/09/33/1033610933.db2.gz NNOUWQYEZUTNAH-AWEZNQCLSA-N 1 0 336.432 3.587 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H](OC)c1ccccc1 ZINC000595019475 1033611014 /nfs/dbraw/zinc/61/10/14/1033611014.db2.gz WKHINPOVEZNQTB-SCLBCKFNSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](OC)c1ccccc1 ZINC000595019474 1033612259 /nfs/dbraw/zinc/61/22/59/1033612259.db2.gz WKHINPOVEZNQTB-FZKQIMNGSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1cccc([C@H](C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])OC)c1 ZINC000598986459 1033612575 /nfs/dbraw/zinc/61/25/75/1033612575.db2.gz AGIPPNRHAXPGSX-QBUQCISBSA-N 1 0 342.395 3.594 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000595021003 1033614602 /nfs/dbraw/zinc/61/46/02/1033614602.db2.gz WIGLJFOYVGJDML-KGLIPLIRSA-N 1 0 342.395 3.820 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)N[C@@H]1COc2ccc(C)cc21 ZINC000595022883 1033617532 /nfs/dbraw/zinc/61/75/32/1033617532.db2.gz QDWJLKHZQJMGCF-BLLLJJGKSA-N 1 0 328.368 3.696 20 5 EHBDRO CCC(CC)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)[NH+](C)C ZINC000603438482 1033630200 /nfs/dbraw/zinc/63/02/00/1033630200.db2.gz QVRYYSWTNBDHLZ-KRWDZBQOSA-N 1 0 330.432 3.921 20 5 EHBDRO COc1cccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595009231 1033632540 /nfs/dbraw/zinc/63/25/40/1033632540.db2.gz FXSDNNJBQDVEFB-ZDUSSCGKSA-N 1 0 330.384 3.505 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1cnc(C(F)(F)F)nc1 ZINC000595062271 1033639239 /nfs/dbraw/zinc/63/92/39/1033639239.db2.gz VCJLVJFQJPWWFB-JTQLQIEISA-N 1 0 340.305 3.563 20 5 EHBDRO CCC[C@H]([NH2+][C@@H]1CCC[C@H]([S@](C)=O)C1)c1cccc([N+](=O)[O-])c1 ZINC000595061444 1033640156 /nfs/dbraw/zinc/64/01/56/1033640156.db2.gz KZFGMRYJRFBBSB-FFBQQKEYSA-N 1 0 338.473 3.715 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@H]1CCCO[C@@H]1C(C)C ZINC000595027545 1033648957 /nfs/dbraw/zinc/64/89/57/1033648957.db2.gz POLMXNIBWHSCIP-SUNYJGFJSA-N 1 0 336.432 3.705 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCC1CCC(OC)CC1 ZINC000595034544 1033655309 /nfs/dbraw/zinc/65/53/09/1033655309.db2.gz XUJUKBVSCRHEOH-HLIUYOAVSA-N 1 0 336.432 3.849 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2C(C)(C)C2(F)F)cc1[N+](=O)[O-] ZINC000595092579 1033700292 /nfs/dbraw/zinc/70/02/92/1033700292.db2.gz LEBDJAFMXQIWAW-QMTHXVAHSA-N 1 0 328.359 3.935 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCc2ccc(O)cc21 ZINC000595092837 1033700494 /nfs/dbraw/zinc/70/04/94/1033700494.db2.gz XJRDASLKEUTIPF-SCLBCKFNSA-N 1 0 326.396 3.899 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)OC)c1 ZINC000599061114 1033700987 /nfs/dbraw/zinc/70/09/87/1033700987.db2.gz KQZXMMOYKMVNSH-AUUYWEPGSA-N 1 0 344.411 3.950 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCc2ccc(O)cc21 ZINC000595092835 1033701783 /nfs/dbraw/zinc/70/17/83/1033701783.db2.gz XJRDASLKEUTIPF-ACJLOTCBSA-N 1 0 326.396 3.899 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](n1cccn1)C(F)(F)F ZINC000599053930 1033706158 /nfs/dbraw/zinc/70/61/58/1033706158.db2.gz BAMDBHGJVIUABI-BXUZGUMPSA-N 1 0 342.321 3.554 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CC(C)(C)c1ccc(C)cn1 ZINC000599069711 1033710592 /nfs/dbraw/zinc/71/05/92/1033710592.db2.gz VGTSHZKPPUTUSJ-CQSZACIVSA-N 1 0 343.427 3.935 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000078559574 1033713059 /nfs/dbraw/zinc/71/30/59/1033713059.db2.gz NBHUPPCGJWDACD-GFCCVEGCSA-N 1 0 345.365 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H]1CCN1C1CCCC1)CCC2 ZINC000599074672 1033716706 /nfs/dbraw/zinc/71/67/06/1033716706.db2.gz UFNNVVQHAAJIFI-MJGOQNOKSA-N 1 0 329.444 3.579 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CO[C@H](C3CC3)C2)c2ccccc2)c1 ZINC000599085129 1033723342 /nfs/dbraw/zinc/72/33/42/1033723342.db2.gz NEHJSEGGHLAPDA-YZGWKJHDSA-N 1 0 338.407 3.841 20 5 EHBDRO CO[C@H]1C[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000599090588 1033728769 /nfs/dbraw/zinc/72/87/69/1033728769.db2.gz FMTYHWCHZUYXLP-KYNGSXCRSA-N 1 0 326.396 3.699 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@H]1CC[N@@H+]1C1CCCCC1 ZINC000599127994 1033748422 /nfs/dbraw/zinc/74/84/22/1033748422.db2.gz TXGVADRGIUEQMM-QGZVFWFLSA-N 1 0 333.432 3.560 20 5 EHBDRO C[C@H](COCC1CC1)[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000593682501 1033753515 /nfs/dbraw/zinc/75/35/15/1033753515.db2.gz QSSMKXCVBZNDSI-CYBMUJFWSA-N 1 0 330.384 3.760 20 5 EHBDRO C[C@@H]1CC[C@@H](C)[NH+]1[C@@H]1CCCN(Cc2ccc(F)cc2[N+](=O)[O-])C1 ZINC000595363639 1033781658 /nfs/dbraw/zinc/78/16/58/1033781658.db2.gz FWYGDDRWLMOICJ-CKEIUWERSA-N 1 0 335.423 3.571 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](Cc1ccccc1)[C@@H](CO)C1CC1 ZINC000595389158 1033787258 /nfs/dbraw/zinc/78/72/58/1033787258.db2.gz LWQQTGLXLNKICL-IBGZPJMESA-N 1 0 344.386 3.507 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCSc1cccc(Cl)c1)CC2 ZINC000595424455 1033795427 /nfs/dbraw/zinc/79/54/27/1033795427.db2.gz MWVIKFKWBDFSJU-UHFFFAOYSA-N 1 0 349.843 3.794 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](C)c2ccc(C)cc2)c1 ZINC000593020575 1033825139 /nfs/dbraw/zinc/82/51/39/1033825139.db2.gz PCXXSNNNWDGPQB-ZDUSSCGKSA-N 1 0 328.368 3.541 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1(CO)CCC1 ZINC000593719045 1033834436 /nfs/dbraw/zinc/83/44/36/1033834436.db2.gz UGZYALNUHKTKAI-CQSZACIVSA-N 1 0 338.473 3.608 20 5 EHBDRO CN(Cc1ccc(F)cc1[N+](=O)[O-])[C@H](CO)c1ccc(Cl)cc1 ZINC000595511514 1033836830 /nfs/dbraw/zinc/83/68/30/1033836830.db2.gz SDQUIYOTGKEWTH-MRXNPFEDSA-N 1 0 338.766 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCn3cccn3)s2)cc1 ZINC000102420932 1033839367 /nfs/dbraw/zinc/83/93/67/1033839367.db2.gz OXQWDAPQQGOGBK-UHFFFAOYSA-N 1 0 342.424 3.700 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)C1CCC(F)CC1 ZINC000595818812 1033992859 /nfs/dbraw/zinc/99/28/59/1033992859.db2.gz JZRLFDXNJZLIAA-DCBWTQNWSA-N 1 0 348.378 3.651 20 5 EHBDRO COc1cccc(C[C@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000603936114 1034052446 /nfs/dbraw/zinc/05/24/46/1034052446.db2.gz FVQFIFJQMKFMRD-OAHLLOKOSA-N 1 0 332.425 3.872 20 5 EHBDRO O=[N+]([O-])c1cc(NC[C@@H]2CC[N@@H+](C3CC3)C2)ccc1C(F)(F)F ZINC000596079346 1034070373 /nfs/dbraw/zinc/07/03/73/1034070373.db2.gz OUZAZLXXZAJNAL-JTQLQIEISA-N 1 0 329.322 3.510 20 5 EHBDRO CCC[N@H+](CCn1cc([N+](=O)[O-])ccc1=O)[C@H](CC)c1ccccc1 ZINC000534134929 1034177533 /nfs/dbraw/zinc/17/75/33/1034177533.db2.gz YJQGTJREBCSQGT-GOSISDBHSA-N 1 0 343.427 3.620 20 5 EHBDRO C[NH+](C)CC1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450394339 1034233092 /nfs/dbraw/zinc/23/30/92/1034233092.db2.gz SIBCULIZBSZVNQ-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000179375562 1034257595 /nfs/dbraw/zinc/25/75/95/1034257595.db2.gz GTKIOQYBLLGLSL-VXGBXAGGSA-N 1 0 347.440 3.951 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NCC3CC[NH+](CC4CC4)CC3)ccnc21 ZINC000596562714 1034290480 /nfs/dbraw/zinc/29/04/80/1034290480.db2.gz OOGWGFQAXUDSOU-UHFFFAOYSA-N 1 0 340.427 3.677 20 5 EHBDRO C[C@H](NCC12CC(C1)C[NH2+]2)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596655887 1034330490 /nfs/dbraw/zinc/33/04/90/1034330490.db2.gz ZDMPELIFBZGXLF-ZVLZOBCMSA-N 1 0 343.452 3.726 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@H]2CCOC2)ccc1Oc1ccc(F)cc1 ZINC000604419099 1034370827 /nfs/dbraw/zinc/37/08/27/1034370827.db2.gz GQHPCAYKEXXNID-CQSZACIVSA-N 1 0 346.358 3.652 20 5 EHBDRO O=[N+]([O-])c1cccc(OCC[N@H+]2CCC[C@@H]2c2ccc(O)cc2)c1 ZINC000604484186 1034388619 /nfs/dbraw/zinc/38/86/19/1034388619.db2.gz CNHSJGNVLHAVGU-GOSISDBHSA-N 1 0 328.368 3.516 20 5 EHBDRO CC(C)c1ccc(CNC2CC[NH+](C3CCC3)CC2)cc1[N+](=O)[O-] ZINC000604532697 1034414002 /nfs/dbraw/zinc/41/40/02/1034414002.db2.gz TVZUESLAVQTIBP-UHFFFAOYSA-N 1 0 331.460 3.825 20 5 EHBDRO COc1ccc(C[N@H+](C[C@H]2CCCO2)C2CCCC2)cc1[N+](=O)[O-] ZINC000075831757 1034443248 /nfs/dbraw/zinc/44/32/48/1034443248.db2.gz GACXHYSQPWCTEE-MRXNPFEDSA-N 1 0 334.416 3.527 20 5 EHBDRO COc1cc(C[NH2+]C2CC(C)(C)C2)c([N+](=O)[O-])cc1OCC(F)F ZINC000597239422 1034618727 /nfs/dbraw/zinc/61/87/27/1034618727.db2.gz KUAPFQVKXWOLAG-UHFFFAOYSA-N 1 0 344.358 3.526 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC([C@H]2CCCCO2)CC1 ZINC000597225011 1034625953 /nfs/dbraw/zinc/62/59/53/1034625953.db2.gz LOTZPSJAFNQSCE-SUOMESGTSA-N 1 0 330.428 3.889 20 5 EHBDRO C[NH2+]Cc1ccccc1C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000593321993 1034645420 /nfs/dbraw/zinc/64/54/20/1034645420.db2.gz KPZWVGCZLJMXNR-LJQANCHMSA-N 1 0 339.439 3.826 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]Cc2ccc(O)c(OC)c2[N+](=O)[O-])cc1 ZINC000892479826 1034666609 /nfs/dbraw/zinc/66/66/09/1034666609.db2.gz PUXTUOFNQDQQGX-LBPRGKRZSA-N 1 0 346.383 3.559 20 5 EHBDRO C[N@@H+]1CCC[C@@H]1CCSc1ccc(Br)cc1[N+](=O)[O-] ZINC000534608009 1034724161 /nfs/dbraw/zinc/72/41/61/1034724161.db2.gz MCTAGQANPXKBBT-LLVKDONJSA-N 1 0 345.262 3.934 20 5 EHBDRO COCCOCc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1 ZINC000290171207 1035017182 /nfs/dbraw/zinc/01/71/82/1035017182.db2.gz QZMBCWPIVUQKAC-OAHLLOKOSA-N 1 0 344.411 3.609 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCc2ccccn2)c2ccccc2)c1 ZINC000179966959 1035095478 /nfs/dbraw/zinc/09/54/78/1035095478.db2.gz DTSPELOIYVHPOY-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)cs1 ZINC000365503326 1035367046 /nfs/dbraw/zinc/36/70/46/1035367046.db2.gz DYWHUGCMYRGASP-AWEZNQCLSA-N 1 0 331.441 3.663 20 5 EHBDRO CC(C)([NH2+]C[C@H]1CCOc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000613042876 1035369977 /nfs/dbraw/zinc/36/99/77/1035369977.db2.gz ZSTFKLWSAYPJFY-CQSZACIVSA-N 1 0 326.396 3.986 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1CCCCC12CCCC2 ZINC000463451086 1035519329 /nfs/dbraw/zinc/51/93/29/1035519329.db2.gz FGTADNTVMXDIQM-MRXNPFEDSA-N 1 0 345.443 3.934 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccccc2[N+](=O)[O-])cc1OC ZINC000045004340 1035600898 /nfs/dbraw/zinc/60/08/98/1035600898.db2.gz BTFLIHAKJSPYJL-MRXNPFEDSA-N 1 0 342.395 3.949 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](CO)c1ccc(Cl)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000588232396 1035832780 /nfs/dbraw/zinc/83/27/80/1035832780.db2.gz DFBNJBUEYFRTNI-DOMZBBRYSA-N 1 0 334.803 3.675 20 5 EHBDRO CCOC[C@@H]1CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000180154130 1035919754 /nfs/dbraw/zinc/91/97/54/1035919754.db2.gz XDDRNGFZXLRDQO-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO CCCC[C@H]1CCC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000460347908 1035927469 /nfs/dbraw/zinc/92/74/69/1035927469.db2.gz DSRCGZRVXRABCS-LSDHHAIUSA-N 1 0 333.432 3.872 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@@H](OC)C23CCC3)cc1[N+](=O)[O-] ZINC000414188420 1035956385 /nfs/dbraw/zinc/95/63/85/1035956385.db2.gz QGHPNFFBJXXYNY-JCURWCKSSA-N 1 0 334.416 3.602 20 5 EHBDRO CC[C@H]([NH2+][C@H]1Cc2cccc(OC)c2C1)c1cccc([N+](=O)[O-])c1 ZINC000414191927 1035976869 /nfs/dbraw/zinc/97/68/69/1035976869.db2.gz SDVDIRBGXOGOJK-YJBOKZPZSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000463956877 1035997654 /nfs/dbraw/zinc/99/76/54/1035997654.db2.gz CLNKKEYXEGWIAF-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO Cc1c(C[N@H+](Cc2ccccc2)[C@H](CO)C2CC2)cccc1[N+](=O)[O-] ZINC000535091580 1036017618 /nfs/dbraw/zinc/01/76/18/1036017618.db2.gz FYFVCLQVJAQYRW-HXUWFJFHSA-N 1 0 340.423 3.676 20 5 EHBDRO C[NH2+]Cc1cccc(NC(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)c1 ZINC000457362497 1036028946 /nfs/dbraw/zinc/02/89/46/1036028946.db2.gz CUMKNSBNSHULOA-UHFFFAOYSA-N 1 0 327.384 3.690 20 5 EHBDRO CCOc1cc(C[NH2+]C2(c3ccc(OC)cc3)CC2)ccc1[N+](=O)[O-] ZINC000492608950 1036042491 /nfs/dbraw/zinc/04/24/91/1036042491.db2.gz RSTKTODWWXRXCT-UHFFFAOYSA-N 1 0 342.395 3.781 20 5 EHBDRO CC(C)(C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)OCC1CC1 ZINC000414249888 1036276939 /nfs/dbraw/zinc/27/69/39/1036276939.db2.gz AYAQUNZRUNSVQI-KRWDZBQOSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCC[C@H](C[C@@H]2CCOC2)C1 ZINC000589200177 1036305280 /nfs/dbraw/zinc/30/52/80/1036305280.db2.gz VQUVAWFZZFZSGV-YQIFSTGGSA-N 1 0 330.428 3.747 20 5 EHBDRO Cc1c(C[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000589317764 1036356803 /nfs/dbraw/zinc/35/68/03/1036356803.db2.gz LLFZCHMDKAMTEB-UHFFFAOYSA-N 1 0 340.301 3.917 20 5 EHBDRO CC(C)(C)[C@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1ccccc1 ZINC000054397277 1036364392 /nfs/dbraw/zinc/36/43/92/1036364392.db2.gz XUBLTDOAGQWPNA-QGZVFWFLSA-N 1 0 341.411 3.571 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccccc2)CCOCC1 ZINC000541776655 1036628969 /nfs/dbraw/zinc/62/89/69/1036628969.db2.gz SFDGVNMDWFOBTQ-UHFFFAOYSA-N 1 0 326.396 3.699 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[NH+](C)C)c2)c1C ZINC000888137971 1036700885 /nfs/dbraw/zinc/70/08/85/1036700885.db2.gz GTQFQYVEIUDSOI-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000590165660 1036781688 /nfs/dbraw/zinc/78/16/88/1036781688.db2.gz BPVYMZOTHZVFBN-CYBMUJFWSA-N 1 0 345.365 3.576 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1cccc(F)c1 ZINC000152826433 1036825892 /nfs/dbraw/zinc/82/58/92/1036825892.db2.gz RYDFEDLLZVVWBG-UHFFFAOYSA-N 1 0 345.374 3.585 20 5 EHBDRO CCC[C@]1(C)CCC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])C1 ZINC000464842664 1036880630 /nfs/dbraw/zinc/88/06/30/1036880630.db2.gz KGIZDQKFFCSGJJ-GOSISDBHSA-N 1 0 333.432 3.826 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCCC1(C)C)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000191290591 1036889657 /nfs/dbraw/zinc/88/96/57/1036889657.db2.gz GKIYEJFGJXXJCQ-BXUZGUMPSA-N 1 0 330.388 3.874 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]2C[NH+]2CCCCC2)cc1Cl ZINC000761505982 1037088708 /nfs/dbraw/zinc/08/87/08/1037088708.db2.gz KIDLHIPLIDQFEW-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]CCOc2ccccc2[N+](=O)[O-])c1 ZINC000180708067 1037110662 /nfs/dbraw/zinc/11/06/62/1037110662.db2.gz KVUZTLHVMTWXJY-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@H]2Cc3cccc(O)c3C2)cc1[N+](=O)[O-] ZINC000428556499 1037158559 /nfs/dbraw/zinc/15/85/59/1037158559.db2.gz DTGAAAATOXRHLY-HNNXBMFYSA-N 1 0 326.396 3.681 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000193024451 1037251804 /nfs/dbraw/zinc/25/18/04/1037251804.db2.gz CEVOBRLZLLUOEO-HOTGVXAUSA-N 1 0 333.457 4.000 20 5 EHBDRO C[N@H+](C/C=C\c1ccccc1[N+](=O)[O-])[C@H](CCO)c1ccccc1 ZINC000539826868 1037252093 /nfs/dbraw/zinc/25/20/93/1037252093.db2.gz CTVPUZGPAFOGBW-RLGIIYIFSA-N 1 0 326.396 3.664 20 5 EHBDRO C[C@H]1OCC[C@@]1(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000542314675 1037280458 /nfs/dbraw/zinc/28/04/58/1037280458.db2.gz VKHIKGRWAXNFNI-SJKOYZFVSA-N 1 0 332.425 3.980 20 5 EHBDRO Cc1cc(C[NH+](C)C)ccc1NC(=O)c1cc([N+](=O)[O-])ccc1Cl ZINC001299195479 1037285230 /nfs/dbraw/zinc/28/52/30/1037285230.db2.gz JXQDRNWBZQDPTL-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO Cc1cc(N2CC[NH+]([C@H](C)c3ccsc3)CC2)ccc1[N+](=O)[O-] ZINC000462694775 1037287286 /nfs/dbraw/zinc/28/72/86/1037287286.db2.gz HDHBXFYMQLKKHW-CQSZACIVSA-N 1 0 331.441 3.848 20 5 EHBDRO Cc1ccnc(NCC[C@H](C)[N@H+](C)Cc2ccccc2)c1[N+](=O)[O-] ZINC000348350803 1037292928 /nfs/dbraw/zinc/29/29/28/1037292928.db2.gz OYMMHRXSAFRNBT-HNNXBMFYSA-N 1 0 328.416 3.621 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591267707 1037311358 /nfs/dbraw/zinc/31/13/58/1037311358.db2.gz DEKCYEXBJJWOMD-MRXNPFEDSA-N 1 0 340.427 3.617 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000163410796 1037381155 /nfs/dbraw/zinc/38/11/55/1037381155.db2.gz XTSAZFUQMBCSMZ-DOMZBBRYSA-N 1 0 330.388 3.703 20 5 EHBDRO Cc1cn2c(n1)[C@@H](C[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)CCC2 ZINC000532538078 1037565590 /nfs/dbraw/zinc/56/55/90/1037565590.db2.gz XLAUKQLNFHMHDJ-HUUCEWRRSA-N 1 0 328.416 3.636 20 5 EHBDRO Cc1ccc(NC(=O)NCCCC[N@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000045951303 1037581059 /nfs/dbraw/zinc/58/10/59/1037581059.db2.gz XMCSYCHBGJTHLI-AWEZNQCLSA-N 1 0 348.447 3.537 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2c3cc(F)ccc3C[C@H]2C)cc1[N+](=O)[O-] ZINC000540173946 1037641585 /nfs/dbraw/zinc/64/15/85/1037641585.db2.gz NLMBMVKLTCKRAJ-ADLMAVQZSA-N 1 0 330.359 3.766 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc(C)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000463053126 1037704381 /nfs/dbraw/zinc/70/43/81/1037704381.db2.gz IKFVKPMWHZFXQV-KRWDZBQOSA-N 1 0 342.443 3.663 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221651 1037780764 /nfs/dbraw/zinc/78/07/64/1037780764.db2.gz QVBHBQJKBYYJCC-GUYCJALGSA-N 1 0 327.384 3.663 20 5 EHBDRO CC(C)[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000026266679 1037810810 /nfs/dbraw/zinc/81/08/10/1037810810.db2.gz QUCDAUPETHQOIS-IBGZPJMESA-N 1 0 341.411 3.910 20 5 EHBDRO CC(C)CC1CC[NH+](Cc2cc([N+](=O)[O-])cc3c2OCOC3)CC1 ZINC000760927356 1037825952 /nfs/dbraw/zinc/82/59/52/1037825952.db2.gz XJJIKRWYMJFMMZ-UHFFFAOYSA-N 1 0 334.416 3.719 20 5 EHBDRO C[C@@H](C[NH2+][C@H](c1nnc[nH]1)C1CCCCC1)c1ccccc1[N+](=O)[O-] ZINC000897460711 1037846945 /nfs/dbraw/zinc/84/69/45/1037846945.db2.gz VCEZSLGTLBEKLY-GUYCJALGSA-N 1 0 343.431 3.728 20 5 EHBDRO CCCn1nc(C)c(C[NH2+]C[C@@H](C)c2ccccc2[N+](=O)[O-])c1C ZINC000897463917 1037869797 /nfs/dbraw/zinc/86/97/97/1037869797.db2.gz COCTWVHRAQOINJ-CYBMUJFWSA-N 1 0 330.432 3.711 20 5 EHBDRO C[C@@H]1CCCC[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000187926205 1037872516 /nfs/dbraw/zinc/87/25/16/1037872516.db2.gz UHRRCUJYQQGKEZ-CQSZACIVSA-N 1 0 329.400 3.914 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1c(F)cccc1F ZINC000341293531 1037884024 /nfs/dbraw/zinc/88/40/24/1037884024.db2.gz PSXSRAXARMWZIV-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-])C1(CO)CC=CC1 ZINC000592177092 1037905974 /nfs/dbraw/zinc/90/59/74/1037905974.db2.gz ATAQAWGLKKZVSB-INIZCTEOSA-N 1 0 338.835 3.691 20 5 EHBDRO Cc1cc(C)cc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2)c1 ZINC000540410483 1037909041 /nfs/dbraw/zinc/90/90/41/1037909041.db2.gz ZNLCJWYWDFNHES-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1cc(F)ccc1F ZINC000540446157 1037946649 /nfs/dbraw/zinc/94/66/49/1037946649.db2.gz PBJNYYHDIRJOME-HNNXBMFYSA-N 1 0 336.338 3.993 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CC[C@H](C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000592378413 1037951698 /nfs/dbraw/zinc/95/16/98/1037951698.db2.gz YELGWNPULOOSQZ-LSDHHAIUSA-N 1 0 334.416 3.503 20 5 EHBDRO Cc1cnc(CC[N@H+](Cc2ccccc2[N+](=O)[O-])C2CC2)c(C)c1 ZINC000573961445 1037978240 /nfs/dbraw/zinc/97/82/40/1037978240.db2.gz ROPCJEMWBQIIQP-UHFFFAOYSA-N 1 0 325.412 3.814 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccccc1N(C)C ZINC000539070012 1038669610 /nfs/dbraw/zinc/66/96/10/1038669610.db2.gz DVERKVKNNXLVFP-HNNXBMFYSA-N 1 0 327.428 3.772 20 5 EHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000545458926 1038682832 /nfs/dbraw/zinc/68/28/32/1038682832.db2.gz XDBMFCXZTTYZKY-QWRGUYRKSA-N 1 0 347.337 3.633 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](C)[C@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961576 1038698370 /nfs/dbraw/zinc/69/83/70/1038698370.db2.gz XUMUGMBNYAFZQO-GHMZBOCLSA-N 1 0 331.338 3.817 20 5 EHBDRO COc1cc(N[C@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000539185530 1038723279 /nfs/dbraw/zinc/72/32/79/1038723279.db2.gz DYBSKHLKUGOSBA-YOEHRIQHSA-N 1 0 341.411 3.851 20 5 EHBDRO COc1ccc([C@H]2C[C@H]([NH2+]Cc3ccc([N+](=O)[O-])cc3)C2)cc1F ZINC000500461897 1038776419 /nfs/dbraw/zinc/77/64/19/1038776419.db2.gz OYVRGQBWMWKYTQ-SHTZXODSSA-N 1 0 330.359 3.778 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ccc(OC)cc1[N+](=O)[O-])c1ccc(F)cc1 ZINC001168370143 1038884221 /nfs/dbraw/zinc/88/42/21/1038884221.db2.gz HRVRJCAVZUZQRZ-MRXNPFEDSA-N 1 0 348.374 3.862 20 5 EHBDRO C[C@@H]1CCC[C@H](C[NH2+][C@@H](c2nccn2C)c2cccc([N+](=O)[O-])c2)C1 ZINC000552047526 1038912799 /nfs/dbraw/zinc/91/27/99/1038912799.db2.gz PMYBUFNFZODFLU-RVKKMQEKSA-N 1 0 342.443 3.834 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H]2c3ccccc3CC[C@@H]2C)c1[N+](=O)[O-] ZINC000893269347 1038941305 /nfs/dbraw/zinc/94/13/05/1038941305.db2.gz NWJZKKHFDURHLP-SJCJKPOMSA-N 1 0 342.395 3.722 20 5 EHBDRO CCC(CC)([NH2+]CCn1ccc([N+](=O)[O-])n1)c1ccc(Cl)cc1 ZINC000478039782 1039140995 /nfs/dbraw/zinc/14/09/95/1039140995.db2.gz JOCZOHVOAPPVHK-UHFFFAOYSA-N 1 0 336.823 3.750 20 5 EHBDRO COc1ccc(C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1[N+](=O)[O-] ZINC000552274210 1039145391 /nfs/dbraw/zinc/14/53/91/1039145391.db2.gz HBRJOOGAUSKDQN-QGZVFWFLSA-N 1 0 326.396 3.983 20 5 EHBDRO CC[C@](C)(O)C[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000111384849 1039309511 /nfs/dbraw/zinc/30/95/11/1039309511.db2.gz ADXPENOTQWCUJG-SFHVURJKSA-N 1 0 348.374 3.777 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000128418824 1039628699 /nfs/dbraw/zinc/62/86/99/1039628699.db2.gz PREWWBXGVWTJEJ-CYBMUJFWSA-N 1 0 337.395 3.573 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@H](CO)c1ccccc1)CCCC2 ZINC000417307857 1039659696 /nfs/dbraw/zinc/65/96/96/1039659696.db2.gz HNIKBWJAQFBYBC-XLIONFOSSA-N 1 0 340.423 3.728 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](NC1CC([NH+]3CCCCC3)C1)CCCC2 ZINC000417328098 1039675414 /nfs/dbraw/zinc/67/54/14/1039675414.db2.gz HYHZWDWLIICTKV-OUNSHVDWSA-N 1 0 343.471 3.969 20 5 EHBDRO Cc1nn(C)c(C)c1CC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417323469 1039680590 /nfs/dbraw/zinc/68/05/90/1039680590.db2.gz OJLWKPOABQJZCH-LJQANCHMSA-N 1 0 342.443 3.545 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000554991698 1040022116 /nfs/dbraw/zinc/02/21/16/1040022116.db2.gz QOYPWGCIXXMSQV-AWEZNQCLSA-N 1 0 326.396 3.986 20 5 EHBDRO Cc1cc(F)ncc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000894082107 1040038707 /nfs/dbraw/zinc/03/87/07/1040038707.db2.gz SAPHBPRQLAWXNB-UHFFFAOYSA-N 1 0 343.280 3.746 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CC[C@H](C)C[C@@H]1C ZINC000481187499 1040452475 /nfs/dbraw/zinc/45/24/75/1040452475.db2.gz HAOBFCYEESGPKT-HEHGZKQESA-N 1 0 333.432 3.646 20 5 EHBDRO CCCCC[C@@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000486813416 1040466545 /nfs/dbraw/zinc/46/65/45/1040466545.db2.gz UXQAOUTWWIDHHB-OAHLLOKOSA-N 1 0 333.432 3.886 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000490340286 1040502167 /nfs/dbraw/zinc/50/21/67/1040502167.db2.gz MHFKEPDJOAERMK-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CC1(CO)CC3(CCC3)C1)CCC2 ZINC000433055698 1040559270 /nfs/dbraw/zinc/55/92/70/1040559270.db2.gz FNXIAJNAKHPQIH-QGZVFWFLSA-N 1 0 330.428 3.505 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CC[C@]2(C1)OCc1ccccc12 ZINC000588492061 1040688166 /nfs/dbraw/zinc/68/81/66/1040688166.db2.gz XJQWKXHIDJBSRI-DASIIQCKSA-N 1 0 336.391 3.739 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CC2(CO)CC3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433091780 1040721725 /nfs/dbraw/zinc/72/17/25/1040721725.db2.gz PDCNVSSVRLSPNX-KRWDZBQOSA-N 1 0 344.455 3.850 20 5 EHBDRO CC[C@H]([NH2+][C@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453340609 1040726270 /nfs/dbraw/zinc/72/62/70/1040726270.db2.gz HTONLBSJZHMMRX-WDSOQIARSA-N 1 0 341.411 3.951 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](c2ccccc2F)C1 ZINC000555584063 1040878704 /nfs/dbraw/zinc/87/87/04/1040878704.db2.gz ZGNNDZNUISQMIW-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(Cc2ccc([N+](=O)[O-])cc2F)C1 ZINC000491078764 1040886244 /nfs/dbraw/zinc/88/62/44/1040886244.db2.gz QATRPIVWONYKFH-HOTGVXAUSA-N 1 0 349.450 3.820 20 5 EHBDRO O=[N+]([O-])c1cccc(CN2CCC[C@H](C[NH+]3CCCCCC3)C2)c1 ZINC000491059239 1040896751 /nfs/dbraw/zinc/89/67/51/1040896751.db2.gz RYJXJSZQTRMDQP-GOSISDBHSA-N 1 0 331.460 3.683 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cs1 ZINC000491061028 1040897710 /nfs/dbraw/zinc/89/77/10/1040897710.db2.gz LZJOPZCDLSYRMP-HNNXBMFYSA-N 1 0 337.489 3.744 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000433157847 1040941658 /nfs/dbraw/zinc/94/16/58/1040941658.db2.gz NVXBQRSEEVIWMN-SJORKVTESA-N 1 0 343.427 3.803 20 5 EHBDRO C[C@H](COCC(F)(F)F)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433165011 1040952204 /nfs/dbraw/zinc/95/22/04/1040952204.db2.gz HCNAUDOAGVEAFI-QMTHXVAHSA-N 1 0 346.349 3.874 20 5 EHBDRO CCc1ncc(C[NH2+][C@@H](CC)CSc2ccccc2[N+](=O)[O-])o1 ZINC000453389205 1041072142 /nfs/dbraw/zinc/07/21/42/1041072142.db2.gz PQRGBVXJSCGUJG-LBPRGKRZSA-N 1 0 335.429 3.806 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433280784 1041193996 /nfs/dbraw/zinc/19/39/96/1041193996.db2.gz FHJKDPPLJPTQPI-FZKQIMNGSA-N 1 0 325.412 3.933 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CN1C1CC1 ZINC000433295137 1041247745 /nfs/dbraw/zinc/24/77/45/1041247745.db2.gz OLGKNYIOVYBMPK-VFVRVIDISA-N 1 0 329.444 3.532 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CCC[C@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000600470735 1041248747 /nfs/dbraw/zinc/24/87/47/1041248747.db2.gz IHKGLNMGZZFVLM-MYZSUADSSA-N 1 0 333.432 3.645 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C[C@H]1CCCCO1 ZINC000511665843 1041448638 /nfs/dbraw/zinc/44/86/38/1041448638.db2.gz STGRGVROAOWALT-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[C@H]1CN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C[C@@H](C)O1 ZINC000511837882 1041684739 /nfs/dbraw/zinc/68/47/39/1041684739.db2.gz JZMPEAWVCHWUJS-CJNGLKHVSA-N 1 0 330.384 3.854 20 5 EHBDRO CC(=O)c1cc(NCCCC[NH+]2CCC(C)CC2)ccc1[N+](=O)[O-] ZINC000341538086 1041695113 /nfs/dbraw/zinc/69/51/13/1041695113.db2.gz WSBWKINTAKXTKP-UHFFFAOYSA-N 1 0 333.432 3.721 20 5 EHBDRO COc1ccc(C[NH2+]CCCF)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000136513116 1041743476 /nfs/dbraw/zinc/74/34/76/1041743476.db2.gz KGYBHWVDAVJBLG-UHFFFAOYSA-N 1 0 348.374 3.632 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000181710309 1041766492 /nfs/dbraw/zinc/76/64/92/1041766492.db2.gz ASXGKTISDBHUME-INIZCTEOSA-N 1 0 341.411 3.973 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCCC[C@@H](C)C1 ZINC000248557217 1042526787 /nfs/dbraw/zinc/52/67/87/1042526787.db2.gz LJGJAQVSCLQIHB-CHWSQXEVSA-N 1 0 330.388 3.828 20 5 EHBDRO CCC[C@](C)(CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236794583 1042758489 /nfs/dbraw/zinc/75/84/89/1042758489.db2.gz RCBAWPFGRWOSTN-QGZVFWFLSA-N 1 0 334.441 3.964 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(CO)CC2)ccc1Oc1ccccc1Cl ZINC000120373491 1042771286 /nfs/dbraw/zinc/77/12/86/1042771286.db2.gz MNBFAUUXSAKGMB-UHFFFAOYSA-N 1 0 348.786 3.655 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccc(NC(N)=O)cc2)cccc1[N+](=O)[O-] ZINC000165435124 1042814624 /nfs/dbraw/zinc/81/46/24/1042814624.db2.gz SEUBGSDNDNVAGX-CHWSQXEVSA-N 1 0 342.399 3.806 20 5 EHBDRO C[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC(C)(C)O1 ZINC000511979139 1042829975 /nfs/dbraw/zinc/82/99/75/1042829975.db2.gz RUAGUVIYCFUGTI-ZDUSSCGKSA-N 1 0 330.384 3.854 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1COc3ccc(F)cc3C1)CCC2 ZINC000343962660 1042958100 /nfs/dbraw/zinc/95/81/00/1042958100.db2.gz AXWQDNHAXKVHCU-MAUKXSAKSA-N 1 0 342.370 3.705 20 5 EHBDRO CC(=Cc1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ccc2c[nH]nc2c1 ZINC000585743449 1043017907 /nfs/dbraw/zinc/01/79/07/1043017907.db2.gz OEVJXOZZUKGPRO-ZROIWOOFSA-N 1 0 336.395 3.707 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C(C)(C)c1ccccc1 ZINC000585754490 1043024324 /nfs/dbraw/zinc/02/43/24/1043024324.db2.gz PQHCPTFLPBZZDV-UHFFFAOYSA-N 1 0 341.411 3.791 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1COc2ccc(F)cc2C1)c1cccc([N+](=O)[O-])c1 ZINC000344017338 1043104581 /nfs/dbraw/zinc/10/45/81/1043104581.db2.gz FCFDHXCRKGXJIM-NVXWUHKLSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000344045398 1043152531 /nfs/dbraw/zinc/15/25/31/1043152531.db2.gz IECGOFYFJWRNPC-SFHVURJKSA-N 1 0 326.396 3.813 20 5 EHBDRO [NH3+]CCN(Cc1csc2ccccc12)c1ccccc1[N+](=O)[O-] ZINC000348896373 1043997040 /nfs/dbraw/zinc/99/70/40/1043997040.db2.gz UDBAKZGKTZFKAW-UHFFFAOYSA-N 1 0 327.409 3.775 20 5 EHBDRO C[NH+](C)CCc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)cc1 ZINC000076169651 1125578516 /nfs/dbraw/zinc/57/85/16/1125578516.db2.gz FJYIGFMQRNICII-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO Cc1ccc(C[C@H](CO)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)cc1C ZINC001560872630 1126214063 /nfs/dbraw/zinc/21/40/63/1126214063.db2.gz PMFMBNIIOCNOTC-MRXNPFEDSA-N 1 0 348.830 3.558 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](Cc3ccc(Cl)cc3)CC2)cn1 ZINC000072883481 1126911511 /nfs/dbraw/zinc/91/15/11/1126911511.db2.gz RXCCTQAJAMDPNI-UHFFFAOYSA-N 1 0 346.818 3.720 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)c1ccc(-n2ccnn2)cc1 ZINC000090879383 1127081770 /nfs/dbraw/zinc/08/17/70/1127081770.db2.gz MQYGOFPBLUKSJB-KGLIPLIRSA-N 1 0 337.383 3.587 20 5 EHBDRO C[C@@H]1CCCC[C@@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765341983 1127600110 /nfs/dbraw/zinc/60/01/10/1127600110.db2.gz AYCUWCGGIHXYGD-HZPDHXFCSA-N 1 0 331.460 3.980 20 5 EHBDRO C[C@@H]1CCCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000765341978 1127599975 /nfs/dbraw/zinc/59/99/75/1127599975.db2.gz AYCUWCGGIHXYGD-CVEARBPZSA-N 1 0 331.460 3.980 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc(C[S@](C)=O)cc1 ZINC000552317875 1127749043 /nfs/dbraw/zinc/74/90/43/1127749043.db2.gz JWEQKVYLLIKZAQ-BSEYFRJRSA-N 1 0 346.452 3.633 20 5 EHBDRO C[C@@H]([NH2+][C@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171402 1127798765 /nfs/dbraw/zinc/79/87/65/1127798765.db2.gz UHIUAKVAROPBOS-VXGBXAGGSA-N 1 0 330.388 3.874 20 5 EHBDRO CCc1ccc([C@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+](C)C)cc1 ZINC000301428294 1127872980 /nfs/dbraw/zinc/87/29/80/1127872980.db2.gz MXLNTXZEIASYSP-KRWDZBQOSA-N 1 0 328.416 3.575 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cn2)[C@H]1c1cccs1 ZINC000301426067 1127875949 /nfs/dbraw/zinc/87/59/49/1127875949.db2.gz PBMBNLHBQZRWOB-WBMJQRKESA-N 1 0 332.429 3.546 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNc2cc(OC)ccc2[N+](=O)[O-])c1 ZINC000338657320 1128002969 /nfs/dbraw/zinc/00/29/69/1128002969.db2.gz QDUIBJMRHBYOTE-UHFFFAOYSA-N 1 0 329.400 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+]Cc2c(F)ccc(F)c2Cl)cc1 ZINC001649112150 1128291548 /nfs/dbraw/zinc/29/15/48/1128291548.db2.gz MNDGYSZUIRHJDN-UHFFFAOYSA-N 1 0 342.729 3.695 20 5 EHBDRO C[C@H](CC(N)=O)[NH2+]Cc1c2ccccc2c(Cl)c2ccccc21 ZINC000765788394 1128367346 /nfs/dbraw/zinc/36/73/46/1128367346.db2.gz FZFUBGYFWDXEPP-GFCCVEGCSA-N 1 0 326.827 4.000 20 5 EHBDRO CNC(=O)[C@@H]1CCC[C@H]1[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000765798018 1128380182 /nfs/dbraw/zinc/38/01/82/1128380182.db2.gz UFYBVNIKSQIHOM-TZIWHRDSSA-N 1 0 332.447 3.997 20 5 EHBDRO C[C@@H]1C[C@H](CC[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000273187568 1128448314 /nfs/dbraw/zinc/44/83/14/1128448314.db2.gz GBBUOSBGWPYMFG-IIDMSEBBSA-N 1 0 332.444 3.711 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2cc(C)c([N+](=O)[O-])cc2Cl)C1 ZINC000301472321 1128468160 /nfs/dbraw/zinc/46/81/60/1128468160.db2.gz KQTGRDLHRXZFOZ-CYBMUJFWSA-N 1 0 325.840 3.725 20 5 EHBDRO COc1cc(NC[C@@H](c2cccs2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301527960 1128486980 /nfs/dbraw/zinc/48/69/80/1128486980.db2.gz ODTQIFYEGRFMPP-HNNXBMFYSA-N 1 0 347.440 3.914 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(CO)CCC2)ccc1Oc1ccc(F)cc1 ZINC000347642836 1128504869 /nfs/dbraw/zinc/50/48/69/1128504869.db2.gz CVIAIKRFSMKHKX-UHFFFAOYSA-N 1 0 346.358 3.531 20 5 EHBDRO CCC[C@H]([NH2+]CCOC1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000903444379 1128513724 /nfs/dbraw/zinc/51/37/24/1128513724.db2.gz PNFSUNJFKUAGDS-KRWDZBQOSA-N 1 0 338.473 3.938 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@H](CNc2ccc([N+](=O)[O-])c3cccnc23)C1 ZINC000301603657 1128521460 /nfs/dbraw/zinc/52/14/60/1128521460.db2.gz LFPCLLHSHBNHKS-CQSZACIVSA-N 1 0 328.416 3.533 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCc3cc(Cl)ccc32)cc1 ZINC000765848652 1128559425 /nfs/dbraw/zinc/55/94/25/1128559425.db2.gz KNQCOIXCJWZVJC-IAGOWNOFSA-N 1 0 332.787 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCSc3ccc(F)cc32)cc1 ZINC000765844698 1128547379 /nfs/dbraw/zinc/54/73/79/1128547379.db2.gz HXFKTPKBPJGEMF-HOTGVXAUSA-N 1 0 348.399 3.594 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1Br)C(C1CC1)C1CC1 ZINC001116650596 1128705976 /nfs/dbraw/zinc/70/59/76/1128705976.db2.gz BJZBPIVQAGJJCF-UHFFFAOYSA-N 1 0 339.233 3.978 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CCN1c2ccccc2C[C@@H]1C ZINC001648938430 1120238738 /nfs/dbraw/zinc/23/87/38/1120238738.db2.gz QWZBDRGVUOBNHS-HNNXBMFYSA-N 1 0 339.439 3.752 20 5 EHBDRO CCOc1cc(C[NH2+][C@H]2CCCO[C@@H]2CC(C)C)ccc1[N+](=O)[O-] ZINC000492874960 1120374103 /nfs/dbraw/zinc/37/41/03/1120374103.db2.gz QXDVDFTUBUNUDV-DOTOQJQBSA-N 1 0 336.432 3.677 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2c(Cl)cccc2[N+](=O)[O-])C1 ZINC000494634828 1120708528 /nfs/dbraw/zinc/70/85/28/1120708528.db2.gz DWNOQROPNMWIIZ-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCCn2cnc3ccccc32)cccc1[N+](=O)[O-] ZINC000161556298 1128964399 /nfs/dbraw/zinc/96/43/99/1128964399.db2.gz MQLRBHOMIKYPCX-OAHLLOKOSA-N 1 0 338.411 3.994 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])[C@H]2CCCO[C@@H]21 ZINC000495440381 1121204819 /nfs/dbraw/zinc/20/48/19/1121204819.db2.gz RRSJVAIXWPKYTK-BMFZPTHFSA-N 1 0 338.835 3.584 20 5 EHBDRO C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@@H](c2ccccc2)C1 ZINC000301066219 1121298353 /nfs/dbraw/zinc/29/83/53/1121298353.db2.gz JTHGGNYVZYEQCQ-HXUWFJFHSA-N 1 0 348.406 3.636 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000495744929 1121396332 /nfs/dbraw/zinc/39/63/32/1121396332.db2.gz IWGSYAVMHCGDNK-LBPRGKRZSA-N 1 0 329.356 3.624 20 5 EHBDRO COCC[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccco1 ZINC000272619779 1121796741 /nfs/dbraw/zinc/79/67/41/1121796741.db2.gz XWJAHJIFWSVMNB-HOCLYGCPSA-N 1 0 332.400 3.876 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2cccc([N+](=O)[O-])c2C(C)=O)CC1 ZINC000763202865 1121860578 /nfs/dbraw/zinc/86/05/78/1121860578.db2.gz JCOHXVLTYARHNI-UHFFFAOYSA-N 1 0 347.459 3.746 20 5 EHBDRO CC(=O)c1c(NC[C@H](c2ccccc2)[NH+](C)C)cccc1[N+](=O)[O-] ZINC000763207031 1121876532 /nfs/dbraw/zinc/87/65/32/1121876532.db2.gz OZUNZOXFKHYEIS-QGZVFWFLSA-N 1 0 327.384 3.512 20 5 EHBDRO O=[N+]([O-])c1ccccc1NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301180697 1122293590 /nfs/dbraw/zinc/29/35/90/1122293590.db2.gz HTEBAJOGVIRPLL-KRWDZBQOSA-N 1 0 325.412 3.571 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(OC3CCCCC3)CC2)cc1 ZINC000125451447 1122317126 /nfs/dbraw/zinc/31/71/26/1122317126.db2.gz BRBAOPVCZLFUTO-UHFFFAOYSA-N 1 0 332.444 3.951 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccc([N+](=O)[O-])cc2)sc2nc(C)nc(C)c12 ZINC000916839558 1122364468 /nfs/dbraw/zinc/36/44/68/1122364468.db2.gz FSQCVJJIRLNBFK-UHFFFAOYSA-N 1 0 342.424 3.815 20 5 EHBDRO C[C@@H](c1ccccc1)N(C)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000917180423 1122545255 /nfs/dbraw/zinc/54/52/55/1122545255.db2.gz SOFIZULJYJDBPI-LBPRGKRZSA-N 1 0 347.802 3.880 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CC)C(C)(C)O ZINC000556237692 1122890163 /nfs/dbraw/zinc/89/01/63/1122890163.db2.gz FCZXZOPBBZTCDO-DOMZBBRYSA-N 1 0 326.462 3.605 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000154970194 1123054313 /nfs/dbraw/zinc/05/43/13/1123054313.db2.gz UEFSTCPBWYESPG-KDOFPFPSSA-N 1 0 343.427 3.557 20 5 EHBDRO C[C@@H]1c2ccccc2CC[N@H+]1CCCOc1ccc([N+](=O)[O-])cc1 ZINC000609315894 1123374062 /nfs/dbraw/zinc/37/40/62/1123374062.db2.gz IQSGGOIHQPGAQQ-OAHLLOKOSA-N 1 0 326.396 3.983 20 5 EHBDRO C[C@](O)(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C1CC1 ZINC000609564530 1123609537 /nfs/dbraw/zinc/60/95/37/1123609537.db2.gz UWAUIUXMEMXHCU-KRWDZBQOSA-N 1 0 332.425 3.574 20 5 EHBDRO O=[N+]([O-])c1sccc1NC1CC[NH+](CCc2ccccc2)CC1 ZINC000067912445 1123781594 /nfs/dbraw/zinc/78/15/94/1123781594.db2.gz JZGZFNBIBCWGAY-UHFFFAOYSA-N 1 0 331.441 3.775 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1ccnn1C)C(C)C ZINC000615943143 1123912362 /nfs/dbraw/zinc/91/23/62/1123912362.db2.gz FWFKYIRFOORGKX-QWSHFYNQSA-N 1 0 342.443 3.761 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000616092201 1123947543 /nfs/dbraw/zinc/94/75/43/1123947543.db2.gz SNTDKSDDLRHTCU-GFCCVEGCSA-N 1 0 328.359 3.777 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@@H](CCCN2c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301838380 1129172351 /nfs/dbraw/zinc/17/23/51/1129172351.db2.gz WRIXLILWBLKQTR-SMDDNHRTSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+]C2(c3cccc(Cl)c3)CCCC2)n1 ZINC000181456463 1124852521 /nfs/dbraw/zinc/85/25/21/1124852521.db2.gz UVNTUDGZCPVTLQ-UHFFFAOYSA-N 1 0 334.807 3.504 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000080652687 1124918967 /nfs/dbraw/zinc/91/89/67/1124918967.db2.gz IGQAUXPRTQPZLO-GFCCVEGCSA-N 1 0 345.365 3.782 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000080652685 1124920791 /nfs/dbraw/zinc/92/07/91/1124920791.db2.gz IGQAUXPRTQPZLO-LBPRGKRZSA-N 1 0 345.365 3.782 20 5 EHBDRO Cc1ccnc(Nc2ccc(CC[NH+]3CCCC3)cc2)c1[N+](=O)[O-] ZINC000301251175 1125042674 /nfs/dbraw/zinc/04/26/74/1125042674.db2.gz CEDOVWJDBIJPBL-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2ncc([N+](=O)[O-])cc2C)CC1 ZINC000181832228 1125054226 /nfs/dbraw/zinc/05/42/26/1125054226.db2.gz JUYXSWRDHFZALA-UHFFFAOYSA-N 1 0 334.464 3.637 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](CO)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571686 1125120613 /nfs/dbraw/zinc/12/06/13/1125120613.db2.gz LAQVIQHTMXWDJK-VOBQZIQPSA-N 1 0 340.423 3.726 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@H]2CCCC[N@@H+]2Cc2ccc([N+](=O)[O-])cc2)C1 ZINC000619569437 1125363731 /nfs/dbraw/zinc/36/37/31/1125363731.db2.gz CKBYRUPCGACMKL-FDPIWHGQSA-N 1 0 332.444 3.746 20 5 EHBDRO C[C@H](O)C[N@H+](Cc1cc([N+](=O)[O-])ccc1Cl)C1CCCCC1 ZINC000735491941 1131353251 /nfs/dbraw/zinc/35/32/51/1131353251.db2.gz LZLIJMWUGCMYAB-LBPRGKRZSA-N 1 0 326.824 3.764 20 5 EHBDRO CC(=O)c1ccc(N[C@H]2CC[N@@H+](C)[C@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC000301845871 1129184565 /nfs/dbraw/zinc/18/45/65/1129184565.db2.gz TXXGTEDYCCIEBF-HKUYNNGSSA-N 1 0 339.395 3.655 20 5 EHBDRO CC[NH+](CC)[C@@H]1CCN(c2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301847940 1129188690 /nfs/dbraw/zinc/18/86/90/1129188690.db2.gz CCNFQOCURIIEQA-MRXNPFEDSA-N 1 0 340.427 3.577 20 5 EHBDRO CC(C)(C)Oc1cc(N2CCC([NH+]3CCCC3)CC2)ccc1[N+](=O)[O-] ZINC000301858119 1129217384 /nfs/dbraw/zinc/21/73/84/1129217384.db2.gz DQSHEVBZWHMNNJ-UHFFFAOYSA-N 1 0 347.459 3.837 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@@H]1CCCC[C@H]1C ZINC000255959010 1129237938 /nfs/dbraw/zinc/23/79/38/1129237938.db2.gz LWQLSZVXMZRBRX-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@H+](C)C[C@@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000543181740 1129316352 /nfs/dbraw/zinc/31/63/52/1129316352.db2.gz IYXZSELUSQFTLB-LSDHHAIUSA-N 1 0 331.416 3.518 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[NH+](CCc2cccs2)CC1 ZINC000489304592 1129321041 /nfs/dbraw/zinc/32/10/41/1129321041.db2.gz IPSHZYDOKLHVSD-OAHLLOKOSA-N 1 0 345.468 3.578 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920388 1129362454 /nfs/dbraw/zinc/36/24/54/1129362454.db2.gz DUNUAIVXJGJKQZ-NWDGAFQWSA-N 1 0 343.374 3.729 20 5 EHBDRO Cc1nc(N[C@@H]2C[N@@H+](Cc3ccccc3)CC[C@@H]2C)ccc1[N+](=O)[O-] ZINC000716229534 1131371954 /nfs/dbraw/zinc/37/19/54/1131371954.db2.gz NMPVILUDZPTSDS-WMLDXEAASA-N 1 0 340.427 3.621 20 5 EHBDRO COc1ccc(C[NH2+]CCc2c[nH]c3ccc(F)cc23)cc1[N+](=O)[O-] ZINC000116922970 1129403213 /nfs/dbraw/zinc/40/32/13/1129403213.db2.gz VTTAKWUFNLRIKE-UHFFFAOYSA-N 1 0 343.358 3.556 20 5 EHBDRO C[NH+](C)CCc1ccc(CNc2c(F)cc([N+](=O)[O-])cc2F)cc1 ZINC000466436532 1129444734 /nfs/dbraw/zinc/44/47/34/1129444734.db2.gz MDAQXSKHDSMTQS-UHFFFAOYSA-N 1 0 335.354 3.589 20 5 EHBDRO COc1cc(N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)ccc1[N+](=O)[O-] ZINC000301975780 1129464816 /nfs/dbraw/zinc/46/48/16/1129464816.db2.gz CZSMICIJYPRJIF-MRXNPFEDSA-N 1 0 347.459 3.552 20 5 EHBDRO CCOCCC[NH2+][C@@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000543405239 1129465440 /nfs/dbraw/zinc/46/54/40/1129465440.db2.gz UHVLAABGZZHYDW-GOSISDBHSA-N 1 0 332.400 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)CCc2ccccc2)C2CC2)cc1 ZINC000543439704 1129490072 /nfs/dbraw/zinc/49/00/72/1129490072.db2.gz HHOAKQILQQZDBW-FQEVSTJZSA-N 1 0 340.423 3.553 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@]2(C)CCCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000154127389 1129534943 /nfs/dbraw/zinc/53/49/43/1129534943.db2.gz WVVZUPJNOFTLBZ-DOPJRALCSA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cc2c(c(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)c1)O[C@@H](C)C2 ZINC000922537844 1129565213 /nfs/dbraw/zinc/56/52/13/1129565213.db2.gz LIHFUPDOFJVSDE-QWHCGFSZSA-N 1 0 342.395 3.778 20 5 EHBDRO Cc1c(C[N@@H+](Cc2ccccc2)[C@@H](C)CCO)cccc1[N+](=O)[O-] ZINC000093303985 1129583714 /nfs/dbraw/zinc/58/37/14/1129583714.db2.gz QOCXCOAJOWXQBT-HNNXBMFYSA-N 1 0 328.412 3.676 20 5 EHBDRO COc1ccc(C[NH2+]C(C)(C)COCc2ccccc2)cc1[N+](=O)[O-] ZINC000390056858 1129601841 /nfs/dbraw/zinc/60/18/41/1129601841.db2.gz OQMWZGLERRWCQC-UHFFFAOYSA-N 1 0 344.411 3.688 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])cn1 ZINC000390854219 1129638465 /nfs/dbraw/zinc/63/84/65/1129638465.db2.gz JYEDTCOEDPAEOZ-KRWDZBQOSA-N 1 0 340.427 3.702 20 5 EHBDRO C[C@H]([NH2+]CCn1ccnc1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000155630299 1129653854 /nfs/dbraw/zinc/65/38/54/1129653854.db2.gz KSTSISSNHNADKS-ZDUSSCGKSA-N 1 0 342.424 3.871 20 5 EHBDRO COc1ccc(C[NH+]2CCC(OC3CCCCC3)CC2)cc1[N+](=O)[O-] ZINC000125452492 1129693010 /nfs/dbraw/zinc/69/30/10/1129693010.db2.gz IXGLPHSBKXNLIR-UHFFFAOYSA-N 1 0 348.443 3.917 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000392549797 1129717429 /nfs/dbraw/zinc/71/74/29/1129717429.db2.gz YSHSALQLXHUASI-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](C)CO)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000157180703 1129752259 /nfs/dbraw/zinc/75/22/59/1129752259.db2.gz VDKPWUURKNCPEE-AGIUHOORSA-N 1 0 334.441 3.991 20 5 EHBDRO Cc1cc(N[C@@H]2CCC[C@H]3OCC[C@H]32)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302092622 1129767578 /nfs/dbraw/zinc/76/75/78/1129767578.db2.gz QIXFPNXJCPLHQS-JCKWVBRZSA-N 1 0 327.384 3.821 20 5 EHBDRO COc1cc(N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)ccc1[N+](=O)[O-] ZINC000302157001 1129770669 /nfs/dbraw/zinc/77/06/69/1129770669.db2.gz FJQLFBDRRHYVJO-PBHICJAKSA-N 1 0 341.411 3.536 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c(C)c1 ZINC000056196915 1129805652 /nfs/dbraw/zinc/80/56/52/1129805652.db2.gz VNCSBLGHKWVGPV-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO COc1c(C)cc(C[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1C ZINC000303168891 1129822881 /nfs/dbraw/zinc/82/28/81/1129822881.db2.gz VISVZJWKJPWVAG-UHFFFAOYSA-N 1 0 344.411 3.731 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH+]2CCC(COc3ccccc3)CC2)cc1 ZINC000303523445 1129851614 /nfs/dbraw/zinc/85/16/14/1129851614.db2.gz PWJCPOIYPYQMHK-UHFFFAOYSA-N 1 0 340.423 3.928 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+]C(C)(C)c2cccs2)cccc1[N+](=O)[O-] ZINC000543506118 1129908615 /nfs/dbraw/zinc/90/86/15/1129908615.db2.gz ODUBJZFHYXZTGB-LBPRGKRZSA-N 1 0 347.440 3.817 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]3OCC[C@@H]32)cc1[N+](=O)[O-] ZINC000245508313 1130223980 /nfs/dbraw/zinc/22/39/80/1130223980.db2.gz RSEYKXYFKWIAKM-CRNXPOROSA-N 1 0 334.416 3.602 20 5 EHBDRO CC(C)C1CC[NH+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)CC1 ZINC000173588685 1130254164 /nfs/dbraw/zinc/25/41/64/1130254164.db2.gz OLDLVKFRFCQHJF-UHFFFAOYSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H]1CC([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)C[C@H](C)C1 ZINC000766107779 1130323149 /nfs/dbraw/zinc/32/31/49/1130323149.db2.gz JMCYNWUYSIYBBU-HUUCEWRRSA-N 1 0 331.460 3.978 20 5 EHBDRO C[N@H+](CCCOc1ccc([N+](=O)[O-])cc1)CCc1ccccc1F ZINC000731671541 1130829398 /nfs/dbraw/zinc/82/93/98/1130829398.db2.gz GHENDIXXSACWSW-UHFFFAOYSA-N 1 0 332.375 3.677 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869884 1131551113 /nfs/dbraw/zinc/55/11/13/1131551113.db2.gz BQOLHSCBKGPEMM-OAHLLOKOSA-N 1 0 343.402 3.835 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2cc([N+](=O)[O-])ccc2Cl)C[C@@H]1C ZINC000740881337 1131552920 /nfs/dbraw/zinc/55/29/20/1131552920.db2.gz AJXPUBJYJHEEDN-JSGCOSHPSA-N 1 0 325.840 3.553 20 5 EHBDRO C[C@H](C(=O)OCc1ccc(Cl)cc1[N+](=O)[O-])[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021843 1131570796 /nfs/dbraw/zinc/57/07/96/1131570796.db2.gz QGCGTCIVXUNFRA-GRYCIOLGSA-N 1 0 340.807 3.553 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(N3CC[C@@H](C[NH+]4CCCCC4)C3)sc2c1 ZINC000742418002 1131721889 /nfs/dbraw/zinc/72/18/89/1131721889.db2.gz JCKAFXYGMOSVPS-ZDUSSCGKSA-N 1 0 346.456 3.517 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])c1ccco1 ZINC000742564853 1131747942 /nfs/dbraw/zinc/74/79/42/1131747942.db2.gz YBEBBWCLXJCHLD-HNNXBMFYSA-N 1 0 348.359 3.591 20 5 EHBDRO [NH3+]Cc1cnc2c(ccn2[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172898125 1131882326 /nfs/dbraw/zinc/88/23/26/1131882326.db2.gz GRJPBLUWBVGQBV-QGZVFWFLSA-N 1 0 336.395 3.523 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172900752 1131883529 /nfs/dbraw/zinc/88/35/29/1131883529.db2.gz ZHMULQXWCKACTD-KRWDZBQOSA-N 1 0 326.396 3.641 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCc3cccnc31)CC2 ZINC001172901994 1131885444 /nfs/dbraw/zinc/88/54/44/1131885444.db2.gz SDGHDKFKRULEPL-PKOBYXMFSA-N 1 0 337.423 3.904 20 5 EHBDRO COc1ccccc1CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172896225 1131901547 /nfs/dbraw/zinc/90/15/47/1131901547.db2.gz BXUBIUYOZCNOGP-SFHVURJKSA-N 1 0 340.423 3.683 20 5 EHBDRO COC(C)(C)[C@H]1CCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916384 1131904024 /nfs/dbraw/zinc/90/40/24/1131904024.db2.gz RLUIHQJUOXOBOH-FUHWJXTLSA-N 1 0 332.444 3.732 20 5 EHBDRO COC(C)(C)[C@@H]1CCC[N@@H+]1[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172916381 1131904050 /nfs/dbraw/zinc/90/40/50/1131904050.db2.gz RLUIHQJUOXOBOH-AEFFLSMTSA-N 1 0 332.444 3.732 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(N)cc1 ZINC001172911269 1131917511 /nfs/dbraw/zinc/91/75/11/1131917511.db2.gz IBDIWNOQBZUCMD-SCLBCKFNSA-N 1 0 325.412 3.775 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H]1CCc3ccc(O)cc31)CC2 ZINC001172911923 1131917736 /nfs/dbraw/zinc/91/77/36/1131917736.db2.gz KXQCHVPYBBNOJC-OXQOHEQNSA-N 1 0 338.407 3.825 20 5 EHBDRO [NH3+][C@@H]1CCN([C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c2ccccc21 ZINC001172911179 1131917764 /nfs/dbraw/zinc/91/77/64/1131917764.db2.gz GTMXFBDMWFGDAS-QFBILLFUSA-N 1 0 337.423 3.752 20 5 EHBDRO [NH3+]Cc1cccc2cnn([C@@H]3CCc4ccc([N+](=O)[O-])cc4CC3)c21 ZINC001172912792 1131917940 /nfs/dbraw/zinc/91/79/40/1131917940.db2.gz QBKJJIGLKPAQQJ-QGZVFWFLSA-N 1 0 336.395 3.523 20 5 EHBDRO Cc1ccc(C[N@@H+](C)[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cn1 ZINC001172911617 1131918069 /nfs/dbraw/zinc/91/80/69/1131918069.db2.gz CZWUHGHGSLBFPT-SFHVURJKSA-N 1 0 325.412 3.678 20 5 EHBDRO CCOCC1CC[NH+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)CC1 ZINC001172912459 1131918095 /nfs/dbraw/zinc/91/80/95/1131918095.db2.gz ABJPBCAZCCEYCK-GOSISDBHSA-N 1 0 332.444 3.591 20 5 EHBDRO C[C@H](CN1CCC(C)CC1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913500 1131919432 /nfs/dbraw/zinc/91/94/32/1131919432.db2.gz WJEOTRIREBCRGR-VQIMIIECSA-N 1 0 345.487 3.552 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccc(C)cc2)c1F ZINC001173174827 1131990685 /nfs/dbraw/zinc/99/06/85/1131990685.db2.gz DBUGUFJNGGKWMT-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCCc2ccccc2)c1F ZINC001173174669 1131990800 /nfs/dbraw/zinc/99/08/00/1131990800.db2.gz AJKVDHISHVUQDY-AWEZNQCLSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]Cc2ccccc2F)c1F ZINC001173175010 1131991465 /nfs/dbraw/zinc/99/14/65/1131991465.db2.gz INHPEFRTOQAWPW-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2C[C@H]2c2ccccc2)c1F ZINC001173190571 1131994867 /nfs/dbraw/zinc/99/48/67/1131994867.db2.gz YTZPEULTTIGPDG-NOLJZWGESA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@H+](C)Cc2cccnc2C)c1F ZINC001173191218 1131995375 /nfs/dbraw/zinc/99/53/75/1131995375.db2.gz BBSXRBZUACGLJF-LBPRGKRZSA-N 1 0 347.390 3.509 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC001173217867 1132001778 /nfs/dbraw/zinc/00/17/78/1132001778.db2.gz MUDVZNQWNKYPJT-FZKQIMNGSA-N 1 0 348.830 3.893 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1nc(-c2ccccc2)cc1C[NH3+] ZINC001173215660 1132002113 /nfs/dbraw/zinc/00/21/13/1132002113.db2.gz YCXLKZHJOJMJOE-AWEZNQCLSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCN(C2CCCCC2)C1 ZINC001173219314 1132003466 /nfs/dbraw/zinc/00/34/66/1132003466.db2.gz ATMIYKWVIVZBGE-NVXWUHKLSA-N 1 0 331.460 3.522 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@](CF)(C(F)(F)F)C1 ZINC001173221257 1132004785 /nfs/dbraw/zinc/00/47/85/1132004785.db2.gz GSEJDXUPRPRGAE-BXUZGUMPSA-N 1 0 334.313 3.750 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(C(F)(F)F)n1 ZINC001173223947 1132004988 /nfs/dbraw/zinc/00/49/88/1132004988.db2.gz CAVFRWBIEAQEEN-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO COc1cnccc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173230354 1132008149 /nfs/dbraw/zinc/00/81/49/1132008149.db2.gz XOUWXJMIVNBHGU-BFUOFWGJSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@@H]1CC(=O)OC(C)(C)C ZINC001173231925 1132009148 /nfs/dbraw/zinc/00/91/48/1132009148.db2.gz OXGXYWDDKSEECK-WMLDXEAASA-N 1 0 348.443 3.722 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2cc(F)ccc2C1 ZINC001173230955 1132009670 /nfs/dbraw/zinc/00/96/70/1132009670.db2.gz WSRNGQJXCAMGPY-SCLBCKFNSA-N 1 0 328.387 3.812 20 5 EHBDRO COc1cccc(CC[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173235294 1132010456 /nfs/dbraw/zinc/01/04/56/1132010456.db2.gz VXMYHTXKUWQYSS-HNNXBMFYSA-N 1 0 328.412 3.709 20 5 EHBDRO COC(=O)c1ccc([C@@H](C)[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173209747 1132013069 /nfs/dbraw/zinc/01/30/69/1132013069.db2.gz FHBZAIMJRGLZBP-UONOGXRCSA-N 1 0 342.395 3.663 20 5 EHBDRO C[C@H]1CN(C)c2ccccc2CN1Cc1ccc([N+](=O)[O-])cc1F ZINC001174622608 1132418696 /nfs/dbraw/zinc/41/86/96/1132418696.db2.gz LORDSEDVKLMDDS-ZDUSSCGKSA-N 1 0 329.375 3.574 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC001174781078 1132463245 /nfs/dbraw/zinc/46/32/45/1132463245.db2.gz UBIGIEVGZNLVJZ-UONOGXRCSA-N 1 0 349.431 3.585 20 5 EHBDRO CCCC[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN(c2cccc([N+](=O)[O-])c2)C1=O ZINC001168982868 1132619737 /nfs/dbraw/zinc/61/97/37/1132619737.db2.gz TVFCPKHZRNWDEP-FHLIZLRMSA-N 1 0 345.443 3.649 20 5 EHBDRO CC(C)(C)OC(=O)Nc1cccc(C[NH2+][C@H]2CC[C@H](C[N+](=O)[O-])C2)c1 ZINC001168961179 1132620090 /nfs/dbraw/zinc/62/00/90/1132620090.db2.gz HPEKCSNGWSTCTF-GJZGRUSLSA-N 1 0 349.431 3.569 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccccc1C[NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168968521 1132622762 /nfs/dbraw/zinc/62/27/62/1132622762.db2.gz ZUPTZOUXHROYSM-UKRRQHHQSA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+][C@H](c2ncccc2C(F)(F)F)C2CC2)C1 ZINC001168997007 1132627874 /nfs/dbraw/zinc/62/78/74/1132627874.db2.gz AYSWGBJOOQIPNQ-OSMZGAPFSA-N 1 0 343.349 3.587 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2ccncc2)C1 ZINC001169009702 1132631112 /nfs/dbraw/zinc/63/11/12/1132631112.db2.gz XHOMEXLSPXELQL-MOPGFXCFSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH+]2CCC(c3noc4cc(F)ccc43)CC2)C1 ZINC001169010102 1132631561 /nfs/dbraw/zinc/63/15/61/1132631561.db2.gz AYGCUVYYDLBGPP-SWLSCSKDSA-N 1 0 347.390 3.592 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3c2cccc3F)C1 ZINC001169042043 1132638095 /nfs/dbraw/zinc/63/80/95/1132638095.db2.gz CQNGNDFPYPTFBP-UKRRQHHQSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(Oc3cccc(Cl)c3)CC2)C1 ZINC001169023868 1132641117 /nfs/dbraw/zinc/64/11/17/1132641117.db2.gz FYEXZXNOQFOOQL-ZFWWWQNUSA-N 1 0 338.835 3.629 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@@H+]2CCC[C@]3(CCc4c3cccc4F)C2)C1 ZINC001169051291 1132642524 /nfs/dbraw/zinc/64/25/24/1132642524.db2.gz CTWPQZDOQGJCSE-VCBZYWHSSA-N 1 0 332.419 3.551 20 5 EHBDRO COc1c(F)cc(N[C@@H]2CC(C)(C)C[C@@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169148260 1132678028 /nfs/dbraw/zinc/67/80/28/1132678028.db2.gz VLRZUWIXTAWMHD-PXAZEXFGSA-N 1 0 339.411 3.698 20 5 EHBDRO CC(=O)Nc1ccc(N[C@@H]2CC(C)(C)C[C@](C)(C[NH3+])C2)cc1[N+](=O)[O-] ZINC001169151474 1132679040 /nfs/dbraw/zinc/67/90/40/1132679040.db2.gz KDHTYRIVZSCKHF-RDTXWAMCSA-N 1 0 348.447 3.509 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2Cc3ccccc3N3CCC[C@@H]3C2)cc1F ZINC001175668632 1132734623 /nfs/dbraw/zinc/73/46/23/1132734623.db2.gz FSENKNSDZUOWTN-MRXNPFEDSA-N 1 0 341.386 3.719 20 5 EHBDRO COc1ccc(Nc2cccc(C[NH+]3CCCC3)c2)cc1[N+](=O)[O-] ZINC001176363262 1132922925 /nfs/dbraw/zinc/92/29/25/1132922925.db2.gz MGKVNFFIIJFWBL-UHFFFAOYSA-N 1 0 327.384 3.943 20 5 EHBDRO COCC[C@@H](c1ccccc1)[N@@H+]1CCc2c(cccc2[N+](=O)[O-])C1 ZINC000767118581 1132951588 /nfs/dbraw/zinc/95/15/88/1132951588.db2.gz JRUUFSDTNLXWHP-SFHVURJKSA-N 1 0 326.396 3.731 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@H]1CCc2cc(O)ccc2C1 ZINC000767726983 1133043773 /nfs/dbraw/zinc/04/37/73/1133043773.db2.gz FDNFOJUCNAQCTG-HNNXBMFYSA-N 1 0 332.787 3.601 20 5 EHBDRO C[C@]1(Cc2ccccc2)CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937202 1133073155 /nfs/dbraw/zinc/07/31/55/1133073155.db2.gz YXRZKEPQVQGTDB-WOJBJXKFSA-N 1 0 340.423 3.725 20 5 EHBDRO C[C@@]1(Cc2ccccc2)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000767937197 1133073296 /nfs/dbraw/zinc/07/32/96/1133073296.db2.gz YXRZKEPQVQGTDB-PMACEKPBSA-N 1 0 340.423 3.725 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CCC[C@H](C[C@H]2CCOC2)C1 ZINC000773699597 1133091003 /nfs/dbraw/zinc/09/10/03/1133091003.db2.gz IAJNUQAHLUBJJK-ZIAGYGMSSA-N 1 0 338.835 3.887 20 5 EHBDRO CCc1ccc2c(c1)[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCO2 ZINC001178445437 1133165255 /nfs/dbraw/zinc/16/52/55/1133165255.db2.gz ZLJWMRACNAFYEJ-MRXNPFEDSA-N 1 0 342.395 3.779 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179348064 1133243849 /nfs/dbraw/zinc/24/38/49/1133243849.db2.gz NFFKLIRTWXZGTI-WLHTULFXSA-N 1 0 330.384 3.756 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000774210698 1133634845 /nfs/dbraw/zinc/63/48/45/1133634845.db2.gz GVTMIPSHJJLZNA-QGZVFWFLSA-N 1 0 341.367 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](O)c1c(F)cccc1F)CCC2 ZINC000774249556 1133643230 /nfs/dbraw/zinc/64/32/30/1133643230.db2.gz BUIJDVPDHDRKSJ-IAGOWNOFSA-N 1 0 348.349 3.574 20 5 EHBDRO C[C@@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2cccc(F)c2[N+](=O)[O-])C1 ZINC000774518638 1133703521 /nfs/dbraw/zinc/70/35/21/1133703521.db2.gz WLRZXSHHTDXFCL-DZGCQCFKSA-N 1 0 329.375 3.981 20 5 EHBDRO Cc1c(CN2C[C@H]([NH+](C)C)CCc3ccccc32)cccc1[N+](=O)[O-] ZINC001182833748 1133738424 /nfs/dbraw/zinc/73/84/24/1133738424.db2.gz FPBYTJXJMDMELR-GOSISDBHSA-N 1 0 339.439 3.786 20 5 EHBDRO Cc1ccccc1[C@@H](C)[NH2+][C@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001183136449 1133774126 /nfs/dbraw/zinc/77/41/26/1133774126.db2.gz KZMPHFOKRHVQNC-HUUCEWRRSA-N 1 0 341.411 3.971 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccnc(-c3ccccc3)c2)cc1 ZINC001183197620 1133778665 /nfs/dbraw/zinc/77/86/65/1133778665.db2.gz XWBHDJYXQBEVOG-UHFFFAOYSA-N 1 0 333.391 3.989 20 5 EHBDRO C[C@H](C[C@H]1CCOC1)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000786925039 1133929967 /nfs/dbraw/zinc/92/99/67/1133929967.db2.gz FVPSCFRHKJRKKO-GHMZBOCLSA-N 1 0 332.322 3.518 20 5 EHBDRO CC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H](COC)Cc1ccccc1 ZINC000746668800 1133987982 /nfs/dbraw/zinc/98/79/82/1133987982.db2.gz BGUKFVMXVSDDOC-GOSISDBHSA-N 1 0 346.402 3.814 20 5 EHBDRO C[C@H](CNc1ncc([N+](=O)[O-])c2ccccc21)[N@@H+]1CCCC[C@@H]1C ZINC001184856824 1133999090 /nfs/dbraw/zinc/99/90/90/1133999090.db2.gz MTYGYMMSRLNJFS-UONOGXRCSA-N 1 0 328.416 3.818 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[N@H+](CC3CCCCC3)CC2)cc1F ZINC000788477638 1134130084 /nfs/dbraw/zinc/13/00/84/1134130084.db2.gz DQPSENSOGDFSHU-UHFFFAOYSA-N 1 0 349.450 3.822 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(-n2cccn2)c1 ZINC000788488841 1134131187 /nfs/dbraw/zinc/13/11/87/1134131187.db2.gz MFSGZZLCFXHSQD-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO C[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)COCc1ccccc1 ZINC000788568808 1134146321 /nfs/dbraw/zinc/14/63/21/1134146321.db2.gz DGKJJOJCADTMCP-HUUCEWRRSA-N 1 0 343.427 3.681 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](O)c2cccc(F)c2)c2cc([N+](=O)[O-])ccc21 ZINC000788580008 1134147172 /nfs/dbraw/zinc/14/71/72/1134147172.db2.gz JXUHDLQPDZAWPL-ROUUACIJSA-N 1 0 344.386 3.780 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)[C@@H](O)c1ccccc1 ZINC000788806969 1134171951 /nfs/dbraw/zinc/17/19/51/1134171951.db2.gz QVLQYCDUYRRGJU-IXDGSTSKSA-N 1 0 343.427 3.730 20 5 EHBDRO CC1(C)CCC[N@H+](CCNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC001186267294 1134190522 /nfs/dbraw/zinc/19/05/22/1134190522.db2.gz PAWPQRZAUABIJO-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH+]2CCC(F)(c3ccccc3)CC2)cc1 ZINC000789311713 1134252003 /nfs/dbraw/zinc/25/20/03/1134252003.db2.gz UAJQAIRKZVAPKX-GOSISDBHSA-N 1 0 344.386 3.589 20 5 EHBDRO CC(C)c1cccc2c1CC[N@H+](C[C@@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC000789557314 1134300319 /nfs/dbraw/zinc/30/03/19/1134300319.db2.gz YXMXBCRPDRCITO-HXUWFJFHSA-N 1 0 340.423 3.810 20 5 EHBDRO CC(C)c1cccc2c1CC[N@H+](C[C@H](O)c1cccc([N+](=O)[O-])c1)C2 ZINC000789557312 1134300837 /nfs/dbraw/zinc/30/08/37/1134300837.db2.gz YXMXBCRPDRCITO-FQEVSTJZSA-N 1 0 340.423 3.810 20 5 EHBDRO CN1CCN(c2ccc([N+](=O)[O-])cc2Cl)[C@@H](c2ccccc2)C1 ZINC000746958449 1134488813 /nfs/dbraw/zinc/48/88/13/1134488813.db2.gz LFEJIXNRYOMMPH-QGZVFWFLSA-N 1 0 331.803 3.741 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@H]1[NH2+]Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000775370107 1134672628 /nfs/dbraw/zinc/67/26/28/1134672628.db2.gz LAABKVIHKKQADN-GDBMZVCRSA-N 1 0 326.824 3.932 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2cccc(C)n2)c([N+](=O)[O-])c1 ZINC001170305633 1134739528 /nfs/dbraw/zinc/73/95/28/1134739528.db2.gz OIOACKUJVQXWOL-UONOGXRCSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C2(c3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC001170314434 1134745302 /nfs/dbraw/zinc/74/53/02/1134745302.db2.gz VKMJONZPTRGAJS-CYBMUJFWSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CC2(c3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC001170313345 1134745309 /nfs/dbraw/zinc/74/53/09/1134745309.db2.gz LNNQEZFBSCHDQC-HNNXBMFYSA-N 1 0 340.423 3.856 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCCc3cnccc32)c([N+](=O)[O-])c1 ZINC001170328081 1134749362 /nfs/dbraw/zinc/74/93/62/1134749362.db2.gz UUCHCGKMXLGXSJ-ACJLOTCBSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329841 1134749730 /nfs/dbraw/zinc/74/97/30/1134749730.db2.gz VRCMLUXFOADKFF-NWDGAFQWSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2Cc3cccc(C)c3C2)c([N+](=O)[O-])c1 ZINC001170328697 1134749765 /nfs/dbraw/zinc/74/97/65/1134749765.db2.gz LMKCUEZSAQWWST-CQSZACIVSA-N 1 0 326.396 3.859 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3cc(C)ccc3C2)c([N+](=O)[O-])c1 ZINC001170354171 1134753680 /nfs/dbraw/zinc/75/36/80/1134753680.db2.gz HVZXSTBDMZJNNF-OAHLLOKOSA-N 1 0 340.423 3.901 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCC[C@@H]2c2ccncc2)c([N+](=O)[O-])c1 ZINC001170345841 1134759715 /nfs/dbraw/zinc/75/97/15/1134759715.db2.gz MXANIWHQPWSNIJ-KBXCAEBGSA-N 1 0 341.411 3.767 20 5 EHBDRO CCOc1cc(C[N@H+](C)CCN(C)c2ccccc2)ccc1[N+](=O)[O-] ZINC001190894434 1134764211 /nfs/dbraw/zinc/76/42/11/1134764211.db2.gz DHSIPTIYXMMZES-UHFFFAOYSA-N 1 0 343.427 3.562 20 5 EHBDRO CCOC(=O)CCCCC[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC001170410228 1134771745 /nfs/dbraw/zinc/77/17/45/1134771745.db2.gz FKILUQJUEVINDS-KRWDZBQOSA-N 1 0 348.443 3.898 20 5 EHBDRO Nc1ccc(NC2CC[NH+](CC3CCCCC3)CC2)c([N+](=O)[O-])c1 ZINC000804388669 1135052695 /nfs/dbraw/zinc/05/26/95/1135052695.db2.gz YJIGBFHIBOQWPA-UHFFFAOYSA-N 1 0 332.448 3.634 20 5 EHBDRO CCCCC[C@H](C)NC(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000775549927 1135060484 /nfs/dbraw/zinc/06/04/84/1135060484.db2.gz RTIPSDATMOCODV-LSDHHAIUSA-N 1 0 335.448 3.639 20 5 EHBDRO CC[N@H+](CCC1CC1)Cc1ccc([N+](=O)[O-])cc1Br ZINC001193117847 1135104122 /nfs/dbraw/zinc/10/41/22/1135104122.db2.gz QPSFULCZYHSZHG-UHFFFAOYSA-N 1 0 327.222 3.979 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC001197515020 1135697557 /nfs/dbraw/zinc/69/75/57/1135697557.db2.gz XGUUVQKWXWPKPC-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCC[C@@H]([C@@H]3CCOC3)C2)cc1 ZINC001198563990 1135831124 /nfs/dbraw/zinc/83/11/24/1135831124.db2.gz VBIRAVMITANSFI-IAGOWNOFSA-N 1 0 348.443 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCCC[C@H]([C@H]3CCOC3)C2)cc1 ZINC001198563991 1135831259 /nfs/dbraw/zinc/83/12/59/1135831259.db2.gz VBIRAVMITANSFI-IRXDYDNUSA-N 1 0 348.443 3.502 20 5 EHBDRO CN(Cc1ccc(C[NH+](C)C)cc1)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000809738939 1135883669 /nfs/dbraw/zinc/88/36/69/1135883669.db2.gz QFSMWEHRFCQHGE-UHFFFAOYSA-N 1 0 347.846 3.942 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CC[C@@H]([NH+]2CCCC2)C1 ZINC000809939967 1135902990 /nfs/dbraw/zinc/90/29/90/1135902990.db2.gz AODPDESFLVKODL-CYBMUJFWSA-N 1 0 344.242 3.572 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@@H]1CCCOC1 ZINC000809975179 1135907542 /nfs/dbraw/zinc/90/75/42/1135907542.db2.gz AAWOQJIXWJIIMF-NXEZZACHSA-N 1 0 333.215 3.806 20 5 EHBDRO C[C@@]1([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCO[C@@H]1C1CC1 ZINC000809975085 1135908267 /nfs/dbraw/zinc/90/82/67/1135908267.db2.gz WBLBBOCRVJDJNN-HUUCEWRRSA-N 1 0 345.226 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CC[C@@]3(C2)CCc2ccccc2O3)cc1F ZINC000810047053 1135915464 /nfs/dbraw/zinc/91/54/64/1135915464.db2.gz IXOOPZZSBIUCPZ-LJQANCHMSA-N 1 0 342.370 3.704 20 5 EHBDRO Cc1cccc2c1OC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)C2 ZINC000810177548 1135934638 /nfs/dbraw/zinc/93/46/38/1135934638.db2.gz ANAIOSPJSGOKDS-CQSZACIVSA-N 1 0 332.787 3.650 20 5 EHBDRO Cc1cc([C@H]([NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)C2CC2)ccc1F ZINC000776030895 1135936495 /nfs/dbraw/zinc/93/64/95/1135936495.db2.gz BXIQSNLLVFMYQQ-RBUKOAKNSA-N 1 0 344.386 3.817 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H](C)C[C@H](O)c1ccc(F)cc1 ZINC001201788358 1136066623 /nfs/dbraw/zinc/06/66/23/1136066623.db2.gz YLRVVLMOBXXPTP-DJJJIMSYSA-N 1 0 346.402 3.953 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC[C@@H]1CCCCO1 ZINC000811488838 1136092791 /nfs/dbraw/zinc/09/27/91/1136092791.db2.gz NEKWEQZQAXJEEO-LBPRGKRZSA-N 1 0 333.215 3.950 20 5 EHBDRO CC1(C)CC[C@@H](C[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])O1 ZINC000811492493 1136093465 /nfs/dbraw/zinc/09/34/65/1136093465.db2.gz SZHGAYADCMDOBT-NSHDSACASA-N 1 0 333.215 3.949 20 5 EHBDRO Cc1ccc(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])cn1 ZINC000811479664 1136097325 /nfs/dbraw/zinc/09/73/25/1136097325.db2.gz LEOXGUXTVYRZBY-UHFFFAOYSA-N 1 0 340.210 3.937 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)cc1Cl ZINC000811512712 1136103698 /nfs/dbraw/zinc/10/36/98/1136103698.db2.gz QFSYZAZHWISVPM-QAPCUYQASA-N 1 0 346.814 3.504 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]CCc2cccc3ccccc32)cc1 ZINC000776276960 1136130687 /nfs/dbraw/zinc/13/06/87/1136130687.db2.gz MJSFAVGXONQEEO-HXUWFJFHSA-N 1 0 336.391 3.614 20 5 EHBDRO CC(C)([NH2+]C[C@@H]1CCC[C@@H](C(F)(F)F)O1)c1ccccc1[N+](=O)[O-] ZINC001170650852 1136162068 /nfs/dbraw/zinc/16/20/68/1136162068.db2.gz QGPDLTATISZBJF-FZMZJTMJSA-N 1 0 346.349 3.920 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2[C@H]3Cc4cc(F)ccc4[C@@H]23)c1 ZINC000850409482 1136252031 /nfs/dbraw/zinc/25/20/31/1136252031.db2.gz VSTOMTRHXYCQSA-USXIJHARSA-N 1 0 332.762 3.815 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)[C@@H](O)c1ccccc1 ZINC000812849006 1136260405 /nfs/dbraw/zinc/26/04/05/1136260405.db2.gz NSPWHADXAJSQLL-IFXJQAMLSA-N 1 0 344.411 3.547 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC1SCCS1)C1CC1 ZINC000850569848 1136288576 /nfs/dbraw/zinc/28/85/76/1136288576.db2.gz CRVRMHASGBHSKV-AWEZNQCLSA-N 1 0 338.498 3.702 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1ccc(F)cc1 ZINC000776580722 1136445510 /nfs/dbraw/zinc/44/55/10/1136445510.db2.gz ZGNAYPLDXVBUNY-SCLBCKFNSA-N 1 0 332.375 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H](c2ccccc2)C2CCC2)cc1 ZINC000776591783 1136453122 /nfs/dbraw/zinc/45/31/22/1136453122.db2.gz HDXLLIQWLBYVTD-MOPGFXCFSA-N 1 0 326.396 3.759 20 5 EHBDRO CC(C)([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000776593168 1136453649 /nfs/dbraw/zinc/45/36/49/1136453649.db2.gz QRONPKSJJUZCDL-MRXNPFEDSA-N 1 0 334.803 3.807 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1c(F)cccc1Cl ZINC000776604315 1136465999 /nfs/dbraw/zinc/46/59/99/1136465999.db2.gz BJXARYKNWFNZHX-ZUZCIYMTSA-N 1 0 338.766 3.772 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccn2)cccc1[N+](=O)[O-] ZINC000852566981 1136467266 /nfs/dbraw/zinc/46/72/66/1136467266.db2.gz JVTUAHXLUGDTJN-QAPCUYQASA-N 1 0 325.412 3.799 20 5 EHBDRO CCc1ccc([C@@H]2CC[N@H+](C[C@@H](O)c3cccc([N+](=O)[O-])c3)C2)cc1 ZINC000814640972 1136487684 /nfs/dbraw/zinc/48/76/84/1136487684.db2.gz ZHQBTRJMNPRNFW-UYAOXDASSA-N 1 0 340.423 3.680 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CC[C@H]([NH+]2CCCCC2)C1 ZINC000853299852 1136524640 /nfs/dbraw/zinc/52/46/40/1136524640.db2.gz UXGGIWNNPBPOFW-ZDUSSCGKSA-N 1 0 325.359 3.597 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnc(Br)c1)c1cccc([N+](=O)[O-])c1 ZINC000815081813 1136548485 /nfs/dbraw/zinc/54/84/85/1136548485.db2.gz PMHKHYFFSCTDQV-SNVBAGLBSA-N 1 0 336.189 3.603 20 5 EHBDRO COc1ccc(C)cc1[C@@H](C)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555001 1136610379 /nfs/dbraw/zinc/61/03/79/1136610379.db2.gz NRBNNKZABYORFG-CHWSQXEVSA-N 1 0 329.400 3.906 20 5 EHBDRO Cc1ccccc1OCCC[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815577542 1136613104 /nfs/dbraw/zinc/61/31/04/1136613104.db2.gz SVCJCJAVPICXCM-CQSZACIVSA-N 1 0 329.400 3.605 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)Nc1ccccc1 ZINC000815577291 1136613134 /nfs/dbraw/zinc/61/31/34/1136613134.db2.gz MAVAFKMOAPDNSM-KDOFPFPSSA-N 1 0 342.443 3.964 20 5 EHBDRO C[N@@H+]1CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)c2ccccc2C1 ZINC000816618384 1136742470 /nfs/dbraw/zinc/74/24/70/1136742470.db2.gz WKLBAXZKLCKJIM-UHFFFAOYSA-N 1 0 331.803 3.700 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC[C@@H]1CC1(Cl)Cl ZINC000856806482 1136813210 /nfs/dbraw/zinc/81/32/10/1136813210.db2.gz FTRIZYRSGUJDNL-LLVKDONJSA-N 1 0 333.215 3.667 20 5 EHBDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951850 1136850891 /nfs/dbraw/zinc/85/08/91/1136850891.db2.gz BCKFXLQUZIRPPA-UGSOOPFHSA-N 1 0 342.443 3.651 20 5 EHBDRO CC(C)c1ccc([C@@H](N)C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000817951841 1136851074 /nfs/dbraw/zinc/85/10/74/1136851074.db2.gz BCKFXLQUZIRPPA-ACJLOTCBSA-N 1 0 342.443 3.651 20 5 EHBDRO CCCCOc1cccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818961014 1136891857 /nfs/dbraw/zinc/89/18/57/1136891857.db2.gz KOEUKAGFMOZBIY-LJQANCHMSA-N 1 0 344.411 3.597 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819015446 1136903383 /nfs/dbraw/zinc/90/33/83/1136903383.db2.gz HMUWBBGTDVQJSR-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@H]1COC2(CCCCCC2)O1 ZINC000776958651 1136904635 /nfs/dbraw/zinc/90/46/35/1136904635.db2.gz FACJCYFDVFYDIU-LKUPDRCFSA-N 1 0 346.427 3.664 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCCc3c(F)cc(F)cc32)cc1 ZINC000819333767 1136932383 /nfs/dbraw/zinc/93/23/83/1136932383.db2.gz ROOWDICFPQSVLW-ZWKOTPCHSA-N 1 0 348.349 3.574 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C1(CO)CCCC1 ZINC001170929194 1136948906 /nfs/dbraw/zinc/94/89/06/1136948906.db2.gz KKUZGOBNFIHTOT-INIZCTEOSA-N 1 0 340.851 3.915 20 5 EHBDRO C[NH+](C)[C@@H](CNc1cc(Cl)c(F)cc1[N+](=O)[O-])c1ccco1 ZINC000820604535 1136999603 /nfs/dbraw/zinc/99/96/03/1136999603.db2.gz KFWYNXGUWROVKA-ZDUSSCGKSA-N 1 0 327.743 3.695 20 5 EHBDRO C[C@H]([NH2+]CCc1nc2c(cccc2F)n1C)c1cccc([N+](=O)[O-])c1 ZINC000173414329 1137088570 /nfs/dbraw/zinc/08/85/70/1137088570.db2.gz KGBNPHJIYMQEOS-LBPRGKRZSA-N 1 0 342.374 3.514 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@H]3CCCC3(F)F)CC2)cc1 ZINC000824799932 1137153023 /nfs/dbraw/zinc/15/30/23/1137153023.db2.gz RVKIAWLEUOILJE-CYBMUJFWSA-N 1 0 339.386 3.589 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCO[C@@H](c3ccccn3)C2)cc1Cl ZINC000825090768 1137165066 /nfs/dbraw/zinc/16/50/66/1137165066.db2.gz HIAHPTWKVHFLSJ-CXAGYDPISA-N 1 0 347.802 3.653 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@](C)(O)c1ccccc1 ZINC000846038376 1137328913 /nfs/dbraw/zinc/32/89/13/1137328913.db2.gz PUCOYSKBFSRVIC-QINHECLXSA-N 1 0 342.439 3.802 20 5 EHBDRO C[C@H](Cc1ccc(O)cc1)[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866259737 1137340126 /nfs/dbraw/zinc/34/01/26/1137340126.db2.gz PHUCROUBHGXIQC-CHWSQXEVSA-N 1 0 332.375 3.591 20 5 EHBDRO Cc1cnc([C@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866338783 1137347376 /nfs/dbraw/zinc/34/73/76/1137347376.db2.gz XOZQOLJNKQZMAK-MNOVXSKESA-N 1 0 337.420 3.823 20 5 EHBDRO Cc1cnc([C@@H](C)C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])s1 ZINC000866338784 1137347380 /nfs/dbraw/zinc/34/73/80/1137347380.db2.gz XOZQOLJNKQZMAK-QWRGUYRKSA-N 1 0 337.420 3.823 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]CC1(c2ccccn2)CCC1 ZINC000866356652 1137349048 /nfs/dbraw/zinc/34/90/48/1137349048.db2.gz FJXSTOILFPSFAQ-AWEZNQCLSA-N 1 0 343.402 3.771 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000866367751 1137350044 /nfs/dbraw/zinc/35/00/44/1137350044.db2.gz OHFGTQBAFBLNSJ-KBPBESRZSA-N 1 0 336.407 3.604 20 5 EHBDRO Cc1ncc([C@H](C)[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)s1 ZINC000866454827 1137356186 /nfs/dbraw/zinc/35/61/86/1137356186.db2.gz QTLKNAHNBDJEMU-LBPRGKRZSA-N 1 0 346.456 3.679 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000772949618 1137361717 /nfs/dbraw/zinc/36/17/17/1137361717.db2.gz CSELNCPSVVVRHK-HNNXBMFYSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000772980604 1137405400 /nfs/dbraw/zinc/40/54/00/1137405400.db2.gz YBRKIDPMCCIXPL-CYBMUJFWSA-N 1 0 345.355 3.541 20 5 EHBDRO CCC(=O)c1ccc(N2CCC[N@@H+](C3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000795094485 1137464759 /nfs/dbraw/zinc/46/47/59/1137464759.db2.gz ISXWUBWTUUYBNA-UHFFFAOYSA-N 1 0 345.443 3.642 20 5 EHBDRO CCC[C@H](CCO)C[NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041141 1137567153 /nfs/dbraw/zinc/56/71/53/1137567153.db2.gz QCKBXVNUMWQVRY-QWHCGFSZSA-N 1 0 326.462 3.766 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CC[C@H]2SCCS[C@@H]12)c1c(F)cccc1[N+](=O)[O-] ZINC000872051182 1137568073 /nfs/dbraw/zinc/56/80/73/1137568073.db2.gz IGGJNRZVGWKIKO-XKFJNSEWSA-N 1 0 342.461 3.764 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086090 1137570418 /nfs/dbraw/zinc/57/04/18/1137570418.db2.gz ROGMRUUJTJJONV-BJJXKVORSA-N 1 0 346.406 3.529 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCC[C@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086095 1137570455 /nfs/dbraw/zinc/57/04/55/1137570455.db2.gz ROGMRUUJTJJONV-NOLJZWGESA-N 1 0 346.406 3.529 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H]1CCCn2nccc21 ZINC000872095222 1137571059 /nfs/dbraw/zinc/57/10/59/1137571059.db2.gz RTMHTBLUAJQTRQ-FZMZJTMJSA-N 1 0 332.429 3.699 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2C[C@@H]3CCC[C@H]3O2)cc1[N+](=O)[O-] ZINC000872109781 1137571798 /nfs/dbraw/zinc/57/17/98/1137571798.db2.gz RFQMPAKGIWVDKY-NZUILWFCSA-N 1 0 334.416 3.602 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ncc(Cl)s1 ZINC000872112656 1137571924 /nfs/dbraw/zinc/57/19/24/1137571924.db2.gz KJYOGEKAMYWJBF-MRVPVSSYSA-N 1 0 329.784 3.565 20 5 EHBDRO COc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1OC ZINC000873007347 1137587922 /nfs/dbraw/zinc/58/79/22/1137587922.db2.gz MZBREZGAJOBGEQ-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccc(OC(C)C)nc1 ZINC000873015348 1137588203 /nfs/dbraw/zinc/58/82/03/1137588203.db2.gz ZREPMNKYXSGHLB-UHFFFAOYSA-N 1 0 329.400 3.684 20 5 EHBDRO Cc1c(C[NH2+]CCc2nc(C(F)(F)F)cs2)cccc1[N+](=O)[O-] ZINC000873065764 1137589367 /nfs/dbraw/zinc/58/93/67/1137589367.db2.gz NJFKAXJGYLLNJK-UHFFFAOYSA-N 1 0 345.346 3.711 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)C[C@@H](O)c1cccs1 ZINC000873097863 1137590122 /nfs/dbraw/zinc/59/01/22/1137590122.db2.gz XLCCLHSIMPFHOF-MLGOLLRUSA-N 1 0 334.441 3.875 20 5 EHBDRO CC(C)c1ccc(CCC[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877037058 1137668444 /nfs/dbraw/zinc/66/84/44/1137668444.db2.gz JKTXNJQGPHDZNL-UHFFFAOYSA-N 1 0 342.443 3.841 20 5 EHBDRO Cc1cccc([C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C(C)C)c1 ZINC000877657165 1137684480 /nfs/dbraw/zinc/68/44/80/1137684480.db2.gz XEJXXRKPKXDVTP-LEOMRAHMSA-N 1 0 328.416 3.790 20 5 EHBDRO CCC1([NH+](C)C)CCN(Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000877690696 1137686037 /nfs/dbraw/zinc/68/60/37/1137686037.db2.gz UDASFVLRDMVYBJ-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)[C@@H]2CCCC[C@@H]21 ZINC000878398809 1137714146 /nfs/dbraw/zinc/71/41/46/1137714146.db2.gz DMVRHLXQHOMSCM-UMVBOHGHSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1csc([C@@H]2CC[N@H+](CCCOc3ccc([N+](=O)[O-])cc3)C2)n1 ZINC000880012045 1137765494 /nfs/dbraw/zinc/76/54/94/1137765494.db2.gz XOKDAKRRSGSBFS-CQSZACIVSA-N 1 0 347.440 3.618 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCCC[C@@H](C3CCOCC3)C2)cc1F ZINC000880577798 1137781653 /nfs/dbraw/zinc/78/16/53/1137781653.db2.gz LCFZIHMQCDMEPN-MRXNPFEDSA-N 1 0 336.407 3.763 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)N(C)CCCC[NH+]1CCCCC1 ZINC000882625966 1137830405 /nfs/dbraw/zinc/83/04/05/1137830405.db2.gz QTOLRZFKHRGUFR-UHFFFAOYSA-N 1 0 347.459 3.550 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(c2ccc([N+](=O)[O-])c(C)n2)CC1 ZINC000882816926 1137834955 /nfs/dbraw/zinc/83/49/55/1137834955.db2.gz HNIUJBMFXFRCCR-UHFFFAOYSA-N 1 0 332.448 3.533 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1ccccc1F)c1cccc([N+](=O)[O-])c1 ZINC000130371908 1137836599 /nfs/dbraw/zinc/83/65/99/1137836599.db2.gz UPFVSCMSDZTCOX-ROUUACIJSA-N 1 0 332.375 3.898 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H](C)C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000130503720 1137838792 /nfs/dbraw/zinc/83/87/92/1137838792.db2.gz SFHQECOOSAHQRF-SUMWQHHRSA-N 1 0 332.400 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)c2ccc(F)cc2F)C2CC2)cc1 ZINC000130557390 1137839345 /nfs/dbraw/zinc/83/93/45/1137839345.db2.gz HYSFHKBOVBXGQV-GOSISDBHSA-N 1 0 348.349 3.571 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]C[C@H]1CCC2(CCC2)O1)C1CC1 ZINC000883356423 1137857284 /nfs/dbraw/zinc/85/72/84/1137857284.db2.gz NLBXLAAKNAOKMR-SJORKVTESA-N 1 0 330.428 3.607 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCC2(COC2)CC1 ZINC000883382579 1137858376 /nfs/dbraw/zinc/85/83/76/1137858376.db2.gz JLGSAOCOIWPQDC-LBPRGKRZSA-N 1 0 336.457 3.927 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@H]1[C@@H]1C[C@H](C)CC[C@@H]1O ZINC000331901932 1137925153 /nfs/dbraw/zinc/92/51/53/1137925153.db2.gz JRXSICFUKJONQJ-WWECUESFSA-N 1 0 332.444 3.917 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]CCC1CC(F)(F)C1 ZINC001202682444 1137925702 /nfs/dbraw/zinc/92/57/02/1137925702.db2.gz CNAWCDKEHBEFSV-UHFFFAOYSA-N 1 0 349.175 3.882 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000332200170 1137935419 /nfs/dbraw/zinc/93/54/19/1137935419.db2.gz BYDUUWRGQKTCHK-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO CC(=O)NCCC[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000121309161 1137956872 /nfs/dbraw/zinc/95/68/72/1137956872.db2.gz QRLODFNLVUQISN-GFCCVEGCSA-N 1 0 347.440 3.500 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](C[C@H](O)c1cccc(Cl)c1)C1CC1 ZINC000135223603 1137964745 /nfs/dbraw/zinc/96/47/45/1137964745.db2.gz RKVNVYNQSYAVRC-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000884718542 1137970960 /nfs/dbraw/zinc/97/09/60/1137970960.db2.gz HXNYBWCHYWTKMD-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@H]([NH2+]CC[C@@H]1CCC2(CCOCC2)CO1)c1ccc([N+](=O)[O-])cc1 ZINC000886707419 1138120475 /nfs/dbraw/zinc/12/04/75/1138120475.db2.gz HQABYGNAESPKLV-YJBOKZPZSA-N 1 0 348.443 3.611 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCC(C(=O)OC(C)C)CC1 ZINC000886728661 1138127222 /nfs/dbraw/zinc/12/72/22/1138127222.db2.gz CCCHVPCNPINWRJ-CQSZACIVSA-N 1 0 334.416 3.628 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H]1CC[C@]2(CO[C@@H](C)[C@H]2C)O1 ZINC000886772073 1138137678 /nfs/dbraw/zinc/13/76/78/1138137678.db2.gz RVIWMFGTYXILMM-OKVDMCGNSA-N 1 0 348.443 3.526 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCOC1 ZINC000093839943 1138241510 /nfs/dbraw/zinc/24/15/10/1138241510.db2.gz WSMCEKHWCKXBSW-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C[C@H]1CCOC1 ZINC000093839721 1138241766 /nfs/dbraw/zinc/24/17/66/1138241766.db2.gz VXPGGHCOQSQFQD-CYBMUJFWSA-N 1 0 332.425 3.792 20 5 EHBDRO CC(=O)Nc1cccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c1 ZINC000130393127 1138452357 /nfs/dbraw/zinc/45/23/57/1138452357.db2.gz BMUGDMIRHZXARO-UHFFFAOYSA-N 1 0 339.395 3.718 20 5 EHBDRO COCc1ccc([C@@H]2CCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)o1 ZINC000130898729 1138482955 /nfs/dbraw/zinc/48/29/55/1138482955.db2.gz AWNOACVAGCRKQM-KRWDZBQOSA-N 1 0 330.384 3.714 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cccc(C)c1[N+](=O)[O-] ZINC000177347676 1139614656 /nfs/dbraw/zinc/61/46/56/1139614656.db2.gz KURLKBXLELHMLI-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1cccc(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000178195793 1139678186 /nfs/dbraw/zinc/67/81/86/1139678186.db2.gz UXJVIEUYKKNBIQ-QGZVFWFLSA-N 1 0 341.411 3.891 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ccc(Cl)nc1)C1CC1 ZINC000178247132 1139681847 /nfs/dbraw/zinc/68/18/47/1139681847.db2.gz YTTHLUXSYVWVTA-OAHLLOKOSA-N 1 0 331.803 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCCOCC3)s2)cc1 ZINC000181029058 1139880942 /nfs/dbraw/zinc/88/09/42/1139880942.db2.gz IXPZHUWCLFVPMZ-AWEZNQCLSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@@H]1CCC[C@H](C)C1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000182946521 1140003316 /nfs/dbraw/zinc/00/33/16/1140003316.db2.gz QBFLQGLEWRYDBW-HBBFGDNQSA-N 1 0 330.388 3.559 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000183986380 1140071603 /nfs/dbraw/zinc/07/16/03/1140071603.db2.gz PZYVTLZSIALICJ-ZBFHGGJFSA-N 1 0 336.432 3.993 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+][C@@H](CCO)c1ccco1 ZINC000186543454 1140209146 /nfs/dbraw/zinc/20/91/46/1140209146.db2.gz VWRANQPEIKFCGD-OIISXLGYSA-N 1 0 344.411 3.612 20 5 EHBDRO C[N@H+](Cc1c2ccccc2cc2ccccc21)CC1(O)CCOCC1 ZINC000188837472 1140310590 /nfs/dbraw/zinc/31/05/90/1140310590.db2.gz YAUMKKQJQHVETR-UHFFFAOYSA-N 1 0 335.447 3.966 20 5 EHBDRO CCOC1CC(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)C1 ZINC000189262760 1140331543 /nfs/dbraw/zinc/33/15/43/1140331543.db2.gz MOTGGWZREXHKES-UYJHFMRCSA-N 1 0 332.444 3.711 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCS2 ZINC000191528815 1140470607 /nfs/dbraw/zinc/47/06/07/1140470607.db2.gz RLCLROSRIWUAMD-MRXNPFEDSA-N 1 0 330.409 3.930 20 5 EHBDRO COCc1ccc(C[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000192636320 1140541307 /nfs/dbraw/zinc/54/13/07/1140541307.db2.gz LFTHQIDFRKTJLE-LJQANCHMSA-N 1 0 326.396 3.908 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCCNc2ccccc21 ZINC000192826197 1140552856 /nfs/dbraw/zinc/55/28/56/1140552856.db2.gz IUSKEACKZCVLGI-KRWDZBQOSA-N 1 0 327.384 3.640 20 5 EHBDRO Cc1noc(C)c1C[C@H](C)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192883121 1140554180 /nfs/dbraw/zinc/55/41/80/1140554180.db2.gz QLRMHLYFSGBNGL-VOJFVSQTSA-N 1 0 329.400 3.798 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000267361078 1140782366 /nfs/dbraw/zinc/78/23/66/1140782366.db2.gz IGARZAJOZRCDQQ-WBVHZDCISA-N 1 0 348.443 3.706 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1[N+](=O)[O-] ZINC000268809169 1140997466 /nfs/dbraw/zinc/99/74/66/1140997466.db2.gz ILUTYZJULFNFBZ-GFCCVEGCSA-N 1 0 345.355 3.671 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)CCO)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268950008 1141033532 /nfs/dbraw/zinc/03/35/32/1141033532.db2.gz RUWBQRJGTLUGKD-QWHCGFSZSA-N 1 0 334.441 3.992 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccc(F)cc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000270680337 1141256127 /nfs/dbraw/zinc/25/61/27/1141256127.db2.gz YJBOWCWPIHSVPM-FHSNZYRGSA-N 1 0 332.375 3.897 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cn(C)nc1C ZINC000271131391 1141311429 /nfs/dbraw/zinc/31/14/29/1141311429.db2.gz MBAAYTPCXXODTN-JSGCOSHPSA-N 1 0 348.472 3.858 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cnn(C)c1 ZINC000271185876 1141321077 /nfs/dbraw/zinc/32/10/77/1141321077.db2.gz WPHJDEPBYPZAKI-GXTWGEPZSA-N 1 0 334.445 3.550 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC12CCC2 ZINC000271281796 1141339137 /nfs/dbraw/zinc/33/91/37/1141339137.db2.gz AEETUFWELXUNMV-ZDUSSCGKSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000271455155 1141372276 /nfs/dbraw/zinc/37/22/76/1141372276.db2.gz GNLKVLYAMACJPU-ZJNRKIDTSA-N 1 0 332.375 3.815 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCc1nccs1)C1CC1 ZINC000271476366 1141376643 /nfs/dbraw/zinc/37/66/43/1141376643.db2.gz JPGBLDCVFKXKGO-HNNXBMFYSA-N 1 0 331.441 3.595 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])CCO1 ZINC000271563635 1141398355 /nfs/dbraw/zinc/39/83/55/1141398355.db2.gz OVAYCZZXRTYRLV-KONPQCLYSA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1ccc(-c2n[nH]cc2C[N@H+](C)CCc2ccccc2[N+](=O)[O-])o1 ZINC000348637252 1141559761 /nfs/dbraw/zinc/55/97/61/1141559761.db2.gz TYTDPHMLMCPTTQ-UHFFFAOYSA-N 1 0 340.383 3.561 20 5 EHBDRO COCc1ccc([C@H]2CCCN2Cc2ccc([N+](=O)[O-])c(F)c2)o1 ZINC000283170119 1141566336 /nfs/dbraw/zinc/56/63/36/1141566336.db2.gz PMDGEEWCJOCMFC-MRXNPFEDSA-N 1 0 334.347 3.810 20 5 EHBDRO COc1ccc(C[NH2+]CCc2nc3ccccc3s2)cc1[N+](=O)[O-] ZINC000348898655 1141606122 /nfs/dbraw/zinc/60/61/22/1141606122.db2.gz YSIJBTKQWOBATB-UHFFFAOYSA-N 1 0 343.408 3.545 20 5 EHBDRO Cc1ccc(CN(C/C=C\c2ccccc2[N+](=O)[O-])CC[NH+](C)C)o1 ZINC000349034752 1141625435 /nfs/dbraw/zinc/62/54/35/1141625435.db2.gz FUZXMRYUZKTHLE-VURMDHGXSA-N 1 0 343.427 3.573 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000051560029 214096140 /nfs/dbraw/zinc/09/61/40/214096140.db2.gz KDZBVNLQCZAXAV-QGZVFWFLSA-N 1 0 342.395 3.949 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+](Cc1ccccc1)C1CCCCC1 ZINC000028473788 212620399 /nfs/dbraw/zinc/62/03/99/212620399.db2.gz GOUYIUGNPKGTCK-UHFFFAOYSA-N 1 0 342.443 3.935 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](CO)C2CCCCC2)cc1[N+](=O)[O-] ZINC000537986721 1032064791 /nfs/dbraw/zinc/06/47/91/1032064791.db2.gz IWFCUTYTSMQZEY-CJNGLKHVSA-N 1 0 336.432 3.585 20 5 EHBDRO CCC1(O)CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000536663101 1032079668 /nfs/dbraw/zinc/07/96/68/1032079668.db2.gz WNNVEHFIYLULGX-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NC1CC(C)(C)[NH2+]C(C)(C)C1 ZINC000120147909 1014478295 /nfs/dbraw/zinc/47/82/95/1014478295.db2.gz JUXAWULIEBUROF-UHFFFAOYSA-N 1 0 348.447 3.642 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@H]1CCOC2(CCCC2)C1)C1CC1 ZINC000127074895 1015285143 /nfs/dbraw/zinc/28/51/43/1015285143.db2.gz JUFXAVBGJBBFGM-ZWKOTPCHSA-N 1 0 344.455 3.997 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2c[nH]nc2-c2cccnc2)C2CC2)c1 ZINC000154293644 1015350095 /nfs/dbraw/zinc/35/00/95/1015350095.db2.gz AINBEDNSAKEUBA-UHFFFAOYSA-N 1 0 349.394 3.545 20 5 EHBDRO Cc1c(C[NH2+]Cc2c[nH]nc2-c2cccs2)cccc1[N+](=O)[O-] ZINC000336872831 1015873896 /nfs/dbraw/zinc/87/38/96/1015873896.db2.gz QFQZUNUJQWUFHS-UHFFFAOYSA-N 1 0 328.397 3.645 20 5 EHBDRO C[NH2+]Cc1cn(-c2cnc3cc([N+](=O)[O-])ccc3n2)c2ccc(C)cc12 ZINC001167120908 1016149401 /nfs/dbraw/zinc/14/94/01/1016149401.db2.gz DFURREXYSUQTFV-UHFFFAOYSA-N 1 0 347.378 3.510 20 5 EHBDRO CC(C)c1ccc(C(=O)NC[C@@H]2CCC[N@@H+](C(C)C)C2)cc1[N+](=O)[O-] ZINC000189475863 1016521460 /nfs/dbraw/zinc/52/14/60/1016521460.db2.gz WFCKXBZQHBOFTH-HNNXBMFYSA-N 1 0 347.459 3.568 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)C[C@@H]1c1ccccc1 ZINC000340279958 1016849131 /nfs/dbraw/zinc/84/91/31/1016849131.db2.gz RQJIRDKWDPAXNH-PKOBYXMFSA-N 1 0 325.412 3.520 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CS[C@@H](C)C3)o2)c([N+](=O)[O-])c1 ZINC000414497270 1016942904 /nfs/dbraw/zinc/94/29/04/1016942904.db2.gz FPIXFXBTZIONCE-NWDGAFQWSA-N 1 0 348.424 3.847 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@H](C)O1 ZINC000414517056 1016949460 /nfs/dbraw/zinc/94/94/60/1016949460.db2.gz QCTAZMJFNZNBMN-MBNYWOFBSA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)[C@@H](C)O1 ZINC000414517051 1016949997 /nfs/dbraw/zinc/94/99/97/1016949997.db2.gz QCTAZMJFNZNBMN-BZPMIXESSA-N 1 0 347.440 3.621 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1ccc2c(c1)OCCO2 ZINC000449069658 1032157394 /nfs/dbraw/zinc/15/73/94/1032157394.db2.gz XYSNKVAZZAQFNA-ZIAGYGMSSA-N 1 0 342.395 3.648 20 5 EHBDRO CC1(c2ccccc2)CC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C1 ZINC000459498337 1032198682 /nfs/dbraw/zinc/19/86/82/1032198682.db2.gz AKXWTLIHMKPBTP-UHFFFAOYSA-N 1 0 336.395 3.681 20 5 EHBDRO Cc1cc(N[C@@H](C[NH+]2CCCC2)c2ccccc2)ncc1[N+](=O)[O-] ZINC000074739365 1032216500 /nfs/dbraw/zinc/21/65/00/1032216500.db2.gz FEKGAYXESJCTOE-INIZCTEOSA-N 1 0 326.400 3.547 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000449150219 1032252219 /nfs/dbraw/zinc/25/22/19/1032252219.db2.gz ZCOGRDQEYSNKTM-HOCLYGCPSA-N 1 0 326.396 3.682 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449168831 1032261653 /nfs/dbraw/zinc/26/16/53/1032261653.db2.gz BQQHQBULUFVTJH-DYVFJYSZSA-N 1 0 332.375 3.642 20 5 EHBDRO C[C@H](COCc1ccccc1)[NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449176132 1032269101 /nfs/dbraw/zinc/26/91/01/1032269101.db2.gz SCVSYEHTKFDIQX-JKSUJKDBSA-N 1 0 328.412 3.721 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CC3(C2)CCCOC3)s1 ZINC000459612006 1032306111 /nfs/dbraw/zinc/30/61/11/1032306111.db2.gz VLXHRXWSXIXDQW-UHFFFAOYSA-N 1 0 344.436 3.936 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2cccnc12)c1ccsc1 ZINC000026719940 1032394896 /nfs/dbraw/zinc/39/48/96/1032394896.db2.gz GDYWCKPMMAWQAH-MRXNPFEDSA-N 1 0 342.424 3.919 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc2c(n1)CCCC2 ZINC000449283005 1032403060 /nfs/dbraw/zinc/40/30/60/1032403060.db2.gz JRANISLQJHVCCD-AWEZNQCLSA-N 1 0 325.412 3.589 20 5 EHBDRO CC1(C)CCC[C@](O)(C[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1 ZINC000783733524 1032431546 /nfs/dbraw/zinc/43/15/46/1032431546.db2.gz IEPAVSYCPPWOOC-MRXNPFEDSA-N 1 0 326.824 3.669 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)c1 ZINC000449327428 1032440273 /nfs/dbraw/zinc/44/02/73/1032440273.db2.gz DIOSLYPGNWWXIB-HNNXBMFYSA-N 1 0 340.423 3.856 20 5 EHBDRO CCC[C@H]([NH2+][C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459809538 1032473011 /nfs/dbraw/zinc/47/30/11/1032473011.db2.gz STBLSYGCUSGJAU-CJNGLKHVSA-N 1 0 333.432 3.789 20 5 EHBDRO CC(C)(C)C[NH+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])CC(C)(C)C ZINC000537120573 1032520850 /nfs/dbraw/zinc/52/08/50/1032520850.db2.gz WVYBPOKSKSVEEQ-UHFFFAOYSA-N 1 0 335.448 3.588 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CCO[C@@H](C(C)C)C1 ZINC000449490274 1032656432 /nfs/dbraw/zinc/65/64/32/1032656432.db2.gz BRRIONTXLVPIGP-RDTXWAMCSA-N 1 0 336.432 3.534 20 5 EHBDRO CC(C)c1ccc([C@H]([NH3+])CNC(=O)Nc2cccc([N+](=O)[O-])c2)cc1 ZINC000414664047 1017115828 /nfs/dbraw/zinc/11/58/28/1017115828.db2.gz SVCSUYXTTHAPAH-QGZVFWFLSA-N 1 0 342.399 3.540 20 5 EHBDRO Cn1nc(C[NH2+]CCCCc2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000610271496 1017161299 /nfs/dbraw/zinc/16/12/99/1017161299.db2.gz QGPNXVHWYQNXKG-UHFFFAOYSA-N 1 0 338.411 3.594 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CC[C@@H]1O ZINC000190052629 1017266256 /nfs/dbraw/zinc/26/62/56/1017266256.db2.gz KEKKBGWERSCMSZ-LRDDRELGSA-N 1 0 332.425 3.526 20 5 EHBDRO C[C@H]1CC[NH2+]C[C@@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414910396 1017302418 /nfs/dbraw/zinc/30/24/18/1017302418.db2.gz COSOXRMXUBGYDE-ZBEGNZNMSA-N 1 0 349.818 3.596 20 5 EHBDRO CC1(C)[NH2+]CC[C@H]1NCc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000415030532 1017429915 /nfs/dbraw/zinc/42/99/15/1017429915.db2.gz COXYKCGXUIHCRH-MRXNPFEDSA-N 1 0 331.441 3.553 20 5 EHBDRO CC[NH+](CC)CC1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593454159 1032707946 /nfs/dbraw/zinc/70/79/46/1032707946.db2.gz CSKKQRVPIMHGAA-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000610285190 1017660485 /nfs/dbraw/zinc/66/04/85/1017660485.db2.gz GCTQECZVPBZVIV-HNNXBMFYSA-N 1 0 331.441 3.615 20 5 EHBDRO Cc1cnn([C@@H]2CC[N@@H+](Cc3ccc(C(C)C)c([N+](=O)[O-])c3)C2)c1 ZINC000365625080 1018088372 /nfs/dbraw/zinc/08/83/72/1018088372.db2.gz UMNYUCVKRUSUPP-MRXNPFEDSA-N 1 0 328.416 3.670 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@H](n2cnc3c2CCCC3)C1 ZINC000548010023 1018197475 /nfs/dbraw/zinc/19/74/75/1018197475.db2.gz BSXIIFICMOXOGP-YOEHRIQHSA-N 1 0 340.427 3.678 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NC[C@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000415689170 1018398023 /nfs/dbraw/zinc/39/80/23/1018398023.db2.gz CQTOIBLONXCGCX-QWHCGFSZSA-N 1 0 348.447 3.531 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+][C@H]1CCCc3ccc([N+](=O)[O-])cc31)CCC2 ZINC000365738215 1018621036 /nfs/dbraw/zinc/62/10/36/1018621036.db2.gz RRIMYWVMTNRJSQ-YJBOKZPZSA-N 1 0 340.427 3.644 20 5 EHBDRO C[C@@H](C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)N(C)C ZINC000449554551 1032785997 /nfs/dbraw/zinc/78/59/97/1032785997.db2.gz CHQFUIWLOAKYPU-NSHDSACASA-N 1 0 337.807 3.548 20 5 EHBDRO CCn1nc(C[N@H+](C)CCc2cccc([N+](=O)[O-])c2)c2ccccc21 ZINC000580218547 1018819770 /nfs/dbraw/zinc/81/97/70/1018819770.db2.gz MJUKRAATTOXXJU-UHFFFAOYSA-N 1 0 338.411 3.639 20 5 EHBDRO CCOc1cc(C[NH2+][C@H](C)c2cnn(C(C)C)c2)ccc1[N+](=O)[O-] ZINC000580268426 1018895111 /nfs/dbraw/zinc/89/51/11/1018895111.db2.gz ILEAVEZECMXWGG-CYBMUJFWSA-N 1 0 332.404 3.622 20 5 EHBDRO CCC[C@H]([NH2+]CCC(=O)N1CCCCCC1)c1cccc([N+](=O)[O-])c1 ZINC000129091933 1018920993 /nfs/dbraw/zinc/92/09/93/1018920993.db2.gz JJCMGXLIYUIQCK-SFHVURJKSA-N 1 0 347.459 3.818 20 5 EHBDRO O=[N+]([O-])c1cc2ccccc2nc1N1CCCC[C@H]([NH+]2CCCC2)C1 ZINC000473525748 1019385367 /nfs/dbraw/zinc/38/53/67/1019385367.db2.gz ZTAAAIXVJSGBIA-INIZCTEOSA-N 1 0 340.427 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@H](C[NH+]2CCCCC2)C1 ZINC000182811010 1019753386 /nfs/dbraw/zinc/75/33/86/1019753386.db2.gz WOMHUDFMWBGYAS-IAGOWNOFSA-N 1 0 331.460 3.772 20 5 EHBDRO COc1ccccc1CC[N@H+](C)C/C=C\c1ccccc1[N+](=O)[O-] ZINC000513502739 1019760109 /nfs/dbraw/zinc/76/01/09/1019760109.db2.gz DZLFICHXTSJNPB-YFHOEESVSA-N 1 0 326.396 3.791 20 5 EHBDRO C[C@H]1CCC[C@H](C)C1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000182954334 1019850596 /nfs/dbraw/zinc/85/05/96/1019850596.db2.gz BYTQEMRZIVYFDS-QWRGUYRKSA-N 1 0 339.823 3.601 20 5 EHBDRO CC[C@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@H]1CCCCO1 ZINC000594040218 1032861025 /nfs/dbraw/zinc/86/10/25/1032861025.db2.gz FLAVSUSGIZRYLN-DLBZAZTESA-N 1 0 345.399 3.687 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1c(C)nn(C)c1C)c1cccc([N+](=O)[O-])c1 ZINC000120682394 1019945473 /nfs/dbraw/zinc/94/54/73/1019945473.db2.gz UHRNRKOKDMHKKV-SGTLLEGYSA-N 1 0 330.432 3.617 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C1CCC(F)(F)CC1 ZINC000594042802 1032863469 /nfs/dbraw/zinc/86/34/69/1032863469.db2.gz DQOCIZNCNFRMRH-LBPRGKRZSA-N 1 0 328.359 3.777 20 5 EHBDRO CC(=O)c1cc(NCCCCC[NH+]2CCCCC2)ccc1[N+](=O)[O-] ZINC000561195751 1020101817 /nfs/dbraw/zinc/10/18/17/1020101817.db2.gz NKMLCYZHKBUFCM-UHFFFAOYSA-N 1 0 333.432 3.866 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)n1 ZINC000360875587 1020846733 /nfs/dbraw/zinc/84/67/33/1020846733.db2.gz XDGKIXCRSZLXRC-RHSMWYFYSA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cnn1C(C)(C)C ZINC000276347670 1021070670 /nfs/dbraw/zinc/07/06/70/1021070670.db2.gz KTERRCUZOIIUDN-ZDUSSCGKSA-N 1 0 330.432 3.748 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C(C)(C)O ZINC000518404475 1021162178 /nfs/dbraw/zinc/16/21/78/1021162178.db2.gz WKMPKBATNVEZIC-INIZCTEOSA-N 1 0 334.441 3.962 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@@H]1Nc1ccc([N+](=O)[O-])s1 ZINC000610516019 1021172650 /nfs/dbraw/zinc/17/26/50/1021172650.db2.gz VJHPYSSOWHHLOI-HIFRSBDPSA-N 1 0 331.441 3.979 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H]2CCN(c3ccccc3F)C2)cccc1[N+](=O)[O-] ZINC000426289912 1021196436 /nfs/dbraw/zinc/19/64/36/1021196436.db2.gz NSCVCXLRLBNMJK-CABCVRRESA-N 1 0 343.402 3.972 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000426296735 1021200072 /nfs/dbraw/zinc/20/00/72/1021200072.db2.gz SXDUSVQPEIWOBX-UKRRQHHQSA-N 1 0 329.375 3.663 20 5 EHBDRO Cc1cccc(C)c1[C@@H](C)[NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000546225432 1021275685 /nfs/dbraw/zinc/27/56/85/1021275685.db2.gz NVGZRINNXURMDL-OAHLLOKOSA-N 1 0 341.411 3.891 20 5 EHBDRO COc1c(C)cc(C[N@H+](C)CCOc2ccc([N+](=O)[O-])cc2)cc1C ZINC000507626091 1021408570 /nfs/dbraw/zinc/40/85/70/1021408570.db2.gz LGPJFUBOCNEFKJ-UHFFFAOYSA-N 1 0 344.411 3.731 20 5 EHBDRO COCCC1(C[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCC1 ZINC000602568517 1032978858 /nfs/dbraw/zinc/97/88/58/1032978858.db2.gz ODLSVIRNCGUAMV-UHFFFAOYSA-N 1 0 346.349 3.910 20 5 EHBDRO C[NH2+][C@@H]1CCCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000262074230 1021504867 /nfs/dbraw/zinc/50/48/67/1021504867.db2.gz SJQOEKCPOUGJMO-CQSZACIVSA-N 1 0 331.441 3.507 20 5 EHBDRO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)CCO2 ZINC000178146652 1021783436 /nfs/dbraw/zinc/78/34/36/1021783436.db2.gz LXGXOMWQCOFUNA-QGZVFWFLSA-N 1 0 328.368 3.607 20 5 EHBDRO Cc1cnc(NCC2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000361259144 1021832847 /nfs/dbraw/zinc/83/28/47/1021832847.db2.gz BGMBAVJADPIVQY-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936239 1021949030 /nfs/dbraw/zinc/94/90/30/1021949030.db2.gz SGGMYLMGKVJXLQ-QFYYESIMSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc(Cl)c(F)c1)c1ccc([N+](=O)[O-])cc1 ZINC000090936241 1021949567 /nfs/dbraw/zinc/94/95/67/1021949567.db2.gz SGGMYLMGKVJXLQ-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@H](c3ccc(F)cc3)C2)cc1 ZINC000602613063 1033029218 /nfs/dbraw/zinc/02/92/18/1033029218.db2.gz MWCUPWQCNUZDRC-MJGOQNOKSA-N 1 0 344.386 3.786 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CCC[C@@H]3CCOC3)cs2)c1 ZINC000449682492 1033034876 /nfs/dbraw/zinc/03/48/76/1033034876.db2.gz LPQFJPQQOBXAGE-CYBMUJFWSA-N 1 0 347.440 3.625 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@H]2CCC[N@@H+](C)[C@@H]2c2cccs2)n1 ZINC000178236931 1022249597 /nfs/dbraw/zinc/24/95/97/1022249597.db2.gz VPEOTBVGWDMZPF-CJNGLKHVSA-N 1 0 346.456 3.855 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000341587337 1022421823 /nfs/dbraw/zinc/42/18/23/1022421823.db2.gz JGIJVNXLWIYCKN-QGZVFWFLSA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+]C[C@H]3CCCCC3(F)F)nc2c1 ZINC000602672683 1033052125 /nfs/dbraw/zinc/05/21/25/1033052125.db2.gz DYFQPAJGEUGJTD-SNVBAGLBSA-N 1 0 325.315 3.651 20 5 EHBDRO Cc1cc(NC[C@H](c2ccccc2)[NH+]2CCCC2)ncc1[N+](=O)[O-] ZINC000074725972 1022469246 /nfs/dbraw/zinc/46/92/46/1022469246.db2.gz DYXDMTCNGLPMPG-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO CCN1CCCC[C@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000517711763 1022602291 /nfs/dbraw/zinc/60/22/91/1022602291.db2.gz NNQIXZIKRILCDB-HNNXBMFYSA-N 1 0 343.427 3.819 20 5 EHBDRO CSCC1CCC([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CC1 ZINC000602677393 1033078969 /nfs/dbraw/zinc/07/89/69/1033078969.db2.gz GKPXPTWGRKRHPO-UHFFFAOYSA-N 1 0 335.429 3.747 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]C1CCC(OC(F)F)CC1 ZINC000894768919 1022862469 /nfs/dbraw/zinc/86/24/69/1022862469.db2.gz OXKYFUYHZVBDSN-UHFFFAOYSA-N 1 0 334.750 3.888 20 5 EHBDRO C[C@H]1CCC[C@@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517970412 1022901520 /nfs/dbraw/zinc/90/15/20/1022901520.db2.gz ZQOFOYICRFILSF-SCLBCKFNSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@H]1CCC[C@]1(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000517970413 1022901762 /nfs/dbraw/zinc/90/17/62/1022901762.db2.gz ZQOFOYICRFILSF-UGSOOPFHSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@H](Nc1ccc(Br)cc1[N+](=O)[O-])C(C)(C)C[NH+](C)C ZINC000558604410 1023079522 /nfs/dbraw/zinc/07/95/22/1023079522.db2.gz MPCUSYALVGEEQZ-JTQLQIEISA-N 1 0 344.253 3.746 20 5 EHBDRO Cn1nccc1-c1ccccc1C[N@H+](C)Cc1ccccc1[N+](=O)[O-] ZINC000507245357 1023211904 /nfs/dbraw/zinc/21/19/04/1023211904.db2.gz ZAXPYGHOTQIKTJ-UHFFFAOYSA-N 1 0 336.395 3.627 20 5 EHBDRO CCOc1cc(C[N@H+](CC)CCc2nccs2)ccc1[N+](=O)[O-] ZINC000276931396 1023403543 /nfs/dbraw/zinc/40/35/43/1023403543.db2.gz QYYYZIQQPXWHJL-UHFFFAOYSA-N 1 0 335.429 3.515 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H](c3cccs3)C3CC3)nc2c1 ZINC000341842092 1023440952 /nfs/dbraw/zinc/44/09/52/1023440952.db2.gz JQNSZCYTQUUVNS-MRXNPFEDSA-N 1 0 328.397 3.774 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000247529003 1023451249 /nfs/dbraw/zinc/45/12/49/1023451249.db2.gz OBWKOBGVEFIYNQ-IVMMDQJWSA-N 1 0 342.399 3.798 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]CC(C)(C)C[NH+]1CCCC1 ZINC000477908625 1023550922 /nfs/dbraw/zinc/55/09/22/1023550922.db2.gz CBGHOYFPPICAQR-MRXNPFEDSA-N 1 0 333.476 3.628 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@H]1CCCO1 ZINC000342051339 1023804749 /nfs/dbraw/zinc/80/47/49/1023804749.db2.gz SIZFQDAPMZQEKY-SJLPKXTDSA-N 1 0 334.416 3.525 20 5 EHBDRO Cc1cc(NC(=O)c2cccc(C)c2[N+](=O)[O-])ccc1C[NH+](C)C ZINC000458290806 1023852747 /nfs/dbraw/zinc/85/27/47/1023852747.db2.gz SEMWOZRQSQBSCW-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO O=[N+]([O-])c1sccc1NC[C@H]1CCC[N@H+](Cc2ccccc2)C1 ZINC000065202053 1023892314 /nfs/dbraw/zinc/89/23/14/1023892314.db2.gz QNFCLDLOPCHPIB-OAHLLOKOSA-N 1 0 331.441 3.980 20 5 EHBDRO CCS[C@@H]1CCCC[C@H]1[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780081 1024007631 /nfs/dbraw/zinc/00/76/31/1024007631.db2.gz MMRFSTUITBHBJC-CZUORRHYSA-N 1 0 342.436 3.896 20 5 EHBDRO CCC[NH+]1CCC(Nc2cc(Br)ccc2[N+](=O)[O-])CC1 ZINC000087834355 1024079427 /nfs/dbraw/zinc/07/94/27/1024079427.db2.gz RLSLYIGWOIDBAM-UHFFFAOYSA-N 1 0 342.237 3.644 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](c2cccnc2)C2CCC2)cc1[N+](=O)[O-] ZINC000280857554 1024085815 /nfs/dbraw/zinc/08/58/15/1024085815.db2.gz MYXCYSPFQOJZNS-GOSISDBHSA-N 1 0 327.384 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CC[C@@H]3[C@@H](CCC[N@@H+]3C3CC3)C2)c(Cl)c1 ZINC000248427137 1024094836 /nfs/dbraw/zinc/09/48/36/1024094836.db2.gz OOZQBERVYYPXTJ-KBXCAEBGSA-N 1 0 349.862 3.697 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CC[N@@H+]([C@@H]2C[C@@H]2C)C[C@H](C)C1 ZINC000430112701 1024381884 /nfs/dbraw/zinc/38/18/84/1024381884.db2.gz DZMVXDRVKUWYJT-KZWKSZDHSA-N 1 0 343.471 3.660 20 5 EHBDRO CO[C@H](c1ccccc1F)[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000538488088 1024396783 /nfs/dbraw/zinc/39/67/83/1024396783.db2.gz OGJSXJXIYMCCTE-ACJLOTCBSA-N 1 0 332.375 3.908 20 5 EHBDRO CC(C)([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@@H](O)c1ccccc1 ZINC000895658150 1024695344 /nfs/dbraw/zinc/69/53/44/1024695344.db2.gz IDCJCQICACGPKC-HCWHUNCVSA-N 1 0 326.396 3.710 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@]2(CO)C[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000514761225 1024719610 /nfs/dbraw/zinc/71/96/10/1024719610.db2.gz IPJIXDIDVYTIPM-QKYXUNIQSA-N 1 0 340.423 3.720 20 5 EHBDRO CCN(Cc1ccc(C[NH+](C)C)cc1)c1ncc([N+](=O)[O-])cc1Cl ZINC000346404108 1024721598 /nfs/dbraw/zinc/72/15/98/1024721598.db2.gz PXSTZHHEMSVKMN-UHFFFAOYSA-N 1 0 348.834 3.731 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+]Cc1cccc2c1CCOC2 ZINC000895770324 1024813451 /nfs/dbraw/zinc/81/34/51/1024813451.db2.gz MICUEIZECARKFM-UHFFFAOYSA-N 1 0 332.787 3.611 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2CC[C@H]([C@@H]3CCCO3)C2)o1 ZINC000895843994 1024890638 /nfs/dbraw/zinc/89/06/38/1024890638.db2.gz KXBZGBSLIKLNMI-KSSFIOAISA-N 1 0 342.395 3.856 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000539224486 1024969932 /nfs/dbraw/zinc/96/99/32/1024969932.db2.gz AAFVTUXCPWNJQP-CXAGYDPISA-N 1 0 330.384 3.760 20 5 EHBDRO CCn1nc(C)c(CN(C)Cc2ccc(Cl)cc2[N+](=O)[O-])c1C ZINC000602927683 1033255577 /nfs/dbraw/zinc/25/55/77/1033255577.db2.gz XZWUUZJEXSPYST-UHFFFAOYSA-N 1 0 336.823 3.713 20 5 EHBDRO CC[C@@H](c1ccccc1)[N@H+](CC)Cc1ccc(C(N)=O)cc1[N+](=O)[O-] ZINC000346664913 1025001897 /nfs/dbraw/zinc/00/18/97/1025001897.db2.gz IALFIVWFFQNPMC-KRWDZBQOSA-N 1 0 341.411 3.667 20 5 EHBDRO COc1ccc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000515123761 1025035240 /nfs/dbraw/zinc/03/52/40/1025035240.db2.gz OLIVCRXKDJLMBK-LJQANCHMSA-N 1 0 342.395 3.819 20 5 EHBDRO CC[NH2+]Cc1cccc(NCc2cc([N+](=O)[O-])ccc2OCC)c1 ZINC000414873637 1025129970 /nfs/dbraw/zinc/12/99/70/1025129970.db2.gz XIANBYMLOZXVJO-UHFFFAOYSA-N 1 0 329.400 3.715 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](C)N2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520948062 1025135568 /nfs/dbraw/zinc/13/55/68/1025135568.db2.gz QHTVJEGMJLQFPD-JKSUJKDBSA-N 1 0 333.476 3.928 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCCO1 ZINC000237362279 1025178169 /nfs/dbraw/zinc/17/81/69/1025178169.db2.gz WRZVUEBOUKZPPT-KRWDZBQOSA-N 1 0 332.425 3.982 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@H]([C@@H]2CCCC[N@@H+]2CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000439000133 1025381459 /nfs/dbraw/zinc/38/14/59/1025381459.db2.gz WDUWNJURNCTRCJ-TTYHFUOFSA-N 1 0 346.471 3.789 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1cccc([N+](=O)[O-])c1 ZINC000119915558 1025423277 /nfs/dbraw/zinc/42/32/77/1025423277.db2.gz WBKHTYLKQJVHKU-GXTWGEPZSA-N 1 0 346.818 3.573 20 5 EHBDRO Cc1cc(C)cc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000451107426 1025540715 /nfs/dbraw/zinc/54/07/15/1025540715.db2.gz RJXKHOPTNWCEMH-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@]2(CO)CCCc3ccccc32)ccc1Cl ZINC000281840464 1025562699 /nfs/dbraw/zinc/56/26/99/1025562699.db2.gz YKPWDRANDVJEIK-SFHVURJKSA-N 1 0 346.814 3.562 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)[C@@H](c2ccccc2)N(C)C)cc1[N+](=O)[O-] ZINC000185673805 1025584283 /nfs/dbraw/zinc/58/42/83/1025584283.db2.gz HTMFUXLZDZNUQL-BEFAXECRSA-N 1 0 327.428 3.684 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)CN1CCC[N@@H+](C(C)(C)C)CC1 ZINC000530342006 1025680968 /nfs/dbraw/zinc/68/09/68/1025680968.db2.gz AHZCBQOJCFWJOV-SSZFMOIBSA-N 1 0 331.460 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1NCCCCC[NH+]1CCCCC1)CCN2 ZINC000436402863 1025682926 /nfs/dbraw/zinc/68/29/26/1025682926.db2.gz CCOCCBYNCYQXMB-UHFFFAOYSA-N 1 0 332.448 3.631 20 5 EHBDRO Cc1ccc2c(CC[NH2+]Cc3csc([N+](=O)[O-])c3)cn(C)c2c1 ZINC000436416170 1025697113 /nfs/dbraw/zinc/69/71/13/1025697113.db2.gz YPLIPFJCYWQWCJ-UHFFFAOYSA-N 1 0 329.425 3.789 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000474865730 1025717571 /nfs/dbraw/zinc/71/75/71/1025717571.db2.gz BAPKEVDHLXDMGE-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@@H]1[C@@H]1CCC[C@H]1O ZINC000451412189 1025945700 /nfs/dbraw/zinc/94/57/00/1025945700.db2.gz FWFSNZZCDLBFFL-RCCFBDPRSA-N 1 0 348.443 3.507 20 5 EHBDRO CSc1ccc([C@H](CNc2ncc([N+](=O)[O-])cc2C)[NH+](C)C)cc1 ZINC000338833953 1026215415 /nfs/dbraw/zinc/21/54/15/1026215415.db2.gz CHOUUHFWYJUCGL-INIZCTEOSA-N 1 0 346.456 3.735 20 5 EHBDRO COC(=O)c1oc([C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511122014 1026218058 /nfs/dbraw/zinc/21/80/58/1026218058.db2.gz LZDOZCGDIGEFGQ-CYBMUJFWSA-N 1 0 346.383 3.518 20 5 EHBDRO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000338957093 1026301692 /nfs/dbraw/zinc/30/16/92/1026301692.db2.gz YBCHHLMQRYUCPE-UHFFFAOYSA-N 1 0 344.459 3.838 20 5 EHBDRO C[C@H](c1cccs1)N(C)Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000025931401 1026462259 /nfs/dbraw/zinc/46/22/59/1026462259.db2.gz AJXTYZGJDXMQKU-LLVKDONJSA-N 1 0 344.396 3.899 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1 ZINC000452090383 1026484893 /nfs/dbraw/zinc/48/48/93/1026484893.db2.gz QTZMHRINOQBAJZ-KBPBESRZSA-N 1 0 327.384 3.581 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[N@H+]3CCCC[C@H]3C)C2)n1 ZINC000611616502 1026524847 /nfs/dbraw/zinc/52/48/47/1026524847.db2.gz ULTPPOBCNVRUNB-SJORKVTESA-N 1 0 346.475 3.697 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@H](C[N@H+]3CCCC[C@H]3C)C2)n1 ZINC000611616500 1026525265 /nfs/dbraw/zinc/52/52/65/1026525265.db2.gz ULTPPOBCNVRUNB-IAGOWNOFSA-N 1 0 346.475 3.697 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@H](COC)Cc1ccccc1 ZINC000531104373 1026574499 /nfs/dbraw/zinc/57/44/99/1026574499.db2.gz VMTAVDHFEGGELK-IBGZPJMESA-N 1 0 328.412 3.674 20 5 EHBDRO C[C@H]([NH2+]C[C@H](CO)C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000562104422 1026780129 /nfs/dbraw/zinc/78/01/29/1026780129.db2.gz VCDCQTZYKLHVKS-GXTWGEPZSA-N 1 0 346.452 3.992 20 5 EHBDRO CC[NH+](CC)[C@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)(F)F)C1 ZINC000301467751 1026815967 /nfs/dbraw/zinc/81/59/67/1026815967.db2.gz MNDSRTXERPWYHR-LBPRGKRZSA-N 1 0 331.338 3.534 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)c(OC)c1 ZINC000531694208 1027246527 /nfs/dbraw/zinc/24/65/27/1027246527.db2.gz HYNXVULVADASAR-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(Cc2ccccc2)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000310625640 1027490186 /nfs/dbraw/zinc/49/01/86/1027490186.db2.gz CUTYMFVFNVKSPZ-TWOQFEAHSA-N 1 0 339.439 3.908 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1C[C@@H](c2ccccc2F)[C@H]([NH3+])C1 ZINC000420386864 1027505144 /nfs/dbraw/zinc/50/51/44/1027505144.db2.gz JGBZZTTXAAYQBD-XVGQJIODSA-N 1 0 343.402 3.530 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)COCc1ccccc1 ZINC000390057189 1027696346 /nfs/dbraw/zinc/69/63/46/1027696346.db2.gz OVVAJSYXKKBNTN-UHFFFAOYSA-N 1 0 344.411 3.688 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCN2CCCC[C@@H]12 ZINC000513784976 1027706362 /nfs/dbraw/zinc/70/63/62/1027706362.db2.gz COOFMJXOOVPDLL-BOLBYERCSA-N 1 0 343.471 3.522 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+]CC1(O)CCCCC1 ZINC000513786665 1027712398 /nfs/dbraw/zinc/71/23/98/1027712398.db2.gz LBYWRKCHBHLHBS-DOTOQJQBSA-N 1 0 332.444 3.591 20 5 EHBDRO COc1ccc2c(c1)CC[C@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)C2 ZINC000612049435 1027781739 /nfs/dbraw/zinc/78/17/39/1027781739.db2.gz PNANRNDTLCLMIV-DYVFJYSZSA-N 1 0 326.396 3.812 20 5 EHBDRO CO[C@@H](C)C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)C(C)C ZINC000533432417 1027869668 /nfs/dbraw/zinc/86/96/68/1027869668.db2.gz XOCYSZSDMPEFNO-AWEZNQCLSA-N 1 0 347.415 3.538 20 5 EHBDRO C[C@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)c1ccccc1 ZINC000444674263 1028145694 /nfs/dbraw/zinc/14/56/94/1028145694.db2.gz OPEABPLRJQNJAO-ZDUSSCGKSA-N 1 0 338.411 3.927 20 5 EHBDRO CC[C@](O)(CCC(F)(F)F)C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-] ZINC000897522291 1028223342 /nfs/dbraw/zinc/22/33/42/1028223342.db2.gz LGVUPMFRAJGOJA-PKYBCLHXSA-N 1 0 346.349 3.681 20 5 EHBDRO C[C@H](N[C@@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178621 1028248871 /nfs/dbraw/zinc/24/88/71/1028248871.db2.gz CEWQDLKJGBPAFE-QWHCGFSZSA-N 1 0 331.441 3.726 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H](CCO)CC3)o2)cc1 ZINC000421401228 1028348228 /nfs/dbraw/zinc/34/82/28/1028348228.db2.gz TYVYPLRRDKZHGC-HNNXBMFYSA-N 1 0 344.411 3.839 20 5 EHBDRO CCc1ccccc1[C@H](N)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000423505219 1028469809 /nfs/dbraw/zinc/46/98/09/1028469809.db2.gz OCHUTDGQJMZGDA-KBXCAEBGSA-N 1 0 327.428 3.816 20 5 EHBDRO Cc1cc(N)cc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000423484119 1028473867 /nfs/dbraw/zinc/47/38/67/1028473867.db2.gz TZJAXMFUCKRMCZ-GOSISDBHSA-N 1 0 325.412 3.596 20 5 EHBDRO c1ccc2c(c1)cc1ccccc1c2C[NH2+]C[C@H]1CN2CCC[C@H]2CO1 ZINC000729684798 1028553608 /nfs/dbraw/zinc/55/36/08/1028553608.db2.gz WWXALVNUZANNJU-PMACEKPBSA-N 1 0 346.474 3.946 20 5 EHBDRO CC(C)(c1nc(C2([NH3+])CCCCC2)no1)c1ccc([N+](=O)[O-])cc1F ZINC000424347736 1029027897 /nfs/dbraw/zinc/02/78/97/1029027897.db2.gz SBGJNWFCEBKVGJ-UHFFFAOYSA-N 1 0 348.378 3.561 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](O)CC(C)(C)C ZINC000504894963 1029039708 /nfs/dbraw/zinc/03/97/08/1029039708.db2.gz PMBYNFDDXYRCPV-KBPBESRZSA-N 1 0 340.489 3.852 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCOc2ccccc2F)cc1[N+](=O)[O-] ZINC000504906034 1029050121 /nfs/dbraw/zinc/05/01/21/1029050121.db2.gz RRQHKZPMPPCUKC-CYBMUJFWSA-N 1 0 348.374 3.862 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC[C@@H](O)C1 ZINC000504905770 1029051265 /nfs/dbraw/zinc/05/12/65/1029051265.db2.gz NOWMLWQNYGYDFE-RRFJBIMHSA-N 1 0 338.473 3.606 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCCN1CC ZINC000504911347 1029052659 /nfs/dbraw/zinc/05/26/59/1029052659.db2.gz FAPHGSDDOWPEJR-LSDHHAIUSA-N 1 0 337.489 3.539 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCCN1CC ZINC000504911345 1029053402 /nfs/dbraw/zinc/05/34/02/1029053402.db2.gz FAPHGSDDOWPEJR-GJZGRUSLSA-N 1 0 337.489 3.539 20 5 EHBDRO CC[C@@H](C)[C@@](C)(O)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000524294191 1029055682 /nfs/dbraw/zinc/05/56/82/1029055682.db2.gz WUXQMIZEMZGFHH-ACJLOTCBSA-N 1 0 332.400 3.742 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCN2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930042 1029076407 /nfs/dbraw/zinc/07/64/07/1029076407.db2.gz MYVRYQPXFWRVRA-GJZGRUSLSA-N 1 0 335.448 3.519 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCN2CCCC[C@@H]2C)cc1[N+](=O)[O-] ZINC000504930045 1029076762 /nfs/dbraw/zinc/07/67/62/1029076762.db2.gz MYVRYQPXFWRVRA-LSDHHAIUSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CC(=O)Nc1ccc(Cl)cc1 ZINC000533088505 1029315183 /nfs/dbraw/zinc/31/51/83/1029315183.db2.gz ZTSZJXCSWSAZLL-LBPRGKRZSA-N 1 0 347.802 3.846 20 5 EHBDRO CC1(C)CCCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000446063136 1029355500 /nfs/dbraw/zinc/35/55/00/1029355500.db2.gz WWPQMKOSICQCNP-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C)[C@@H]1CCC[C@@H](C)C1 ZINC000533248716 1029526408 /nfs/dbraw/zinc/52/64/08/1029526408.db2.gz MLFHECFMTIZLJF-UKRRQHHQSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H]1C[N@@H+](C2CC2)C[C@@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988784 1029575121 /nfs/dbraw/zinc/57/51/21/1029575121.db2.gz JSICUHZRMWEXML-ZANVPECISA-N 1 0 329.322 3.508 20 5 EHBDRO CC[C@H](CCO)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000524885158 1029594306 /nfs/dbraw/zinc/59/43/06/1029594306.db2.gz LCRHUMSXXXRMDK-MRXNPFEDSA-N 1 0 343.427 3.613 20 5 EHBDRO CC[C@@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)CC1 ZINC000533298146 1029600530 /nfs/dbraw/zinc/60/05/30/1029600530.db2.gz IEDSIQOVQHSWRO-OAHLLOKOSA-N 1 0 333.432 3.744 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000428442185 1029623671 /nfs/dbraw/zinc/62/36/71/1029623671.db2.gz SVQRGYCXVJVQES-ICEKFOEVSA-N 1 0 340.423 3.957 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CNc2ncc([N+](=O)[O-])s2)[C@@H]1c1cccs1 ZINC000192464447 1029681060 /nfs/dbraw/zinc/68/10/60/1029681060.db2.gz DFJGXVDATKCAFT-GXFFZTMASA-N 1 0 338.458 3.608 20 5 EHBDRO CC[C@@]1(O)CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000428446995 1029688963 /nfs/dbraw/zinc/68/89/63/1029688963.db2.gz KXUKPVKLURFERH-QGZVFWFLSA-N 1 0 332.425 3.670 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCC1CCN(c2ncc([N+](=O)[O-])s2)CC1 ZINC000192492646 1029708741 /nfs/dbraw/zinc/70/87/41/1029708741.db2.gz GGZIGXVNTFJLLM-ZDUSSCGKSA-N 1 0 338.477 3.532 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+](CCCO)Cc2cccc(Cl)c2)cc1 ZINC000441064077 1029724565 /nfs/dbraw/zinc/72/45/65/1029724565.db2.gz PKFNPMDNAZXONQ-UHFFFAOYSA-N 1 0 348.830 3.675 20 5 EHBDRO CCC[N@H+](CCc1ccc([N+](=O)[O-])cc1)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000525409895 1029839620 /nfs/dbraw/zinc/83/96/20/1029839620.db2.gz WRJHQJGHRPQAEU-KURKYZTESA-N 1 0 332.444 3.663 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@H]3CCO)s2)cc1 ZINC000428462390 1029873828 /nfs/dbraw/zinc/87/38/28/1029873828.db2.gz SWQAFTIYYGJZEB-AWEZNQCLSA-N 1 0 332.425 3.670 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCc2ccc(OCCC[NH+](C)C)cc2)c1 ZINC000447077843 1029904824 /nfs/dbraw/zinc/90/48/24/1029904824.db2.gz REKIKCIRZCFPSS-UHFFFAOYSA-N 1 0 343.427 3.846 20 5 EHBDRO COc1ccc([C@@H](CCO)[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000120258371 1029929136 /nfs/dbraw/zinc/92/91/36/1029929136.db2.gz UKFOADFITYVAEJ-IFXJQAMLSA-N 1 0 344.411 3.686 20 5 EHBDRO CC(C)(C)OC(=O)CC[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000525697333 1030029071 /nfs/dbraw/zinc/02/90/71/1030029071.db2.gz LNPRTAKOQFTKMI-UHFFFAOYSA-N 1 0 346.383 3.676 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)CC(C)(C)O ZINC000453320122 1030099383 /nfs/dbraw/zinc/09/93/83/1030099383.db2.gz NEAHLVLENUZGGF-STQMWFEESA-N 1 0 326.462 3.605 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@@H](C)n2ccnc21 ZINC000453345456 1030130739 /nfs/dbraw/zinc/13/07/39/1030130739.db2.gz KAGZHGNDHCAWKS-MCIONIFRSA-N 1 0 346.456 3.958 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC[C@@H]1CCOC1 ZINC000453356780 1030150606 /nfs/dbraw/zinc/15/06/06/1030150606.db2.gz JCHIVNNDXDJVFY-CABCVRRESA-N 1 0 338.473 3.872 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H]2CCC[C@H]2O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453385879 1030169342 /nfs/dbraw/zinc/16/93/42/1030169342.db2.gz OHMWZAJHZUCNDH-POZUXBRTSA-N 1 0 344.411 3.590 20 5 EHBDRO C[C@@H]1CC[C@@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)O1 ZINC000453408793 1030219775 /nfs/dbraw/zinc/21/97/75/1030219775.db2.gz NRHMTGORQABIAK-CCKFTAQKSA-N 1 0 326.396 3.841 20 5 EHBDRO CO[C@@H]([C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000453390116 1030235256 /nfs/dbraw/zinc/23/52/56/1030235256.db2.gz XWNNIVVCDYNPNA-KOJWFEOWSA-N 1 0 332.444 3.709 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2ccccc2Cl)n1 ZINC000447544080 1030277712 /nfs/dbraw/zinc/27/77/12/1030277712.db2.gz NDRHFTCQQHBJPD-CVEARBPZSA-N 1 0 348.834 3.761 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1F ZINC000447544177 1030278777 /nfs/dbraw/zinc/27/87/77/1030278777.db2.gz UOQKHEQNPKGNBR-GOSISDBHSA-N 1 0 344.386 3.952 20 5 EHBDRO CO[C@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447559614 1030300635 /nfs/dbraw/zinc/30/06/35/1030300635.db2.gz AEQFEGGEJQQCTL-RBUKOAKNSA-N 1 0 326.396 3.950 20 5 EHBDRO CN(C)c1ccccc1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447589619 1030326002 /nfs/dbraw/zinc/32/60/02/1030326002.db2.gz YOKRNECKCDHKOX-SFHVURJKSA-N 1 0 325.412 3.828 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](CCO)C1CCCCC1)CCC2 ZINC000447577650 1030338265 /nfs/dbraw/zinc/33/82/65/1030338265.db2.gz ASYRKHDWDMJGCT-RBUKOAKNSA-N 1 0 332.444 3.893 20 5 EHBDRO CN(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000192601699 1030426898 /nfs/dbraw/zinc/42/68/98/1030426898.db2.gz ANUCPAJYLYVJGA-IRXDYDNUSA-N 1 0 345.468 3.926 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]C1CCC2(CC2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000278403414 1030645284 /nfs/dbraw/zinc/64/52/84/1030645284.db2.gz OPFPLBUMEIVLQX-QGZVFWFLSA-N 1 0 340.427 3.730 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN1CCC[C@H]1c1cccc(C)n1 ZINC000160343711 1030685071 /nfs/dbraw/zinc/68/50/71/1030685071.db2.gz DTUAVBCGJPOJBR-KRWDZBQOSA-N 1 0 327.384 3.644 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(O)CCC[C@@H](C(F)(F)F)C1)c1cccc([N+](=O)[O-])c1 ZINC000249174524 1030752003 /nfs/dbraw/zinc/75/20/03/1030752003.db2.gz DMVQMUCLMFZRPO-LNSITVRQSA-N 1 0 346.349 3.729 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC(C)(C)O[C@@]2(CCCOC2)C1 ZINC000483340554 1031127638 /nfs/dbraw/zinc/12/76/38/1031127638.db2.gz KVHQGZVPPYLDNM-KXBFYZLASA-N 1 0 348.443 3.624 20 5 EHBDRO COc1cc([C@@H](C)[NH2+]CC2([C@H]3CCCCO3)CCC2)cc([N+](=O)[O-])c1 ZINC000903211759 1031287531 /nfs/dbraw/zinc/28/75/31/1031287531.db2.gz HWFCBIQNAGMNJI-RDTXWAMCSA-N 1 0 348.443 3.993 20 5 EHBDRO CCC1(CO)CC[NH+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000129816692 1031402521 /nfs/dbraw/zinc/40/25/21/1031402521.db2.gz KRVOKLGMQAPYKL-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1nc2c(s1)CCC2 ZINC000926931388 1031532425 /nfs/dbraw/zinc/53/24/25/1031532425.db2.gz ABVOJULNYAQUDM-LBPRGKRZSA-N 1 0 331.441 3.742 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)[C@@H](C)C1 ZINC000248548758 1031938305 /nfs/dbraw/zinc/93/83/05/1031938305.db2.gz GXQJTLBXQIGZSW-TYNCELHUSA-N 1 0 330.388 3.559 20 5 EHBDRO C[C@@H]([NH2+][C@H](CNC(=O)OC(C)(C)C)C1CC1)c1cccc([N+](=O)[O-])c1 ZINC000173439629 1033333391 /nfs/dbraw/zinc/33/33/91/1033333391.db2.gz HCVPCBLNLDGWEO-MLGOLLRUSA-N 1 0 349.431 3.549 20 5 EHBDRO CCOc1cncc(C[N@@H+]2CCC[C@@H](c3ccc([N+](=O)[O-])cc3)C2)c1 ZINC000598674996 1033390833 /nfs/dbraw/zinc/39/08/33/1033390833.db2.gz BRYXSGJKSNZOLS-QGZVFWFLSA-N 1 0 341.411 3.768 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](CCC(C)C)C2CC2)cccc1[N+](=O)[O-] ZINC000063493221 1033400797 /nfs/dbraw/zinc/40/07/97/1033400797.db2.gz NMAUNKPHXHZXBQ-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H](c2ccco2)N2CCCCC2)c1 ZINC000061013459 1033436739 /nfs/dbraw/zinc/43/67/39/1033436739.db2.gz GGJZMWXXDLVTLV-KRWDZBQOSA-N 1 0 329.400 3.505 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@H]23)cc1OC(F)F ZINC000594597684 1033444117 /nfs/dbraw/zinc/44/41/17/1033444117.db2.gz DXMKCTXRFCIURB-QWHCGFSZSA-N 1 0 341.358 3.625 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1(CO)CC1 ZINC000594968741 1033577228 /nfs/dbraw/zinc/57/72/28/1033577228.db2.gz JOHINVUAOLXLGI-LBPRGKRZSA-N 1 0 332.425 3.574 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(C(F)(F)F)nn1C)c1cccc([N+](=O)[O-])c1 ZINC000594937157 1033586461 /nfs/dbraw/zinc/58/64/61/1033586461.db2.gz IKRLPWXVHDXNMT-ZDUSSCGKSA-N 1 0 342.321 3.588 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC000595000226 1033626247 /nfs/dbraw/zinc/62/62/47/1033626247.db2.gz HWDXZNAIIIXRLV-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054949 1033633122 /nfs/dbraw/zinc/63/31/22/1033633122.db2.gz XRZZHCUCIULDMU-DZGCQCFKSA-N 1 0 335.448 3.517 20 5 EHBDRO CC(C)CC[C@H](CO)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000598991675 1033644550 /nfs/dbraw/zinc/64/45/50/1033644550.db2.gz RHQBYXPMIKYTOF-CQSZACIVSA-N 1 0 349.456 3.605 20 5 EHBDRO Cc1cc(NCC(C)(C)C(F)(F)F)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000515313446 1033650587 /nfs/dbraw/zinc/65/05/87/1033650587.db2.gz GKYQRFRSRFCVSM-UHFFFAOYSA-N 1 0 327.306 3.874 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H]1CC(=O)N(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595105928 1033690957 /nfs/dbraw/zinc/69/09/57/1033690957.db2.gz URJXTFQERVEXMG-WMLDXEAASA-N 1 0 347.459 3.673 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000595103627 1033692397 /nfs/dbraw/zinc/69/23/97/1033692397.db2.gz NFWLVERKDCCDOM-KXBFYZLASA-N 1 0 325.412 3.520 20 5 EHBDRO COCc1csc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2OC)c1 ZINC000595077154 1033696348 /nfs/dbraw/zinc/69/63/48/1033696348.db2.gz MNAYDGVKHLWFKF-LLVKDONJSA-N 1 0 336.413 3.662 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@@H]1CCN1C1CCCCC1 ZINC000599064268 1033702312 /nfs/dbraw/zinc/70/23/12/1033702312.db2.gz LXEGXCNRDGFZFE-MAUKXSAKSA-N 1 0 329.444 3.579 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CC[C@H]1CCCOC1 ZINC000599055302 1033706768 /nfs/dbraw/zinc/70/67/68/1033706768.db2.gz DEJKBVYRMOMKDQ-HUUCEWRRSA-N 1 0 338.473 3.872 20 5 EHBDRO CC(C)c1ccc(C(=O)N2CCC[C@@H](C)[C@H]2CCC[NH3+])cc1[N+](=O)[O-] ZINC000595258495 1033724711 /nfs/dbraw/zinc/72/47/11/1033724711.db2.gz OAZUWEYTDAWZMI-RHSMWYFYSA-N 1 0 347.459 3.698 20 5 EHBDRO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000595330863 1033728168 /nfs/dbraw/zinc/72/81/68/1033728168.db2.gz MZJZNLQYGHSMGD-USXIJHARSA-N 1 0 336.407 3.759 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])C2CC2)cn1 ZINC000599095554 1033730581 /nfs/dbraw/zinc/73/05/81/1033730581.db2.gz GXGZCFZBSHKVNZ-LPHOPBHVSA-N 1 0 339.395 3.727 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc(F)cc1[N+](=O)[O-])c1ccccc1 ZINC000595460798 1033817496 /nfs/dbraw/zinc/81/74/96/1033817496.db2.gz IATYEZGVVILLBY-KRWDZBQOSA-N 1 0 332.375 3.583 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2ccccc2)C2CC2)c1 ZINC000593020290 1033823387 /nfs/dbraw/zinc/82/33/87/1033823387.db2.gz FTSRIZZNEXRZOF-SFHVURJKSA-N 1 0 340.379 3.622 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H](c3ccccn3)C2)cc1 ZINC000595502888 1033834890 /nfs/dbraw/zinc/83/48/90/1033834890.db2.gz XDMPCGDITXZYKJ-INIZCTEOSA-N 1 0 341.411 3.638 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1C[C@@H]2CCCC[C@@H]21 ZINC000595566253 1033844525 /nfs/dbraw/zinc/84/45/25/1033844525.db2.gz NANYGQCVGMNVCQ-ZLDLUXBVSA-N 1 0 328.372 3.580 20 5 EHBDRO O=[N+]([O-])c1sccc1N1CCC[N@H+](CCCc2ccccc2)CC1 ZINC000608779443 1033884240 /nfs/dbraw/zinc/88/42/40/1033884240.db2.gz RDOHRWONKIFYDY-UHFFFAOYSA-N 1 0 345.468 3.801 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)C2CCC(F)CC2)c([N+](=O)[O-])cc1F ZINC000595819337 1033992614 /nfs/dbraw/zinc/99/26/14/1033992614.db2.gz OFYNOLUTJDVTHZ-ZBOXLXRLSA-N 1 0 328.359 3.749 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[NH2+][C@@H](c2ccccn2)C2CCC2)cc1 ZINC000599570539 1034004257 /nfs/dbraw/zinc/00/42/57/1034004257.db2.gz ZNHLJDYVQNMTPR-LJQANCHMSA-N 1 0 341.411 3.890 20 5 EHBDRO CCCC[NH+]1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450262038 1034004735 /nfs/dbraw/zinc/00/47/35/1034004735.db2.gz QQCFWKXLUNAUIA-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCC[C@H](C4CCC4)C3)n2)c1 ZINC000595832132 1034014817 /nfs/dbraw/zinc/01/48/17/1034014817.db2.gz IRDHUXBRTKASBD-HNNXBMFYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[NH+](C)C1CCC(Nc2c(Br)cccc2[N+](=O)[O-])CC1 ZINC000596279645 1034139030 /nfs/dbraw/zinc/13/90/30/1034139030.db2.gz YPKBXBHWUISTGM-UHFFFAOYSA-N 1 0 342.237 3.642 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CCC[C@H]2CCO)c2ccccc2)c1 ZINC000250122692 1034139867 /nfs/dbraw/zinc/13/98/67/1034139867.db2.gz VPDMOKMWYWYCRC-RYGJVYDSSA-N 1 0 340.423 3.825 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)c1 ZINC000456269158 1034268148 /nfs/dbraw/zinc/26/81/48/1034268148.db2.gz JPSCYRIUUGVXOZ-KRWDZBQOSA-N 1 0 339.395 3.704 20 5 EHBDRO CCOc1cccc(NC[C@H]2CCC[N@H+](CC3CC3)C2)c1[N+](=O)[O-] ZINC000596570814 1034293450 /nfs/dbraw/zinc/29/34/50/1034293450.db2.gz OHDDICJRCOIQQN-OAHLLOKOSA-N 1 0 333.432 3.527 20 5 EHBDRO Nc1ccc2c(c1)CC[C@H]2[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000596650288 1034345629 /nfs/dbraw/zinc/34/56/29/1034345629.db2.gz GVVJCRAYEUMTLO-RTBURBONSA-N 1 0 337.423 3.775 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])C2 ZINC000612194074 1034435966 /nfs/dbraw/zinc/43/59/66/1034435966.db2.gz XAONJTCEBBHYJJ-WLPBJKJWSA-N 1 0 338.407 3.764 20 5 EHBDRO CC(C)OCCOC1CC[NH+]([C@H](C)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000451955080 1034439038 /nfs/dbraw/zinc/43/90/38/1034439038.db2.gz ZDSBMXLMGAWUKL-OAHLLOKOSA-N 1 0 336.432 3.562 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@@H]1CCCn2nccc21 ZINC000601319999 1034450785 /nfs/dbraw/zinc/45/07/85/1034450785.db2.gz CJLQRRUAMZCJRW-USXIJHARSA-N 1 0 340.427 3.627 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CCC[C@@](O)(C4CC4)C3)o2)cc1 ZINC000597205083 1034607678 /nfs/dbraw/zinc/60/76/78/1034607678.db2.gz LHWKUHZPPGUWMQ-IBGZPJMESA-N 1 0 342.395 3.592 20 5 EHBDRO C[C@@H](c1cccc(Nc2ccccc2[N+](=O)[O-])c1)N1CCOCC1 ZINC000511452446 1035459055 /nfs/dbraw/zinc/45/90/55/1035459055.db2.gz BMZLOYPVZRPMDX-AWEZNQCLSA-N 1 0 327.384 3.732 20 5 EHBDRO COCC1(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCC1 ZINC000581681402 1035546960 /nfs/dbraw/zinc/54/69/60/1035546960.db2.gz NCYUNGUPBIYYCE-KRWDZBQOSA-N 1 0 332.444 3.712 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(CNc3sccc3[N+](=O)[O-])cc2)CC1 ZINC000588050441 1035679831 /nfs/dbraw/zinc/67/98/31/1035679831.db2.gz DGDNVSXFWZWBCK-UHFFFAOYSA-N 1 0 347.440 3.741 20 5 EHBDRO CC(=O)c1cc(N[C@H](C)C[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000588012563 1035681132 /nfs/dbraw/zinc/68/11/32/1035681132.db2.gz BACYFZZUNVODCF-CQSZACIVSA-N 1 0 341.411 3.730 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1nccn1-c1ccccc1 ZINC000588311570 1035899718 /nfs/dbraw/zinc/89/97/18/1035899718.db2.gz BFMAXWCDNYGRRB-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C2CCC(C(F)F)CC2)n1 ZINC000414190072 1035982051 /nfs/dbraw/zinc/98/20/51/1035982051.db2.gz RGEVELQGVNTUHN-NWINJMCUSA-N 1 0 342.390 3.689 20 5 EHBDRO COc1cccc2c1C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000414204103 1036048242 /nfs/dbraw/zinc/04/82/42/1036048242.db2.gz ZYNOUJYWGAZQSE-DZGCQCFKSA-N 1 0 326.396 3.730 20 5 EHBDRO CCCC[C@@H]1CCC[C@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000492818133 1036335600 /nfs/dbraw/zinc/33/56/00/1036335600.db2.gz MPZORQWWSWKODL-GDBMZVCRSA-N 1 0 333.432 3.790 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2c2ccccc2)c1 ZINC000589494668 1036436162 /nfs/dbraw/zinc/43/61/62/1036436162.db2.gz LCSBPGCLEIJBTL-KRWDZBQOSA-N 1 0 340.379 3.719 20 5 EHBDRO Cc1cc(C[NH+](C)C)cc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c1 ZINC000535418012 1036455466 /nfs/dbraw/zinc/45/54/66/1036455466.db2.gz JAVREYBZCZNIHQ-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CCOC(=O)[C@]1(C(C)C)CC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000572825989 1036509593 /nfs/dbraw/zinc/50/95/93/1036509593.db2.gz IPDGKFFJYCSDMZ-RDTXWAMCSA-N 1 0 334.416 3.567 20 5 EHBDRO CCOc1cccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(OC)c2)c1 ZINC000493005836 1036513611 /nfs/dbraw/zinc/51/36/11/1036513611.db2.gz ANSJUNUMBNREEZ-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@H](c2ccccc2)[C@H](CO)C1 ZINC000595748159 1036553801 /nfs/dbraw/zinc/55/38/01/1036553801.db2.gz QDVUYDDMEIMJJK-VDZJLULYSA-N 1 0 340.423 3.754 20 5 EHBDRO CC(C)[C@H](O)CC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000493050288 1036580525 /nfs/dbraw/zinc/58/05/25/1036580525.db2.gz BKIQFWBDZJERCU-RTBURBONSA-N 1 0 328.412 3.681 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN(c2ccc(F)cc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000152809927 1036790414 /nfs/dbraw/zinc/79/04/14/1036790414.db2.gz MJKMCMKXFOUPAU-CABCVRRESA-N 1 0 343.402 3.911 20 5 EHBDRO CCC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000539491144 1036808444 /nfs/dbraw/zinc/80/84/44/1036808444.db2.gz KNESJGAVOQJSNE-OAHLLOKOSA-N 1 0 333.432 3.872 20 5 EHBDRO C[C@@H](C(=O)OCc1ccc(Cl)c([N+](=O)[O-])c1)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000783775821 1036812579 /nfs/dbraw/zinc/81/25/79/1036812579.db2.gz IULOMQVTLBHQSY-TUAOUCFPSA-N 1 0 340.807 3.553 20 5 EHBDRO C[C@H]1CCC[C@H](C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000237693902 1036868167 /nfs/dbraw/zinc/86/81/67/1036868167.db2.gz JTFULGTVBDAEMT-GJZGRUSLSA-N 1 0 342.443 3.911 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C2(c3ccc(F)cc3)CCOCC2)c1 ZINC000237744857 1036902966 /nfs/dbraw/zinc/90/29/66/1036902966.db2.gz CQYAZMMIRSHYOP-UHFFFAOYSA-N 1 0 330.359 3.529 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[N@@H+]2CCCC[C@H]2CCCc2ccccc2)c1 ZINC000443650940 1036937129 /nfs/dbraw/zinc/93/71/29/1036937129.db2.gz QMOOHGSHKQNFOO-SFHVURJKSA-N 1 0 342.443 3.669 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCO[C@@H](CC(C)C)C1 ZINC000539615751 1036982834 /nfs/dbraw/zinc/98/28/34/1036982834.db2.gz JEUVXCKRADOIPW-RDJZCZTQSA-N 1 0 336.432 3.677 20 5 EHBDRO CC(C)[NH+](CCCNCc1ccc([N+](=O)[O-])c(Cl)c1)C(C)C ZINC000761524470 1037108977 /nfs/dbraw/zinc/10/89/77/1037108977.db2.gz DMZPUYCZZMJNCU-UHFFFAOYSA-N 1 0 327.856 3.847 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(CCCO)CC2)o1 ZINC000542177099 1037149943 /nfs/dbraw/zinc/14/99/43/1037149943.db2.gz IUTRIVAXGOZDPA-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H]2CCCSCC2)cc(C(F)(F)F)c1 ZINC000595045598 1037197569 /nfs/dbraw/zinc/19/75/69/1037197569.db2.gz ODOHETIXWUQYHJ-LBPRGKRZSA-N 1 0 334.363 3.989 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@@H]1CCOC2(CCSCC2)C1 ZINC000573107567 1037288931 /nfs/dbraw/zinc/28/89/31/1037288931.db2.gz YCUYTFUWXRCYGR-CZUORRHYSA-N 1 0 348.468 3.617 20 5 EHBDRO COc1cccc(CC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c1OC ZINC000532474067 1037433179 /nfs/dbraw/zinc/43/31/79/1037433179.db2.gz RRBYQOHVZVKQJX-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462830211 1037433241 /nfs/dbraw/zinc/43/32/41/1037433241.db2.gz AWQWOQCUZOVTNW-TXEJJXNPSA-N 1 0 343.374 3.871 20 5 EHBDRO CCCC[N@H+](C)CCNc1ccc([N+](=O)[O-])cc1Br ZINC000462842539 1037472382 /nfs/dbraw/zinc/47/23/82/1037472382.db2.gz DTPWDJISWYXWHD-UHFFFAOYSA-N 1 0 330.226 3.501 20 5 EHBDRO CC[C@@H]([NH2+]CCOc1ncccc1Cl)c1cccc([N+](=O)[O-])c1 ZINC000181322385 1037511465 /nfs/dbraw/zinc/51/14/65/1037511465.db2.gz CPJSDHXGGNPSCI-OAHLLOKOSA-N 1 0 335.791 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+][C@@H](CCO)C1CCCCC1 ZINC000760862914 1037534973 /nfs/dbraw/zinc/53/49/73/1037534973.db2.gz DAXBQHRQYOILKJ-HNNXBMFYSA-N 1 0 326.824 3.669 20 5 EHBDRO CO[C@@](C)(C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)C1CC1 ZINC000462907931 1037538682 /nfs/dbraw/zinc/53/86/82/1037538682.db2.gz WHJINFVLHTUERJ-SFHVURJKSA-N 1 0 330.384 3.760 20 5 EHBDRO CC(C)[NH+](CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1)C(C)C ZINC000462931985 1037555971 /nfs/dbraw/zinc/55/59/71/1037555971.db2.gz YUFYGESTZMUFLL-UHFFFAOYSA-N 1 0 331.363 3.727 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cnn(CC(F)(F)F)c2)cccc1[N+](=O)[O-] ZINC000532538724 1037568991 /nfs/dbraw/zinc/56/89/91/1037568991.db2.gz BOPLGACKKMBYKU-LLVKDONJSA-N 1 0 342.321 3.513 20 5 EHBDRO Cc1ccc2c(c1)OCCC[C@@H]2[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000540168434 1037636997 /nfs/dbraw/zinc/63/69/97/1037636997.db2.gz INQXQPQMNAEEFW-SFHVURJKSA-N 1 0 342.395 3.786 20 5 EHBDRO CN(C[C@@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc(F)cc1[N+](=O)[O-] ZINC000463067717 1037729081 /nfs/dbraw/zinc/72/90/81/1037729081.db2.gz FDPPWRCIDPICEK-INIZCTEOSA-N 1 0 343.402 3.692 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCC[N@@H+]2CCCC[C@H]12 ZINC000596296318 1037758114 /nfs/dbraw/zinc/75/81/14/1037758114.db2.gz HAVCDQYUSYMCRZ-GXTWGEPZSA-N 1 0 325.359 3.961 20 5 EHBDRO CC[C@H](O)CCC[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494004000 1037763573 /nfs/dbraw/zinc/76/35/73/1037763573.db2.gz NJAOAEYCPAZWEV-OALUTQOASA-N 1 0 328.412 3.825 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000341221994 1037784338 /nfs/dbraw/zinc/78/43/38/1037784338.db2.gz WQFNLHBONSEROH-INIZCTEOSA-N 1 0 341.411 3.973 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000540395324 1037887737 /nfs/dbraw/zinc/88/77/37/1037887737.db2.gz RBJFFNUFRWBZPN-CYBMUJFWSA-N 1 0 330.432 3.537 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](c1cccs1)N(C)C ZINC000468644776 1037901363 /nfs/dbraw/zinc/90/13/63/1037901363.db2.gz GOURMISXVWKXJL-QXSWTLKVSA-N 1 0 345.468 3.952 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)c1csc(C)c1 ZINC000592188869 1037925715 /nfs/dbraw/zinc/92/57/15/1037925715.db2.gz QSFFRWACRZLTSY-INIZCTEOSA-N 1 0 347.440 3.668 20 5 EHBDRO CC[C@H](O)C[NH2+]Cc1ccc(Sc2ccc(C)cc2)c([N+](=O)[O-])c1 ZINC000492078160 1037955443 /nfs/dbraw/zinc/95/54/43/1037955443.db2.gz DVDLQQUPFJVWBI-HNNXBMFYSA-N 1 0 346.452 3.915 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(C)[C@H]2CCCC[C@H]2C)cc1[N+](=O)[O-] ZINC000540479659 1037991321 /nfs/dbraw/zinc/99/13/21/1037991321.db2.gz SLDORBLCEAGQJY-KMFMINBZSA-N 1 0 347.459 3.591 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@H+](C)[C@@H](C)C2)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000461961579 1038698647 /nfs/dbraw/zinc/69/86/47/1038698647.db2.gz XUMUGMBNYAFZQO-WDEREUQCSA-N 1 0 331.338 3.817 20 5 EHBDRO CC(C)c1noc(CCC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)n1 ZINC000192809672 1038728468 /nfs/dbraw/zinc/72/84/68/1038728468.db2.gz ZXKLEFHVQPRUMY-INIZCTEOSA-N 1 0 344.415 3.701 20 5 EHBDRO CC[C@@H](C)[C@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000539313688 1038768353 /nfs/dbraw/zinc/76/83/53/1038768353.db2.gz AZQQHAMNOAPTJU-WBMJQRKESA-N 1 0 336.823 3.822 20 5 EHBDRO Cc1cccc(C(=O)Nc2ccc(C[NH+]3CCCC3)cc2)c1[N+](=O)[O-] ZINC000028162458 1038888728 /nfs/dbraw/zinc/88/87/28/1038888728.db2.gz OPUWYOUSXCLYMJ-UHFFFAOYSA-N 1 0 339.395 3.751 20 5 EHBDRO Cc1cccc(C)c1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905854958 1039160693 /nfs/dbraw/zinc/16/06/93/1039160693.db2.gz YMDYTUXHBZQDGG-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H]1C[C@@H](CCNc2ncccc2[N+](=O)[O-])C[N@@H+]1Cc1ccccc1 ZINC000511603747 1039429986 /nfs/dbraw/zinc/42/99/86/1039429986.db2.gz MDGPRTLCQXQBDV-DOTOQJQBSA-N 1 0 340.427 3.702 20 5 EHBDRO O=C(C[NH2+][C@H]1CCCCC12CCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000584669436 1039444301 /nfs/dbraw/zinc/44/43/01/1039444301.db2.gz WLHKIGPAZLOSIJ-INIZCTEOSA-N 1 0 331.416 3.626 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C(C)(C)O ZINC000480471413 1039590082 /nfs/dbraw/zinc/59/00/82/1039590082.db2.gz HCPICRYNIUSGDG-KRWDZBQOSA-N 1 0 332.400 3.740 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)c(C)o1 ZINC000417301342 1039643288 /nfs/dbraw/zinc/64/32/88/1039643288.db2.gz BIYXWACJPGJVHJ-SFHVURJKSA-N 1 0 329.400 3.799 20 5 EHBDRO CN(C)c1ccc(C[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cn1 ZINC000417309899 1039663468 /nfs/dbraw/zinc/66/34/68/1039663468.db2.gz GMMTXTPSLHTSBR-SFHVURJKSA-N 1 0 340.427 3.613 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCCOC[C@H]1CCCO1)CCCC2 ZINC000417309998 1039663962 /nfs/dbraw/zinc/66/39/62/1039663962.db2.gz GSSCNKWTKADRGR-MJGOQNOKSA-N 1 0 348.443 3.538 20 5 EHBDRO Cc1nccn1CCCC[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417311964 1039666944 /nfs/dbraw/zinc/66/69/44/1039666944.db2.gz MUSOAMLXGLQJOV-IBGZPJMESA-N 1 0 342.443 3.937 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+][C@@H]1COCc2ccccc21)C1CC1 ZINC000417364474 1039732510 /nfs/dbraw/zinc/73/25/10/1039732510.db2.gz MVUHVKZPWQPQJD-RTBURBONSA-N 1 0 338.407 3.777 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CO)C1CCCC1 ZINC000573610103 1040159245 /nfs/dbraw/zinc/15/92/45/1040159245.db2.gz JQBJEPZEQXVYTG-CABCVRRESA-N 1 0 338.473 3.606 20 5 EHBDRO COCCOc1ccccc1C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000481046267 1040294529 /nfs/dbraw/zinc/29/45/29/1040294529.db2.gz ILTOEBZLUDPJFA-OAHLLOKOSA-N 1 0 344.411 3.779 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](C[N@H+](C)CC2CC2)C1 ZINC000490037577 1040301208 /nfs/dbraw/zinc/30/12/08/1040301208.db2.gz IBUOPEXCVKJFDK-WBVHZDCISA-N 1 0 331.460 3.628 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(NC(N)=O)cc1)c1cccc([N+](=O)[O-])c1 ZINC000192848844 1040593778 /nfs/dbraw/zinc/59/37/78/1040593778.db2.gz JRULVDWBAONMII-PXAZEXFGSA-N 1 0 342.399 3.887 20 5 EHBDRO CC1(C)C[C@@H](N[C@H]2CC[N@@H+](C3CCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000433114678 1040766178 /nfs/dbraw/zinc/76/61/78/1040766178.db2.gz GTIKIRFAQFDIBV-IFXJQAMLSA-N 1 0 343.471 3.924 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1nccc2c1cccc2[N+](=O)[O-] ZINC001167751004 1040794988 /nfs/dbraw/zinc/79/49/88/1040794988.db2.gz GRNGCSPCCQSQSD-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1)C(C)(C)O ZINC000555627795 1040941324 /nfs/dbraw/zinc/94/13/24/1040941324.db2.gz OBMUDTYTKKCNKQ-KRWDZBQOSA-N 1 0 348.399 3.503 20 5 EHBDRO COC(=O)c1cc([C@@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])oc1C ZINC000433178859 1041009436 /nfs/dbraw/zinc/00/94/36/1041009436.db2.gz CQORMHLEDGYOHQ-GFCCVEGCSA-N 1 0 346.383 3.518 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)nc1 ZINC000078333905 1041019378 /nfs/dbraw/zinc/01/93/78/1041019378.db2.gz DSLMIVQKXIZSHO-QGZVFWFLSA-N 1 0 326.400 3.629 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@H]2CCCN(c3ccccc3)C2)c1 ZINC000433201848 1041057115 /nfs/dbraw/zinc/05/71/15/1041057115.db2.gz NYWAIKZVEYAFSZ-QGZVFWFLSA-N 1 0 325.412 3.601 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCCN(c3ccccc3)C2)c1 ZINC000433201847 1041058016 /nfs/dbraw/zinc/05/80/16/1041058016.db2.gz NYWAIKZVEYAFSZ-KRWDZBQOSA-N 1 0 325.412 3.601 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@@H]3CSC[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000512868904 1041139256 /nfs/dbraw/zinc/13/92/56/1041139256.db2.gz KCTQJDZXWLVRIP-XHDPSFHLSA-N 1 0 348.424 3.705 20 5 EHBDRO CC[C@@H]1CCCCC[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000150741042 1041217957 /nfs/dbraw/zinc/21/79/57/1041217957.db2.gz DBOBNVLMFCWITE-CQSZACIVSA-N 1 0 349.431 3.587 20 5 EHBDRO C[C@H](C[N@H+](C)CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000066854651 1041247330 /nfs/dbraw/zinc/24/73/30/1041247330.db2.gz GJHRWOUHORNMFS-OAHLLOKOSA-N 1 0 341.411 3.659 20 5 EHBDRO C[C@@H](CCc1ccc2c(c1)OCO2)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000481733644 1041308609 /nfs/dbraw/zinc/30/86/09/1041308609.db2.gz UMLWMZAQOKWUCK-KBPBESRZSA-N 1 0 342.395 3.995 20 5 EHBDRO Cc1cc(CC[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)on1 ZINC000512997777 1041366168 /nfs/dbraw/zinc/36/61/68/1041366168.db2.gz RKROVMSRZGAFJN-UHFFFAOYSA-N 1 0 343.408 3.952 20 5 EHBDRO CSc1ccc([N+](=O)[O-])c(C(=O)Nc2cccc(C[NH+](C)C)c2)c1 ZINC000047453752 1041643466 /nfs/dbraw/zinc/64/34/66/1041643466.db2.gz WSYNRJXQJVSADZ-UHFFFAOYSA-N 1 0 345.424 3.631 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000181710326 1041766903 /nfs/dbraw/zinc/76/69/03/1041766903.db2.gz ASXGKTISDBHUME-MRXNPFEDSA-N 1 0 341.411 3.973 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH2+]C2(CCO)CCCCC2)c1 ZINC000549527577 1041929739 /nfs/dbraw/zinc/92/97/39/1041929739.db2.gz SGUKKEQVQRUSOM-UHFFFAOYSA-N 1 0 346.349 3.789 20 5 EHBDRO CN(C(=O)C[NH2+][C@H]1CCCC[C@@H]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000111173955 1042238534 /nfs/dbraw/zinc/23/85/34/1042238534.db2.gz VUJLBZQUEIBBMJ-IRXDYDNUSA-N 1 0 347.459 3.752 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH+]1CCC(c2ccc(O)cc2)CC1 ZINC000544603603 1042468716 /nfs/dbraw/zinc/46/87/16/1042468716.db2.gz BDJMCOYRGIRBED-UHFFFAOYSA-N 1 0 326.396 3.988 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)NCCCCC[NH+]1CCCCC1 ZINC001126211724 1042594791 /nfs/dbraw/zinc/59/47/91/1042594791.db2.gz JDODHTVHXKPFTK-UHFFFAOYSA-N 1 0 347.459 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCCNc1ccccn1 ZINC000162874003 1042602681 /nfs/dbraw/zinc/60/26/81/1042602681.db2.gz MIBFZZAIZDYIIA-HNNXBMFYSA-N 1 0 328.416 3.841 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](c2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000156181346 1042630084 /nfs/dbraw/zinc/63/00/84/1042630084.db2.gz XNBROPWKTNXWJY-KXBFYZLASA-N 1 0 327.428 3.857 20 5 EHBDRO COc1ccccc1CCN(C)Cc1ccc([N+](=O)[O-])cc1Cl ZINC000541995233 1043003218 /nfs/dbraw/zinc/00/32/18/1043003218.db2.gz KVFOTDSSJZNAAZ-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCC[C@@H]4CCCC[C@@H]43)o2)cc1 ZINC000072971115 1043374029 /nfs/dbraw/zinc/37/40/29/1043374029.db2.gz VNLBGXLWBNUKIC-BBRMVZONSA-N 1 0 342.399 3.799 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC000512217910 1044185497 /nfs/dbraw/zinc/18/54/97/1044185497.db2.gz IDCOYMFUYUDDCM-LBPRGKRZSA-N 1 0 334.803 3.717 20 5 EHBDRO Cc1ccccc1[C@@H]1CCC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000178575966 1044776055 /nfs/dbraw/zinc/77/60/55/1044776055.db2.gz DWWMWJREWDUYDD-OALUTQOASA-N 1 0 326.396 3.774 20 5 EHBDRO Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])cc2Cl)c(C[NH+](C)C)c1 ZINC000072840236 1126901779 /nfs/dbraw/zinc/90/17/79/1126901779.db2.gz YSIJYXCKUJTPTP-UHFFFAOYSA-N 1 0 347.802 3.871 20 5 EHBDRO CC[C@@H](C)C[N@H+](CC)[C@H](C)C(=O)Nc1cc([N+](=O)[O-])ccc1Cl ZINC000764283262 1127473600 /nfs/dbraw/zinc/47/36/00/1127473600.db2.gz PFKBJQOHBYXWMX-VXGBXAGGSA-N 1 0 341.839 3.943 20 5 EHBDRO CC(C)(C)C1CC[NH+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000172031752 1127660906 /nfs/dbraw/zinc/66/09/06/1127660906.db2.gz WKXNJUODGYSDDP-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CNc1cc[nH+]c2cc(F)ccc12 ZINC000301281822 1127729354 /nfs/dbraw/zinc/72/93/54/1127729354.db2.gz QFVCTMWJYTYNNN-UHFFFAOYSA-N 1 0 327.315 3.903 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](C(C)C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000552488448 1127758224 /nfs/dbraw/zinc/75/82/24/1127758224.db2.gz BUHOVWSTAQUONE-LLVKDONJSA-N 1 0 344.358 3.683 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cn1ncc2cc([N+](=O)[O-])ccc21 ZINC000734477797 1131242135 /nfs/dbraw/zinc/24/21/35/1131242135.db2.gz UMDLYFQDCXRZKI-YOEHRIQHSA-N 1 0 336.395 3.780 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](O)c1cccc(F)c1 ZINC000273063598 1128439020 /nfs/dbraw/zinc/43/90/20/1128439020.db2.gz IBMNWEWMGDRDMM-QFYYESIMSA-N 1 0 338.766 3.599 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](O)C2CCCCC2)cc1[N+](=O)[O-] ZINC000153551647 1128448543 /nfs/dbraw/zinc/44/85/43/1128448543.db2.gz AXFMABNPLLVJSM-DYVFJYSZSA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cc(N[C@H]2C[C@@H](C)[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000301609977 1128519264 /nfs/dbraw/zinc/51/92/64/1128519264.db2.gz BUCFYTUYAXOSQV-PBHICJAKSA-N 1 0 341.411 3.678 20 5 EHBDRO CC(C)Oc1ccc([C@@H](C)[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000765847348 1128557453 /nfs/dbraw/zinc/55/74/53/1128557453.db2.gz BCBZRXNGXLWMOS-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@@H](C[N@H+](Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)CO)c1ccccc1 ZINC000554279722 1128636806 /nfs/dbraw/zinc/63/68/06/1128636806.db2.gz PLTSFXBABGRSOZ-HOTGVXAUSA-N 1 0 328.412 3.581 20 5 EHBDRO CO[C@@H](C)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000338704927 1128722887 /nfs/dbraw/zinc/72/28/87/1128722887.db2.gz CDDJHCCIEYJDGM-HNNXBMFYSA-N 1 0 343.427 3.877 20 5 EHBDRO Cc1nc(NCC(C)(C)[N@@H+]2CCc3ccccc3C2)ccc1[N+](=O)[O-] ZINC000301613892 1128745822 /nfs/dbraw/zinc/74/58/22/1128745822.db2.gz AKMHIKSRPXCANT-UHFFFAOYSA-N 1 0 340.427 3.547 20 5 EHBDRO Cc1nc(NC[C@H](c2ccccc2)[NH+]2CCCC2)ccc1[N+](=O)[O-] ZINC000301647189 1128822070 /nfs/dbraw/zinc/82/20/70/1128822070.db2.gz OIXMYCMRDPCOMS-QGZVFWFLSA-N 1 0 326.400 3.547 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000609194202 1120543018 /nfs/dbraw/zinc/54/30/18/1120543018.db2.gz DIGSHQUMGXTRRK-UHFFFAOYSA-N 1 0 330.359 3.782 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2cccc(OCC)c2[N+](=O)[O-])CC1 ZINC000542482453 1120551702 /nfs/dbraw/zinc/55/17/02/1120551702.db2.gz SJSKIMZDHONNRN-UHFFFAOYSA-N 1 0 349.475 3.942 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC[C@H]2CCOC2)c2ccccc2)c1 ZINC000542486346 1120607152 /nfs/dbraw/zinc/60/71/52/1120607152.db2.gz FLIBMZTYMWZZPM-HNAYVOBHSA-N 1 0 326.396 3.700 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)[C@H](C)c1ccccc1 ZINC000542539538 1120965144 /nfs/dbraw/zinc/96/51/44/1120965144.db2.gz SLSMBTWPTDMUJB-LSDHHAIUSA-N 1 0 341.411 3.705 20 5 EHBDRO C[C@@H](C(=O)Nc1ccc(C[NH+](C)C)c(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000761988710 1121036050 /nfs/dbraw/zinc/03/60/50/1121036050.db2.gz YSMYERPMAJBJGX-GFCCVEGCSA-N 1 0 345.374 3.538 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNc2ncccc2[N+](=O)[O-])cc1 ZINC000301069438 1121312225 /nfs/dbraw/zinc/31/22/25/1121312225.db2.gz COPYRWMGQPJMGW-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CC[C@@H]2SCCS[C@@H]12 ZINC000762616348 1121383506 /nfs/dbraw/zinc/38/35/06/1121383506.db2.gz SAARJDZHKLXKCW-HISOYIKUSA-N 1 0 336.482 3.577 20 5 EHBDRO CC1(c2ccccc2)CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000153737182 1121631229 /nfs/dbraw/zinc/63/12/29/1121631229.db2.gz YNXKEULPLDPGHS-LJQANCHMSA-N 1 0 340.423 3.682 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000272486279 1121661408 /nfs/dbraw/zinc/66/14/08/1121661408.db2.gz CWKOAYYZKWWHSW-KRWDZBQOSA-N 1 0 328.416 3.588 20 5 EHBDRO C[C@@H]1CCCC[C@H]1[N@H+](C)Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000194143306 1121784337 /nfs/dbraw/zinc/78/43/37/1121784337.db2.gz OXLCSTUULHJZSO-IUODEOHRSA-N 1 0 330.388 3.655 20 5 EHBDRO CC1CC[NH+](CCCCNc2ncc(Cl)cc2[N+](=O)[O-])CC1 ZINC000301734175 1129013803 /nfs/dbraw/zinc/01/38/03/1129013803.db2.gz GKEKNORUZAGULF-UHFFFAOYSA-N 1 0 326.828 3.567 20 5 EHBDRO CC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(OC)c(OC)c1 ZINC000326522057 1121974454 /nfs/dbraw/zinc/97/44/54/1121974454.db2.gz URWVZZLSVIUJBB-QGZVFWFLSA-N 1 0 344.411 3.895 20 5 EHBDRO COC(=O)Nc1cccc(C[NH2+][C@H]2CCc3c2cccc3[N+](=O)[O-])c1 ZINC000496676989 1122152906 /nfs/dbraw/zinc/15/29/06/1122152906.db2.gz FIXJDTTWGGCZDR-INIZCTEOSA-N 1 0 341.367 3.550 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132036229 1129040758 /nfs/dbraw/zinc/04/07/58/1129040758.db2.gz KQXUYHGOIJCSDT-IUODEOHRSA-N 1 0 337.395 3.621 20 5 EHBDRO Cc1c(C(=O)NCCCCCCC[NH+]2CCCC2)cccc1[N+](=O)[O-] ZINC000920250804 1123342470 /nfs/dbraw/zinc/34/24/70/1123342470.db2.gz PBCPWHQTIXREAS-UHFFFAOYSA-N 1 0 347.459 3.679 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccccc2CNc2ncc([N+](=O)[O-])s2)C1 ZINC000195509023 1123494836 /nfs/dbraw/zinc/49/48/36/1123494836.db2.gz ZHBACGHSTZGZFD-ZDUSSCGKSA-N 1 0 346.456 3.895 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2cccc([N+](=O)[O-])c2C)C1 ZINC000609489226 1123590565 /nfs/dbraw/zinc/59/05/65/1123590565.db2.gz CDIYRPCRMZNMEM-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@@H]21 ZINC000609631770 1123634855 /nfs/dbraw/zinc/63/48/55/1123634855.db2.gz WFDQFRPVCDOBBW-BPUTZDHNSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)C(C)(C)O ZINC000609707422 1123647789 /nfs/dbraw/zinc/64/77/89/1123647789.db2.gz OWXLSJUTXMMEQU-GFCCVEGCSA-N 1 0 348.374 3.775 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H]1C ZINC000610133757 1123739171 /nfs/dbraw/zinc/73/91/71/1123739171.db2.gz SUFGRGRJXAHMFI-YPMHNXCESA-N 1 0 345.365 3.923 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1ccnn1C)C(C)C ZINC000615967168 1123919470 /nfs/dbraw/zinc/91/94/70/1123919470.db2.gz PYKSNDOANDHORR-WMLDXEAASA-N 1 0 330.432 3.727 20 5 EHBDRO Cc1ccc([C@@H](CNc2ncc([N+](=O)[O-])cc2Cl)[NH+](C)C)cc1 ZINC000301255411 1124867017 /nfs/dbraw/zinc/86/70/17/1124867017.db2.gz DDNFMPJTAPOFRN-OAHLLOKOSA-N 1 0 334.807 3.666 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000122855215 1124985258 /nfs/dbraw/zinc/98/52/58/1124985258.db2.gz OVEQIAMPOISCLV-IFXJQAMLSA-N 1 0 340.423 3.842 20 5 EHBDRO CCc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000181824476 1125054247 /nfs/dbraw/zinc/05/42/47/1125054247.db2.gz UGLXTGFXQFMLFO-AWEZNQCLSA-N 1 0 341.411 3.755 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccc(F)c1F ZINC000181968719 1125103958 /nfs/dbraw/zinc/10/39/58/1125103958.db2.gz CCOGCHKVWLSSJO-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCCc3cccnc32)cc1 ZINC000619611309 1125372665 /nfs/dbraw/zinc/37/26/65/1125372665.db2.gz IQROYADFKCSKOI-SFHVURJKSA-N 1 0 325.412 3.980 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)c1ccsc1 ZINC000619782812 1125404260 /nfs/dbraw/zinc/40/42/60/1125404260.db2.gz KNCWQCHNIUAIAN-SECBINFHSA-N 1 0 339.804 3.599 20 5 EHBDRO COc1cccc(C2(C[NH2+][C@H](C)c3ccc([N+](=O)[O-])cc3)CC2)c1 ZINC000554991699 1129192334 /nfs/dbraw/zinc/19/23/34/1129192334.db2.gz QOYPWGCIXXMSQV-CQSZACIVSA-N 1 0 326.396 3.986 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccc(F)cc1 ZINC000301880074 1129250873 /nfs/dbraw/zinc/25/08/73/1129250873.db2.gz ZPLFHHVYMVASKC-DLBZAZTESA-N 1 0 333.338 3.730 20 5 EHBDRO C[N@@H+]1CC[C@@H](Nc2ccc([N+](=O)[O-])cc2F)[C@H]1c1ccc(F)cc1 ZINC000301880075 1129251646 /nfs/dbraw/zinc/25/16/46/1129251646.db2.gz ZPLFHHVYMVASKC-IAGOWNOFSA-N 1 0 333.338 3.730 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(Oc2ccc(F)cc2)CC1 ZINC000115557186 1129273615 /nfs/dbraw/zinc/27/36/15/1129273615.db2.gz NGVAUFDOEGKKRG-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO C[NH+](C)C1(CNc2ccc([N+](=O)[O-])c3ncccc23)CCCCC1 ZINC000499679443 1129325440 /nfs/dbraw/zinc/32/54/40/1129325440.db2.gz CAYINEIPBXKZMD-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000116280538 1129348938 /nfs/dbraw/zinc/34/89/38/1129348938.db2.gz LJMZDFLYAHHEHG-KRWDZBQOSA-N 1 0 346.814 3.730 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[N@@H+]2CC[C@H](C(C)(C)C)C2)cccc1[N+](=O)[O-] ZINC000543247734 1129371605 /nfs/dbraw/zinc/37/16/05/1129371605.db2.gz HYTRUVCPMJZSAN-KBPBESRZSA-N 1 0 333.432 3.598 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+](C(C)C)C1CCCC1 ZINC000068449280 1129371951 /nfs/dbraw/zinc/37/19/51/1129371951.db2.gz KAVPQIYYBPFCDB-UHFFFAOYSA-N 1 0 333.432 3.885 20 5 EHBDRO CCOc1cc(N[C@@H]2CC[N@H+](C)[C@H]2c2ccccc2)ccc1[N+](=O)[O-] ZINC000301971347 1129465722 /nfs/dbraw/zinc/46/57/22/1129465722.db2.gz GFQJSYWUWVDUKL-APWZRJJASA-N 1 0 341.411 3.851 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](c1ccc(F)cc1)C1CC1 ZINC000543427891 1129482333 /nfs/dbraw/zinc/48/23/33/1129482333.db2.gz GQSWGOGPFVHPIH-GOSISDBHSA-N 1 0 330.359 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2nc3ccc(F)cc3s2)cc1 ZINC000428847564 1129524340 /nfs/dbraw/zinc/52/43/40/1129524340.db2.gz GPNQLFQGGAULSL-UHFFFAOYSA-N 1 0 331.372 3.676 20 5 EHBDRO Cc1ccc(CN(Cc2ccco2)C[C@H]2CCCO2)cc1[N+](=O)[O-] ZINC000092436539 1129545924 /nfs/dbraw/zinc/54/59/24/1129545924.db2.gz MSLKURBLPVUAMC-QGZVFWFLSA-N 1 0 330.384 3.677 20 5 EHBDRO CCOCOc1ccc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000922538337 1129565441 /nfs/dbraw/zinc/56/54/41/1129565441.db2.gz PUKLWGQLPKQTOY-CQSZACIVSA-N 1 0 330.384 3.818 20 5 EHBDRO COc1cccc(N[C@H]2C[N@H+](Cc3ccccc3)C[C@H]2C)c1[N+](=O)[O-] ZINC000389794507 1129590059 /nfs/dbraw/zinc/59/00/59/1129590059.db2.gz SGRBJJCNIXSKJF-PBHICJAKSA-N 1 0 341.411 3.536 20 5 EHBDRO C[C@H]([NH2+][C@H]1CN(Cc2ccccc2)C[C@@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000389875891 1129593567 /nfs/dbraw/zinc/59/35/67/1129593567.db2.gz UEJMUDWLKJFOQG-FTRWYGJKSA-N 1 0 339.439 3.766 20 5 EHBDRO Cc1ccc(CN2CCO[C@]3(CCc4ccccc43)C2)cc1[N+](=O)[O-] ZINC000093638059 1129597811 /nfs/dbraw/zinc/59/78/11/1129597811.db2.gz AFONHTKGFSENQT-HXUWFJFHSA-N 1 0 338.407 3.577 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)N(C)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390557283 1129622925 /nfs/dbraw/zinc/62/29/25/1129622925.db2.gz IRQRZBLFGBWBLE-HZPDHXFCSA-N 1 0 327.428 3.766 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC000922694027 1129625753 /nfs/dbraw/zinc/62/57/53/1129625753.db2.gz IZUJNGHRKJBAFU-MVOUDAGVSA-N 1 0 344.333 3.698 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCC[C@H](C(F)(F)F)O1 ZINC000922694029 1129625791 /nfs/dbraw/zinc/62/57/91/1129625791.db2.gz IZUJNGHRKJBAFU-OZQCQIJRSA-N 1 0 344.333 3.698 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)NC(=O)c1cc2cc([N+](=O)[O-])ccc2o1 ZINC000338874028 1129640407 /nfs/dbraw/zinc/64/04/07/1129640407.db2.gz ZIOYMTAGLLZXFM-CYBMUJFWSA-N 1 0 347.415 3.581 20 5 EHBDRO CCN(CC)C(=O)C1CC[NH+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000330734600 1129644154 /nfs/dbraw/zinc/64/41/54/1129644154.db2.gz VBUYTQSTMMEWEY-HNNXBMFYSA-N 1 0 347.459 3.545 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)CCCCO1 ZINC000922816731 1129679830 /nfs/dbraw/zinc/67/98/30/1129679830.db2.gz KJXRZKVKTXFDOK-KRWDZBQOSA-N 1 0 347.440 3.767 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1nccc(C)c1[N+](=O)[O-])c1ccccc1 ZINC000391697467 1129679989 /nfs/dbraw/zinc/67/99/89/1129679989.db2.gz RJWMNPHTYZUBRU-MRXNPFEDSA-N 1 0 328.416 3.793 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@@H+](CCCCO)C3CC3)o2)c1 ZINC000125693701 1129711116 /nfs/dbraw/zinc/71/11/16/1129711116.db2.gz WUWZNDKQYZZPSN-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N2CC[C@@H]([NH+]3CCCC3)C2)c(Cl)c1 ZINC000302011783 1129763292 /nfs/dbraw/zinc/76/32/92/1129763292.db2.gz CRKFMGWZPLHOOZ-SNVBAGLBSA-N 1 0 330.215 3.576 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1sccc1[N+](=O)[O-] ZINC000302032644 1129764546 /nfs/dbraw/zinc/76/45/46/1129764546.db2.gz SPQUPQLHOYTZMS-UKRRQHHQSA-N 1 0 331.441 3.979 20 5 EHBDRO Cc1cc(N2CC[C@@]3(O)CCCC[C@@H]3C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302066816 1129766030 /nfs/dbraw/zinc/76/60/30/1129766030.db2.gz FKQBODPHPLSWKL-KUHUBIRLSA-N 1 0 341.411 3.583 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCCNc1c2c(ccc1[N+](=O)[O-])NCC2 ZINC000302829741 1129794246 /nfs/dbraw/zinc/79/42/46/1129794246.db2.gz JZJQZONPDRCAIM-AWEZNQCLSA-N 1 0 332.448 3.629 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(-c2nc(-c3ccn4c[nH+]cc4c3)no2)c1 ZINC000351089690 1129799069 /nfs/dbraw/zinc/79/90/69/1129799069.db2.gz NZJMNIBLUALFFU-UHFFFAOYSA-N 1 0 341.714 3.613 20 5 EHBDRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000056196403 1129805814 /nfs/dbraw/zinc/80/58/14/1129805814.db2.gz RDKZWRFTCILAKT-ZIAGYGMSSA-N 1 0 341.411 3.835 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCc1nc2ccccc2n1C(F)F ZINC000347832278 1129901046 /nfs/dbraw/zinc/90/10/46/1129901046.db2.gz AKIKBHJPJDCRTJ-UHFFFAOYSA-N 1 0 346.337 3.672 20 5 EHBDRO CC[C@@](C)([NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2)c1ccccc1 ZINC000730817665 1130741480 /nfs/dbraw/zinc/74/14/80/1130741480.db2.gz QPINYMWSAMJINX-LJQANCHMSA-N 1 0 342.395 3.876 20 5 EHBDRO COCCN1CC[C@H]([NH2+]Cc2c3ccccc3cc3ccccc32)C1 ZINC000730818387 1130742221 /nfs/dbraw/zinc/74/22/21/1130742221.db2.gz SDYOEOIQRIIRKW-IBGZPJMESA-N 1 0 334.463 3.803 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2cccc3c2OCCO3)cc1[N+](=O)[O-] ZINC000733331655 1131028541 /nfs/dbraw/zinc/02/85/41/1131028541.db2.gz JZJAIULVADBZOJ-UHFFFAOYSA-N 1 0 342.395 3.779 20 5 EHBDRO CC(C)C[N@H+](Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1)C1CCCC1 ZINC000742146773 1131690491 /nfs/dbraw/zinc/69/04/91/1131690491.db2.gz LARGRIFMLCWFHS-UHFFFAOYSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H](CCO)c1ccccc1)CC2 ZINC001172898651 1131882128 /nfs/dbraw/zinc/88/21/28/1131882128.db2.gz IHXFKMXGFJWDDN-QUCCMNQESA-N 1 0 340.423 3.556 20 5 EHBDRO CC(C)(Cc1ccncc1)[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903536 1131885846 /nfs/dbraw/zinc/88/58/46/1131885846.db2.gz HXLQTBIHQIJEMV-SFHVURJKSA-N 1 0 339.439 3.848 20 5 EHBDRO [NH3+]Cc1ccc2cn([C@H]3CCc4ccc([N+](=O)[O-])cc4CC3)nc2c1 ZINC001172904604 1131886551 /nfs/dbraw/zinc/88/65/51/1131886551.db2.gz YSBMALXFUUCIPM-KRWDZBQOSA-N 1 0 336.395 3.523 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccnc(Cl)c1)CC2 ZINC001172895460 1131901900 /nfs/dbraw/zinc/90/19/00/1131901900.db2.gz DQUBDJLFOZJZHL-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO Cc1ncccc1C[N@@H+](C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172913893 1131902650 /nfs/dbraw/zinc/90/26/50/1131902650.db2.gz VMPGMBLUKUNKHB-SFHVURJKSA-N 1 0 325.412 3.678 20 5 EHBDRO CC[N@H+](CC(=O)OC(C)(C)C)[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172921778 1131905697 /nfs/dbraw/zinc/90/56/97/1131905697.db2.gz SYTJZYDYWGZZPD-INIZCTEOSA-N 1 0 348.443 3.506 20 5 EHBDRO CCC[C@@H]1[C@H](C)CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000743381060 1131914475 /nfs/dbraw/zinc/91/44/75/1131914475.db2.gz TUJABFOPVRSLDP-GDBMZVCRSA-N 1 0 343.431 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1COc3ccc(F)cc31)CC2 ZINC001172912097 1131917904 /nfs/dbraw/zinc/91/79/04/1131917904.db2.gz LUNZOAYNQZYMAM-QAPCUYQASA-N 1 0 342.370 3.705 20 5 EHBDRO CCC(CC)C[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173005155 1131934354 /nfs/dbraw/zinc/93/43/54/1131934354.db2.gz CRPHRWHFROKEAV-UHFFFAOYSA-N 1 0 341.402 3.868 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C1CCC1 ZINC001173011736 1131935347 /nfs/dbraw/zinc/93/53/47/1131935347.db2.gz IKCVEMFVJNXWTD-LLVKDONJSA-N 1 0 339.386 3.620 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]C2(c3ccccc3)CC2)c1F ZINC001173176471 1131991211 /nfs/dbraw/zinc/99/12/11/1131991211.db2.gz HJXFJAJTHAPVTN-CYBMUJFWSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)N2Cc3cccc(C)c3C2)c1F ZINC001173179701 1131992299 /nfs/dbraw/zinc/99/22/99/1131992299.db2.gz GFYYGKHGJJQQPG-CYBMUJFWSA-N 1 0 344.386 3.998 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CCc3ccccc32)c1F ZINC001173179820 1131992713 /nfs/dbraw/zinc/99/27/13/1131992713.db2.gz QBMMMXOQZZLWAF-LRDDRELGSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCc3ccccc3C2)c1F ZINC001173184439 1131993391 /nfs/dbraw/zinc/99/33/91/1131993391.db2.gz NHODXDAGIXSQNL-CYBMUJFWSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@@H](C)c2cccc(C)n2)c1F ZINC001173188041 1131993625 /nfs/dbraw/zinc/99/36/25/1131993625.db2.gz HYLOYPCRNVIIBO-STQMWFEESA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH+]2CC3(C2)CCCCC3)c1F ZINC001173197226 1131996947 /nfs/dbraw/zinc/99/69/47/1131996947.db2.gz RMMBNXGPNYSVGY-ZDUSSCGKSA-N 1 0 336.407 3.940 20 5 EHBDRO COc1cc(OC)cc([C@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173220136 1132002937 /nfs/dbraw/zinc/00/29/37/1132002937.db2.gz UPEPUTNIBKNJKN-KGLIPLIRSA-N 1 0 344.411 3.894 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](c1ccccc1)C1(O)CCC1 ZINC001173222289 1132004036 /nfs/dbraw/zinc/00/40/36/1132004036.db2.gz WAUOIXKZRWPRIX-BEFAXECRSA-N 1 0 340.423 3.772 20 5 EHBDRO CCOC(=O)[C@]1(C)CCCC[N@@H+]([C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223257 1132005555 /nfs/dbraw/zinc/00/55/55/1132005555.db2.gz ZEFPSUGKFYKGCA-HNAYVOBHSA-N 1 0 348.443 3.581 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@H](O)c1cc2ccccc2o1 ZINC001173231075 1132008901 /nfs/dbraw/zinc/00/89/01/1132008901.db2.gz XDCOSKKNRDPTLE-DYVFJYSZSA-N 1 0 340.379 3.595 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173230671 1132009386 /nfs/dbraw/zinc/00/93/86/1132009386.db2.gz TYHPNKMEALALBU-ZIAGYGMSSA-N 1 0 341.411 3.835 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C)CC/C=C/c1cccnc1 ZINC001173233421 1132010045 /nfs/dbraw/zinc/01/00/45/1132010045.db2.gz WNEIFMGALGZERO-WUTVXBCWSA-N 1 0 325.412 3.956 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@@H](C(=O)c2ccccc2)C1 ZINC001173233806 1132010652 /nfs/dbraw/zinc/01/06/52/1132010652.db2.gz YYWJXLCQEINBSN-CRAIPNDOSA-N 1 0 338.407 3.731 20 5 EHBDRO CCC[N@H+](CCc1ccccn1)[C@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173234034 1132010661 /nfs/dbraw/zinc/01/06/61/1132010661.db2.gz OTFFEOSIUWUERX-MRXNPFEDSA-N 1 0 327.428 3.876 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(OC(F)F)cc1 ZINC001173213250 1132014135 /nfs/dbraw/zinc/01/41/35/1132014135.db2.gz HGRYYXLZZJXSEN-LBPRGKRZSA-N 1 0 336.338 3.917 20 5 EHBDRO CC[C@@]1(C)CCCN(CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC000744419586 1132087409 /nfs/dbraw/zinc/08/74/09/1132087409.db2.gz KONSKMUVQJYCFE-INIZCTEOSA-N 1 0 339.823 3.699 20 5 EHBDRO COC(=O)[C@H]1CCCC[C@@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860262 1132582594 /nfs/dbraw/zinc/58/25/94/1132582594.db2.gz VYKFJNJSGUQUPC-QAPCUYQASA-N 1 0 346.427 3.539 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccncc1 ZINC001168958868 1132620350 /nfs/dbraw/zinc/62/03/50/1132620350.db2.gz QNBHUNSISRCSCI-SZVBFZGTSA-N 1 0 325.412 3.514 20 5 EHBDRO C[C@@H]1OC2(CC[NH+]([C@H]3CC[C@@H](C[N+](=O)[O-])C3)CC2)c2ccccc21 ZINC001169057021 1132645563 /nfs/dbraw/zinc/64/55/63/1132645563.db2.gz UOWSZWUDNFWHSV-XHSDSOJGSA-N 1 0 330.428 3.514 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@H](C[NH+]2CCCCC2)c2ccccc2)cs1 ZINC001169188539 1132687153 /nfs/dbraw/zinc/68/71/53/1132687153.db2.gz XYXHBAFGAPDNTI-QGZVFWFLSA-N 1 0 345.468 3.973 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1Cl)c1ccccc1[N+](=O)[O-] ZINC001175890841 1132782372 /nfs/dbraw/zinc/78/23/72/1132782372.db2.gz VJGXXNFUAKUTIA-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO CCOc1cnc(N2CCC[C@H]([NH3+])c3cc(C)ccc32)c([N+](=O)[O-])c1 ZINC001169686268 1132820101 /nfs/dbraw/zinc/82/01/01/1132820101.db2.gz XGFHCSZQRHECKB-HNNXBMFYSA-N 1 0 342.399 3.629 20 5 EHBDRO CCOc1cnc(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)c([N+](=O)[O-])c1 ZINC001169686270 1132820461 /nfs/dbraw/zinc/82/04/61/1132820461.db2.gz XGFHCSZQRHECKB-OAHLLOKOSA-N 1 0 342.399 3.629 20 5 EHBDRO COc1c([N+](=O)[O-])cc(Cl)c(C)c1NC(C)(C)CC[NH+](C)C ZINC001169717882 1132833389 /nfs/dbraw/zinc/83/33/89/1132833389.db2.gz GZSFRRTYTVRTQU-UHFFFAOYSA-N 1 0 329.828 3.707 20 5 EHBDRO C[C@@H](CN1CCCCC1)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC001177222949 1133042649 /nfs/dbraw/zinc/04/26/49/1133042649.db2.gz WJTIRJYHCXVUTP-HNNXBMFYSA-N 1 0 343.427 3.819 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]CC(C)(C)N1CCC[C@@H](C)C1 ZINC001177483322 1133068415 /nfs/dbraw/zinc/06/84/15/1133068415.db2.gz MPGXRJRTTMWBIX-CQSZACIVSA-N 1 0 333.476 3.812 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H](C[C@@H]3CCOC3)C2)ccc1Cl ZINC000773700947 1133090407 /nfs/dbraw/zinc/09/04/07/1133090407.db2.gz LGFDFAWLESGVEF-HIFRSBDPSA-N 1 0 338.835 3.887 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[NH2+]C1CC2(CCC2)C1 ZINC001179065856 1133226250 /nfs/dbraw/zinc/22/62/50/1133226250.db2.gz CFTPGDCVCYNMLT-UHFFFAOYSA-N 1 0 325.206 3.780 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC001179507084 1133257568 /nfs/dbraw/zinc/25/75/68/1133257568.db2.gz OLFQYPDINKLUJB-OAHLLOKOSA-N 1 0 348.830 3.731 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CCC[C@@H]1C1CC1 ZINC000769331654 1133263499 /nfs/dbraw/zinc/26/34/99/1133263499.db2.gz VVUZHVQKGNHOCT-CYBMUJFWSA-N 1 0 325.206 3.732 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1C[NH+]1CCC3(CCCC3)CC1)OCCO2 ZINC000769331280 1133263991 /nfs/dbraw/zinc/26/39/91/1133263991.db2.gz FEWNBAYSNYZBED-UHFFFAOYSA-N 1 0 332.400 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(OC(F)F)c(C[N@@H+]2CCC3(CCCC3)C2)c1 ZINC000769402687 1133276754 /nfs/dbraw/zinc/27/67/54/1133276754.db2.gz NKWUNUAKBOMEPI-UHFFFAOYSA-N 1 0 326.343 3.962 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC[C@@H](O)C2CC2)s1 ZINC001179768500 1133277149 /nfs/dbraw/zinc/27/71/49/1133277149.db2.gz QADKHBYJAKNTHT-MRXNPFEDSA-N 1 0 332.425 3.574 20 5 EHBDRO C[C@@H]1COCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000769457804 1133294699 /nfs/dbraw/zinc/29/46/99/1133294699.db2.gz UTNJBYLGSWQLSL-ZDUSSCGKSA-N 1 0 332.425 3.792 20 5 EHBDRO O=[N+]([O-])c1cccc(Br)c1C[N@@H+]1CC[C@H](C2CC2)C1 ZINC000769514971 1133307539 /nfs/dbraw/zinc/30/75/39/1133307539.db2.gz MUZHXKUGVMVRJV-NSHDSACASA-N 1 0 325.206 3.589 20 5 EHBDRO C[C@@H]1Cc2cc(F)ccc2[C@H](C)[N@@H+]1C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000769954224 1133365560 /nfs/dbraw/zinc/36/55/60/1133365560.db2.gz QJRIHCWEQBEFPK-QHRIQVFBSA-N 1 0 344.386 3.775 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@H+](C)CCOc1ccccc1F ZINC001180445087 1133370416 /nfs/dbraw/zinc/37/04/16/1133370416.db2.gz JTXIXGFWFBLYKN-UHFFFAOYSA-N 1 0 332.375 3.862 20 5 EHBDRO CN(C)CC[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC1CCCCC1 ZINC001181472354 1133491138 /nfs/dbraw/zinc/49/11/38/1133491138.db2.gz PXDMEZPSZPCMQG-UHFFFAOYSA-N 1 0 333.476 3.581 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCC2 ZINC000774210693 1133634597 /nfs/dbraw/zinc/63/45/97/1133634597.db2.gz GVTMIPSHJJLZNA-KRWDZBQOSA-N 1 0 341.367 3.713 20 5 EHBDRO Cc1cccc(F)c1C[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774210650 1133634840 /nfs/dbraw/zinc/63/48/40/1133634840.db2.gz GONNZKHYPPDXIX-CVEARBPZSA-N 1 0 332.379 3.512 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1COc2cc(F)ccc2C1 ZINC001182960478 1133751957 /nfs/dbraw/zinc/75/19/57/1133751957.db2.gz RZDYKXUBHWXLEI-CXAGYDPISA-N 1 0 344.386 3.648 20 5 EHBDRO COC(=O)CC[C@H]1CCC[N@H+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC001183631246 1133839366 /nfs/dbraw/zinc/83/93/66/1133839366.db2.gz QIQOAOGRRADIJI-RBFDBLARSA-N 1 0 346.427 3.663 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC001184135580 1133897469 /nfs/dbraw/zinc/89/74/69/1133897469.db2.gz SSEBXEPEEICEQQ-QWHCGFSZSA-N 1 0 345.374 3.802 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)c1ccccc1C ZINC000786816709 1133911484 /nfs/dbraw/zinc/91/14/84/1133911484.db2.gz WBKYSJQJQBPDIT-CPPNXCSESA-N 1 0 326.396 3.630 20 5 EHBDRO Cc1cc(N2CCC[C@H]([N@H+]3[C@H](C)CC[C@@H]3C)C2)c(F)cc1[N+](=O)[O-] ZINC001184925741 1134006546 /nfs/dbraw/zinc/00/65/46/1134006546.db2.gz CVJODBUBEIIZLT-ZNMIVQPWSA-N 1 0 335.423 3.884 20 5 EHBDRO C[C@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774886593 1134100143 /nfs/dbraw/zinc/10/01/43/1134100143.db2.gz WGAZCGAXJHFDSH-BBRMVZONSA-N 1 0 341.367 3.881 20 5 EHBDRO CC(C)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@H](O)c1ccccc1 ZINC000788537328 1134139203 /nfs/dbraw/zinc/13/92/03/1134139203.db2.gz JHXSKLJVBLQITR-ZWKOTPCHSA-N 1 0 332.375 3.582 20 5 EHBDRO CC[NH+](CC)CCN(CC(C)C)c1ccc(C(C)=O)cc1[N+](=O)[O-] ZINC001185897928 1134146450 /nfs/dbraw/zinc/14/64/50/1134146450.db2.gz JGSJUGIRAGPHDT-UHFFFAOYSA-N 1 0 335.448 3.602 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@H](O)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000788575966 1134147358 /nfs/dbraw/zinc/14/73/58/1134147358.db2.gz INPGIBXGHYKTFB-MSOLQXFVSA-N 1 0 326.396 3.640 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788796785 1134170581 /nfs/dbraw/zinc/17/05/81/1134170581.db2.gz VALAHSBJEWIJKP-MEDUHNTESA-N 1 0 349.818 3.869 20 5 EHBDRO CC(C)Oc1ccccc1[C@H](C)[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000774982216 1134177029 /nfs/dbraw/zinc/17/70/29/1134177029.db2.gz RASXMRULHYRVOE-KSSFIOAISA-N 1 0 344.411 3.766 20 5 EHBDRO CCCC1CCC([N@H+](C)Cn2nc(C)c3cc([N+](=O)[O-])cnc32)CC1 ZINC000790480174 1134423065 /nfs/dbraw/zinc/42/30/65/1134423065.db2.gz QUWBWECERCORGY-UHFFFAOYSA-N 1 0 345.447 3.896 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CCCC23CCC3)ccc1Br ZINC000775184918 1134489000 /nfs/dbraw/zinc/48/90/00/1134489000.db2.gz UAKMSXKQXZKMHU-UHFFFAOYSA-N 1 0 325.206 3.876 20 5 EHBDRO CC(C)(C)C[C@H]1CCC[N@@H+]1Cn1cnc(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000747076089 1134689930 /nfs/dbraw/zinc/68/99/30/1134689930.db2.gz LAEZXSFUWVGXFM-MRXNPFEDSA-N 1 0 343.431 3.711 20 5 EHBDRO CC(C)N(CC[NH+]1C[C@@H](C)C[C@H](C)C1)Cc1ccc([N+](=O)[O-])cc1 ZINC001190527816 1134713411 /nfs/dbraw/zinc/71/34/11/1134713411.db2.gz HLMYVPHIOJJBFY-IRXDYDNUSA-N 1 0 333.476 3.783 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cc(C)ccn2)c([N+](=O)[O-])c1 ZINC001170297510 1134737220 /nfs/dbraw/zinc/73/72/20/1134737220.db2.gz OHDXZZVYLBPCSM-ZIAGYGMSSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](CF)c2ccccc2)c([N+](=O)[O-])c1 ZINC001170304526 1134738797 /nfs/dbraw/zinc/73/87/97/1134738797.db2.gz DMFAFUGBGPEOMA-CXAGYDPISA-N 1 0 332.375 3.835 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](c2ccccn2)C(C)C)c([N+](=O)[O-])c1 ZINC001170304331 1134739141 /nfs/dbraw/zinc/73/91/41/1134739141.db2.gz BQCRQNZAZIBMTA-IFXJQAMLSA-N 1 0 343.427 3.916 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](c2ccccn2)C2CC2)c([N+](=O)[O-])c1 ZINC001170312740 1134744742 /nfs/dbraw/zinc/74/47/42/1134744742.db2.gz HLJLZRFJLPBMMW-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C(C)(C)Cc2ccccn2)c([N+](=O)[O-])c1 ZINC001170323885 1134747524 /nfs/dbraw/zinc/74/75/24/1134747524.db2.gz NGQWDVBSMRXJGC-AWEZNQCLSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C[C@@H]2CCCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170321851 1134747645 /nfs/dbraw/zinc/74/76/45/1134747645.db2.gz CPKZKUAMMCAXIJ-QWHCGFSZSA-N 1 0 342.386 3.950 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H]2CCCc3cnccc32)c([N+](=O)[O-])c1 ZINC001170328082 1134748960 /nfs/dbraw/zinc/74/89/60/1134748960.db2.gz UUCHCGKMXLGXSJ-FZKQIMNGSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170307463 1134753357 /nfs/dbraw/zinc/75/33/57/1134753357.db2.gz GDMDZPIDSDDJLY-XWIAVFTESA-N 1 0 326.396 3.680 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)NC2CCCCCCC2)cc1[N+](=O)[O-] ZINC000775550249 1135060382 /nfs/dbraw/zinc/06/03/82/1135060382.db2.gz XCDHVXDGHMPFGL-HNNXBMFYSA-N 1 0 347.459 3.783 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H](O)c2ccc(F)cc2C)cc1[N+](=O)[O-] ZINC000775549868 1135061086 /nfs/dbraw/zinc/06/10/86/1135061086.db2.gz QKEJCUVAGAGOHR-SCLBCKFNSA-N 1 0 332.375 3.735 20 5 EHBDRO CSc1ccccc1C[N@H+](C)CCOc1ccc([N+](=O)[O-])cc1 ZINC001193974275 1135208464 /nfs/dbraw/zinc/20/84/64/1135208464.db2.gz APAJNQASCLCGNO-UHFFFAOYSA-N 1 0 332.425 3.828 20 5 EHBDRO Cc1ccccc1CC[N@H+](C)CCCOc1ccc([N+](=O)[O-])cc1 ZINC001194632761 1135294801 /nfs/dbraw/zinc/29/48/01/1135294801.db2.gz GRDPNQZJMPJOAN-UHFFFAOYSA-N 1 0 328.412 3.847 20 5 EHBDRO CCCC[N@H+](Cc1ccc(C(N)=O)cc1[N+](=O)[O-])[C@H]1CCC[C@@H](C)C1 ZINC001194714595 1135311707 /nfs/dbraw/zinc/31/17/07/1135311707.db2.gz IWFYJJRIKUUNMX-PBHICJAKSA-N 1 0 347.459 3.875 20 5 EHBDRO C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCO2 ZINC001196302203 1135544606 /nfs/dbraw/zinc/54/46/06/1135544606.db2.gz IUWUNCKTDXLHNK-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CC2(O)CCCCC2)o1 ZINC000102426097 1135551889 /nfs/dbraw/zinc/55/18/89/1135551889.db2.gz KSGJMUWUHZXUJL-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C(=O)Nc1ccc(C)cc1 ZINC001197506164 1135701046 /nfs/dbraw/zinc/70/10/46/1135701046.db2.gz FLRDCWPJNYJOQR-YOEHRIQHSA-N 1 0 341.411 3.971 20 5 EHBDRO C[NH+](C)CCN(Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000809728075 1135872746 /nfs/dbraw/zinc/87/27/46/1135872746.db2.gz JJTGMLFMKXUZAL-UHFFFAOYSA-N 1 0 347.846 3.812 20 5 EHBDRO COc1cccc(CC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1OC ZINC001199403121 1135903892 /nfs/dbraw/zinc/90/38/92/1135903892.db2.gz GWEPHKONGACLCD-UHFFFAOYSA-N 1 0 344.411 3.561 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@@H](c2ccccc2)C2CCCCC2)n1 ZINC000776005005 1135915759 /nfs/dbraw/zinc/91/57/59/1135915759.db2.gz AREJHRYPWKFGOD-SFHVURJKSA-N 1 0 328.416 3.703 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@H](CO)C1CCCC1 ZINC000810116150 1135928122 /nfs/dbraw/zinc/92/81/22/1135928122.db2.gz VCHGTXTXCHKCEB-CYBMUJFWSA-N 1 0 333.215 3.542 20 5 EHBDRO C[C@@H](C[NH2+]CCn1cc([N+](=O)[O-])cn1)Cc1ccc(C(C)(C)C)cc1 ZINC001201192186 1135994264 /nfs/dbraw/zinc/99/42/64/1135994264.db2.gz JDGXWLRMAMDNMY-OAHLLOKOSA-N 1 0 344.459 3.557 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H]2CCN(c3ccc(Cl)c(F)c3)C2)c1 ZINC001201450673 1136026470 /nfs/dbraw/zinc/02/64/70/1136026470.db2.gz ZHCMFWBSGXEMKV-CYBMUJFWSA-N 1 0 349.793 3.756 20 5 EHBDRO CO[C@@H]1CCC[C@@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811486135 1136092290 /nfs/dbraw/zinc/09/22/90/1136092290.db2.gz JXDGWMPEMBYPSY-NOZJJQNGSA-N 1 0 333.215 3.806 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CCc1cccnc1 ZINC000811473851 1136095628 /nfs/dbraw/zinc/09/56/28/1136095628.db2.gz OLEGLLQDXAXQAY-UHFFFAOYSA-N 1 0 326.183 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH+]2CCC(c3ccccc3F)CC2)cc1 ZINC000776278058 1136130740 /nfs/dbraw/zinc/13/07/40/1136130740.db2.gz RCBKGGAINOKBGT-IBGZPJMESA-N 1 0 344.386 3.647 20 5 EHBDRO C[C@@H](c1cc(F)ccc1F)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776276594 1136130936 /nfs/dbraw/zinc/13/09/36/1136130936.db2.gz KUIQHEYPXLVLRI-APPDUMDISA-N 1 0 336.338 3.599 20 5 EHBDRO CC1(c2ccccc2)CC[NH+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC1 ZINC000776280256 1136135582 /nfs/dbraw/zinc/13/55/82/1136135582.db2.gz YZKTUWSYJYNMCY-LJQANCHMSA-N 1 0 340.423 3.682 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1cc(F)cc(F)c1[N+](=O)[O-] ZINC001170682284 1136227501 /nfs/dbraw/zinc/22/75/01/1136227501.db2.gz PJNKCNOIBPTZTF-JTQLQIEISA-N 1 0 344.321 3.745 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCC[C@H]2Cc2ccccn2)cc1[N+](=O)[O-] ZINC000850385617 1136247053 /nfs/dbraw/zinc/24/70/53/1136247053.db2.gz IOHUZHCFRMLPPH-WMZOPIPTSA-N 1 0 325.412 3.799 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(F)c1)[C@H](C)[C@@H](O)c1ccccc1 ZINC000812851550 1136261322 /nfs/dbraw/zinc/26/13/22/1136261322.db2.gz SMMDYKIBYGWRCN-FZKQIMNGSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1COC2(CCC2)C1 ZINC000850525552 1136277796 /nfs/dbraw/zinc/27/77/96/1136277796.db2.gz OMWHNYKOJJDJSC-KBPBESRZSA-N 1 0 336.457 3.767 20 5 EHBDRO C[C@]1(CC[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)CC1(F)F ZINC000850536713 1136281328 /nfs/dbraw/zinc/28/13/28/1136281328.db2.gz MRIFVLVIGFJMGA-INIZCTEOSA-N 1 0 339.386 3.589 20 5 EHBDRO C[C@H]([NH2+]C[C@@H]1CCCN(C(=O)C(C)(C)C)C1)c1ccc([N+](=O)[O-])cc1 ZINC000852095893 1136433077 /nfs/dbraw/zinc/43/30/77/1136433077.db2.gz GGYWRUZKXGAUQT-GJZGRUSLSA-N 1 0 347.459 3.530 20 5 EHBDRO CC(C)[N@@H+](Cc1ccc(F)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580586 1136444941 /nfs/dbraw/zinc/44/49/41/1136444941.db2.gz WQHYSQOCZCSCFH-GOSISDBHSA-N 1 0 332.375 3.678 20 5 EHBDRO CC[C@H](Cc1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589396 1136450658 /nfs/dbraw/zinc/45/06/58/1136450658.db2.gz RXSUDWBTYMYSEA-IEBWSBKVSA-N 1 0 328.412 3.581 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](C)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776589395 1136452607 /nfs/dbraw/zinc/45/26/07/1136452607.db2.gz RXSUDWBTYMYSEA-HKUYNNGSSA-N 1 0 328.412 3.581 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000217094831 1136487602 /nfs/dbraw/zinc/48/76/02/1136487602.db2.gz KESMQSQQKAEEOT-CMPLNLGQSA-N 1 0 344.358 3.873 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000111190617 1136520310 /nfs/dbraw/zinc/52/03/10/1136520310.db2.gz GQRVBDVOMHDFTB-UHFFFAOYSA-N 1 0 348.472 3.763 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815555004 1136610335 /nfs/dbraw/zinc/61/03/35/1136610335.db2.gz NRBNNKZABYORFG-STQMWFEESA-N 1 0 329.400 3.906 20 5 EHBDRO Cc1cccc(OCCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000815589862 1136616045 /nfs/dbraw/zinc/61/60/45/1136616045.db2.gz FUPNIOXQOYWCAC-CQSZACIVSA-N 1 0 329.400 3.605 20 5 EHBDRO C[C@H]([NH2+][C@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815589949 1136616049 /nfs/dbraw/zinc/61/60/49/1136616049.db2.gz HXLYDEHLGDMNFE-URKNILKWSA-N 1 0 341.411 3.605 20 5 EHBDRO C[C@@H](CC[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000856812959 1136814718 /nfs/dbraw/zinc/81/47/18/1136814718.db2.gz BAVPNKUYJJVICH-KGXGESDWSA-N 1 0 349.431 3.501 20 5 EHBDRO Cc1ccc(SC[C@H](C)[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819239704 1136923860 /nfs/dbraw/zinc/92/38/60/1136923860.db2.gz VKJRWEDNEJFSQC-KBXCAEBGSA-N 1 0 346.452 3.707 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@@H]2CC[C@@H](c3cccc(F)c3)C2)c1 ZINC000819279505 1136931124 /nfs/dbraw/zinc/93/11/24/1136931124.db2.gz MPAOCQPPHBPRMH-LSBZLQRGSA-N 1 0 344.386 3.693 20 5 EHBDRO Cc1cccc([C@@H]([NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)C(C)C)c1 ZINC000859849263 1137034405 /nfs/dbraw/zinc/03/44/05/1137034405.db2.gz BXNSLGONYRIQRN-MOPGFXCFSA-N 1 0 328.412 3.924 20 5 EHBDRO CC(C)(CCC(=O)Nc1ccc(C[NH+]2CCCCCC2)cc1)[N+](=O)[O-] ZINC000822836671 1137076142 /nfs/dbraw/zinc/07/61/42/1137076142.db2.gz IZNDMDZMYNLYLU-UHFFFAOYSA-N 1 0 347.459 3.837 20 5 EHBDRO Cc1c(-c2noc(C3C[C@H]4CCC[C@@H](C3)C4[NH3+])n2)cccc1[N+](=O)[O-] ZINC000823269789 1137092378 /nfs/dbraw/zinc/09/23/78/1137092378.db2.gz LCIZJSYKKRWQBH-ZAQWFSBCSA-N 1 0 342.399 3.574 20 5 EHBDRO Cc1nn(C)c(Cl)c1C[N@@H+]1CCC[C@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000824821145 1137154007 /nfs/dbraw/zinc/15/40/07/1137154007.db2.gz VCRIQEPDUPMWOL-AWEZNQCLSA-N 1 0 348.834 3.670 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+][C@H]2CCCc3ccc(Cl)cc32)c1 ZINC000863583196 1137192728 /nfs/dbraw/zinc/19/27/28/1137192728.db2.gz PRWJGQAMUGBLIU-ZWKOTPCHSA-N 1 0 346.814 3.949 20 5 EHBDRO Cc1c(F)cc([N+](=O)[O-])cc1-n1c2ccccc2c2c1C[C@H]([NH3+])CC2 ZINC001171099946 1137196183 /nfs/dbraw/zinc/19/61/83/1137196183.db2.gz QXHWQVASUQBFNH-GFCCVEGCSA-N 1 0 339.370 3.802 20 5 EHBDRO Cc1ccccc1C1([NH2+]Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])CCC1 ZINC000844352429 1137214382 /nfs/dbraw/zinc/21/43/82/1137214382.db2.gz ZCLVGRNJQIQPES-UHFFFAOYSA-N 1 0 341.367 3.980 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCN(c2ccc([N+](=O)[O-])cc2C(F)F)C1 ZINC000865567506 1137295582 /nfs/dbraw/zinc/29/55/82/1137295582.db2.gz NQOKNPGEKNXXKI-LBPRGKRZSA-N 1 0 327.375 3.701 20 5 EHBDRO COc1ccc(C[NH2+]CCC[C@@H]2CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC000846103284 1137335426 /nfs/dbraw/zinc/33/54/26/1137335426.db2.gz VYFBMEQAXOTOCU-LLVKDONJSA-N 1 0 333.215 3.667 20 5 EHBDRO C[C@H](O)c1ccc(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000866244773 1137338577 /nfs/dbraw/zinc/33/85/77/1137338577.db2.gz UIYRJBRZOJEVMI-STQMWFEESA-N 1 0 332.375 3.508 20 5 EHBDRO C[C@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000846215286 1137341927 /nfs/dbraw/zinc/34/19/27/1137341927.db2.gz NQJVBTSHPWNIBV-ONGXEEELSA-N 1 0 332.231 3.802 20 5 EHBDRO CSc1cc(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])ccn1 ZINC000866289056 1137343120 /nfs/dbraw/zinc/34/31/20/1137343120.db2.gz UPPGSMARFUBUEH-NSHDSACASA-N 1 0 335.404 3.572 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000866343143 1137347644 /nfs/dbraw/zinc/34/76/44/1137347644.db2.gz XHLUYEGTFGUGDL-CYBMUJFWSA-N 1 0 346.402 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H](C1CCC1)[C@H]1CCOC1)CCC2 ZINC000866512005 1137360162 /nfs/dbraw/zinc/36/01/62/1137360162.db2.gz HFXUWMFOYRFYLJ-KFKAGJAMSA-N 1 0 330.428 3.767 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCC23CCOCC3)cc1[N+](=O)[O-] ZINC000866528784 1137361419 /nfs/dbraw/zinc/36/14/19/1137361419.db2.gz JYAVZEAZZRDVIP-HOCLYGCPSA-N 1 0 348.443 3.851 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+][C@@H]3CCCC(F)(F)C3)CC2)cc1 ZINC000773080846 1137463700 /nfs/dbraw/zinc/46/37/00/1137463700.db2.gz NUHHPVADYJHJAQ-CQSZACIVSA-N 1 0 339.386 3.731 20 5 EHBDRO Cc1ncc(CC[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)s1 ZINC000773083049 1137463925 /nfs/dbraw/zinc/46/39/25/1137463925.db2.gz RYQNUUVTUTZYPP-INIZCTEOSA-N 1 0 331.441 3.513 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cccc1[N+](=O)[O-] ZINC000123226170 1137502292 /nfs/dbraw/zinc/50/22/92/1137502292.db2.gz AEUSTWARFCEZPT-ZDUSSCGKSA-N 1 0 329.356 3.705 20 5 EHBDRO C[C@@H](C(=O)Nc1cccc([N+](=O)[O-])c1)[N@@H+]1CCCC2(CCCC2)CC1 ZINC001171911648 1137518147 /nfs/dbraw/zinc/51/81/47/1137518147.db2.gz TWRAJFFSTYZJCP-HNNXBMFYSA-N 1 0 345.443 3.968 20 5 EHBDRO C[C@@H]([NH2+]C1CCN(C(=O)CC(C)(C)C)CC1)c1ccccc1[N+](=O)[O-] ZINC000872129569 1137573066 /nfs/dbraw/zinc/57/30/66/1137573066.db2.gz LFMAGYQFAWJQTD-CQSZACIVSA-N 1 0 347.459 3.673 20 5 EHBDRO Cc1ccccc1NC(=O)C[C@@H](C)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129605 1137573107 /nfs/dbraw/zinc/57/31/07/1137573107.db2.gz RXBVVVFJLLTSGN-CABCVRRESA-N 1 0 341.411 3.971 20 5 EHBDRO Cc1c(C[NH2+]Cc2ccnc(N3CCCCC3)c2)cccc1[N+](=O)[O-] ZINC000873013660 1137587975 /nfs/dbraw/zinc/58/79/75/1137587975.db2.gz FHXMZORBCATQIH-UHFFFAOYSA-N 1 0 340.427 3.578 20 5 EHBDRO COc1cccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c1OC ZINC000873016934 1137588170 /nfs/dbraw/zinc/58/81/70/1137588170.db2.gz UCZMTMVXZOZXPK-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO COc1ccc(C[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000873016328 1137588206 /nfs/dbraw/zinc/58/82/06/1137588206.db2.gz JXUVVPVUADLFBT-UHFFFAOYSA-N 1 0 330.384 3.519 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](O)c2cccc(OC(C)C)c2)cccc1[N+](=O)[O-] ZINC000873053115 1137589005 /nfs/dbraw/zinc/58/90/05/1137589005.db2.gz FFSWSGXUFOGNMK-IBGZPJMESA-N 1 0 344.411 3.514 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2ccc(OC(C)C)cc2)cccc1[N+](=O)[O-] ZINC000873052272 1137589007 /nfs/dbraw/zinc/58/90/07/1137589007.db2.gz NHJURIWXGZHRDF-LJQANCHMSA-N 1 0 344.411 3.514 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1ccnc(C(F)(F)F)c1 ZINC000873130719 1137590917 /nfs/dbraw/zinc/59/09/17/1137590917.db2.gz GPIKGTGKQGSFEF-UHFFFAOYSA-N 1 0 339.317 3.915 20 5 EHBDRO CC(C)(C)c1ccc([N+](=O)[O-])cc1NC(=O)C1CC[NH+](C2CC2)CC1 ZINC000876339429 1137649122 /nfs/dbraw/zinc/64/91/22/1137649122.db2.gz AGIKZZWQHKINNY-UHFFFAOYSA-N 1 0 345.443 3.705 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH+]1CC(c2nc3ccccc3[nH]2)C1 ZINC000876763882 1137660564 /nfs/dbraw/zinc/66/05/64/1137660564.db2.gz QITVQNBNWRCFDU-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]C3CCC(c4ccccc4)CC3)C2)c1 ZINC000877144381 1137671479 /nfs/dbraw/zinc/67/14/79/1137671479.db2.gz LMZPFCCFPBUMRW-UHFFFAOYSA-N 1 0 340.427 3.811 20 5 EHBDRO C[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cccc(C2CC2)c1 ZINC000877557277 1137681157 /nfs/dbraw/zinc/68/11/57/1137681157.db2.gz JMZGAPLYRCAERH-AXOLYNHLSA-N 1 0 326.400 3.723 20 5 EHBDRO Cc1csc([C@@H]2CC[N@H+](C/C=C\c3ccccc3[N+](=O)[O-])C2)n1 ZINC000877813828 1137690976 /nfs/dbraw/zinc/69/09/76/1137690976.db2.gz PKNJCVQOEWWUBX-ZDTYVGOBSA-N 1 0 329.425 3.862 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC12CCC2 ZINC000878337485 1137711372 /nfs/dbraw/zinc/71/13/72/1137711372.db2.gz LGVSXYQMCGHMBB-ZDUSSCGKSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447926 1137716476 /nfs/dbraw/zinc/71/64/76/1137716476.db2.gz OVZLGIYKROZIIL-TZMCWYRMSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H]1CCC[C@@H]1[NH2+]Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878507753 1137718379 /nfs/dbraw/zinc/71/83/79/1137718379.db2.gz JPBFLDWDBDHSSH-SKDRFNHKSA-N 1 0 336.779 3.576 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](C[C@@H](O)c2ccc(F)c(F)c2)C2CC2)cc1 ZINC000130200377 1137834852 /nfs/dbraw/zinc/83/48/52/1137834852.db2.gz OTGXWERYXALWKM-GOSISDBHSA-N 1 0 348.349 3.571 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H]1CCC2(CCOCC2)CO1 ZINC000883261938 1137851127 /nfs/dbraw/zinc/85/11/27/1137851127.db2.gz QZWPAAGTDCBBGM-NVXWUHKLSA-N 1 0 348.443 3.530 20 5 EHBDRO C[C@@](CO)(C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000348253308 1137881194 /nfs/dbraw/zinc/88/11/94/1137881194.db2.gz DMQLSIHOZRZCDP-UXHICEINSA-N 1 0 340.423 3.512 20 5 EHBDRO CC[C@H]([NH2+]C[C@](C)(CO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000348276776 1137892037 /nfs/dbraw/zinc/89/20/37/1137892037.db2.gz FLIMUCGLCVUBEF-RBUKOAKNSA-N 1 0 328.412 3.586 20 5 EHBDRO CC(C)([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1cccs1 ZINC000348315299 1137942152 /nfs/dbraw/zinc/94/21/52/1137942152.db2.gz GZXRQCWKAWEVQK-UHFFFAOYSA-N 1 0 333.413 3.510 20 5 EHBDRO COc1cccc([C@@H]2CC[N@H+](Cc3cccnc3[N+](=O)[O-])C2(C)C)c1 ZINC000886316743 1138066700 /nfs/dbraw/zinc/06/67/00/1138066700.db2.gz LJMLYIXJHGKRCJ-KRWDZBQOSA-N 1 0 341.411 3.767 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@@H]2CC[C@]3(CO[C@@H](C)[C@@H]3C)O2)cc1[N+](=O)[O-] ZINC000886771667 1138137335 /nfs/dbraw/zinc/13/73/35/1138137335.db2.gz LSRGLTPSSQJCQC-NDVSXACPSA-N 1 0 348.443 3.526 20 5 EHBDRO CCC[C@H]([NH2+]CCCOC1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000090082491 1138209048 /nfs/dbraw/zinc/20/90/48/1138209048.db2.gz GHLOKFXLIBNVQB-SFHVURJKSA-N 1 0 336.432 3.611 20 5 EHBDRO CCOC[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000093838973 1138241639 /nfs/dbraw/zinc/24/16/39/1138241639.db2.gz MTYZMJDLRAKORV-AWEZNQCLSA-N 1 0 330.384 3.713 20 5 EHBDRO C[C@@H]1c2ccccc2CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000337261168 1138512470 /nfs/dbraw/zinc/51/24/70/1138512470.db2.gz XSBIQZQGPMDLGV-CQSZACIVSA-N 1 0 339.395 3.543 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CC(NC(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000302093634 1138711212 /nfs/dbraw/zinc/71/12/12/1138711212.db2.gz ONAZSFDREGXYCJ-LRVUVFPRSA-N 1 0 349.431 3.610 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000153256716 1139129057 /nfs/dbraw/zinc/12/90/57/1139129057.db2.gz FOXYEKUQOTVUPI-YVEFUNNKSA-N 1 0 348.374 3.517 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C2CCN(CC(F)(F)F)CC2)cccc1[N+](=O)[O-] ZINC000178366913 1139688891 /nfs/dbraw/zinc/68/88/91/1139688891.db2.gz UNONYDLHTUPSCG-GFCCVEGCSA-N 1 0 345.365 3.581 20 5 EHBDRO Cc1cc([C@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c(C)s1 ZINC000182988318 1140005915 /nfs/dbraw/zinc/00/59/15/1140005915.db2.gz PUWPDZSVJJZMKS-LBPRGKRZSA-N 1 0 347.440 3.587 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC[C@@H](C)[NH+]1CCCCC1 ZINC000183876286 1140063255 /nfs/dbraw/zinc/06/32/55/1140063255.db2.gz UCPUVTLPKFAVIB-CQSZACIVSA-N 1 0 348.447 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]Cc1ccc(-n3cccn3)cc1)CCC2 ZINC000192675995 1140543150 /nfs/dbraw/zinc/54/31/50/1140543150.db2.gz MODXAWYDCSWBQF-FQEVSTJZSA-N 1 0 348.406 3.948 20 5 EHBDRO CO[C@@H]1CCCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000266141159 1140646349 /nfs/dbraw/zinc/64/63/49/1140646349.db2.gz HHIXPLFBBRKPCE-HZPDHXFCSA-N 1 0 347.440 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)Nc2cc(C)cc(C[NH+](C)C)c2)c1 ZINC000270409284 1141219088 /nfs/dbraw/zinc/21/90/88/1141219088.db2.gz ZEWBSSNHPHNITJ-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CC(CC)(CC)CCO)cc1[N+](=O)[O-] ZINC000271140927 1141313106 /nfs/dbraw/zinc/31/31/06/1141313106.db2.gz OJWRXZBXFIKRLB-CQSZACIVSA-N 1 0 338.448 3.833 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1c(C)noc1C ZINC000271176603 1141318641 /nfs/dbraw/zinc/31/86/41/1141318641.db2.gz VCEQXHMNIFOCGU-CQSZACIVSA-N 1 0 349.456 3.903 20 5 EHBDRO COc1ccc([C@@H]([NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)C2CC2)cc1 ZINC000283074745 1141547686 /nfs/dbraw/zinc/54/76/86/1141547686.db2.gz KIDNLCPHMPFKIR-SFHVURJKSA-N 1 0 330.359 3.983 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(c3nc4ccccc4[nH]3)CC2)c1 ZINC000004315214 210167630 /nfs/dbraw/zinc/16/76/30/210167630.db2.gz UGUBSHDHXRPBIJ-UHFFFAOYSA-N 1 0 336.395 3.851 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(Cn2cccn2)c1 ZINC000579732244 1014312661 /nfs/dbraw/zinc/31/26/61/1014312661.db2.gz SNMFAQBCFFAPGA-IBGZPJMESA-N 1 0 348.406 3.617 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@@H](COc2ccccc2)C1 ZINC000430197057 1014831909 /nfs/dbraw/zinc/83/19/09/1014831909.db2.gz TZHMJCWARIIYSC-OAHLLOKOSA-N 1 0 342.395 3.504 20 5 EHBDRO C[N@@H+](C/C=C\c1ccccc1[N+](=O)[O-])CCOCc1ccccc1 ZINC000535820335 1015017830 /nfs/dbraw/zinc/01/78/30/1015017830.db2.gz QEQGBOHBUQOJKT-XFFZJAGNSA-N 1 0 326.396 3.757 20 5 EHBDRO Cn1cc(C[NH2+]CC23CCC(CC2)C3)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000339789939 1015676317 /nfs/dbraw/zinc/67/63/17/1015676317.db2.gz OAHCLDQUKRNPGF-UHFFFAOYSA-N 1 0 340.427 3.665 20 5 EHBDRO CCOc1cc(NC[C@H](Cc2ccccc2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000471241465 1016011643 /nfs/dbraw/zinc/01/16/43/1016011643.db2.gz PZYHVWKPPBDODM-KRWDZBQOSA-N 1 0 343.427 3.578 20 5 EHBDRO C[NH2+]Cc1cn(-c2nc(C)cc(Cl)c2[N+](=O)[O-])c2ccc(C)cc12 ZINC001167123527 1016186754 /nfs/dbraw/zinc/18/67/54/1016186754.db2.gz LDOOLVLTFOPVEN-UHFFFAOYSA-N 1 0 344.802 3.923 20 5 EHBDRO CC(C)(C)[C@H]([NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000430384332 1016583672 /nfs/dbraw/zinc/58/36/72/1016583672.db2.gz KMPDGHACDVJGCZ-MRXNPFEDSA-N 1 0 343.383 3.699 20 5 EHBDRO CC1(C)CC[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000189713472 1016693680 /nfs/dbraw/zinc/69/36/80/1016693680.db2.gz XEHYUMGYXVVWSO-HNNXBMFYSA-N 1 0 347.440 3.766 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(CCO)CC3)s2)cc1 ZINC000189993048 1016833761 /nfs/dbraw/zinc/83/37/61/1016833761.db2.gz WSBHRMXOBIQBPJ-UHFFFAOYSA-N 1 0 332.425 3.576 20 5 EHBDRO Cc1ccc(C[C@H]2CCC[N@H+](Cc3cccnc3[N+](=O)[O-])C2)cc1 ZINC001167263977 1016867462 /nfs/dbraw/zinc/86/74/62/1016867462.db2.gz HAZSLYQOCFOPDU-QGZVFWFLSA-N 1 0 325.412 3.753 20 5 EHBDRO C[C@@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@@H](C)O1 ZINC000414523194 1016951272 /nfs/dbraw/zinc/95/12/72/1016951272.db2.gz YAYBXJLDQCPTRX-MCIONIFRSA-N 1 0 330.384 3.758 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCN(Cc2ccc(C(C)C)c([N+](=O)[O-])c2)C1 ZINC000536696705 1032157412 /nfs/dbraw/zinc/15/74/12/1032157412.db2.gz FLLPFZSONCFIIE-QGZVFWFLSA-N 1 0 333.476 3.882 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCN(c2ccccc2)C1 ZINC000449077016 1032167198 /nfs/dbraw/zinc/16/71/98/1032167198.db2.gz QOYHBSOOYFERSA-IAGOWNOFSA-N 1 0 339.439 3.642 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-] ZINC000449174620 1032266783 /nfs/dbraw/zinc/26/67/83/1032266783.db2.gz PMPLTBOJYPPPAH-HUUCEWRRSA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@@H]([NH2+]CCN1CCC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536841429 1032333544 /nfs/dbraw/zinc/33/35/44/1032333544.db2.gz UKUCIOWSGHSORI-CYBMUJFWSA-N 1 0 331.441 3.680 20 5 EHBDRO COCC[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000449228049 1032345791 /nfs/dbraw/zinc/34/57/91/1032345791.db2.gz RSRNOMNZSPFIKB-CJNGLKHVSA-N 1 0 332.400 3.795 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCOc2ccc(F)c(F)c2)cccc1[N+](=O)[O-] ZINC000536860355 1032359326 /nfs/dbraw/zinc/35/93/26/1032359326.db2.gz XJCCIVDPWFGYOW-GFCCVEGCSA-N 1 0 336.338 3.911 20 5 EHBDRO CC[N@H+](C[C@H]1COc2ccccc2O1)[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000485189005 1032368612 /nfs/dbraw/zinc/36/86/12/1032368612.db2.gz FKGWQLJOKCEKOP-GJZGRUSLSA-N 1 0 342.395 3.818 20 5 EHBDRO CC(C)C[C@@H]1C[C@H]1[NH2+]Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000459671515 1032400737 /nfs/dbraw/zinc/40/07/37/1032400737.db2.gz WIYVDYQQCAKTFD-RHSMWYFYSA-N 1 0 328.416 3.520 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CC[C@@H](O)[C@H](C3CCCC3)C2)c(Cl)c1 ZINC000459755160 1032447129 /nfs/dbraw/zinc/44/71/29/1032447129.db2.gz NRXPFOYZWLOTNT-DOTOQJQBSA-N 1 0 338.835 3.621 20 5 EHBDRO COc1ccc(CNc2ccc(C[NH+](C)C)c(C)c2)cc1[N+](=O)[O-] ZINC000459740063 1032454897 /nfs/dbraw/zinc/45/48/97/1032454897.db2.gz LMTXAUONBDPNFF-UHFFFAOYSA-N 1 0 329.400 3.586 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C2(CCOCc3ccccc3)CC2)cs1 ZINC000340595588 1032520959 /nfs/dbraw/zinc/52/09/59/1032520959.db2.gz JWOOZSGDDFUPQI-UHFFFAOYSA-N 1 0 332.425 3.885 20 5 EHBDRO C[C@H](CCCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000449410328 1032532893 /nfs/dbraw/zinc/53/28/93/1032532893.db2.gz YRXSYNFBWXDDBL-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000537307299 1032613944 /nfs/dbraw/zinc/61/39/44/1032613944.db2.gz PJNGFFZFRSMZQY-IEZWGBDMSA-N 1 0 346.471 3.693 20 5 EHBDRO O=[N+]([O-])c1cc(CO)cc(-c2ccc(C[NH+]3CCCCC3)cc2)c1 ZINC000592984386 1032652515 /nfs/dbraw/zinc/65/25/15/1032652515.db2.gz BGLQVPJMPSALIL-UHFFFAOYSA-N 1 0 326.396 3.740 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H]1CCO[C@H](C(C)C)C1 ZINC000449490272 1032656923 /nfs/dbraw/zinc/65/69/23/1032656923.db2.gz BRRIONTXLVPIGP-KDOFPFPSSA-N 1 0 336.432 3.534 20 5 EHBDRO CCn1nc(C)c(C[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c1C ZINC000449497177 1032670130 /nfs/dbraw/zinc/67/01/30/1032670130.db2.gz IGWXTWJOEDVMGK-KRWDZBQOSA-N 1 0 342.443 3.808 20 5 EHBDRO C[C@@H]([NH3+])[C@@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000414656209 1017107302 /nfs/dbraw/zinc/10/73/02/1017107302.db2.gz HZWKOUGIYNJYFY-UKRRQHHQSA-N 1 0 345.468 3.883 20 5 EHBDRO CC(C)[C@@H]([NH3+])CNCc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000414802268 1017204974 /nfs/dbraw/zinc/20/49/74/1017204974.db2.gz VJYBTVYDTFGZNJ-INIZCTEOSA-N 1 0 347.390 3.599 20 5 EHBDRO CC(C)[C@H]([NH3+])CNCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414805412 1017207222 /nfs/dbraw/zinc/20/72/22/1017207222.db2.gz YKQKDGFMPIDYBT-OAHLLOKOSA-N 1 0 337.807 3.581 20 5 EHBDRO CC[N@H+](C)C[C@@H]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])C1 ZINC000892730071 1017241197 /nfs/dbraw/zinc/24/11/97/1017241197.db2.gz DLCPEHQSPLDYCW-LBPRGKRZSA-N 1 0 348.834 3.574 20 5 EHBDRO CCc1ccccc1[C@@H](N)C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-] ZINC000415070023 1017504055 /nfs/dbraw/zinc/50/40/55/1017504055.db2.gz UEUAZGFSCJSEAB-KXBFYZLASA-N 1 0 341.455 3.768 20 5 EHBDRO CC(C)n1ccc(C[C@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)n1 ZINC000468033499 1017527687 /nfs/dbraw/zinc/52/76/87/1017527687.db2.gz LFRLHAYFFYHUJE-LBPRGKRZSA-N 1 0 336.823 3.746 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@@H]2[N@@H+]1Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000118849882 1017990051 /nfs/dbraw/zinc/99/00/51/1017990051.db2.gz WALCDVDUTBFCFG-INWMFGNUSA-N 1 0 342.399 3.798 20 5 EHBDRO CC[C@H]1C[C@@H](C)C[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000610410598 1018933242 /nfs/dbraw/zinc/93/32/42/1018933242.db2.gz VJCAACNBIZWXAK-PWSUYJOCSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccccc1F ZINC000592402476 1032797205 /nfs/dbraw/zinc/79/72/05/1032797205.db2.gz HMPJIQVBDMOLDB-KSSFIOAISA-N 1 0 346.402 3.768 20 5 EHBDRO CN(Cc1ccccc1)CC(C)(C)[NH2+]Cc1cccc([N+](=O)[O-])c1 ZINC000379623373 1019002193 /nfs/dbraw/zinc/00/21/93/1019002193.db2.gz IGQMNGHBWOTJHQ-UHFFFAOYSA-N 1 0 327.428 3.595 20 5 EHBDRO C[C@@H]1CC[C@H]([NH2+][C@@H](c2nccn2C)c2ccc([N+](=O)[O-])cc2)C[C@@H]1C ZINC000580340936 1019094200 /nfs/dbraw/zinc/09/42/00/1019094200.db2.gz FQZUOTBNLRXZQK-YQYZPQCESA-N 1 0 342.443 3.832 20 5 EHBDRO C[C@@H]1C[C@H]([NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])c2nccn21 ZINC000449572027 1032827820 /nfs/dbraw/zinc/82/78/20/1032827820.db2.gz MMCPLGSGKAHPQD-WTTBNOFXSA-N 1 0 340.427 3.798 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000182344483 1019459608 /nfs/dbraw/zinc/45/96/08/1019459608.db2.gz BGRQCTPADOIZCK-GFCCVEGCSA-N 1 0 347.802 3.846 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH+]1CCC(OC[C@H]2CCCO2)CC1 ZINC000182836767 1019768107 /nfs/dbraw/zinc/76/81/07/1019768107.db2.gz KXJFCBPAKCLCPR-MAUKXSAKSA-N 1 0 348.443 3.624 20 5 EHBDRO COc1ccccc1[C@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000157798609 1032880499 /nfs/dbraw/zinc/88/04/99/1032880499.db2.gz MHAKRXHQRNFHDL-ZDUSSCGKSA-N 1 0 330.359 3.732 20 5 EHBDRO CC1(C)C[C@H](O)CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449616047 1032886465 /nfs/dbraw/zinc/88/64/65/1032886465.db2.gz BMSTXRAFPXJPKU-MRXNPFEDSA-N 1 0 344.411 3.838 20 5 EHBDRO CC(C)[C@@H](C[N@H+](C)Cc1ccccc1)Nc1ncc([N+](=O)[O-])s1 ZINC000337016026 1020542453 /nfs/dbraw/zinc/54/24/53/1020542453.db2.gz LRDMJSKOASGQSM-CQSZACIVSA-N 1 0 334.445 3.620 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])cc1)[C@@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000393853548 1021078825 /nfs/dbraw/zinc/07/88/25/1021078825.db2.gz XBVIWQYUTFVSBC-DOTOQJQBSA-N 1 0 325.412 3.917 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341221648 1021123076 /nfs/dbraw/zinc/12/30/76/1021123076.db2.gz QVBHBQJKBYYJCC-DYVFJYSZSA-N 1 0 327.384 3.663 20 5 EHBDRO CC[NH+](CC)C[C@@H](C)N[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581612117 1021150496 /nfs/dbraw/zinc/15/04/96/1021150496.db2.gz CPOFWSYTJAVJBV-RISCZKNCSA-N 1 0 333.354 3.518 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(Cc2csc([N+](=O)[O-])c2)CC1 ZINC000054174814 1021168210 /nfs/dbraw/zinc/16/82/10/1021168210.db2.gz OATSFIDWGYPRMQ-UHFFFAOYSA-N 1 0 345.468 3.673 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CCN(c2ccccc2F)C1)c1cccc([N+](=O)[O-])c1 ZINC000426296734 1021199427 /nfs/dbraw/zinc/19/94/27/1021199427.db2.gz SXDUSVQPEIWOBX-HIFRSBDPSA-N 1 0 329.375 3.663 20 5 EHBDRO CCc1ccc([C@@H](CO)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000090843964 1021204565 /nfs/dbraw/zinc/20/45/65/1021204565.db2.gz PXHKHZGMRMXUJL-KBXCAEBGSA-N 1 0 328.412 3.850 20 5 EHBDRO CO[C@H]([C@H](C)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000449633531 1032967740 /nfs/dbraw/zinc/96/77/40/1032967740.db2.gz ULVVFSATIJVLKE-KPZWWZAWSA-N 1 0 330.384 3.758 20 5 EHBDRO Cc1ccc(O[C@@H](C)C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)cc1 ZINC000602560099 1032973171 /nfs/dbraw/zinc/97/31/71/1032973171.db2.gz IEUCDKWFYNBKKB-ZDUSSCGKSA-N 1 0 341.367 3.602 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCc2c[nH]c3ccc(F)cc23)cc1 ZINC000337309233 1021357015 /nfs/dbraw/zinc/35/70/15/1021357015.db2.gz TYYHCXUQFRUAMB-UHFFFAOYSA-N 1 0 327.359 3.938 20 5 EHBDRO C[NH+](C)C1(C)CCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000894850183 1021380772 /nfs/dbraw/zinc/38/07/72/1021380772.db2.gz UTUBRTNOKVWUBM-UHFFFAOYSA-N 1 0 331.338 3.534 20 5 EHBDRO C[C@H]1CC([NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@H](C)O1 ZINC000602577344 1032995491 /nfs/dbraw/zinc/99/54/91/1032995491.db2.gz HKGUFJXFTNUBME-UWVGGRQHSA-N 1 0 332.322 3.659 20 5 EHBDRO Cc1cnccc1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602583815 1033003780 /nfs/dbraw/zinc/00/37/80/1033003780.db2.gz YUQNSHSJIAIBQX-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H]2CCO[C@@H](c3ccc(F)cc3)C2)cc1 ZINC000602613062 1033028648 /nfs/dbraw/zinc/02/86/48/1033028648.db2.gz MWCUPWQCNUZDRC-IEBWSBKVSA-N 1 0 344.386 3.786 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cnn(-c3ccccc3)c2)cccc1[N+](=O)[O-] ZINC000129490760 1022136143 /nfs/dbraw/zinc/13/61/43/1022136143.db2.gz PWACQEYRPMZILO-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO COc1ccc([C@@H](CNc2ccccc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000025777468 1022144691 /nfs/dbraw/zinc/14/46/91/1022144691.db2.gz OXFDXKIPERVXHZ-LJQANCHMSA-N 1 0 341.411 3.852 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CC[C@H](OC)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000471788848 1022207142 /nfs/dbraw/zinc/20/71/42/1022207142.db2.gz QSPZOHFOXBKDMY-DKSSEZFCSA-N 1 0 344.411 3.997 20 5 EHBDRO C[N@H+](CCCCO)Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000276683510 1022239929 /nfs/dbraw/zinc/23/99/29/1022239929.db2.gz QYTKWCDFBKEFEZ-UHFFFAOYSA-N 1 0 338.791 3.713 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2ccc3c(c2)CCO3)cccc1[N+](=O)[O-] ZINC000178233750 1022247187 /nfs/dbraw/zinc/24/71/87/1022247187.db2.gz OJLAYNQWQNDLBI-AWEZNQCLSA-N 1 0 326.396 3.731 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000425934803 1022267877 /nfs/dbraw/zinc/26/78/77/1022267877.db2.gz ATWQDPNNCCLJTF-BBRMVZONSA-N 1 0 326.396 3.812 20 5 EHBDRO CC[C@H]1[C@H](C)CC[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000187579990 1022356512 /nfs/dbraw/zinc/35/65/12/1022356512.db2.gz NTHYTJTUZOGIFI-DYVFJYSZSA-N 1 0 328.416 3.616 20 5 EHBDRO O=[N+]([O-])c1ccn(C2CC[NH+](Cc3cc4cc(F)ccc4o3)CC2)n1 ZINC000425974581 1022530386 /nfs/dbraw/zinc/53/03/86/1022530386.db2.gz DMPVZCXIOKOLIW-UHFFFAOYSA-N 1 0 344.346 3.514 20 5 EHBDRO CCSCC[C@H](C)[N@H+](C)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000184264169 1022679383 /nfs/dbraw/zinc/67/93/83/1022679383.db2.gz MTDPJXCVFOAZGU-NSHDSACASA-N 1 0 330.425 3.706 20 5 EHBDRO CCC1(CC)CC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)C1 ZINC000438493833 1022721697 /nfs/dbraw/zinc/72/16/97/1022721697.db2.gz MTGQFVCZXXDGIP-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCC[C@H]2c2ccccn2)cc1 ZINC000610582241 1022796583 /nfs/dbraw/zinc/79/65/83/1022796583.db2.gz PQYHFEPPXLQIFY-SFHVURJKSA-N 1 0 327.384 3.596 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3cn4ccnc4s3)C2)cc1 ZINC000894722121 1022818125 /nfs/dbraw/zinc/81/81/25/1022818125.db2.gz ILSODVDMWCWXSL-AWEZNQCLSA-N 1 0 342.424 3.684 20 5 EHBDRO COc1ccc([C@H](C)[N@H+](C)CCOc2cccc([N+](=O)[O-])c2)cc1 ZINC000058932682 1033085597 /nfs/dbraw/zinc/08/55/97/1033085597.db2.gz VUVSZXOFIPRTNH-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO Cc1ncc([C@H](C)[N@@H+]2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)c(C)n1 ZINC000602684817 1033085766 /nfs/dbraw/zinc/08/57/66/1033085766.db2.gz IQIBPTJSJWHWRW-YOEHRIQHSA-N 1 0 340.427 3.942 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CCO[C@H]3C3CC3)s2)cc1 ZINC000536339176 1022899971 /nfs/dbraw/zinc/89/99/71/1022899971.db2.gz ZMGUFBNMRGCZHY-WMZOPIPTSA-N 1 0 344.436 3.980 20 5 EHBDRO C[N@H+]1C[C@H]2CC[C@@H](C1)N2C(=O)c1c2ccccc2cc2ccccc21 ZINC001270377288 1022924305 /nfs/dbraw/zinc/92/43/05/1022924305.db2.gz RQGUJBKKDIZAFB-HDICACEKSA-N 1 0 330.431 3.912 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602705606 1033092312 /nfs/dbraw/zinc/09/23/12/1033092312.db2.gz NOCHQDPTUQDILF-NSHDSACASA-N 1 0 339.317 3.729 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](CO)C1CCCCC1 ZINC000550276371 1022954476 /nfs/dbraw/zinc/95/44/76/1022954476.db2.gz LGFUJVLFMAICLS-BXBOZWQASA-N 1 0 332.444 3.777 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)c2ccc(-n3ccnc3)cc2)cccc1[N+](=O)[O-] ZINC000327712687 1023106636 /nfs/dbraw/zinc/10/66/36/1023106636.db2.gz ZUPBHXYEWCOAQH-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCN(C3CC3)CC2)s1 ZINC000506434926 1023133507 /nfs/dbraw/zinc/13/35/07/1023133507.db2.gz YBFMYLKTYKCGOO-UHFFFAOYSA-N 1 0 343.452 3.603 20 5 EHBDRO C[C@@H](C[C@@H]1CCOC1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000610740642 1023403173 /nfs/dbraw/zinc/40/31/73/1023403173.db2.gz XERKNQOIYCNJKG-STQMWFEESA-N 1 0 347.440 3.623 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccc2[nH]c(=O)[nH]c2c1 ZINC000610818797 1023782450 /nfs/dbraw/zinc/78/24/50/1023782450.db2.gz SJTBIYJDLPQPAP-NEPJUHHUSA-N 1 0 340.383 3.897 20 5 EHBDRO C[C@@H]1CC2(CC([NH2+]Cc3ccc(-c4ccccc4[N+](=O)[O-])o3)C2)CO1 ZINC000897781191 1033174030 /nfs/dbraw/zinc/17/40/30/1033174030.db2.gz SCASZPBGOSFDIT-VFPJAPOESA-N 1 0 342.395 3.902 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@H]2CCCC(F)(F)C2)CC1 ZINC000513960962 1023998267 /nfs/dbraw/zinc/99/82/67/1023998267.db2.gz SCSZRFOXTDKQLM-AWEZNQCLSA-N 1 0 339.386 3.542 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1CC[NH+](C[C@@H]2CCCC(F)(F)C2)CC1 ZINC000513960963 1024001048 /nfs/dbraw/zinc/00/10/48/1024001048.db2.gz SCSZRFOXTDKQLM-CQSZACIVSA-N 1 0 339.386 3.542 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@@H](C)[N@H+](C)CCn1ccc([N+](=O)[O-])n1 ZINC000176288586 1024012579 /nfs/dbraw/zinc/01/25/79/1024012579.db2.gz YEGPFBVVNKFQJR-QWHCGFSZSA-N 1 0 336.823 3.569 20 5 EHBDRO CO[C@H](C[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1)C1CCCC1 ZINC001167499041 1024214822 /nfs/dbraw/zinc/21/48/22/1024214822.db2.gz AZDZRKJWOWACGW-LJQANCHMSA-N 1 0 348.443 3.643 20 5 EHBDRO C[NH+](C)CC[C@@H]1CCN(c2c3cc(Cl)ccc3ncc2[N+](=O)[O-])C1 ZINC000895319334 1024284011 /nfs/dbraw/zinc/28/40/11/1024284011.db2.gz HSMJYMOIGBGOIU-GFCCVEGCSA-N 1 0 348.834 3.574 20 5 EHBDRO CCN(Cc1ccc(OC)c(OC)c1)Cc1c(F)cccc1[N+](=O)[O-] ZINC000505581671 1024533115 /nfs/dbraw/zinc/53/31/15/1024533115.db2.gz KEWCDMLNLKPWCR-UHFFFAOYSA-N 1 0 348.374 3.773 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@H](N(C)C(=O)OC(C)(C)C)C1 ZINC000749810682 1024549922 /nfs/dbraw/zinc/54/99/22/1024549922.db2.gz MRKBNWIYZKAXQS-KGLIPLIRSA-N 1 0 349.431 3.597 20 5 EHBDRO O=[N+]([O-])c1c2cccnc2ccc1N1CCC[C@H]1C[NH+]1CCCCC1 ZINC000548617233 1024755021 /nfs/dbraw/zinc/75/50/21/1024755021.db2.gz IGZKMIPZMIDRIN-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+]3CC[C@@H](CCCO)C3)s2)cc1 ZINC000449791155 1033234839 /nfs/dbraw/zinc/23/48/39/1033234839.db2.gz NVEOUPQJHBLZKD-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO COc1cc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])cc(OC)c1 ZINC000508000982 1024817338 /nfs/dbraw/zinc/81/73/38/1024817338.db2.gz UQNQRZHHCSUBAL-SOFGYWHQSA-N 1 0 342.395 3.757 20 5 EHBDRO [NH3+][C@H]1CCN(Cc2ccc(Oc3ccccc3Cl)c([N+](=O)[O-])c2)C1 ZINC000435382380 1024864393 /nfs/dbraw/zinc/86/43/93/1024864393.db2.gz ZJZFYSDUSQWKCJ-ZDUSSCGKSA-N 1 0 347.802 3.574 20 5 EHBDRO C[C@@H](c1ccc(F)c(F)c1)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000515123993 1025035332 /nfs/dbraw/zinc/03/53/32/1025035332.db2.gz SHVSOWIRZUZHPQ-LBPRGKRZSA-N 1 0 336.338 3.945 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2ccc([N+](=O)[O-])c(OC(C)(C)C)c2)C1 ZINC000582039192 1025073176 /nfs/dbraw/zinc/07/31/76/1025073176.db2.gz CNZJESPUWZGWOK-GDBMZVCRSA-N 1 0 347.459 3.693 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+][C@@H]2C[C@@H]3CCC[C@@H]23)cc1Br ZINC000897958705 1033259694 /nfs/dbraw/zinc/25/96/94/1033259694.db2.gz MHSGWLQUHKNQQL-JVUFJMBOSA-N 1 0 331.235 3.697 20 5 EHBDRO O=C(NC[C@@H]1CCC[N@@H+]1C1CCCCC1)Nc1ccc([N+](=O)[O-])cc1 ZINC000435771461 1025130706 /nfs/dbraw/zinc/13/07/06/1025130706.db2.gz VOHYUQIXEQIWJC-KRWDZBQOSA-N 1 0 346.431 3.513 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccccc1OC(F)F ZINC000511065717 1025174778 /nfs/dbraw/zinc/17/47/78/1025174778.db2.gz PDJNHLJZANFVSB-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2ccc3nonc3c2)cc1[N+](=O)[O-] ZINC000897993512 1033264887 /nfs/dbraw/zinc/26/48/87/1033264887.db2.gz FBGDAAVBMFVOJV-UHFFFAOYSA-N 1 0 326.356 3.544 20 5 EHBDRO C[C@](CO)([NH2+]Cc1cccc(C(F)F)c1)c1cccc([N+](=O)[O-])c1 ZINC000602962089 1033280314 /nfs/dbraw/zinc/28/03/14/1033280314.db2.gz GUABMZUPQVKMQI-QGZVFWFLSA-N 1 0 336.338 3.530 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346993838 1025395466 /nfs/dbraw/zinc/39/54/66/1025395466.db2.gz BAYSOFGYSZEQME-CZUORRHYSA-N 1 0 329.400 3.557 20 5 EHBDRO C[C@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346993841 1025397183 /nfs/dbraw/zinc/39/71/83/1025397183.db2.gz BAYSOFGYSZEQME-XJKSGUPXSA-N 1 0 329.400 3.557 20 5 EHBDRO CN(Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C1C[C@H]2CC[C@@H](C1)[NH2+]2 ZINC000347083657 1025503762 /nfs/dbraw/zinc/50/37/62/1025503762.db2.gz ZOZUBIPTCDCMNV-FKEKPDDDSA-N 1 0 341.411 3.570 20 5 EHBDRO CC1(C)CC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC(C)(C)[NH2+]1 ZINC000436276359 1025547292 /nfs/dbraw/zinc/54/72/92/1025547292.db2.gz SMZNMLZTBUKMHN-UHFFFAOYSA-N 1 0 346.353 3.730 20 5 EHBDRO CCN(C(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000451100756 1025562361 /nfs/dbraw/zinc/56/23/61/1025562361.db2.gz XJWVQIDFWHKQRA-LSDHHAIUSA-N 1 0 341.411 3.687 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1)N(C)C ZINC000443008630 1025660202 /nfs/dbraw/zinc/66/02/02/1025660202.db2.gz GZNMZXXGYBGRAL-BEFAXECRSA-N 1 0 327.428 3.684 20 5 EHBDRO Cc1ccccc1[C@H]([C@@H](C)NCc1csc([N+](=O)[O-])c1)[NH+](C)C ZINC000443012250 1025662549 /nfs/dbraw/zinc/66/25/49/1025662549.db2.gz IQYHPLFWDOGUSL-DYVFJYSZSA-N 1 0 333.457 3.746 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+]Cc1ccccc1[N+](=O)[O-])OC(C)C ZINC000185720644 1025691176 /nfs/dbraw/zinc/69/11/76/1025691176.db2.gz SAMMCZRADIDHIP-IBGZPJMESA-N 1 0 344.411 3.859 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](COc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000505811276 1025707130 /nfs/dbraw/zinc/70/71/30/1025707130.db2.gz DYEXLAAUMCUCOD-INIZCTEOSA-N 1 0 342.395 3.504 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncccc1F ZINC000530471563 1025877958 /nfs/dbraw/zinc/87/79/58/1025877958.db2.gz IMYYDMDZZFEISU-LBPRGKRZSA-N 1 0 335.404 3.789 20 5 EHBDRO Cc1c(NC(=O)CC[NH2+][C@H]2CCC23CCCC3)cccc1[N+](=O)[O-] ZINC000451451876 1025979497 /nfs/dbraw/zinc/97/94/97/1025979497.db2.gz BOVVEIFQYGXXNI-INIZCTEOSA-N 1 0 331.416 3.544 20 5 EHBDRO CC1CC[NH+](CCN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)CC1 ZINC000451548075 1026098038 /nfs/dbraw/zinc/09/80/38/1026098038.db2.gz MIKHBQYVUQROIW-SFHVURJKSA-N 1 0 331.460 3.506 20 5 EHBDRO CCN(CCC[NH2+][C@H](C)c1ccccc1[N+](=O)[O-])CC(F)(F)F ZINC000475132454 1026236119 /nfs/dbraw/zinc/23/61/19/1026236119.db2.gz XRXCLZVTDICZMW-GFCCVEGCSA-N 1 0 333.354 3.520 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC000892288639 1027063723 /nfs/dbraw/zinc/06/37/23/1027063723.db2.gz SKPMZLZGKYTLRY-UHFFFAOYSA-N 1 0 348.834 3.763 20 5 EHBDRO CC(C)c1ccc(CN[C@@H](C)C[N@@H+]2CCC[C@H](C)C2)cc1[N+](=O)[O-] ZINC000520200571 1027077988 /nfs/dbraw/zinc/07/79/88/1027077988.db2.gz CPVROQRQISIXSF-HOTGVXAUSA-N 1 0 333.476 3.928 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])cc2F)CC[N@@H+]1Cc1ccccc1 ZINC000413172861 1027210395 /nfs/dbraw/zinc/21/03/95/1027210395.db2.gz GCZXUORFIXRFPA-ZFWWWQNUSA-N 1 0 344.390 3.594 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c3ncccc23)C1 ZINC000413188174 1027233997 /nfs/dbraw/zinc/23/39/97/1027233997.db2.gz TXPJIMTWDAPQGC-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CCC[C@H]([C@@H](O)C(F)(F)F)C1 ZINC000277845600 1027249843 /nfs/dbraw/zinc/24/98/43/1027249843.db2.gz SMMASRNHWLXDDK-SLEUVZQESA-N 1 0 346.349 3.599 20 5 EHBDRO C[N@H+](CCc1cccc(Nc2ncc([N+](=O)[O-])cc2F)c1)C1CC1 ZINC000413220992 1027307215 /nfs/dbraw/zinc/30/72/15/1027307215.db2.gz IFHZEEVZGBMBIQ-UHFFFAOYSA-N 1 0 330.363 3.509 20 5 EHBDRO COCCNc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000127184419 1027409750 /nfs/dbraw/zinc/40/97/50/1027409750.db2.gz PQFAGUJBIFAYQB-AWEZNQCLSA-N 1 0 329.400 3.504 20 5 EHBDRO C[NH+](C)Cc1cc(-c2noc(-c3ccc([N+](=O)[O-])cc3)n2)ccc1F ZINC000545752047 1027506222 /nfs/dbraw/zinc/50/62/22/1027506222.db2.gz PXLUOSZCOJJYQU-UHFFFAOYSA-N 1 0 342.330 3.513 20 5 EHBDRO COc1ccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000178659884 1027619918 /nfs/dbraw/zinc/61/99/18/1027619918.db2.gz OPSPQHGBLUQKJB-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO CC(C)(C)Oc1cccc(C[NH2+]C/C=C\c2ccccc2[N+](=O)[O-])n1 ZINC000503262917 1027694608 /nfs/dbraw/zinc/69/46/08/1027694608.db2.gz IBOFHPGLLLEHHQ-CLFYSBASSA-N 1 0 341.411 3.970 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCOc1ccccc1C(F)(F)F ZINC000237810127 1027765684 /nfs/dbraw/zinc/76/56/84/1027765684.db2.gz MTKDJWLYKGTFGB-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO Cc1nc(N[C@@H](C)[C@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781589 1027788582 /nfs/dbraw/zinc/78/85/82/1027788582.db2.gz BQOJWUNUAQKKFM-YOEHRIQHSA-N 1 0 340.427 3.621 20 5 EHBDRO CC(C)C[C@@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000533391410 1027796344 /nfs/dbraw/zinc/79/63/44/1027796344.db2.gz XQEKOAKWZBNORR-INIZCTEOSA-N 1 0 334.416 3.862 20 5 EHBDRO CCc1ccc(C(=O)Nc2ccc(C[NH+](C)C)cc2C)cc1[N+](=O)[O-] ZINC000909605512 1028024388 /nfs/dbraw/zinc/02/43/88/1028024388.db2.gz HHOUXYOIIMYPIM-UHFFFAOYSA-N 1 0 341.411 3.780 20 5 EHBDRO Cc1cnc(NC[C@@H]2CCC[N@H+](Cc3cccs3)C2)c([N+](=O)[O-])c1 ZINC000078656081 1028046201 /nfs/dbraw/zinc/04/62/01/1028046201.db2.gz ORPDITTUJGKMLN-AWEZNQCLSA-N 1 0 346.456 3.684 20 5 EHBDRO CCS[C@H]1CCCC[C@H]1[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444685663 1028131675 /nfs/dbraw/zinc/13/16/75/1028131675.db2.gz PAIQAFHEMYBTQK-HIFRSBDPSA-N 1 0 334.445 3.625 20 5 EHBDRO CC[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])[C@H]1CCCC[C@@H]1C ZINC000444677653 1028148599 /nfs/dbraw/zinc/14/85/99/1028148599.db2.gz QAQYSSVWMJBBAW-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681887 1028151945 /nfs/dbraw/zinc/15/19/45/1028151945.db2.gz RULKDUNXTZRSIV-WMLDXEAASA-N 1 0 333.432 3.742 20 5 EHBDRO COCC[C@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000502433129 1028197866 /nfs/dbraw/zinc/19/78/66/1028197866.db2.gz HADIDYOVOXODTB-DOMZBBRYSA-N 1 0 346.349 3.908 20 5 EHBDRO C[NH2+]C[C@H](C)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423285349 1028322255 /nfs/dbraw/zinc/32/22/55/1028322255.db2.gz ZJWABFRPJBNPGT-STQMWFEESA-N 1 0 333.457 3.829 20 5 EHBDRO C[C@@H]1C[C@@H](CO)C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000421369117 1028328801 /nfs/dbraw/zinc/32/88/01/1028328801.db2.gz XVUCUWGEVRCRJP-ZIAGYGMSSA-N 1 0 346.452 3.774 20 5 EHBDRO CCc1ccc([C@H](N[C@H]2CC[NH2+][C@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000423391993 1028404272 /nfs/dbraw/zinc/40/42/72/1028404272.db2.gz XGKVZPGMNQXDAP-FRIZHTMISA-N 1 0 343.427 3.570 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419802 1028435631 /nfs/dbraw/zinc/43/56/31/1028435631.db2.gz JKZDDISUZZNVNM-AWEZNQCLSA-N 1 0 330.384 3.675 20 5 EHBDRO CN(Cc1ccccc1[N+](=O)[O-])C(=O)CC[C@@H]([NH3+])CC1CCCCC1 ZINC000424083240 1028788758 /nfs/dbraw/zinc/78/87/58/1028788758.db2.gz CSMCWLXGWCBWOS-QGZVFWFLSA-N 1 0 347.459 3.631 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](CC(C)C)N(C)C)cc1[N+](=O)[O-] ZINC000504899742 1029042235 /nfs/dbraw/zinc/04/22/35/1029042235.db2.gz LISZDSVWIXGMLD-ZBFHGGJFSA-N 1 0 337.464 3.620 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CC)C2CCOCC2)cc1[N+](=O)[O-] ZINC000504918773 1029042937 /nfs/dbraw/zinc/04/29/37/1029042937.db2.gz IPDWGOHTSZZCIF-XJKSGUPXSA-N 1 0 336.432 3.849 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCC1(C)C)C(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000191850723 1029082337 /nfs/dbraw/zinc/08/23/37/1029082337.db2.gz PHEQYYDZBHDNQV-HZMBPMFUSA-N 1 0 339.823 3.744 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCCc3[nH]c(=O)ccc32)cc1[N+](=O)[O-] ZINC000343088966 1029094771 /nfs/dbraw/zinc/09/47/71/1029094771.db2.gz ATGLIKXOCOFPJU-MRXNPFEDSA-N 1 0 341.411 3.986 20 5 EHBDRO CC(C)[C@H](CC(F)(F)F)[NH2+]CCCOc1ccc([N+](=O)[O-])cc1 ZINC000445888355 1029209595 /nfs/dbraw/zinc/20/95/95/1029209595.db2.gz UMVBBBVEFLHZPL-AWEZNQCLSA-N 1 0 334.338 3.930 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000052183668 1029234502 /nfs/dbraw/zinc/23/45/02/1029234502.db2.gz MSGUIRSYDQBKTE-HNNXBMFYSA-N 1 0 340.427 3.976 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1Cc1ccc(CNc2ccc([N+](=O)[O-])cn2)cc1 ZINC000052183667 1029235796 /nfs/dbraw/zinc/23/57/96/1029235796.db2.gz MSGUIRSYDQBKTE-OAHLLOKOSA-N 1 0 340.427 3.976 20 5 EHBDRO COc1ccccc1[C@@H](CNc1ccc(Cl)cc1[N+](=O)[O-])[NH+](C)C ZINC000248184784 1029482243 /nfs/dbraw/zinc/48/22/43/1029482243.db2.gz GWTKNNOSFLNJSY-MRXNPFEDSA-N 1 0 349.818 3.972 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CC1(CCO)CCCC1 ZINC000513822897 1029523784 /nfs/dbraw/zinc/52/37/84/1029523784.db2.gz KRUMLNXIGNYPRP-SJLPKXTDSA-N 1 0 346.471 3.838 20 5 EHBDRO C[C@H]1C[N@@H+](C2CC2)C[C@H]1Nc1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC000535988781 1029575293 /nfs/dbraw/zinc/57/52/93/1029575293.db2.gz JSICUHZRMWEXML-TVQRCGJNSA-N 1 0 329.322 3.508 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000533293613 1029587555 /nfs/dbraw/zinc/58/75/55/1029587555.db2.gz WASKHZUVYVWYTL-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CCC1(CC)CC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000446721487 1029773233 /nfs/dbraw/zinc/77/32/33/1029773233.db2.gz UTYHSJBEWFWPIX-UHFFFAOYSA-N 1 0 330.388 3.657 20 5 EHBDRO CCO[C@@H](C[NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000446849532 1029818070 /nfs/dbraw/zinc/81/80/70/1029818070.db2.gz OEYPGYFRTITIQA-ICEKFOEVSA-N 1 0 326.396 3.975 20 5 EHBDRO CC[C@H](C)[NH2+][C@@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258795 1029961199 /nfs/dbraw/zinc/96/11/99/1029961199.db2.gz WDZPYGKJWYWTFV-JSGCOSHPSA-N 1 0 332.404 3.741 20 5 EHBDRO CCc1ccc([C@H]([NH2+]C[C@@H](C)CCCO)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453284386 1030024657 /nfs/dbraw/zinc/02/46/57/1030024657.db2.gz WBJHFFPPFASJSN-IFXJQAMLSA-N 1 0 346.427 3.838 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CC2(CF)CCOCC2)c2cc([N+](=O)[O-])ccc21 ZINC000453306210 1030074402 /nfs/dbraw/zinc/07/44/02/1030074402.db2.gz IXPCBIFRVUGTCJ-INIZCTEOSA-N 1 0 336.407 3.673 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@@H](C)[C@H](n2ccnc2)C1 ZINC000245515288 1030109478 /nfs/dbraw/zinc/10/94/78/1030109478.db2.gz DJQBSAGIKSFGQZ-RVKKMQEKSA-N 1 0 328.416 3.744 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1cccc([N+](=O)[O-])c1 ZINC000453341452 1030126639 /nfs/dbraw/zinc/12/66/39/1030126639.db2.gz CBYVVQIMDNLSFO-DDUZABMNSA-N 1 0 327.384 3.561 20 5 EHBDRO C[NH+](C)C[C@H](N[C@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(F)cc1 ZINC000583574591 1030168965 /nfs/dbraw/zinc/16/89/65/1030168965.db2.gz DPBUGARPYHYUIA-ROUUACIJSA-N 1 0 343.402 3.614 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C/C=C\c2ccccc2)n1 ZINC000447530372 1030252614 /nfs/dbraw/zinc/25/26/14/1030252614.db2.gz MLEHNONCUYVXRM-REEAJDFCSA-N 1 0 326.400 3.578 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCCc2cccc(F)c2)n1 ZINC000447530824 1030253383 /nfs/dbraw/zinc/25/33/83/1030253383.db2.gz PCEDBCZDZICGNQ-IRXDYDNUSA-N 1 0 346.406 3.637 20 5 EHBDRO CSc1ccc(C[NH2+][C@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)cc1 ZINC000447533904 1030269548 /nfs/dbraw/zinc/26/95/48/1030269548.db2.gz ZFSYFYUYFVQDQE-HOTGVXAUSA-N 1 0 346.456 3.787 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]CCn1cnc3ccccc31)CCC2 ZINC000447536405 1030271943 /nfs/dbraw/zinc/27/19/43/1030271943.db2.gz NAPFVXLHXRUSDU-KRWDZBQOSA-N 1 0 336.395 3.612 20 5 EHBDRO C[C@H](CC(C)(C)C)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453430003 1030285536 /nfs/dbraw/zinc/28/55/36/1030285536.db2.gz QCYWCWJAUHGVON-CJNGLKHVSA-N 1 0 330.432 3.832 20 5 EHBDRO C[C@H]([NH2+]C[C@H](C)N(C)C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000482507805 1030487221 /nfs/dbraw/zinc/48/72/21/1030487221.db2.gz IGYCNRXPJDGQIN-STQMWFEESA-N 1 0 333.457 3.924 20 5 EHBDRO Cc1cccc2c1CC[C@H]2[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000583748104 1030621393 /nfs/dbraw/zinc/62/13/93/1030621393.db2.gz QLJOJOVXBYMKGO-MRXNPFEDSA-N 1 0 339.395 3.509 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000237523774 1030673898 /nfs/dbraw/zinc/67/38/98/1030673898.db2.gz SVYFWRXBDAIPIF-STQMWFEESA-N 1 0 327.384 3.965 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](Cc1ccccc1)C[C@H](C)O ZINC000527304335 1030767552 /nfs/dbraw/zinc/76/75/52/1030767552.db2.gz AQYOAMXUWBKYFF-NIFLVVHWSA-N 1 0 340.423 3.881 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@@H](C(F)(F)F)C2)cc1 ZINC000527326343 1030799561 /nfs/dbraw/zinc/79/95/61/1030799561.db2.gz AZKQJVQQTGAQHB-VXGBXAGGSA-N 1 0 332.322 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@H+](Cc3ccc4ccccc4c3)C2)nc1 ZINC000237998931 1030810263 /nfs/dbraw/zinc/81/02/63/1030810263.db2.gz DYSAPZMXKCHHBR-SFHVURJKSA-N 1 0 348.406 3.829 20 5 EHBDRO C[C@H](O)[C@@](C)(C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)Cc1ccccc1 ZINC000249293670 1031111947 /nfs/dbraw/zinc/11/19/47/1031111947.db2.gz BOHZMKUVXSHKGZ-TWOQFEAHSA-N 1 0 342.439 3.875 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ccc([N+](=O)[O-])c(OC)c1)c1ccco1 ZINC000174704855 1031247601 /nfs/dbraw/zinc/24/76/01/1031247601.db2.gz ZOPRYEDBJLFYGY-HNNXBMFYSA-N 1 0 333.388 3.691 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H](C)C1CCCCC1 ZINC000483739071 1031311279 /nfs/dbraw/zinc/31/12/79/1031311279.db2.gz FGCCXXRUUMGCOI-KGLIPLIRSA-N 1 0 333.432 3.870 20 5 EHBDRO C[C@H]1C[C@H](N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC[N@@H+]1C ZINC000161118754 1031337348 /nfs/dbraw/zinc/33/73/48/1031337348.db2.gz OYIGLBRRJYIXCG-CMPLNLGQSA-N 1 0 331.338 3.533 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@]2(O)CCCC[C@@H]2C1 ZINC000161145753 1031357900 /nfs/dbraw/zinc/35/79/00/1031357900.db2.gz PDQXHOAEAXOKNL-VQIMIIECSA-N 1 0 348.443 3.509 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1ccc([N+](=O)[O-])cc1)CCc1cccs1 ZINC000343566051 1031424689 /nfs/dbraw/zinc/42/46/89/1031424689.db2.gz KVZVFMNUOAMSEY-UHFFFAOYSA-N 1 0 347.440 3.550 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCc3c(OC)cccc32)cc1[N+](=O)[O-] ZINC000584032319 1031504747 /nfs/dbraw/zinc/50/47/47/1031504747.db2.gz HHEHDWZNIFIMQQ-INIZCTEOSA-N 1 0 342.395 3.779 20 5 EHBDRO Cc1nn(C)cc1[C@H](C)[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000278597149 1031580003 /nfs/dbraw/zinc/58/00/03/1031580003.db2.gz AIWYYLKEJZULCT-APPDUMDISA-N 1 0 328.416 3.710 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c(F)c1 ZINC000537956063 1032044534 /nfs/dbraw/zinc/04/45/34/1032044534.db2.gz YKELDSKCMNOSFO-SFHVURJKSA-N 1 0 344.386 3.853 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)C1CCC(C)CC1 ZINC000063482942 1033388274 /nfs/dbraw/zinc/38/82/74/1033388274.db2.gz PBYHVENMWUTLCW-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc(-n2cncn2)cc1 ZINC000594490670 1033394804 /nfs/dbraw/zinc/39/48/04/1033394804.db2.gz PFCFJCIYYQESEE-FZKQIMNGSA-N 1 0 349.394 3.514 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCc2c1cccc2[N+](=O)[O-])c1ccc2[nH]c(=O)[nH]c2c1 ZINC000594494522 1033397425 /nfs/dbraw/zinc/39/74/25/1033397425.db2.gz CAMYCALXMKLKBS-IINYFYTJSA-N 1 0 338.367 3.515 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]C1CCN(c2cccs2)CC1 ZINC000594502871 1033403737 /nfs/dbraw/zinc/40/37/37/1033403737.db2.gz RVVFXPZGQXOAFM-INIZCTEOSA-N 1 0 343.452 3.902 20 5 EHBDRO CCC[C@@H]([NH2+][C@H]1c2ccccc2C[C@@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000594520286 1033429144 /nfs/dbraw/zinc/42/91/44/1033429144.db2.gz YSQKEXXWYNHPGQ-QYZOEREBSA-N 1 0 326.396 3.684 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000061015193 1033432403 /nfs/dbraw/zinc/43/24/03/1033432403.db2.gz MLOKIEYPTBOQRI-LJQANCHMSA-N 1 0 327.428 3.768 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2C(C)C)c([N+](=O)[O-])cc1OC(F)F ZINC000063618735 1033521289 /nfs/dbraw/zinc/52/12/89/1033521289.db2.gz DXPFMKTYUFRFKS-GFCCVEGCSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccccc2)C[C@@H]1CNc1ccc([N+](=O)[O-])cc1 ZINC000708583492 1033573889 /nfs/dbraw/zinc/57/38/89/1033573889.db2.gz KKHBVVLBNFZYOE-WBVHZDCISA-N 1 0 325.412 3.775 20 5 EHBDRO COC1CC(CC[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000594965145 1033602194 /nfs/dbraw/zinc/60/21/94/1033602194.db2.gz QGQQZHMWKGJKII-UHFFFAOYSA-N 1 0 347.440 3.623 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)c(C)c1 ZINC000595020943 1033613669 /nfs/dbraw/zinc/61/36/69/1033613669.db2.gz BLSUVGOZSRPFNL-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](CCO)C1CCCCC1 ZINC000595021049 1033614183 /nfs/dbraw/zinc/61/41/83/1033614183.db2.gz OKEXZXPSPOSRQL-DYVFJYSZSA-N 1 0 336.432 3.585 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]CCc1nc(C)c(C)s1 ZINC000595021077 1033614346 /nfs/dbraw/zinc/61/43/46/1033614346.db2.gz OYIZFEOHHHSZIC-LLVKDONJSA-N 1 0 335.429 3.570 20 5 EHBDRO C[C@@H](CNC(=O)c1cc2ccccc2c2cccnc12)[NH+]1CCCC1 ZINC000063732787 1033630137 /nfs/dbraw/zinc/63/01/37/1033630137.db2.gz YPWCSRFUTFFHIW-HNNXBMFYSA-N 1 0 333.435 3.602 20 5 EHBDRO CCOc1ccc([C@H](C)N[C@@H]2CC[N@@H+](C(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000595057256 1033635862 /nfs/dbraw/zinc/63/58/62/1033635862.db2.gz VYNJIYOEZZSXNR-DZGCQCFKSA-N 1 0 335.448 3.517 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3CO[C@@H](C4CC4)C3)s2)cc1 ZINC000599008177 1033642221 /nfs/dbraw/zinc/64/22/21/1033642221.db2.gz VMZUXMUAUUOHMO-WMLDXEAASA-N 1 0 344.436 3.980 20 5 EHBDRO C[C@H](COc1c(F)cccc1F)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000595072777 1033646489 /nfs/dbraw/zinc/64/64/89/1033646489.db2.gz QOPVEJWVYZVXLI-VXGBXAGGSA-N 1 0 336.338 3.991 20 5 EHBDRO COc1ccc(C(C)(C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1F ZINC000598996411 1033650257 /nfs/dbraw/zinc/65/02/57/1033650257.db2.gz ITZMYZDAFBPVAG-UHFFFAOYSA-N 1 0 348.374 3.776 20 5 EHBDRO C[C@H](Nc1ccc([N+](=O)[O-])c(OC(C)(C)C)c1)C1CC[NH+](C)CC1 ZINC000599042918 1033672295 /nfs/dbraw/zinc/67/22/95/1033672295.db2.gz GPQIQZDOUSJDRA-ZDUSSCGKSA-N 1 0 335.448 3.914 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCc2ccccc21 ZINC000595075715 1033693097 /nfs/dbraw/zinc/69/30/97/1033693097.db2.gz BALNXSUYPPDYBD-FZKQIMNGSA-N 1 0 339.395 3.589 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+]1CC2(CCC2)[C@@H]1C1CCOCC1 ZINC000595553797 1033858552 /nfs/dbraw/zinc/85/85/52/1033858552.db2.gz NRASDKAVIPHIBQ-KRWDZBQOSA-N 1 0 334.391 3.515 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H](CCO)c1ccco1 ZINC000249046058 1033886234 /nfs/dbraw/zinc/88/62/34/1033886234.db2.gz VWRANQPEIKFCGD-USXIJHARSA-N 1 0 344.411 3.612 20 5 EHBDRO C[C@H](CO)[C@H]1CCCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000595670815 1033942725 /nfs/dbraw/zinc/94/27/25/1033942725.db2.gz DNPVLWXDCHTWLD-IAQYHMDHSA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1cnc(NC2CCC([NH+]3CCCCC3)CC2)c(Cl)c1 ZINC000080247930 1033946137 /nfs/dbraw/zinc/94/61/37/1033946137.db2.gz JTMRNMKNCWZKPN-UHFFFAOYSA-N 1 0 338.839 3.852 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](Cc1ccc(F)cc1)C1CC1 ZINC000603836687 1033961702 /nfs/dbraw/zinc/96/17/02/1033961702.db2.gz ALICYFQZFVOBPC-UHFFFAOYSA-N 1 0 330.359 3.777 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@@H+]3CCC[C@@H](C4CCC4)C3)n2)cc1 ZINC000595837053 1034001498 /nfs/dbraw/zinc/00/14/98/1034001498.db2.gz OHFZYDNSGHXYIQ-OAHLLOKOSA-N 1 0 342.399 3.657 20 5 EHBDRO Cc1ccc([C@H](C)NC[C@H]2CCC[N@H+](CC3CC3)C2)cc1[N+](=O)[O-] ZINC000596093692 1034079267 /nfs/dbraw/zinc/07/92/67/1034079267.db2.gz DPIRGJCUGCTNFT-DOTOQJQBSA-N 1 0 331.460 3.676 20 5 EHBDRO COc1cc(NC[C@@H]2CCC[N@@H+](C(C)C)C2)c(Cl)cc1[N+](=O)[O-] ZINC000596096601 1034081208 /nfs/dbraw/zinc/08/12/08/1034081208.db2.gz VGJMZCBBMKZPOT-LBPRGKRZSA-N 1 0 341.839 3.789 20 5 EHBDRO C[C@@H]([NH2+]CCCN1CCc2ccccc21)c1ccc([N+](=O)[O-])cc1 ZINC000325102145 1034153714 /nfs/dbraw/zinc/15/37/14/1034153714.db2.gz TVWBGKBJUPWSII-OAHLLOKOSA-N 1 0 325.412 3.698 20 5 EHBDRO Cc1cc(NCC2CC[NH+](Cc3ccncc3)CC2)ccc1[N+](=O)[O-] ZINC000596443509 1034246613 /nfs/dbraw/zinc/24/66/13/1034246613.db2.gz YPMFSTJPBVGRIP-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1cc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c(C)s1 ZINC000179375745 1034258317 /nfs/dbraw/zinc/25/83/17/1034258317.db2.gz IIRXERFSJJUMLV-RYUDHWBXSA-N 1 0 347.440 3.951 20 5 EHBDRO Cc1ccc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)cc1[N+](=O)[O-] ZINC000456260286 1034258708 /nfs/dbraw/zinc/25/87/08/1034258708.db2.gz HUVPBMVQFARSCG-KRWDZBQOSA-N 1 0 339.395 3.704 20 5 EHBDRO Cc1cc(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)cc([N+](=O)[O-])c1 ZINC000456267182 1034267222 /nfs/dbraw/zinc/26/72/22/1034267222.db2.gz ILCACTDGBZHSNW-SFHVURJKSA-N 1 0 339.395 3.704 20 5 EHBDRO C[C@H](N[C@@H]1C[NH2+]CC[C@@H]1c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000596649328 1034347214 /nfs/dbraw/zinc/34/72/14/1034347214.db2.gz IIFIZMIVDQJSRE-MJXNMMHHSA-N 1 0 343.402 3.530 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000604435389 1034377737 /nfs/dbraw/zinc/37/77/37/1034377737.db2.gz UQABKOFDHMNJKZ-GOSISDBHSA-N 1 0 345.443 3.886 20 5 EHBDRO COCC1(C2CCC2)C[NH+](C/C(C)=C/c2cccc([N+](=O)[O-])c2)C1 ZINC000597195507 1034579970 /nfs/dbraw/zinc/57/99/70/1034579970.db2.gz JLGOTOMXYXMYAQ-OQLLNIDSSA-N 1 0 330.428 3.747 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC[C@H]1C ZINC000480622394 1034658180 /nfs/dbraw/zinc/65/81/80/1034658180.db2.gz XYWCUHSQXJTGRH-GPMSIDNRSA-N 1 0 345.487 3.768 20 5 EHBDRO CCc1nnc(C[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])s1 ZINC000290146949 1034753492 /nfs/dbraw/zinc/75/34/92/1034753492.db2.gz LAWHCQLDBXUCMU-OCCSQVGLSA-N 1 0 346.456 3.510 20 5 EHBDRO CCCO[C@@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000365191458 1034956224 /nfs/dbraw/zinc/95/62/24/1034956224.db2.gz SEDBGUAMKFEAHG-MRXNPFEDSA-N 1 0 336.432 3.775 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCCn2cccn2)c2ccccc2)c1 ZINC000180053460 1035301193 /nfs/dbraw/zinc/30/11/93/1035301193.db2.gz IPHHFAPVTKPNPV-LJQANCHMSA-N 1 0 336.395 3.561 20 5 EHBDRO Cc1ccc(CN(CC[NH+](C)C)Cc2ccccc2F)cc1[N+](=O)[O-] ZINC000580499060 1035436703 /nfs/dbraw/zinc/43/67/03/1035436703.db2.gz MBYUMWFFLDLSGI-UHFFFAOYSA-N 1 0 345.418 3.606 20 5 EHBDRO COC[C@@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000540617151 1035506405 /nfs/dbraw/zinc/50/64/05/1035506405.db2.gz BMQZDPYYMXNTSS-UKINESCASA-N 1 0 330.359 3.724 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000414102277 1035509109 /nfs/dbraw/zinc/50/91/09/1035509109.db2.gz XGTXPPDAUZMEML-ZIAGYGMSSA-N 1 0 329.400 3.589 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[NH2+][C@H]1CCCCC12CCCC2 ZINC000463450191 1035518277 /nfs/dbraw/zinc/51/82/77/1035518277.db2.gz RZFCBSNTLULSSC-KRWDZBQOSA-N 1 0 345.443 3.934 20 5 EHBDRO O=[N+]([O-])c1cccnc1NC[C@H]1CCCC[N@H+](Cc2ccccc2)C1 ZINC000386471256 1035661046 /nfs/dbraw/zinc/66/10/46/1035661046.db2.gz UUMXEUUIOZNXEC-QGZVFWFLSA-N 1 0 340.427 3.704 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](c1ccco1)N1CCCC1 ZINC000152276977 1036271799 /nfs/dbraw/zinc/27/17/99/1036271799.db2.gz JVJQZGIPLOGXEY-QAPCUYQASA-N 1 0 343.427 3.984 20 5 EHBDRO CC[C@@H](C)[N@H+](C)CCNC(=O)c1cc2ccccc2c2cccnc12 ZINC000589180875 1036294530 /nfs/dbraw/zinc/29/45/30/1036294530.db2.gz LEQUIGCXBBAOKR-OAHLLOKOSA-N 1 0 335.451 3.848 20 5 EHBDRO CC(C)Cc1ncc(C[N@H+](C)CCc2ccccc2[N+](=O)[O-])s1 ZINC000589183767 1036295352 /nfs/dbraw/zinc/29/53/52/1036295352.db2.gz MOLFOKHTBWOWTA-UHFFFAOYSA-N 1 0 333.457 3.924 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(Cl)cc1 ZINC000589284650 1036340848 /nfs/dbraw/zinc/34/08/48/1036340848.db2.gz NZQLJZIQCOKGDL-SJLPKXTDSA-N 1 0 345.830 3.783 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1C[C@H](C)O[C@@H]1C ZINC000414284054 1036436222 /nfs/dbraw/zinc/43/62/22/1036436222.db2.gz QAPSHSNUPNXBCV-LJISPDSOSA-N 1 0 338.473 3.869 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@@H](C(C)(C)C)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000541555018 1036447815 /nfs/dbraw/zinc/44/78/15/1036447815.db2.gz GULNGSZPEZWURU-MRXNPFEDSA-N 1 0 342.443 3.863 20 5 EHBDRO C[C@@H]([NH2+]CC(=O)N(C)c1ccc([N+](=O)[O-])cc1)[C@H](C)C1CCCCC1 ZINC000541601539 1036482648 /nfs/dbraw/zinc/48/26/48/1036482648.db2.gz GXIXZHYCGXMERE-LSDHHAIUSA-N 1 0 347.459 3.752 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@@H]1C[C@@H](C)CC[C@@H]1C(C)C ZINC000541614934 1036501942 /nfs/dbraw/zinc/50/19/42/1036501942.db2.gz VYBCEWCALQCCKE-NUEKZKHPSA-N 1 0 347.459 3.892 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCC[C@H]2c2ccc(F)cc2)c1 ZINC000269687383 1036728461 /nfs/dbraw/zinc/72/84/61/1036728461.db2.gz TVZMAYBXGOUAOA-ROUUACIJSA-N 1 0 330.359 3.604 20 5 EHBDRO CC(C)(C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1cccnc1 ZINC000414336228 1036735854 /nfs/dbraw/zinc/73/58/54/1036735854.db2.gz OYDXZFKCSHNQJA-GOSISDBHSA-N 1 0 339.439 3.878 20 5 EHBDRO COC(=O)c1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000892622068 1036738106 /nfs/dbraw/zinc/73/81/06/1036738106.db2.gz NMLYBOHFZMHVTA-CYBMUJFWSA-N 1 0 328.368 3.541 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@@H]2CCCO[C@@H]21 ZINC000539507463 1036826779 /nfs/dbraw/zinc/82/67/79/1036826779.db2.gz CLVCBCBZOWLMCV-KSZLIROESA-N 1 0 332.444 3.711 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2c[nH]c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000237768860 1036911301 /nfs/dbraw/zinc/91/13/01/1036911301.db2.gz GZHQESZMURFDHQ-UHFFFAOYSA-N 1 0 327.359 3.856 20 5 EHBDRO COc1cc(NC[C@H](c2ccsc2)[NH+](C)C)c([N+](=O)[O-])cc1C ZINC000590571463 1036953850 /nfs/dbraw/zinc/95/38/50/1036953850.db2.gz PCESMCYDMACKIB-OAHLLOKOSA-N 1 0 335.429 3.688 20 5 EHBDRO C[C@H]([NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[C@H]1CCC[C@@H](C)C1 ZINC000452066900 1036973693 /nfs/dbraw/zinc/97/36/93/1036973693.db2.gz LTMLYUNZGAWWTE-IPYPFGDCSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[NH+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519673 1037099025 /nfs/dbraw/zinc/09/90/25/1037099025.db2.gz DCCJNQQFGNSJIF-CHWSQXEVSA-N 1 0 325.840 3.601 20 5 EHBDRO C[C@H]1CCC[C@H](C)[NH+]1CCNCc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761519674 1037099042 /nfs/dbraw/zinc/09/90/42/1037099042.db2.gz DCCJNQQFGNSJIF-STQMWFEESA-N 1 0 325.840 3.601 20 5 EHBDRO CC[C@@H](CCO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738911 1037133554 /nfs/dbraw/zinc/13/35/54/1037133554.db2.gz MHZBLGFFSLEZNF-HNAYVOBHSA-N 1 0 328.412 3.682 20 5 EHBDRO CO[C@H](C)C[N@H+](C)Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000573018214 1037158669 /nfs/dbraw/zinc/15/86/69/1037158669.db2.gz DTOBMFDDQWCNMZ-CYBMUJFWSA-N 1 0 348.374 3.993 20 5 EHBDRO C[N@H+](Cc1ccccc1)C1(CNc2ncc([N+](=O)[O-])s2)CCC1 ZINC000386726872 1037228768 /nfs/dbraw/zinc/22/87/68/1037228768.db2.gz AJEXWPNJZQNPOM-UHFFFAOYSA-N 1 0 332.429 3.518 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1ccc(F)cc1)N(C)C ZINC000532449031 1037301259 /nfs/dbraw/zinc/30/12/59/1037301259.db2.gz RKAVVSDRKJIKFX-LIRRHRJNSA-N 1 0 345.418 3.996 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)Oc1ccc(C)cc1 ZINC000462733792 1037335611 /nfs/dbraw/zinc/33/56/11/1037335611.db2.gz KLNYEVJAVQIMNF-HNNXBMFYSA-N 1 0 344.411 3.859 20 5 EHBDRO C[C@@H]1C[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C[N@@H+]1C1CC1 ZINC000177185147 1037408968 /nfs/dbraw/zinc/40/89/68/1037408968.db2.gz CRTWYUFDTRZXTO-GDBMZVCRSA-N 1 0 345.446 3.743 20 5 EHBDRO CCOc1cc(NC[C@@H]2CCC[N@H+](CC(C)C)C2)ccc1[N+](=O)[O-] ZINC000540023646 1037483178 /nfs/dbraw/zinc/48/31/78/1037483178.db2.gz BWCZIYFCTNBUJJ-HNNXBMFYSA-N 1 0 335.448 3.773 20 5 EHBDRO COCC(C)(C)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000491482504 1037516600 /nfs/dbraw/zinc/51/66/00/1037516600.db2.gz BJECKKCKGMDZJL-UHFFFAOYSA-N 1 0 348.399 3.626 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCOC1 ZINC000540067923 1037517378 /nfs/dbraw/zinc/51/73/78/1037517378.db2.gz FYFILFDSMWERIZ-QGZVFWFLSA-N 1 0 332.425 3.982 20 5 EHBDRO CC1(C)C[C@@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582564 1037517757 /nfs/dbraw/zinc/51/77/57/1037517757.db2.gz LPNOQXBNVUQZRM-CXAGYDPISA-N 1 0 329.444 3.582 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)NCc1nccn1CC(F)(F)F ZINC000532497840 1037541704 /nfs/dbraw/zinc/54/17/04/1037541704.db2.gz SWZIZPPYSCZTIS-LLVKDONJSA-N 1 0 342.321 3.513 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](CC1CC1)C1CCCCC1 ZINC000532546349 1037577193 /nfs/dbraw/zinc/57/71/93/1037577193.db2.gz HVTLLDKVNGUWRY-UHFFFAOYSA-N 1 0 345.443 3.886 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCO[C@@H]1C1CC1 ZINC000540151698 1037622132 /nfs/dbraw/zinc/62/21/32/1037622132.db2.gz STQMMJBKVPULMZ-JKIFEVAISA-N 1 0 336.457 3.623 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cc2c(s1)CCC2 ZINC000540169146 1037636192 /nfs/dbraw/zinc/63/61/92/1037636192.db2.gz QOGKBRWYXRHKNG-LBPRGKRZSA-N 1 0 332.425 3.875 20 5 EHBDRO C[C@H](C(=O)OCc1cc([N+](=O)[O-])ccc1Cl)[N@H+]1[C@H](C)CC[C@@H]1C ZINC000741021670 1037690038 /nfs/dbraw/zinc/69/00/38/1037690038.db2.gz FOXUNYQISOMGJG-GRYCIOLGSA-N 1 0 340.807 3.553 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CC1=CCCC1)[C@H]1CC[C@H](O)CC1 ZINC000592132495 1037842415 /nfs/dbraw/zinc/84/24/15/1037842415.db2.gz HJXMKKLGNDAFIE-IYARVYRRSA-N 1 0 330.428 3.811 20 5 EHBDRO C[C@@H](C[NH2+]C1CCN(c2ccccc2)CC1)c1ccccc1[N+](=O)[O-] ZINC000897465734 1037875252 /nfs/dbraw/zinc/87/52/52/1037875252.db2.gz HKVWYUZZSSWIGZ-INIZCTEOSA-N 1 0 339.439 3.957 20 5 EHBDRO C[C@@H](C[NH2+]Cc1cn(C)nc1C(C)(C)C)c1ccccc1[N+](=O)[O-] ZINC000897466134 1037876942 /nfs/dbraw/zinc/87/69/42/1037876942.db2.gz ORYRSEPUMKLQSD-ZDUSSCGKSA-N 1 0 330.432 3.519 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000463200468 1037887215 /nfs/dbraw/zinc/88/72/15/1037887215.db2.gz UEYNQBMGLSOFOT-KURKYZTESA-N 1 0 348.443 3.509 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCC[C@H](O)[C@H]2CCc2ccccc2)cs1 ZINC000592165653 1037910832 /nfs/dbraw/zinc/91/08/32/1037910832.db2.gz DIOPGRXXXQOAPK-SJORKVTESA-N 1 0 346.452 3.614 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1NCc1ccc(C[NH+]2CCCC2)cc1 ZINC000341364199 1038010426 /nfs/dbraw/zinc/01/04/26/1038010426.db2.gz IANVCCFUVZMEHD-UHFFFAOYSA-N 1 0 329.375 3.942 20 5 EHBDRO C[NH+](C)C1(CNc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCCC1 ZINC000321731895 1038444284 /nfs/dbraw/zinc/44/42/84/1038444284.db2.gz SXVHZCOXAFNECR-UHFFFAOYSA-N 1 0 331.338 3.900 20 5 EHBDRO C[N@H+](CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1)CC1CCCC1 ZINC000104679485 1038451457 /nfs/dbraw/zinc/45/14/57/1038451457.db2.gz OWAAUOSJGPRIRQ-UHFFFAOYSA-N 1 0 329.400 3.914 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCC[C@@H]1C[NH+]1CCCCC1 ZINC000470182589 1038594511 /nfs/dbraw/zinc/59/45/11/1038594511.db2.gz MCHSOQOWCWYXRD-XMJIKXADSA-N 1 0 343.471 3.948 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCOc1ncccc1Cl ZINC000539059970 1038659729 /nfs/dbraw/zinc/65/97/29/1038659729.db2.gz FNZAJBJVXHJERB-GFCCVEGCSA-N 1 0 335.791 3.681 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1 ZINC000539188663 1038730039 /nfs/dbraw/zinc/73/00/39/1038730039.db2.gz PTVLIWUTIAARHR-MRXNPFEDSA-N 1 0 347.459 3.552 20 5 EHBDRO CCC[C@@](C)(CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000236944206 1038758154 /nfs/dbraw/zinc/75/81/54/1038758154.db2.gz QTIURTXMWMEUSJ-KRWDZBQOSA-N 1 0 334.441 3.964 20 5 EHBDRO Cc1ccc([C@H](C)NC(=O)[C@H](C(C)C)[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000488052309 1038809019 /nfs/dbraw/zinc/80/90/19/1038809019.db2.gz CAAVDNCDDZIRIV-YJBOKZPZSA-N 1 0 347.459 3.591 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2CCC[C@H]2OC(F)F)cc1[N+](=O)[O-] ZINC000500503540 1038862073 /nfs/dbraw/zinc/86/20/73/1038862073.db2.gz OLKQLIXVSQPTHG-UKRRQHHQSA-N 1 0 328.359 3.968 20 5 EHBDRO Cc1cc(F)ccc1C[N@H+](C)CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000488108436 1038865285 /nfs/dbraw/zinc/86/52/85/1038865285.db2.gz NZTLIEKCQQTJKX-UHFFFAOYSA-N 1 0 345.374 3.503 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@@H]([NH+]3CCCC3)CC2)c(Cl)c1 ZINC000182183978 1038895490 /nfs/dbraw/zinc/89/54/90/1038895490.db2.gz RIGOPVHNZKNKAV-OAHLLOKOSA-N 1 0 337.851 3.699 20 5 EHBDRO CCCC[N@H+](C)CCNc1ccc(Br)cc1[N+](=O)[O-] ZINC000488255385 1039010174 /nfs/dbraw/zinc/01/01/74/1039010174.db2.gz MYROCAAKOIHBOZ-UHFFFAOYSA-N 1 0 330.226 3.501 20 5 EHBDRO Cc1cccc([C@@H]2CCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)c1C ZINC000478013178 1039117782 /nfs/dbraw/zinc/11/77/82/1039117782.db2.gz CQQMWCSMMFDLDZ-KRWDZBQOSA-N 1 0 328.416 3.635 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1F)[C@@H]1Oc2ccccc2[C@@H]1C ZINC000478209354 1039290452 /nfs/dbraw/zinc/29/04/52/1039290452.db2.gz QJXRUOQAJHUSFM-OAVHHTNSSA-N 1 0 330.359 3.777 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2ccsc2)N(C)C)cccc1[N+](=O)[O-] ZINC000480229737 1039313656 /nfs/dbraw/zinc/31/36/56/1039313656.db2.gz LZASLLIUCBINTP-CXAGYDPISA-N 1 0 333.457 3.918 20 5 EHBDRO CN(CC[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000480218878 1039317290 /nfs/dbraw/zinc/31/72/90/1039317290.db2.gz DOMNIDCKFATASK-IBGZPJMESA-N 1 0 339.439 3.642 20 5 EHBDRO COC[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000488766995 1039389021 /nfs/dbraw/zinc/38/90/21/1039389021.db2.gz OSFXFVNUOPSJIN-QGZVFWFLSA-N 1 0 334.803 3.768 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)cc1 ZINC000488979846 1039534559 /nfs/dbraw/zinc/53/45/59/1039534559.db2.gz LDILDIHXWXWNQX-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H]1c3ccccc3C[C@@H]1O)CCCC2 ZINC000417309704 1039660781 /nfs/dbraw/zinc/66/07/81/1039660781.db2.gz FIHKFSANGVRIQR-SLFFLAALSA-N 1 0 338.407 3.610 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H](NC1CC[NH+](CC3CC3)CC1)CCCC2 ZINC000417323084 1039680215 /nfs/dbraw/zinc/68/02/15/1039680215.db2.gz NXGJLNSJBJVNBL-FQEVSTJZSA-N 1 0 343.471 3.826 20 5 EHBDRO CCOC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C(C)C ZINC000549708988 1039716173 /nfs/dbraw/zinc/71/61/73/1039716173.db2.gz MGBKZLVAMZRJEB-CQSZACIVSA-N 1 0 334.338 3.764 20 5 EHBDRO O=[N+]([O-])c1cc(CN(Cc2cccs2)C2CC2)c2c(c1)COCO2 ZINC000027107734 1039897921 /nfs/dbraw/zinc/89/79/21/1039897921.db2.gz VMTGQRQTYLUNLM-UHFFFAOYSA-N 1 0 346.408 3.687 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000192827517 1039913954 /nfs/dbraw/zinc/91/39/54/1039913954.db2.gz PSZPQTGZAHGQFE-ORAYPTAESA-N 1 0 326.396 3.899 20 5 EHBDRO COc1cccc2c1CC[N@@H+]([C@@H](C)c1ccccc1[N+](=O)[O-])CC2 ZINC000489603313 1040100498 /nfs/dbraw/zinc/10/04/98/1040100498.db2.gz HQFRXIFJCQQZDA-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCn1ccc2cc(Cl)ccc21 ZINC000512575220 1040178049 /nfs/dbraw/zinc/17/80/49/1040178049.db2.gz WMIXXDSOVJEDMI-UHFFFAOYSA-N 1 0 329.787 3.993 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(Nc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000432925143 1040189455 /nfs/dbraw/zinc/18/94/55/1040189455.db2.gz BAQPPHJKHLTHGN-MRXNPFEDSA-N 1 0 331.347 3.863 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccccc1[N+](=O)[O-])Oc1cc(F)cc(F)c1 ZINC000512580199 1040190075 /nfs/dbraw/zinc/19/00/75/1040190075.db2.gz ABLTYUDJMSNKHH-UHFFFAOYSA-N 1 0 336.338 3.820 20 5 EHBDRO COc1cccc(C2CC[NH+](Cc3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000512589799 1040216871 /nfs/dbraw/zinc/21/68/71/1040216871.db2.gz BUJRJHKYKWVGTK-UHFFFAOYSA-N 1 0 326.396 3.983 20 5 EHBDRO CC(C)(C)Oc1ccc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])cn1 ZINC000486566415 1040252385 /nfs/dbraw/zinc/25/23/85/1040252385.db2.gz NTDGWSOYQMPOFA-SOFGYWHQSA-N 1 0 341.411 3.970 20 5 EHBDRO C[C@H](C[N+](C)(C)C)OCCCCCCCNC(=O)OC(C)(C)C ZINC001224782469 1040337859 /nfs/dbraw/zinc/33/78/59/1040337859.db2.gz FYMRASOERSMLAZ-MRXNPFEDSA-O 1 0 331.521 3.573 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nc(C[NH2+][C@@H]3CC4CCC3CC4)co2)cc1 ZINC000432987653 1040375419 /nfs/dbraw/zinc/37/54/19/1040375419.db2.gz FAXVMIBURIITIT-QWQCLYJRSA-N 1 0 327.384 3.918 20 5 EHBDRO C[C@@H](CCc1ccco1)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000500060911 1040406974 /nfs/dbraw/zinc/40/69/74/1040406974.db2.gz FCHUXLKDFNTTHJ-KBPBESRZSA-N 1 0 345.399 3.516 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CCC([NH+]2CCC2)CC1 ZINC000912880933 1040417174 /nfs/dbraw/zinc/41/71/74/1040417174.db2.gz JOABACXMIKBPPO-UHFFFAOYSA-N 1 0 345.446 3.698 20 5 EHBDRO C[NH+](C)Cc1cccc(CNCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000893329596 1040440906 /nfs/dbraw/zinc/44/09/06/1040440906.db2.gz FLIRTVFJNRJNMQ-UHFFFAOYSA-N 1 0 333.819 3.600 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(C(C)(C)O)cc1 ZINC000925642118 1040451745 /nfs/dbraw/zinc/45/17/45/1040451745.db2.gz QCUVOTASOIMVLT-AWEZNQCLSA-N 1 0 328.412 3.716 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481207353 1040490953 /nfs/dbraw/zinc/49/09/53/1040490953.db2.gz QDFFRUNFHANJFK-YPMHNXCESA-N 1 0 339.823 3.745 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@@H]3C[C@H]4OCCC[C@H]34)o2)cc1 ZINC000190350982 1040500477 /nfs/dbraw/zinc/50/04/77/1040500477.db2.gz OIRLCRDVXGEPKW-JFIYKMOQSA-N 1 0 328.368 3.512 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cnn(-c2ccccc2)c1 ZINC000129490275 1040504367 /nfs/dbraw/zinc/50/43/67/1040504367.db2.gz QELODEGQEBLWNJ-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@@H]([NH2+]CC1(CO)CC(c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000433066782 1040622649 /nfs/dbraw/zinc/62/26/49/1040622649.db2.gz KVVDEGGNNBVEOB-MYWSLZCHSA-N 1 0 340.423 3.802 20 5 EHBDRO CO[C@H](CC[NH2+][C@@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C(F)(F)F ZINC000433075775 1040637417 /nfs/dbraw/zinc/63/74/17/1040637417.db2.gz LGUYIHQBZIQUMA-ZIAGYGMSSA-N 1 0 346.349 3.874 20 5 EHBDRO CC[C@H]1C[C@H](C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487163788 1040746272 /nfs/dbraw/zinc/74/62/72/1040746272.db2.gz SPOZOAQKHOEQDO-ABAIWWIYSA-N 1 0 346.349 3.908 20 5 EHBDRO CC[C@@H]1[C@H](C)CC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000481371483 1040791130 /nfs/dbraw/zinc/79/11/30/1040791130.db2.gz MXYURLXIVJSOIU-ZYHUDNBSSA-N 1 0 344.358 3.825 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1cc2cccnc2c([N+](=O)[O-])c1 ZINC001167752318 1040832059 /nfs/dbraw/zinc/83/20/59/1040832059.db2.gz DYDKKCOKJGHGPT-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO COC(=O)[C@H](C)C[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509797030 1040836111 /nfs/dbraw/zinc/83/61/11/1040836111.db2.gz AWQSZADUVQETRQ-GFCCVEGCSA-N 1 0 348.424 3.564 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+]Cc1scnc1C1CC1 ZINC000487550040 1040953246 /nfs/dbraw/zinc/95/32/46/1040953246.db2.gz PMTXUACVDXCHAB-UHFFFAOYSA-N 1 0 337.832 3.914 20 5 EHBDRO Cc1cccn2cc(CC[NH2+][C@@H](C)c3cc([N+](=O)[O-])ccc3C)nc12 ZINC000156319404 1040978005 /nfs/dbraw/zinc/97/80/05/1040978005.db2.gz WLUXFILLSQVQAV-HNNXBMFYSA-N 1 0 338.411 3.753 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2ccc([S@](C)=O)cc2)cc1[N+](=O)[O-] ZINC000080344670 1040980064 /nfs/dbraw/zinc/98/00/64/1040980064.db2.gz APGRTSZCNIKMDQ-XMMPIXPASA-N 1 0 346.452 3.745 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCc3ccc([N+](=O)[O-])cc3F)cccc21 ZINC000433203878 1041059240 /nfs/dbraw/zinc/05/92/40/1041059240.db2.gz DEFMNVJFTSMFQZ-QGZVFWFLSA-N 1 0 345.374 3.731 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H]2CCOC(C)(C)C2)cc1[N+](=O)[O-] ZINC000453431311 1041101745 /nfs/dbraw/zinc/10/17/45/1041101745.db2.gz RKMSSNWIIALXGQ-KGLIPLIRSA-N 1 0 336.432 3.849 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@@]3(C2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000481699341 1041265093 /nfs/dbraw/zinc/26/50/93/1041265093.db2.gz VHYOQSVHSWWMPK-FQEVSTJZSA-N 1 0 338.407 3.925 20 5 EHBDRO C[C@@H]1C[C@@H]2CCCC[C@H]2[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000247201364 1041582540 /nfs/dbraw/zinc/58/25/40/1041582540.db2.gz CBFNYVDKCTXXDZ-IIYDPXPESA-N 1 0 332.400 3.614 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[N@H+](C)CCCNC(=O)OC(C)(C)C ZINC000125250715 1041926557 /nfs/dbraw/zinc/92/65/57/1041926557.db2.gz SDXROIZQEORKOM-ZDUSSCGKSA-N 1 0 337.420 3.502 20 5 EHBDRO COc1cccc(C[NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)c1 ZINC000278844339 1042079318 /nfs/dbraw/zinc/07/93/18/1042079318.db2.gz WIBKSOHVYRIVQC-UHFFFAOYSA-N 1 0 340.301 3.912 20 5 EHBDRO CC[C@@H](C)[C@](C)(O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000236871573 1042111706 /nfs/dbraw/zinc/11/17/06/1042111706.db2.gz ADDYDFXLJNZHMY-FZKQIMNGSA-N 1 0 332.400 3.742 20 5 EHBDRO COC(=O)C(C)(C)[C@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000093283788 1042134541 /nfs/dbraw/zinc/13/45/41/1042134541.db2.gz IQTARADSKNIRTJ-ZFWWWQNUSA-N 1 0 334.416 3.567 20 5 EHBDRO CC(C)(C)[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000054396901 1042475787 /nfs/dbraw/zinc/47/57/87/1042475787.db2.gz PTZOHVLZOMVLQY-GOSISDBHSA-N 1 0 341.411 3.910 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccco1 ZINC000236888427 1042524317 /nfs/dbraw/zinc/52/43/17/1042524317.db2.gz BYGGQXXMFWMQOL-RUJXFNLJSA-N 1 0 343.427 3.874 20 5 EHBDRO C[N@H+](CCCc1ccc2c(c1)CCO2)Cc1ccccc1[N+](=O)[O-] ZINC000482074468 1042913230 /nfs/dbraw/zinc/91/32/30/1042913230.db2.gz AOCUQQUFJLHNNZ-UHFFFAOYSA-N 1 0 326.396 3.594 20 5 EHBDRO CCC[C@H]([NH2+]CCCN1CCCO[C@@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421087 1043157953 /nfs/dbraw/zinc/15/79/53/1043157953.db2.gz FSRYGANXJJIWEW-LPHOPBHVSA-N 1 0 349.475 3.527 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CCCOc2ccc(F)cc21 ZINC000344093954 1043242218 /nfs/dbraw/zinc/24/22/18/1043242218.db2.gz QDEQARQUIXQFMT-MRXNPFEDSA-N 1 0 330.359 3.780 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@@H]2CCCc3cn[nH]c32)c2cc([N+](=O)[O-])ccc21 ZINC000279118023 1043380737 /nfs/dbraw/zinc/38/07/37/1043380737.db2.gz PVMVCVNBTGCICP-HZPDHXFCSA-N 1 0 326.400 3.708 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CC[C@@H]3CCC[C@@H]3C2)c([N+](=O)[O-])cc1OC ZINC000344342314 1043690987 /nfs/dbraw/zinc/69/09/87/1043690987.db2.gz CWRAQAABAOESNC-GZBFAFLISA-N 1 0 334.416 3.670 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@H](C)[C@@H](C)c1ccccc1 ZINC000183356177 1125537646 /nfs/dbraw/zinc/53/76/46/1125537646.db2.gz KSXGAWXYRACGGD-HUUCEWRRSA-N 1 0 341.411 3.624 20 5 EHBDRO Cc1nn(C)c(C)c1CCC[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000183491148 1125575112 /nfs/dbraw/zinc/57/51/12/1125575112.db2.gz LBXRRRCEOOPOQG-ZDUSSCGKSA-N 1 0 330.432 3.537 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NCCC[N@H+](C)Cc2ccccc2)c1 ZINC000301321445 1127737241 /nfs/dbraw/zinc/73/72/41/1127737241.db2.gz DEFFAYARKYQYED-UHFFFAOYSA-N 1 0 329.400 3.537 20 5 EHBDRO CCC[N@@H+]1CCC[C@H]1CN[C@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336579 1127750116 /nfs/dbraw/zinc/75/01/16/1127750116.db2.gz FYIQYYADWXGVFM-ZBFHGGJFSA-N 1 0 335.448 3.519 20 5 EHBDRO Cc1ccc([C@@H](CNc2cc(C)c([N+](=O)[O-])cn2)[NH+]2CCCC2)cc1 ZINC000301427794 1127765682 /nfs/dbraw/zinc/76/56/82/1127765682.db2.gz IJUKQZNCJQPQMM-GOSISDBHSA-N 1 0 340.427 3.856 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)C1CCCC1)c1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000172171392 1127798656 /nfs/dbraw/zinc/79/86/56/1127798656.db2.gz UHIUAKVAROPBOS-NWDGAFQWSA-N 1 0 330.388 3.874 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@H](Nc2ccc([N+](=O)[O-])cc2Br)C1 ZINC000301567434 1128497586 /nfs/dbraw/zinc/49/75/86/1128497586.db2.gz KBXQKMSBTKOTBV-QWRGUYRKSA-N 1 0 342.237 3.642 20 5 EHBDRO Cc1cnc(N[C@H]2CC[N@H+](Cc3ccccc3)[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000301564050 1128497976 /nfs/dbraw/zinc/49/79/76/1128497976.db2.gz VRNPDEUWRPYHDB-RDJZCZTQSA-N 1 0 340.427 3.763 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000542693634 1128542006 /nfs/dbraw/zinc/54/20/06/1128542006.db2.gz NNJULUQITNOYII-DAXSKMNVSA-N 1 0 337.423 3.958 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(Cc2cccnc2)CC1 ZINC000542693635 1128542095 /nfs/dbraw/zinc/54/20/95/1128542095.db2.gz NNJULUQITNOYII-QPJJXVBHSA-N 1 0 337.423 3.958 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](CO)c1ccccc1Cl ZINC000554067553 1128609806 /nfs/dbraw/zinc/60/98/06/1128609806.db2.gz PMRPVUISFWLFFT-ZIAGYGMSSA-N 1 0 348.830 3.983 20 5 EHBDRO CO[C@H](C)CC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000338704928 1128722809 /nfs/dbraw/zinc/72/28/09/1128722809.db2.gz CDDJHCCIEYJDGM-OAHLLOKOSA-N 1 0 343.427 3.877 20 5 EHBDRO Cc1nc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000301647358 1128822744 /nfs/dbraw/zinc/82/27/44/1128822744.db2.gz IHUVHKJOSYHKSK-WMLDXEAASA-N 1 0 340.427 3.621 20 5 EHBDRO COC(=O)C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])C1CCCCC1 ZINC000542533839 1120932788 /nfs/dbraw/zinc/93/27/88/1120932788.db2.gz XSIKUJSWJATBAR-BBRMVZONSA-N 1 0 334.416 3.757 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+][C@@H]1CC[C@@H]2SCCS[C@H]12 ZINC000762616344 1121383751 /nfs/dbraw/zinc/38/37/51/1121383751.db2.gz SAARJDZHKLXKCW-HGSIOQJUSA-N 1 0 336.482 3.577 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@@H]2COCC[C@@H]2C1 ZINC000921976302 1128989079 /nfs/dbraw/zinc/98/90/79/1128989079.db2.gz NBAVAFAASXDRKM-IIAWOOMASA-N 1 0 338.835 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H]2/C=C/c2ccccc2)cc1 ZINC000780400261 1121575132 /nfs/dbraw/zinc/57/51/32/1121575132.db2.gz UQZPVQNKRTVKJO-FFQNAWCLSA-N 1 0 338.407 3.806 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1C)c1ccc(C)cc1 ZINC000194014255 1121752886 /nfs/dbraw/zinc/75/28/86/1121752886.db2.gz KIBOOLYXMFIDPW-QGZVFWFLSA-N 1 0 341.411 3.891 20 5 EHBDRO CCC[C@@H]([NH2+]CCc1cn2ccccc2n1)c1cccc([N+](=O)[O-])c1 ZINC000130627437 1121945257 /nfs/dbraw/zinc/94/52/57/1121945257.db2.gz BXOSDGZJEZZJLB-GOSISDBHSA-N 1 0 338.411 3.916 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2ccc(C)cc2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000301127081 1122046093 /nfs/dbraw/zinc/04/60/93/1122046093.db2.gz ZUJKSNFTJRQQAG-LJQANCHMSA-N 1 0 341.411 3.821 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCOC2CCCC2)cc1[N+](=O)[O-] ZINC000153400809 1122079866 /nfs/dbraw/zinc/07/98/66/1122079866.db2.gz JAINYPQWSUYVGE-AWEZNQCLSA-N 1 0 336.432 3.993 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNC(=O)Nc1c(C)ccc([N+](=O)[O-])c1C ZINC000127881764 1122513212 /nfs/dbraw/zinc/51/32/12/1122513212.db2.gz IFYAMQOEUQGVSF-HNNXBMFYSA-N 1 0 348.447 3.598 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@H]2C2CCCCC2)c1 ZINC000917477206 1122612784 /nfs/dbraw/zinc/61/27/84/1122612784.db2.gz FAPQXFLXJZBTPU-QGZVFWFLSA-N 1 0 328.416 3.947 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2c(C)cccc2[N+](=O)[O-])C1 ZINC000194676692 1122837865 /nfs/dbraw/zinc/83/78/65/1122837865.db2.gz RNEZYQLAUCUERC-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000556580065 1123043441 /nfs/dbraw/zinc/04/34/41/1123043441.db2.gz BXNQPONQFHNABI-JSNMRZPZSA-N 1 0 340.423 3.928 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])c1ccccc1 ZINC000007783593 1123353432 /nfs/dbraw/zinc/35/34/32/1123353432.db2.gz YYPFYSMFWSFMNZ-NSHDSACASA-N 1 0 333.775 3.538 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000301813940 1129117982 /nfs/dbraw/zinc/11/79/82/1129117982.db2.gz FYRQELMIOCZRCF-NSHDSACASA-N 1 0 331.338 3.757 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CCc3ccccc3)CC2)c(F)c1 ZINC000195566206 1123591495 /nfs/dbraw/zinc/59/14/95/1123591495.db2.gz BCICOGUXKWMSNO-UHFFFAOYSA-N 1 0 343.402 3.853 20 5 EHBDRO CCC[C@](C)(O)C[NH2+]Cc1ccc(-c2ccc(OC)cc2[N+](=O)[O-])o1 ZINC000609571597 1123610967 /nfs/dbraw/zinc/61/09/67/1123610967.db2.gz URRCIBQSEWSZKQ-SFHVURJKSA-N 1 0 348.399 3.504 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\CN1CCC[C@H]1C[NH+]1CCCCC1 ZINC000255566044 1129140712 /nfs/dbraw/zinc/14/07/12/1129140712.db2.gz LKZCXIBCKYFRAV-KKMIYCERSA-N 1 0 329.444 3.558 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CC1(c2cccc(F)c2)CC1 ZINC000610089146 1123729064 /nfs/dbraw/zinc/72/90/64/1123729064.db2.gz DCQGNMNTJQCTPL-UHFFFAOYSA-N 1 0 344.386 3.954 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C[C@@H]1C ZINC000610133756 1123739139 /nfs/dbraw/zinc/73/91/39/1123739139.db2.gz SUFGRGRJXAHMFI-WCQYABFASA-N 1 0 345.365 3.923 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C[N@@H+]1C1CC1 ZINC000301820948 1129147939 /nfs/dbraw/zinc/14/79/39/1129147939.db2.gz JRTZWJMBDCHHID-GXSJLCMTSA-N 1 0 329.322 3.651 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC(C)(C)[C@@H](O)C(C)C)cc1[N+](=O)[O-] ZINC000090810271 1123790714 /nfs/dbraw/zinc/79/07/14/1123790714.db2.gz ZEKQJEUXODOYLG-GUYCJALGSA-N 1 0 338.448 3.687 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@@H](OC(F)F)C1 ZINC000615837609 1123884776 /nfs/dbraw/zinc/88/47/76/1123884776.db2.gz LAPDJOXDGHTNGX-LDCOFTPGSA-N 1 0 326.343 3.702 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccnn1C ZINC000618577756 1125114816 /nfs/dbraw/zinc/11/48/16/1125114816.db2.gz NWIFNOUWGVYOEQ-MSOLQXFVSA-N 1 0 342.443 3.735 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCC3)c2cc([N+](=O)[O-])ccc21 ZINC000618988420 1125263027 /nfs/dbraw/zinc/26/30/27/1125263027.db2.gz KJKBGWLUVALANL-BVPBIZIASA-N 1 0 342.439 3.864 20 5 EHBDRO CC(C)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])c(-c3ccccc3)n2)C1 ZINC000301861150 1129229327 /nfs/dbraw/zinc/22/93/27/1129229327.db2.gz KVYVAYVJWSTQGX-HNNXBMFYSA-N 1 0 326.400 3.551 20 5 EHBDRO COc1cc(C[NH2+]C(C)(C)c2ccc([N+](=O)[O-])cc2)cc(OC)c1 ZINC000080347354 1129347937 /nfs/dbraw/zinc/34/79/37/1129347937.db2.gz JTEOAMMCTDHKKM-UHFFFAOYSA-N 1 0 330.384 3.637 20 5 EHBDRO CC(C)c1nc2c(n1C)CCN(Cc1ccc(Cl)cc1[N+](=O)[O-])C2 ZINC000116278915 1129348904 /nfs/dbraw/zinc/34/89/04/1129348904.db2.gz JEICFZCAUXWQKN-UHFFFAOYSA-N 1 0 348.834 3.663 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO[C@H]1C1CC1 ZINC000543242502 1129366584 /nfs/dbraw/zinc/36/65/84/1129366584.db2.gz QWYHRVXJECBNQF-RBUKOAKNSA-N 1 0 342.395 3.902 20 5 EHBDRO CC(C)(C)[C@@H]1CC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000543247690 1129371502 /nfs/dbraw/zinc/37/15/02/1129371502.db2.gz VPOOKZFNUWFWFB-CYBMUJFWSA-N 1 0 330.388 3.513 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(Nc2ccc(CC[NH+](C)C)cc2)c1 ZINC000301950012 1129401629 /nfs/dbraw/zinc/40/16/29/1129401629.db2.gz GCNKEVSORDODPM-UHFFFAOYSA-N 1 0 333.363 3.590 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(Cc2cc([N+](=O)[O-])ccc2OC(C)C)C1 ZINC000081584597 1129429950 /nfs/dbraw/zinc/42/99/50/1129429950.db2.gz QDKHKBRRLPWTCN-INIZCTEOSA-N 1 0 349.475 3.546 20 5 EHBDRO CN(C)CC1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CCC1 ZINC000466424687 1129441337 /nfs/dbraw/zinc/44/13/37/1129441337.db2.gz WXFJYGMOWKYMPY-UHFFFAOYSA-N 1 0 345.468 3.897 20 5 EHBDRO CCOCCC[NH2+][C@H](c1ccc(CC)o1)c1ccc([N+](=O)[O-])cc1 ZINC000543405240 1129465426 /nfs/dbraw/zinc/46/54/26/1129465426.db2.gz UHVLAABGZZHYDW-SFHVURJKSA-N 1 0 332.400 3.856 20 5 EHBDRO CCC[NH+]1CCC(Nc2cc(C)nc3c2cccc3[N+](=O)[O-])CC1 ZINC000301984266 1129470669 /nfs/dbraw/zinc/47/06/69/1129470669.db2.gz CCNBMDGRCCOZMS-UHFFFAOYSA-N 1 0 328.416 3.738 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H](c1ccc(F)cc1)C1CC1 ZINC000543427892 1129482541 /nfs/dbraw/zinc/48/25/41/1129482541.db2.gz GQSWGOGPFVHPIH-SFHVURJKSA-N 1 0 330.359 3.983 20 5 EHBDRO C[C@@H](O)C[C@@H]1CCCCC[N@@H+]1Cc1c(Cl)cccc1[N+](=O)[O-] ZINC000318383678 1129504309 /nfs/dbraw/zinc/50/43/09/1129504309.db2.gz CLSQHRJCGPYMRK-OLZOCXBDSA-N 1 0 326.824 3.764 20 5 EHBDRO COc1cc(CN2CCCCC2)c([N+](=O)[O-])cc1OCC(F)(F)F ZINC000092107127 1129533266 /nfs/dbraw/zinc/53/32/66/1129533266.db2.gz QNWHWDMAKUTDTP-UHFFFAOYSA-N 1 0 348.321 3.530 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCCNc2ccccn2)cc1[N+](=O)[O-] ZINC000154158370 1129535725 /nfs/dbraw/zinc/53/57/25/1129535725.db2.gz UMMDFEYUONECJT-AWEZNQCLSA-N 1 0 344.415 3.541 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1nccc2c1CCCC2 ZINC000922464510 1129542091 /nfs/dbraw/zinc/54/20/91/1129542091.db2.gz ZQCHGAQCHLHAGV-UHFFFAOYSA-N 1 0 325.412 3.775 20 5 EHBDRO Cn1cc(C[NH+](CC2CC2)CC2CC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000093480036 1129590430 /nfs/dbraw/zinc/59/04/30/1129590430.db2.gz MWODGLANVWLMIS-UHFFFAOYSA-N 1 0 340.427 3.617 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CN(Cc2ccccc2)C[C@@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000389865031 1129593013 /nfs/dbraw/zinc/59/30/13/1129593013.db2.gz KMRRIXCTNHMWSU-TWOQFEAHSA-N 1 0 339.439 3.766 20 5 EHBDRO C[C@@H](N[C@H](CO)c1cccc(Cl)c1F)c1ccc([N+](=O)[O-])cc1 ZINC000499955482 1129593427 /nfs/dbraw/zinc/59/34/27/1129593427.db2.gz YJLYJYGKEMUJSL-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO CSCC[C@H](C)[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000093558563 1129594283 /nfs/dbraw/zinc/59/42/83/1129594283.db2.gz NYOJIZGKLVMDLU-ZDUSSCGKSA-N 1 0 348.472 3.569 20 5 EHBDRO C[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)CC1CCOCC1 ZINC000466472438 1129595256 /nfs/dbraw/zinc/59/52/56/1129595256.db2.gz XSFIQVFEUONKMI-LBPRGKRZSA-N 1 0 326.824 3.791 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+](C3CC3)C2)c(C(F)(F)F)c1 ZINC000390049145 1129601956 /nfs/dbraw/zinc/60/19/56/1129601956.db2.gz FOUFXAYQYJZNRJ-SNVBAGLBSA-N 1 0 329.322 3.510 20 5 EHBDRO CC[C@H](O)CC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000124387208 1129602821 /nfs/dbraw/zinc/60/28/21/1129602821.db2.gz XGZBGKBCTJKAQM-HNNXBMFYSA-N 1 0 348.374 3.777 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](C)N(C)Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000390571412 1129624081 /nfs/dbraw/zinc/62/40/81/1129624081.db2.gz TZIJQQDDUYCUOL-JKSUJKDBSA-N 1 0 327.428 3.766 20 5 EHBDRO COC[C@H]([NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156533881 1129723043 /nfs/dbraw/zinc/72/30/43/1129723043.db2.gz YBPJBHAWOHZKHF-BBRMVZONSA-N 1 0 332.400 3.795 20 5 EHBDRO C[C@H](CCNc1ccc([N+](=O)[O-])c2cccnc12)[NH+]1CCCCC1 ZINC000302164313 1129771080 /nfs/dbraw/zinc/77/10/80/1129771080.db2.gz OMXDXIABFQJEDG-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1ccccc1Cl ZINC000056196897 1129805629 /nfs/dbraw/zinc/80/56/29/1129805629.db2.gz FJZVWWJBUHAAIJ-RYUDHWBXSA-N 1 0 347.802 3.926 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1F ZINC000056196534 1129805955 /nfs/dbraw/zinc/80/59/55/1129805955.db2.gz SFRHNZAVTFYKIL-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[NH+](C1CCC1)C1CCC1 ZINC000429118872 1129831562 /nfs/dbraw/zinc/83/15/62/1129831562.db2.gz YUBMJODMZIRLNF-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)c1ccc2c(c1)CCC2 ZINC001168741947 1129839466 /nfs/dbraw/zinc/83/94/66/1129839466.db2.gz VQHPSCJOVYTFCA-GFCCVEGCSA-N 1 0 336.395 3.811 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1CN1CCC[C@H](C[NH+]2CCCCCC2)C1 ZINC000509150391 1129856694 /nfs/dbraw/zinc/85/66/94/1129856694.db2.gz GULYXGOBSOWCAO-MRXNPFEDSA-N 1 0 349.450 3.822 20 5 EHBDRO C[NH+]1CCC(C)(CNc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC000227307398 1129901633 /nfs/dbraw/zinc/90/16/33/1129901633.db2.gz DEVIPBUYMFPCLZ-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@@H]2[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C ZINC000766046226 1129939843 /nfs/dbraw/zinc/93/98/43/1129939843.db2.gz WQGBMMOFDUYDOM-WBMJQRKESA-N 1 0 326.400 3.730 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1cccc(F)c1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000133557313 1129952366 /nfs/dbraw/zinc/95/23/66/1129952366.db2.gz PKKCKBBZCSEPPF-SCLBCKFNSA-N 1 0 331.391 3.687 20 5 EHBDRO Cc1c(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@H]2C)cccc1[N+](=O)[O-] ZINC000543542257 1129953416 /nfs/dbraw/zinc/95/34/16/1129953416.db2.gz ITJBVRWROMDGQW-PJIJBLCYSA-N 1 0 326.396 3.946 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](CCCO)Cc2cccc(Cl)c2)c1 ZINC000134292258 1129990014 /nfs/dbraw/zinc/99/00/14/1129990014.db2.gz GNUCQSDQOSGSDN-UHFFFAOYSA-N 1 0 334.803 3.633 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN(C(=O)OC(C)(C)C)[C@H]1C)c1ccc([N+](=O)[O-])cc1 ZINC000700734693 1130066406 /nfs/dbraw/zinc/06/64/06/1130066406.db2.gz RVHFNMFCPNEHPF-HEHGZKQESA-N 1 0 349.431 3.643 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CN(C)C(=O)OC(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000701880045 1130178136 /nfs/dbraw/zinc/17/81/36/1130178136.db2.gz UYPJRTDGDDNNFP-QWHCGFSZSA-N 1 0 337.420 3.501 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173334113 1130210530 /nfs/dbraw/zinc/21/05/30/1130210530.db2.gz OMRWSIXZNSGDNF-FZKQIMNGSA-N 1 0 331.391 3.687 20 5 EHBDRO C[C@@H]([NH2+]CC[C@H](C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173391806 1130222576 /nfs/dbraw/zinc/22/25/76/1130222576.db2.gz FWXDUYSMEDKGFX-QWHCGFSZSA-N 1 0 337.420 3.549 20 5 EHBDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)C1(C)C ZINC000766090459 1130256056 /nfs/dbraw/zinc/25/60/56/1130256056.db2.gz SZKPBENVBGJPGO-GJZGRUSLSA-N 1 0 326.824 3.930 20 5 EHBDRO Cc1nc(C(C)(C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)sc1C ZINC000173953846 1130325131 /nfs/dbraw/zinc/32/51/31/1130325131.db2.gz IKUAQCZXYOXNQO-UHFFFAOYSA-N 1 0 335.429 3.572 20 5 EHBDRO CC[C@H](C)[C@H](O)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000245976137 1130335852 /nfs/dbraw/zinc/33/58/52/1130335852.db2.gz OSXQVIVIVROWSG-GDIGMMSISA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCC[C@H](O)C3)s2)cc1 ZINC000174430089 1130358604 /nfs/dbraw/zinc/35/86/04/1130358604.db2.gz AVOQGTKDBNYRQY-BBRMVZONSA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CN1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000246462448 1130384980 /nfs/dbraw/zinc/38/49/80/1130384980.db2.gz FNOSIDDXGZQZIQ-GUYCJALGSA-N 1 0 349.862 3.697 20 5 EHBDRO O=[N+]([O-])c1ccc2nc(NCCC[NH2+]C3CCCCC3)sc2c1 ZINC000731209105 1130779216 /nfs/dbraw/zinc/77/92/16/1130779216.db2.gz SIMODPCTFBVBEZ-UHFFFAOYSA-N 1 0 334.445 3.929 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(Cl)c1 ZINC000732917910 1130970481 /nfs/dbraw/zinc/97/04/81/1130970481.db2.gz SDDCWTSVKIHBIR-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1c1ccc([N+](=O)[O-])cc1F ZINC000740869883 1131550758 /nfs/dbraw/zinc/55/07/58/1131550758.db2.gz BQOLHSCBKGPEMM-HNNXBMFYSA-N 1 0 343.402 3.835 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CC(C3CC3)C3CC3)CC2)cc1 ZINC000766271323 1131625474 /nfs/dbraw/zinc/62/54/74/1131625474.db2.gz DCBJMVMALLTDLI-UHFFFAOYSA-N 1 0 329.444 3.589 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cn2cc([N+](=O)[O-])c(-c3ccncc3)n2)CC1 ZINC000742152849 1131694011 /nfs/dbraw/zinc/69/40/11/1131694011.db2.gz KGKYNIYGTJBVMI-OAHLLOKOSA-N 1 0 343.431 3.569 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C)c2cccc(-n3ccnc3)c2)cc1[N+](=O)[O-] ZINC000742391434 1131714891 /nfs/dbraw/zinc/71/48/91/1131714891.db2.gz HYVNGRXIUUBPQO-OAHLLOKOSA-N 1 0 336.395 3.940 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H](CCO)c1ccccc1)CC2 ZINC001172898647 1131882304 /nfs/dbraw/zinc/88/23/04/1131882304.db2.gz IHXFKMXGFJWDDN-AZUAARDMSA-N 1 0 340.423 3.556 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CCOc1ccccc1F)CC2 ZINC001172898774 1131882755 /nfs/dbraw/zinc/88/27/55/1131882755.db2.gz JEZKFVXBTGMICF-MRXNPFEDSA-N 1 0 344.386 3.650 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc(Cl)cn1)CC2 ZINC001172901230 1131884038 /nfs/dbraw/zinc/88/40/38/1131884038.db2.gz LNDLAOUGLLEYRJ-HNNXBMFYSA-N 1 0 331.803 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]Cc1ncc(Cl)s1)CC2 ZINC001172903746 1131886356 /nfs/dbraw/zinc/88/63/56/1131886356.db2.gz SXRXAKZGHBCERM-GFCCVEGCSA-N 1 0 337.832 3.742 20 5 EHBDRO CC(C)(Cc1ccncc1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172903535 1131886663 /nfs/dbraw/zinc/88/66/63/1131886663.db2.gz HXLQTBIHQIJEMV-GOSISDBHSA-N 1 0 339.439 3.848 20 5 EHBDRO Cc1cc2c(cn1)[C@H]([NH2+][C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172903767 1131886997 /nfs/dbraw/zinc/88/69/97/1131886997.db2.gz IEQQJRXLHRKYNX-YLJYHZDGSA-N 1 0 337.423 3.823 20 5 EHBDRO CC(C)(Cc1cccnc1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172907264 1131888125 /nfs/dbraw/zinc/88/81/25/1131888125.db2.gz RNSPZYWLXRRAFV-GOSISDBHSA-N 1 0 339.439 3.848 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](c3ccncc3)C1)CC2 ZINC001172911307 1131917661 /nfs/dbraw/zinc/91/76/61/1131917661.db2.gz SECGJTKBRZQOTF-RBUKOAKNSA-N 1 0 337.423 3.727 20 5 EHBDRO CCCCC[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173010746 1131935523 /nfs/dbraw/zinc/93/55/23/1131935523.db2.gz AGXFDAIBHASXPY-UHFFFAOYSA-N 1 0 341.402 3.964 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+]CCc2cccs2)c1F ZINC001173175530 1131991635 /nfs/dbraw/zinc/99/16/35/1131991635.db2.gz PBYAKWKAAPUTSB-NSHDSACASA-N 1 0 338.404 3.567 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[NH2+][C@H]2CCCC23CCC3)c1F ZINC001173187356 1131993670 /nfs/dbraw/zinc/99/36/70/1131993670.db2.gz ZZIMVSRAOZHCIJ-LRDDRELGSA-N 1 0 336.407 3.986 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H]1CCOc2cc(F)ccc21 ZINC001173220328 1132004641 /nfs/dbraw/zinc/00/46/41/1132004641.db2.gz YKVCCFYUSBNFOJ-SJCJKPOMSA-N 1 0 330.359 3.778 20 5 EHBDRO COc1cc([C@H]([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccn1 ZINC001173227432 1132006982 /nfs/dbraw/zinc/00/69/82/1132006982.db2.gz FPWLZHAKFSBJNM-ORAYPTAESA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c(-c2ccccc2)cnc1C[NH3+] ZINC001173229163 1132008015 /nfs/dbraw/zinc/00/80/15/1132008015.db2.gz LSIKTYSMNFPHNO-AWEZNQCLSA-N 1 0 336.395 3.721 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CSc2ccccc2C1 ZINC001173231108 1132008818 /nfs/dbraw/zinc/00/88/18/1132008818.db2.gz XLRBRFMYXJGITJ-CJNGLKHVSA-N 1 0 328.437 3.832 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233514 1132010135 /nfs/dbraw/zinc/01/01/35/1132010135.db2.gz JJTNOVRPHXUVGK-UGSOOPFHSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1c2ccccc2c2c1C[C@@H]([NH3+])C2 ZINC001173235494 1132010439 /nfs/dbraw/zinc/01/04/39/1132010439.db2.gz UDUVRFHFIPPALM-ZFWWWQNUSA-N 1 0 335.407 3.779 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(-n2cccn2)cc1 ZINC001173214432 1132015008 /nfs/dbraw/zinc/01/50/08/1132015008.db2.gz BUMKEZVDIZHFOB-OAHLLOKOSA-N 1 0 336.395 3.501 20 5 EHBDRO NC(=O)c1ccccc1Nc1ccc2cc3ccc(N)cc3[nH+]c2c1 ZINC001173984681 1132194729 /nfs/dbraw/zinc/19/47/29/1132194729.db2.gz YZWLTSVMQVKIFC-UHFFFAOYSA-N 1 0 328.375 3.813 20 5 EHBDRO COc1ccc(OCC[N@@H+]2CC(C)(C)CCC2(C)C)c([N+](=O)[O-])c1 ZINC001174723549 1132452119 /nfs/dbraw/zinc/45/21/19/1132452119.db2.gz CSJLECWEXKWBLQ-UHFFFAOYSA-N 1 0 336.432 3.883 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@H+](CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)C1 ZINC001175052533 1132550759 /nfs/dbraw/zinc/55/07/59/1132550759.db2.gz HAWVDZIQYFGLBP-PYLYLYNFSA-N 1 0 349.406 3.741 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2cccc(OCc3ccccc3)c2)C1 ZINC001168966796 1132621545 /nfs/dbraw/zinc/62/15/45/1132621545.db2.gz LFPZFNHTVUYULP-MOPGFXCFSA-N 1 0 340.423 3.801 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(-c3ccnc(F)c3)c(F)c2)C1 ZINC001168970886 1132622191 /nfs/dbraw/zinc/62/21/91/1132622191.db2.gz JDIOQORHVFCEHP-ZFWWWQNUSA-N 1 0 347.365 3.562 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+]Cc2ccc(-c3ccnc(F)c3)c(F)c2)C1 ZINC001168970883 1132622829 /nfs/dbraw/zinc/62/28/29/1132622829.db2.gz JDIOQORHVFCEHP-DZGCQCFKSA-N 1 0 347.365 3.562 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(Cl)cc2C(F)(F)F)C1 ZINC001168973468 1132624733 /nfs/dbraw/zinc/62/47/33/1132624733.db2.gz OTXCLGZFUDKAQY-CABZTGNLSA-N 1 0 336.741 3.894 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+][C@H]2CC[C@@H](OCc3ccccc3)CC2)C1 ZINC001169000656 1132628744 /nfs/dbraw/zinc/62/87/44/1132628744.db2.gz YLPXHEQNOYECPN-CADBVGFASA-N 1 0 332.444 3.549 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H](c2cccnc2C(F)(F)F)C2CC2)C1 ZINC001169009758 1132631653 /nfs/dbraw/zinc/63/16/53/1132631653.db2.gz XYEDGPZWIFABBB-MPKXVKKWSA-N 1 0 343.349 3.587 20 5 EHBDRO C[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(F)cc1Br ZINC001168990036 1132634596 /nfs/dbraw/zinc/63/45/96/1132634596.db2.gz AXRBPRCFKVUTJJ-UMNHJUIQSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([N@H+](Cc2ccccc2)Cc2cccnc2)C1 ZINC001169030293 1132635629 /nfs/dbraw/zinc/63/56/29/1132635629.db2.gz YCUIASDNTPVIHF-MJGOQNOKSA-N 1 0 325.412 3.529 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3cccc(F)c32)C1 ZINC001169041110 1132638046 /nfs/dbraw/zinc/63/80/46/1132638046.db2.gz BCCWBDVOTMHAJX-DZGCQCFKSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([N@H+](Cc2ccccc2)C2CCSCC2)C1 ZINC001169041697 1132638218 /nfs/dbraw/zinc/63/82/18/1132638218.db2.gz CBNJSOPBCHCETQ-FUHWJXTLSA-N 1 0 334.485 3.830 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([N@@H+]2CCC[C@H](Oc3ccc(Cl)cc3)C2)C1 ZINC001169040153 1132638279 /nfs/dbraw/zinc/63/82/79/1132638279.db2.gz YHTQTDVZJKYHRM-UNEWFSDZSA-N 1 0 338.835 3.629 20 5 EHBDRO C[N@H+](CCOc1ccccc1[N+](=O)[O-])Cc1ccc2cc[nH]c2c1 ZINC001175611316 1132725495 /nfs/dbraw/zinc/72/54/95/1132725495.db2.gz KYPXILGYFDVXDN-UHFFFAOYSA-N 1 0 325.368 3.587 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCCC[C@H](C2CCOCC2)C1 ZINC001175697580 1132729765 /nfs/dbraw/zinc/72/97/65/1132729765.db2.gz DYGUSEVLEQARDW-INIZCTEOSA-N 1 0 348.443 3.632 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2(C)C)c1[N+](=O)[O-] ZINC001175714359 1132742145 /nfs/dbraw/zinc/74/21/45/1132742145.db2.gz HAEDTJJUXFPHAU-HNNXBMFYSA-N 1 0 329.400 3.968 20 5 EHBDRO CCC1([NH+]2CCCCC2)CCN(Cc2c(F)cccc2[N+](=O)[O-])CC1 ZINC001175759651 1132759702 /nfs/dbraw/zinc/75/97/02/1132759702.db2.gz YMOHXOGHEHZVDP-UHFFFAOYSA-N 1 0 349.450 3.964 20 5 EHBDRO CCC1(CC)CC[NH+]([C@@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169430840 1132761670 /nfs/dbraw/zinc/76/16/70/1132761670.db2.gz IHMOGCWKBHOUSB-AWEZNQCLSA-N 1 0 333.432 3.824 20 5 EHBDRO CC[NH+]1CCC(Nc2ccc(C)c(Br)c2[N+](=O)[O-])CC1 ZINC000804331459 1132793741 /nfs/dbraw/zinc/79/37/41/1132793741.db2.gz AGEPJSGLIQTCOJ-UHFFFAOYSA-N 1 0 342.237 3.562 20 5 EHBDRO C[NH+](C)CCOc1cc(F)ccc1Nc1ccc(/C=C/[N+](=O)[O-])cc1 ZINC001175907592 1132795308 /nfs/dbraw/zinc/79/53/08/1132795308.db2.gz USTBMCZAWPRMKV-MDZDMXLPSA-N 1 0 345.374 3.757 20 5 EHBDRO COc1cccc(N2CCC[C@@H]([NH3+])c3cc(C)ccc32)c1[N+](=O)[O-] ZINC001169696202 1132823069 /nfs/dbraw/zinc/82/30/69/1132823069.db2.gz KNGHKVHGYOTWCV-CQSZACIVSA-N 1 0 327.384 3.844 20 5 EHBDRO COc1c(F)cc(N2CCC[C@H]([NH3+])c3cc(C)ccc32)cc1[N+](=O)[O-] ZINC001169697653 1132823868 /nfs/dbraw/zinc/82/38/68/1132823868.db2.gz OKKNJYHQMUKBFT-HNNXBMFYSA-N 1 0 345.374 3.983 20 5 EHBDRO C[NH+](C)CCC(C)(C)Nc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 ZINC001169719100 1132834229 /nfs/dbraw/zinc/83/42/29/1132834229.db2.gz WTUXSKABBJMMDM-UHFFFAOYSA-N 1 0 335.326 3.636 20 5 EHBDRO Cc1nn(C[N@H+]2CCC[C@@H]2CCC(C)C)c2ncc([N+](=O)[O-])cc12 ZINC000767766240 1133049774 /nfs/dbraw/zinc/04/97/74/1133049774.db2.gz RLKANKYCLLOLJY-CQSZACIVSA-N 1 0 331.420 3.506 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@@H]1C ZINC000768555295 1133155577 /nfs/dbraw/zinc/15/55/77/1133155577.db2.gz PTUBEMVHGYPQCN-JSGCOSHPSA-N 1 0 325.840 3.553 20 5 EHBDRO Cc1ccc(C[NH2+][C@H]2CCCc3cnn(C(C)C)c32)cc1[N+](=O)[O-] ZINC001178430540 1133162996 /nfs/dbraw/zinc/16/29/96/1133162996.db2.gz IBVWJYBTNHDCIF-INIZCTEOSA-N 1 0 328.416 3.848 20 5 EHBDRO CCOc1ccc2c(c1)c(=[NH2+])c1ccc(N)cc1n2C(=O)[C@H]1C[C@@H]1C ZINC001178561502 1133181228 /nfs/dbraw/zinc/18/12/28/1133181228.db2.gz QYMSDAUZAZWXDJ-NHYWBVRUSA-N 1 0 335.407 3.551 20 5 EHBDRO C[C@H](C[NH2+]Cc1cnc2ccc(Cl)cn12)c1ccccc1[N+](=O)[O-] ZINC001179685346 1133270331 /nfs/dbraw/zinc/27/03/31/1133270331.db2.gz KNQQWNBCXAVWFQ-GFCCVEGCSA-N 1 0 344.802 3.789 20 5 EHBDRO CCSc1cccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)c1 ZINC000769910703 1133357659 /nfs/dbraw/zinc/35/76/59/1133357659.db2.gz GYZGHPNIQOOWIY-QGZVFWFLSA-N 1 0 332.425 3.530 20 5 EHBDRO O=C(Oc1cc(F)cc([N+](=O)[O-])c1)c1ccc(C[NH+]2CCCC2)cc1 ZINC000771486219 1133562868 /nfs/dbraw/zinc/56/28/68/1133562868.db2.gz GMTPATKQTYJAAI-UHFFFAOYSA-N 1 0 344.342 3.549 20 5 EHBDRO COc1ccc([C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000774407586 1133673084 /nfs/dbraw/zinc/67/30/84/1133673084.db2.gz BCDULDSTTMJCAH-OALUTQOASA-N 1 0 344.411 3.624 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)C1CC1 ZINC000774411532 1133673987 /nfs/dbraw/zinc/67/39/87/1133673987.db2.gz PYCAKLJFAKDCLH-RBUKOAKNSA-N 1 0 326.396 3.678 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[NH2+]C(C)(C)C1CCOCC1 ZINC000786163291 1133810018 /nfs/dbraw/zinc/81/00/18/1133810018.db2.gz MQONXMJLWACAMO-UHFFFAOYSA-N 1 0 336.432 3.677 20 5 EHBDRO Cc1csc2nc(C)c(C[NH2+][C@@H](C)c3ccc([N+](=O)[O-])cc3)n12 ZINC001183788027 1133858237 /nfs/dbraw/zinc/85/82/37/1133858237.db2.gz HCYIYGUPSAFTRZ-NSHDSACASA-N 1 0 330.413 3.772 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)C[C@@H](O)c1ccco1 ZINC000786820525 1133911554 /nfs/dbraw/zinc/91/15/54/1133911554.db2.gz KKQNIUVLRWYAJG-IQRUHWCRSA-N 1 0 330.384 3.693 20 5 EHBDRO CC(C)[NH2+][C@H]1CCCN(c2cc(C(F)(F)F)ccc2[N+](=O)[O-])C1 ZINC001185098603 1134028929 /nfs/dbraw/zinc/02/89/29/1134028929.db2.gz OWCOKWMXTZUHNA-LBPRGKRZSA-N 1 0 331.338 3.580 20 5 EHBDRO Cc1ccccc1[C@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])C1 ZINC000774873510 1134089740 /nfs/dbraw/zinc/08/97/40/1134089740.db2.gz JGAUFQWRAYTOEC-AWEZNQCLSA-N 1 0 341.367 3.801 20 5 EHBDRO Cc1ccc(C[C@H](C)[N@H+](C)Cc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])cc1 ZINC000774905543 1134114059 /nfs/dbraw/zinc/11/40/59/1134114059.db2.gz QMMPREZVCNWCGA-AWEZNQCLSA-N 1 0 343.383 3.874 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](C(C)C)[C@@H](O)c1ccccc1 ZINC000788540199 1134139672 /nfs/dbraw/zinc/13/96/72/1134139672.db2.gz RMFXHKWUXRRDPH-MOPGFXCFSA-N 1 0 328.412 3.751 20 5 EHBDRO C[C@@H]([NH2+]CCCCN(C)c1ccccc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788562966 1134143334 /nfs/dbraw/zinc/14/33/34/1134143334.db2.gz MKSNGPKFGMZYRT-OAHLLOKOSA-N 1 0 342.443 3.744 20 5 EHBDRO Cc1cccc(O[C@H](C)C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000788607090 1134150243 /nfs/dbraw/zinc/15/02/43/1134150243.db2.gz COVPFFRJHHBNGQ-KGLIPLIRSA-N 1 0 329.400 3.604 20 5 EHBDRO CO[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1cccc(Cl)c1 ZINC000788666068 1134159251 /nfs/dbraw/zinc/15/92/51/1134159251.db2.gz PXTYANODQMOIGH-APPDUMDISA-N 1 0 349.818 3.869 20 5 EHBDRO C[C@H]([NH2+]CC1(C)Cc2ccccc2C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788694942 1134163948 /nfs/dbraw/zinc/16/39/48/1134163948.db2.gz XWLYPGOUSBUPAS-ZDUSSCGKSA-N 1 0 325.412 3.633 20 5 EHBDRO C[C@@H]([NH2+]CCC1CC(OC(C)(C)C)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788780314 1134174676 /nfs/dbraw/zinc/17/46/76/1134174676.db2.gz CTRMGSHPONWQPN-DNOWBOINSA-N 1 0 335.448 3.811 20 5 EHBDRO O=[N+]([O-])c1cnc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ccccc21 ZINC001186873534 1134264885 /nfs/dbraw/zinc/26/48/85/1134264885.db2.gz YFNDBCKTUNACBK-CVEARBPZSA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1cc(NCC2(c3ccccc3)CC[NH+](C)CC2)ccc1[N+](=O)[O-] ZINC001187189702 1134307470 /nfs/dbraw/zinc/30/74/70/1134307470.db2.gz GNKPYRHEKVXKRX-UHFFFAOYSA-N 1 0 339.439 3.979 20 5 EHBDRO CCC(=O)c1ccc(N(C)CCCC[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC001187437580 1134334916 /nfs/dbraw/zinc/33/49/16/1134334916.db2.gz IGXINOUBBPFSNO-UHFFFAOYSA-N 1 0 347.459 3.890 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(F)ccc2C)c([N+](=O)[O-])c1 ZINC001170297545 1134737341 /nfs/dbraw/zinc/73/73/41/1134737341.db2.gz PBTLUCYFMFYTJK-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2cc(C)ccn2)c([N+](=O)[O-])c1 ZINC001170297507 1134737699 /nfs/dbraw/zinc/73/76/99/1134737699.db2.gz OHDXZZVYLBPCSM-KBPBESRZSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(c3cccc(F)c3)CC2)c([N+](=O)[O-])c1 ZINC001170314438 1134745460 /nfs/dbraw/zinc/74/54/60/1134745460.db2.gz VKMJONZPTRGAJS-ZDUSSCGKSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3ccccc3C2)c([N+](=O)[O-])c1 ZINC001170326628 1134748556 /nfs/dbraw/zinc/74/85/56/1134748556.db2.gz AVXJPVCKUHXAPD-AWEZNQCLSA-N 1 0 326.396 3.593 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCCc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC001170307208 1134753425 /nfs/dbraw/zinc/75/34/25/1134753425.db2.gz FHERTLUMDKRHAG-AWEZNQCLSA-N 1 0 346.402 3.896 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3ccc(F)cc3C2)c([N+](=O)[O-])c1 ZINC001170352654 1134753999 /nfs/dbraw/zinc/75/39/99/1134753999.db2.gz PLYQPANNDFNPRP-ZDUSSCGKSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccccc2F)c([N+](=O)[O-])c1 ZINC001170347883 1134759519 /nfs/dbraw/zinc/75/95/19/1134759519.db2.gz SUJBEQDEYXABRP-CYBMUJFWSA-N 1 0 332.375 3.806 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000792879802 1134812680 /nfs/dbraw/zinc/81/26/80/1134812680.db2.gz LEENVLNJIGPILY-LLVKDONJSA-N 1 0 335.282 3.570 20 5 EHBDRO C[C@H]1c2ccccc2CC[N@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC001191477517 1134870247 /nfs/dbraw/zinc/87/02/47/1134870247.db2.gz YKELYKGMQXSLFG-AWEZNQCLSA-N 1 0 339.395 3.543 20 5 EHBDRO C[C@H](Cc1cccs1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC001191464695 1134876373 /nfs/dbraw/zinc/87/63/73/1134876373.db2.gz MVBUOYHJEBPXEB-LLVKDONJSA-N 1 0 330.413 3.596 20 5 EHBDRO Cc1ccc([C@H](CNc2c([N+](=O)[O-])cccc2[N+](=O)[O-])[NH+](C)C)cc1 ZINC000804386901 1135051786 /nfs/dbraw/zinc/05/17/86/1135051786.db2.gz JDVIYDRXKBWBAK-INIZCTEOSA-N 1 0 344.371 3.526 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccc(Cl)cc1 ZINC000804532135 1135109397 /nfs/dbraw/zinc/10/93/97/1135109397.db2.gz WWBRNOWNVLXNKD-INIZCTEOSA-N 1 0 334.807 3.545 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1cc2ccccc2[nH]1 ZINC000775629701 1135354562 /nfs/dbraw/zinc/35/45/62/1135354562.db2.gz WKSLMLATZRGUDA-ZDUSSCGKSA-N 1 0 325.368 3.806 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)CCc2ccc(F)cc21 ZINC001195694378 1135456583 /nfs/dbraw/zinc/45/65/83/1135456583.db2.gz KRQQEUZHYKVUDO-CQSZACIVSA-N 1 0 328.387 3.938 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095625 1135591448 /nfs/dbraw/zinc/59/14/48/1135591448.db2.gz KYRMPSASJUIVAA-INIZCTEOSA-N 1 0 347.462 3.991 20 5 EHBDRO COc1ccc(C[N@H+]2C[C@H]3[C@H](C[C@@H]3c3ccccc3)C2)cc1[N+](=O)[O-] ZINC001196889493 1135622199 /nfs/dbraw/zinc/62/21/99/1135622199.db2.gz SPYNELTZZSQIMN-KURKYZTESA-N 1 0 338.407 3.839 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+]2CCC[C@H](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC001197203119 1135659280 /nfs/dbraw/zinc/65/92/80/1135659280.db2.gz RNMMTTNYWJOCTP-AWEZNQCLSA-N 1 0 333.388 3.905 20 5 EHBDRO CCc1noc(C)c1[C@@H](C)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000808727430 1135723224 /nfs/dbraw/zinc/72/32/24/1135723224.db2.gz FEFCXYANLQKPKZ-LLVKDONJSA-N 1 0 342.399 3.828 20 5 EHBDRO CN(C)c1ccccc1C[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000808785602 1135737486 /nfs/dbraw/zinc/73/74/86/1135737486.db2.gz MGLQIQUBSJQODU-UHFFFAOYSA-N 1 0 333.819 3.946 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]Cc2ccnc(N3CCCC3)c2)cc1Cl ZINC000809793638 1135893215 /nfs/dbraw/zinc/89/32/15/1135893215.db2.gz JDFDZKFMGIWKEP-UHFFFAOYSA-N 1 0 346.818 3.533 20 5 EHBDRO CN(Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C[C@@H]1CCC[N@H+](C)C1 ZINC000809948631 1135905504 /nfs/dbraw/zinc/90/55/04/1135905504.db2.gz IHNYHNAISLFTOO-LLVKDONJSA-N 1 0 346.258 3.675 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC[C@H]2COCC[C@@H]21 ZINC000809954145 1135906012 /nfs/dbraw/zinc/90/60/12/1135906012.db2.gz QHUDKABSEGTORW-HZMBPMFUSA-N 1 0 345.226 3.903 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000810093371 1135920337 /nfs/dbraw/zinc/92/03/37/1135920337.db2.gz NHOHCOODRRVCHO-CVEARBPZSA-N 1 0 336.819 3.782 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)C(C)(C)c1ccccc1 ZINC000776024497 1135928442 /nfs/dbraw/zinc/92/84/42/1135928442.db2.gz QSKHLIKLIQVOBH-MOPGFXCFSA-N 1 0 342.439 3.974 20 5 EHBDRO C[N@H+](Cc1c(Br)cccc1[N+](=O)[O-])C(C1CC1)C1CC1 ZINC000769192735 1135997283 /nfs/dbraw/zinc/99/72/83/1135997283.db2.gz YRPSQCYNLHXANE-UHFFFAOYSA-N 1 0 339.233 3.978 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254066 1136104779 /nfs/dbraw/zinc/10/47/79/1136104779.db2.gz QYEVCQLEMUGIGX-ROUUACIJSA-N 1 0 345.830 3.783 20 5 EHBDRO CC(C)c1ccc(C[N@H+](C)C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776271686 1136124383 /nfs/dbraw/zinc/12/43/83/1136124383.db2.gz NDIURPJBPVTVRF-LJQANCHMSA-N 1 0 328.412 3.884 20 5 EHBDRO Cc1ccc([C@@H]2CCC[N@@H+]2C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776278193 1136133087 /nfs/dbraw/zinc/13/30/87/1136133087.db2.gz SNIKGPBPMFXYHI-OALUTQOASA-N 1 0 326.396 3.774 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000850424807 1136256318 /nfs/dbraw/zinc/25/63/18/1136256318.db2.gz HMQWRFRQCMUZLW-GUYCJALGSA-N 1 0 346.431 3.565 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000850437088 1136258573 /nfs/dbraw/zinc/25/85/73/1136258573.db2.gz ZCJWUWGRTRDVRM-VNBZBWLYSA-N 1 0 348.374 3.515 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@H](C)[C@H](O)c1ccccc1 ZINC000812847474 1136259480 /nfs/dbraw/zinc/25/94/80/1136259480.db2.gz DDMSFPDZTCEGED-KUHUBIRLSA-N 1 0 344.411 3.547 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812850770 1136261028 /nfs/dbraw/zinc/26/10/28/1136261028.db2.gz XTGQUSPTOIHAER-LIRRHRJNSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@@](C)(O)c1ccccc1 ZINC000850477246 1136266803 /nfs/dbraw/zinc/26/68/03/1136266803.db2.gz RVHFBJJGKQXJLT-IQUTYRLHSA-N 1 0 344.411 3.550 20 5 EHBDRO CC(C)[C@H](c1ccccc1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776581325 1136444946 /nfs/dbraw/zinc/44/49/46/1136444946.db2.gz CLIOXAAXPCXIEO-RTBURBONSA-N 1 0 328.412 3.957 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-])C1CCC(F)CC1 ZINC000852651649 1136473706 /nfs/dbraw/zinc/47/37/06/1136473706.db2.gz QAXLMADMHDYQCN-ZBOXLXRLSA-N 1 0 325.340 3.509 20 5 EHBDRO COc1cc(C[NH2+][C@@H]2CCCC[C@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000217094878 1136487636 /nfs/dbraw/zinc/48/76/36/1136487636.db2.gz KESMQSQQKAEEOT-ZYHUDNBSSA-N 1 0 344.358 3.873 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCC[C@@H](c3ccccc3)C2)cc1 ZINC000814641825 1136488507 /nfs/dbraw/zinc/48/85/07/1136488507.db2.gz LLGDTLVAUICKSI-IEBWSBKVSA-N 1 0 326.396 3.508 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CC[C@@H](c3cccc(Cl)c3)C2)cc1 ZINC000814666335 1136491775 /nfs/dbraw/zinc/49/17/75/1136491775.db2.gz GMGJIIKVNURMBM-CRAIPNDOSA-N 1 0 346.814 3.771 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240425 1136521556 /nfs/dbraw/zinc/52/15/56/1136521556.db2.gz GZWASNNHGHUPCA-STQMWFEESA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@@H]1CN(c2ccc(C(F)F)cc2[N+](=O)[O-])CC[N@@H+](C2CCC2)C1 ZINC000853644267 1136552298 /nfs/dbraw/zinc/55/22/98/1136552298.db2.gz IEOTXLLPMLHBEH-LBPRGKRZSA-N 1 0 339.386 3.843 20 5 EHBDRO CCCCCn1cc(C[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c(C)n1 ZINC000815600095 1136616961 /nfs/dbraw/zinc/61/69/61/1136616961.db2.gz LLTWEZYCMFMONY-CYBMUJFWSA-N 1 0 345.447 3.723 20 5 EHBDRO Cc1ccc2c(CC[NH2+][C@H](C)c3ccc(N)c([N+](=O)[O-])c3)c[nH]c2c1 ZINC000815572361 1136618071 /nfs/dbraw/zinc/61/80/71/1136618071.db2.gz BDZGEQJISXHKEX-CYBMUJFWSA-N 1 0 338.411 3.860 20 5 EHBDRO Cc1nc2c(s1)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)CCC2 ZINC000815614992 1136618917 /nfs/dbraw/zinc/61/89/17/1136618917.db2.gz FZLIGKXWBWCEJI-TVQRCGJNSA-N 1 0 332.429 3.670 20 5 EHBDRO CCS(=O)(=O)C[C@@H](C)[NH2+]Cc1c2ccccc2cc2ccccc21 ZINC000113349621 1136697516 /nfs/dbraw/zinc/69/75/16/1136697516.db2.gz FUYIZILLNXIZRF-OAHLLOKOSA-N 1 0 341.476 3.906 20 5 EHBDRO C[N@@H+]1CCN(Cc2cc([N+](=O)[O-])ccc2Cl)c2ccccc2C1 ZINC000816617978 1136742648 /nfs/dbraw/zinc/74/26/48/1136742648.db2.gz MPMMCVNVZGIUHC-UHFFFAOYSA-N 1 0 331.803 3.700 20 5 EHBDRO COC1(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])CCC1 ZINC000816638119 1136743203 /nfs/dbraw/zinc/74/32/03/1136743203.db2.gz AOLIQLVFMWAWPT-UHFFFAOYSA-N 1 0 333.215 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]CCCc2cccc(Cl)c2)c1 ZINC000818985438 1136896918 /nfs/dbraw/zinc/89/69/18/1136896918.db2.gz SSFSZUOPIASGEL-QGZVFWFLSA-N 1 0 334.803 3.504 20 5 EHBDRO Cc1[nH]c2ccc(C[NH2+]C[C@H](O)c3cccc([N+](=O)[O-])c3)cc2c1C ZINC000818975164 1136900933 /nfs/dbraw/zinc/90/09/33/1136900933.db2.gz JKEALWHJQNSGJZ-IBGZPJMESA-N 1 0 339.395 3.516 20 5 EHBDRO CC(F)(F)c1ccc(C[NH2+]C[C@@H](O)c2cccc([N+](=O)[O-])c2)cc1 ZINC000819331049 1136932004 /nfs/dbraw/zinc/93/20/04/1136932004.db2.gz IQIFUJXHBZRJAC-MRXNPFEDSA-N 1 0 336.338 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)cc1 ZINC000819333764 1136932432 /nfs/dbraw/zinc/93/24/32/1136932432.db2.gz ROOWDICFPQSVLW-MSOLQXFVSA-N 1 0 348.349 3.574 20 5 EHBDRO Cc1ccc([C@H](C)NC2C[C@H]3CC[C@@H](C2)[N@H+]3C2CC2)cc1[N+](=O)[O-] ZINC000820822239 1137005824 /nfs/dbraw/zinc/00/58/24/1137005824.db2.gz IKQVZAQEQWCJJD-ZVRJUHEZSA-N 1 0 329.444 3.712 20 5 EHBDRO CC(C)(c1nc(-c2ccc([N+](=O)[O-])s2)no1)[C@@H]([NH3+])c1ccccc1 ZINC000823069280 1137085962 /nfs/dbraw/zinc/08/59/62/1137085962.db2.gz LGWWBXOMWLLGHV-ZDUSSCGKSA-N 1 0 344.396 3.684 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000823659961 1137108546 /nfs/dbraw/zinc/10/85/46/1137108546.db2.gz AQTZZBJJYXINDZ-QGZVFWFLSA-N 1 0 334.391 3.515 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@@H](C)CNC(=O)OC(C)(C)C ZINC000824287714 1137130705 /nfs/dbraw/zinc/13/07/05/1137130705.db2.gz WOGQWPQWVIXIDB-XXYUJHKVSA-N 1 0 349.431 3.501 20 5 EHBDRO C[C@H]([NH2+]CCc1nc(C(F)(F)F)cs1)c1cccc([N+](=O)[O-])c1 ZINC000173454629 1137138453 /nfs/dbraw/zinc/13/84/53/1137138453.db2.gz CDUOFHJIJHTLHM-VIFPVBQESA-N 1 0 345.346 3.963 20 5 EHBDRO Cc1c(F)nccc1C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000862349523 1137139314 /nfs/dbraw/zinc/13/93/14/1137139314.db2.gz GDYWSJQKTRRNCJ-UHFFFAOYSA-N 1 0 343.280 3.746 20 5 EHBDRO CCOCOc1ccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000824462814 1137140253 /nfs/dbraw/zinc/14/02/53/1137140253.db2.gz PUKLWGQLPKQTOY-AWEZNQCLSA-N 1 0 330.384 3.818 20 5 EHBDRO CC[C@@H](COCC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000824555443 1137142623 /nfs/dbraw/zinc/14/26/23/1137142623.db2.gz UPVNCJIQSGQOIA-JTQLQIEISA-N 1 0 340.729 3.695 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H]([NH+]3CCCCC3)C2)c(C(F)F)c1 ZINC000865525846 1137291762 /nfs/dbraw/zinc/29/17/62/1137291762.db2.gz HLWDJSMBVBCDJJ-ZDUSSCGKSA-N 1 0 325.359 3.597 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000865787710 1137311857 /nfs/dbraw/zinc/31/18/57/1137311857.db2.gz RLQXSWOEUWGMFO-HNNXBMFYSA-N 1 0 344.411 3.607 20 5 EHBDRO COc1cc2c(c(C[NH2+]Cc3ccc(C)c([N+](=O)[O-])c3)c1)O[C@@H](C)C2 ZINC000865786799 1137311917 /nfs/dbraw/zinc/31/19/17/1137311917.db2.gz CLTHABRQAOGROS-ZDUSSCGKSA-N 1 0 342.395 3.525 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@]23CCC[C@H]2OCC3)o1 ZINC000865858832 1137317381 /nfs/dbraw/zinc/31/73/81/1137317381.db2.gz ILQSANPKSUVYRM-MSOLQXFVSA-N 1 0 328.368 3.656 20 5 EHBDRO C[C@H](C[C@@H](O)c1ccco1)[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000120865998 1137324829 /nfs/dbraw/zinc/32/48/29/1137324829.db2.gz AFNHJXFHAQADGX-RPVQJOFSSA-N 1 0 344.411 3.611 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000866367119 1137349940 /nfs/dbraw/zinc/34/99/40/1137349940.db2.gz GBSWSXCIAGZMMK-NOZJJQNGSA-N 1 0 335.206 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2NCc1ccc(Br)cn1 ZINC000866570644 1137365878 /nfs/dbraw/zinc/36/58/78/1137365878.db2.gz IEPXYEHNSSURSV-CQSZACIVSA-N 1 0 348.200 3.529 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000773011005 1137459231 /nfs/dbraw/zinc/45/92/31/1137459231.db2.gz QQJVHGFYNSZALU-SJKOYZFVSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3CC3)o2)c(Br)c1 ZINC000036819301 1137474713 /nfs/dbraw/zinc/47/47/13/1137474713.db2.gz WOIQYIJWQAPJCL-UHFFFAOYSA-N 1 0 337.173 3.869 20 5 EHBDRO C[NH+](C)CCCC1CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000123175654 1137497125 /nfs/dbraw/zinc/49/71/25/1137497125.db2.gz WBWUZAQLEYETGS-UHFFFAOYSA-N 1 0 339.867 3.802 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1ccsc1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017902 1137564791 /nfs/dbraw/zinc/56/47/91/1137564791.db2.gz GUWQZFMHHLPXOD-ABAIWWIYSA-N 1 0 337.420 3.749 20 5 EHBDRO C[C@H]([NH2+]C[C@H](CCO)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872038696 1137566897 /nfs/dbraw/zinc/56/68/97/1137566897.db2.gz OZMBRPKQGUDYRT-ZFWWWQNUSA-N 1 0 332.375 3.551 20 5 EHBDRO CC[C@H](C[C@H](C)CO)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1SC ZINC000872041581 1137567028 /nfs/dbraw/zinc/56/70/28/1137567028.db2.gz UPUAGODCBQQEDP-YNEHKIRRSA-N 1 0 326.462 3.764 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1ccccc1Cl)c1c(F)cccc1[N+](=O)[O-] ZINC000872047159 1137567680 /nfs/dbraw/zinc/56/76/80/1137567680.db2.gz BUGFPBIJGPNMFO-MEBBXXQBSA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872053529 1137568287 /nfs/dbraw/zinc/56/82/87/1137568287.db2.gz YFPRTTAYSBWWCF-NSHDSACASA-N 1 0 333.319 3.535 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCO[C@H](C2CC2)C1 ZINC000872060802 1137568901 /nfs/dbraw/zinc/56/89/01/1137568901.db2.gz ABDVUMCBDLBNHG-GHJWDPDVSA-N 1 0 336.457 3.925 20 5 EHBDRO C[C@@H]([NH2+]CC[C@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064604 1137569102 /nfs/dbraw/zinc/56/91/02/1137569102.db2.gz IUHWAWQZYATFBP-ACJLOTCBSA-N 1 0 332.375 3.682 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCc1cccc(C)n1 ZINC000872066916 1137569377 /nfs/dbraw/zinc/56/93/77/1137569377.db2.gz MDLSESNJRLZYAE-CYBMUJFWSA-N 1 0 331.441 3.913 20 5 EHBDRO C[C@H]([NH2+]C[C@@]1(CO)C[C@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072665 1137569707 /nfs/dbraw/zinc/56/97/07/1137569707.db2.gz IGAYLCFMPULGMC-ZUEVXXBESA-N 1 0 344.386 3.551 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077399 1137570003 /nfs/dbraw/zinc/57/00/03/1137570003.db2.gz HSFCXLKXBKJTLG-OGHNNQOOSA-N 1 0 345.374 3.700 20 5 EHBDRO COc1cccc([C@@H](C[NH2+][C@@H](C)c2c(F)cccc2[N+](=O)[O-])OC)c1 ZINC000872086903 1137570641 /nfs/dbraw/zinc/57/06/41/1137570641.db2.gz CASCTAWVXQNKIH-YVEFUNNKSA-N 1 0 348.374 3.781 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCC[C@H](OC2CCC2)CC1 ZINC000872281401 1137577737 /nfs/dbraw/zinc/57/77/37/1137577737.db2.gz UXTLGYORBZBFKF-KRWDZBQOSA-N 1 0 334.416 3.527 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCOc2ccc(F)cc21 ZINC000873112502 1137590308 /nfs/dbraw/zinc/59/03/08/1137590308.db2.gz USYRADCJKPPWMK-MRXNPFEDSA-N 1 0 330.359 3.964 20 5 EHBDRO Cc1c(C[NH2+][C@H](c2ccccc2)[C@@H](O)C(C)C)cccc1[N+](=O)[O-] ZINC000873138762 1137591219 /nfs/dbraw/zinc/59/12/19/1137591219.db2.gz MPVLWTWLLQXQRF-MOPGFXCFSA-N 1 0 328.412 3.751 20 5 EHBDRO CC(C)n1ncc2cc(C[NH2+][C@@H](C)c3ccccc3[N+](=O)[O-])cnc21 ZINC000873183637 1137592859 /nfs/dbraw/zinc/59/28/59/1137592859.db2.gz XZOWJMWDIICQNA-ZDUSSCGKSA-N 1 0 339.399 3.771 20 5 EHBDRO Cc1ccc(SC[C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877402021 1137675510 /nfs/dbraw/zinc/67/55/10/1137675510.db2.gz VQVHIVFLLNZFOH-WLYUNCDWSA-N 1 0 346.456 3.574 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+]Cc3cc(Cl)cc(Cl)c3)C2)c1 ZINC000877620904 1137683257 /nfs/dbraw/zinc/68/32/57/1137683257.db2.gz ZRZUDCZBWMSZJB-UHFFFAOYSA-N 1 0 341.198 3.591 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000877730291 1137687071 /nfs/dbraw/zinc/68/70/71/1137687071.db2.gz USMMKZLNCUGPNI-DMZKTXOQSA-N 1 0 328.349 3.716 20 5 EHBDRO CC[C@H](C)C[N@H+](C)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878092963 1137702110 /nfs/dbraw/zinc/70/21/10/1137702110.db2.gz CQTNLAYEUMHKDG-JTQLQIEISA-N 1 0 338.795 3.776 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1csc2ccccc12 ZINC000878421174 1137715298 /nfs/dbraw/zinc/71/52/98/1137715298.db2.gz SOOIBXOOLDARDE-LLVKDONJSA-N 1 0 330.413 3.665 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447451 1137716331 /nfs/dbraw/zinc/71/63/31/1137716331.db2.gz MUGSELXQRQAVPK-JSGCOSHPSA-N 1 0 330.388 3.703 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@H]1CCCOC1 ZINC000880466730 1137779420 /nfs/dbraw/zinc/77/94/20/1137779420.db2.gz QLOUJWZVKYIATD-WMLDXEAASA-N 1 0 336.432 3.677 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1[N+](=O)[O-] ZINC000129715017 1137828774 /nfs/dbraw/zinc/82/87/74/1137828774.db2.gz GIXHIOYAQBUWPK-CYBMUJFWSA-N 1 0 329.356 3.705 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC[C@H]2CCCC2(F)F)n1 ZINC000883274640 1137851870 /nfs/dbraw/zinc/85/18/70/1137851870.db2.gz QSDUOKXPCBCYLR-HZSPNIEDSA-N 1 0 342.390 3.690 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](Cn1ccnc1)c1ccccc1 ZINC000883387722 1137858993 /nfs/dbraw/zinc/85/89/93/1137858993.db2.gz CUTYDKJKPWUWIJ-OALUTQOASA-N 1 0 348.406 3.810 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)o1 ZINC000104662179 1137878869 /nfs/dbraw/zinc/87/88/69/1137878869.db2.gz UILZWYMUQLDCAQ-UHFFFAOYSA-N 1 0 341.367 3.826 20 5 EHBDRO C[C@@H]1C[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC[C@@H]1c1ccccc1 ZINC000137067564 1138045253 /nfs/dbraw/zinc/04/52/53/1138045253.db2.gz AGDYQNQAWZRYHU-XPGWFJOJSA-N 1 0 340.423 3.754 20 5 EHBDRO O[C@@H]1CC[C@@H]([NH2+]Cc2c3ccccc3cc3ccccc32)CC[C@@H]1O ZINC000886257778 1138062678 /nfs/dbraw/zinc/06/26/78/1138062678.db2.gz LEAJMKNNDCSFAO-HUQNJDMZSA-N 1 0 335.447 3.747 20 5 EHBDRO O=[N+]([O-])c1cc(CN[C@H]2CCc3cccnc32)cc(C(F)(F)F)c1 ZINC000886601525 1138100664 /nfs/dbraw/zinc/10/06/64/1138100664.db2.gz VQNSCPZRWHQBCO-AWEZNQCLSA-N 1 0 337.301 3.786 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC(OCc3ccccc3)CC2)c1 ZINC000073106417 1138110916 /nfs/dbraw/zinc/11/09/16/1138110916.db2.gz JLYYXLJPKLJKDB-UHFFFAOYSA-N 1 0 326.396 3.776 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cnn(C3CCCC3)c2)cc1[N+](=O)[O-] ZINC000337469489 1138578343 /nfs/dbraw/zinc/57/83/43/1138578343.db2.gz NAZZBOZHPXMUER-CYBMUJFWSA-N 1 0 344.415 3.766 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2coc(-c3ccc([N+](=O)[O-])cc3)n2)C(C)(C)O1 ZINC000132497263 1138584883 /nfs/dbraw/zinc/58/48/83/1138584883.db2.gz ISDPDJVGTHOEQL-HNNXBMFYSA-N 1 0 345.399 3.686 20 5 EHBDRO C[N@H+](Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)C(C1CC1)C1CC1 ZINC000153374524 1139133293 /nfs/dbraw/zinc/13/32/93/1139133293.db2.gz VZIURWCJNFLHCH-UHFFFAOYSA-N 1 0 327.384 3.870 20 5 EHBDRO Cc1sc(C(=O)Nc2cc(C[NH+](C)C)ccc2C)cc1[N+](=O)[O-] ZINC000177348231 1139614716 /nfs/dbraw/zinc/61/47/16/1139614716.db2.gz HMFKCEHNHXLFPA-UHFFFAOYSA-N 1 0 333.413 3.587 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1ccc(OC)c(O)c1)c1cccc([N+](=O)[O-])c1 ZINC000178410069 1139691874 /nfs/dbraw/zinc/69/18/74/1139691874.db2.gz LXVYBAVTXRGUAG-MRXNPFEDSA-N 1 0 330.384 3.940 20 5 EHBDRO CC1(C)C[C@H]([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000178781315 1139717523 /nfs/dbraw/zinc/71/75/23/1139717523.db2.gz PQOFUFXXMVVXJM-CQSZACIVSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185497069 1140152867 /nfs/dbraw/zinc/15/28/67/1140152867.db2.gz HHWXLCXMADBBHW-OAHLLOKOSA-N 1 0 326.396 3.639 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)C(=O)c2ccc(C(C)C)c([N+](=O)[O-])c2)[C@H](C)C1 ZINC000187769651 1140270310 /nfs/dbraw/zinc/27/03/10/1140270310.db2.gz STHCQQPZNJQXQX-PBHICJAKSA-N 1 0 347.459 3.521 20 5 EHBDRO CCN(CCC[NH+]1CCCC1)C(=O)Nc1cc([N+](=O)[O-])c(C)cc1C ZINC000189783139 1140363641 /nfs/dbraw/zinc/36/36/41/1140363641.db2.gz BPAAMGVFZATAEH-UHFFFAOYSA-N 1 0 348.447 3.551 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]Cc1ccccc1-n1ccnc1)CCC2 ZINC000192727146 1140548162 /nfs/dbraw/zinc/54/81/62/1140548162.db2.gz AYOCYGCCRLZCSX-LJQANCHMSA-N 1 0 348.406 3.948 20 5 EHBDRO CO[C@H]1CCCC[C@H]1[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000266141151 1140645779 /nfs/dbraw/zinc/64/57/79/1140645779.db2.gz HHIXPLFBBRKPCE-CVEARBPZSA-N 1 0 347.440 3.766 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)[C@H]1CCOC1 ZINC000266187486 1140653332 /nfs/dbraw/zinc/65/33/32/1140653332.db2.gz XJAKRYRGLMBLSV-OCCSQVGLSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1cccc2oc(CC[NH2+][C@@H](C)c3cccc([N+](=O)[O-])c3)nc21 ZINC000266770388 1140723066 /nfs/dbraw/zinc/72/30/66/1140723066.db2.gz JGMXLEWUMATHJC-ZDUSSCGKSA-N 1 0 325.368 3.938 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](C3CCCC3)CC2)c2ccncc21 ZINC000267183323 1140765926 /nfs/dbraw/zinc/76/59/26/1140765926.db2.gz KRIQRCRXNGPIHO-UHFFFAOYSA-N 1 0 340.427 3.962 20 5 EHBDRO CC[C@@H]([NH2+]C1CCN(CC(F)(F)F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000268804942 1140996388 /nfs/dbraw/zinc/99/63/88/1140996388.db2.gz FHVBVXMTLCKFQC-OAHLLOKOSA-N 1 0 345.365 3.662 20 5 EHBDRO CC(C)Oc1cccc([C@H](O)C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000268915303 1141024899 /nfs/dbraw/zinc/02/48/99/1141024899.db2.gz NQSVMYSIQZMYNX-AUUYWEPGSA-N 1 0 344.411 3.766 20 5 EHBDRO C[C@H](O)C[C@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000268983100 1141039882 /nfs/dbraw/zinc/03/98/82/1141039882.db2.gz DDKSWCOQGHMCDN-RLFYNMQTSA-N 1 0 328.412 3.800 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC2(CCO)CCCC2)cc1[N+](=O)[O-] ZINC000271127475 1141310859 /nfs/dbraw/zinc/31/08/59/1141310859.db2.gz KVFVIAMELXTRSY-AWEZNQCLSA-N 1 0 336.432 3.587 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCc2cn[nH]c21 ZINC000271558786 1141397471 /nfs/dbraw/zinc/39/74/71/1141397471.db2.gz WIBDAPHEKCVWEI-ZIAGYGMSSA-N 1 0 346.456 3.856 20 5 EHBDRO C[C@@H](CCO)[N@H+](Cc1ccccc1)Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000283143443 1141561589 /nfs/dbraw/zinc/56/15/89/1141561589.db2.gz ODEZXFGDSVIJJB-AWEZNQCLSA-N 1 0 332.375 3.507 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@H]2C2CCCC2)c2c(c1)COCO2 ZINC000055927962 214348983 /nfs/dbraw/zinc/34/89/83/214348983.db2.gz UBOVJDFPKCQGGJ-KRWDZBQOSA-N 1 0 332.400 3.616 20 5 EHBDRO CC1CC[NH+](Cc2ccc(NC(=O)c3ccc([N+](=O)[O-])o3)cc2)CC1 ZINC000058353277 214558862 /nfs/dbraw/zinc/55/88/62/214558862.db2.gz DZZKDCPLWIKJPD-UHFFFAOYSA-N 1 0 343.383 3.672 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C)Cc2c(C)noc2C)cc1[N+](=O)[O-] ZINC000153894297 1014486591 /nfs/dbraw/zinc/48/65/91/1014486591.db2.gz DOONYQSNLXFHDE-NEPJUHHUSA-N 1 0 347.415 3.880 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](C)[C@H]1CCc2ccccc2C1 ZINC000430196372 1014813580 /nfs/dbraw/zinc/81/35/80/1014813580.db2.gz QYRIGMRLVCSBNC-KRWDZBQOSA-N 1 0 326.396 3.593 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@H+](C3CC3)C3CCCC3)n2)c1 ZINC000064809283 1015006169 /nfs/dbraw/zinc/00/61/69/1015006169.db2.gz XGIGFJMPUBZANM-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@H+](CCc1nccs1)C(C)C ZINC000430211739 1015015695 /nfs/dbraw/zinc/01/56/95/1015015695.db2.gz YLGYCBXLWARXQZ-UHFFFAOYSA-N 1 0 335.429 3.513 20 5 EHBDRO CCC[N@@H+]1CC[C@H](CNc2cccc(Br)c2[N+](=O)[O-])C1 ZINC000692958648 1015034506 /nfs/dbraw/zinc/03/45/06/1015034506.db2.gz YTZSCBZDGPRNJN-LLVKDONJSA-N 1 0 342.237 3.501 20 5 EHBDRO COc1ccc(CCC[N@H+](C)Cc2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000430227362 1015121978 /nfs/dbraw/zinc/12/19/78/1015121978.db2.gz RATJITNYMCZEIB-UHFFFAOYSA-N 1 0 344.411 3.677 20 5 EHBDRO COC(=O)c1ccc(-c2cccc(C[NH2+]C(C)C)c2)c([N+](=O)[O-])c1 ZINC000600784479 1015387213 /nfs/dbraw/zinc/38/72/13/1015387213.db2.gz KKXLBGKGDRNUBI-UHFFFAOYSA-N 1 0 328.368 3.546 20 5 EHBDRO C[NH+]1CCC(CCNc2ccc([N+](=O)[O-])cc2Br)CC1 ZINC000229946657 1015560988 /nfs/dbraw/zinc/56/09/88/1015560988.db2.gz VPVHUXKSJJIZDL-UHFFFAOYSA-N 1 0 342.237 3.501 20 5 EHBDRO CC(=O)N1CC[C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000339762416 1015658169 /nfs/dbraw/zinc/65/81/69/1015658169.db2.gz HUNQPRZUTPSSSP-UGSOOPFHSA-N 1 0 339.395 3.743 20 5 EHBDRO CN(C)[C@@H](CNc1ccsc1[N+](=O)[O-])c1c(F)cccc1F ZINC000609670320 1015827564 /nfs/dbraw/zinc/82/75/64/1015827564.db2.gz QQDZKPAFLJGHSW-LBPRGKRZSA-N 1 0 327.356 3.649 20 5 EHBDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2nc3cc([N+](=O)[O-])ccc3o2)C12CCC2 ZINC000120837072 1016353340 /nfs/dbraw/zinc/35/33/40/1016353340.db2.gz DXSXNWJGDRJLCH-HOTGVXAUSA-N 1 0 345.399 3.516 20 5 EHBDRO CCSc1cc(C[NH2+]C/C=C/c2ccccc2[N+](=O)[O-])ccn1 ZINC000189584556 1016563681 /nfs/dbraw/zinc/56/36/81/1016563681.db2.gz SXVDIDBIFIUOLF-FNORWQNLSA-N 1 0 329.425 3.905 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2CCC[C@@H]2CCO)s1 ZINC000189977508 1016819831 /nfs/dbraw/zinc/81/98/31/1016819831.db2.gz FBGZJOKKGZLXHE-CZUORRHYSA-N 1 0 346.452 3.964 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC2(c3ccccc3)CC2)n1 ZINC000472641064 1016920218 /nfs/dbraw/zinc/92/02/18/1016920218.db2.gz ZPLJKMCXSMCHDY-DLBZAZTESA-N 1 0 340.427 3.596 20 5 EHBDRO C[C@@H]1C[C@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)[C@H](C)O1 ZINC000414523193 1016952369 /nfs/dbraw/zinc/95/23/69/1016952369.db2.gz YAYBXJLDQCPTRX-HZSPNIEDSA-N 1 0 330.384 3.758 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1OC ZINC000538169635 1032192499 /nfs/dbraw/zinc/19/24/99/1032192499.db2.gz XSUMPWLLRVXKCV-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@@H+]1CC[C@](C)(C(=O)OC(C)(C)C)C1 ZINC000459593526 1032315011 /nfs/dbraw/zinc/31/50/11/1032315011.db2.gz VOYBOPWMXNVOAE-UGSOOPFHSA-N 1 0 334.416 3.710 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H]1COc2ccccc21 ZINC000449202502 1032327038 /nfs/dbraw/zinc/32/70/38/1032327038.db2.gz FSIXXPHKJNQNDD-CPUCHLNUSA-N 1 0 326.396 3.680 20 5 EHBDRO C[C@@H]1CCCC[C@@]1(C)[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000459615517 1032353085 /nfs/dbraw/zinc/35/30/85/1032353085.db2.gz PEABAZIOVPVEOP-SJKOYZFVSA-N 1 0 330.388 3.703 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](CCO)c1ccc(Cl)cc1 ZINC000449330401 1032442302 /nfs/dbraw/zinc/44/23/02/1032442302.db2.gz KZZMKAXMGAUWBV-DYVFJYSZSA-N 1 0 348.830 3.893 20 5 EHBDRO CCC[C@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1C)C1CCC1 ZINC000459809525 1032473487 /nfs/dbraw/zinc/47/34/87/1032473487.db2.gz STBLSYGCUSGJAU-BBRMVZONSA-N 1 0 333.432 3.789 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2[C@@H]2CCC[C@@H]2O)cc1[N+](=O)[O-] ZINC000449455722 1032572986 /nfs/dbraw/zinc/57/29/86/1032572986.db2.gz AYGAGOZIRAVEET-SCTDSRPQSA-N 1 0 332.444 3.844 20 5 EHBDRO CC(C)c1ccc(C[N@@H+]2CCC[C@@H]2[C@H]2CCC[C@H]2O)cc1[N+](=O)[O-] ZINC000449455724 1032573102 /nfs/dbraw/zinc/57/31/02/1032573102.db2.gz AYGAGOZIRAVEET-ZHALLVOQSA-N 1 0 332.444 3.844 20 5 EHBDRO COc1ncc(C[NH2+][C@@H](C)CCc2ccccc2[N+](=O)[O-])cc1Cl ZINC000449461809 1032610354 /nfs/dbraw/zinc/61/03/54/1032610354.db2.gz RQZNDLWOVCNFNM-LBPRGKRZSA-N 1 0 349.818 3.763 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]([C@H](CO)C2CC2)C2CC2)cc1[N+](=O)[O-] ZINC000449505097 1032688450 /nfs/dbraw/zinc/68/84/50/1032688450.db2.gz JSIUNAXSRPMTGO-IEBWSBKVSA-N 1 0 332.444 3.605 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(c2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000610274785 1017271800 /nfs/dbraw/zinc/27/18/00/1017271800.db2.gz ATAJIFIBPZZSAG-UHFFFAOYSA-N 1 0 343.374 3.507 20 5 EHBDRO CC(C)c1ccc(CN2CCCC[C@@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057906 1017469339 /nfs/dbraw/zinc/46/93/39/1017469339.db2.gz VFAHMMGSIDBCSU-SJLPKXTDSA-N 1 0 331.460 3.682 20 5 EHBDRO CN(C[C@H]1CC[N@H+](Cc2ccccc2)C1)c1ccc([N+](=O)[O-])s1 ZINC000610285191 1017660513 /nfs/dbraw/zinc/66/05/13/1017660513.db2.gz GCTQECZVPBZVIV-OAHLLOKOSA-N 1 0 331.441 3.615 20 5 EHBDRO Cc1ccncc1C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449527130 1032726982 /nfs/dbraw/zinc/72/69/82/1032726982.db2.gz ZRIOXFGTMBTBKR-QAPCUYQASA-N 1 0 325.412 3.799 20 5 EHBDRO Cc1ccncc1C[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000449527128 1032728779 /nfs/dbraw/zinc/72/87/79/1032728779.db2.gz ZRIOXFGTMBTBKR-CRAIPNDOSA-N 1 0 325.412 3.799 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)CCc1ccccc1 ZINC000468609993 1018128977 /nfs/dbraw/zinc/12/89/77/1018128977.db2.gz RKPWNVYBEWCXTP-WNJRYGEDSA-N 1 0 340.423 3.581 20 5 EHBDRO Cn1ccnc1[C@H]([NH2+]CC1CCC(F)CC1)c1cccc([N+](=O)[O-])c1 ZINC000592400519 1032758791 /nfs/dbraw/zinc/75/87/91/1032758791.db2.gz VGCIKJASSXMLPX-PUJMQQBBSA-N 1 0 346.406 3.536 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NC[C@@H]2CCC[C@@H]([NH3+])C2)cc1[N+](=O)[O-] ZINC000415689166 1018398489 /nfs/dbraw/zinc/39/84/89/1018398489.db2.gz CQTOIBLONXCGCX-CHWSQXEVSA-N 1 0 348.447 3.531 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CCn1cnc2ccccc21 ZINC000468625030 1018466224 /nfs/dbraw/zinc/46/62/24/1018466224.db2.gz JAUWPZBTWXYJBI-PTNGSMBKSA-N 1 0 336.395 3.638 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000610367962 1018536156 /nfs/dbraw/zinc/53/61/56/1018536156.db2.gz SAAWRGAYDFTKDR-ZACQAIPSSA-N 1 0 337.423 3.724 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)CCCOc2ccc([N+](=O)[O-])cc2)C1 ZINC000610371726 1018548428 /nfs/dbraw/zinc/54/84/28/1018548428.db2.gz KNYDTKVMPGRTCO-NVXWUHKLSA-N 1 0 338.473 3.970 20 5 EHBDRO C[C@H](c1ccccc1F)N(C)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000052074220 1018724783 /nfs/dbraw/zinc/72/47/83/1018724783.db2.gz RRQMJPWAWAWJMH-GFCCVEGCSA-N 1 0 346.358 3.793 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)Nc2cc([N+](=O)[O-])ccc2C)cc1 ZINC000182329529 1019065351 /nfs/dbraw/zinc/06/53/51/1019065351.db2.gz PFXCSDVMEBZKFF-AWEZNQCLSA-N 1 0 327.384 3.501 20 5 EHBDRO CC[NH+](CC)Cc1ccc(C(=O)Nc2cccc([N+](=O)[O-])c2C)cc1 ZINC000047904181 1019313486 /nfs/dbraw/zinc/31/34/86/1019313486.db2.gz DFZSETIZNLZSTO-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO CCCC[N@H+](C)CC1CCN(c2c(OC)cccc2[N+](=O)[O-])CC1 ZINC000580481949 1019453903 /nfs/dbraw/zinc/45/39/03/1019453903.db2.gz ZBBQAOOPCSJBTO-UHFFFAOYSA-N 1 0 335.448 3.552 20 5 EHBDRO CN(c1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1C[C@H]2CC[C@@H](C1)[N@H+]2C ZINC000574065296 1019502333 /nfs/dbraw/zinc/50/23/33/1019502333.db2.gz LOQVUVJOLKPZSN-FUNVUKJBSA-N 1 0 343.349 3.675 20 5 EHBDRO [NH3+]C1(c2noc(-c3cc4cc([N+](=O)[O-])ccc4s3)n2)CCCC1 ZINC000261789937 1019537847 /nfs/dbraw/zinc/53/78/47/1019537847.db2.gz OLEUQUQVLXSTOG-UHFFFAOYSA-N 1 0 330.369 3.588 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H]3CC[NH2+][C@H]3C2)s1 ZINC000592432847 1032838670 /nfs/dbraw/zinc/83/86/70/1032838670.db2.gz YTLGLAWOHORDRX-BBRMVZONSA-N 1 0 343.452 3.507 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CC[C@@H]3CC[NH2+][C@@H]3C2)s1 ZINC000592432850 1032838852 /nfs/dbraw/zinc/83/88/52/1032838852.db2.gz YTLGLAWOHORDRX-XJKSGUPXSA-N 1 0 343.452 3.507 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CC[C@@H]4CC[NH2+][C@@H]4C3)s2)cc1 ZINC000592432488 1032838887 /nfs/dbraw/zinc/83/88/87/1032838887.db2.gz LDEJTRDHFIQZND-SUMWQHHRSA-N 1 0 343.452 3.507 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]2c2ccc3c(c2)OCO3)cc1[N+](=O)[O-] ZINC000513380834 1019585722 /nfs/dbraw/zinc/58/57/22/1019585722.db2.gz MODKPCPFXTYVOC-INIZCTEOSA-N 1 0 340.379 3.969 20 5 EHBDRO CCCCNC(=O)[C@@H]1CCC[N@@H+]([C@@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000182718412 1019738654 /nfs/dbraw/zinc/73/86/54/1019738654.db2.gz LAWUPBSGLNPYMT-JKSUJKDBSA-N 1 0 347.459 3.593 20 5 EHBDRO CC(C)C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000119357896 1020269673 /nfs/dbraw/zinc/26/96/73/1020269673.db2.gz ZCDZDAZSBLDCGY-AWEZNQCLSA-N 1 0 344.415 3.903 20 5 EHBDRO CCC(C)(C)[C@@H]1CCC[N@@H+]1Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000156732586 1020295926 /nfs/dbraw/zinc/29/59/26/1020295926.db2.gz MLFOGKKNULEIAK-INIZCTEOSA-N 1 0 334.416 3.862 20 5 EHBDRO CCC[C@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000548160618 1020764760 /nfs/dbraw/zinc/76/47/60/1020764760.db2.gz BMDGXWHHBJPVNF-HOCLYGCPSA-N 1 0 333.432 3.790 20 5 EHBDRO COc1cc(NC[C@@H](C)[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000361029390 1020892043 /nfs/dbraw/zinc/89/20/43/1020892043.db2.gz HBDLOIFIXAANJD-CQSZACIVSA-N 1 0 329.400 3.536 20 5 EHBDRO C[C@H]([NH2+]CC1([C@H](O)c2ccccc2)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000090771176 1020914851 /nfs/dbraw/zinc/91/48/51/1020914851.db2.gz PYWXQVHFQFZKOP-KBXCAEBGSA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@H+](CCC(F)(F)F)CC1CC1 ZINC000084137481 1021006013 /nfs/dbraw/zinc/00/60/13/1021006013.db2.gz QIEHXZZIWALVDS-UHFFFAOYSA-N 1 0 332.322 3.638 20 5 EHBDRO C[C@@H]1CN(Cc2cccc([N+](=O)[O-])c2)C[C@H](c2ccc(F)cc2)O1 ZINC000126664103 1021162460 /nfs/dbraw/zinc/16/24/60/1021162460.db2.gz QVRIKYISBNAMNH-FZKQIMNGSA-N 1 0 330.359 3.696 20 5 EHBDRO CCc1ccc([C@@H](CO)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000090843966 1021204965 /nfs/dbraw/zinc/20/49/65/1021204965.db2.gz PXHKHZGMRMXUJL-RDTXWAMCSA-N 1 0 328.412 3.850 20 5 EHBDRO CCc1ccc([C@@H](CO)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000090843860 1021205467 /nfs/dbraw/zinc/20/54/67/1021205467.db2.gz WVMPODGBMSDPQC-KBXCAEBGSA-N 1 0 328.412 3.850 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@@H]3CCOC4(CCCCC4)C3)nc2c1 ZINC000602569537 1032977404 /nfs/dbraw/zinc/97/74/04/1032977404.db2.gz SXMFKDWCVWNYFS-CYBMUJFWSA-N 1 0 345.399 3.708 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@H]2Cc3ccccc3N(C)C2)cc1[N+](=O)[O-] ZINC000437074599 1021527317 /nfs/dbraw/zinc/52/73/17/1021527317.db2.gz DEBPLANPCNMCMX-HZPDHXFCSA-N 1 0 339.439 3.863 20 5 EHBDRO O=[N+]([O-])c1cccc(CC[NH2+][C@H](C[C@@H]2CCOC2)c2ccccc2)c1 ZINC000090910179 1021715181 /nfs/dbraw/zinc/71/51/81/1021715181.db2.gz WKUQHDNZVNBUFY-FXAWDEMLSA-N 1 0 340.423 3.895 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC[C@H]([C@H]2CCOC2)C1 ZINC000441295805 1022138907 /nfs/dbraw/zinc/13/89/07/1022138907.db2.gz UATQVSYPTUBEPB-HOTGVXAUSA-N 1 0 348.443 3.631 20 5 EHBDRO COc1cccc2c1CC[C@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000425934804 1022266924 /nfs/dbraw/zinc/26/69/24/1022266924.db2.gz ATWQDPNNCCLJTF-CJNGLKHVSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NCC2CCN(c3cc[nH+]cc3)CC2)c1 ZINC000357211398 1022376845 /nfs/dbraw/zinc/37/68/45/1022376845.db2.gz UMOMNIDVWGXZOY-UHFFFAOYSA-N 1 0 326.400 3.627 20 5 EHBDRO NC(=[NH2+])N(c1ccc(F)cc1)c1cc(Cl)ccc1/C=C/[N+](=O)[O-] ZINC001167994561 1022416299 /nfs/dbraw/zinc/41/62/99/1022416299.db2.gz LUASYHMKBOZEEE-BQYQJAHWSA-N 1 0 334.738 3.758 20 5 EHBDRO CCN(Cc1nc2cc([N+](=O)[O-])ccc2o1)[C@@H](C)c1cccnc1 ZINC000602668898 1033066447 /nfs/dbraw/zinc/06/64/47/1033066447.db2.gz VHLGIAWDNMKPOQ-LBPRGKRZSA-N 1 0 326.356 3.714 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000042977342 1022626949 /nfs/dbraw/zinc/62/69/49/1022626949.db2.gz BKNULRIDVOZZLR-UHFFFAOYSA-N 1 0 342.395 3.874 20 5 EHBDRO Cc1ccccc1[C@H]1C[N@H+](CCc2ccc([N+](=O)[O-])cc2)[C@H](C)CO1 ZINC000441440475 1022802737 /nfs/dbraw/zinc/80/27/37/1022802737.db2.gz QFFDFVFOIBGWQN-OXQOHEQNSA-N 1 0 340.423 3.908 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1 ZINC000894751083 1022848483 /nfs/dbraw/zinc/84/84/83/1022848483.db2.gz JTBIRZYWLVMMOJ-RHSMWYFYSA-N 1 0 347.802 3.653 20 5 EHBDRO Cc1cc(C)c(-n2cc(CC[NH3+])c3cc(O)ccc32)c(C)c1[N+](=O)[O-] ZINC001167983562 1022929533 /nfs/dbraw/zinc/92/95/33/1022929533.db2.gz SUEQSIQXYCMPSS-UHFFFAOYSA-N 1 0 339.395 3.671 20 5 EHBDRO COc1ccc(OCC[NH2+]C2(c3ccccc3)CCC2)c([N+](=O)[O-])c1 ZINC000438711444 1022943951 /nfs/dbraw/zinc/94/39/51/1022943951.db2.gz CMWHXOQNTMXUFQ-UHFFFAOYSA-N 1 0 342.395 3.651 20 5 EHBDRO Cc1cc(C[NH2+]Cc2ccccc2[N+](=O)[O-])ccc1Br ZINC000091469938 1022945942 /nfs/dbraw/zinc/94/59/42/1022945942.db2.gz LPPOGGOPZBVUAB-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1N[C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294274944 1023001198 /nfs/dbraw/zinc/00/11/98/1023001198.db2.gz MBCVAPKITFRWCY-ZDUSSCGKSA-N 1 0 328.416 3.720 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCOc2c(F)cccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000294276909 1023001381 /nfs/dbraw/zinc/00/13/81/1023001381.db2.gz MDBADDREWMJFDP-ZBEGNZNMSA-N 1 0 345.374 3.881 20 5 EHBDRO CC(C)C1(C)CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000426743253 1023012804 /nfs/dbraw/zinc/01/28/04/1023012804.db2.gz NMLPGUNSGGKIBB-UHFFFAOYSA-N 1 0 344.415 3.903 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1CNC[C@@]1([NH+](C)C)CCC[C@H](C)C1 ZINC000509572847 1023070209 /nfs/dbraw/zinc/07/02/09/1023070209.db2.gz RTKPSLLWLUBUHV-HNAYVOBHSA-N 1 0 349.475 3.594 20 5 EHBDRO CC(C)(O)C(C)(C)C[NH2+]Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000449719776 1033106195 /nfs/dbraw/zinc/10/61/95/1033106195.db2.gz HVEKBPYPOFZMNH-UHFFFAOYSA-N 1 0 332.400 3.742 20 5 EHBDRO C[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccncc1 ZINC000610830987 1023781255 /nfs/dbraw/zinc/78/12/55/1023781255.db2.gz YZCPGTWOHQOATF-KBXCAEBGSA-N 1 0 325.412 3.704 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818772 1023782208 /nfs/dbraw/zinc/78/22/08/1023782208.db2.gz ANXJIQKRIDBXGR-VXGBXAGGSA-N 1 0 340.383 3.897 20 5 EHBDRO COCC[C@@H](c1ccccc1)[N@@H+]1CCc2ccc([N+](=O)[O-])cc2C1 ZINC000535822704 1023787657 /nfs/dbraw/zinc/78/76/57/1023787657.db2.gz PSQAVTCVVWMLOY-IBGZPJMESA-N 1 0 326.396 3.731 20 5 EHBDRO Cc1cc(NC(=O)c2ccc([N+](=O)[O-])cc2C)ccc1C[NH+](C)C ZINC000458296483 1023856175 /nfs/dbraw/zinc/85/61/75/1023856175.db2.gz XWTKOJHXQNKZSP-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO Cc1ccc([C@H](CNc2c(F)cccc2[N+](=O)[O-])[NH+]2CCCC2)o1 ZINC000342098523 1023953023 /nfs/dbraw/zinc/95/30/23/1023953023.db2.gz SFGGFGBGRWVOKF-HNNXBMFYSA-N 1 0 333.363 3.884 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C)C2 ZINC000164539592 1023959884 /nfs/dbraw/zinc/95/98/84/1023959884.db2.gz JFAQQBAMECGJNX-ZFWWWQNUSA-N 1 0 342.395 3.566 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](C)c1cc2ccccc2s1 ZINC000602807580 1033180209 /nfs/dbraw/zinc/18/02/09/1033180209.db2.gz BLQZJIWTUUMLTF-LLVKDONJSA-N 1 0 330.413 3.665 20 5 EHBDRO CC(C)[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000522298920 1024185001 /nfs/dbraw/zinc/18/50/01/1024185001.db2.gz LQZGSNVIGAHHSR-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO CCOC(=O)CC1([NH2+]Cc2c(Cl)cccc2[N+](=O)[O-])CCCC1 ZINC000434612795 1024194917 /nfs/dbraw/zinc/19/49/17/1024194917.db2.gz WREIKNQPHSDACF-UHFFFAOYSA-N 1 0 340.807 3.604 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2cnc(CC[N@@H+]3CC[C@@H](CC4CC4)C3)o2)c1 ZINC000550422500 1024195707 /nfs/dbraw/zinc/19/57/07/1024195707.db2.gz LYFWELVGRCCSSF-HNNXBMFYSA-N 1 0 341.411 3.914 20 5 EHBDRO CC(C)c1ccc(CN2C[C@@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000520600161 1024210476 /nfs/dbraw/zinc/21/04/76/1024210476.db2.gz GMWQQZNNNBJHNE-MOPGFXCFSA-N 1 0 330.428 3.862 20 5 EHBDRO CC(C)c1ccc(CN2C[C@]3(CCCO3)[C@H]2C2CC2)cc1[N+](=O)[O-] ZINC000520600164 1024211899 /nfs/dbraw/zinc/21/18/99/1024211899.db2.gz GMWQQZNNNBJHNE-RTBURBONSA-N 1 0 330.428 3.862 20 5 EHBDRO O=C(c1cc2ccccc2c2cccnc12)N1CCC[N@@H+]2CCC[C@H]2C1 ZINC000141537300 1024230767 /nfs/dbraw/zinc/23/07/67/1024230767.db2.gz PMYXDJUCNFOHLA-KRWDZBQOSA-N 1 0 345.446 3.698 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@H](C)C1 ZINC000119456431 1024260912 /nfs/dbraw/zinc/26/09/12/1024260912.db2.gz BKIHHQNVFDFWMQ-LALPHHSUSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+]Cc2ncc(Cl)s2)cc1 ZINC000472047742 1024495545 /nfs/dbraw/zinc/49/55/45/1024495545.db2.gz MDCBEBKUNKEBKW-UHFFFAOYSA-N 1 0 325.821 3.817 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C ZINC000472057782 1024524342 /nfs/dbraw/zinc/52/43/42/1024524342.db2.gz LSCDUXZFOYUGDB-KXBFYZLASA-N 1 0 327.428 3.684 20 5 EHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000472057356 1024528837 /nfs/dbraw/zinc/52/88/37/1024528837.db2.gz HNMRHJUUVMMZJR-YHAFJJQESA-N 1 0 339.439 3.889 20 5 EHBDRO CC(=O)c1ccc(NC[C@H](c2cccc(F)c2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000024107783 1024594695 /nfs/dbraw/zinc/59/46/95/1024594695.db2.gz AEHKRXGFRBJTLP-GOSISDBHSA-N 1 0 345.374 3.651 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCSC[C@@H]23)c(C(F)F)c1 ZINC000895567678 1024624373 /nfs/dbraw/zinc/62/43/73/1024624373.db2.gz GQVFMDOQZNHBDC-KGLIPLIRSA-N 1 0 343.399 3.524 20 5 EHBDRO COc1ccc([C@@H](OC)[C@@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000538966779 1024642481 /nfs/dbraw/zinc/64/24/81/1024642481.db2.gz DTTOHDIPUWORFE-KUHUBIRLSA-N 1 0 344.411 3.778 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@H]2Cc2ccccc2)cc1 ZINC000065532897 1024661741 /nfs/dbraw/zinc/66/17/41/1024661741.db2.gz YWPAAMDCLTYHFG-SFHVURJKSA-N 1 0 326.396 3.681 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)[C@@H](O)Cc1ccccc1 ZINC000539050221 1024695110 /nfs/dbraw/zinc/69/51/10/1024695110.db2.gz HKVCNBDAQXMGNB-DOXZYTNZSA-N 1 0 328.412 3.546 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](Cc2ccccc2)C[C@@H]2CCCO2)c1 ZINC000053221413 1024988752 /nfs/dbraw/zinc/98/87/52/1024988752.db2.gz HKXQARNNDUIZHN-IBGZPJMESA-N 1 0 326.396 3.776 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc([N+](=O)[O-])c2ncccc12)c1cccs1 ZINC000346695437 1025019065 /nfs/dbraw/zinc/01/90/65/1025019065.db2.gz BPNAAHQFPVMOMR-OAHLLOKOSA-N 1 0 342.424 3.919 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](C)N2CCC[C@@H](C)C2)cc1[N+](=O)[O-] ZINC000520948059 1025134765 /nfs/dbraw/zinc/13/47/65/1025134765.db2.gz QHTVJEGMJLQFPD-CVEARBPZSA-N 1 0 333.476 3.928 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2cc(O)cc(C(F)(F)F)c2)cc1 ZINC000521319593 1025328584 /nfs/dbraw/zinc/32/85/84/1025328584.db2.gz BXRZTXGGORUVOP-UHFFFAOYSA-N 1 0 340.301 3.652 20 5 EHBDRO O=[N+]([O-])c1cccc(F)c1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@@H]1O ZINC000438996709 1025384613 /nfs/dbraw/zinc/38/46/13/1025384613.db2.gz PPOLSGIVJKGAMM-QBIMZIAESA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(c2ncccc2Cl)C1)c1cccc([N+](=O)[O-])c1 ZINC000119915690 1025423903 /nfs/dbraw/zinc/42/39/03/1025423903.db2.gz WBKHTYLKQJVHKU-TZMCWYRMSA-N 1 0 346.818 3.573 20 5 EHBDRO C[C@@H]([NH3+])[C@H]1CCCCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000347113921 1025521395 /nfs/dbraw/zinc/52/13/95/1025521395.db2.gz SPCNAGMJLLIOHY-CXAGYDPISA-N 1 0 329.400 3.557 20 5 EHBDRO CC1CC[NH+](CCCNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436273826 1025544367 /nfs/dbraw/zinc/54/43/67/1025544367.db2.gz VJMQOSJXONSGFV-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436310857 1025572002 /nfs/dbraw/zinc/57/20/02/1025572002.db2.gz JBJMUIWZPPBABV-UHFFFAOYSA-N 1 0 346.353 3.683 20 5 EHBDRO CCC[NH+]1CCC(CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])CC1 ZINC000436386519 1025653413 /nfs/dbraw/zinc/65/34/13/1025653413.db2.gz PIYNBDKBZGTUEK-UHFFFAOYSA-N 1 0 346.353 3.543 20 5 EHBDRO CCOc1cc(C[N@@H+]2C[C@H](C)C[C@@H]2c2cccnc2)ccc1[N+](=O)[O-] ZINC000347213769 1025683376 /nfs/dbraw/zinc/68/33/76/1025683376.db2.gz WFIMYFNFGPIAOV-RDTXWAMCSA-N 1 0 341.411 3.972 20 5 EHBDRO CC[C@@H]1CCC[N@@H+](C(C)(C)CNC(=O)c2ccc([N+](=O)[O-])cc2C)C1 ZINC000521982339 1025854778 /nfs/dbraw/zinc/85/47/78/1025854778.db2.gz JSXQTTGSOWCTNT-OAHLLOKOSA-N 1 0 347.459 3.534 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CCCC[C@@H]2O)s1 ZINC000074371281 1025919269 /nfs/dbraw/zinc/91/92/69/1025919269.db2.gz CMMIPSNUZWRCMZ-HOCLYGCPSA-N 1 0 332.425 3.716 20 5 EHBDRO CCC[C@@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)C(C)(C)C ZINC000451414560 1025948526 /nfs/dbraw/zinc/94/85/26/1025948526.db2.gz DKUJGGWMKARFBU-CQSZACIVSA-N 1 0 332.404 3.949 20 5 EHBDRO C[NH+](C)Cc1ccc(-c2noc(-c3cc(F)cc([N+](=O)[O-])c3)n2)cc1 ZINC000530632150 1026139454 /nfs/dbraw/zinc/13/94/54/1026139454.db2.gz HXMNGGDLAVPAEX-UHFFFAOYSA-N 1 0 342.330 3.513 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)c1 ZINC000452089775 1026484465 /nfs/dbraw/zinc/48/44/65/1026484465.db2.gz QBIJSKQZSVVYNP-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO CCN(CC)[C@H](C)C[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000475335968 1026490736 /nfs/dbraw/zinc/49/07/36/1026490736.db2.gz NNDGMKYYZYGJOB-SOLBZPMBSA-N 1 0 333.476 3.626 20 5 EHBDRO CC(C)[NH+](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])C(C)C ZINC000323773666 1027087427 /nfs/dbraw/zinc/08/74/27/1027087427.db2.gz AMIGICFBYDASCX-UHFFFAOYSA-N 1 0 334.342 3.539 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2Cc3ccccc3O2)cc1[N+](=O)[O-] ZINC000520213272 1027179929 /nfs/dbraw/zinc/17/99/29/1027179929.db2.gz RRADONZBWUKKHB-MRXNPFEDSA-N 1 0 326.396 3.812 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](CO)Cc2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000531696810 1027216647 /nfs/dbraw/zinc/21/66/47/1027216647.db2.gz GWFGURLWGGXKER-GDBMZVCRSA-N 1 0 346.402 3.544 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](CCO)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000178652595 1027374006 /nfs/dbraw/zinc/37/40/06/1027374006.db2.gz BUWFDUQOMSHNAZ-IEBWSBKVSA-N 1 0 328.412 3.802 20 5 EHBDRO CCCOc1ccc(OCC[N@H+](C)Cc2ccccc2[N+](=O)[O-])cc1 ZINC000501777149 1027530073 /nfs/dbraw/zinc/53/00/73/1027530073.db2.gz OOFKEZZPSDTXEN-UHFFFAOYSA-N 1 0 344.411 3.894 20 5 EHBDRO COc1cccc([N+](=O)[O-])c1NC[C@H](c1ccco1)[NH+]1CCCCC1 ZINC000582756048 1027587216 /nfs/dbraw/zinc/58/72/16/1027587216.db2.gz PPAKVLCOQBJQTG-OAHLLOKOSA-N 1 0 345.399 3.836 20 5 EHBDRO C[C@]1(CCCO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000293730633 1027702929 /nfs/dbraw/zinc/70/29/29/1027702929.db2.gz GQOASDHPUHAUGJ-OAHLLOKOSA-N 1 0 346.349 3.741 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN3CCC4(CC[NH2+]4)CC3)s2)cc1 ZINC000422565712 1027791647 /nfs/dbraw/zinc/79/16/47/1027791647.db2.gz ZTPWEJFJJNDLFO-UHFFFAOYSA-N 1 0 343.452 3.651 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC2(C1)CCCCC2 ZINC000533426698 1027854993 /nfs/dbraw/zinc/85/49/93/1027854993.db2.gz GJQCLZLIMIRAFS-AWEZNQCLSA-N 1 0 331.416 3.578 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1C(C)(C)C ZINC000533428500 1027861622 /nfs/dbraw/zinc/86/16/22/1027861622.db2.gz VQKGHSRLEZVXDS-MRXNPFEDSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)cccc1[N+](=O)[O-] ZINC000612174605 1027913325 /nfs/dbraw/zinc/91/33/25/1027913325.db2.gz PAXKWOZKTIINHY-KRWDZBQOSA-N 1 0 330.359 3.696 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@H]2CCCC23CCOCC3)cc1 ZINC000502266837 1028019300 /nfs/dbraw/zinc/01/93/00/1028019300.db2.gz GFIWAFKDCYBYLI-SFHVURJKSA-N 1 0 332.444 3.856 20 5 EHBDRO CCCn1nccc1C1CC[NH+](Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000502299212 1028075906 /nfs/dbraw/zinc/07/59/06/1028075906.db2.gz HDUFOVNEXDXUSG-UHFFFAOYSA-N 1 0 342.443 3.889 20 5 EHBDRO C[C@@H]1C[C@H](c2ccccc2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648634 1028111578 /nfs/dbraw/zinc/11/15/78/1028111578.db2.gz HKHOHHZCBJCWGN-HIFRSBDPSA-N 1 0 336.395 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@@H]3CCC[C@H]3c3ccccc3)nc2c1 ZINC000444684583 1028156622 /nfs/dbraw/zinc/15/66/22/1028156622.db2.gz NDPWTPLOQVIPRX-JKSUJKDBSA-N 1 0 336.395 3.897 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2c3cc(C)ccc3C[C@@H]2C)cc1[N+](=O)[O-] ZINC000503900631 1028193704 /nfs/dbraw/zinc/19/37/04/1028193704.db2.gz HPYCWOSYKKAOLL-ORAYPTAESA-N 1 0 326.396 3.935 20 5 EHBDRO CC[C@@](O)(CCC(F)(F)F)C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-] ZINC000897522090 1028218114 /nfs/dbraw/zinc/21/81/14/1028218114.db2.gz LGVUPMFRAJGOJA-KEDPEKRHSA-N 1 0 346.349 3.681 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1CCC[C@@H](C(C)C)C1 ZINC000444774973 1028262630 /nfs/dbraw/zinc/26/26/30/1028262630.db2.gz YXPJXOJFDNRTFF-OAHLLOKOSA-N 1 0 333.432 3.600 20 5 EHBDRO CCC([NH3+])(CC)CN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000423287761 1028326210 /nfs/dbraw/zinc/32/62/10/1028326210.db2.gz OJRLQXHMLZDCRT-GOSISDBHSA-N 1 0 327.428 3.791 20 5 EHBDRO C[C@@H]1CC[C@@H](O)C[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000421378347 1028339942 /nfs/dbraw/zinc/33/99/42/1028339942.db2.gz SSIVQKICXJSSMZ-IUODEOHRSA-N 1 0 332.425 3.669 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@@H]2CCCC(F)(F)C2)n1 ZINC000502593275 1028410404 /nfs/dbraw/zinc/41/04/04/1028410404.db2.gz BVXHXZCGFCPGRB-MGPQQGTHSA-N 1 0 342.390 3.690 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000016419803 1028436594 /nfs/dbraw/zinc/43/65/94/1028436594.db2.gz JKZDDISUZZNVNM-CQSZACIVSA-N 1 0 330.384 3.675 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1C(=O)Nc1ccc(CC[NH+](C)C)cc1 ZINC000421478997 1028485965 /nfs/dbraw/zinc/48/59/65/1028485965.db2.gz XSWWBXSLKKULMP-UHFFFAOYSA-N 1 0 341.411 3.568 20 5 EHBDRO C[C@@H]1CC[C@H](C)[N@H+]1[C@H]1CCCN(Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000344615676 1028488038 /nfs/dbraw/zinc/48/80/38/1028488038.db2.gz ZTVQYZUBZNPVGL-ZNMIVQPWSA-N 1 0 335.423 3.571 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)C(C)(C)C ZINC000546307375 1028558319 /nfs/dbraw/zinc/55/83/19/1028558319.db2.gz DQVQYPZPFIMRHE-XJKSGUPXSA-N 1 0 340.489 3.852 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+][C@H](CO)c1ccccc1 ZINC000130206263 1028775598 /nfs/dbraw/zinc/77/55/98/1028775598.db2.gz QVVRQNNWCZEGAY-BHIYHBOVSA-N 1 0 340.423 3.629 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCn1cnc2ccccc21 ZINC000161555868 1028995614 /nfs/dbraw/zinc/99/56/14/1028995614.db2.gz YRTIHWGKCDZUSJ-HNNXBMFYSA-N 1 0 338.411 3.994 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2C[C@H](OCC)C23CCC3)cc1[N+](=O)[O-] ZINC000504917983 1029044414 /nfs/dbraw/zinc/04/44/14/1029044414.db2.gz FLBQAAJDUXLONC-VHSSKADRSA-N 1 0 348.443 3.992 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCCCC1 ZINC000504925833 1029069883 /nfs/dbraw/zinc/06/98/83/1029069883.db2.gz FTHWKOQZBWPFQN-HNNXBMFYSA-N 1 0 337.489 3.541 20 5 EHBDRO CC[C@H](C)[C@@H](C)[N@H+](CC(=O)Nc1c(C)cccc1[N+](=O)[O-])C1CC1 ZINC000533288259 1029578729 /nfs/dbraw/zinc/57/87/29/1029578729.db2.gz WUFPQVPSYZPABD-GXTWGEPZSA-N 1 0 333.432 3.741 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000192376042 1029637605 /nfs/dbraw/zinc/63/76/05/1029637605.db2.gz NXMMWGCFWAOERS-YRCFHQPNSA-N 1 0 338.407 3.975 20 5 EHBDRO CCO[C@@H]1C[C@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407736 1029839193 /nfs/dbraw/zinc/83/91/93/1029839193.db2.gz HLAMISMXLMIVHU-LSDHHAIUSA-N 1 0 326.824 3.884 20 5 EHBDRO COc1ccc(OCC[N@H+](Cc2ccccc2)C(C)C)c([N+](=O)[O-])c1 ZINC000441183873 1029880962 /nfs/dbraw/zinc/88/09/62/1029880962.db2.gz SYHCEAOPKSNSCW-UHFFFAOYSA-N 1 0 344.411 3.893 20 5 EHBDRO Cc1cccc([C@@H](C)[NH+]2CCN(c3cccc([N+](=O)[O-])c3)CC2)c1 ZINC000441207062 1029963276 /nfs/dbraw/zinc/96/32/76/1029963276.db2.gz XSTOQIZMMJLASI-MRXNPFEDSA-N 1 0 325.412 3.786 20 5 EHBDRO CC(C)[C@@H](O)CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000525697783 1030030689 /nfs/dbraw/zinc/03/06/89/1030030689.db2.gz UWFMIHDNHLPYBE-INIZCTEOSA-N 1 0 334.441 3.820 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C1CCN(C(=O)OC)CC1)c1cccc([N+](=O)[O-])c1 ZINC000186752359 1030067511 /nfs/dbraw/zinc/06/75/11/1030067511.db2.gz HRFBDDHIDQYCFK-GUYCJALGSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCOC3(CCC3)C1)CCC2 ZINC000453308529 1030079047 /nfs/dbraw/zinc/07/90/47/1030079047.db2.gz CQYAHZQDBMGJPG-RDTXWAMCSA-N 1 0 330.428 3.911 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC2(CC)COC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453351688 1030143343 /nfs/dbraw/zinc/14/33/43/1030143343.db2.gz GWYATMZCQMXIHI-SFHVURJKSA-N 1 0 344.411 3.856 20 5 EHBDRO CCOc1ccc([C@H](C)[N@@H+]2CCC[C@@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365340 1030180077 /nfs/dbraw/zinc/18/00/77/1030180077.db2.gz LVARIAAIFKWXAN-KBXCAEBGSA-N 1 0 334.416 3.557 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]CCc2cccc(Cl)c2)n1 ZINC000447519120 1030241555 /nfs/dbraw/zinc/24/15/55/1030241555.db2.gz XSZNLTNZEZWXHC-CVEARBPZSA-N 1 0 348.834 3.761 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1C ZINC000531993683 1030243303 /nfs/dbraw/zinc/24/33/03/1030243303.db2.gz VTISKKHYAUCHDG-RDJZCZTQSA-N 1 0 328.412 3.812 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1cccs1 ZINC000447529081 1030250724 /nfs/dbraw/zinc/25/07/24/1030250724.db2.gz LBMPAUBUZRGHTB-KBPBESRZSA-N 1 0 348.472 3.904 20 5 EHBDRO C[C@H]([NH2+]CCCc1ccc2c(c1)CCO2)c1cccc([N+](=O)[O-])c1 ZINC000482233357 1030274352 /nfs/dbraw/zinc/27/43/52/1030274352.db2.gz XEUUHHXIKAWVKB-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@@H]1CCCCN1C1CC1)C1CC1 ZINC000447592413 1030328125 /nfs/dbraw/zinc/32/81/25/1030328125.db2.gz LJEWLIJSKMNBDD-RBUKOAKNSA-N 1 0 343.471 3.522 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2ccccc2)C2(CO)CCCC2)c1 ZINC000453614345 1030404992 /nfs/dbraw/zinc/40/49/92/1030404992.db2.gz MCWGMGLOCQXJPQ-LJQANCHMSA-N 1 0 340.423 3.978 20 5 EHBDRO CC(C)(C)OC(=O)C[C@H]1CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C1 ZINC000532125091 1030418593 /nfs/dbraw/zinc/41/85/93/1030418593.db2.gz ZRAMYYWACYFZBX-OAHLLOKOSA-N 1 0 334.416 3.539 20 5 EHBDRO Cc1cnc(CC[N@H+](Cc2ccc([N+](=O)[O-])cc2)C2CC2)c(C)c1 ZINC000583691012 1030462750 /nfs/dbraw/zinc/46/27/50/1030462750.db2.gz SFEJNNVQJMJCNH-UHFFFAOYSA-N 1 0 325.412 3.814 20 5 EHBDRO C[NH+](C)CCc1ccc(NCc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000892354714 1030642960 /nfs/dbraw/zinc/64/29/60/1030642960.db2.gz PVNAQKPUJGUXBV-UHFFFAOYSA-N 1 0 333.819 3.964 20 5 EHBDRO Cc1cc(N[C@@H]2CCO[C@@H](C3CC3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000160340519 1030685105 /nfs/dbraw/zinc/68/51/05/1030685105.db2.gz KLPAUVBDFSNNEM-FZKQIMNGSA-N 1 0 327.384 3.821 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(CN2CCOCC23CCCC3)o1 ZINC000537660845 1030916516 /nfs/dbraw/zinc/91/65/16/1030916516.db2.gz KCFPXNLVEGTBDN-UHFFFAOYSA-N 1 0 342.395 4.000 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000551113176 1031042574 /nfs/dbraw/zinc/04/25/74/1031042574.db2.gz WXCYMLIRMLRESH-OAHLLOKOSA-N 1 0 341.411 3.834 20 5 EHBDRO CC(C)(C)[C@@H]1CCC[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000483251363 1031065257 /nfs/dbraw/zinc/06/52/57/1031065257.db2.gz CZBJTNZDQRDWAD-CQSZACIVSA-N 1 0 344.415 3.903 20 5 EHBDRO COc1cc([C@@H](C)[NH2+][C@H]2CCOC3(CCCC3)C2)cc([N+](=O)[O-])c1 ZINC000903127507 1031238096 /nfs/dbraw/zinc/23/80/96/1031238096.db2.gz ZVXXXUDYAJRTPH-HIFRSBDPSA-N 1 0 334.416 3.746 20 5 EHBDRO COc1cccc([C@@H](CNc2ccc([N+](=O)[O-])cc2Cl)[NH+](C)C)c1 ZINC000007979741 1031287627 /nfs/dbraw/zinc/28/76/27/1031287627.db2.gz WTNOZLCQAIKHAF-QGZVFWFLSA-N 1 0 349.818 3.972 20 5 EHBDRO CCc1nc(C)c([C@@H](C)[N@H+](C)CCOc2ccccc2[N+](=O)[O-])s1 ZINC000122053324 1031292146 /nfs/dbraw/zinc/29/21/46/1031292146.db2.gz AQQUEVISZCZLKT-CYBMUJFWSA-N 1 0 349.456 3.994 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2([NH+]3CCSCC3)CCCCC2)cc1 ZINC000484569186 1031725471 /nfs/dbraw/zinc/72/54/71/1031725471.db2.gz KGSPWTKXNVFDIG-UHFFFAOYSA-N 1 0 335.473 3.758 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@@H]3CC[C@@H]4CCCC[C@H]4[NH2+]3)n2)s1 ZINC000904110275 1031734913 /nfs/dbraw/zinc/73/49/13/1031734913.db2.gz QVZGCMQWAYALEB-AXFHLTTASA-N 1 0 334.401 3.690 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCO[C@H](C)C1 ZINC000537766090 1031899339 /nfs/dbraw/zinc/89/93/39/1031899339.db2.gz CFUMNMSTUPCZEF-RBSFLKMASA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]1C ZINC000248544657 1031956381 /nfs/dbraw/zinc/95/63/81/1031956381.db2.gz DSWMIKYBYNOFEG-XUJVJEKNSA-N 1 0 330.388 3.559 20 5 EHBDRO CCS[C@H]1CC[C@@H]([N@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487880 1033369409 /nfs/dbraw/zinc/36/94/09/1033369409.db2.gz NYBDKGJUYQAWRW-HIFRSBDPSA-N 1 0 334.445 3.508 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+][C@@H](CCCO)c1ccccc1 ZINC000594495265 1033396324 /nfs/dbraw/zinc/39/63/24/1033396324.db2.gz PGAZEJVJZSRJQS-ROUUACIJSA-N 1 0 326.396 3.686 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1C)C1CCCCC1 ZINC000063493759 1033401795 /nfs/dbraw/zinc/40/17/95/1033401795.db2.gz QGYOEOWCYUWWCT-UHFFFAOYSA-N 1 0 333.432 3.886 20 5 EHBDRO COC(=O)c1ccc2c(c1)[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])CCC2 ZINC000594500812 1033402456 /nfs/dbraw/zinc/40/24/56/1033402456.db2.gz BECUAGHVIQQEMO-KRWDZBQOSA-N 1 0 340.379 3.549 20 5 EHBDRO Cc1ncccc1CC[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000898253408 1033409852 /nfs/dbraw/zinc/40/98/52/1033409852.db2.gz OCMOLRYNCCBHAK-UHFFFAOYSA-N 1 0 340.210 3.937 20 5 EHBDRO COC1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCCCC1 ZINC000898259967 1033413996 /nfs/dbraw/zinc/41/39/96/1033413996.db2.gz VOGUZTKBRQRYIG-UHFFFAOYSA-N 1 0 333.388 3.565 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCCN2CCCC[C@H]12 ZINC000594520388 1033429897 /nfs/dbraw/zinc/42/98/97/1033429897.db2.gz OCCPLGCGJVBRNV-HHXXYDBFSA-N 1 0 331.460 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@@H](c2ccco2)N2CCCCC2)cc1 ZINC000061013460 1033436083 /nfs/dbraw/zinc/43/60/83/1033436083.db2.gz IWMVHMXSUJCRHY-KRWDZBQOSA-N 1 0 329.400 3.505 20 5 EHBDRO Cn1cc(C[NH2+]CCCC2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000594976400 1033579937 /nfs/dbraw/zinc/57/99/37/1033579937.db2.gz CZBNCZKHGUBHIX-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](CCCO)c1ccccc1 ZINC000595020765 1033613918 /nfs/dbraw/zinc/61/39/18/1033613918.db2.gz BLCDFTZALKJILP-RDTXWAMCSA-N 1 0 344.411 3.768 20 5 EHBDRO CC(C)c1ccc(C[NH2+]Cc2c(C3CC3)cnn2C)cc1[N+](=O)[O-] ZINC000594982908 1033619468 /nfs/dbraw/zinc/61/94/68/1033619468.db2.gz CQEQRMUIFWURIO-UHFFFAOYSA-N 1 0 328.416 3.619 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)c(Cl)c1 ZINC000594996624 1033624272 /nfs/dbraw/zinc/62/42/72/1033624272.db2.gz UIAFHETXJPGVEM-HYVNUMGLSA-N 1 0 332.762 3.815 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)[C@@H](C)c1ccccc1 ZINC000594999583 1033625806 /nfs/dbraw/zinc/62/58/06/1033625806.db2.gz CAPRUGYZUJASPS-QWSHPKPYSA-N 1 0 340.423 3.752 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@H]2CO[C@@H](C3CC3)C2)s1 ZINC000599008205 1033642361 /nfs/dbraw/zinc/64/23/61/1033642361.db2.gz WIQOVMLSOOGUDG-CXAGYDPISA-N 1 0 344.436 3.980 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@H](c1cccnc1)C1CC1 ZINC000595036176 1033657290 /nfs/dbraw/zinc/65/72/90/1033657290.db2.gz QBDCSNNACBSUJF-XIKOKIGWSA-N 1 0 327.384 3.800 20 5 EHBDRO C[C@H](O)[C@@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000595103980 1033691711 /nfs/dbraw/zinc/69/17/11/1033691711.db2.gz PWURQELHDJSDDA-FASAQXTFSA-N 1 0 326.396 3.684 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC(=O)N(C(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000595105929 1033692126 /nfs/dbraw/zinc/69/21/26/1033692126.db2.gz URJXTFQERVEXMG-YOEHRIQHSA-N 1 0 347.459 3.673 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H]1Cc3ccccc3CO1)CCC2 ZINC000599058394 1033696830 /nfs/dbraw/zinc/69/68/30/1033696830.db2.gz LHOBCOLJDTUCPE-ICSRJNTNSA-N 1 0 338.407 3.703 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCC[C@@H]2Cc2cnn(C)c2)cccc1[N+](=O)[O-] ZINC000595084074 1033698076 /nfs/dbraw/zinc/69/80/76/1033698076.db2.gz FHNVKHGAXWHFHT-LESCRADOSA-N 1 0 342.443 3.699 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CO[C@@H](C2CC2)C1 ZINC000599086256 1033725834 /nfs/dbraw/zinc/72/58/34/1033725834.db2.gz ZQMQWLCQCDRQOJ-IIAWOOMASA-N 1 0 336.457 3.623 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CCC[N@H+](CC3CC3)C2)ccc2cnccc21 ZINC000599110646 1033741699 /nfs/dbraw/zinc/74/16/99/1033741699.db2.gz DZPFSVRVCMKMMY-OAHLLOKOSA-N 1 0 340.427 3.677 20 5 EHBDRO Cc1nccn1-c1ccc([C@@H](C)[NH2+]Cc2ccccc2[N+](=O)[O-])cc1 ZINC000089512119 1033752305 /nfs/dbraw/zinc/75/23/05/1033752305.db2.gz ILQJQSPNHWITLG-CQSZACIVSA-N 1 0 336.395 3.940 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+][C@@H](c2ccccc2)C(C)C)c1 ZINC000592997345 1033778306 /nfs/dbraw/zinc/77/83/06/1033778306.db2.gz YENPYNYXLKFRAY-GOSISDBHSA-N 1 0 342.395 3.868 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@@H+]2C2CCCC2)c2ncccc12 ZINC000599164092 1033779650 /nfs/dbraw/zinc/77/96/50/1033779650.db2.gz JLABLQRTNPNSKM-CQSZACIVSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1ccc([C@H]([NH2+]Cc2ccc(F)cc2[N+](=O)[O-])C2CC2)cc1 ZINC000595426318 1033797381 /nfs/dbraw/zinc/79/73/81/1033797381.db2.gz SHKOEJUAOIZZSO-GOSISDBHSA-N 1 0 330.359 3.983 20 5 EHBDRO CC(C)c1cccc(C[NH+]2CCC(n3ccc([N+](=O)[O-])n3)CC2)c1 ZINC000595481972 1033808730 /nfs/dbraw/zinc/80/87/30/1033808730.db2.gz PZVRKJLRCRVXEF-UHFFFAOYSA-N 1 0 328.416 3.752 20 5 EHBDRO CN1CC[C@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704416 1033893457 /nfs/dbraw/zinc/89/34/57/1033893457.db2.gz XKSPOEQZIJADTE-AZUAARDMSA-N 1 0 339.439 3.562 20 5 EHBDRO CC(C)C[NH+]1CCC(Nc2nccc3c2cccc3[N+](=O)[O-])CC1 ZINC000450244267 1033947716 /nfs/dbraw/zinc/94/77/16/1033947716.db2.gz PDQRCCLJNYAYBO-UHFFFAOYSA-N 1 0 328.416 3.675 20 5 EHBDRO C[NH+](C)[C@H](CNc1ccc2ncccc2c1[N+](=O)[O-])c1ccccc1 ZINC000603837504 1033962406 /nfs/dbraw/zinc/96/24/06/1033962406.db2.gz NLFRODRIFCEGDZ-GOSISDBHSA-N 1 0 336.395 3.858 20 5 EHBDRO O=[N+]([O-])c1ncccc1NC[C@H](c1cccc(Cl)c1)[NH+]1CCCC1 ZINC000603850875 1033975286 /nfs/dbraw/zinc/97/52/86/1033975286.db2.gz GZNATEBKHKGRMB-MRXNPFEDSA-N 1 0 346.818 3.892 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc(C[N@H+](CCC3CC3)CC3CC3)n2)cc1 ZINC000595872359 1034031565 /nfs/dbraw/zinc/03/15/65/1034031565.db2.gz WLWYWDJWRCLTOI-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO CC[C@@H]1CCC[C@H](C)[N@@H+]1CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC ZINC000595867048 1034032567 /nfs/dbraw/zinc/03/25/67/1034032567.db2.gz JVZOPZAPGKEHTE-UONOGXRCSA-N 1 0 349.431 3.585 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)CC1 ZINC000596210530 1034119416 /nfs/dbraw/zinc/11/94/16/1034119416.db2.gz ZRMAODLDIPBNPV-NSHDSACASA-N 1 0 331.338 3.534 20 5 EHBDRO O=[N+]([O-])c1cccc2c1ccnc2N[C@H]1CC[N@@H+](C2CCCC2)C1 ZINC000450320756 1034127315 /nfs/dbraw/zinc/12/73/15/1034127315.db2.gz XJYPBXCJGOMGCA-ZDUSSCGKSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N[C@H]1CCC[N@@H+]2CCCC[C@@H]12 ZINC000596296319 1034147532 /nfs/dbraw/zinc/14/75/32/1034147532.db2.gz HAVCDQYUSYMCRZ-JSGCOSHPSA-N 1 0 325.359 3.961 20 5 EHBDRO CC(C)c1ccc(C(=O)NC(C)(C)CCC[NH+](C)C)cc1[N+](=O)[O-] ZINC000456177568 1034202480 /nfs/dbraw/zinc/20/24/80/1034202480.db2.gz YKCVIVGGEFKJOT-UHFFFAOYSA-N 1 0 335.448 3.568 20 5 EHBDRO CCOc1ccc([C@H](C)NCCC[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000179394455 1034277992 /nfs/dbraw/zinc/27/79/92/1034277992.db2.gz YEFFQSSWOCYCOE-HNNXBMFYSA-N 1 0 335.448 3.520 20 5 EHBDRO CC(C)[C@H]([NH3+])CCN[C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000596655694 1034330113 /nfs/dbraw/zinc/33/01/13/1034330113.db2.gz XFFNHLNLTDIJGW-RTBURBONSA-N 1 0 327.428 3.647 20 5 EHBDRO CC(C)n1ncc2c1C[C@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)CC2 ZINC000364374429 1034604833 /nfs/dbraw/zinc/60/48/33/1034604833.db2.gz MTJHXNRZFOAFLE-XJKSGUPXSA-N 1 0 328.416 3.580 20 5 EHBDRO C[NH+](C)[C@H]1CCc2cc(NC(=O)c3c(F)cccc3[N+](=O)[O-])ccc21 ZINC000601617198 1034643653 /nfs/dbraw/zinc/64/36/53/1034643653.db2.gz JFAHIBSPPIJNNH-HNNXBMFYSA-N 1 0 343.358 3.535 20 5 EHBDRO C[C@@H](C[NH2+][C@@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC[C@H]1C ZINC000480622392 1034672717 /nfs/dbraw/zinc/67/27/17/1034672717.db2.gz XYWCUHSQXJTGRH-GJYPPUQNSA-N 1 0 345.487 3.768 20 5 EHBDRO CC[C@H]1CCCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1OC ZINC000411282932 1034850269 /nfs/dbraw/zinc/85/02/69/1034850269.db2.gz JYDPLLREBZSANA-AWEZNQCLSA-N 1 0 349.431 3.587 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2F)cc1[N+](=O)[O-] ZINC000411477433 1034892189 /nfs/dbraw/zinc/89/21/89/1034892189.db2.gz RULJTKIWUUNNTE-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000612419786 1034910360 /nfs/dbraw/zinc/91/03/60/1034910360.db2.gz REYWNMPBCVUWDN-SUMWQHHRSA-N 1 0 326.396 3.812 20 5 EHBDRO COc1ccccc1CCC[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC000548935652 1035002280 /nfs/dbraw/zinc/00/22/80/1035002280.db2.gz QSAZXMRVXLWGKT-UHFFFAOYSA-N 1 0 328.412 3.711 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CCC2(CCOCC2)[C@@H]1C ZINC000612540179 1035044063 /nfs/dbraw/zinc/04/40/63/1035044063.db2.gz CBNNNOBZJPTFAT-HNNXBMFYSA-N 1 0 348.443 3.773 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)c1C ZINC000580519535 1035438303 /nfs/dbraw/zinc/43/83/03/1035438303.db2.gz CBJVEBXAEINEIS-SFHVURJKSA-N 1 0 328.416 3.595 20 5 EHBDRO COc1ccc([C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)c(C)c1 ZINC000414084991 1035465633 /nfs/dbraw/zinc/46/56/33/1035465633.db2.gz XUKDASNNYJOJSA-ZDUSSCGKSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000414102275 1035510039 /nfs/dbraw/zinc/51/00/39/1035510039.db2.gz XGTXPPDAUZMEML-KGLIPLIRSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1cc(C[N@H+](C)CCCc2ccccc2)c([N+](=O)[O-])cc1F ZINC000463475049 1035529010 /nfs/dbraw/zinc/52/90/10/1035529010.db2.gz VMXAJJJIJJVPRS-UHFFFAOYSA-N 1 0 332.375 3.807 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](COCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000075865944 1035569624 /nfs/dbraw/zinc/56/96/24/1035569624.db2.gz GPVRWZGFGIYJPG-SFHVURJKSA-N 1 0 340.423 3.942 20 5 EHBDRO CC[N@H+](CCC(=O)OC)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000511496523 1035699895 /nfs/dbraw/zinc/69/98/95/1035699895.db2.gz RCRVQWMDYZGSOK-UHFFFAOYSA-N 1 0 348.424 3.708 20 5 EHBDRO CC(C)[N@@H+]1CC[C@@H](N(C)C(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000457106745 1035743882 /nfs/dbraw/zinc/74/38/82/1035743882.db2.gz DOPNOKPWUPVVMU-QGZVFWFLSA-N 1 0 347.462 3.943 20 5 EHBDRO C[C@H](C[N@H+](Cc1c(F)cccc1[N+](=O)[O-])[C@@H](C)CO)c1ccccc1 ZINC000588214985 1035826679 /nfs/dbraw/zinc/82/66/79/1035826679.db2.gz WDWKSDOGXADMAB-CABCVRRESA-N 1 0 346.402 3.720 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H]2CCCOC2)c2ccccc2)c1 ZINC000180182406 1036048985 /nfs/dbraw/zinc/04/89/85/1036048985.db2.gz KKBXUPMMQIBPMO-DNVCBOLYSA-N 1 0 326.396 3.700 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3cccc(F)c3)C2)c([N+](=O)[O-])cc1F ZINC000464102573 1036126152 /nfs/dbraw/zinc/12/61/52/1036126152.db2.gz BCRNGCWYOVSRTN-CYBMUJFWSA-N 1 0 348.349 3.871 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCc2c1cccc2[N+](=O)[O-])[C@H](c1ccccc1)N(C)C ZINC000582677779 1036193051 /nfs/dbraw/zinc/19/30/51/1036193051.db2.gz VHXOZDGXHQHBGM-ADLFWFRXSA-N 1 0 339.439 3.863 20 5 EHBDRO CC(C)(C)[C@H]1CC[N@H+](CC(=O)Nc2ccc(Cl)cc2[N+](=O)[O-])C1 ZINC000541391378 1036277269 /nfs/dbraw/zinc/27/72/69/1036277269.db2.gz VPTGDVXIINPCQN-NSHDSACASA-N 1 0 339.823 3.555 20 5 EHBDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000492818135 1036336140 /nfs/dbraw/zinc/33/61/40/1036336140.db2.gz MPZORQWWSWKODL-HOCLYGCPSA-N 1 0 333.432 3.790 20 5 EHBDRO COC[C@@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000589340419 1036351406 /nfs/dbraw/zinc/35/14/06/1036351406.db2.gz DOZQWVYXVLLLCD-MRXNPFEDSA-N 1 0 334.803 3.768 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])Cc1ccc(Cl)cc1 ZINC000031006289 1036389814 /nfs/dbraw/zinc/38/98/14/1036389814.db2.gz HBAFCLLBWGKTTN-UHFFFAOYSA-N 1 0 347.802 3.709 20 5 EHBDRO CC(C)c1ccc([C@@H]2CCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000535381397 1036423604 /nfs/dbraw/zinc/42/36/04/1036423604.db2.gz IHTRECUFMZVADI-SFHVURJKSA-N 1 0 328.416 3.752 20 5 EHBDRO Cc1ccccc1[C@@H]([C@H](C)Nc1ccc([N+](=O)[O-])c(N)c1F)[NH+](C)C ZINC000589600656 1036544013 /nfs/dbraw/zinc/54/40/13/1036544013.db2.gz CUBVXLHZDNAUHU-KPZWWZAWSA-N 1 0 346.406 3.728 20 5 EHBDRO CCC[C@H]1CCCC[N@@H+]1CCC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000541662200 1036546451 /nfs/dbraw/zinc/54/64/51/1036546451.db2.gz BSTLVVJZNYHZPZ-HNNXBMFYSA-N 1 0 333.432 3.886 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](CO)c1ccc(F)cc1)c1cccc([N+](=O)[O-])c1 ZINC000414301783 1036551558 /nfs/dbraw/zinc/55/15/58/1036551558.db2.gz BVOUCRRGJZDEMZ-QFBILLFUSA-N 1 0 346.402 3.941 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H](C)c1ccc(NC(N)=O)cc1 ZINC000165434066 1036557889 /nfs/dbraw/zinc/55/78/89/1036557889.db2.gz PRTXGXBNCBKYFA-CHWSQXEVSA-N 1 0 342.399 3.806 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](Cc3ccccc3)C2)c([N+](=O)[O-])cc1F ZINC000464675721 1036648940 /nfs/dbraw/zinc/64/89/40/1036648940.db2.gz BWJIBTJHTVLICZ-OAHLLOKOSA-N 1 0 344.386 3.807 20 5 EHBDRO CCC[C@@H]1[C@@H](C)CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736836 1036695161 /nfs/dbraw/zinc/69/51/61/1036695161.db2.gz LTXPSCIYHXSGDB-DZGCQCFKSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCc1ccc2ccccc2n1 ZINC000539497816 1036832699 /nfs/dbraw/zinc/83/26/99/1036832699.db2.gz YSLUPUILUISFMV-YVMONPNESA-N 1 0 333.391 3.989 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1cccc(Cl)c1)c1cccc([N+](=O)[O-])c1 ZINC000180446348 1036839396 /nfs/dbraw/zinc/83/93/96/1036839396.db2.gz XCISZVNMBRDMSX-GFCCVEGCSA-N 1 0 347.802 3.928 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)CC[C@H]1O ZINC000249777553 1036920312 /nfs/dbraw/zinc/92/03/12/1036920312.db2.gz CJIMKUAUUMBZER-BLLLJJGKSA-N 1 0 332.425 3.526 20 5 EHBDRO C[NH+]1CCC2(CCN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)C2)CC1 ZINC000590567942 1036951786 /nfs/dbraw/zinc/95/17/86/1036951786.db2.gz QGVAFOPXTPQSAT-UHFFFAOYSA-N 1 0 343.349 3.536 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@@H](CC)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000152852064 1036996767 /nfs/dbraw/zinc/99/67/67/1036996767.db2.gz BNFYZLXCVRCXAT-GDBMZVCRSA-N 1 0 335.448 3.519 20 5 EHBDRO CCOc1cccc(CC[NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)c1 ZINC000761528329 1037100127 /nfs/dbraw/zinc/10/01/27/1037100127.db2.gz QPTSMONJCPLLDX-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO O=C1C[C@H]2CC[C@@H](C1)[N@H+]2Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000590967249 1037144187 /nfs/dbraw/zinc/14/41/87/1037144187.db2.gz UYFGGOLZHFIGLF-GASCZTMLSA-N 1 0 326.352 3.551 20 5 EHBDRO C[C@H]([NH2+]CCOCCF)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596093697 1037213095 /nfs/dbraw/zinc/21/30/95/1037213095.db2.gz DRXDJBUNJYDRGV-LBPRGKRZSA-N 1 0 338.404 3.960 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000493308449 1037242684 /nfs/dbraw/zinc/24/26/84/1037242684.db2.gz YPFXHIWGHXBHSG-OALUTQOASA-N 1 0 328.412 3.945 20 5 EHBDRO C[C@@H]1OCC[C@@]1(C)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000542314676 1037280640 /nfs/dbraw/zinc/28/06/40/1037280640.db2.gz VKHIKGRWAXNFNI-YVEFUNNKSA-N 1 0 332.425 3.980 20 5 EHBDRO COc1ccc(C[N@@H+]2CC[C@H](c3cccc(C)c3)C2)cc1[N+](=O)[O-] ZINC000542318603 1037285938 /nfs/dbraw/zinc/28/59/38/1037285938.db2.gz VGVLMWBJMVZROP-KRWDZBQOSA-N 1 0 326.396 3.901 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccc(C)cc3)C2)ccc1[N+](=O)[O-] ZINC000542322048 1037298656 /nfs/dbraw/zinc/29/86/56/1037298656.db2.gz GWIVBKXPPZLICK-QGZVFWFLSA-N 1 0 326.396 3.901 20 5 EHBDRO Cc1cnc(NC[C@H]2CCC[N@H+](Cc3ccccc3)C2)c([N+](=O)[O-])c1 ZINC000311041766 1037311296 /nfs/dbraw/zinc/31/12/96/1037311296.db2.gz SCHXWTPJEFZMGQ-QGZVFWFLSA-N 1 0 340.427 3.622 20 5 EHBDRO Cn1cc(C[N@@H+]2CC[C@H](C3CCC3)C2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000591267706 1037313358 /nfs/dbraw/zinc/31/33/58/1037313358.db2.gz DEKCYEXBJJWOMD-INIZCTEOSA-N 1 0 340.427 3.617 20 5 EHBDRO COc1ccc(OCCC[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000532465004 1037371577 /nfs/dbraw/zinc/37/15/77/1037371577.db2.gz AWBPQZSZJNQPME-AWEZNQCLSA-N 1 0 330.384 3.723 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1C[C@H](OCC)C12CCCC2 ZINC000462756709 1037371903 /nfs/dbraw/zinc/37/19/03/1037371903.db2.gz OXUOOZRISIISOS-ROUUACIJSA-N 1 0 348.443 3.821 20 5 EHBDRO C[C@H](CCNc1ccc2cc([N+](=O)[O-])ccc2n1)[NH+]1CCCCC1 ZINC000302182840 1037419651 /nfs/dbraw/zinc/41/96/51/1037419651.db2.gz SJMCVEUPVKRJLX-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccc(CSC(F)F)o2)cc1 ZINC000058093515 1037479708 /nfs/dbraw/zinc/47/97/08/1037479708.db2.gz ZJNQYSWIWPZEEN-UHFFFAOYSA-N 1 0 342.367 3.976 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC[C@@]2(C)CC[N@H+](Cc3ccccc3)C2)n1 ZINC000311199281 1037570078 /nfs/dbraw/zinc/57/00/78/1037570078.db2.gz JQLUJGYFYYDNDL-LJQANCHMSA-N 1 0 340.427 3.622 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[NH2+]CCSCC(F)(F)F ZINC000698970092 1037635097 /nfs/dbraw/zinc/63/50/97/1037635097.db2.gz ZSFXEKDLIFVDDE-UHFFFAOYSA-N 1 0 328.743 3.633 20 5 EHBDRO CCCC[C@H]1CCC[C@@H]1[NH2+]CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000491822862 1037691748 /nfs/dbraw/zinc/69/17/48/1037691748.db2.gz YAEQLTOPMBTXQJ-GJZGRUSLSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1ccc([C@H](CNc2ncc(C)cc2[N+](=O)[O-])[NH+]2CCCC2)cc1 ZINC000463051291 1037701030 /nfs/dbraw/zinc/70/10/30/1037701030.db2.gz ALMWSRZQENBKGE-SFHVURJKSA-N 1 0 340.427 3.856 20 5 EHBDRO Cc1cc(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)ccc1[N+](=O)[O-] ZINC000494005905 1037766636 /nfs/dbraw/zinc/76/66/36/1037766636.db2.gz DRTSAXZHNYELQL-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@H+](C)Cc1cccc2[nH]ccc21 ZINC000494117166 1037839430 /nfs/dbraw/zinc/83/94/30/1037839430.db2.gz REASRLJACXQGNP-UHFFFAOYSA-N 1 0 325.368 3.717 20 5 EHBDRO CC(C)CCC[C@H](C)NC(=O)C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1 ZINC000540378806 1037887577 /nfs/dbraw/zinc/88/75/77/1037887577.db2.gz DSISLHFZIBTWAR-LSDHHAIUSA-N 1 0 335.448 3.576 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H](c2ccccc2)C2(CO)CC=CC2)cs1 ZINC000592175227 1037916127 /nfs/dbraw/zinc/91/61/27/1037916127.db2.gz BYBMCCNUSGPWJN-KRWDZBQOSA-N 1 0 344.436 3.816 20 5 EHBDRO Cc1cn2c(n1)[C@H](C[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1C)CCC2 ZINC000378180720 1038150056 /nfs/dbraw/zinc/15/00/56/1038150056.db2.gz AHQOCJHQLSNDQH-CABCVRRESA-N 1 0 328.416 3.636 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCO1 ZINC000538777195 1038524407 /nfs/dbraw/zinc/52/44/07/1038524407.db2.gz GYDSSDMWSRYHII-OLZOCXBDSA-N 1 0 332.425 3.980 20 5 EHBDRO C[N@H+](CCOCC1CC1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000538764081 1038529397 /nfs/dbraw/zinc/52/93/97/1038529397.db2.gz LFENRZROWUJNSM-UHFFFAOYSA-N 1 0 330.384 3.713 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@H](c2ccccc2)[C@H]2CCOC2)c(F)c1 ZINC000539297940 1038765284 /nfs/dbraw/zinc/76/52/84/1038765284.db2.gz XAJLFOUHCSCRHV-MAUKXSAKSA-N 1 0 330.359 3.601 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH2+][C@H](c2ccc(Cl)cc2)C2CCCC2)n1 ZINC000539304856 1038775758 /nfs/dbraw/zinc/77/57/58/1038775758.db2.gz PVAKYJPZSMVHKE-KRWDZBQOSA-N 1 0 348.834 3.966 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@]2(Cc3ccc(Cl)cc3)CCOC2)c1 ZINC000500469154 1038779636 /nfs/dbraw/zinc/77/96/36/1038779636.db2.gz KDMLQHMKLNOPAB-GOSISDBHSA-N 1 0 346.814 3.740 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cc(Cl)c1N1CCC([NH2+]C2CC2)CC1 ZINC000572460721 1038888027 /nfs/dbraw/zinc/88/80/27/1038888027.db2.gz JAZGWLYVTJJAQG-UHFFFAOYSA-N 1 0 330.215 3.622 20 5 EHBDRO Cc1cccc([C@H]2CCCC[N@@H+]2CCn2ccc([N+](=O)[O-])n2)c1C ZINC000478013179 1039117033 /nfs/dbraw/zinc/11/70/33/1039117033.db2.gz CQQMWCSMMFDLDZ-QGZVFWFLSA-N 1 0 328.416 3.635 20 5 EHBDRO CCc1ccccc1NC(=O)[C@@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852620 1039157435 /nfs/dbraw/zinc/15/74/35/1039157435.db2.gz KDOCUGVTWCEVHD-ZIAGYGMSSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000905852650 1039159424 /nfs/dbraw/zinc/15/94/24/1039159424.db2.gz LTJHPJZQCYLXNG-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO CC[NH2+]CC1CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000236881471 1039274776 /nfs/dbraw/zinc/27/47/76/1039274776.db2.gz LWBQHSDMUDSJMP-UHFFFAOYSA-N 1 0 347.462 3.850 20 5 EHBDRO C[C@@H](c1cccc(Cl)c1)[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)C1 ZINC000485668097 1039384791 /nfs/dbraw/zinc/38/47/91/1039384791.db2.gz ICUGJSLWRZBFEK-WFASDCNBSA-N 1 0 346.818 3.891 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH+]1CCN(c2ccccc2)CC1 ZINC000485720230 1039461134 /nfs/dbraw/zinc/46/11/34/1039461134.db2.gz XNQAGGHNLITWIT-MRXNPFEDSA-N 1 0 325.412 3.786 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccc2ncsc2c1 ZINC000485813620 1039585999 /nfs/dbraw/zinc/58/59/99/1039585999.db2.gz OJROVBWFABAGKA-LBPRGKRZSA-N 1 0 343.408 3.934 20 5 EHBDRO CCCOc1cc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)ccc1OC ZINC000480500854 1039626976 /nfs/dbraw/zinc/62/69/76/1039626976.db2.gz RIXAMLXSHSBJSS-UHFFFAOYSA-N 1 0 344.411 3.990 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)N1CCCC1 ZINC000480535609 1039652918 /nfs/dbraw/zinc/65/29/18/1039652918.db2.gz KWTUTTHXVYZFLU-UYAOXDASSA-N 1 0 345.487 3.626 20 5 EHBDRO CCOc1ccc([C@@H](C)N[C@H]2COCc3ccccc32)cc1[N+](=O)[O-] ZINC000417340922 1039706532 /nfs/dbraw/zinc/70/65/32/1039706532.db2.gz AXNCEQHAGFIKLE-DYVFJYSZSA-N 1 0 342.395 3.916 20 5 EHBDRO COC(=O)CCC[C@@H]1CCC[C@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000549734242 1039745515 /nfs/dbraw/zinc/74/55/15/1039745515.db2.gz VULKIYDSCGRFKW-IRXDYDNUSA-N 1 0 348.443 3.629 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]C[C@H](c2ccc(F)cc2)N(C)C)cc1[N+](=O)[O-] ZINC000480896512 1040145416 /nfs/dbraw/zinc/14/54/16/1040145416.db2.gz CZQPPFWYOCYOMZ-IFXJQAMLSA-N 1 0 345.418 3.996 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)cnc1NC[C@H]1CC[N@H+](Cc2ccccc2)C1 ZINC000192951738 1040158033 /nfs/dbraw/zinc/15/80/33/1040158033.db2.gz IUOCRVLSPZVWJW-CQSZACIVSA-N 1 0 346.818 3.577 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC(C)(C)C[C@H]1C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481094402 1040349638 /nfs/dbraw/zinc/34/96/38/1040349638.db2.gz WSIOAFZNFFOXQO-HZSPNIEDSA-N 1 0 333.432 3.726 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@H]1[NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000481093933 1040349879 /nfs/dbraw/zinc/34/98/79/1040349879.db2.gz VJASSWJHYDEEQC-UONOGXRCSA-N 1 0 333.432 3.728 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[NH2+][C@H]1CCC(C)(C)C[C@@H]1C ZINC000481094853 1040349910 /nfs/dbraw/zinc/34/99/10/1040349910.db2.gz XIHJLGZDBIJIHL-KBPBESRZSA-N 1 0 333.432 3.646 20 5 EHBDRO CCN(C)CC[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000481245376 1040545090 /nfs/dbraw/zinc/54/50/90/1040545090.db2.gz IHYVTQOTWFBEHF-ZDUSSCGKSA-N 1 0 333.457 3.926 20 5 EHBDRO C[N@@H+](CC(=O)Nc1ccc(Cl)cc1[N+](=O)[O-])CC1CCCCC1 ZINC000029455055 1040626205 /nfs/dbraw/zinc/62/62/05/1040626205.db2.gz MQAKZHDELWQICE-UHFFFAOYSA-N 1 0 339.823 3.699 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@H](c3ccncc3)C2)cc1[N+](=O)[O-] ZINC000453330951 1040703539 /nfs/dbraw/zinc/70/35/39/1040703539.db2.gz BSSLTFDLXSTDGA-YJLNNSPDSA-N 1 0 341.411 3.869 20 5 EHBDRO CC(C)[C@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)CCO1 ZINC000487154079 1040725967 /nfs/dbraw/zinc/72/59/67/1040725967.db2.gz HFUIISXUJQBDQR-DZGCQCFKSA-N 1 0 346.349 3.907 20 5 EHBDRO Cc1ccc(NC(=O)C[C@@H](c2ccccc2)[NH+](C)C)cc1[N+](=O)[O-] ZINC000433110116 1040771501 /nfs/dbraw/zinc/77/15/01/1040771501.db2.gz OBGLTUGDGHBSMS-KRWDZBQOSA-N 1 0 327.384 3.535 20 5 EHBDRO O=[N+]([O-])c1ccccc1CN1CCC[C@@H](C[NH+]2CCCCCC2)C1 ZINC000491057612 1040898255 /nfs/dbraw/zinc/89/82/55/1040898255.db2.gz DTARVUOLCHBQOH-KRWDZBQOSA-N 1 0 331.460 3.683 20 5 EHBDRO C[NH+](C)[C@@H]1CCOc2c(NCc3csc([N+](=O)[O-])c3)cccc21 ZINC000433205748 1041063769 /nfs/dbraw/zinc/06/37/69/1041063769.db2.gz GBHJBNUEXRLLMS-CQSZACIVSA-N 1 0 333.413 3.654 20 5 EHBDRO CCc1ccc([C@@H]2CCCCC[N@@H+]2CCn2cc([N+](=O)[O-])cn2)o1 ZINC000174871417 1041203728 /nfs/dbraw/zinc/20/37/28/1041203728.db2.gz BEAXNIJYHRQLGZ-INIZCTEOSA-N 1 0 332.404 3.564 20 5 EHBDRO C[C@H](O)CC(C)(C)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000290779987 1041368691 /nfs/dbraw/zinc/36/86/91/1041368691.db2.gz CEWPQDMTNAYBNT-VIFPVBQESA-N 1 0 335.231 3.788 20 5 EHBDRO CC(C)(C)CC[NH+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)CC1 ZINC000108308286 1042035535 /nfs/dbraw/zinc/03/55/35/1042035535.db2.gz PJVGEQFOQVABQO-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO COc1cccc(N2CCC(C[NH+]3CCCCCC3)CC2)c1[N+](=O)[O-] ZINC000613869769 1042481371 /nfs/dbraw/zinc/48/13/71/1042481371.db2.gz QIYYCDWMHUTRQO-UHFFFAOYSA-N 1 0 347.459 3.696 20 5 EHBDRO C[C@H]1CN(Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)O1 ZINC000511958984 1042488744 /nfs/dbraw/zinc/48/87/44/1042488744.db2.gz XALBNTBFVZTJMU-ZDUSSCGKSA-N 1 0 330.384 3.854 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccccc2)cc1[N+](=O)[O-] ZINC000164977477 1042580874 /nfs/dbraw/zinc/58/08/74/1042580874.db2.gz AMCNDAGWSQBHCU-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO COc1cc(C[NH2+][C@@H](C)C2CCCC2)c([N+](=O)[O-])cc1OC(F)F ZINC000184667472 1042594488 /nfs/dbraw/zinc/59/44/88/1042594488.db2.gz XIRRDDHYNDMOSV-JTQLQIEISA-N 1 0 344.358 3.873 20 5 EHBDRO C[C@H]1CC[C@H](C)[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000072897481 1042763914 /nfs/dbraw/zinc/76/39/14/1042763914.db2.gz HYHHRJFHHWYJOS-KBPBESRZSA-N 1 0 329.400 3.913 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccnc2c1cccc2[N+](=O)[O-])c1ccccc1 ZINC000432314037 1042796897 /nfs/dbraw/zinc/79/68/97/1042796897.db2.gz MWAKCUFBNLYSIY-SFHVURJKSA-N 1 0 336.395 3.858 20 5 EHBDRO CCn1nccc1C1CC[NH+]([C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000278901061 1042880894 /nfs/dbraw/zinc/88/08/94/1042880894.db2.gz PJLNVCIMARMSBV-AWEZNQCLSA-N 1 0 328.416 3.752 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C2CCC3(CC2)OCCO3)c2cc([N+](=O)[O-])ccc21 ZINC000278979978 1043122500 /nfs/dbraw/zinc/12/25/00/1043122500.db2.gz CWPDQWJNMBKJBY-QGZVFWFLSA-N 1 0 346.427 3.593 20 5 EHBDRO C[C@H](N[C@@H](C)c1cccc([N+](=O)[O-])c1)c1cn(-c2ccccc2)nn1 ZINC000150885662 1044084931 /nfs/dbraw/zinc/08/49/31/1044084931.db2.gz FURHQFXOXARKOD-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO CCOc1cc(NCc2ccc(C[NH+](C)C)c(F)c2)ccc1[N+](=O)[O-] ZINC000342771839 1044134828 /nfs/dbraw/zinc/13/48/28/1044134828.db2.gz BIZQJIBIDPDFHM-UHFFFAOYSA-N 1 0 347.390 3.806 20 5 EHBDRO CCC1(C[NH2+]Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)CCC1 ZINC000344644093 1044222111 /nfs/dbraw/zinc/22/21/11/1044222111.db2.gz SUERVQCKFMWALC-UHFFFAOYSA-N 1 0 328.416 3.665 20 5 EHBDRO C[N@@H+](Cc1ccc(F)c(Cl)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000763823646 1126877165 /nfs/dbraw/zinc/87/71/65/1126877165.db2.gz JHXJVZLJADNXEW-MRXNPFEDSA-N 1 0 338.766 3.553 20 5 EHBDRO CC[C@H](C)C[N@H+](CC)CC(=O)Nc1cc(Cl)ccc1[N+](=O)[O-] ZINC000764283775 1127473549 /nfs/dbraw/zinc/47/35/49/1127473549.db2.gz SKDKRSHBQKCVCY-NSHDSACASA-N 1 0 327.812 3.555 20 5 EHBDRO Cc1ccc(C[NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c(C)c1 ZINC000765103310 1127575105 /nfs/dbraw/zinc/57/51/05/1127575105.db2.gz MRIBFDWJWQFIJF-UHFFFAOYSA-N 1 0 339.439 3.970 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+]([C@@H](C)c2ccccc2)CC1 ZINC000301318627 1127734691 /nfs/dbraw/zinc/73/46/91/1127734691.db2.gz PXWQHUKIAAHQGR-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302456 1127735410 /nfs/dbraw/zinc/73/54/10/1127735410.db2.gz VWTSCTYGMWVORQ-LSDHHAIUSA-N 1 0 335.423 3.825 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302453 1127735661 /nfs/dbraw/zinc/73/56/61/1127735661.db2.gz VWTSCTYGMWVORQ-CABCVRRESA-N 1 0 335.423 3.825 20 5 EHBDRO CCCCCNC(=O)C1CC[NH+]([C@@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000075625948 1128353152 /nfs/dbraw/zinc/35/31/52/1128353152.db2.gz OMFQXZFHNHNWTD-HNNXBMFYSA-N 1 0 347.459 3.674 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCSC(C)(C)C1 ZINC000903280808 1128465487 /nfs/dbraw/zinc/46/54/87/1128465487.db2.gz DHOKAAJUBWHWLV-BXUZGUMPSA-N 1 0 326.437 3.929 20 5 EHBDRO Cc1ncsc1CCN(C)Cc1cc([N+](=O)[O-])ccc1Cl ZINC000172523084 1128474308 /nfs/dbraw/zinc/47/43/08/1128474308.db2.gz JNDUHOTVPAHEOV-UHFFFAOYSA-N 1 0 325.821 3.688 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)CC1 ZINC000301499607 1128483583 /nfs/dbraw/zinc/48/35/83/1128483583.db2.gz DCJMWAGJPHXPRP-UHFFFAOYSA-N 1 0 345.365 3.923 20 5 EHBDRO Cc1ccnc(N[C@@H]2CC[N@H+](Cc3ccccc3)[C@H](C)C2)c1[N+](=O)[O-] ZINC000301545488 1128495947 /nfs/dbraw/zinc/49/59/47/1128495947.db2.gz OSLFSWVMLAQOJF-NVXWUHKLSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+](Cc3ccccc3)C[C@H]2C)ncc1[N+](=O)[O-] ZINC000301599730 1128509238 /nfs/dbraw/zinc/50/92/38/1128509238.db2.gz UOTNMZGRCSCEEB-NVXWUHKLSA-N 1 0 340.427 3.621 20 5 EHBDRO C[NH+](C)CCSc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000301607965 1128516385 /nfs/dbraw/zinc/51/63/85/1128516385.db2.gz OEZOREGADPFPRR-UHFFFAOYSA-N 1 0 328.743 3.921 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]C[C@H](O)c2ccc([N+](=O)[O-])cc2)c2ccccc21 ZINC000765848519 1128559553 /nfs/dbraw/zinc/55/95/53/1128559553.db2.gz HKHIXBIBVTYKIC-ZNOIYHFQSA-N 1 0 326.396 3.856 20 5 EHBDRO COc1cc(C[NH+]2[C@@H](C)CC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000123120786 1128611553 /nfs/dbraw/zinc/61/15/53/1128611553.db2.gz PPABTBCBVMJTSZ-UWVGGRQHSA-N 1 0 330.331 3.578 20 5 EHBDRO C[C@H]1C[C@H](Nc2ncc([N+](=O)[O-])cc2Cl)C[N@@H+]1Cc1ccccc1 ZINC000301636019 1128776707 /nfs/dbraw/zinc/77/67/07/1128776707.db2.gz WRDYUQICNGYRKI-JSGCOSHPSA-N 1 0 346.818 3.718 20 5 EHBDRO Cc1ccc([C@H](C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)N2CCCC2)o1 ZINC000237630782 1120314041 /nfs/dbraw/zinc/31/40/41/1120314041.db2.gz CCDRABYAWPKYKM-SFHVURJKSA-N 1 0 343.427 3.731 20 5 EHBDRO C[C@@H]1CC[C@@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@H](C)C1 ZINC000765955595 1128916120 /nfs/dbraw/zinc/91/61/20/1128916120.db2.gz AAHPZVQJWPXIDZ-SPYBWZPUSA-N 1 0 331.460 3.978 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@](C)(Cc1ccccc1)[C@@H](C)O ZINC000191715977 1120689840 /nfs/dbraw/zinc/68/98/40/1120689840.db2.gz SFUQEZHDIVPNSD-OXQOHEQNSA-N 1 0 342.439 3.623 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)cc1 ZINC000494621278 1120701355 /nfs/dbraw/zinc/70/13/55/1120701355.db2.gz QTDCFDCAGRSBST-GUDVDZBRSA-N 1 0 344.455 3.855 20 5 EHBDRO Cc1c(NC(=O)CC[N@H+](CC2CCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000193215449 1120985599 /nfs/dbraw/zinc/98/55/99/1120985599.db2.gz IYXKWXCVJUMTHQ-UHFFFAOYSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCO[C@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000090540461 1121262833 /nfs/dbraw/zinc/26/28/33/1121262833.db2.gz YQRFHTLOLITXKL-JLJPHGGASA-N 1 0 336.457 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+]2CCCC[C@@H]2c2ccccc2)cc1 ZINC000762632415 1121389581 /nfs/dbraw/zinc/38/95/81/1121389581.db2.gz ISOBYQUINFZCMX-RTBURBONSA-N 1 0 326.396 3.855 20 5 EHBDRO C[N@@H+]1CC[C@H]2[C@H](CCCN2c2ccc(C(F)(F)F)cc2[N+](=O)[O-])C1 ZINC000301724056 1128997698 /nfs/dbraw/zinc/99/76/98/1128997698.db2.gz OOUGQRCVZABZGV-YPMHNXCESA-N 1 0 343.349 3.534 20 5 EHBDRO CC(C)(CCc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000153953753 1122133131 /nfs/dbraw/zinc/13/31/31/1122133131.db2.gz XJIXHKJQYORKPI-GOSISDBHSA-N 1 0 328.412 3.629 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC1CCC([NH+]2CCC(C)CC2)CC1 ZINC000301760104 1129035091 /nfs/dbraw/zinc/03/50/91/1129035091.db2.gz CAHRPUCSVMBWSV-UHFFFAOYSA-N 1 0 332.448 3.753 20 5 EHBDRO C[C@@H]1[C@@H](c2ccccc2)CC[N@@H+]1C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000154427761 1122624759 /nfs/dbraw/zinc/62/47/59/1122624759.db2.gz ZWPJTEUBXXIFQJ-CCKFTAQKSA-N 1 0 326.396 3.506 20 5 EHBDRO CCC[N@H+](Cc1ccc(C)c([N+](=O)[O-])c1)[C@@H]1[C@@H]2CCO[C@H]2C1(C)C ZINC000556896388 1123173109 /nfs/dbraw/zinc/17/31/09/1123173109.db2.gz VWVFKWYFGVRFAG-CGTJXYLNSA-N 1 0 332.444 3.929 20 5 EHBDRO COC(=O)C(C)(C)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000499237232 1123290879 /nfs/dbraw/zinc/29/08/79/1123290879.db2.gz YOZNSOHJUJRCCP-UHFFFAOYSA-N 1 0 348.424 3.612 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](c2ccco2)C1 ZINC000609539970 1123607370 /nfs/dbraw/zinc/60/73/70/1123607370.db2.gz LLPGIGRHURUTHB-AWEZNQCLSA-N 1 0 330.384 3.965 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H](CCCO)c1ccccc1 ZINC000179736554 1123839183 /nfs/dbraw/zinc/83/91/83/1123839183.db2.gz HKJRWCAMOJDRKI-MRXNPFEDSA-N 1 0 334.803 3.852 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH+]1CCC([C@@H]2CCOC2)CC1 ZINC000615837666 1123885148 /nfs/dbraw/zinc/88/51/48/1123885148.db2.gz UPZHNPPLYLOFAU-VHUCWBOISA-N 1 0 330.428 3.747 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](c1ccnn1C)C(C)C ZINC000615943142 1123912787 /nfs/dbraw/zinc/91/27/87/1123912787.db2.gz FWFKYIRFOORGKX-KAPURRDVSA-N 1 0 342.443 3.761 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]C[C@@H]2CCCCO2)s1 ZINC000237956200 1123925143 /nfs/dbraw/zinc/92/51/43/1123925143.db2.gz HXYKPDNTAMRANQ-ZDUSSCGKSA-N 1 0 332.425 3.982 20 5 EHBDRO CC(C)n1ncc2c1C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])CC2 ZINC000616484802 1124003911 /nfs/dbraw/zinc/00/39/11/1124003911.db2.gz FVAUPWWGHNBIMJ-WVRJYTFGSA-N 1 0 340.427 3.533 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1cccc(F)c1F ZINC000182001660 1125110503 /nfs/dbraw/zinc/11/05/03/1125110503.db2.gz ZBTFPVGQNAVPHV-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618568530 1125113544 /nfs/dbraw/zinc/11/35/44/1125113544.db2.gz FANMGMVXCQQQKY-GOSISDBHSA-N 1 0 341.411 3.782 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000618571687 1125120611 /nfs/dbraw/zinc/12/06/11/1125120611.db2.gz LAQVIQHTMXWDJK-XMCHAPAWSA-N 1 0 340.423 3.726 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)C(C)(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000182611364 1125342985 /nfs/dbraw/zinc/34/29/85/1125342985.db2.gz FNPDQIALWHXRNG-SNVBAGLBSA-N 1 0 346.374 3.772 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)CC(=O)Nc1cccc([N+](=O)[O-])c1)c1ccsc1 ZINC000619754270 1125395436 /nfs/dbraw/zinc/39/54/36/1125395436.db2.gz FJORAUWNBPPQAM-NWDGAFQWSA-N 1 0 333.413 3.724 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@@H]1CCOc2ccccc21 ZINC000619846216 1125416183 /nfs/dbraw/zinc/41/61/83/1125416183.db2.gz FANHWGMBHCWYSN-INIZCTEOSA-N 1 0 326.396 3.635 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1C(F)(F)F ZINC000369968319 1129224945 /nfs/dbraw/zinc/22/49/45/1129224945.db2.gz YUEBOHNZJPHRLF-NEPJUHHUSA-N 1 0 329.322 3.652 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+](C)[C@H]1CCCC[C@H]1C ZINC000255959009 1129237760 /nfs/dbraw/zinc/23/77/60/1129237760.db2.gz LWQLSZVXMZRBRX-PBHICJAKSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCC[C@@H](C)[C@H]1C ZINC000255954996 1129237971 /nfs/dbraw/zinc/23/79/71/1129237971.db2.gz YQKXGEKHLKTQKS-SUYBPPKGSA-N 1 0 333.432 3.646 20 5 EHBDRO C[N@@H+]1CC[C@H](Nc2ccc([N+](=O)[O-])cn2)[C@H]1c1ccc(Cl)cc1 ZINC000301878816 1129248807 /nfs/dbraw/zinc/24/88/07/1129248807.db2.gz ORELWPSNDJSXRK-GOEBONIOSA-N 1 0 332.791 3.501 20 5 EHBDRO CCC[N@H+](CC)CCNCc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000080242017 1129339837 /nfs/dbraw/zinc/33/98/37/1129339837.db2.gz ILHIKNZHZTVZAJ-UHFFFAOYSA-N 1 0 348.472 3.540 20 5 EHBDRO CN1CC[C@@H](Nc2ccccc2[N+](=O)[O-])[C@H]1c1ccc(F)c(F)c1 ZINC000301915217 1129347164 /nfs/dbraw/zinc/34/71/64/1129347164.db2.gz VGUKRBFFWXTONX-NVXWUHKLSA-N 1 0 333.338 3.730 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC[C@H]3CCOC3)s2)cc1 ZINC000543227963 1129352359 /nfs/dbraw/zinc/35/23/59/1129352359.db2.gz RCMJBPDZJOCHTO-ZDUSSCGKSA-N 1 0 332.425 3.840 20 5 EHBDRO Cc1cc(Nc2cccc(CC[NH+]3CCCC3)c2)ncc1[N+](=O)[O-] ZINC000301929711 1129370166 /nfs/dbraw/zinc/37/01/66/1129370166.db2.gz JQRGRNJYUMKRSF-UHFFFAOYSA-N 1 0 326.400 3.680 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCCO[C@H]1CCCCO1 ZINC000922232199 1129383560 /nfs/dbraw/zinc/38/35/60/1129383560.db2.gz KLNAEDLTTPYUSR-XOVFHRFOSA-N 1 0 334.416 3.521 20 5 EHBDRO C[NH+](C)CCc1ccc(CNc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000466436058 1129445451 /nfs/dbraw/zinc/44/54/51/1129445451.db2.gz DESFDUDYXVVLME-UHFFFAOYSA-N 1 0 333.819 3.964 20 5 EHBDRO COc1cc(N2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)ccc1[N+](=O)[O-] ZINC000301975778 1129465398 /nfs/dbraw/zinc/46/53/98/1129465398.db2.gz CZSMICIJYPRJIF-INIZCTEOSA-N 1 0 347.459 3.552 20 5 EHBDRO COCC[C@H](Cc1ccco1)[NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C ZINC000543427516 1129482911 /nfs/dbraw/zinc/48/29/11/1129482911.db2.gz BHVFJDDAZVMMES-HUUCEWRRSA-N 1 0 332.400 3.795 20 5 EHBDRO CCC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)C1 ZINC000466494517 1129492324 /nfs/dbraw/zinc/49/23/24/1129492324.db2.gz DFTCOBWYXOJIAK-GJZGRUSLSA-N 1 0 333.432 3.742 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)N(C)C)c1 ZINC000154971412 1129602355 /nfs/dbraw/zinc/60/23/55/1129602355.db2.gz SXKUKTHZPGPJSM-KUHUBIRLSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1ccc([C@H](C)NCc2c(F)cc([N+](=O)[O-])cc2F)cc1F ZINC000508975855 1129604758 /nfs/dbraw/zinc/60/47/58/1129604758.db2.gz CZZDMFSFBUJTMK-VIFPVBQESA-N 1 0 340.301 3.872 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)(C)CC1 ZINC000330456812 1129637689 /nfs/dbraw/zinc/63/76/89/1129637689.db2.gz OETAUKSQXGZYJV-GFCCVEGCSA-N 1 0 330.388 3.828 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[NH+]1CCC(C)(C)CC1 ZINC000330456813 1129637766 /nfs/dbraw/zinc/63/77/66/1129637766.db2.gz OETAUKSQXGZYJV-LBPRGKRZSA-N 1 0 330.388 3.828 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2nc3c(s2)CCC3)c(Cl)c1 ZINC000922715058 1129638612 /nfs/dbraw/zinc/63/86/12/1129638612.db2.gz OZGYBSCLCCJIDG-UHFFFAOYSA-N 1 0 337.832 3.526 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1ccc(F)cc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000124853265 1129640156 /nfs/dbraw/zinc/64/01/56/1129640156.db2.gz IKGCIRFRFDBAEG-SCLBCKFNSA-N 1 0 331.391 3.687 20 5 EHBDRO Cc1nc2c(cccc2CC[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)o1 ZINC000922770252 1129658906 /nfs/dbraw/zinc/65/89/06/1129658906.db2.gz IBBROZVXSUYNRP-UHFFFAOYSA-N 1 0 325.368 3.685 20 5 EHBDRO C[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2OC(F)F)CCS1 ZINC000922844759 1129691042 /nfs/dbraw/zinc/69/10/42/1129691042.db2.gz ZESQCZXUIVSJSO-KOLCDFICSA-N 1 0 332.372 3.570 20 5 EHBDRO C[C@H](Nc1ncc([N+](=O)[O-])cc1Cl)[C@@H]1CCC[N@@H+](C2CCC2)C1 ZINC000302051572 1129766051 /nfs/dbraw/zinc/76/60/51/1129766051.db2.gz OCOCNFJNRACJEQ-NWDGAFQWSA-N 1 0 338.839 3.708 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H](Nc2cc(C)[nH+]c3ccc([N+](=O)[O-])cc23)C1 ZINC000302094569 1129767681 /nfs/dbraw/zinc/76/76/81/1129767681.db2.gz RHECFTYIVVKHPX-OLZOCXBDSA-N 1 0 343.383 3.595 20 5 EHBDRO C[C@@H](C[NH+]1CCCCCC1)Nc1ccc([N+](=O)[O-])c2cnccc12 ZINC000302339297 1129776028 /nfs/dbraw/zinc/77/60/28/1129776028.db2.gz BLJVHVMGXLSNON-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CCC[N@H+](C)C[C@@H]1CCN(c2c(C)cc([N+](=O)[O-])cc2Cl)C1 ZINC000302718249 1129787969 /nfs/dbraw/zinc/78/79/69/1129787969.db2.gz YZAXAGQYCRPKEZ-ZDUSSCGKSA-N 1 0 325.840 3.725 20 5 EHBDRO Cc1cc(N2CC[C@H](Nc3ccc([N+](=O)[O-])cn3)C2)c2ccccc2[nH+]1 ZINC000302728228 1129788234 /nfs/dbraw/zinc/78/82/34/1129788234.db2.gz KRHHPBZKJNWNJN-AWEZNQCLSA-N 1 0 349.394 3.537 20 5 EHBDRO CO[C@@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1ccccc1 ZINC000131410057 1129793508 /nfs/dbraw/zinc/79/35/08/1129793508.db2.gz DBLQHSMRPDNLFB-QUCCMNQESA-N 1 0 340.423 3.893 20 5 EHBDRO CCN(C(=O)[C@H](C)[NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000056196837 1129805906 /nfs/dbraw/zinc/80/59/06/1129805906.db2.gz VJEGJRHJRRZYOX-CABCVRRESA-N 1 0 341.411 3.687 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)[C@@H](O)c1ccc(F)cc1 ZINC000766031316 1129854902 /nfs/dbraw/zinc/85/49/02/1129854902.db2.gz WVORTLDORGJWNP-VEVIJQCQSA-N 1 0 332.375 3.815 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@@H](C)c1oc2ccccc2c1C ZINC000602810629 1129904007 /nfs/dbraw/zinc/90/40/07/1129904007.db2.gz NELRYIGNPOPTOY-LBPRGKRZSA-N 1 0 328.372 3.505 20 5 EHBDRO CC[C@H]([NH2+]CCCCNc1ccccn1)c1cccc([N+](=O)[O-])c1 ZINC000162899020 1129910881 /nfs/dbraw/zinc/91/08/81/1129910881.db2.gz RJEIKEOGVMMPND-KRWDZBQOSA-N 1 0 328.416 3.923 20 5 EHBDRO CC1CCC([NH+]2CCN(C/C=C\c3ccccc3[N+](=O)[O-])CC2)CC1 ZINC000254884745 1129964539 /nfs/dbraw/zinc/96/45/39/1129964539.db2.gz AQEJTWWCXNGERZ-XQRVVYSFSA-N 1 0 343.471 3.804 20 5 EHBDRO CCCCNC(=O)[C@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245521614 1130230506 /nfs/dbraw/zinc/23/05/06/1130230506.db2.gz LAWUPBSGLNPYMT-CVEARBPZSA-N 1 0 347.459 3.593 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H](C)[C@@H](O)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000246583680 1130393457 /nfs/dbraw/zinc/39/34/57/1130393457.db2.gz YUFQCASTCFSPRM-KHYOSLBOSA-N 1 0 328.412 3.546 20 5 EHBDRO C[C@H](c1ccccc1)N1CC[C@@H]([NH2+]CCc2ccc([N+](=O)[O-])cc2)C1 ZINC000246834671 1130417435 /nfs/dbraw/zinc/41/74/35/1130417435.db2.gz LCHMBGLOCYKIQB-VQIMIIECSA-N 1 0 339.439 3.562 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]Cc2csc3ccccc23)cc1 ZINC000731678409 1130832123 /nfs/dbraw/zinc/83/21/23/1130832123.db2.gz LYIJFJAFQPWFDF-MRXNPFEDSA-N 1 0 328.393 3.633 20 5 EHBDRO Cc1ccc(C[NH2+]CC(=O)Nc2cccc3ccccc32)cc1[N+](=O)[O-] ZINC000732230838 1130902971 /nfs/dbraw/zinc/90/29/71/1130902971.db2.gz CBJUSMCBMRNWPL-UHFFFAOYSA-N 1 0 349.390 3.785 20 5 EHBDRO C[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1cnn(-c2ccccc2)c1 ZINC000766193630 1131159774 /nfs/dbraw/zinc/15/97/74/1131159774.db2.gz MIKVULHSFRJRDO-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CC(C)[C@H]1CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)CC1 ZINC000738241924 1131465715 /nfs/dbraw/zinc/46/57/15/1131465715.db2.gz VASOVEKMWDWZRQ-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cccc(Cl)n1)CC2 ZINC001172900884 1131883932 /nfs/dbraw/zinc/88/39/32/1131883932.db2.gz HLRIKQBIAXMIHG-AWEZNQCLSA-N 1 0 331.803 3.680 20 5 EHBDRO [NH2+]=C(N[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(F)c(F)c1 ZINC001172900417 1131884238 /nfs/dbraw/zinc/88/42/38/1131884238.db2.gz TVXAJDNGYXFYIY-AWEZNQCLSA-N 1 0 345.349 3.736 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)n1 ZINC001172902371 1131885352 /nfs/dbraw/zinc/88/53/52/1131885352.db2.gz XTGBLMHVJCFABP-WMLDXEAASA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H]1CCCc3ccncc31)CC2 ZINC001172908184 1131888392 /nfs/dbraw/zinc/88/83/92/1131888392.db2.gz KZQZIBNJZVRDQT-PXNSSMCTSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CC[C@H](C(F)(F)F)C1)CC2 ZINC001172914272 1131903154 /nfs/dbraw/zinc/90/31/54/1131903154.db2.gz GFDYQZACDTXDLG-KBPBESRZSA-N 1 0 328.334 3.726 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CC[C@H](COCC3CC3)C1)CC2 ZINC001172919275 1131904304 /nfs/dbraw/zinc/90/43/04/1131904304.db2.gz FLKBJKLQVMIMJE-QFBILLFUSA-N 1 0 344.455 3.591 20 5 EHBDRO CCC[C@]1(C)CCC[N@H+](Cn2cnc(-c3cccc([N+](=O)[O-])c3)n2)C1 ZINC000743404697 1131916926 /nfs/dbraw/zinc/91/69/26/1131916926.db2.gz BQKOOTGWSMCVFX-GOSISDBHSA-N 1 0 343.431 3.713 20 5 EHBDRO CC1(C)CC([NH2+]C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)C1 ZINC001173008423 1131935928 /nfs/dbraw/zinc/93/59/28/1131935928.db2.gz YLWDQMZTSRJHDN-UHFFFAOYSA-N 1 0 339.386 3.620 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[N@@H+]2CCCC3(CCC3)C2)c1F ZINC001173191656 1131995478 /nfs/dbraw/zinc/99/54/78/1131995478.db2.gz FORQIYVTBWHAII-CYBMUJFWSA-N 1 0 336.407 3.940 20 5 EHBDRO C[NH2+]Cc1cccc(N[C@@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c1 ZINC001173195889 1131996057 /nfs/dbraw/zinc/99/60/57/1131996057.db2.gz JWMYWQLZLXLABI-LBPRGKRZSA-N 1 0 347.390 3.505 20 5 EHBDRO COc1ccc(F)c(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173216003 1132001751 /nfs/dbraw/zinc/00/17/51/1132001751.db2.gz GYDMZIYPTRFSPW-NSHDSACASA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccc2c(c1)C[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)CC2 ZINC001173218465 1132002824 /nfs/dbraw/zinc/00/28/24/1132002824.db2.gz KAGLIASRGBKWOG-KBXCAEBGSA-N 1 0 340.423 3.682 20 5 EHBDRO Cc1ncccc1[C@H]([NH2+][C@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173218373 1132003090 /nfs/dbraw/zinc/00/30/90/1132003090.db2.gz ANOMXACYSIRVLM-BFUOFWGJSA-N 1 0 325.412 3.970 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1CCOc2cc(F)cc(F)c21 ZINC001173220255 1132004130 /nfs/dbraw/zinc/00/41/30/1132004130.db2.gz WSXKNVDYUIYDLT-BDJLRTHQSA-N 1 0 348.349 3.917 20 5 EHBDRO CCOC(=O)[C@@]1(C)CCCC[N@@H+]([C@H](C)Cc2ccc([N+](=O)[O-])cc2)C1 ZINC001173223252 1132005024 /nfs/dbraw/zinc/00/50/24/1132005024.db2.gz ZEFPSUGKFYKGCA-BEFAXECRSA-N 1 0 348.443 3.581 20 5 EHBDRO COc1ccc([C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)nc1 ZINC001173223221 1132005839 /nfs/dbraw/zinc/00/58/39/1132005839.db2.gz HCUPIZMRRLGNJW-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1cccnc1 ZINC001173225584 1132006499 /nfs/dbraw/zinc/00/64/99/1132006499.db2.gz SETQQEVEXOPXMU-HNNXBMFYSA-N 1 0 327.428 3.779 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1OC ZINC001173227216 1132006760 /nfs/dbraw/zinc/00/67/60/1132006760.db2.gz OKJKPBKIJVXAOS-AWEZNQCLSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@@H]1Cc2ccc(Cl)cc2C1 ZINC001173225359 1132007000 /nfs/dbraw/zinc/00/70/00/1132007000.db2.gz JMPZREPYBLQDKL-SJKOYZFVSA-N 1 0 330.815 3.936 20 5 EHBDRO COc1cccnc1[C@@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173228807 1132008299 /nfs/dbraw/zinc/00/82/99/1132008299.db2.gz KLGGMNMMAQCISX-UGSOOPFHSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH+]1CCC(C(=O)OC(C)(C)C)CC1 ZINC001173228605 1132008417 /nfs/dbraw/zinc/00/84/17/1132008417.db2.gz YFOYLIKIAVNTNB-CQSZACIVSA-N 1 0 348.443 3.580 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H]1Cc1ccccn1 ZINC001173228544 1132008433 /nfs/dbraw/zinc/00/84/33/1132008433.db2.gz XMSPKYVQYRCTLA-KXBFYZLASA-N 1 0 325.412 3.628 20 5 EHBDRO CSc1ccc(OCC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC001173234073 1132010606 /nfs/dbraw/zinc/01/06/06/1132010606.db2.gz MAOQGLUTAVFWSW-AWEZNQCLSA-N 1 0 346.452 3.916 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)n1cc(CC[NH3+])c2cc(F)ccc21 ZINC001173213528 1132013545 /nfs/dbraw/zinc/01/35/45/1132013545.db2.gz IGXMMTOQUDRDFI-ZDUSSCGKSA-N 1 0 341.386 3.994 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CCOc1ccccc1Cl ZINC001173210796 1132013971 /nfs/dbraw/zinc/01/39/71/1132013971.db2.gz NOAUNJXKAFNIII-ZDUSSCGKSA-N 1 0 334.803 3.848 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@H+](C1CCCC1)C1CCN(C)CC1 ZINC001173238088 1132026693 /nfs/dbraw/zinc/02/66/93/1132026693.db2.gz MXBKHSMOVKBUDF-INIZCTEOSA-N 1 0 345.487 3.865 20 5 EHBDRO O=[N+]([O-])c1ccc(Nc2ccc(OCC[NH+]3CCCC3)cc2)cc1 ZINC001174478549 1132381556 /nfs/dbraw/zinc/38/15/56/1132381556.db2.gz OIDTVUVMLACCFF-UHFFFAOYSA-N 1 0 327.384 3.813 20 5 EHBDRO CC(C)(C)O[C@@H]1C[C@H]([NH2+]CCOc2cccc([N+](=O)[O-])c2)C12CCC2 ZINC001174565688 1132417180 /nfs/dbraw/zinc/41/71/80/1132417180.db2.gz RPLPDEQHZZHFGR-DLBZAZTESA-N 1 0 348.443 3.690 20 5 EHBDRO COC(=O)[C@@H]1CCCC[C@@H]1C[N@H+](Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001168860257 1132583187 /nfs/dbraw/zinc/58/31/87/1132583187.db2.gz VYKFJNJSGUQUPC-CRAIPNDOSA-N 1 0 346.427 3.539 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+][C@@H]2CCc3c2cccc3OC(F)(F)F)C1 ZINC001168978234 1132618234 /nfs/dbraw/zinc/61/82/34/1132618234.db2.gz QCYBTWKFCAAHMJ-JTNHKYCSSA-N 1 0 344.333 3.608 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cc(C(F)(F)F)ccc2Cl)C1 ZINC001168956342 1132619828 /nfs/dbraw/zinc/61/98/28/1132619828.db2.gz AXRQLSSOQZCFCA-CABZTGNLSA-N 1 0 336.741 3.894 20 5 EHBDRO CC[C@@H]([NH2+][C@@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1 ZINC001169005897 1132629813 /nfs/dbraw/zinc/62/98/13/1132629813.db2.gz VQQPYZZNIBOFRD-KCPJHIHWSA-N 1 0 341.249 3.935 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccccc1C(F)(F)F ZINC001168990398 1132634633 /nfs/dbraw/zinc/63/46/33/1132634633.db2.gz CIQAIXNNSIHELO-NEPJUHHUSA-N 1 0 330.350 3.976 20 5 EHBDRO CC(C)C[C@@H]([NH3+])c1nc2ccccc2n1[C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168990235 1132634975 /nfs/dbraw/zinc/63/49/75/1132634975.db2.gz YUOIIIBSAMEHOZ-QLFBSQMISA-N 1 0 330.432 3.700 20 5 EHBDRO CC1(C)[C@H](c2ccccc2F)CC[N@@H+]1Cc1cccnc1[N+](=O)[O-] ZINC001175454430 1132686964 /nfs/dbraw/zinc/68/69/64/1132686964.db2.gz STUNELFNLJBWEK-HNNXBMFYSA-N 1 0 329.375 3.897 20 5 EHBDRO CC[NH+](CC)Cc1ccc(CNc2ccc(N)cc2[N+](=O)[O-])cc1 ZINC000804332556 1132802953 /nfs/dbraw/zinc/80/29/53/1132802953.db2.gz MBDZVXCPEQCWOH-UHFFFAOYSA-N 1 0 328.416 3.631 20 5 EHBDRO CC[N@@H+]1CC[C@H](N(C)Cc2ccc(Cl)c([N+](=O)[O-])c2)C[C@H]1C ZINC000768555297 1133155311 /nfs/dbraw/zinc/15/53/11/1133155311.db2.gz PTUBEMVHGYPQCN-OCCSQVGLSA-N 1 0 325.840 3.553 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](C[C@H](O)c2cccc(Cl)c2)C2CC2)c1 ZINC000768544276 1133157952 /nfs/dbraw/zinc/15/79/52/1133157952.db2.gz KUXCNTBBHQELRU-SFHVURJKSA-N 1 0 346.814 3.946 20 5 EHBDRO Cc1c(C[NH2+]CCOc2ccc(F)c(Cl)c2)cccc1[N+](=O)[O-] ZINC001178758998 1133196618 /nfs/dbraw/zinc/19/66/18/1133196618.db2.gz QIWVZUVOFPAEIQ-UHFFFAOYSA-N 1 0 338.766 3.864 20 5 EHBDRO Cc1ccncc1CC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC001179109885 1133229310 /nfs/dbraw/zinc/22/93/10/1133229310.db2.gz BRTNESAUMPOYMV-UHFFFAOYSA-N 1 0 337.379 3.891 20 5 EHBDRO C[C@]1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@@H]1c1ccccc1 ZINC001181267692 1133474263 /nfs/dbraw/zinc/47/42/63/1133474263.db2.gz UIASQOFZOIEMQT-DNVCBOLYSA-N 1 0 336.395 3.755 20 5 EHBDRO [NH3+]Cc1ccc2nnn(-c3nc4ccccc4c4ccccc43)c2c1 ZINC001170025922 1133543369 /nfs/dbraw/zinc/54/33/69/1133543369.db2.gz ICOUCPPKVBFRMQ-UHFFFAOYSA-N 1 0 325.375 3.581 20 5 EHBDRO Cc1ncc2c(n1)CCC[C@H]2[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000774204208 1133633197 /nfs/dbraw/zinc/63/31/97/1133633197.db2.gz QGGNVUOCWKYDSV-PKOBYXMFSA-N 1 0 338.411 3.738 20 5 EHBDRO Cc1ccsc1CC[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000774476308 1133686443 /nfs/dbraw/zinc/68/64/43/1133686443.db2.gz UXXZYPYMCWNJQM-UHFFFAOYSA-N 1 0 345.468 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCC[C@@H](C(=O)OC(C)(C)C)C1 ZINC001183397135 1133798908 /nfs/dbraw/zinc/79/89/08/1133798908.db2.gz ZYTXOZZTISBHGB-OAHLLOKOSA-N 1 0 348.443 3.765 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000786809874 1133909739 /nfs/dbraw/zinc/90/97/39/1133909739.db2.gz ADCCVCGNGUTZFX-UKTHLTGXSA-N 1 0 327.340 3.696 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@](C)(O)c1ccc(F)cc1 ZINC000786819379 1133911370 /nfs/dbraw/zinc/91/13/70/1133911370.db2.gz BVYCCROTPWBWHT-ATEOEAFZSA-N 1 0 344.386 3.635 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC[C@H]2c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000774837304 1134043893 /nfs/dbraw/zinc/04/38/93/1134043893.db2.gz PGVCOOKUQYTPPF-INIZCTEOSA-N 1 0 345.330 3.979 20 5 EHBDRO C[C@H]([NH2+]C(C)(C)CNc1c(Cl)cncc1[N+](=O)[O-])c1ccccc1 ZINC001185241016 1134056248 /nfs/dbraw/zinc/05/62/48/1134056248.db2.gz DBUVZLVWZSVHDA-LBPRGKRZSA-N 1 0 348.834 3.606 20 5 EHBDRO CCCOc1ccc(C[NH2+][C@@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788543612 1134140347 /nfs/dbraw/zinc/14/03/47/1134140347.db2.gz XYHORRJSLUKCAF-ZDUSSCGKSA-N 1 0 329.400 3.817 20 5 EHBDRO C[C@H](C[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)COCc1ccccc1 ZINC000788568806 1134146452 /nfs/dbraw/zinc/14/64/52/1134146452.db2.gz DGKJJOJCADTMCP-CABCVRRESA-N 1 0 343.427 3.681 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc21 ZINC000788590081 1134148256 /nfs/dbraw/zinc/14/82/56/1134148256.db2.gz RYGOUWHXOOPSEX-YOEHRIQHSA-N 1 0 346.427 3.593 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631775 1134153573 /nfs/dbraw/zinc/15/35/73/1134153573.db2.gz MWZZSBBOSVDGHN-MEDUHNTESA-N 1 0 327.384 3.524 20 5 EHBDRO COc1cccc2c1CC[C@@H]2[NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788631776 1134153808 /nfs/dbraw/zinc/15/38/08/1134153808.db2.gz MWZZSBBOSVDGHN-ZBEGNZNMSA-N 1 0 327.384 3.524 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1F ZINC000788664782 1134159059 /nfs/dbraw/zinc/15/90/59/1134159059.db2.gz KSYZHWXBJLBLKA-GHMZBOCLSA-N 1 0 333.363 3.737 20 5 EHBDRO CC[C@@H](C)[NH+]1CCN(c2c3cccc(Cl)c3ncc2[N+](=O)[O-])CC1 ZINC001186452188 1134214425 /nfs/dbraw/zinc/21/44/25/1134214425.db2.gz OLWIPPNXOMDCLS-GFCCVEGCSA-N 1 0 348.834 3.717 20 5 EHBDRO C[N@@H+]1C[C@@H]2CC[C@@H](Nc3c(Cl)c(Cl)ccc3[N+](=O)[O-])[C@@H]2C1 ZINC001187913799 1134396142 /nfs/dbraw/zinc/39/61/42/1134396142.db2.gz QCYXKPKVKRNJLG-IQJOONFLSA-N 1 0 330.215 3.654 20 5 EHBDRO CC1(C)C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@H]1C(F)(F)F ZINC000792355351 1134680470 /nfs/dbraw/zinc/68/04/70/1134680470.db2.gz RIZRZAOKKHZSNG-ZIAGYGMSSA-N 1 0 346.349 3.539 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1ccc([Si](C)(C)C)cc1 ZINC001170196187 1134711997 /nfs/dbraw/zinc/71/19/97/1134711997.db2.gz YHMGEMBETYYNPP-UHFFFAOYSA-N 1 0 342.515 3.815 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](CF)c2ccccc2)c([N+](=O)[O-])c1 ZINC001170304527 1134739215 /nfs/dbraw/zinc/73/92/15/1134739215.db2.gz DMFAFUGBGPEOMA-SUMWQHHRSA-N 1 0 332.375 3.835 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H](C)c2cccc(C)n2)c([N+](=O)[O-])c1 ZINC001170305634 1134739778 /nfs/dbraw/zinc/73/97/78/1134739778.db2.gz OIOACKUJVQXWOL-ZIAGYGMSSA-N 1 0 329.400 3.589 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2C[C@@H]2c2ccccc2)c([N+](=O)[O-])c1 ZINC001170307462 1134752976 /nfs/dbraw/zinc/75/29/76/1134752976.db2.gz GDMDZPIDSDDJLY-VHSSKADRSA-N 1 0 326.396 3.680 20 5 EHBDRO O=[N+]([O-])c1ccc(OCCC[N@@H+]2CCS[C@@H]3CCCC[C@@H]32)cc1 ZINC001191368238 1134858629 /nfs/dbraw/zinc/85/86/29/1134858629.db2.gz YYKXFLVXSSLJKS-DLBZAZTESA-N 1 0 336.457 3.724 20 5 EHBDRO CCCCC[C@@H](C)NC(=O)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000775549926 1135060194 /nfs/dbraw/zinc/06/01/94/1135060194.db2.gz RTIPSDATMOCODV-HUUCEWRRSA-N 1 0 335.448 3.639 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2nc(Cl)ccc2[N+](=O)[O-])CC1(C)C ZINC001170450619 1135067968 /nfs/dbraw/zinc/06/79/68/1135067968.db2.gz CVHIXHZMODGVHC-UHFFFAOYSA-N 1 0 326.828 3.707 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1N1CC[C@@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000804564496 1135121782 /nfs/dbraw/zinc/12/17/82/1135121782.db2.gz WWXZAOGNVYCPLP-SWLSCSKDSA-N 1 0 335.835 3.701 20 5 EHBDRO O=[N+]([O-])c1cnn(CC[NH2+][C@@H](c2ccccc2)C2CCCCC2)c1 ZINC000775629052 1135348563 /nfs/dbraw/zinc/34/85/63/1135348563.db2.gz NLVXVNWRYAEWTQ-SFHVURJKSA-N 1 0 328.416 3.703 20 5 EHBDRO CC1(C)c2ccccc2CC[N@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC001195384733 1135421703 /nfs/dbraw/zinc/42/17/03/1135421703.db2.gz CYACJYBMNPJHPE-UHFFFAOYSA-N 1 0 326.396 3.767 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC[C@](C)(c2cccc(F)c2)C1 ZINC001195851589 1135475509 /nfs/dbraw/zinc/47/55/09/1135475509.db2.gz LQBBESJWKNJXLI-IBGZPJMESA-N 1 0 344.386 3.906 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@@H+](Cc2cc(C(=O)OC)ccc2[N+](=O)[O-])C1 ZINC001196613094 1135589710 /nfs/dbraw/zinc/58/97/10/1135589710.db2.gz HTUWVHRXYYYZRL-XGACYXMMSA-N 1 0 332.400 3.560 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H]1CNC(=O)c1cc2ccccc2c2cccnc12 ZINC001131095626 1135591674 /nfs/dbraw/zinc/59/16/74/1135591674.db2.gz KYRMPSASJUIVAA-MRXNPFEDSA-N 1 0 347.462 3.991 20 5 EHBDRO COC(=O)C(C)(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1C)CC(C)C ZINC001197325551 1135679999 /nfs/dbraw/zinc/67/99/99/1135679999.db2.gz JGEAORBMBMPGCP-UHFFFAOYSA-N 1 0 336.432 3.560 20 5 EHBDRO C[C@@]1(Cc2cccs2)CCC[N@@H+]1C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC001198301960 1135796640 /nfs/dbraw/zinc/79/66/40/1135796640.db2.gz ZCKWGIQDQIPLQM-ROUUACIJSA-N 1 0 346.452 3.787 20 5 EHBDRO C[C@@]12CSC[C@@H]1C[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)C2 ZINC001198468478 1135818638 /nfs/dbraw/zinc/81/86/38/1135818638.db2.gz WWBGTXDGHUBVEX-SMDDNHRTSA-N 1 0 346.374 3.799 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1(CO)CCCCC1 ZINC000809964026 1135904433 /nfs/dbraw/zinc/90/44/33/1135904433.db2.gz CVKGIVAUDPPKGV-UHFFFAOYSA-N 1 0 333.215 3.686 20 5 EHBDRO CC[N@@H+]1CCC[C@@H](CNCc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC001199843916 1135931863 /nfs/dbraw/zinc/93/18/63/1135931863.db2.gz SJBVADALIZUJQA-HNNXBMFYSA-N 1 0 343.427 3.676 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCC[C@H](C2CCOCC2)C1 ZINC001201635034 1136045410 /nfs/dbraw/zinc/04/54/10/1136045410.db2.gz XZUDRUDMSJRXDG-RDJZCZTQSA-N 1 0 348.443 3.678 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C[C@H]1CCC[C@H](O)C1 ZINC000811481532 1136091381 /nfs/dbraw/zinc/09/13/81/1136091381.db2.gz FDWSICKOMNCOQE-CABZTGNLSA-N 1 0 333.215 3.542 20 5 EHBDRO CO[C@@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483479 1136092106 /nfs/dbraw/zinc/09/21/06/1136092106.db2.gz JYKADJLSOLKYEW-VXGBXAGGSA-N 1 0 333.215 3.805 20 5 EHBDRO CO[C@H]1CCC[C@H]1C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811486139 1136092614 /nfs/dbraw/zinc/09/26/14/1136092614.db2.gz JXDGWMPEMBYPSY-ZANVPECISA-N 1 0 333.215 3.806 20 5 EHBDRO CC(C)c1ccc(C[N@H+](C)C[C@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776271685 1136124351 /nfs/dbraw/zinc/12/43/51/1136124351.db2.gz NDIURPJBPVTVRF-IBGZPJMESA-N 1 0 328.412 3.884 20 5 EHBDRO CC(C)[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000776277106 1136126430 /nfs/dbraw/zinc/12/64/30/1136126430.db2.gz PEUDBWMDOMLULX-ROUUACIJSA-N 1 0 332.375 3.754 20 5 EHBDRO C[C@H](c1cccc(Cl)c1)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776274959 1136128909 /nfs/dbraw/zinc/12/89/09/1136128909.db2.gz DYSRNZCYUMMEPZ-SJKOYZFVSA-N 1 0 334.803 3.975 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]CCc2csc3ccccc23)cc1 ZINC000776275749 1136129866 /nfs/dbraw/zinc/12/98/66/1136129866.db2.gz HOGBQYVEFWRMDD-KRWDZBQOSA-N 1 0 342.420 3.675 20 5 EHBDRO C[C@@H]1C[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)CC[C@@H]1c1ccccc1 ZINC000776278075 1136131208 /nfs/dbraw/zinc/13/12/08/1136131208.db2.gz RPDXKWXPEPXDDR-UIAACRFSSA-N 1 0 340.423 3.754 20 5 EHBDRO CC(C)c1ccc(C[NH2+][C@@H]2C[C@H](O)c3ccccc32)cc1[N+](=O)[O-] ZINC000850371581 1136244317 /nfs/dbraw/zinc/24/43/17/1136244317.db2.gz KWOOMYAXINGONG-MJGOQNOKSA-N 1 0 326.396 3.986 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH2+]CC3SCCS3)o2)c1 ZINC000850401476 1136249926 /nfs/dbraw/zinc/24/99/26/1136249926.db2.gz CZIGVZQTFPVNAL-UHFFFAOYSA-N 1 0 336.438 3.751 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1ccc2c(c1)CCCO2 ZINC000850431901 1136257796 /nfs/dbraw/zinc/25/77/96/1136257796.db2.gz MSEJNWIWDDCPLU-ZDUSSCGKSA-N 1 0 342.395 3.779 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@@]1(C)C[C@]1(F)Cl ZINC000850476937 1136267163 /nfs/dbraw/zinc/26/71/63/1136267163.db2.gz OZFINOVOVYHIGZ-NZVBXONLSA-N 1 0 330.787 3.959 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC2SCCS2)cc1[N+](=O)[O-] ZINC000850570845 1136289177 /nfs/dbraw/zinc/28/91/77/1136289177.db2.gz MWIDDWOAEVMYKN-LLVKDONJSA-N 1 0 342.486 3.840 20 5 EHBDRO C[C@@H]([C@H](OC(=O)CCC(C)(C)[N+](=O)[O-])c1ccccc1)[NH+]1CCCC1 ZINC000851134512 1136341481 /nfs/dbraw/zinc/34/14/81/1136341481.db2.gz SXXBXALCLZCCHN-YJBOKZPZSA-N 1 0 348.443 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCCCC[C@H]2c2ccco2)cc1 ZINC000776583345 1136441982 /nfs/dbraw/zinc/44/19/82/1136441982.db2.gz DNXJTSNBXZBCOU-IRXDYDNUSA-N 1 0 330.384 3.839 20 5 EHBDRO C[C@@]1(c2ccccc2)CCC[N@H+](C[C@@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776584568 1136442577 /nfs/dbraw/zinc/44/25/77/1136442577.db2.gz MYFGNYYSFWLFEQ-WOJBJXKFSA-N 1 0 340.423 3.682 20 5 EHBDRO CC(C)C[N@H+](CCc1ccccc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579924 1136444648 /nfs/dbraw/zinc/44/46/48/1136444648.db2.gz PQVCIFLWYALVNW-FQEVSTJZSA-N 1 0 342.439 3.829 20 5 EHBDRO C[C@@H]1C[C@H](c2cccc(F)c2)[N@H+](C[C@H](O)c2ccc([N+](=O)[O-])cc2)C1 ZINC000776588190 1136446008 /nfs/dbraw/zinc/44/60/08/1136446008.db2.gz MDZFVILGWLIJNP-ZNOIYHFQSA-N 1 0 344.386 3.850 20 5 EHBDRO CC(C)([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(Cl)cc1 ZINC000776593167 1136453751 /nfs/dbraw/zinc/45/37/51/1136453751.db2.gz QRONPKSJJUZCDL-INIZCTEOSA-N 1 0 334.803 3.807 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)F)ccc1N1CCC(C[NH+]2CCCC2)CC1 ZINC000853177413 1136514814 /nfs/dbraw/zinc/51/48/14/1136514814.db2.gz PFFDBSBKHBMTGO-UHFFFAOYSA-N 1 0 339.386 3.845 20 5 EHBDRO Cn1ncc2c1CC(C)(C)CN(Cc1ccc(Cl)c([N+](=O)[O-])c1)C2 ZINC000854057799 1136584389 /nfs/dbraw/zinc/58/43/89/1136584389.db2.gz BQJONLOVUFLBAH-UHFFFAOYSA-N 1 0 348.834 3.566 20 5 EHBDRO C[C@@H]([NH2+]CCc1cccc2cccnc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815556817 1136610139 /nfs/dbraw/zinc/61/01/39/1136610139.db2.gz FXEJDJQJGAPEFG-CYBMUJFWSA-N 1 0 336.395 3.619 20 5 EHBDRO C[C@H]([NH2+][C@@H](c1ccccc1)[C@@H]1CCOC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815589947 1136616014 /nfs/dbraw/zinc/61/60/14/1136616014.db2.gz HXLYDEHLGDMNFE-CRFBAAHOSA-N 1 0 341.411 3.605 20 5 EHBDRO C[C@H]([NH2+]CCOCc1ccc(Cl)cc1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815597990 1136617055 /nfs/dbraw/zinc/61/70/55/1136617055.db2.gz KJTAIEHBGZTFEY-LBPRGKRZSA-N 1 0 349.818 3.698 20 5 EHBDRO CCCNC(=O)c1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173327599 1136762740 /nfs/dbraw/zinc/76/27/40/1136762740.db2.gz ZANMZWBSWCKNBT-AWEZNQCLSA-N 1 0 341.411 3.585 20 5 EHBDRO CCCCOc1cccc(C[NH2+]C[C@H](O)c2cccc([N+](=O)[O-])c2)c1 ZINC000818961011 1136892020 /nfs/dbraw/zinc/89/20/20/1136892020.db2.gz KOEUKAGFMOZBIY-IBGZPJMESA-N 1 0 344.411 3.597 20 5 EHBDRO Cc1ccccc1C(C)(C)C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000818995387 1136898255 /nfs/dbraw/zinc/89/82/55/1136898255.db2.gz RTLVWGOFJPSNCO-SFHVURJKSA-N 1 0 328.412 3.504 20 5 EHBDRO Cc1cc(F)ccc1[C@H](O)C[NH2+]Cc1cc([N+](=O)[O-])ccc1Cl ZINC000819149702 1136914084 /nfs/dbraw/zinc/91/40/84/1136914084.db2.gz LASAEICWEWLGCA-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+]Cc2ccc(C3CCC3)cc2)c1 ZINC000819262747 1136929956 /nfs/dbraw/zinc/92/99/56/1136929956.db2.gz OGVPXRULCKVALA-IBGZPJMESA-N 1 0 326.396 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[N@@H+]2CCC[C@H]3COCC[C@H]32)c1 ZINC000339015684 1136995399 /nfs/dbraw/zinc/99/53/99/1136995399.db2.gz WPCFZVODFYIFHG-XHDPSFHLSA-N 1 0 344.333 3.615 20 5 EHBDRO O=C(O[C@H]1CC[N@@H+]2CCC[C@@H]2C1)c1cc([N+](=O)[O-])cc2ccccc21 ZINC000860738644 1137075890 /nfs/dbraw/zinc/07/58/90/1137075890.db2.gz CGGKGMVJLWTJDV-ZBFHGGJFSA-N 1 0 340.379 3.532 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823606945 1137106580 /nfs/dbraw/zinc/10/65/80/1137106580.db2.gz XTVZZIRTUBBQCD-DNVCBOLYSA-N 1 0 328.412 3.804 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC[C@@H](c1ccco1)[NH+]1CCCC1 ZINC000266029645 1137111768 /nfs/dbraw/zinc/11/17/68/1137111768.db2.gz RRGOJWLVGDKFQO-KRWDZBQOSA-N 1 0 345.399 3.583 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCC[C@@]3(CCSC3)C2)ccc1Cl ZINC000825215643 1137169038 /nfs/dbraw/zinc/16/90/38/1137169038.db2.gz UQRYHWTVAUTRPE-OAHLLOKOSA-N 1 0 326.849 3.967 20 5 EHBDRO CC[C@@H](CCc1ccccc1)[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000863572004 1137192218 /nfs/dbraw/zinc/19/22/18/1137192218.db2.gz IIYLIVJEZJGWJE-PKOBYXMFSA-N 1 0 328.412 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@H]2CCCc3ccc(Cl)cc32)cc1 ZINC000863583536 1137192644 /nfs/dbraw/zinc/19/26/44/1137192644.db2.gz ZBWHYIORTOGUJC-ZWKOTPCHSA-N 1 0 346.814 3.949 20 5 EHBDRO CC(C)(C)[C@H]1CCC[N@H+](Cn2cnc(-c3ccc([N+](=O)[O-])cc3)n2)C1 ZINC000794706720 1137239703 /nfs/dbraw/zinc/23/97/03/1137239703.db2.gz WABVWJFZHJLYHW-HNNXBMFYSA-N 1 0 343.431 3.569 20 5 EHBDRO Cc1ccc2c(C[C@H](C)[NH3+])cn(-c3ncc(F)c(C)c3[N+](=O)[O-])c2c1 ZINC001171164145 1137276167 /nfs/dbraw/zinc/27/61/67/1137276167.db2.gz HEJBCKCJSOHJPC-NSHDSACASA-N 1 0 342.374 3.579 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[NH2+][C@@H](C)[C@@H]1CCC[C@@H](C)C1 ZINC001171188384 1137297515 /nfs/dbraw/zinc/29/75/15/1137297515.db2.gz BKHCZRLCYNWANS-VHDGCEQUSA-N 1 0 333.432 3.646 20 5 EHBDRO COCc1ccccc1C[NH2+][C@H](C)Cc1ccc(F)cc1[N+](=O)[O-] ZINC000866221344 1137336090 /nfs/dbraw/zinc/33/60/90/1137336090.db2.gz PEWIJHJMPSNPQC-CYBMUJFWSA-N 1 0 332.375 3.601 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@H]1CCO[C@@H](C(C)(C)C)C1 ZINC000866310498 1137344546 /nfs/dbraw/zinc/34/45/46/1137344546.db2.gz FAMKZKDPBLVWFO-ISTRZQFTSA-N 1 0 338.423 3.848 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](C2CCC2)[C@H]2CCOC2)cc1[N+](=O)[O-] ZINC000866510049 1137359895 /nfs/dbraw/zinc/35/98/95/1137359895.db2.gz IQYOFOHDUPQQBX-IYJAJMOOSA-N 1 0 348.443 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](C1CCC1)[C@@H]1CCOC1)CCC2 ZINC000866512006 1137360178 /nfs/dbraw/zinc/36/01/78/1137360178.db2.gz HFXUWMFOYRFYLJ-LZQZEXGQSA-N 1 0 330.428 3.767 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cc3c([nH]c2=O)CCCC3)cccc1[N+](=O)[O-] ZINC000866640701 1137372010 /nfs/dbraw/zinc/37/20/10/1137372010.db2.gz KPSIXBDOZVUUKK-CYBMUJFWSA-N 1 0 341.411 3.733 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@@H]1COc2cccc(OC)c2C1 ZINC001171312723 1137410982 /nfs/dbraw/zinc/41/09/82/1137410982.db2.gz IIBCVGFDQLPODD-KRWDZBQOSA-N 1 0 341.475 3.707 20 5 EHBDRO CC(=O)Oc1ccc(C[N@H+](Cc2ccc([N+](=O)[O-])cc2)C(C)C)cc1 ZINC000122902062 1137475636 /nfs/dbraw/zinc/47/56/36/1137475636.db2.gz OLGSEVATIVLFCI-UHFFFAOYSA-N 1 0 342.395 3.931 20 5 EHBDRO CCC(=O)c1ccc(N2CCC[C@@H]2C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000795141459 1137507111 /nfs/dbraw/zinc/50/71/11/1137507111.db2.gz WQBREVWGYOURNY-MRXNPFEDSA-N 1 0 345.443 3.642 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccc2c(c1)OCO2 ZINC000872016205 1137564594 /nfs/dbraw/zinc/56/45/94/1137564594.db2.gz GZDDYXZAONUHFJ-NSHDSACASA-N 1 0 346.408 3.896 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](c1cccs1)N(C)C)c1c(F)cccc1[N+](=O)[O-] ZINC000872017573 1137564704 /nfs/dbraw/zinc/56/47/04/1137564704.db2.gz CJEZCOYSCCEICF-RISCZKNCSA-N 1 0 337.420 3.749 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]Cc1ccccc1CO ZINC000872028701 1137566226 /nfs/dbraw/zinc/56/62/26/1137566226.db2.gz SCCROUDPHRFGLE-LBPRGKRZSA-N 1 0 332.425 3.660 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](CO)c1ccccc1 ZINC000872038942 1137566879 /nfs/dbraw/zinc/56/68/79/1137566879.db2.gz BTZXDCLDAVEOMN-DZGCQCFKSA-N 1 0 346.452 3.743 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1CCC[C@H]2OCC[C@H]21 ZINC000872044045 1137567332 /nfs/dbraw/zinc/56/73/32/1137567332.db2.gz PUECNKNZWYUBFG-DDUYRFODSA-N 1 0 336.457 3.925 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000872061540 1137568814 /nfs/dbraw/zinc/56/88/14/1137568814.db2.gz YUEWGYNYYAYFRN-ZFWWWQNUSA-N 1 0 326.824 3.586 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCc1scnc1C ZINC000872074808 1137569931 /nfs/dbraw/zinc/56/99/31/1137569931.db2.gz HYPLLRRUAUYWEV-JTQLQIEISA-N 1 0 337.470 3.975 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@@H]1Cc1cnn(C)c1)c1c(F)cccc1[N+](=O)[O-] ZINC000872086094 1137570489 /nfs/dbraw/zinc/57/04/89/1137570489.db2.gz ROGMRUUJTJJONV-JGGQBBKZSA-N 1 0 346.406 3.529 20 5 EHBDRO COc1nc(C)cc(C)c1C[NH2+]Cc1c(C)ccc([N+](=O)[O-])c1C ZINC000873038997 1137588591 /nfs/dbraw/zinc/58/85/91/1137588591.db2.gz YSJFOMSHKIZPDD-UHFFFAOYSA-N 1 0 329.400 3.522 20 5 EHBDRO Cc1c(C[NH2+]C[C@H](c2ccccc2)C(C)(C)CO)cccc1[N+](=O)[O-] ZINC000873093955 1137590078 /nfs/dbraw/zinc/59/00/78/1137590078.db2.gz YAYQSCXNCZCEEG-GOSISDBHSA-N 1 0 342.439 3.795 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)C[C@H](O)c1cccs1 ZINC000873097864 1137590201 /nfs/dbraw/zinc/59/02/01/1137590201.db2.gz XLCCLHSIMPFHOF-WBMJQRKESA-N 1 0 334.441 3.875 20 5 EHBDRO Cc1c(C[NH2+]C[C@@]2(C)OCCc3sccc32)cccc1[N+](=O)[O-] ZINC000873127706 1137590765 /nfs/dbraw/zinc/59/07/65/1137590765.db2.gz UEPPWOZSQWROOU-QGZVFWFLSA-N 1 0 332.425 3.542 20 5 EHBDRO CCOc1ccc(C[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])cc1OC ZINC000873184175 1137593171 /nfs/dbraw/zinc/59/31/71/1137593171.db2.gz DYTZYWKUFLBWMQ-CYBMUJFWSA-N 1 0 330.384 3.853 20 5 EHBDRO Cc1ccc([C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C2CC2)cc1 ZINC000876921170 1137665315 /nfs/dbraw/zinc/66/53/15/1137665315.db2.gz LUSBKJXOBKENSZ-HTWSVDAQSA-N 1 0 326.400 3.544 20 5 EHBDRO Cc1cc([C@H]([NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)C2CC2)ccc1F ZINC000877119093 1137670722 /nfs/dbraw/zinc/67/07/22/1137670722.db2.gz ACSINBDEEQRDHF-JTTJXQCZSA-N 1 0 344.390 3.683 20 5 EHBDRO CSc1ccc([C@@H](C)[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)cc1 ZINC000877500743 1137678676 /nfs/dbraw/zinc/67/86/76/1137678676.db2.gz INQSHMVSGATRII-LMWSTFAQSA-N 1 0 332.429 3.568 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+]C2CC(n3cc([N+](=O)[O-])cn3)C2)c(C)c1 ZINC000877545898 1137680749 /nfs/dbraw/zinc/68/07/49/1137680749.db2.gz FIUUGCUQUDCITD-UHFFFAOYSA-N 1 0 342.443 3.679 20 5 EHBDRO CCn1nc(C)c(CN(C)Cc2ccc([N+](=O)[O-])c(Cl)c2)c1C ZINC000877664641 1137684817 /nfs/dbraw/zinc/68/48/17/1137684817.db2.gz VGHMHDLKHKADOQ-UHFFFAOYSA-N 1 0 336.823 3.713 20 5 EHBDRO Cc1c(C[N@@H+]2CC[C@H](O)C[C@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000877674374 1137685458 /nfs/dbraw/zinc/68/54/58/1137685458.db2.gz UZEFZZFBFXQWCS-HKUYNNGSSA-N 1 0 326.396 3.601 20 5 EHBDRO CC(C)(O)[C@H]1CC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000877835866 1137692879 /nfs/dbraw/zinc/69/28/79/1137692879.db2.gz YLCJAFORLBXBSI-ZDUSSCGKSA-N 1 0 346.452 3.916 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CC=CC[C@H]1C(F)(F)F ZINC000879666982 1137754409 /nfs/dbraw/zinc/75/44/09/1137754409.db2.gz MHEVAMNFZDJQAE-CHWSQXEVSA-N 1 0 330.306 3.590 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@H]([NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC000881822057 1137816072 /nfs/dbraw/zinc/81/60/72/1137816072.db2.gz XFOJMSOFLSASFF-DZKIICNBSA-N 1 0 345.443 3.639 20 5 EHBDRO Cc1cc(N2CC[C@H](c3nccs3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000882858326 1137835946 /nfs/dbraw/zinc/83/59/46/1137835946.db2.gz FCFSLQOQJBIFQB-LBPRGKRZSA-N 1 0 340.408 3.902 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)CC(F)F ZINC000883259588 1137851082 /nfs/dbraw/zinc/85/10/82/1137851082.db2.gz RHDHQCBQOPYYMK-RYUDHWBXSA-N 1 0 330.379 3.546 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+][C@H](Cn1ccnc1)c1ccccc1 ZINC000883387724 1137859018 /nfs/dbraw/zinc/85/90/18/1137859018.db2.gz CUTYDKJKPWUWIJ-RTBURBONSA-N 1 0 348.406 3.810 20 5 EHBDRO COC[C@H]1CCC[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)C1 ZINC000112990616 1137911194 /nfs/dbraw/zinc/91/11/94/1137911194.db2.gz IHTYXISFERVODF-HNNXBMFYSA-N 1 0 337.419 3.805 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccc([N+](=O)[O-])cc2F)CC1 ZINC000119263880 1137939694 /nfs/dbraw/zinc/93/96/94/1137939694.db2.gz TXQCNFDPAYHBMP-CYBMUJFWSA-N 1 0 344.390 3.766 20 5 EHBDRO C[C@H](c1ccncc1)[NH+]1CCC(Nc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000119294151 1137940238 /nfs/dbraw/zinc/94/02/38/1137940238.db2.gz BGBCEWOBSFEVDY-CYBMUJFWSA-N 1 0 344.390 3.766 20 5 EHBDRO Cc1[nH]c(C2CCN(c3cc(C)c([N+](=O)[O-])cc3F)CC2)[nH+]c1C ZINC000884706691 1137969734 /nfs/dbraw/zinc/96/97/34/1137969734.db2.gz LEMJNOGCIUSPRG-UHFFFAOYSA-N 1 0 332.379 3.766 20 5 EHBDRO C[C@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644282 1138239183 /nfs/dbraw/zinc/23/91/83/1138239183.db2.gz QVJALBYKUFALHM-GJZGRUSLSA-N 1 0 343.427 3.769 20 5 EHBDRO C[C@H]1C[C@@H](N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC[N@@H+]1C ZINC000130656387 1138467344 /nfs/dbraw/zinc/46/73/44/1138467344.db2.gz LBYVWKSJWUEBNM-HOCLYGCPSA-N 1 0 343.427 3.769 20 5 EHBDRO Cc1ccc(C[NH+](C)C)cc1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000177307472 1139612322 /nfs/dbraw/zinc/61/23/22/1139612322.db2.gz CUUIFMKIRTYPLT-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO COC(=O)CC[C@@H]([NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000180674130 1139855668 /nfs/dbraw/zinc/85/56/68/1139855668.db2.gz VNTNPQGYUWNCSN-RDTXWAMCSA-N 1 0 342.395 3.940 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@@H]3CCCCO3)cs2)c1 ZINC000181252312 1139896259 /nfs/dbraw/zinc/89/62/59/1139896259.db2.gz DGHLKXWIIJIZHT-INIZCTEOSA-N 1 0 347.440 3.767 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181551156 1139914961 /nfs/dbraw/zinc/91/49/61/1139914961.db2.gz NHDBNDFEALAWAJ-KSSFIOAISA-N 1 0 341.411 3.513 20 5 EHBDRO C[C@H]([NH2+]CC1CCN(CC(F)(F)F)CC1)c1ccc([N+](=O)[O-])cc1 ZINC000187716993 1140268680 /nfs/dbraw/zinc/26/86/80/1140268680.db2.gz OEUQIXTYRCODQO-LBPRGKRZSA-N 1 0 345.365 3.520 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCC2CC(OCC)C2)cc1[N+](=O)[O-] ZINC000189257211 1140330905 /nfs/dbraw/zinc/33/09/05/1140330905.db2.gz RZPADQRVMXRSOU-VQCLRJIVSA-N 1 0 336.432 3.849 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H]1CCO[C@H]1c1ccc(Cl)cc1 ZINC000192024849 1140497520 /nfs/dbraw/zinc/49/75/20/1140497520.db2.gz JPDQFSMCKZKDQM-RDJZCZTQSA-N 1 0 332.787 3.868 20 5 EHBDRO O=[N+]([O-])c1cnc(NCc2ccc(C[NH+]3CCCCC3)cc2)s1 ZINC000195506648 1140640257 /nfs/dbraw/zinc/64/02/57/1140640257.db2.gz DDDNTGYUHJYLCZ-UHFFFAOYSA-N 1 0 332.429 3.649 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@@H](O)c1cccc(F)c1 ZINC000267252571 1140772736 /nfs/dbraw/zinc/77/27/36/1140772736.db2.gz ZSSGJPFCSOWWBK-QLJPJBMISA-N 1 0 338.766 3.599 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CC(=O)N2C ZINC000267460863 1140794129 /nfs/dbraw/zinc/79/41/29/1140794129.db2.gz VBFIZNNVCDHYPJ-QWHCGFSZSA-N 1 0 339.395 3.526 20 5 EHBDRO CCc1nc2c(s1)[C@@H]([NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1)CCC2 ZINC000268856415 1141009126 /nfs/dbraw/zinc/00/91/26/1141009126.db2.gz URUGIYVVPVTZDV-LBPRGKRZSA-N 1 0 347.440 3.790 20 5 EHBDRO COCCOc1ccc([C@@H](C)[NH2+]CCc2ccccc2[N+](=O)[O-])cc1 ZINC000268898145 1141020268 /nfs/dbraw/zinc/02/02/68/1141020268.db2.gz BYFMQHZBPDVZJC-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO CCC[C@H]([NH2+][C@H]1c2ccccc2C[C@H]1O)c1cccc([N+](=O)[O-])c1 ZINC000269126631 1141069303 /nfs/dbraw/zinc/06/93/03/1141069303.db2.gz YSQKEXXWYNHPGQ-OTWHNJEPSA-N 1 0 326.396 3.684 20 5 EHBDRO CC(C)[N@H+](Cc1cnc(N(C)C)s1)Cc1ccc([N+](=O)[O-])cc1 ZINC000271077720 1141305776 /nfs/dbraw/zinc/30/57/76/1141305776.db2.gz PJGOCBNGTDAWOC-UHFFFAOYSA-N 1 0 334.445 3.528 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1cnn(C)c1C ZINC000271142848 1141312970 /nfs/dbraw/zinc/31/29/70/1141312970.db2.gz OTXOZOPXXPHJPB-GXTWGEPZSA-N 1 0 348.472 3.858 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)c1cnn(C)c1 ZINC000271185884 1141320757 /nfs/dbraw/zinc/32/07/57/1141320757.db2.gz WPHJDEPBYPZAKI-TZMCWYRMSA-N 1 0 334.445 3.550 20 5 EHBDRO Cc1ccc(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)cc1[N+](=O)[O-] ZINC000271225743 1141328674 /nfs/dbraw/zinc/32/86/74/1141328674.db2.gz AMLZDCNJGAVITK-DOTOQJQBSA-N 1 0 330.384 3.584 20 5 EHBDRO C[C@H]1C[C@@H](C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCO1 ZINC000271261860 1141335081 /nfs/dbraw/zinc/33/50/81/1141335081.db2.gz AVOJDITZKHEIDE-KBPBESRZSA-N 1 0 330.384 3.760 20 5 EHBDRO CCOCCC1(C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC000271529128 1141389188 /nfs/dbraw/zinc/38/91/88/1141389188.db2.gz QSDOVGUKFSSYQN-KRWDZBQOSA-N 1 0 332.444 3.712 20 5 EHBDRO CC(C)OC(=O)C[C@@H]1CCC[N@@H+]([C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000274275497 1141492137 /nfs/dbraw/zinc/49/21/37/1141492137.db2.gz BYVYDFNBGKKQDA-CABCVRRESA-N 1 0 334.416 3.710 20 5 EHBDRO C[N@H+](CC[C@H]1CCCO1)Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000339116650 1141501433 /nfs/dbraw/zinc/50/14/33/1141501433.db2.gz UZYHIOCVNHUJJL-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@@H]1CC[C@H]([N@H+](CCO)Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1 ZINC000339123760 1141503089 /nfs/dbraw/zinc/50/30/89/1141503089.db2.gz JOZUNRCOLRYLMO-YPMHNXCESA-N 1 0 346.349 3.597 20 5 EHBDRO O=[N+]([O-])c1ccc(CCN2CCC[C@@H](C[NH+]3CCCCCC3)C2)cc1 ZINC000078726435 217108836 /nfs/dbraw/zinc/10/88/36/217108836.db2.gz BXRSZSNPJVLACZ-IBGZPJMESA-N 1 0 345.487 3.725 20 5 EHBDRO C[C@@]1([NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3Cl)o2)CCOC1 ZINC000120181387 1014570703 /nfs/dbraw/zinc/57/07/03/1014570703.db2.gz NHMDCPGZCXHYKK-MRXNPFEDSA-N 1 0 336.775 3.777 20 5 EHBDRO C[C@H]([NH2+]C/C=C/c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000339503484 1014601504 /nfs/dbraw/zinc/60/15/04/1014601504.db2.gz BRMDSBXTLIXBTL-VTWSYHNCSA-N 1 0 344.436 3.696 20 5 EHBDRO O=C(CC[N@@H+]1CCC2(C1)CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000610216210 1015031962 /nfs/dbraw/zinc/03/19/62/1015031962.db2.gz ABQZTJIBUONKMD-UHFFFAOYSA-N 1 0 331.416 3.580 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc([N+](=O)[O-])cc3OC)C2)cc1 ZINC000430228995 1015128207 /nfs/dbraw/zinc/12/82/07/1015128207.db2.gz SOCLOLZJZBCBLB-HNNXBMFYSA-N 1 0 342.395 3.602 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccc(OC(F)F)cc1 ZINC000449057030 1032136015 /nfs/dbraw/zinc/13/60/15/1032136015.db2.gz AIRJTPNJAAEKDO-GFCCVEGCSA-N 1 0 336.338 3.917 20 5 EHBDRO Cc1c([C@H](C)N[C@H](C[NH+](C)C)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000584368977 1032251835 /nfs/dbraw/zinc/25/18/35/1032251835.db2.gz PVQVZKDNOAOGGV-KBXCAEBGSA-N 1 0 345.418 3.996 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449168833 1032262132 /nfs/dbraw/zinc/26/21/32/1032262132.db2.gz BQQHQBULUFVTJH-SUMWQHHRSA-N 1 0 332.375 3.642 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000449191546 1032285837 /nfs/dbraw/zinc/28/58/37/1032285837.db2.gz PHYZCUYVESSIGM-DOTOQJQBSA-N 1 0 332.444 3.997 20 5 EHBDRO CCCCn1cc(C[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])c(C)n1 ZINC000449204198 1032305731 /nfs/dbraw/zinc/30/57/31/1032305731.db2.gz LPRLAUAWRZTNNE-CQSZACIVSA-N 1 0 330.432 3.621 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OCCCCO2)c1ccccc1[N+](=O)[O-] ZINC000449201935 1032326830 /nfs/dbraw/zinc/32/68/30/1032326830.db2.gz HVBBDSPDIGMNRY-CQSZACIVSA-N 1 0 342.395 3.997 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H](CO)CC(C)(C)C ZINC000536835353 1032331256 /nfs/dbraw/zinc/33/12/56/1032331256.db2.gz YBBHYYTTZGQAOP-KBPBESRZSA-N 1 0 340.489 3.852 20 5 EHBDRO CC(C)[C@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000449223162 1032340796 /nfs/dbraw/zinc/34/07/96/1032340796.db2.gz JJFCNZVLJXUWHV-WBMJQRKESA-N 1 0 344.415 3.773 20 5 EHBDRO C[C@@H]([NH2+]CCCCc1ccc([N+](=O)[O-])cc1)c1cccc(CO)c1 ZINC000538457724 1032384571 /nfs/dbraw/zinc/38/45/71/1032384571.db2.gz DIWJSPUPRUHBMB-OAHLLOKOSA-N 1 0 328.412 3.761 20 5 EHBDRO COc1ccc([C@@H](C)[C@@H](C)[NH2+]Cc2ccc(OC)c([N+](=O)[O-])c2)cc1 ZINC000536883246 1032389286 /nfs/dbraw/zinc/38/92/86/1032389286.db2.gz UTFFSYDUVNCISI-UONOGXRCSA-N 1 0 344.411 3.894 20 5 EHBDRO CC[C@H](C)c1nnc([C@@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])[nH]1 ZINC000449288416 1032406185 /nfs/dbraw/zinc/40/61/85/1032406185.db2.gz ZUHNWHBRFYTESK-RWMBFGLXSA-N 1 0 331.420 3.508 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccc(Cl)cc1 ZINC000449330403 1032441949 /nfs/dbraw/zinc/44/19/49/1032441949.db2.gz KZZMKAXMGAUWBV-SUMWQHHRSA-N 1 0 348.830 3.893 20 5 EHBDRO O=[N+]([O-])c1ccc(CCCC[NH2+][C@@H]2[C@@H]3CCO[C@H]3C23CCCC3)cc1 ZINC000537307743 1032613424 /nfs/dbraw/zinc/61/34/24/1032613424.db2.gz QTDCFDCAGRSBST-IPMKNSEASA-N 1 0 344.455 3.855 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](CCc2noc3ccccc32)C2CC2)cc1 ZINC000593968926 1032662696 /nfs/dbraw/zinc/66/26/96/1032662696.db2.gz ODODDGOHTAYHCE-UHFFFAOYSA-N 1 0 337.379 3.943 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]CC[C@H]2CSc3ccccc3O2)c1 ZINC000592372585 1032673795 /nfs/dbraw/zinc/67/37/95/1032673795.db2.gz AEYFUDSNZLSMHQ-HNNXBMFYSA-N 1 0 330.409 3.628 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccs1 ZINC000289925290 1032675265 /nfs/dbraw/zinc/67/52/65/1032675265.db2.gz UWVCTJKUORPIMC-HNNXBMFYSA-N 1 0 338.404 3.645 20 5 EHBDRO Cc1ccc(C[NH2+][C@@H]2CC(C)(C)Oc3ccc(N)cc32)cc1[N+](=O)[O-] ZINC000415020558 1017408594 /nfs/dbraw/zinc/40/85/94/1017408594.db2.gz GUJQENOLOLEFQH-MRXNPFEDSA-N 1 0 341.411 3.877 20 5 EHBDRO CC(C)c1ccc(CN2CCCC[C@H]2[C@@H]2CC[NH2+]C2)cc1[N+](=O)[O-] ZINC000415057904 1017468555 /nfs/dbraw/zinc/46/85/55/1017468555.db2.gz VFAHMMGSIDBCSU-AEFFLSMTSA-N 1 0 331.460 3.682 20 5 EHBDRO CC(C)N(C)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000236652518 1017525474 /nfs/dbraw/zinc/52/54/74/1017525474.db2.gz XRIZUKAUXZXHHC-UHFFFAOYSA-N 1 0 333.457 3.753 20 5 EHBDRO CCOC(=O)C1CCC([N@H+](CC)Cc2cccc([N+](=O)[O-])c2)CC1 ZINC000549187613 1017558458 /nfs/dbraw/zinc/55/84/58/1017558458.db2.gz RGDGTXPTGWCJKJ-UHFFFAOYSA-N 1 0 334.416 3.539 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181552671 1017712252 /nfs/dbraw/zinc/71/22/52/1017712252.db2.gz PZJBGRIUOIVRTN-MDASCCDHSA-N 1 0 328.412 3.628 20 5 EHBDRO CC[N@H+](C)Cc1cccc(CNCc2ccc(Cl)cc2[N+](=O)[O-])c1 ZINC000892937987 1017795891 /nfs/dbraw/zinc/79/58/91/1017795891.db2.gz KLUBCIHGPFCXHH-UHFFFAOYSA-N 1 0 347.846 3.990 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@@H]2C[C@H]3OCCC[C@H]23)c2ccccc2)c1 ZINC000187302018 1017873564 /nfs/dbraw/zinc/87/35/64/1017873564.db2.gz AVFBLVKAOMQSFP-UAFMIMERSA-N 1 0 338.407 3.841 20 5 EHBDRO CC(C)(C)c1ccc(NC(=O)NCCC[C@@H]2CCC[NH2+]2)cc1[N+](=O)[O-] ZINC000415699550 1018408107 /nfs/dbraw/zinc/40/81/07/1018408107.db2.gz JJQIWSGICSZVHZ-ZDUSSCGKSA-N 1 0 348.447 3.546 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2cc([N+](=O)[O-])ccc2C)s1 ZINC000102774569 1018600629 /nfs/dbraw/zinc/60/06/29/1018600629.db2.gz YXFXYRITYDNKFC-UHFFFAOYSA-N 1 0 347.440 3.734 20 5 EHBDRO Cc1ccc([C@H](C)N[C@H](CCO)c2ccccc2F)cc1[N+](=O)[O-] ZINC000592404510 1032776378 /nfs/dbraw/zinc/77/63/78/1032776378.db2.gz ZARRCMMRNNKBKZ-SUMWQHHRSA-N 1 0 332.375 3.817 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCCc3ccc(F)cc32)c1[N+](=O)[O-] ZINC000894160335 1018757300 /nfs/dbraw/zinc/75/73/00/1018757300.db2.gz BMWPOCZSSOPVCZ-HNNXBMFYSA-N 1 0 346.358 3.615 20 5 EHBDRO C[C@H]([NH2+][C@H]1C[C@@H](C)N(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000397997941 1018935543 /nfs/dbraw/zinc/93/55/43/1018935543.db2.gz CRGBNLRVOJOOIM-GJYPPUQNSA-N 1 0 339.439 3.908 20 5 EHBDRO O=C(C[NH2+]Cc1c2ccccc2cc2ccccc21)NCC(F)(F)F ZINC000048745811 1019015350 /nfs/dbraw/zinc/01/53/50/1019015350.db2.gz YXZCRQVLQSHDCZ-UHFFFAOYSA-N 1 0 346.352 3.761 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000182324842 1019060328 /nfs/dbraw/zinc/06/03/28/1019060328.db2.gz RXRUZHJMABIVLN-CQSZACIVSA-N 1 0 327.384 3.583 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CC[C@@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433432 1019091450 /nfs/dbraw/zinc/09/14/50/1019091450.db2.gz JJJRSIYDRNRWIZ-SJLPKXTDSA-N 1 0 339.439 3.862 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C3(CO)CCCC3)s2)cc1 ZINC000083475429 1019196043 /nfs/dbraw/zinc/19/60/43/1019196043.db2.gz UHMSUDYJCDNVQP-UHFFFAOYSA-N 1 0 332.425 3.718 20 5 EHBDRO Cc1ccccc1C1CC[NH+](C[C@@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178861399 1019308046 /nfs/dbraw/zinc/30/80/46/1019308046.db2.gz VKFALJVRWIHKBN-HXUWFJFHSA-N 1 0 340.423 3.816 20 5 EHBDRO CCN(CC)[C@@H](C[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1)c1ccco1 ZINC000119109570 1019360404 /nfs/dbraw/zinc/36/04/04/1019360404.db2.gz BJBSHLLBVDYCGK-YOEHRIQHSA-N 1 0 331.416 3.922 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(CN[C@@H]3CC[NH2+]C34CCCC4)o2)c1 ZINC000592437319 1032842639 /nfs/dbraw/zinc/84/26/39/1032842639.db2.gz HDQZMWMPNRWERT-GOSISDBHSA-N 1 0 341.411 3.619 20 5 EHBDRO Cc1nc2cc(NC(=O)CSc3ccc([N+](=O)[O-])cc3)ccc2[nH]1 ZINC000054535923 1032843401 /nfs/dbraw/zinc/84/34/01/1032843401.db2.gz YGOLYKQCUWYSSU-UHFFFAOYSA-N 1 0 342.380 3.510 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@@H](C(C)C)CC1 ZINC001167425622 1019768355 /nfs/dbraw/zinc/76/83/55/1019768355.db2.gz RVBQUUDJKAERGT-OAHLLOKOSA-N 1 0 333.432 3.600 20 5 EHBDRO CCCN(CC[NH+]1CCCCCC1)C(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000580676277 1019836272 /nfs/dbraw/zinc/83/62/72/1019836272.db2.gz WMRQAGNUOVIQSW-UHFFFAOYSA-N 1 0 347.459 3.631 20 5 EHBDRO CC[C@@H]([NH2+]Cc1coc(-c2ccc([N+](=O)[O-])cc2)n1)[C@@H]1CCCCO1 ZINC000594040400 1032860690 /nfs/dbraw/zinc/86/06/90/1032860690.db2.gz FLAVSUSGIZRYLN-SJORKVTESA-N 1 0 345.399 3.687 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2c(F)cccc2[N+](=O)[O-])C1 ZINC000157798464 1032880702 /nfs/dbraw/zinc/88/07/02/1032880702.db2.gz MHAKRXHQRNFHDL-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO CC(C)[NH2+][C@@H]1CCCN(c2ccc([N+](=O)[O-])c(C(F)(F)F)c2)C1 ZINC000610468534 1020274566 /nfs/dbraw/zinc/27/45/66/1020274566.db2.gz OGNFNUOBXJEOJG-LLVKDONJSA-N 1 0 331.338 3.580 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCCO[C@@H](c3ccccc3)C2)c(F)c1 ZINC000610476528 1020421549 /nfs/dbraw/zinc/42/15/49/1020421549.db2.gz DEBQRVWYLIXFEB-GOSISDBHSA-N 1 0 330.359 3.698 20 5 EHBDRO CC(=O)c1cc(NC[C@@H](C2CCCCC2)[NH+](C)C)ccc1[N+](=O)[O-] ZINC000581149178 1020485415 /nfs/dbraw/zinc/48/54/15/1020485415.db2.gz ZXESAXRISGWLRT-SFHVURJKSA-N 1 0 333.432 3.720 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2nccc3ccc([N+](=O)[O-])cc32)CC1 ZINC000413066195 1020637205 /nfs/dbraw/zinc/63/72/05/1020637205.db2.gz HJJBENZIJBKUQQ-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO CC[NH+](CC)CCCCNc1ncc([N+](=O)[O-])cc1C(F)(F)F ZINC000413102071 1020700146 /nfs/dbraw/zinc/70/01/46/1020700146.db2.gz UYXMRBHGQIIHFC-UHFFFAOYSA-N 1 0 334.342 3.543 20 5 EHBDRO CC[C@@H](C)[C@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138305 1020727527 /nfs/dbraw/zinc/72/75/27/1020727527.db2.gz XTNUSENHHZKUON-KGLIPLIRSA-N 1 0 333.432 3.822 20 5 EHBDRO Cc1nn(C(C)(C)C)c(C)c1C[N@H+](C)CCc1ccccc1[N+](=O)[O-] ZINC000348676117 1021222965 /nfs/dbraw/zinc/22/29/65/1021222965.db2.gz ROLIVRXUSWOWPX-UHFFFAOYSA-N 1 0 344.459 3.838 20 5 EHBDRO CC(C)c1nnc(CC[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000426305420 1021226155 /nfs/dbraw/zinc/22/61/55/1021226155.db2.gz GWYQQOGGRYTSKO-HNNXBMFYSA-N 1 0 346.456 3.779 20 5 EHBDRO CCc1nc(C)c(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000426324782 1021264615 /nfs/dbraw/zinc/26/46/15/1021264615.db2.gz RWCNGGVEJVVKQH-GDBMZVCRSA-N 1 0 343.427 3.955 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[NH2+][C@H]3CCOC4(CCCCC4)C3)nc2c1 ZINC000602569538 1032977941 /nfs/dbraw/zinc/97/79/41/1032977941.db2.gz SXMFKDWCVWNYFS-ZDUSSCGKSA-N 1 0 345.399 3.708 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602568337 1032979159 /nfs/dbraw/zinc/97/91/59/1032979159.db2.gz JXSMLSXVAOWTEP-MRXNPFEDSA-N 1 0 332.448 3.517 20 5 EHBDRO C[C@]1(NCc2c(F)cc([N+](=O)[O-])cc2F)CCOc2ccccc21 ZINC000933371912 1021499042 /nfs/dbraw/zinc/49/90/42/1021499042.db2.gz STIZTBBSFFVXTR-KRWDZBQOSA-N 1 0 334.322 3.661 20 5 EHBDRO CC(C)[C@@H](CC(F)(F)F)[NH2+]Cc1cc([N+](=O)[O-])cc2c1OCOC2 ZINC000438481640 1021564111 /nfs/dbraw/zinc/56/41/11/1021564111.db2.gz YEGPUUPBQJKGLR-CYBMUJFWSA-N 1 0 348.321 3.528 20 5 EHBDRO C[NH+](C)C1(CN[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CCC1 ZINC000437113679 1021569258 /nfs/dbraw/zinc/56/92/58/1021569258.db2.gz KGOJNLPCTFNNBF-IBGZPJMESA-N 1 0 339.439 3.758 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]CCCc1nccs1 ZINC000602592371 1032991690 /nfs/dbraw/zinc/99/16/90/1032991690.db2.gz DJAVCLMTBPTEQF-UHFFFAOYSA-N 1 0 345.346 3.793 20 5 EHBDRO CCC(CC)C[N@H+](CC)Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000172895693 1033004458 /nfs/dbraw/zinc/00/44/58/1033004458.db2.gz ZARQDLAYEMHPCX-UHFFFAOYSA-N 1 0 331.420 3.569 20 5 EHBDRO C[C@H]1C[C@@H](CC[NH2+]Cc2ccc(C(F)(F)F)cc2[N+](=O)[O-])CCO1 ZINC000602607310 1033025050 /nfs/dbraw/zinc/02/50/50/1033025050.db2.gz HWYOLZIMPMJWMH-RYUDHWBXSA-N 1 0 346.349 3.908 20 5 EHBDRO CC(C)OC(=O)C[C@@H]1CCC[N@@H+]([C@@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000184454879 1022340715 /nfs/dbraw/zinc/34/07/15/1022340715.db2.gz JWGNADFEJGZPTM-GJZGRUSLSA-N 1 0 334.416 3.710 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)[C@@H]1C[C@H]1c1cccs1 ZINC000602636093 1033046704 /nfs/dbraw/zinc/04/67/04/1033046704.db2.gz FVWOQULEGVEKOZ-KGYLQXTDSA-N 1 0 342.424 3.814 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000517552663 1022438615 /nfs/dbraw/zinc/43/86/15/1022438615.db2.gz VRQJLKYNZCHZEI-INIZCTEOSA-N 1 0 333.476 3.928 20 5 EHBDRO C[NH+](C)C1CCC(N[C@H](c2ccc([N+](=O)[O-])cc2)C(F)(F)F)CC1 ZINC000581948253 1022512264 /nfs/dbraw/zinc/51/22/64/1022512264.db2.gz DJRYUHDMZXDRFI-SSDMNJCBSA-N 1 0 345.365 3.661 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)c1cccc([N+](=O)[O-])c1C ZINC000430821237 1022726021 /nfs/dbraw/zinc/72/60/21/1022726021.db2.gz HVVNMSOFCHQJPE-RDJZCZTQSA-N 1 0 347.459 3.534 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)c1ccc([N+](=O)[O-])cc1C ZINC000430821824 1022736969 /nfs/dbraw/zinc/73/69/69/1022736969.db2.gz OKJHNQTXJQWZGZ-QAPCUYQASA-N 1 0 347.459 3.534 20 5 EHBDRO CC[NH+](CC)C[C@H]1CCCC[C@@H]1NC(=O)c1cc(C)ccc1[N+](=O)[O-] ZINC000430828719 1022746731 /nfs/dbraw/zinc/74/67/31/1022746731.db2.gz CABBDKZTFJCNOH-WBVHZDCISA-N 1 0 347.459 3.534 20 5 EHBDRO C[C@]1(C[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)CCO[C@@H]1C1CC1 ZINC000519579684 1022945336 /nfs/dbraw/zinc/94/53/36/1022945336.db2.gz COQCWHJCHZFCTI-IPMKNSEASA-N 1 0 330.428 3.767 20 5 EHBDRO CC[NH+](CC)CC1CC[NH+](C/C=C\c2ccccc2[N+](=O)[O-])CC1 ZINC000506926733 1023012213 /nfs/dbraw/zinc/01/22/13/1023012213.db2.gz GMIIKFHVVTXVRZ-CLFYSBASSA-N 1 0 331.460 3.662 20 5 EHBDRO O=[N+]([O-])c1sc(C[NH2+]CC[C@H]2CC2(F)F)cc1Br ZINC000602714375 1033100024 /nfs/dbraw/zinc/10/00/24/1033100024.db2.gz HVIIPFDFIZDSAV-LURJTMIESA-N 1 0 341.177 3.554 20 5 EHBDRO C[C@H](CN(C)Cc1ccccc1)[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000310256558 1023173722 /nfs/dbraw/zinc/17/37/22/1023173722.db2.gz FOHWHCSUULQSFA-CVEARBPZSA-N 1 0 327.428 3.766 20 5 EHBDRO Cc1ccc(C[NH2+]CCCN(C)c2ccccc2F)cc1[N+](=O)[O-] ZINC000518267740 1023176435 /nfs/dbraw/zinc/17/64/35/1023176435.db2.gz SLZKIBVOUGIRCZ-UHFFFAOYSA-N 1 0 331.391 3.658 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)[C@H]2CCCC[C@@H]12 ZINC000248417903 1023260809 /nfs/dbraw/zinc/26/08/09/1023260809.db2.gz JXUAFBHIIUQWAD-KCXAZCMYSA-N 1 0 342.399 3.655 20 5 EHBDRO Cc1c(C[NH+]2CCC3(CC2)OCc2ccccc23)cccc1[N+](=O)[O-] ZINC000610738912 1023401536 /nfs/dbraw/zinc/40/15/36/1023401536.db2.gz ZPCFCYLPKZVIPG-UHFFFAOYSA-N 1 0 338.407 3.925 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CC3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000063282687 1033149216 /nfs/dbraw/zinc/14/92/16/1033149216.db2.gz CICYWJDBXFVNJK-UHFFFAOYSA-N 1 0 348.403 3.570 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H](C)c2ccc3[nH]c(=O)[nH]c3c2)cccc1[N+](=O)[O-] ZINC000610818770 1023782853 /nfs/dbraw/zinc/78/28/53/1023782853.db2.gz ANXJIQKRIDBXGR-NWDGAFQWSA-N 1 0 340.383 3.897 20 5 EHBDRO CC[C@H](c1ccccc1)[NH+]1CCN(c2cccc([N+](=O)[O-])c2)CC1 ZINC000060876850 1033164170 /nfs/dbraw/zinc/16/41/70/1033164170.db2.gz RHDBXTSNFPZBNI-LJQANCHMSA-N 1 0 325.412 3.868 20 5 EHBDRO CCO[C@@H]1CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000610930480 1023877703 /nfs/dbraw/zinc/87/77/03/1023877703.db2.gz ROADPMCUZVXJHZ-CQSZACIVSA-N 1 0 330.384 3.856 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[N@@H+]2CCC[C@H]2c2cccc3ccccc32)n1 ZINC000176217114 1023882722 /nfs/dbraw/zinc/88/27/22/1023882722.db2.gz XXRBMIMTBRMPFU-SFHVURJKSA-N 1 0 336.395 3.782 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1COc2c(C)cccc2C1 ZINC000574444248 1033170524 /nfs/dbraw/zinc/17/05/24/1033170524.db2.gz ZCVHFXRXRINQRB-GDBMZVCRSA-N 1 0 326.396 3.866 20 5 EHBDRO CCS[C@H]1CCCC[C@@H]1[NH2+]Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000469780079 1024007016 /nfs/dbraw/zinc/00/70/16/1024007016.db2.gz MMRFSTUITBHBJC-BBRMVZONSA-N 1 0 342.436 3.896 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(NC2CC[NH+](C3CC3)CC2)c(Cl)c1 ZINC000121102223 1024069929 /nfs/dbraw/zinc/06/99/29/1024069929.db2.gz WSNFFTVNHXJZMD-UHFFFAOYSA-N 1 0 330.215 3.940 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@@H](c2cccs2)C2(CO)CCC2)c1 ZINC000449770913 1033187331 /nfs/dbraw/zinc/18/73/31/1033187331.db2.gz XMZDIZWCNQVHCJ-INIZCTEOSA-N 1 0 332.425 3.650 20 5 EHBDRO Cc1cccc(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c1[N+](=O)[O-] ZINC000425239293 1024496762 /nfs/dbraw/zinc/49/67/62/1024496762.db2.gz NSCOVPKNPXUDKD-HNNXBMFYSA-N 1 0 340.427 3.936 20 5 EHBDRO C[C@H](c1ccccc1)[N@@H+]1CC[C@@H](Nc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000434957238 1024525280 /nfs/dbraw/zinc/52/52/80/1024525280.db2.gz ZMKBBUVSXQAOEL-IUODEOHRSA-N 1 0 346.818 3.891 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@@H]1CCC[C@H]1O ZINC000538812487 1024529055 /nfs/dbraw/zinc/52/90/55/1024529055.db2.gz RSVXKRXWDSVLFW-SUMWQHHRSA-N 1 0 346.452 3.916 20 5 EHBDRO CC(C)(O)[C@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000185218943 1024653007 /nfs/dbraw/zinc/65/30/07/1024653007.db2.gz PXTLHDISBLRQBS-QGZVFWFLSA-N 1 0 330.384 3.590 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[N@@H+]2CCC[C@@H]2c2ccc(F)cc2)cc1 ZINC000065532902 1024665080 /nfs/dbraw/zinc/66/50/80/1024665080.db2.gz BVPWMOUXGJTRJZ-GOSISDBHSA-N 1 0 330.359 3.950 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+]2CC[C@H](c3ccc4cccnc4n3)C2)c1 ZINC000602883984 1033233322 /nfs/dbraw/zinc/23/33/22/1033233322.db2.gz AFVYLFHFBCOFBK-INIZCTEOSA-N 1 0 334.379 3.528 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[N@@H+]1CCC[C@H]1Cc1cccc(F)c1 ZINC000520785197 1024793621 /nfs/dbraw/zinc/79/36/21/1024793621.db2.gz BJMXUPVBGVEIJB-KRWDZBQOSA-N 1 0 344.386 3.820 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@@H+]2C[C@@H]3[C@H](O)CC[C@@H]3C2)s1 ZINC000895785209 1024832209 /nfs/dbraw/zinc/83/22/09/1024832209.db2.gz RUCXBYBMDPXONR-ISTRZQFTSA-N 1 0 344.436 3.526 20 5 EHBDRO CSC1(C[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)CCCCC1 ZINC000895812362 1024866043 /nfs/dbraw/zinc/86/60/43/1024866043.db2.gz OIMAFKKLKVBNPZ-UHFFFAOYSA-N 1 0 335.429 3.892 20 5 EHBDRO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)c2ccccc21 ZINC000185386692 1024920122 /nfs/dbraw/zinc/92/01/22/1024920122.db2.gz HJCAWOAVLUTHCW-GFCCVEGCSA-N 1 0 344.802 3.949 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nc(C(C)(C)C)co1 ZINC000897944854 1033254159 /nfs/dbraw/zinc/25/41/59/1033254159.db2.gz UHJMLJOLNBTYQM-CYBMUJFWSA-N 1 0 331.416 3.991 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@H+](C)C[C@@H]1OCCc2ccccc21 ZINC000515333664 1025176663 /nfs/dbraw/zinc/17/66/63/1025176663.db2.gz ZSWZTAMRQRHYIU-IBGZPJMESA-N 1 0 326.396 3.649 20 5 EHBDRO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000515392846 1025203373 /nfs/dbraw/zinc/20/33/73/1025203373.db2.gz BOJFNZMLJZMNNF-GJZGRUSLSA-N 1 0 340.427 3.514 20 5 EHBDRO C[N@H+](CCCCc1ccccc1)CCOc1ccccc1[N+](=O)[O-] ZINC000521184434 1025259312 /nfs/dbraw/zinc/25/93/12/1025259312.db2.gz VXKNHYCNOCOBQR-UHFFFAOYSA-N 1 0 328.412 3.928 20 5 EHBDRO CCCN(Cc1ccc([N+](=O)[O-])cc1)[C@@H](C)C(=O)Nc1ccccc1 ZINC000072058781 1025283125 /nfs/dbraw/zinc/28/31/25/1025283125.db2.gz ZDRBPTVWHIVLRF-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+][C@@H]1CCC[C@@H]2C[C@@H]21 ZINC000425466113 1025382936 /nfs/dbraw/zinc/38/29/36/1025382936.db2.gz AUIRZAUHSKLWKL-JIMOISOXSA-N 1 0 325.206 3.636 20 5 EHBDRO C[C@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cncc(F)c1 ZINC000521674927 1025577910 /nfs/dbraw/zinc/57/79/10/1025577910.db2.gz UQSPHHCNXJXDSL-NSHDSACASA-N 1 0 328.347 3.504 20 5 EHBDRO CC(C)[N@@H+]1CCC[C@@H](CNc2cc(C(F)(F)F)ncc2[N+](=O)[O-])C1 ZINC000436319136 1025583061 /nfs/dbraw/zinc/58/30/61/1025583061.db2.gz QPWCQKGTEGIZRN-NSHDSACASA-N 1 0 346.353 3.541 20 5 EHBDRO C[C@@H](CCNc1cc(C(F)(F)F)ncc1[N+](=O)[O-])[NH+]1CCCCC1 ZINC000436349594 1025625870 /nfs/dbraw/zinc/62/58/70/1025625870.db2.gz QTHYOYPPGRFNLA-NSHDSACASA-N 1 0 346.353 3.685 20 5 EHBDRO C[C@H](c1nc(C(C)(C)C)no1)N(C)CCc1ccccc1[N+](=O)[O-] ZINC000511093110 1025648428 /nfs/dbraw/zinc/64/84/28/1025648428.db2.gz BYPJLWAMDDLWFS-GFCCVEGCSA-N 1 0 332.404 3.511 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000487423001 1025669522 /nfs/dbraw/zinc/66/95/22/1025669522.db2.gz VEJMGQQWTSVOJI-DLBZAZTESA-N 1 0 347.462 3.991 20 5 EHBDRO COc1ccc([C@@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)c(OC)c1 ZINC000129714367 1026042820 /nfs/dbraw/zinc/04/28/20/1026042820.db2.gz MMSPPFCQERBYBC-CYBMUJFWSA-N 1 0 330.384 3.505 20 5 EHBDRO CO[C@H](c1ccc(F)cc1)[C@H](C)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000478328261 1026066645 /nfs/dbraw/zinc/06/66/45/1026066645.db2.gz PCWOAYNCGHODCG-GTNSWQLSSA-N 1 0 336.338 3.739 20 5 EHBDRO COC(=O)c1oc([C@H](C)[N@H+](C)CCc2ccccc2[N+](=O)[O-])cc1C ZINC000511122016 1026219550 /nfs/dbraw/zinc/21/95/50/1026219550.db2.gz LZDOZCGDIGEFGQ-ZDUSSCGKSA-N 1 0 346.383 3.518 20 5 EHBDRO C[C@H](O)C[C@@H]1CCC[N@@H+]1Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000127718365 1026366184 /nfs/dbraw/zinc/36/61/84/1026366184.db2.gz PXQYOAHJBFLIAI-ZFWWWQNUSA-N 1 0 330.384 3.590 20 5 EHBDRO CC[N@@H+]1CC[C@@H](N(C)Cc2cc([N+](=O)[O-])ccc2OC(C)C)C[C@@H]1C ZINC000530901686 1026385991 /nfs/dbraw/zinc/38/59/91/1026385991.db2.gz QALZDDPMZPDKGL-DOTOQJQBSA-N 1 0 349.475 3.687 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000186319798 1026485221 /nfs/dbraw/zinc/48/52/21/1026485221.db2.gz AVCUQWUMTZAXCC-DOXZYTNZSA-N 1 0 327.428 3.937 20 5 EHBDRO COc1cccc(N2CCC[C@H](C[NH+]3CCC(C)CC3)C2)c1[N+](=O)[O-] ZINC000475351767 1026502520 /nfs/dbraw/zinc/50/25/20/1026502520.db2.gz MPHZCSYFJPFLSY-MRXNPFEDSA-N 1 0 347.459 3.552 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(N2CCC[C@@H](C[N@H+]3CCCC[C@@H]3C)C2)n1 ZINC000611616501 1026525245 /nfs/dbraw/zinc/52/52/45/1026525245.db2.gz ULTPPOBCNVRUNB-IRXDYDNUSA-N 1 0 346.475 3.697 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]C1CC(OCc2ccccc2)C1 ZINC000546657111 1026671152 /nfs/dbraw/zinc/67/11/52/1026671152.db2.gz HYZZOOOMXGUENG-UXBLZVDNSA-N 1 0 338.407 3.945 20 5 EHBDRO CO[C@@H]1C[C@@H]([NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)C1(C)C ZINC000531240425 1026716842 /nfs/dbraw/zinc/71/68/42/1026716842.db2.gz RIFZLHGNHHFWFW-HUUCEWRRSA-N 1 0 347.440 3.621 20 5 EHBDRO CC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000163223259 1026852937 /nfs/dbraw/zinc/85/29/37/1026852937.db2.gz YLHSAKVQJHLGOV-RISCZKNCSA-N 1 0 339.823 3.745 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1)CC1(O)CCCC1 ZINC000128072049 1026916307 /nfs/dbraw/zinc/91/63/07/1026916307.db2.gz VJCYMXHCUIKWQT-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO C[N@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)CC1(O)CCCC1 ZINC000128076023 1026932599 /nfs/dbraw/zinc/93/25/99/1026932599.db2.gz OLCPWSQFCCUGPM-UHFFFAOYSA-N 1 0 330.384 3.592 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@H](C)NC(=O)OC(C)(C)C)c1cccc([N+](=O)[O-])c1 ZINC000310435245 1027004714 /nfs/dbraw/zinc/00/47/14/1027004714.db2.gz OFOAGBQALWHMSP-AVGNSLFASA-N 1 0 337.420 3.547 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H](Nc1cnn(-c2cc[nH+]cc2)c1)C1CC1 ZINC000611480838 1027016954 /nfs/dbraw/zinc/01/69/54/1027016954.db2.gz GFLYEJPVZIWEHV-SFHVURJKSA-N 1 0 349.394 3.609 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[C@H]([NH+]3CCCC3)CC2)c2cccnc21 ZINC000413137591 1027104755 /nfs/dbraw/zinc/10/47/55/1027104755.db2.gz AYWVQKDLUCYGMW-HNNXBMFYSA-N 1 0 340.427 3.598 20 5 EHBDRO COc1ccc(CCC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1OC ZINC000178650880 1027327959 /nfs/dbraw/zinc/32/79/59/1027327959.db2.gz AFOVFYWXZDCGNI-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO C[C@@H]1CC[N@H+](CCC(=O)Nc2ccccc2[N+](=O)[O-])[C@@H]2CCCC[C@H]12 ZINC000548761144 1027408728 /nfs/dbraw/zinc/40/87/28/1027408728.db2.gz GJBLRZRYKSEPTP-BFYDXBDKSA-N 1 0 345.443 3.824 20 5 EHBDRO COc1ccc(C2([NH2+][C@@H](C)Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000453176018 1027455892 /nfs/dbraw/zinc/45/58/92/1027455892.db2.gz OBHYIKLALRMBBL-AWEZNQCLSA-N 1 0 326.396 3.813 20 5 EHBDRO COc1ccc(C2([NH2+][C@H](C)Cc3ccccc3[N+](=O)[O-])CC2)cc1 ZINC000453176019 1027455995 /nfs/dbraw/zinc/45/59/95/1027455995.db2.gz OBHYIKLALRMBBL-CQSZACIVSA-N 1 0 326.396 3.813 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Nc2ccccc2)C1 ZINC000237095854 1027524857 /nfs/dbraw/zinc/52/48/57/1027524857.db2.gz DOKIZWFZECSRKJ-KRWDZBQOSA-N 1 0 341.411 3.680 20 5 EHBDRO C[N@@H+]1CCC[C@H](CNc2ccc([N+](=O)[O-])cn2)[C@@H]1c1cccs1 ZINC000078338098 1027687622 /nfs/dbraw/zinc/68/76/22/1027687622.db2.gz PBMBNLHBQZRWOB-MLGOLLRUSA-N 1 0 332.429 3.546 20 5 EHBDRO CC[C@H]1CCC[N@@H+]([C@@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000533435389 1027875096 /nfs/dbraw/zinc/87/50/96/1027875096.db2.gz WJKGYXCQRINMJF-GJZGRUSLSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CC[N@@H+]([C@H]3CCCc4ccccc43)C2)nc1 ZINC000440486077 1028066260 /nfs/dbraw/zinc/06/62/60/1028066260.db2.gz JBFKATVZRJARLJ-YJBOKZPZSA-N 1 0 338.411 3.554 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](Cc4ccccc4)C3)nc2c1 ZINC000444653933 1028116561 /nfs/dbraw/zinc/11/65/61/1028116561.db2.gz VUAYNUXDIAOCQX-OAHLLOKOSA-N 1 0 336.395 3.536 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681886 1028151070 /nfs/dbraw/zinc/15/10/70/1028151070.db2.gz RULKDUNXTZRSIV-RHSMWYFYSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1C ZINC000444681888 1028151773 /nfs/dbraw/zinc/15/17/73/1028151773.db2.gz RULKDUNXTZRSIV-YOEHRIQHSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCN[C@@H](c2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000423144923 1028205779 /nfs/dbraw/zinc/20/57/79/1028205779.db2.gz IITODWJQSXXXPY-POZUXBRTSA-N 1 0 325.412 3.739 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@@H]2[NH2+]CC2CCC(F)(F)CC2)n1 ZINC000503954301 1028262647 /nfs/dbraw/zinc/26/26/47/1028262647.db2.gz VEQBIYSSVUKBLE-UONOGXRCSA-N 1 0 342.390 3.690 20 5 EHBDRO C[C@@H](N[C@@H](C[NH3+])C1CC1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423284199 1028322704 /nfs/dbraw/zinc/32/27/04/1028322704.db2.gz WPNATHNSKKNLCX-RISCZKNCSA-N 1 0 331.441 3.711 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[N@H+]3CCC[C@H](CCO)CC3)o2)c1 ZINC000421392488 1028367653 /nfs/dbraw/zinc/36/76/53/1028367653.db2.gz BYTZVBVWPFDEAJ-HNNXBMFYSA-N 1 0 344.411 3.839 20 5 EHBDRO Cc1c(CNC(=O)CC[C@@H]([NH3+])CC2CCCCC2)cccc1[N+](=O)[O-] ZINC000424177057 1028852405 /nfs/dbraw/zinc/85/24/05/1028852405.db2.gz TXXSPYLZRVUNQX-QGZVFWFLSA-N 1 0 347.459 3.597 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCCC1(O)CCC1 ZINC000421861043 1028854845 /nfs/dbraw/zinc/85/48/45/1028854845.db2.gz SXEASWMHUIDMMU-CQSZACIVSA-N 1 0 338.473 3.750 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@H](C)N(C)C1CC1 ZINC000504899158 1029026608 /nfs/dbraw/zinc/02/66/08/1029026608.db2.gz BLUJULSVVANRKO-UONOGXRCSA-N 1 0 337.489 3.538 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCC1CCOCC1 ZINC000504899293 1029027270 /nfs/dbraw/zinc/02/72/70/1029027270.db2.gz DIHGLRQCFKBROH-OAHLLOKOSA-N 1 0 338.473 3.872 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@H](C)N2CCC(C)CC2)cc1[N+](=O)[O-] ZINC000504895991 1029041557 /nfs/dbraw/zinc/04/15/57/1029041557.db2.gz WQJPLFVKAOLWEM-JKSUJKDBSA-N 1 0 349.475 3.765 20 5 EHBDRO C[C@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1c([N+](=O)[O-])ncn1C ZINC000355739816 1029047520 /nfs/dbraw/zinc/04/75/20/1029047520.db2.gz JHNRTGOLNAWXPN-RYUDHWBXSA-N 1 0 336.823 3.606 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(OC)cc2)cc1[N+](=O)[O-] ZINC000504912065 1029056497 /nfs/dbraw/zinc/05/64/97/1029056497.db2.gz PNJSOECPCMCVJD-AWEZNQCLSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2nnc(C[N@@H+]3CCCC4(CCCC4)C3)o2)cc1 ZINC000615000593 1029214020 /nfs/dbraw/zinc/21/40/20/1029214020.db2.gz GQCYCHOTPHQQAI-UHFFFAOYSA-N 1 0 342.399 3.801 20 5 EHBDRO CC(C)[N@H+](CC(=O)N1CCc2ccc([N+](=O)[O-])cc21)C1CCCCC1 ZINC000533048794 1029231709 /nfs/dbraw/zinc/23/17/09/1029231709.db2.gz XCQNIGQWSICUBX-UHFFFAOYSA-N 1 0 345.443 3.527 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]CCC1CCOCC1 ZINC000513822444 1029523385 /nfs/dbraw/zinc/52/33/85/1029523385.db2.gz CDPCXAMUGQYHHI-SJLPKXTDSA-N 1 0 332.444 3.712 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]Cc1ccc(F)cn1 ZINC000513829355 1029528439 /nfs/dbraw/zinc/52/84/39/1029528439.db2.gz ARXPWZJOOOGCDH-GUYCJALGSA-N 1 0 329.375 3.630 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCCC[N@@H+](C)C1CCCCC1 ZINC000446495908 1029662631 /nfs/dbraw/zinc/66/26/31/1029662631.db2.gz QKDUFAPNLJESCE-UHFFFAOYSA-N 1 0 348.447 3.679 20 5 EHBDRO Cc1ccc(CC[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)cc1 ZINC000446837778 1029806070 /nfs/dbraw/zinc/80/60/70/1029806070.db2.gz ARAVZJNGJIJXJX-CQSZACIVSA-N 1 0 338.411 3.890 20 5 EHBDRO C[C@@H](CCc1ccccc1)C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835394 1029815263 /nfs/dbraw/zinc/81/52/63/1029815263.db2.gz OMJMIIJOLPCDEQ-AWEZNQCLSA-N 1 0 338.411 3.830 20 5 EHBDRO CC[C@H](Cc1ccc(C)cc1)[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000446835425 1029815923 /nfs/dbraw/zinc/81/59/23/1029815923.db2.gz KZKQTPVBHKIRDF-OAHLLOKOSA-N 1 0 338.411 3.890 20 5 EHBDRO CC(C)C[C@H]1OCCC[C@@H]1[NH2+]Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000481756398 1029906030 /nfs/dbraw/zinc/90/60/30/1029906030.db2.gz NBDYRMSMXFYLAL-GOEBONIOSA-N 1 0 326.824 3.932 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H]2CC[C@@H](c3ccccc3)O2)cc1[N+](=O)[O-] ZINC000520293482 1029949166 /nfs/dbraw/zinc/94/91/66/1029949166.db2.gz BOKCJSIZOUGORH-MJGOQNOKSA-N 1 0 326.396 3.913 20 5 EHBDRO CCc1cnc(CC[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)s1 ZINC000192910656 1030036984 /nfs/dbraw/zinc/03/69/84/1030036984.db2.gz MRHSMJWLGYUMII-MRXNPFEDSA-N 1 0 331.441 3.823 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NC[C@@H](c2ccco2)[NH+]2CCCCC2)c1 ZINC000520307477 1030056288 /nfs/dbraw/zinc/05/62/88/1030056288.db2.gz CKGILRYZLBFEFY-KRWDZBQOSA-N 1 0 345.399 3.836 20 5 EHBDRO C[C@@H](CC(C)(C)O)[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325782 1030108533 /nfs/dbraw/zinc/10/85/33/1030108533.db2.gz RQJFXFMWAADXJG-KSSFIOAISA-N 1 0 328.412 3.823 20 5 EHBDRO CC(=O)Nc1ccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)cc1 ZINC000531941471 1030108775 /nfs/dbraw/zinc/10/87/75/1030108775.db2.gz OPSREFARAYTPFC-ZDUSSCGKSA-N 1 0 327.384 3.712 20 5 EHBDRO CCc1ccc([C@H]([NH2+]CCC2(CO)CC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000453327699 1030109252 /nfs/dbraw/zinc/10/92/52/1030109252.db2.gz AYEMUHMFZQKXRI-GOSISDBHSA-N 1 0 344.411 3.592 20 5 EHBDRO C[C@H]1CCN(Cc2cccc([N+](=O)[O-])c2)CC[N@@H+]1Cc1ccccc1 ZINC000525781216 1030118028 /nfs/dbraw/zinc/11/80/28/1030118028.db2.gz WYKVZGMWQWFGMT-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO [NH3+][C@@H]1CCC[C@H](CNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000567847676 1030143497 /nfs/dbraw/zinc/14/34/97/1030143497.db2.gz WMPDRKJYUUDALF-GOEBONIOSA-N 1 0 333.435 3.635 20 5 EHBDRO C[N@H+](Cc1ccccc1)CC(C)(C)NCc1csc([N+](=O)[O-])c1 ZINC000159362802 1030151183 /nfs/dbraw/zinc/15/11/83/1030151183.db2.gz DCDCMJUXLJFPFV-UHFFFAOYSA-N 1 0 333.457 3.657 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]Cc1ncccc1OC ZINC000453374797 1030193955 /nfs/dbraw/zinc/19/39/55/1030193955.db2.gz SXSVOFAPCKINSB-ZDUSSCGKSA-N 1 0 347.440 3.659 20 5 EHBDRO Cc1ccc(CC[NH2+][C@@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)nc1 ZINC000453413617 1030226102 /nfs/dbraw/zinc/22/61/02/1030226102.db2.gz HZYLLNNWEHNHEQ-GOSISDBHSA-N 1 0 325.412 3.853 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[C@H]1[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000245839270 1030253424 /nfs/dbraw/zinc/25/34/24/1030253424.db2.gz BYTQEMRZIVYFDS-CDMJZVDBSA-N 1 0 339.823 3.601 20 5 EHBDRO Cc1cc(C[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)ccc1F ZINC000447542962 1030277301 /nfs/dbraw/zinc/27/73/01/1030277301.db2.gz QDKJSHINROOMMG-CVEARBPZSA-N 1 0 332.379 3.512 20 5 EHBDRO COC[C@H](Cc1ccccc1)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447563185 1030307681 /nfs/dbraw/zinc/30/76/81/1030307681.db2.gz OUDBPZCWIVUAPM-FXAWDEMLSA-N 1 0 340.423 3.820 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]CCc1ccc(F)c(F)c1 ZINC000526045653 1030367425 /nfs/dbraw/zinc/36/74/25/1030367425.db2.gz AXNYDCSVDTZXPA-UHFFFAOYSA-N 1 0 336.338 3.604 20 5 EHBDRO CN(C)C[C@@H]([NH2+]C/C=C\c1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000583776186 1030704326 /nfs/dbraw/zinc/70/43/26/1030704326.db2.gz TXLRGRAJRBHTFZ-LZCIBIBXSA-N 1 0 343.402 3.640 20 5 EHBDRO COc1ccc2c(c1)[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])CCS2 ZINC000343466086 1031007815 /nfs/dbraw/zinc/00/78/15/1031007815.db2.gz QLLBLAJRHBJUJR-MRXNPFEDSA-N 1 0 344.436 3.973 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000551113174 1031042987 /nfs/dbraw/zinc/04/29/87/1031042987.db2.gz WXCYMLIRMLRESH-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO C[C@@H](C(=O)Nc1ccccc1[N+](=O)[O-])[N@@H+]1CCC[C@@H](C(C)(C)C)C1 ZINC000483254982 1031067683 /nfs/dbraw/zinc/06/76/83/1031067683.db2.gz IWTQSZFLWAFKHE-UONOGXRCSA-N 1 0 333.432 3.680 20 5 EHBDRO CCC[C@@H]1CCCC[C@@H]1[NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C ZINC000548160619 1031233122 /nfs/dbraw/zinc/23/31/22/1031233122.db2.gz BMDGXWHHBJPVNF-ZBFHGGJFSA-N 1 0 333.432 3.790 20 5 EHBDRO CCSc1cc(C[NH2+][C@@H](C)c2cc(OC)cc([N+](=O)[O-])c2)ccn1 ZINC000903153902 1031252736 /nfs/dbraw/zinc/25/27/36/1031252736.db2.gz PNFOCHOVGQTBRD-LBPRGKRZSA-N 1 0 347.440 3.961 20 5 EHBDRO CC[N@H+](CCc1cccs1)[C@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000343559061 1031397273 /nfs/dbraw/zinc/39/72/73/1031397273.db2.gz BMAWNEFCSFKXJG-CYBMUJFWSA-N 1 0 347.440 3.548 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCOc1ccc(F)cc1)C1CC1 ZINC000537918973 1032001958 /nfs/dbraw/zinc/00/19/58/1032001958.db2.gz YPYKATYCKFRGKZ-GOSISDBHSA-N 1 0 344.386 3.724 20 5 EHBDRO CCOc1cncc(CN(Cc2ccccc2[N+](=O)[O-])C2CC2)c1 ZINC000598677798 1033377795 /nfs/dbraw/zinc/37/77/95/1033377795.db2.gz AQXAKTTYIDLLKC-UHFFFAOYSA-N 1 0 327.384 3.553 20 5 EHBDRO COC(=O)c1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000594500734 1033401561 /nfs/dbraw/zinc/40/15/61/1033401561.db2.gz AUYBRKPVCFDWQP-GOSISDBHSA-N 1 0 340.379 3.549 20 5 EHBDRO C[C@@H](Cc1ccccn1)[NH2+][C@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000594514911 1033419863 /nfs/dbraw/zinc/41/98/63/1033419863.db2.gz MDILYZXCSPBCNZ-LIRRHRJNSA-N 1 0 325.412 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@@H]3CCC[N@@H+]4CCCC[C@@H]34)c2c1 ZINC000594599889 1033445906 /nfs/dbraw/zinc/44/59/06/1033445906.db2.gz KAYVLJIRRCHUNT-SJORKVTESA-N 1 0 326.400 3.572 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1CCC[C@@H]1C1CCCC1 ZINC000063551554 1033446284 /nfs/dbraw/zinc/44/62/84/1033446284.db2.gz CGCHEFXYVMOJKL-GOSISDBHSA-N 1 0 345.443 3.886 20 5 EHBDRO Cc1nn(C[N@H+](C)CCc2ccc(F)cc2)c2cc([N+](=O)[O-])ccc12 ZINC000761288583 1033483294 /nfs/dbraw/zinc/48/32/94/1033483294.db2.gz SWZKNIBNSCMMTQ-UHFFFAOYSA-N 1 0 342.374 3.524 20 5 EHBDRO C[C@@H](COc1c(F)cccc1F)[NH2+]Cc1ccc([N+](=O)[O-])cc1F ZINC000594972959 1033578403 /nfs/dbraw/zinc/57/84/03/1033578403.db2.gz GEQVBUJANOMSAZ-JTQLQIEISA-N 1 0 340.301 3.569 20 5 EHBDRO CC(C)C(C[NH2+][C@@H](c1nccn1C)c1cccc([N+](=O)[O-])c1)C(C)C ZINC000557393532 1033596521 /nfs/dbraw/zinc/59/65/21/1033596521.db2.gz TVCMMQFLLXUGMP-GOSISDBHSA-N 1 0 344.459 3.936 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H](OC)c1ccccc1 ZINC000595019473 1033612821 /nfs/dbraw/zinc/61/28/21/1033612821.db2.gz WKHINPOVEZNQTB-ACJLOTCBSA-N 1 0 330.384 3.642 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)N[C@@H]1COc2ccc(C)cc21 ZINC000595022885 1033616090 /nfs/dbraw/zinc/61/60/90/1033616090.db2.gz QDWJLKHZQJMGCF-MLGOLLRUSA-N 1 0 328.368 3.696 20 5 EHBDRO CC1(C)OCC[C@H]1C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000594994080 1033623726 /nfs/dbraw/zinc/62/37/26/1033623726.db2.gz DWWAMJDYEGISJW-ZDUSSCGKSA-N 1 0 347.440 3.623 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)[C@H](C)c1ccccc1 ZINC000594999581 1033625864 /nfs/dbraw/zinc/62/58/64/1033625864.db2.gz CAPRUGYZUJASPS-HWIYTKFHSA-N 1 0 340.423 3.752 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054950 1033633020 /nfs/dbraw/zinc/63/30/20/1033633020.db2.gz XRZZHCUCIULDMU-HIFRSBDPSA-N 1 0 335.448 3.517 20 5 EHBDRO CCc1cnccc1[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595029586 1033650473 /nfs/dbraw/zinc/65/04/73/1033650473.db2.gz ZREGFAXQTFPQSW-QWHCGFSZSA-N 1 0 329.400 3.973 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000595040517 1033660618 /nfs/dbraw/zinc/66/06/18/1033660618.db2.gz GFVISMQTUSFHDW-ZIAGYGMSSA-N 1 0 334.416 3.603 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@H]1CCOC2(CCC2)C1 ZINC000595040280 1033661174 /nfs/dbraw/zinc/66/11/74/1033661174.db2.gz GFVISMQTUSFHDW-KGLIPLIRSA-N 1 0 334.416 3.603 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)C(C)(C)C(F)F ZINC000595046561 1033662283 /nfs/dbraw/zinc/66/22/83/1033662283.db2.gz AMDPXQODNAADNP-SNVBAGLBSA-N 1 0 325.359 3.888 20 5 EHBDRO Cn1ncc(C2CCC2)c1C[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595101604 1033688111 /nfs/dbraw/zinc/68/81/11/1033688111.db2.gz XIYYKHZGUQYEAU-SFHVURJKSA-N 1 0 340.427 3.763 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@@H](O)[C@H](C)c2ccccc2)cccc1[N+](=O)[O-] ZINC000595100569 1033688891 /nfs/dbraw/zinc/68/88/91/1033688891.db2.gz VPEKNWJLCXMBTA-FRIZHTMISA-N 1 0 328.412 3.718 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](c2ccccc2)[C@H](C)O)cc1[N+](=O)[O-] ZINC000595102449 1033691270 /nfs/dbraw/zinc/69/12/70/1033691270.db2.gz IAGDEMLFJQFDGW-NJSLBKSFSA-N 1 0 344.411 3.766 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC1(C)C ZINC000595107652 1033691494 /nfs/dbraw/zinc/69/14/94/1033691494.db2.gz PDLOEAFOJRKQID-KBPBESRZSA-N 1 0 338.473 3.870 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595101247 1033691783 /nfs/dbraw/zinc/69/17/83/1033691783.db2.gz CPRMHLBZSKSZKX-BEFAXECRSA-N 1 0 325.412 3.520 20 5 EHBDRO Cc1c([C@H](C)[NH2+]Cc2c(C(F)(F)F)cnn2C)cccc1[N+](=O)[O-] ZINC000599059996 1033699269 /nfs/dbraw/zinc/69/92/69/1033699269.db2.gz KYJLMYWNRIDHLW-JTQLQIEISA-N 1 0 342.321 3.506 20 5 EHBDRO CC1(C)CCC[C@@](O)(C[NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)C1 ZINC000782534354 1033700083 /nfs/dbraw/zinc/70/00/83/1033700083.db2.gz AGWGSKCUUMRRKL-INIZCTEOSA-N 1 0 326.824 3.669 20 5 EHBDRO Cc1noc(C[N@@H+](C)[C@H]2CCC[C@@H]2c2ccc(C)cc2)c1[N+](=O)[O-] ZINC000595327722 1033728694 /nfs/dbraw/zinc/72/86/94/1033728694.db2.gz RHQZDZMLUCNZRI-CVEARBPZSA-N 1 0 329.400 3.968 20 5 EHBDRO CCC[N@H+](Cc1ccc(F)cc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000595330861 1033729353 /nfs/dbraw/zinc/72/93/53/1033729353.db2.gz MZJZNLQYGHSMGD-OIISXLGYSA-N 1 0 336.407 3.759 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[N@@H+](CCCO)[C@H]1CCc2ccccc21 ZINC000595343396 1033734437 /nfs/dbraw/zinc/73/44/37/1033734437.db2.gz QBZXIUHVAYEXIB-SFHVURJKSA-N 1 0 344.386 3.606 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](c1ccccc1)[C@@H]1CCOC1 ZINC000595418029 1033792299 /nfs/dbraw/zinc/79/22/99/1033792299.db2.gz NHOLPJJANCZFDK-CRAIPNDOSA-N 1 0 330.359 3.601 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@H](C[C@@H]1CCOC1)c1ccccc1 ZINC000595419292 1033793064 /nfs/dbraw/zinc/79/30/64/1033793064.db2.gz KDVWPSDHBQVCGR-KBXCAEBGSA-N 1 0 344.386 3.991 20 5 EHBDRO Cc1noc(C[N@@H+]2CCC[C@](C)(c3ccccc3)CC2)c1[N+](=O)[O-] ZINC000595484684 1033809548 /nfs/dbraw/zinc/80/95/48/1033809548.db2.gz MVSZBDSABIJPGH-SFHVURJKSA-N 1 0 329.400 3.835 20 5 EHBDRO Cc1ccccc1C[N@@H+]1CCCN(c2ccccc2[N+](=O)[O-])CC1 ZINC000603629041 1033814275 /nfs/dbraw/zinc/81/42/75/1033814275.db2.gz MYHSCTHOTDWUDG-UHFFFAOYSA-N 1 0 325.412 3.616 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCC2(CO)CCC2)c2ccccc2)c1 ZINC000593719060 1033834936 /nfs/dbraw/zinc/83/49/36/1033834936.db2.gz UPQHFFXESWOYJL-LJQANCHMSA-N 1 0 340.423 3.827 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@H](c2ccncc2)C1)c1cccc([N+](=O)[O-])c1 ZINC000593722918 1033851301 /nfs/dbraw/zinc/85/13/01/1033851301.db2.gz ROEMIINLBHECRJ-QBIMZIAESA-N 1 0 327.384 3.561 20 5 EHBDRO CCOc1ccc2c(c1)[C@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)CCO2 ZINC000089513464 1033871905 /nfs/dbraw/zinc/87/19/05/1033871905.db2.gz FELXEBJYBQEBHP-QGZVFWFLSA-N 1 0 328.368 3.607 20 5 EHBDRO CN1CC[C@@H]([NH2+]CCc2cccc([N+](=O)[O-])c2)C[C@@H]1c1ccccc1 ZINC000550704419 1033894050 /nfs/dbraw/zinc/89/40/50/1033894050.db2.gz XKSPOEQZIJADTE-UYAOXDASSA-N 1 0 339.439 3.562 20 5 EHBDRO CCC[N@H+](Cc1ccccc1)[C@@H](C)C(=O)Nc1ccccc1[N+](=O)[O-] ZINC000550730489 1033956841 /nfs/dbraw/zinc/95/68/41/1033956841.db2.gz SZNIRWXUIWDTDV-HNNXBMFYSA-N 1 0 341.411 3.834 20 5 EHBDRO C[C@H]([NH2+]Cc1nc(-c2ccc([N+](=O)[O-])cc2)no1)C1CCC(F)CC1 ZINC000595819285 1033994218 /nfs/dbraw/zinc/99/42/18/1033994218.db2.gz NNZMFBZMRDLLKP-DCBWTQNWSA-N 1 0 348.378 3.651 20 5 EHBDRO CCOc1cc(C[N@@H+]2CCC[C@@H]([C@@H]3CCCCO3)C2)ccc1[N+](=O)[O-] ZINC000595787960 1033998996 /nfs/dbraw/zinc/99/89/96/1033998996.db2.gz LAZXWPQISLFDEP-AEFFLSMTSA-N 1 0 348.443 3.775 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1C[C@@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000603905614 1034024268 /nfs/dbraw/zinc/02/42/68/1034024268.db2.gz JRYAVEBKPNFMDJ-KBAYOESNSA-N 1 0 337.423 3.724 20 5 EHBDRO C[C@H]1O[C@@H](C)[C@@H](C)[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000599625113 1034071562 /nfs/dbraw/zinc/07/15/62/1034071562.db2.gz FZZHRHYDQOAXFV-PUXPGTEJSA-N 1 0 332.322 3.515 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@](C)(O)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000169151673 1034104446 /nfs/dbraw/zinc/10/44/46/1034104446.db2.gz OHWDJZOGAWSWNA-RTBURBONSA-N 1 0 328.412 3.933 20 5 EHBDRO Cc1cc(NC2CC[NH+]([C@@H](C)c3ccncc3)CC2)c([N+](=O)[O-])s1 ZINC000596171015 1034118400 /nfs/dbraw/zinc/11/84/00/1034118400.db2.gz CNNKDQPBLRSCQO-ZDUSSCGKSA-N 1 0 346.456 3.997 20 5 EHBDRO CO[C@@]1(C(F)(F)F)CCCN(C/C=C\c2ccccc2[N+](=O)[O-])C1 ZINC000615141116 1034145902 /nfs/dbraw/zinc/14/59/02/1034145902.db2.gz BKZIGRNOIQSMRG-QZDDGCDVSA-N 1 0 344.333 3.651 20 5 EHBDRO CC(C)(C)[N@@H+]1CC[C@@H](CNc2nccc3ccc([N+](=O)[O-])cc32)C1 ZINC000596308794 1034162132 /nfs/dbraw/zinc/16/21/32/1034162132.db2.gz VGYMOKPSNZQJMT-ZDUSSCGKSA-N 1 0 328.416 3.675 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NCC1CC[NH+](Cc2ccncc2)CC1 ZINC000596441094 1034244559 /nfs/dbraw/zinc/24/45/59/1034244559.db2.gz NAGCOXCZNRWRFX-UHFFFAOYSA-N 1 0 340.427 3.622 20 5 EHBDRO Cc1c(C(=O)Nc2ccc3c(c2)CC[C@@H]3[NH+](C)C)cccc1[N+](=O)[O-] ZINC000456264422 1034262865 /nfs/dbraw/zinc/26/28/65/1034262865.db2.gz NHQHMHIXHNGEEW-SFHVURJKSA-N 1 0 339.395 3.704 20 5 EHBDRO CC1CC[NH+]([C@@H](CNc2cccnc2[N+](=O)[O-])c2ccccc2)CC1 ZINC000604270583 1034312229 /nfs/dbraw/zinc/31/22/29/1034312229.db2.gz OFOJNTBTYDMHDZ-SFHVURJKSA-N 1 0 340.427 3.875 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)C2 ZINC000612194052 1034436875 /nfs/dbraw/zinc/43/68/75/1034436875.db2.gz QWTCMWPLKFXOGE-OAHLLOKOSA-N 1 0 346.814 3.904 20 5 EHBDRO C[C@H]([NH2+]CC1(C)OCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000179576487 1034505191 /nfs/dbraw/zinc/50/51/91/1034505191.db2.gz YJDPHEUASLOMKA-LBPRGKRZSA-N 1 0 348.424 3.737 20 5 EHBDRO CCC(CC)[C@@H]([NH2+]CCn1cc([N+](=O)[O-])ccc1=O)c1ccccc1 ZINC000179786752 1034605031 /nfs/dbraw/zinc/60/50/31/1034605031.db2.gz XFVUGTFZQNDHBF-LJQANCHMSA-N 1 0 343.427 3.524 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CC[C@H](C)OC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612408350 1034890309 /nfs/dbraw/zinc/89/03/09/1034890309.db2.gz WXOBGLJJXKKGCJ-UGSOOPFHSA-N 1 0 332.400 3.854 20 5 EHBDRO CCc1ccc([C@H](NCC[NH+]2CCCC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000612406304 1034898321 /nfs/dbraw/zinc/89/83/21/1034898321.db2.gz DDYNGXDCJXXKMX-LJQANCHMSA-N 1 0 343.427 3.525 20 5 EHBDRO CCC(=O)c1ccc(NC2CC[NH+](C3CCC3)CC2)c([N+](=O)[O-])c1 ZINC000450876003 1034901685 /nfs/dbraw/zinc/90/16/85/1034901685.db2.gz IMBSYIMOYSHDDI-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO COc1ccc([C@@H](C[NH+]2CCCC2)Nc2ccc([N+](=O)[O-])s2)cc1 ZINC000612449919 1034946745 /nfs/dbraw/zinc/94/67/45/1034946745.db2.gz KDCKBWMICORTQN-OAHLLOKOSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@@H](Cc1ccsc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000584493182 1035150853 /nfs/dbraw/zinc/15/08/53/1035150853.db2.gz KIJARKQPOFAYSU-LBPRGKRZSA-N 1 0 329.425 3.901 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[N@@H+]1CCCN2c3ccccc3C[C@H]2C1 ZINC000580984603 1035468428 /nfs/dbraw/zinc/46/84/28/1035468428.db2.gz OFXFYGGHCMQXGU-STISFXCESA-N 1 0 349.434 3.745 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccnc(OC(F)F)c1 ZINC000581503388 1035514459 /nfs/dbraw/zinc/51/44/59/1035514459.db2.gz HEBXGJWCJOXEKA-GHXNOFRVSA-N 1 0 349.337 3.784 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164525878 1035652831 /nfs/dbraw/zinc/65/28/31/1035652831.db2.gz KHVVKDNCTPWAQD-UKRRQHHQSA-N 1 0 349.431 3.563 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H]1[C@H]2CCO[C@@H]2C12CCCC2 ZINC000540789164 1035683081 /nfs/dbraw/zinc/68/30/81/1035683081.db2.gz MWMVCGJOAUOAOG-NZPGVSJUSA-N 1 0 330.428 3.902 20 5 EHBDRO O=[N+]([O-])c1ccc(CN2CCC([NH+]3CCCCC3)CC2)c(Cl)c1 ZINC000541072396 1035953959 /nfs/dbraw/zinc/95/39/59/1035953959.db2.gz SNKNZIADWPVVCI-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+]CC1(O)CCCCC1 ZINC000513786668 1036088153 /nfs/dbraw/zinc/08/81/53/1036088153.db2.gz LBYWRKCHBHLHBS-WBVHZDCISA-N 1 0 332.444 3.591 20 5 EHBDRO CC[C@@]1(C[NH2+]Cc2ccc([N+](=O)[O-])cc2F)OCCc2ccccc21 ZINC000589319282 1036358888 /nfs/dbraw/zinc/35/88/88/1036358888.db2.gz FOCYWCYYDGVRNS-IBGZPJMESA-N 1 0 344.386 3.702 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@H](C)COC)c2ccc([N+](=O)[O-])cc2)o1 ZINC000541547135 1036426002 /nfs/dbraw/zinc/42/60/02/1036426002.db2.gz AKOHSWOOTBSXPU-ACJLOTCBSA-N 1 0 332.400 3.712 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@H]2C2CCCC2)c1 ZINC000589496692 1036439496 /nfs/dbraw/zinc/43/94/96/1036439496.db2.gz DJWJUABWHFPBSL-MRXNPFEDSA-N 1 0 332.400 3.536 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@H]2C2CCCC2)c1 ZINC000589496690 1036440411 /nfs/dbraw/zinc/44/04/11/1036440411.db2.gz DJWJUABWHFPBSL-INIZCTEOSA-N 1 0 332.400 3.536 20 5 EHBDRO COCC[C@@H](Cc1ccco1)[NH2+][C@@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000541571974 1036463097 /nfs/dbraw/zinc/46/30/97/1036463097.db2.gz YBDWZESRWQKGEH-HOCLYGCPSA-N 1 0 332.400 3.795 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)c1ccc(NC(N)=O)cc1 ZINC000165434193 1036556673 /nfs/dbraw/zinc/55/66/73/1036556673.db2.gz PRTXGXBNCBKYFA-OLZOCXBDSA-N 1 0 342.399 3.806 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])c(C)c1C(=O)NCCC[N@H+]1CCCC[C@H]1C ZINC000180334792 1036695279 /nfs/dbraw/zinc/69/52/79/1036695279.db2.gz AKKXLMYYLJCSSV-OAHLLOKOSA-N 1 0 347.459 3.514 20 5 EHBDRO CCC[C@H]1[C@H](C)CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000464736837 1036695259 /nfs/dbraw/zinc/69/52/59/1036695259.db2.gz LTXPSCIYHXSGDB-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CC2CCOCC2)c2ccccc2)c1 ZINC000180351863 1036717556 /nfs/dbraw/zinc/71/75/56/1036717556.db2.gz CZNJGOKKRKRPJI-IBGZPJMESA-N 1 0 326.396 3.700 20 5 EHBDRO Cc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135584 1036784400 /nfs/dbraw/zinc/78/44/00/1036784400.db2.gz OASBPCYQDKYZBE-RYUDHWBXSA-N 1 0 343.349 3.961 20 5 EHBDRO CO[C@H]1CCC[N@H+](Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)CC1 ZINC000590173536 1036800965 /nfs/dbraw/zinc/80/09/65/1036800965.db2.gz ZRGHVRUSLXARKY-ZDUSSCGKSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@H](CN[C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1)[N@H+](C)C1CC1 ZINC000180469545 1036870549 /nfs/dbraw/zinc/87/05/49/1036870549.db2.gz MWVWBTBHKHNSBR-QRWLVFNGSA-N 1 0 339.439 3.757 20 5 EHBDRO CCN(C)c1ccc(C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cn1 ZINC000191290320 1036886379 /nfs/dbraw/zinc/88/63/79/1036886379.db2.gz DCNYJYNRJANPEO-CQSZACIVSA-N 1 0 328.416 3.605 20 5 EHBDRO Cc1ccc(C[N@H+](C)CCC(=O)Nc2ccc([N+](=O)[O-])cc2C)s1 ZINC000076342873 1036938061 /nfs/dbraw/zinc/93/80/61/1036938061.db2.gz QHEVVXVBLRACIW-UHFFFAOYSA-N 1 0 347.440 3.734 20 5 EHBDRO C[C@@H]1C[C@@H](N[C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233794 1036959354 /nfs/dbraw/zinc/95/93/54/1036959354.db2.gz UYHZXTBHFAACFG-BPAFIMBUSA-N 1 0 339.439 3.757 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@H]2CCCC[C@@H]2O)c2ccccc2)c1 ZINC000180612823 1036996642 /nfs/dbraw/zinc/99/66/42/1036996642.db2.gz XMNBZJCSZPKVEB-YZGWKJHDSA-N 1 0 340.423 3.825 20 5 EHBDRO CC(C)[C@H]1OCCC[C@H]1C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000761524385 1037099351 /nfs/dbraw/zinc/09/93/51/1037099351.db2.gz BXKCSXHPPRQLTB-XJKSGUPXSA-N 1 0 326.824 3.789 20 5 EHBDRO [NH3+]CCCN(Cc1ccc([N+](=O)[O-])c(Cl)c1)c1cccc(F)c1 ZINC000761535842 1037116952 /nfs/dbraw/zinc/11/69/52/1037116952.db2.gz ZWTULNYWRARADF-UHFFFAOYSA-N 1 0 337.782 3.743 20 5 EHBDRO COc1cc(C[N@@H+]2C[C@H](C)[C@H]3CCCC[C@H]32)c([N+](=O)[O-])cc1OC ZINC000542185222 1037144621 /nfs/dbraw/zinc/14/46/21/1037144621.db2.gz OCGKOWQRNATKOL-NWANDNLSSA-N 1 0 334.416 3.623 20 5 EHBDRO C[C@@H](O)[C@@H]1CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000180867702 1037274735 /nfs/dbraw/zinc/27/47/35/1037274735.db2.gz XWODQLCQXLMUMB-TZMCWYRMSA-N 1 0 332.425 3.526 20 5 EHBDRO CC[C@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(C)c([N+](=O)[O-])c1 ZINC000539850260 1037279893 /nfs/dbraw/zinc/27/98/93/1037279893.db2.gz LBHMWFDPMLXVSP-SFHVURJKSA-N 1 0 328.412 3.676 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@H](C)Oc1cccc(C)c1 ZINC000462730034 1037328354 /nfs/dbraw/zinc/32/83/54/1037328354.db2.gz FHFIESQXZSBNJT-HNNXBMFYSA-N 1 0 344.411 3.859 20 5 EHBDRO CO[C@@H]1CC[C@@H]([NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000188821105 1037340640 /nfs/dbraw/zinc/34/06/40/1037340640.db2.gz KOSXVWGRUAYTFQ-QRQLOZEOSA-N 1 0 326.396 3.841 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1C[C@H](OCC)C12CCCC2 ZINC000462756706 1037373316 /nfs/dbraw/zinc/37/33/16/1037373316.db2.gz OXUOOZRISIISOS-MSOLQXFVSA-N 1 0 348.443 3.821 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000462838719 1037463371 /nfs/dbraw/zinc/46/33/71/1037463371.db2.gz ZHTZOUYKINCVNN-CYBMUJFWSA-N 1 0 343.374 3.873 20 5 EHBDRO Cc1cccc([C@H](C)C[NH2+][C@H]2CCCC[C@H]2n2ccc([N+](=O)[O-])n2)c1 ZINC000472616569 1037476594 /nfs/dbraw/zinc/47/65/94/1037476594.db2.gz MLBSWYRPSOKZGF-BPQIPLTHSA-N 1 0 342.443 3.977 20 5 EHBDRO CC1(C)C[C@H](N[C@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582566 1037517197 /nfs/dbraw/zinc/51/71/97/1037517197.db2.gz LPNOQXBNVUQZRM-GUYCJALGSA-N 1 0 329.444 3.582 20 5 EHBDRO CC1(C)C[C@H](N[C@@H]2CC[NH2+]C3(CCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000591582565 1037518463 /nfs/dbraw/zinc/51/84/63/1037518463.db2.gz LPNOQXBNVUQZRM-DYVFJYSZSA-N 1 0 329.444 3.582 20 5 EHBDRO CO[C@](C)(C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)C1CC1 ZINC000462905012 1037533592 /nfs/dbraw/zinc/53/35/92/1037533592.db2.gz IOTAMRIXQGBSJP-GOSISDBHSA-N 1 0 330.384 3.760 20 5 EHBDRO CC(F)(F)CCC[NH+]1CCC(Oc2ccc([N+](=O)[O-])cc2)CC1 ZINC000929749707 1037541696 /nfs/dbraw/zinc/54/16/96/1037541696.db2.gz PXMQFLNYGPUWDK-UHFFFAOYSA-N 1 0 328.359 3.873 20 5 EHBDRO CC(C)C[C@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+](C)C ZINC000462916765 1037547140 /nfs/dbraw/zinc/54/71/40/1037547140.db2.gz JCNYCKQFUCCIGY-GFCCVEGCSA-N 1 0 331.363 3.584 20 5 EHBDRO CC(C)C[C@@H](CNc1ccc([N+](=O)[O-])c(OC(F)F)c1)[NH+](C)C ZINC000462916766 1037548938 /nfs/dbraw/zinc/54/89/38/1037548938.db2.gz JCNYCKQFUCCIGY-LBPRGKRZSA-N 1 0 331.363 3.584 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](c2cccnc2)C2CC2)ccc1[N+](=O)[O-] ZINC000491596730 1037576791 /nfs/dbraw/zinc/57/67/91/1037576791.db2.gz NJJRJIGRNBMUHV-GOSISDBHSA-N 1 0 327.384 3.629 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)CCCC2 ZINC000760889295 1037577664 /nfs/dbraw/zinc/57/76/64/1037577664.db2.gz YBYBXNGCJKBIKF-XOBRGWDASA-N 1 0 340.423 3.858 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CCO[C@H]1C1CC1 ZINC000540151699 1037622877 /nfs/dbraw/zinc/62/28/77/1037622877.db2.gz STQMMJBKVPULMZ-KEYYUXOJSA-N 1 0 336.457 3.623 20 5 EHBDRO CCC[C@@H](C)[C@@H](CO)[NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F ZINC000573615420 1037630194 /nfs/dbraw/zinc/63/01/94/1037630194.db2.gz WTRXJQKKOCNUNP-QMTHXVAHSA-N 1 0 334.338 3.500 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCNC(=O)CC1CCCCC1 ZINC000540186259 1037669189 /nfs/dbraw/zinc/66/91/89/1037669189.db2.gz PZECKFVFMDGLRQ-HNNXBMFYSA-N 1 0 347.459 3.640 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C(=O)N(C)C(C)(C)C[NH+]2CCCCCC2)c1 ZINC000494078690 1037828649 /nfs/dbraw/zinc/82/86/49/1037828649.db2.gz LLCAZYXFPBPKBU-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO C[C@H](C[NH2+][C@@H]1CCc2cccnc2CC1)c1ccccc1[N+](=O)[O-] ZINC000897460719 1037848266 /nfs/dbraw/zinc/84/82/66/1037848266.db2.gz VFYDQCNHPNURQJ-GDBMZVCRSA-N 1 0 325.412 3.631 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@@H+]3CCCC[C@H]3C3CCC3)n2)c1 ZINC000592198798 1037943532 /nfs/dbraw/zinc/94/35/32/1037943532.db2.gz VNIWTCRFQSIQMN-INIZCTEOSA-N 1 0 342.399 3.799 20 5 EHBDRO CC(C)C[C@@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)c1ccncc1 ZINC000592387664 1037952787 /nfs/dbraw/zinc/95/27/87/1037952787.db2.gz CSNQFPZGLHRHPG-GOSISDBHSA-N 1 0 329.400 3.746 20 5 EHBDRO COc1ccc(C[NH2+][C@H](CC(C)C)c2ccncc2)cc1[N+](=O)[O-] ZINC000592387238 1037953268 /nfs/dbraw/zinc/95/32/68/1037953268.db2.gz AGNFMYDOBDCGOK-MRXNPFEDSA-N 1 0 329.400 3.875 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(F)c1 ZINC000540479037 1037991262 /nfs/dbraw/zinc/99/12/62/1037991262.db2.gz TUJAUNIQCZFNLK-ZDUSSCGKSA-N 1 0 345.374 3.640 20 5 EHBDRO COc1ccccc1C[C@@H]1CCC[N@@H+]1Cc1csc([N+](=O)[O-])c1 ZINC000058525408 1038046192 /nfs/dbraw/zinc/04/61/92/1038046192.db2.gz PMDAPTNIVKIBRE-HNNXBMFYSA-N 1 0 332.425 3.872 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1NC(=O)NCC(C)(C)[NH+]1CCCCC1 ZINC000085636200 1038083135 /nfs/dbraw/zinc/08/31/35/1038083135.db2.gz GODOVEUGILNEMT-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO C[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1F ZINC000181580670 1038097445 /nfs/dbraw/zinc/09/74/45/1038097445.db2.gz YOAXSNJHSBTGFS-NSHDSACASA-N 1 0 349.337 3.552 20 5 EHBDRO CC(C)C[C@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000538731134 1038497675 /nfs/dbraw/zinc/49/76/75/1038497675.db2.gz DLSYTFNKWOQISM-OAHLLOKOSA-N 1 0 342.443 3.863 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[N@H+](CCCO)Cc1ccccc1 ZINC000470176562 1038544412 /nfs/dbraw/zinc/54/44/12/1038544412.db2.gz XNLKTPTUVRBDLC-LGMDPLHJSA-N 1 0 340.423 3.883 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CN(C)Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000539049349 1038653867 /nfs/dbraw/zinc/65/38/67/1038653867.db2.gz OXFMZCLTSOHXGH-RBUKOAKNSA-N 1 0 325.412 3.822 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+][C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290612 1038763118 /nfs/dbraw/zinc/76/31/18/1038763118.db2.gz ARCFYBURAKYVCX-HUUCEWRRSA-N 1 0 341.411 3.889 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H](c2cccs2)[NH+](C)C)c([N+](=O)[O-])c1 ZINC000479853034 1038785849 /nfs/dbraw/zinc/78/58/49/1038785849.db2.gz RJBNTIOXUUCDCT-HNNXBMFYSA-N 1 0 347.440 3.964 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000067038753 1038840405 /nfs/dbraw/zinc/84/04/05/1038840405.db2.gz PEKRDIARMCLFLW-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1NC1CC[NH+](C2CC2)CC1 ZINC000014327115 1038873480 /nfs/dbraw/zinc/87/34/80/1038873480.db2.gz AXSXGKQOXCSKME-UHFFFAOYSA-N 1 0 329.322 3.652 20 5 EHBDRO CC[C@]1(CO)CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000190227456 1038908874 /nfs/dbraw/zinc/90/88/74/1038908874.db2.gz MMXTWSWIUDZRAO-IBGZPJMESA-N 1 0 344.411 3.839 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CCN(Cc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000480090346 1039140109 /nfs/dbraw/zinc/14/01/09/1039140109.db2.gz WGSCCDPFVCXOKK-FUHWJXTLSA-N 1 0 339.439 3.828 20 5 EHBDRO Cn1ccnc1[C@@H]([NH2+]CC1(C)CCCCC1)c1ccc([N+](=O)[O-])cc1 ZINC000552275246 1039147285 /nfs/dbraw/zinc/14/72/85/1039147285.db2.gz OXTRUDFLCFJMGN-KRWDZBQOSA-N 1 0 342.443 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H](CO)c1ccccc1)CCCC2 ZINC000417307855 1039659447 /nfs/dbraw/zinc/65/94/47/1039659447.db2.gz HNIKBWJAQFBYBC-FXAWDEMLSA-N 1 0 340.423 3.728 20 5 EHBDRO Cc1nc(CC[NH2+][C@H]2CCCCc3ccc([N+](=O)[O-])cc32)cs1 ZINC000417308844 1039664456 /nfs/dbraw/zinc/66/44/56/1039664456.db2.gz FNVGNHKOLWSVIX-KRWDZBQOSA-N 1 0 331.441 3.960 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]CCC(C)(C)O)c2ccc([N+](=O)[O-])cc2)o1 ZINC000480722846 1039929663 /nfs/dbraw/zinc/92/96/63/1039929663.db2.gz QJVFVCHFSYWYHF-KRWDZBQOSA-N 1 0 332.400 3.590 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])cc1F ZINC000573624408 1040177903 /nfs/dbraw/zinc/17/79/03/1040177903.db2.gz LUKVFDPJIXGHGB-MRXNPFEDSA-N 1 0 330.359 3.910 20 5 EHBDRO COc1cc(C[N@@H+]2CCSC3(CCCCC3)C2)ccc1[N+](=O)[O-] ZINC000490061764 1040331911 /nfs/dbraw/zinc/33/19/11/1040331911.db2.gz TYMHUZJDNNTHLP-UHFFFAOYSA-N 1 0 336.457 3.855 20 5 EHBDRO COc1cc(C[NH2+]C2CC(c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000105492475 1040440249 /nfs/dbraw/zinc/44/02/49/1040440249.db2.gz KLKNCYJEOHXBKR-UHFFFAOYSA-N 1 0 342.395 3.648 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCOCC2(CCCC2)C1 ZINC000614222942 1040745487 /nfs/dbraw/zinc/74/54/87/1040745487.db2.gz SZDJFSOKQIQYHF-UHFFFAOYSA-N 1 0 348.443 3.775 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+]C/C=C\c2ccncc2)cc(C(F)(F)F)c1 ZINC000487182177 1040771374 /nfs/dbraw/zinc/77/13/74/1040771374.db2.gz ANSBIAUKUYWCLP-UPHRSURJSA-N 1 0 337.301 3.812 20 5 EHBDRO C[NH+](C)C1(C)CCN(C(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000913398513 1040785681 /nfs/dbraw/zinc/78/56/81/1040785681.db2.gz MMVDGAVZLWGHJO-UHFFFAOYSA-N 1 0 347.462 3.944 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1CCCNc1ccc2cnccc2c1[N+](=O)[O-] ZINC001167754018 1040871979 /nfs/dbraw/zinc/87/19/79/1040871979.db2.gz SSFCPPMXTIGVCN-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO COc1cc(C[N@H+](C)CC(C)(C)C)c([N+](=O)[O-])cc1OCC(F)F ZINC000491110188 1040904711 /nfs/dbraw/zinc/90/47/11/1040904711.db2.gz BXRITLPNFPEYSO-UHFFFAOYSA-N 1 0 346.374 3.725 20 5 EHBDRO CCOc1c(Cl)cccc1C[NH2+]CCc1ccc([N+](=O)[O-])cc1 ZINC000487312270 1040918398 /nfs/dbraw/zinc/91/83/98/1040918398.db2.gz VWZFETYEUKSYTF-UHFFFAOYSA-N 1 0 334.803 3.979 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]CCc2ccc(O)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433167311 1040955704 /nfs/dbraw/zinc/95/57/04/1040955704.db2.gz MZVLTCKRYCWBMG-GOSISDBHSA-N 1 0 326.396 3.855 20 5 EHBDRO Cc1cc(C)n(CCC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)n1 ZINC000433177905 1041023346 /nfs/dbraw/zinc/02/33/46/1041023346.db2.gz RDONFOSSURQPRH-SFHVURJKSA-N 1 0 342.443 3.810 20 5 EHBDRO C[C@H](O)CCC[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000433194549 1041039302 /nfs/dbraw/zinc/03/93/02/1041039302.db2.gz NYNMIPSJEWVZBM-ZDUSSCGKSA-N 1 0 348.374 3.777 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1C[NH2+][C@H]1CCCC[C@@H]1n1cccn1 ZINC000128573561 1041153095 /nfs/dbraw/zinc/15/30/95/1041153095.db2.gz JNDSVNAWVBTNFR-GJZGRUSLSA-N 1 0 334.807 3.718 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@@H]2[NH2+]Cc1cccc(Cn2ccnc2)c1 ZINC000570986056 1041158041 /nfs/dbraw/zinc/15/80/41/1041158041.db2.gz ZHXFJEFEDQBOHG-IBGZPJMESA-N 1 0 348.406 3.617 20 5 EHBDRO CC1(C2CC2)CC[NH+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)CC1 ZINC000571211411 1041253338 /nfs/dbraw/zinc/25/33/38/1041253338.db2.gz GUXJMKVJFMDSBK-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO O=C(NCC[NH+]1CCCCCC1)c1cc2ccccc2c2cccnc12 ZINC000643159896 1041287239 /nfs/dbraw/zinc/28/72/39/1041287239.db2.gz OJOVTPNUVGAGKB-UHFFFAOYSA-N 1 0 347.462 3.994 20 5 EHBDRO CC(=O)c1ccc(N[C@H](C)C[NH+]2C[C@H](C)C[C@@H](C)C2)c([N+](=O)[O-])c1 ZINC000511710999 1041473705 /nfs/dbraw/zinc/47/37/05/1041473705.db2.gz CHYNDCFCJONRGN-MGPQQGTHSA-N 1 0 333.432 3.576 20 5 EHBDRO CN(C(=O)C[NH2+][C@H]1CCCC[C@H]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000111173952 1042237944 /nfs/dbraw/zinc/23/79/44/1042237944.db2.gz VUJLBZQUEIBBMJ-SJORKVTESA-N 1 0 347.459 3.752 20 5 EHBDRO C[N@@H+]1CCC[C@@]2(CCN(c3ccc([N+](=O)[O-])c(OC(C)(C)C)c3)C2)C1 ZINC000549572815 1042350206 /nfs/dbraw/zinc/35/02/06/1042350206.db2.gz UCSRZJBJFFXOOY-LJQANCHMSA-N 1 0 347.459 3.694 20 5 EHBDRO C[N@@H+]1CCC[C@]2(CCN(c3c(Cl)cc(Cl)cc3[N+](=O)[O-])C2)C1 ZINC000549576370 1042355642 /nfs/dbraw/zinc/35/56/42/1042355642.db2.gz MCQYETKJPYOVQI-HNNXBMFYSA-N 1 0 344.242 3.824 20 5 EHBDRO CCC[NH+]1CCC(CNc2ccnc3c2cccc3[N+](=O)[O-])CC1 ZINC000432314402 1042798313 /nfs/dbraw/zinc/79/83/13/1042798313.db2.gz NZTCIMZDGHGONV-UHFFFAOYSA-N 1 0 328.416 3.677 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+][C@@H](CC1CCCC1)c1ccccc1 ZINC000342229803 1042841202 /nfs/dbraw/zinc/84/12/02/1042841202.db2.gz VMMPQRFMQXYVJB-INIZCTEOSA-N 1 0 328.416 3.740 20 5 EHBDRO C[C@@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034609 1042953850 /nfs/dbraw/zinc/95/38/50/1042953850.db2.gz JMIDJNIIKMRSAU-HUUCEWRRSA-N 1 0 335.423 3.825 20 5 EHBDRO COc1ccccc1CC(C)(C)[NH2+]Cc1ccc(OC)c([N+](=O)[O-])c1 ZINC000106469802 1042986138 /nfs/dbraw/zinc/98/61/38/1042986138.db2.gz GQBQYCIHISQHTB-UHFFFAOYSA-N 1 0 344.411 3.723 20 5 EHBDRO COCc1ccccc1/C=C(\C)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000512050875 1043043960 /nfs/dbraw/zinc/04/39/60/1043043960.db2.gz FGBMPQNCMKFKQD-RVDMUPIBSA-N 1 0 326.396 3.934 20 5 EHBDRO CCC[C@@H]([NH2+]CCCN1CCCO[C@H](C)C1)c1cccc([N+](=O)[O-])c1 ZINC000432421089 1043157691 /nfs/dbraw/zinc/15/76/91/1043157691.db2.gz FSRYGANXJJIWEW-VQIMIIECSA-N 1 0 349.475 3.527 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C2CCN(C3CC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000279129143 1043404691 /nfs/dbraw/zinc/40/46/91/1043404691.db2.gz QWJWOJXXEZIRKJ-SFHVURJKSA-N 1 0 329.444 3.534 20 5 EHBDRO CC(C)(C)[C@H]1CC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000344213846 1043440863 /nfs/dbraw/zinc/44/08/63/1043440863.db2.gz NZXDTOSLAFSCEE-ZDUSSCGKSA-N 1 0 330.388 3.513 20 5 EHBDRO Cc1ccc(CN2CCC[C@@H](C[NH+]3CCC(C)CC3)C2)cc1[N+](=O)[O-] ZINC000512164289 1043546200 /nfs/dbraw/zinc/54/62/00/1043546200.db2.gz BYRFRQJXBVRYNS-IBGZPJMESA-N 1 0 345.487 3.847 20 5 EHBDRO C[N@H+](Cn1cc(-c2ccc([N+](=O)[O-])cc2)cn1)C1Cc2ccccc2C1 ZINC000728899382 1043707743 /nfs/dbraw/zinc/70/77/43/1043707743.db2.gz SWIRQQJZUQKMOA-UHFFFAOYSA-N 1 0 348.406 3.515 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])nc2)[NH+]2CCCC2)cc1 ZINC000344410510 1043976272 /nfs/dbraw/zinc/97/62/72/1043976272.db2.gz AYQFCYQRQPMGRD-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO CO[C@@H](CC[NH2+]C/C(C)=C\c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000344799255 1044434728 /nfs/dbraw/zinc/43/47/28/1044434728.db2.gz SNXMOYNUZFBUHQ-MSKHEQNASA-N 1 0 332.322 3.555 20 5 EHBDRO Cc1ccc([C@H]2OCCC[C@H]2[NH2+]Cc2cccc([N+](=O)[O-])c2)cc1 ZINC000072756339 1126874685 /nfs/dbraw/zinc/87/46/85/1126874685.db2.gz BQZRLDMKRMGCIG-RTBURBONSA-N 1 0 326.396 3.913 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2cccc3nsnc32)C2CC2)cc1 ZINC000764493727 1127499135 /nfs/dbraw/zinc/49/91/35/1127499135.db2.gz TZKLCYMPQNYXEO-UHFFFAOYSA-N 1 0 340.408 3.764 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000765252144 1127588894 /nfs/dbraw/zinc/58/88/94/1127588894.db2.gz RFQBMHXEUQVFIR-PBHICJAKSA-N 1 0 330.432 3.865 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[NH2+][C@H](c1ccc(Cl)cc1)[C@@H]1C[C@H]1C ZINC001168541567 1127620383 /nfs/dbraw/zinc/62/03/83/1127620383.db2.gz JWXZKDVVZARPHF-RGYTYGDFSA-N 1 0 348.834 3.740 20 5 EHBDRO Cc1ccnc(NC[C@H]2CCC[N@@H+](C)[C@H]2c2cccs2)c1[N+](=O)[O-] ZINC000301415282 1127743067 /nfs/dbraw/zinc/74/30/67/1127743067.db2.gz LUXLRCNWWDHECX-CZUORRHYSA-N 1 0 346.456 3.855 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1NC1CC[NH+](CC2CCCC2)CC1 ZINC000301446526 1127907862 /nfs/dbraw/zinc/90/78/62/1127907862.db2.gz QCMPRZSKPGWBEF-UHFFFAOYSA-N 1 0 347.459 3.808 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+]Cc2cc([N+](=O)[O-])ccc2OC)cc1 ZINC000765767494 1128072410 /nfs/dbraw/zinc/07/24/10/1128072410.db2.gz KNRUPDQYOGKDES-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO Cc1cc(NC[C@@H](c2ccc(Cl)cc2)[NH+](C)C)ncc1[N+](=O)[O-] ZINC000301470378 1128468111 /nfs/dbraw/zinc/46/81/11/1128468111.db2.gz IUNCBBYXONFTSU-HNNXBMFYSA-N 1 0 334.807 3.666 20 5 EHBDRO Cc1ccccc1[C@@H]([C@@H](C)Nc1ccc([N+](=O)[O-])c(C)n1)[NH+](C)C ZINC000553706715 1128516678 /nfs/dbraw/zinc/51/66/78/1128516678.db2.gz YVCRVVBTKWNSQI-RDTXWAMCSA-N 1 0 328.416 3.710 20 5 EHBDRO CC(C)[C@H](CO)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000554089110 1128613245 /nfs/dbraw/zinc/61/32/45/1128613245.db2.gz RNOIWMDGILABPR-HKUYNNGSSA-N 1 0 328.412 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2CCSc3c(F)cccc32)cc1 ZINC000765849490 1128570054 /nfs/dbraw/zinc/57/00/54/1128570054.db2.gz QLYHEOVJSSFVTD-HOTGVXAUSA-N 1 0 348.399 3.594 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@]1(O)CCCc2ccccc21 ZINC000765875758 1128631003 /nfs/dbraw/zinc/63/10/03/1128631003.db2.gz FXMWDMAZLDXBQW-FOIQADDNSA-N 1 0 340.423 3.778 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@]2(O)CCCc3ccccc32)cccc1[N+](=O)[O-] ZINC000765879840 1128637354 /nfs/dbraw/zinc/63/73/54/1128637354.db2.gz UJNOGAAQOBSQHQ-MGPUTAFESA-N 1 0 340.423 3.778 20 5 EHBDRO CCOc1cc(NC[C@H]2CC[N@@H+]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000715698833 1128729963 /nfs/dbraw/zinc/72/99/63/1128729963.db2.gz UXRHJYUBBJYQNO-QGZVFWFLSA-N 1 0 341.411 3.680 20 5 EHBDRO CN(C(=O)c1cc2ccccc2c2cccnc12)[C@H]1CCC[N@H+](C)C1 ZINC000172659536 1128774988 /nfs/dbraw/zinc/77/49/88/1128774988.db2.gz YBEUWLSSRCQSOP-INIZCTEOSA-N 1 0 333.435 3.554 20 5 EHBDRO Cc1nc(N[C@H]2CC[N@@H+](Cc3ccccc3)C[C@@H]2C)ccc1[N+](=O)[O-] ZINC000301647361 1128814436 /nfs/dbraw/zinc/81/44/36/1128814436.db2.gz IHUVHKJOSYHKSK-YOEHRIQHSA-N 1 0 340.427 3.621 20 5 EHBDRO CCCC[C@H](COC)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000494508911 1120583654 /nfs/dbraw/zinc/58/36/54/1120583654.db2.gz CKKGKPHEIQMHTL-CYBMUJFWSA-N 1 0 334.338 3.908 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1c2cc(F)ccc2C[C@H]1C ZINC000542497098 1120788800 /nfs/dbraw/zinc/78/88/00/1120788800.db2.gz XDWMAVAVIXEWNJ-ADLMAVQZSA-N 1 0 330.359 3.766 20 5 EHBDRO CC1(C)CC[C@H](C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)O1 ZINC000495167820 1120976181 /nfs/dbraw/zinc/97/61/81/1120976181.db2.gz NTSGOUBOIUAGIW-MRXNPFEDSA-N 1 0 330.384 3.902 20 5 EHBDRO C[C@@H]([NH2+]CCn1cc([N+](=O)[O-])cn1)c1cc(F)c(Cl)cc1Cl ZINC000090538370 1121141061 /nfs/dbraw/zinc/14/10/61/1121141061.db2.gz VOPGDTRZEQESKN-MRVPVSSYSA-N 1 0 347.177 3.588 20 5 EHBDRO CCOC(=O)N1CCC([C@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])CC1 ZINC000495492508 1121231965 /nfs/dbraw/zinc/23/19/65/1121231965.db2.gz MLROMLWVTDXBJG-UONOGXRCSA-N 1 0 349.431 3.502 20 5 EHBDRO CC(C)[C@@H](CNc1ccc([N+](=O)[O-])c2cnccc12)[NH+]1CCCC1 ZINC000301064876 1121296169 /nfs/dbraw/zinc/29/61/69/1121296169.db2.gz HAXSIUAFONYPCS-GOSISDBHSA-N 1 0 328.416 3.675 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CCCC[N@H+](Cc3ccccc3)C2)nc1 ZINC000311225880 1128989363 /nfs/dbraw/zinc/98/93/63/1128989363.db2.gz POIWVMGPFMRQMR-KRWDZBQOSA-N 1 0 340.427 3.704 20 5 EHBDRO C[C@@H]1CCC[N@H+](CCCCNc2ncc(Cl)cc2[N+](=O)[O-])C1 ZINC000301729234 1129000757 /nfs/dbraw/zinc/00/07/57/1129000757.db2.gz CHCIVCUCPJIDPD-GFCCVEGCSA-N 1 0 326.828 3.567 20 5 EHBDRO COCCCCC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113330980 1129001405 /nfs/dbraw/zinc/00/14/05/1129001405.db2.gz YEDCVSBYTKHNSO-UHFFFAOYSA-N 1 0 335.429 3.625 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCOc2cccc3cccnc32)cc1 ZINC000113343037 1129003525 /nfs/dbraw/zinc/00/35/25/1129003525.db2.gz MXYWIFWGUOXRQL-UHFFFAOYSA-N 1 0 337.379 3.702 20 5 EHBDRO CC[C@@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(C)cc1 ZINC000194014080 1121752139 /nfs/dbraw/zinc/75/21/39/1121752139.db2.gz FYTVYQZDXQHHIN-OAHLLOKOSA-N 1 0 327.384 3.583 20 5 EHBDRO CCC[C@H]([NH2+][C@H](CO)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000130425364 1121801969 /nfs/dbraw/zinc/80/19/69/1121801969.db2.gz FSPHGIZCNUXKPP-HKUYNNGSSA-N 1 0 328.412 3.629 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCCO2 ZINC000194414891 1121884363 /nfs/dbraw/zinc/88/43/63/1121884363.db2.gz ZITOHYFXVVOPPC-CQSZACIVSA-N 1 0 342.395 3.649 20 5 EHBDRO C[C@H](N[C@@H](C)[C@H]1CCC[N@@H+](C2CCC2)C1)c1ccccc1[N+](=O)[O-] ZINC000272722560 1121961772 /nfs/dbraw/zinc/96/17/72/1121961772.db2.gz XSTVDMBNNZSCNK-JYJNAYRXSA-N 1 0 331.460 3.898 20 5 EHBDRO C[C@H]1CCC[N@H+](Cc2ccc(CNc3ncccc3[N+](=O)[O-])cc2)C1 ZINC000301129846 1122022075 /nfs/dbraw/zinc/02/20/75/1122022075.db2.gz ZSUADSXMPRSQKP-HNNXBMFYSA-N 1 0 340.427 3.834 20 5 EHBDRO C[NH+](C)Cc1cc(CNc2c(F)cc([N+](=O)[O-])cc2F)ccc1F ZINC000301758648 1129036502 /nfs/dbraw/zinc/03/65/02/1129036502.db2.gz AOXCEMGNBLGBBK-UHFFFAOYSA-N 1 0 339.317 3.686 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@H]2CC[N@H+](CCc3ccccc3)C2)cc1 ZINC000301184217 1122283256 /nfs/dbraw/zinc/28/32/56/1122283256.db2.gz IYYSHDYKRGIEFF-QGZVFWFLSA-N 1 0 325.412 3.571 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@@H](c2cccc(F)c2)C1 ZINC000557022407 1123268583 /nfs/dbraw/zinc/26/85/83/1123268583.db2.gz LDFOWTBAUHFVEU-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@@H]1C[C@H](c2ccc(F)cc2)C[N@@H+]1CCOc1ccc([N+](=O)[O-])cc1 ZINC000609916579 1123691903 /nfs/dbraw/zinc/69/19/03/1123691903.db2.gz YCTABOITTRVVHU-ZBFHGGJFSA-N 1 0 344.386 3.991 20 5 EHBDRO CC[C@@H]([NH2+]C[C@H](c1ccnn1C)C(C)C)c1cccc([N+](=O)[O-])c1 ZINC000615967265 1123919509 /nfs/dbraw/zinc/91/95/09/1123919509.db2.gz YLNQGKUIPOQFEZ-DLBZAZTESA-N 1 0 330.432 3.809 20 5 EHBDRO C[C@H]([NH2+]CCOc1ccc([N+](=O)[O-])cc1)C1CCC(F)(F)CC1 ZINC000616092202 1123947861 /nfs/dbraw/zinc/94/78/61/1123947861.db2.gz SNTDKSDDLRHTCU-LBPRGKRZSA-N 1 0 328.359 3.777 20 5 EHBDRO CC(C)(C)[N@@H+]1CCCN(Cc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000734835482 1131284174 /nfs/dbraw/zinc/28/41/74/1131284174.db2.gz YJXQZOPLRROKBH-UHFFFAOYSA-N 1 0 325.840 3.554 20 5 EHBDRO Cc1cc(NCC(C)(C)C[NH+](C)C)c([N+](=O)[O-])cc1Br ZINC001168769662 1131300667 /nfs/dbraw/zinc/30/06/67/1131300667.db2.gz VWOAWZCBKOUULO-UHFFFAOYSA-N 1 0 344.253 3.665 20 5 EHBDRO COCCOc1cccc(C[NH2+][C@@H](C)c2cc([N+](=O)[O-])ccc2C)c1 ZINC000163007986 1125022287 /nfs/dbraw/zinc/02/22/87/1125022287.db2.gz DTCWBNVWFBVBQQ-HNNXBMFYSA-N 1 0 344.411 3.779 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H](Nc1cnn(-c3cc[nH+]cc3)c1)CCC2 ZINC000618574522 1125121814 /nfs/dbraw/zinc/12/18/14/1125121814.db2.gz AREWSXJIDARTBG-GOSISDBHSA-N 1 0 335.367 3.665 20 5 EHBDRO CCC[C@H]([NH2+]Cc1cccc(N(C)C)n1)c1cccc([N+](=O)[O-])c1 ZINC000090850697 1125169636 /nfs/dbraw/zinc/16/96/36/1125169636.db2.gz RGLYEQXPKDWCRG-KRWDZBQOSA-N 1 0 328.416 3.687 20 5 EHBDRO C[C@H]1CC(CC[NH2+]Cc2ccc([N+](=O)[O-])cc2Cl)C[C@H](C)O1 ZINC000619798687 1125407700 /nfs/dbraw/zinc/40/77/00/1125407700.db2.gz SROYOQCGLGXZSU-RYUDHWBXSA-N 1 0 326.824 3.932 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)ccc1OC ZINC000079724035 1129289787 /nfs/dbraw/zinc/28/97/87/1129289787.db2.gz RVOMXTMDYCXGOE-ZDUSSCGKSA-N 1 0 330.384 3.853 20 5 EHBDRO C[C@@H](C[N@@H+]1CCC[C@H](C)C1)Nc1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000301920389 1129364871 /nfs/dbraw/zinc/36/48/71/1129364871.db2.gz DUNUAIVXJGJKQZ-RYUDHWBXSA-N 1 0 343.374 3.729 20 5 EHBDRO C[C@@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)CC1CCCC1 ZINC000069227692 1129433719 /nfs/dbraw/zinc/43/37/19/1129433719.db2.gz FDZYFZNTDBLJDT-LBPRGKRZSA-N 1 0 330.388 3.828 20 5 EHBDRO O=[N+]([O-])c1ccsc1NC[C@@H]1CC[N@H+](CCc2ccccc2)C1 ZINC000301974779 1129465100 /nfs/dbraw/zinc/46/51/00/1129465100.db2.gz BBSLKGWBCGOOFQ-HNNXBMFYSA-N 1 0 331.441 3.633 20 5 EHBDRO CCC[N@H+](C)C[C@H]1CCN(c2cc(C)nc3c2cccc3[N+](=O)[O-])C1 ZINC000301994993 1129506029 /nfs/dbraw/zinc/50/60/29/1129506029.db2.gz HERAOQYGKIYAOJ-OAHLLOKOSA-N 1 0 342.443 3.620 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC000509005677 1129637295 /nfs/dbraw/zinc/63/72/95/1129637295.db2.gz FGLWPSIKMAJCPV-JTQLQIEISA-N 1 0 336.294 3.767 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](c1ccc(F)cc1)N(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000124852821 1129640247 /nfs/dbraw/zinc/64/02/47/1129640247.db2.gz IKGCIRFRFDBAEG-UGSOOPFHSA-N 1 0 331.391 3.687 20 5 EHBDRO CC[NH+](CC)[C@@H](CNCc1ccc([N+](=O)[O-])cc1F)c1ccccc1 ZINC000393178412 1129738154 /nfs/dbraw/zinc/73/81/54/1129738154.db2.gz SECTUPWONDWFOS-IBGZPJMESA-N 1 0 345.418 3.907 20 5 EHBDRO CCC[N@H+](CC(=O)Nc1cc([N+](=O)[O-])ccc1C)Cc1ccccc1 ZINC000021918647 1129739692 /nfs/dbraw/zinc/73/96/92/1129739692.db2.gz ZABGGMOWQWSRLP-UHFFFAOYSA-N 1 0 341.411 3.754 20 5 EHBDRO COc1cccc([C@@H](CNc2sccc2[N+](=O)[O-])[NH+]2CCCC2)c1 ZINC000302010476 1129763365 /nfs/dbraw/zinc/76/33/65/1129763365.db2.gz YGDODTQJMJYACK-MRXNPFEDSA-N 1 0 347.440 3.914 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@H]1CCCN(c2cccc(F)c2[N+](=O)[O-])C1 ZINC000302034610 1129764789 /nfs/dbraw/zinc/76/47/89/1129764789.db2.gz JMIDJNIIKMRSAU-LSDHHAIUSA-N 1 0 335.423 3.825 20 5 EHBDRO Cc1cc(N[C@@H](C)C[C@@H](O)c2ccco2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302088406 1129767081 /nfs/dbraw/zinc/76/70/81/1129767081.db2.gz OJOHFICLBUSSNZ-YVEFUNNKSA-N 1 0 341.367 3.969 20 5 EHBDRO CCOc1cccc(NC2CC[NH+](C3CCCC3)CC2)c1[N+](=O)[O-] ZINC000302143084 1129770263 /nfs/dbraw/zinc/77/02/63/1129770263.db2.gz HYKKGEYNIXZJCD-UHFFFAOYSA-N 1 0 333.432 3.812 20 5 EHBDRO CC[C@@H]([NH2+]C[C@@H](O)[C@@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC001168741707 1129836321 /nfs/dbraw/zinc/83/63/21/1129836321.db2.gz PEUVPRFNMWUCGM-GDIGMMSISA-N 1 0 328.412 3.800 20 5 EHBDRO C[C@@H](C[N@H+]1C[C@H](C)C[C@H](C)C1)Nc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303475461 1129847981 /nfs/dbraw/zinc/84/79/81/1129847981.db2.gz RQXQHRXJYXVBLE-ZNMIVQPWSA-N 1 0 342.443 3.921 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000303655729 1129861561 /nfs/dbraw/zinc/86/15/61/1129861561.db2.gz UZPSIHLCSQCQIK-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO Cc1cccc(NCC[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)n1 ZINC000347822347 1129880552 /nfs/dbraw/zinc/88/05/52/1129880552.db2.gz XHQKSZHNDLOYOT-UHFFFAOYSA-N 1 0 328.416 3.623 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc3nc(C)sc3c2)cc1[N+](=O)[O-] ZINC000494027410 1129905431 /nfs/dbraw/zinc/90/54/31/1129905431.db2.gz MLXPXMLHWLEYEA-UHFFFAOYSA-N 1 0 343.408 3.811 20 5 EHBDRO CC[NH+](CC)Cc1cccc(NC(=O)c2cc(C)ccc2[N+](=O)[O-])c1 ZINC000172768856 1130160132 /nfs/dbraw/zinc/16/01/32/1130160132.db2.gz CLTSHBAPTNTNID-UHFFFAOYSA-N 1 0 341.411 3.997 20 5 EHBDRO C[C@@H]([NH2+]CCc1nc2c(s1)CCCC2)c1cccc([N+](=O)[O-])c1 ZINC000173413017 1130228263 /nfs/dbraw/zinc/22/82/63/1130228263.db2.gz FWDRKQNQSAEHKG-GFCCVEGCSA-N 1 0 331.441 3.823 20 5 EHBDRO CCCC(=O)NC[C@@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000245538850 1130232925 /nfs/dbraw/zinc/23/29/25/1130232925.db2.gz ZFPVKUUNPBDOFW-CVEARBPZSA-N 1 0 347.459 3.593 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1CC[C@@H](C[NH+]2CCCCC2)C1 ZINC000245535393 1130233399 /nfs/dbraw/zinc/23/33/99/1130233399.db2.gz WOMHUDFMWBGYAS-SJORKVTESA-N 1 0 331.460 3.772 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCO[C@@]3(CCSC3)C2)cc1[N+](=O)[O-] ZINC000246581402 1130392540 /nfs/dbraw/zinc/39/25/40/1130392540.db2.gz YQRFHTLOLITXKL-LXZKKBNFSA-N 1 0 336.457 3.609 20 5 EHBDRO CCC[NH+]1CCC(CNc2nc3ccc([N+](=O)[O-])cc3s2)CC1 ZINC000731209938 1130779253 /nfs/dbraw/zinc/77/92/53/1130779253.db2.gz FNCOLLSMJIHDKG-UHFFFAOYSA-N 1 0 334.445 3.738 20 5 EHBDRO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@@H]2CCO[C@@H]2C1(C)C ZINC000740881780 1131552997 /nfs/dbraw/zinc/55/29/97/1131552997.db2.gz CWSQXBYFLXWXKI-UAGQMJEPSA-N 1 0 336.407 3.759 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cn2cc(-c3ccc([N+](=O)[O-])cc3)cn2)C1 ZINC000742154509 1131694130 /nfs/dbraw/zinc/69/41/30/1131694130.db2.gz KMEYHTLHRXOUIZ-HUUCEWRRSA-N 1 0 328.416 3.926 20 5 EHBDRO C[C@@H]1CCCN1CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000742388434 1131714201 /nfs/dbraw/zinc/71/42/01/1131714201.db2.gz UKDZRVPIUXZDCQ-CQSZACIVSA-N 1 0 345.468 3.897 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc([N+](=O)[O-])c1)[C@H](O)c1c(F)cccc1F ZINC000742715066 1131784360 /nfs/dbraw/zinc/78/43/60/1131784360.db2.gz RAYZFNPIKSSNKM-DOMZBBRYSA-N 1 0 342.367 3.536 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)nc1 ZINC001172902537 1131885535 /nfs/dbraw/zinc/88/55/35/1131885535.db2.gz ZMBUAWKCVYDDKW-YOEHRIQHSA-N 1 0 325.412 3.896 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@H]1CCCc3cnccc31)CC2 ZINC001172905359 1131885833 /nfs/dbraw/zinc/88/58/33/1131885833.db2.gz JEZNNWKHHHKGRD-XLIONFOSSA-N 1 0 337.423 3.904 20 5 EHBDRO COc1ccc(C[N@H+](C)[C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)cc1 ZINC001172905388 1131886681 /nfs/dbraw/zinc/88/66/81/1131886681.db2.gz RRBGIVNERGXJDI-GOSISDBHSA-N 1 0 340.423 3.983 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@H+]1CCc3cc(O)ccc3C1)CC2 ZINC001172906200 1131888317 /nfs/dbraw/zinc/88/83/17/1131888317.db2.gz WOFJQQVFJAJCLT-SFHVURJKSA-N 1 0 338.407 3.606 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]CCc1cccc(F)c1)CC2 ZINC001172896081 1131901521 /nfs/dbraw/zinc/90/15/21/1131901521.db2.gz LHXJTRCDSHPWDR-SFHVURJKSA-N 1 0 328.387 3.814 20 5 EHBDRO Cc1ccnc(CCC[NH2+][C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172912390 1131917835 /nfs/dbraw/zinc/91/78/35/1131917835.db2.gz NVSAIPFXUXJUDJ-SFHVURJKSA-N 1 0 339.439 3.768 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@H](c1ccccn1)C1CC1)CC2 ZINC001172910743 1131918294 /nfs/dbraw/zinc/91/82/94/1131918294.db2.gz CKKWPMPTBFYHKN-PXNSSMCTSA-N 1 0 337.423 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+]CC1(c3ccccn3)CC1)CC2 ZINC001172913543 1131919217 /nfs/dbraw/zinc/91/92/17/1131919217.db2.gz WXLNEQPQXKWBGC-QGZVFWFLSA-N 1 0 337.423 3.559 20 5 EHBDRO Cc1cnc2c(c1)C[N@H+]([C@@H]1CCc3ccc([N+](=O)[O-])cc3CC1)CC2 ZINC001172913217 1131919315 /nfs/dbraw/zinc/91/93/15/1131919315.db2.gz QHTJSGKIEDICEF-GOSISDBHSA-N 1 0 337.423 3.604 20 5 EHBDRO CC(C)C[C@H](C)[NH2+]C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173008491 1131935887 /nfs/dbraw/zinc/93/58/87/1131935887.db2.gz ACVVPJIGEBOTNY-LBPRGKRZSA-N 1 0 341.402 3.866 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1c(F)c(OC)ccc1[N+](=O)[O-])c1ccncc1 ZINC001173190026 1131994920 /nfs/dbraw/zinc/99/49/20/1131994920.db2.gz UCNQCELXDBVGHT-WFASDCNBSA-N 1 0 347.390 3.809 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H]2C[C@@H]2c2ccccc2)c1F ZINC001173190572 1131995544 /nfs/dbraw/zinc/99/55/44/1131995544.db2.gz YTZPEULTTIGPDG-XPKDYRNWSA-N 1 0 344.386 3.819 20 5 EHBDRO COc1c(F)ccc(C[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1F ZINC001173217099 1132002036 /nfs/dbraw/zinc/00/20/36/1132002036.db2.gz LMVWJHNWMXQMPP-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO COc1ccccc1CC1([NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173223686 1132005429 /nfs/dbraw/zinc/00/54/29/1132005429.db2.gz KWEWFEKHNVAZRM-HNNXBMFYSA-N 1 0 340.423 3.899 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCC[C@H](c2ccccn2)C1 ZINC001173225014 1132005961 /nfs/dbraw/zinc/00/59/61/1132005961.db2.gz ARUOZBIDDPDJDI-WBVHZDCISA-N 1 0 325.412 3.800 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)N1CC[NH+](CC2CCCCC2)CC1 ZINC001173229845 1132008157 /nfs/dbraw/zinc/00/81/57/1132008157.db2.gz VUKHOGGZKCZLOX-QGZVFWFLSA-N 1 0 345.487 3.724 20 5 EHBDRO COc1cc([C@@H]([NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)C2CC2)ccn1 ZINC001173227433 1132008487 /nfs/dbraw/zinc/00/84/87/1132008487.db2.gz FPWLZHAKFSBJNM-YJYMSZOUSA-N 1 0 341.411 3.670 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](CO)c1cccc(Cl)c1 ZINC001173231070 1132008983 /nfs/dbraw/zinc/00/89/83/1132008983.db2.gz XATLJGSCKBHFPF-CJNGLKHVSA-N 1 0 348.830 3.545 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](CO)c1cccc(Cl)c1 ZINC001173235885 1132010389 /nfs/dbraw/zinc/01/03/89/1132010389.db2.gz VPVOLCZOKGKZGN-YVEFUNNKSA-N 1 0 334.803 3.502 20 5 EHBDRO Nc1ccc2cc3ccc(Nc4ccc5ncnn5c4)cc3[nH+]c2c1 ZINC001174375435 1132340338 /nfs/dbraw/zinc/34/03/38/1132340338.db2.gz ZABHBYGMFGJLGQ-UHFFFAOYSA-N 1 0 326.363 3.757 20 5 EHBDRO CC1(C)C[C@@]1([NH2+]CCOc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC001174907464 1132500702 /nfs/dbraw/zinc/50/07/02/1132500702.db2.gz NRWOADMOADFLSP-LJQANCHMSA-N 1 0 326.396 3.889 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccccc1C[NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1 ZINC001168968520 1132622644 /nfs/dbraw/zinc/62/26/44/1132622644.db2.gz ZUPTZOUXHROYSM-HIFRSBDPSA-N 1 0 349.431 3.569 20 5 EHBDRO [NH2+]=C(N[C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cc(C(F)(F)F)ccc1Cl ZINC001168997907 1132627743 /nfs/dbraw/zinc/62/77/43/1132627743.db2.gz GJIPVCRLXAKHFC-WCBMZHEXSA-N 1 0 349.740 3.719 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH+]2CCC(Oc3cccc(Cl)c3)CC2)C1 ZINC001169023866 1132640825 /nfs/dbraw/zinc/64/08/25/1132640825.db2.gz FYEXZXNOQFOOQL-HIFRSBDPSA-N 1 0 338.835 3.629 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H](n2cc(C3CC[NH2+]CC3)c3ccc(F)cc32)C1 ZINC001169049673 1132642662 /nfs/dbraw/zinc/64/26/62/1132642662.db2.gz XSMDBWXZLLUZOM-XJKSGUPXSA-N 1 0 345.418 3.865 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H](N2Cc3nc(-c4ccccc4)sc3C2)C1 ZINC001169052022 1132642779 /nfs/dbraw/zinc/64/27/79/1132642779.db2.gz FOHUXDDFXMMXCI-TZMCWYRMSA-N 1 0 329.425 3.571 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)C[C@H]1CC[C@@H](c2ccccc2)O1 ZINC001169667942 1132814675 /nfs/dbraw/zinc/81/46/75/1132814675.db2.gz YFFZMRHXIDAXRE-UXHICEINSA-N 1 0 340.423 3.989 20 5 EHBDRO Cc1ccc2c(c1)[C@H]([NH3+])CCCN2c1ccc2nc[nH]c2c1[N+](=O)[O-] ZINC001169689673 1132821939 /nfs/dbraw/zinc/82/19/39/1132821939.db2.gz HSQCUOZDOQYLMF-CYBMUJFWSA-N 1 0 337.383 3.711 20 5 EHBDRO COc1ccc(Nc2ccc(OCCC[NH+](C)C)cc2)cc1[N+](=O)[O-] ZINC001176363751 1132922853 /nfs/dbraw/zinc/92/28/53/1132922853.db2.gz QHJKHQMAWLEBFY-UHFFFAOYSA-N 1 0 345.399 3.678 20 5 EHBDRO COc1ccc(Nc2ccc(CC[NH+]3CCCC3)cc2)cc1[N+](=O)[O-] ZINC001176363974 1132922944 /nfs/dbraw/zinc/92/29/44/1132922944.db2.gz UPEZNICQPJWKQW-UHFFFAOYSA-N 1 0 341.411 3.985 20 5 EHBDRO C[NH+](C)CCn1cc(Nc2ccc3nc4ccccc4cc3c2)cn1 ZINC001176449904 1132936925 /nfs/dbraw/zinc/93/69/25/1132936925.db2.gz WLIOFPQUWTYRHJ-UHFFFAOYSA-N 1 0 331.423 3.890 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+][C@@H](CCO)C1CCCC1 ZINC001176505147 1132952674 /nfs/dbraw/zinc/95/26/74/1132952674.db2.gz LIMNPDORHYZZGK-AWEZNQCLSA-N 1 0 347.242 3.932 20 5 EHBDRO O=C(CC[NH2+]C1(C2CCCCC2)CC1)Nc1ccc([N+](=O)[O-])cc1 ZINC001176841959 1133003958 /nfs/dbraw/zinc/00/39/58/1133003958.db2.gz LSSCVPPOSIJGQO-UHFFFAOYSA-N 1 0 331.416 3.626 20 5 EHBDRO CCC[C@H](C)[C@@H]1CCC[N@@H+]1Cn1cc([N+](=O)[O-])c(-c2ccncc2)n1 ZINC000767765171 1133050177 /nfs/dbraw/zinc/05/01/77/1133050177.db2.gz KHOHLPBIUORPEB-HOCLYGCPSA-N 1 0 343.431 3.711 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H](C)N2CCCCC2)cc1[N+](=O)[O-] ZINC000768093613 1133091430 /nfs/dbraw/zinc/09/14/30/1133091430.db2.gz PABCGYAWAFGTPT-CABCVRRESA-N 1 0 335.448 3.519 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCN1CCC[C@H]1C ZINC000768103669 1133094995 /nfs/dbraw/zinc/09/49/95/1133094995.db2.gz VEIGEJQBHMNAKX-CABCVRRESA-N 1 0 337.489 3.539 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+](Cc2cccc3nsnc32)C2CC2)c1 ZINC000768543709 1133158394 /nfs/dbraw/zinc/15/83/94/1133158394.db2.gz DUBHKDJQYHQCII-UHFFFAOYSA-N 1 0 340.408 3.764 20 5 EHBDRO COc1ccc(C[NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])c(F)c1 ZINC001178326844 1133160045 /nfs/dbraw/zinc/16/00/45/1133160045.db2.gz RGIKCHHJIOFYKH-UHFFFAOYSA-N 1 0 338.766 3.728 20 5 EHBDRO CC[N@H+](CCCNCc1ccc(OC)c([N+](=O)[O-])c1)C1CCCCC1 ZINC001179090447 1133227109 /nfs/dbraw/zinc/22/71/09/1133227109.db2.gz CZMZQTYERJGXLS-UHFFFAOYSA-N 1 0 349.475 3.738 20 5 EHBDRO Cc1scc(C[NH+]2CCN(c3ccc([N+](=O)[O-])cc3)CC2)c1C ZINC001180445786 1133371235 /nfs/dbraw/zinc/37/12/35/1133371235.db2.gz NQZLPWVHJPKFNR-UHFFFAOYSA-N 1 0 331.441 3.595 20 5 EHBDRO O=C(OCc1csc([N+](=O)[O-])c1)c1cccc(C[NH+]2CCCC2)c1 ZINC000785715782 1133746542 /nfs/dbraw/zinc/74/65/42/1133746542.db2.gz SPSBLIKBZYHYET-UHFFFAOYSA-N 1 0 346.408 3.609 20 5 EHBDRO Cc1ccc([C@@H]2C[C@@H](C)[N@@H+](C[C@@H](O)c3ccc([N+](=O)[O-])cc3)C2)cc1 ZINC000786126796 1133810837 /nfs/dbraw/zinc/81/08/37/1133810837.db2.gz UHWRNXWMLPYYCO-XFQXTVEOSA-N 1 0 340.423 3.815 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccc(F)cc1 ZINC001184135579 1133897914 /nfs/dbraw/zinc/89/79/14/1133897914.db2.gz SSEBXEPEEICEQQ-CHWSQXEVSA-N 1 0 345.374 3.802 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccccc1Cl ZINC000786810832 1133909127 /nfs/dbraw/zinc/90/91/27/1133909127.db2.gz BFNJSSBJNYOEKH-YVJSUPCUSA-N 1 0 346.814 3.975 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](O)c1ccccc1C ZINC000786816711 1133911202 /nfs/dbraw/zinc/91/12/02/1133911202.db2.gz WBKYSJQJQBPDIT-LMICACPXSA-N 1 0 326.396 3.630 20 5 EHBDRO CC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774908571 1134116187 /nfs/dbraw/zinc/11/61/87/1134116187.db2.gz MEMMKLBYYVSNCK-INIZCTEOSA-N 1 0 343.383 3.956 20 5 EHBDRO COc1ccccc1C[C@H]1CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(F)c1 ZINC000788476062 1134129737 /nfs/dbraw/zinc/12/97/37/1134129737.db2.gz MULKWSVVIPFKMT-MRXNPFEDSA-N 1 0 344.386 3.950 20 5 EHBDRO CO[C@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000788609365 1134145677 /nfs/dbraw/zinc/14/56/77/1134145677.db2.gz HRSGIICIROAYLN-PIGZYNQJSA-N 1 0 349.818 3.869 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]C[C@@H]2COC3(CCCC3)O2)c2cc([N+](=O)[O-])ccc21 ZINC000788590079 1134148115 /nfs/dbraw/zinc/14/81/15/1134148115.db2.gz RYGOUWHXOOPSEX-RHSMWYFYSA-N 1 0 346.427 3.593 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCO[C@@H](c2ccccc2)C1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788749549 1134164673 /nfs/dbraw/zinc/16/46/73/1134164673.db2.gz GUCJDFJFEZNJCR-IYJAJMOOSA-N 1 0 341.411 3.748 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455106 1134276959 /nfs/dbraw/zinc/27/69/59/1134276959.db2.gz IGJUKDHAXRUGEA-INIZCTEOSA-N 1 0 348.830 3.938 20 5 EHBDRO CC(C)C[C@@]1(CO)CCC[N@@H+]1Cc1cc([N+](=O)[O-])ccc1Cl ZINC000789513474 1134289429 /nfs/dbraw/zinc/28/94/29/1134289429.db2.gz JZJGWRUGQURPFT-MRXNPFEDSA-N 1 0 326.824 3.621 20 5 EHBDRO CC(C)C[C@]1(CO)CCC[N@@H+]1Cc1ccc([N+](=O)[O-])c(Cl)c1 ZINC000789593102 1134302930 /nfs/dbraw/zinc/30/29/30/1134302930.db2.gz LYNGSLVEDKMEBX-INIZCTEOSA-N 1 0 326.824 3.621 20 5 EHBDRO CC[NH+](CC)CC[C@H](C)Nc1c(Br)cccc1[N+](=O)[O-] ZINC001187921605 1134400753 /nfs/dbraw/zinc/40/07/53/1134400753.db2.gz XNRYHQPMMLRCKP-NSHDSACASA-N 1 0 344.253 3.890 20 5 EHBDRO CCC1CCC([N@H+](CC(=O)Nc2ccccc2[N+](=O)[O-])C2CC2)CC1 ZINC001190399998 1134691762 /nfs/dbraw/zinc/69/17/62/1134691762.db2.gz TVNOEYTZTMXLMI-UHFFFAOYSA-N 1 0 345.443 3.967 20 5 EHBDRO CCC[N@H+](CCn1c(C)ncc1[N+](=O)[O-])[C@H](CC)c1ccccc1 ZINC001190581955 1134722791 /nfs/dbraw/zinc/72/27/91/1134722791.db2.gz KYXLKZUADUPMJV-QGZVFWFLSA-N 1 0 330.432 3.963 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]Cc2cc(F)cc(F)c2)c([N+](=O)[O-])c1 ZINC001170294795 1134736623 /nfs/dbraw/zinc/73/66/23/1134736623.db2.gz CRWVJGMJZHAATQ-LLVKDONJSA-N 1 0 336.338 3.602 20 5 EHBDRO CCc1ccc(CC[NH2+][C@H](C)Cc2ccc(OC)cc2[N+](=O)[O-])cc1 ZINC001170297015 1134737703 /nfs/dbraw/zinc/73/77/03/1134737703.db2.gz JZVRVXNEEGQCTJ-OAHLLOKOSA-N 1 0 342.439 3.929 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCc2ccccc2C)c([N+](=O)[O-])c1 ZINC001170298171 1134738058 /nfs/dbraw/zinc/73/80/58/1134738058.db2.gz HMWGTEPJRYHWCX-HNNXBMFYSA-N 1 0 328.412 3.675 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]CCOc2cccc(C)c2)c([N+](=O)[O-])c1 ZINC001170305853 1134739710 /nfs/dbraw/zinc/73/97/10/1134739710.db2.gz QWSRZZRFGZXIQD-HNNXBMFYSA-N 1 0 344.411 3.511 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccn1 ZINC001170304718 1134739723 /nfs/dbraw/zinc/73/97/23/1134739723.db2.gz GGSBPTCSSSKXPM-BBRMVZONSA-N 1 0 329.400 3.670 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C(C)(C)Cc2ccncc2)c([N+](=O)[O-])c1 ZINC001170323380 1134747663 /nfs/dbraw/zinc/74/76/63/1134747663.db2.gz JGUXLSZLNNIGAK-AWEZNQCLSA-N 1 0 343.427 3.540 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H]2CCc3sccc32)c([N+](=O)[O-])c1 ZINC001170326362 1134748636 /nfs/dbraw/zinc/74/86/36/1134748636.db2.gz HXRZVCBMIGBULY-XHDPSFHLSA-N 1 0 332.425 3.873 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCCc3cccnc32)c([N+](=O)[O-])c1 ZINC001170306558 1134752582 /nfs/dbraw/zinc/75/25/82/1134752582.db2.gz XLUXCPQRLRANMU-GUYCJALGSA-N 1 0 341.411 3.597 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+](C)Cc2ccccc2OC)c([N+](=O)[O-])c1 ZINC001170341444 1134758385 /nfs/dbraw/zinc/75/83/85/1134758385.db2.gz IXJKRIIOJRTVGU-CQSZACIVSA-N 1 0 344.411 3.675 20 5 EHBDRO C[C@H]1CCC[C@H](C)[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069302 1134786246 /nfs/dbraw/zinc/78/62/46/1134786246.db2.gz GLVOZPMMMNVWSN-RYUDHWBXSA-N 1 0 339.823 3.697 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2[C@H](C)C[C@@H]3CCCC[C@H]32)c1 ZINC001191075710 1134788802 /nfs/dbraw/zinc/78/88/02/1134788802.db2.gz CLXJFNCSLIKQJW-DVOMOZLQSA-N 1 0 332.400 3.534 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@@H+](C)[C@H]1CCC[C@H]1c1ccc(C)cc1 ZINC001191214068 1134818456 /nfs/dbraw/zinc/81/84/56/1134818456.db2.gz MAZLJVQMBFBLOU-ROUUACIJSA-N 1 0 342.443 3.676 20 5 EHBDRO CC(C)C[C@H]1CCC[N@H+](CCC(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001192200420 1134979228 /nfs/dbraw/zinc/97/92/28/1134979228.db2.gz RKNIRCUMWPCLJL-OAHLLOKOSA-N 1 0 333.432 3.682 20 5 EHBDRO CC[C@H]1Cc2ccccc2C[N@@H+]1CCOc1ccccc1[N+](=O)[O-] ZINC001193119684 1135104182 /nfs/dbraw/zinc/10/41/82/1135104182.db2.gz YZXXWWCYLAWKQK-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO C[C@@]1(CNc2ccc(N)cc2[N+](=O)[O-])CCC[N@@H+]1Cc1ccccc1 ZINC000804624235 1135145071 /nfs/dbraw/zinc/14/50/71/1135145071.db2.gz KKFYTIQWDCEFMQ-IBGZPJMESA-N 1 0 340.427 3.644 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1CN(C)C(C)(C)C[NH+]1CCCCCC1 ZINC001193616519 1135159497 /nfs/dbraw/zinc/15/94/97/1135159497.db2.gz NVMFVKDUEMRNPU-UHFFFAOYSA-N 1 0 349.475 3.690 20 5 EHBDRO C[C@@H]1CC[C@H](C(=O)OC(C)(C)C)C[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC001195287115 1135407181 /nfs/dbraw/zinc/40/71/81/1135407181.db2.gz APXAMQVWRIXMFT-ZBFHGGJFSA-N 1 0 348.443 3.580 20 5 EHBDRO CC1(C)CCC[C@@H]1[C@H]1CC[N@H+](C[C@H](O)c2cccc([N+](=O)[O-])c2)C1 ZINC001195424184 1135428029 /nfs/dbraw/zinc/42/80/29/1135428029.db2.gz HXMKKWKEOXIZGJ-JQHSSLGASA-N 1 0 332.444 3.776 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CCC[C@H](C3CCC3)C2)cccc1[N+](=O)[O-] ZINC001196254033 1135536426 /nfs/dbraw/zinc/53/64/26/1135536426.db2.gz JBBYXFMZQSIDIE-INIZCTEOSA-N 1 0 345.443 3.744 20 5 EHBDRO CC[C@H](CO)[N@H+](Cc1ccccc1)Cc1cccc([N+](=O)[O-])c1C ZINC001197114126 1135651525 /nfs/dbraw/zinc/65/15/25/1135651525.db2.gz FBRUKQFIZXNOIQ-GOSISDBHSA-N 1 0 328.412 3.676 20 5 EHBDRO CCOC(=O)[C@@H](C)[C@H](C)[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000809976455 1135908105 /nfs/dbraw/zinc/90/81/05/1135908105.db2.gz DTGYSXYXYBWTOF-IUCAKERBSA-N 1 0 349.214 3.579 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](CO)Cc2ccccc2)cc1[N+](=O)[O-] ZINC001199720885 1135922829 /nfs/dbraw/zinc/92/28/29/1135922829.db2.gz BGHAOIDPBSSXBU-SFHVURJKSA-N 1 0 342.439 3.659 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+]C[C@]2(CO)C[C@@H]2c2ccccc2)c1 ZINC000810165503 1135929624 /nfs/dbraw/zinc/92/96/24/1135929624.db2.gz URSKPJDDCSLDJD-AEFFLSMTSA-N 1 0 346.814 3.504 20 5 EHBDRO COc1ccc([C@@H](OC)[C@H](C)[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC001201704134 1136054372 /nfs/dbraw/zinc/05/43/72/1136054372.db2.gz MEJGGIOMYRQDKY-LIRRHRJNSA-N 1 0 344.411 3.778 20 5 EHBDRO CC[NH+](CC)[C@H](C)CNCc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811473263 1136095737 /nfs/dbraw/zinc/09/57/37/1136095737.db2.gz UAJCFBGKTQYUBU-SNVBAGLBSA-N 1 0 334.247 3.722 20 5 EHBDRO CN1CC[C@@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2Cl)[C@@H]1c1ccccc1 ZINC000776254063 1136103941 /nfs/dbraw/zinc/10/39/41/1136103941.db2.gz QYEVCQLEMUGIGX-MSOLQXFVSA-N 1 0 345.830 3.783 20 5 EHBDRO C[C@@H](C1CC1)[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776271954 1136124483 /nfs/dbraw/zinc/12/44/83/1136124483.db2.gz PIGGULWUPYBOBQ-MGPUTAFESA-N 1 0 340.423 3.929 20 5 EHBDRO Cc1nn(C[N@@H+]2CCC[C@H](Cc3ccc(C)cc3)C2)c(C)c1[N+](=O)[O-] ZINC000747797738 1136230134 /nfs/dbraw/zinc/23/01/34/1136230134.db2.gz JFSFKEUDMQKTFZ-GOSISDBHSA-N 1 0 342.443 3.629 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[NH2+][C@@H]2[C@@H]3Cc4cc(F)ccc4[C@@H]32)c1 ZINC000850409481 1136252226 /nfs/dbraw/zinc/25/22/26/1136252226.db2.gz VSTOMTRHXYCQSA-HYVNUMGLSA-N 1 0 332.762 3.815 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)NC1CC[NH+](C(C)(C)C)CC1 ZINC000850444160 1136260008 /nfs/dbraw/zinc/26/00/08/1136260008.db2.gz XAEBBXZUPWPFMR-ZDUSSCGKSA-N 1 0 335.448 3.517 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]Cc1ccc(C(C)(C)O)cc1 ZINC000850460804 1136263555 /nfs/dbraw/zinc/26/35/55/1136263555.db2.gz CIDUGCWZCRTNHJ-ZDUSSCGKSA-N 1 0 344.411 3.682 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@@]1(C)CC1(Cl)Cl ZINC000850472521 1136265664 /nfs/dbraw/zinc/26/56/64/1136265664.db2.gz JCLSFXVHPCWKSN-TVQRCGJNSA-N 1 0 333.215 3.838 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]CC1SCCS1 ZINC000850562322 1136286468 /nfs/dbraw/zinc/28/64/68/1136286468.db2.gz ZUMBMAVGWRKNOM-JSGCOSHPSA-N 1 0 338.498 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H]2c2ccc(F)c(F)c2)cc1 ZINC000776583160 1136441661 /nfs/dbraw/zinc/44/16/61/1136441661.db2.gz YPNOSGWVYQUSKZ-MSOLQXFVSA-N 1 0 348.349 3.744 20 5 EHBDRO Cc1ccc(C[C@@H]2CCC[N@@H+]2C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000776583857 1136442441 /nfs/dbraw/zinc/44/24/41/1136442441.db2.gz GMKLKTWJRPXIIA-VQTJNVASSA-N 1 0 340.423 3.644 20 5 EHBDRO CC[C@H](C)[N@@H+](Cc1ccccc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776579238 1136444002 /nfs/dbraw/zinc/44/40/02/1136444002.db2.gz KAYKLDLKDFZHPI-HNAYVOBHSA-N 1 0 328.412 3.929 20 5 EHBDRO CC(C)[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1F ZINC000852446115 1136456578 /nfs/dbraw/zinc/45/65/78/1136456578.db2.gz DJTQCZWZZCYTOG-QZTJIDSGSA-N 1 0 332.375 3.754 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[N@@H+](Cc2ccccc2F)CC2CC2)cc1 ZINC000852564661 1136467016 /nfs/dbraw/zinc/46/70/16/1136467016.db2.gz QKYAILTVSXPKSQ-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO CC(C)CC1([NH2+][C@@H](C)C(=O)Nc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000852683082 1136477213 /nfs/dbraw/zinc/47/72/13/1136477213.db2.gz RQAIUGXCLIBGTR-NSHDSACASA-N 1 0 339.823 3.744 20 5 EHBDRO C[C@H](CNc1nc2ccc([N+](=O)[O-])cc2s1)C[NH+]1CCCCC1 ZINC000111190155 1136520120 /nfs/dbraw/zinc/52/01/20/1136520120.db2.gz LTRHHSCGVRGNQG-GFCCVEGCSA-N 1 0 334.445 3.738 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc2c(c1)CCCO2 ZINC000853240420 1136521586 /nfs/dbraw/zinc/52/15/86/1136521586.db2.gz GZWASNNHGHUPCA-OLZOCXBDSA-N 1 0 341.411 3.914 20 5 EHBDRO C[C@H](OC(=O)[C@@H]1CCCC[N@@H+]1C1CCCC1)c1ccccc1[N+](=O)[O-] ZINC000815445442 1136596493 /nfs/dbraw/zinc/59/64/93/1136596493.db2.gz YSCJKCLJXBIIKR-KSSFIOAISA-N 1 0 346.427 3.996 20 5 EHBDRO C[C@H]([NH2+]C[C@H](O)c1ccc([N+](=O)[O-])cc1)c1cccc(C2CC2)c1 ZINC000815577025 1136613065 /nfs/dbraw/zinc/61/30/65/1136613065.db2.gz DZWBMATZAJEZNQ-DJJJIMSYSA-N 1 0 326.396 3.856 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](C)c1ccc(F)cc1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815584963 1136614575 /nfs/dbraw/zinc/61/45/75/1136614575.db2.gz UANRRLXVYMJSSA-GHMZBOCLSA-N 1 0 335.354 3.910 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1SCCc2ccccc21)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815587119 1136615178 /nfs/dbraw/zinc/61/51/78/1136615178.db2.gz ZYELPBYLRSSUGW-XIKOKIGWSA-N 1 0 343.452 3.858 20 5 EHBDRO CC1(C)CCC[C@H]1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000815657592 1136622757 /nfs/dbraw/zinc/62/27/57/1136622757.db2.gz CLJUFMSCHLPRME-HNNXBMFYSA-N 1 0 331.460 3.980 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc(-c2cnn(C)c2)s1)c1cccc([N+](=O)[O-])c1 ZINC000509476909 1136625543 /nfs/dbraw/zinc/62/55/43/1136625543.db2.gz QKSSWMJEPNPKMX-GFCCVEGCSA-N 1 0 342.424 3.908 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000776753784 1136643286 /nfs/dbraw/zinc/64/32/86/1136643286.db2.gz GYDDVGSMQSCXRL-ILXRZTDVSA-N 1 0 349.431 3.502 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC(Nc3cc4c(c[nH+]3)CCC4)CC2)cc1 ZINC000816660475 1136746085 /nfs/dbraw/zinc/74/60/85/1136746085.db2.gz FWUKRGHAFNJSMN-UHFFFAOYSA-N 1 0 338.411 3.559 20 5 EHBDRO CCN(CC)c1ccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cn1 ZINC000173335420 1136775867 /nfs/dbraw/zinc/77/58/67/1136775867.db2.gz KANVTYPZJXJFLC-AWEZNQCLSA-N 1 0 328.416 3.687 20 5 EHBDRO C[C@@H]1CCc2c(F)cccc2[C@H]1[NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819138079 1136912372 /nfs/dbraw/zinc/91/23/72/1136912372.db2.gz LWIQJDGCGBENPN-DPMMWBKBSA-N 1 0 344.386 3.681 20 5 EHBDRO CCc1ccc(C[NH+]2CCC(Oc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC000339013182 1136989020 /nfs/dbraw/zinc/98/90/20/1136989020.db2.gz MBCHNIWHZGOOMT-UHFFFAOYSA-N 1 0 341.411 3.596 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])c(Cl)c1)C[C@](C)(O)c1ccccc1 ZINC000822516309 1137064228 /nfs/dbraw/zinc/06/42/28/1137064228.db2.gz KGRXZPJUEDXXFO-KRWDZBQOSA-N 1 0 334.803 3.588 20 5 EHBDRO Cc1cc(-c2noc([C@@H]3C[C@H]4CCCC[C@H]4[NH2+]3)n2)cc([N+](=O)[O-])c1 ZINC000823270839 1137092552 /nfs/dbraw/zinc/09/25/52/1137092552.db2.gz VYWKXZGZCLSWPH-DFBGVHRSSA-N 1 0 328.372 3.546 20 5 EHBDRO CC[C@@H](C[NH2+]C/C=C/c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000824661326 1137147254 /nfs/dbraw/zinc/14/72/54/1137147254.db2.gz VTKZQMWBGXLCCE-HQPKTYMTSA-N 1 0 349.431 3.501 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@H+]2CCCC[C@@H]2[C@H]2CCC[C@H]2O)ccc1Cl ZINC000824696253 1137148946 /nfs/dbraw/zinc/14/89/46/1137148946.db2.gz JHCMHNHIVMOSIB-FRFSOERESA-N 1 0 338.835 3.764 20 5 EHBDRO CC[NH+](CC)[C@@H](CNC(=O)c1c(C)ccc([N+](=O)[O-])c1C)CC(C)C ZINC001144198258 1137250150 /nfs/dbraw/zinc/25/01/50/1137250150.db2.gz ZUKZUSXOJRITJR-MRXNPFEDSA-N 1 0 349.475 3.698 20 5 EHBDRO COC(C)(C)CC[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000865756171 1137308737 /nfs/dbraw/zinc/30/87/37/1137308737.db2.gz YSCSZJXXIJYTPS-UHFFFAOYSA-N 1 0 335.429 3.623 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2c(C3CC3)nc3sccn23)cc1[N+](=O)[O-] ZINC000865787295 1137311905 /nfs/dbraw/zinc/31/19/05/1137311905.db2.gz KQCRDONKLSPEPO-UHFFFAOYSA-N 1 0 342.424 3.780 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CC12CCSCC2 ZINC000866375600 1137350368 /nfs/dbraw/zinc/35/03/68/1137350368.db2.gz DGWGVHVNFKQPKE-OCCSQVGLSA-N 1 0 338.448 3.788 20 5 EHBDRO C[C@H]([NH2+]CC1([C@@H]2CCCCO2)CCC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000866480307 1137358022 /nfs/dbraw/zinc/35/80/22/1137358022.db2.gz CCEBFWXTTWYDHX-GUYCJALGSA-N 1 0 333.432 3.567 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]Cc1cccc2c1CCOC2 ZINC000866479494 1137358075 /nfs/dbraw/zinc/35/80/75/1137358075.db2.gz UTLCLJAPZUUKPN-CYBMUJFWSA-N 1 0 344.386 3.527 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H](C1CCC1)[C@H]1CCOC1)CCC2 ZINC000866512004 1137360102 /nfs/dbraw/zinc/36/01/02/1137360102.db2.gz HFXUWMFOYRFYLJ-IPELMVKDSA-N 1 0 330.428 3.767 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)C(C)(F)F ZINC000866544691 1137363664 /nfs/dbraw/zinc/36/36/64/1137363664.db2.gz ZGWJKJRWDATRKB-RYUDHWBXSA-N 1 0 330.379 3.546 20 5 EHBDRO Cc1ccc2c(ccnc2-n2c(CC[NH3+])cc3ccccc32)c1[N+](=O)[O-] ZINC001171302344 1137403737 /nfs/dbraw/zinc/40/37/37/1137403737.db2.gz WRXPRWDXPXBKKE-UHFFFAOYSA-N 1 0 346.390 3.897 20 5 EHBDRO CCC(=O)c1ccc(N2CCCC[C@@H]([NH+]3CCCC3)C2)c([N+](=O)[O-])c1 ZINC000795093356 1137462471 /nfs/dbraw/zinc/46/24/71/1137462471.db2.gz LXWZGXDNAQEVFJ-MRXNPFEDSA-N 1 0 345.443 3.642 20 5 EHBDRO CCC[C@H]([NH2+]C[C@]1(O)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000773097632 1137465416 /nfs/dbraw/zinc/46/54/16/1137465416.db2.gz HELPCCXZLHODQT-VQTJNVASSA-N 1 0 340.423 3.860 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cnn(-c2ccccc2)c1 ZINC000773116075 1137466157 /nfs/dbraw/zinc/46/61/57/1137466157.db2.gz DDGBOIQKFMWFDS-HNNXBMFYSA-N 1 0 336.395 3.674 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1ccco1)N(C)C ZINC000872018795 1137564857 /nfs/dbraw/zinc/56/48/57/1137564857.db2.gz PPHUCPMLPOTHPX-WFASDCNBSA-N 1 0 349.456 3.863 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C[C@H](CO)c1ccccc1 ZINC000872038945 1137566976 /nfs/dbraw/zinc/56/69/76/1137566976.db2.gz BTZXDCLDAVEOMN-UKRRQHHQSA-N 1 0 346.452 3.743 20 5 EHBDRO C[C@H]([NH2+]C[C@]1(CO)C[C@@H]1c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872072662 1137569705 /nfs/dbraw/zinc/56/97/05/1137569705.db2.gz IGAYLCFMPULGMC-OHNRDTAOSA-N 1 0 344.386 3.551 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@@H]1CCCC(F)(F)[C@H]1O ZINC000872080357 1137570171 /nfs/dbraw/zinc/57/01/71/1137570171.db2.gz PVTNVBWNTJZXOM-IUPBHXKESA-N 1 0 346.399 3.516 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@@H]1CCO[C@@H](c2cccnc2)C1 ZINC000873130810 1137590863 /nfs/dbraw/zinc/59/08/63/1137590863.db2.gz GYYSUQBDTZDOHL-VQIMIIECSA-N 1 0 341.411 3.617 20 5 EHBDRO Cc1ccccc1[C@@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)C1CC1 ZINC000877029089 1137668015 /nfs/dbraw/zinc/66/80/15/1137668015.db2.gz QFSQESOISKECBL-JMLCCBQJSA-N 1 0 326.400 3.544 20 5 EHBDRO CCC(CC)(C[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccccc1 ZINC000877070359 1137669350 /nfs/dbraw/zinc/66/93/50/1137669350.db2.gz WFDGPQKGXVSSDL-UHFFFAOYSA-N 1 0 342.443 3.842 20 5 EHBDRO CC(C)c1ccc2c(c1)[C@H]([NH2+]C1CC(n3cc([N+](=O)[O-])cn3)C1)CC2 ZINC000877438574 1137676289 /nfs/dbraw/zinc/67/62/89/1137676289.db2.gz SRTMZSOMIDBNIM-LADRWXRNSA-N 1 0 340.427 3.895 20 5 EHBDRO C[C@]1(CC[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)C[C@]1(F)Cl ZINC000877610954 1137682897 /nfs/dbraw/zinc/68/28/97/1137682897.db2.gz MRZOESBOUUGAMA-UONOGXRCSA-N 1 0 327.743 3.530 20 5 EHBDRO CC(C)[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)C1CCCC1 ZINC000878232861 1137708157 /nfs/dbraw/zinc/70/81/57/1137708157.db2.gz CLFGVPRRBFBBMW-UHFFFAOYSA-N 1 0 330.388 3.798 20 5 EHBDRO CC[C@@H]1CCCC[C@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447455 1137716440 /nfs/dbraw/zinc/71/64/40/1137716440.db2.gz MUGSELXQRQAVPK-TZMCWYRMSA-N 1 0 330.388 3.703 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[NH+]2CCCCCCCC2)o1 ZINC000878682245 1137724737 /nfs/dbraw/zinc/72/47/37/1137724737.db2.gz LSGRTOPXCNIXFQ-UHFFFAOYSA-N 1 0 330.388 3.801 20 5 EHBDRO CC[C@H](C)[N@H+](CC)Cc1nnc(-c2ccc(Cl)cc2[N+](=O)[O-])o1 ZINC000878885154 1137730896 /nfs/dbraw/zinc/73/08/96/1137730896.db2.gz XYEURDQGVFLDIU-JTQLQIEISA-N 1 0 338.795 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCC[C@H](C3CCC3)C2)o1 ZINC000878994658 1137734506 /nfs/dbraw/zinc/73/45/06/1137734506.db2.gz XBLPMTXCKMZSDF-AWEZNQCLSA-N 1 0 342.399 3.657 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc([N+](=O)[O-])c(F)c1)c1cccc(OC)c1OC ZINC000879466570 1137748579 /nfs/dbraw/zinc/74/85/79/1137748579.db2.gz UMBYAGFSWOHCRW-HNNXBMFYSA-N 1 0 348.374 3.992 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000880469015 1137779585 /nfs/dbraw/zinc/77/95/85/1137779585.db2.gz HOPXTISAXDIUCI-IAQYHMDHSA-N 1 0 346.349 3.908 20 5 EHBDRO CC(=O)c1c([N+](=O)[O-])cccc1N1CCC[C@@H]([N@H+]2[C@H](C)CC[C@@H]2C)C1 ZINC000881822059 1137816063 /nfs/dbraw/zinc/81/60/63/1137816063.db2.gz XFOJMSOFLSASFF-IJEWVQPXSA-N 1 0 345.443 3.639 20 5 EHBDRO CO[C@H]1C[C@H](C[NH2+][C@@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)C1 ZINC000883271092 1137851763 /nfs/dbraw/zinc/85/17/63/1137851763.db2.gz FMTYHWCHZUYXLP-JVPBZIDWSA-N 1 0 326.396 3.699 20 5 EHBDRO O=[N+]([O-])c1cc(Br)ccc1C[NH2+]C1CC(CF)(CF)C1 ZINC000883295502 1137853506 /nfs/dbraw/zinc/85/35/06/1137853506.db2.gz KOVPOCQSDACFLH-UHFFFAOYSA-N 1 0 349.175 3.535 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@H]2CCC3(CCC3)O2)cc1[N+](=O)[O-] ZINC000883356836 1137857177 /nfs/dbraw/zinc/85/71/77/1137857177.db2.gz XCDLCXAKZQTJGS-DZGCQCFKSA-N 1 0 334.416 3.746 20 5 EHBDRO Cc1nn(C)c(C)c1[C@@H]1CCC[N@H+]1[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000331824704 1137922010 /nfs/dbraw/zinc/92/20/10/1137922010.db2.gz QAKPTFDMNZWLRR-DYVFJYSZSA-N 1 0 328.416 3.843 20 5 EHBDRO Cc1cccc([C@@H](C)[NH2+]Cc2cc([N+](=O)[O-])cc3c2OCOC3)c1C ZINC000115630545 1137922676 /nfs/dbraw/zinc/92/26/76/1137922676.db2.gz BNDOTOOUHMRKQY-CQSZACIVSA-N 1 0 342.395 3.929 20 5 EHBDRO COCC[C@@H]1CCCC[N@H+](Cc2ccc([N+](=O)[O-])cc2Cl)C1 ZINC000332367252 1137941721 /nfs/dbraw/zinc/94/17/21/1137941721.db2.gz WCKCRHAAJZOUCW-ZDUSSCGKSA-N 1 0 326.824 3.887 20 5 EHBDRO CC(=O)c1ccc(N2CCC(c3[nH]c(C)c(C)[nH+]3)CC2)c([N+](=O)[O-])c1 ZINC000884707170 1137969925 /nfs/dbraw/zinc/96/99/25/1137969925.db2.gz AMMNRNGSPQVSFD-UHFFFAOYSA-N 1 0 342.399 3.521 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+][C@H](C[C@H]1CCOC1)c1ccccc1 ZINC000089512648 1138200471 /nfs/dbraw/zinc/20/04/71/1138200471.db2.gz RTQCWPMBPQRZLC-CRAIPNDOSA-N 1 0 326.396 3.852 20 5 EHBDRO CCOc1ccc([C@@H](C)NC2CC[NH+](C(C)(C)C)CC2)cc1[N+](=O)[O-] ZINC000089512951 1138200585 /nfs/dbraw/zinc/20/05/85/1138200585.db2.gz PMPLXRSARCXMEJ-CQSZACIVSA-N 1 0 349.475 3.907 20 5 EHBDRO OCC1(C[NH2+]Cc2c3ccccc3c(Cl)c3ccccc32)COC1 ZINC000123051400 1138265552 /nfs/dbraw/zinc/26/55/52/1138265552.db2.gz FOASGQXDFIUOTQ-UHFFFAOYSA-N 1 0 341.838 3.745 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc(F)cc1F)c1cccc([N+](=O)[O-])c1 ZINC000124765954 1138294344 /nfs/dbraw/zinc/29/43/44/1138294344.db2.gz MJVFNPVQPBLENV-DLBZAZTESA-N 1 0 336.338 3.647 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])[C@H]1CCc2ccccc21 ZINC000336965386 1138436599 /nfs/dbraw/zinc/43/65/99/1138436599.db2.gz JADPNDIUFXVTTR-KRWDZBQOSA-N 1 0 339.395 3.543 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CCCOc3ccc(F)cc32)cc1[N+](=O)[O-] ZINC000264326237 1138477342 /nfs/dbraw/zinc/47/73/42/1138477342.db2.gz ITIFNAGFZORHQN-HNNXBMFYSA-N 1 0 346.358 3.746 20 5 EHBDRO C[C@@H](c1ccco1)[N@H+](C)Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000131028602 1138491563 /nfs/dbraw/zinc/49/15/63/1138491563.db2.gz LFKDUFYHOQTXNI-ZDUSSCGKSA-N 1 0 340.383 3.781 20 5 EHBDRO O=C(CC[N@@H+]1CCC[C@@]2(CC=CCC2)C1)Nc1ccccc1[N+](=O)[O-] ZINC000337211485 1138496172 /nfs/dbraw/zinc/49/61/72/1138496172.db2.gz DORXUPKSUBJCQI-IBGZPJMESA-N 1 0 343.427 3.746 20 5 EHBDRO COCC1(C[NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCC1 ZINC000337238194 1138504343 /nfs/dbraw/zinc/50/43/43/1138504343.db2.gz DFPHJFHBUBFYPD-UHFFFAOYSA-N 1 0 330.384 3.761 20 5 EHBDRO C[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CCC(C)(C)CC1 ZINC000337254058 1138509816 /nfs/dbraw/zinc/50/98/16/1138509816.db2.gz QHNXUZVEVUAKTK-UHFFFAOYSA-N 1 0 333.432 3.824 20 5 EHBDRO COc1cc(C[NH2+]C2CCC2)ccc1OCc1ccc([N+](=O)[O-])cc1 ZINC000337352656 1138541315 /nfs/dbraw/zinc/54/13/15/1138541315.db2.gz ZGJUUKIKTUFSCZ-UHFFFAOYSA-N 1 0 342.395 3.825 20 5 EHBDRO O=[N+]([O-])c1ccn(CC[NH+](Cc2cccs2)Cc2cccs2)n1 ZINC000176198033 1139544633 /nfs/dbraw/zinc/54/46/33/1139544633.db2.gz SXCUMZFKMQVYMB-UHFFFAOYSA-N 1 0 348.453 3.617 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(OC[C@@H]2CCCCO2)CC1 ZINC000177605993 1139628694 /nfs/dbraw/zinc/62/86/94/1139628694.db2.gz CAYWDCYTRFLJKZ-BEFAXECRSA-N 1 0 348.443 3.706 20 5 EHBDRO CC(C)[NH2+]C1CCN(Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000179835284 1139787358 /nfs/dbraw/zinc/78/73/58/1139787358.db2.gz RVDQNDJAKIYBAQ-UHFFFAOYSA-N 1 0 343.427 3.817 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(C)c1 ZINC000181808257 1139933083 /nfs/dbraw/zinc/93/30/83/1139933083.db2.gz XDMOGQKPSULJJP-OAHLLOKOSA-N 1 0 341.411 3.809 20 5 EHBDRO Cc1cccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000181818111 1139933761 /nfs/dbraw/zinc/93/37/61/1139933761.db2.gz WJFCHKNBUAAVJF-CQSZACIVSA-N 1 0 327.384 3.501 20 5 EHBDRO Cc1noc([C@H]2CCC[N@@H+]([C@@H](C)c3cc([N+](=O)[O-])ccc3C)C2)n1 ZINC000182685685 1139986214 /nfs/dbraw/zinc/98/62/14/1139986214.db2.gz RLFWDKNBSQVDCM-JSGCOSHPSA-N 1 0 330.388 3.535 20 5 EHBDRO C[C@@H](N[C@@H](C)[C@@H]1CCC[N@@H+](C2CCC2)C1)c1cccc([N+](=O)[O-])c1 ZINC000183186653 1140019337 /nfs/dbraw/zinc/01/93/37/1140019337.db2.gz BPFDIQXJBPXMOY-HLLBOEOZSA-N 1 0 331.460 3.898 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)c1nccs1 ZINC000186749640 1140220358 /nfs/dbraw/zinc/22/03/58/1140220358.db2.gz JTFXKNWRNZKHDK-IUODEOHRSA-N 1 0 331.441 3.766 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@H]2C[C@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309596 1140918864 /nfs/dbraw/zinc/91/88/64/1140918864.db2.gz XAKOPLIAXABHPX-RDJZCZTQSA-N 1 0 330.384 3.584 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[N@@H+]2CCCCC[C@H]2c2ccco2)c1 ZINC000269633872 1141129760 /nfs/dbraw/zinc/12/97/60/1141129760.db2.gz GNBCBKDESGSINQ-IRXDYDNUSA-N 1 0 330.384 3.839 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1ccccn1 ZINC000271203307 1141324700 /nfs/dbraw/zinc/32/47/00/1141324700.db2.gz ZREUEPQOUIPANT-AWEZNQCLSA-N 1 0 331.441 3.693 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccccc1[N+](=O)[O-])c1ccc([S@@](C)=O)cc1 ZINC000271445031 1141369243 /nfs/dbraw/zinc/36/92/43/1141369243.db2.gz FLWYICUGCOJWNH-VQNPYFGKSA-N 1 0 332.425 3.744 20 5 EHBDRO CC(C)(CCCO)C[NH2+][C@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000271584797 1141402302 /nfs/dbraw/zinc/40/23/02/1141402302.db2.gz RZTCLQGMEAXHGO-RDJZCZTQSA-N 1 0 334.460 3.694 20 5 EHBDRO COc1ccccc1[C@@H]1CC[N@H+](Cc2ccc([N+](=O)[O-])c(F)c2)C1 ZINC000283052307 1141544441 /nfs/dbraw/zinc/54/44/41/1141544441.db2.gz JAWJFCBLWYAXGX-CQSZACIVSA-N 1 0 330.359 3.732 20 5 EHBDRO COc1cc([C@@H](C)[NH2+][C@H]2CCCc3ccc([N+](=O)[O-])cc32)ccn1 ZINC000348753141 1141575622 /nfs/dbraw/zinc/57/56/22/1141575622.db2.gz HXBNLKXPGRVFAN-PXAZEXFGSA-N 1 0 327.384 3.727 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@H+](C1CC1)C1CCCCC1 ZINC000048008822 1014314710 /nfs/dbraw/zinc/31/47/10/1014314710.db2.gz RZEREEBLASYJOC-UHFFFAOYSA-N 1 0 331.416 3.639 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccccc1[N+](=O)[O-])c1ccc(-n2cccn2)c(F)c1 ZINC000339425786 1014403833 /nfs/dbraw/zinc/40/38/33/1014403833.db2.gz OEAHUFHEMNHDNU-CYBMUJFWSA-N 1 0 340.358 3.770 20 5 EHBDRO C[NH+](C)CCCCCOC(=O)c1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000133683102 1014573657 /nfs/dbraw/zinc/57/36/57/1014573657.db2.gz QUWCHMPVALBBSV-UHFFFAOYSA-N 1 0 348.321 3.502 20 5 EHBDRO Cc1ccccc1OCCC[N@@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC001167086105 1015533811 /nfs/dbraw/zinc/53/38/11/1015533811.db2.gz WNLPKCUEMCZSDQ-UHFFFAOYSA-N 1 0 344.411 3.683 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccc1)[C@H]1CCOC1 ZINC000359872826 1015883138 /nfs/dbraw/zinc/88/31/38/1015883138.db2.gz PRWIPTCMUMLVSI-PKOBYXMFSA-N 1 0 326.396 3.771 20 5 EHBDRO Cc1ccc(C)c(C[NH+]2CCN(c3ccccc3[N+](=O)[O-])CC2)c1 ZINC000016564836 1015932677 /nfs/dbraw/zinc/93/26/77/1015932677.db2.gz CLCFRWIHECSFMZ-UHFFFAOYSA-N 1 0 325.412 3.534 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ccccn2)CC1 ZINC000348513264 1016618709 /nfs/dbraw/zinc/61/87/09/1016618709.db2.gz WLIKJDDUDMKRIV-AWEZNQCLSA-N 1 0 327.384 3.594 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCCc1ccccn1)C1CC1 ZINC000181487829 1016848307 /nfs/dbraw/zinc/84/83/07/1016848307.db2.gz NWSPXLMYFLCHGM-SFHVURJKSA-N 1 0 325.412 3.533 20 5 EHBDRO COC1([C@@H](C)[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CCC1 ZINC000414523841 1016951351 /nfs/dbraw/zinc/95/13/51/1016951351.db2.gz JDFXTCRAUBDNOY-CYBMUJFWSA-N 1 0 330.384 3.902 20 5 EHBDRO CC[C@@H]([NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)[C@H](O)C(C)C ZINC000414536824 1016963363 /nfs/dbraw/zinc/96/33/63/1016963363.db2.gz YHLZVAIECMNOHV-HZPDHXFCSA-N 1 0 349.456 3.603 20 5 EHBDRO Cc1cc(NC2CC[NH+](Cc3ccc(F)cc3)CC2)ncc1[N+](=O)[O-] ZINC000074741875 1032212833 /nfs/dbraw/zinc/21/28/33/1032212833.db2.gz LWANJNWYTVXWIN-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])ccc1OC ZINC000449138990 1032241957 /nfs/dbraw/zinc/24/19/57/1032241957.db2.gz FDGZXMBVBSVQGJ-AWEZNQCLSA-N 1 0 344.411 3.723 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(OC2CCC2)c1 ZINC000449203479 1032328013 /nfs/dbraw/zinc/32/80/13/1032328013.db2.gz HRGDMTLEIVNORI-AWEZNQCLSA-N 1 0 341.411 3.642 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]Cc1ccnc(OC2CCC2)c1 ZINC000449203480 1032328879 /nfs/dbraw/zinc/32/88/79/1032328879.db2.gz HRGDMTLEIVNORI-CQSZACIVSA-N 1 0 341.411 3.642 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1CN(C)Cc2ccccc21 ZINC000536838829 1032333065 /nfs/dbraw/zinc/33/30/65/1032333065.db2.gz LJCSEWKRVJAMCH-BEFAXECRSA-N 1 0 339.439 3.692 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CC1Cc2ccccc2C1)C1CC1 ZINC000536860194 1032358496 /nfs/dbraw/zinc/35/84/96/1032358496.db2.gz YFYDSVVQPFZBDH-FQEVSTJZSA-N 1 0 336.435 3.921 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@H](C)[C@@H](c1ccccc1)N(C)C ZINC000449251091 1032358675 /nfs/dbraw/zinc/35/86/75/1032358675.db2.gz QSGBNJMILMKJQN-QINHECLXSA-N 1 0 341.455 3.807 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCC[C@H]1OC(F)F ZINC000449308264 1032426473 /nfs/dbraw/zinc/42/64/73/1032426473.db2.gz VVAOZKGQVVEDMO-UXIGCNINSA-N 1 0 328.359 3.666 20 5 EHBDRO C[C@@H](Cc1cccc(F)c1)[N@H+](C)Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000459757907 1032450794 /nfs/dbraw/zinc/45/07/94/1032450794.db2.gz HZKWMNBDUIDZKI-LBPRGKRZSA-N 1 0 342.374 3.673 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCN(c2ccccc2F)C1 ZINC000449335511 1032469522 /nfs/dbraw/zinc/46/95/22/1032469522.db2.gz JEXVFVTXSZMQQL-GOEBONIOSA-N 1 0 343.402 3.533 20 5 EHBDRO Cn1cc(C[NH2+]CC2=CCCCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000449376976 1032504551 /nfs/dbraw/zinc/50/45/51/1032504551.db2.gz QLBGKCYSRXJOLQ-UHFFFAOYSA-N 1 0 326.400 3.585 20 5 EHBDRO Cc1ccc(NC(=O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1F ZINC000537176112 1032548692 /nfs/dbraw/zinc/54/86/92/1032548692.db2.gz QWYMHHVBUQRCAM-CYBMUJFWSA-N 1 0 345.374 3.640 20 5 EHBDRO C[NH2+]CCCNCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000414863697 1017253839 /nfs/dbraw/zinc/25/38/39/1017253839.db2.gz YENBJZFIZLXQBF-UHFFFAOYSA-N 1 0 349.818 3.740 20 5 EHBDRO C[C@@H]1CCN(c2ccsc2[N+](=O)[O-])CC[N@@H+]1Cc1ccccc1 ZINC000610284382 1017657055 /nfs/dbraw/zinc/65/70/55/1017657055.db2.gz QGTQGPAUBOPQOQ-CQSZACIVSA-N 1 0 331.441 3.757 20 5 EHBDRO CCC(=O)c1ccc(NCCCCC[NH+]2CCCC2)c([N+](=O)[O-])c1 ZINC000549232743 1017732689 /nfs/dbraw/zinc/73/26/89/1017732689.db2.gz MSVXFFAGYSGHLX-UHFFFAOYSA-N 1 0 333.432 3.866 20 5 EHBDRO CC(C)([NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F)c1ccccc1 ZINC000275497200 1017735703 /nfs/dbraw/zinc/73/57/03/1017735703.db2.gz QLRTVNUTKJXSDQ-UHFFFAOYSA-N 1 0 345.374 3.587 20 5 EHBDRO C[C@@H](c1cccc(O)c1)N(C)Cc1nc2cc([N+](=O)[O-])ccc2o1 ZINC000083171263 1017807932 /nfs/dbraw/zinc/80/79/32/1017807932.db2.gz SXHCYJDMZDYKIA-NSHDSACASA-N 1 0 327.340 3.635 20 5 EHBDRO [NH3+]CCCN(Cc1ccccc1)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000303983861 1017869189 /nfs/dbraw/zinc/86/91/89/1017869189.db2.gz CRDGSXDZQLVJRS-UHFFFAOYSA-N 1 0 333.819 3.599 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1CN1CCc2cc(F)ccc2[C@@H]1C ZINC000610003891 1017979195 /nfs/dbraw/zinc/97/91/95/1017979195.db2.gz MZNXMBKVPSNFGI-LBPRGKRZSA-N 1 0 330.359 3.862 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@H](C)O ZINC000449533521 1032744013 /nfs/dbraw/zinc/74/40/13/1032744013.db2.gz BEPUVCSXLRTWLQ-BONVTDFDSA-N 1 0 338.791 3.757 20 5 EHBDRO CC[N@H+](Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000593069976 1032767623 /nfs/dbraw/zinc/76/76/23/1032767623.db2.gz MIUIELICYXDGTQ-CYBMUJFWSA-N 1 0 332.322 3.615 20 5 EHBDRO C[C@@H](c1ccccc1[N+](=O)[O-])[N@H+]1C[C@H]2CN(c3ccccc3)C[C@H]2C1 ZINC000610367961 1018535242 /nfs/dbraw/zinc/53/52/42/1018535242.db2.gz SAAWRGAYDFTKDR-YESZJQIVSA-N 1 0 337.423 3.724 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@@H]1CSCCc2ccccc21 ZINC000548055114 1018569743 /nfs/dbraw/zinc/56/97/43/1018569743.db2.gz NEVCXAKIFYHREB-QGZVFWFLSA-N 1 0 328.437 3.758 20 5 EHBDRO O=[N+]([O-])c1ccccc1CC[NH2+][C@H]1CSCCc2ccccc21 ZINC000548055113 1018569821 /nfs/dbraw/zinc/56/98/21/1018569821.db2.gz NEVCXAKIFYHREB-KRWDZBQOSA-N 1 0 328.437 3.758 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C(=O)OC(C)(C)C)C1)c1cccc([N+](=O)[O-])c1 ZINC000592404878 1032777125 /nfs/dbraw/zinc/77/71/25/1032777125.db2.gz YNVOLFMRSDTOPY-VHDGCEQUSA-N 1 0 334.416 3.756 20 5 EHBDRO C[N@H+](CCNc1ccc([N+](=O)[O-])c2cccnc12)Cc1ccccc1 ZINC000064916265 1018714975 /nfs/dbraw/zinc/71/49/75/1018714975.db2.gz XUNSFIFCRXFBAK-UHFFFAOYSA-N 1 0 336.395 3.687 20 5 EHBDRO C[C@@]1(C[NH2+]Cc2ccccc2[N+](=O)[O-])CCCN1Cc1ccccc1 ZINC000397867097 1018912319 /nfs/dbraw/zinc/91/23/19/1018912319.db2.gz GOSPQKBDQRLDBQ-FQEVSTJZSA-N 1 0 339.439 3.739 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H](CCO)c1ccccc1F ZINC000592402477 1032797344 /nfs/dbraw/zinc/79/73/44/1032797344.db2.gz HMPJIQVBDMOLDB-RDTXWAMCSA-N 1 0 346.402 3.768 20 5 EHBDRO C[NH+](C)[C@H]1CCCN(Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)C1 ZINC000513138931 1019083357 /nfs/dbraw/zinc/08/33/57/1019083357.db2.gz LDXNARWXKAHGRD-AWEZNQCLSA-N 1 0 345.468 3.849 20 5 EHBDRO C[C@H](c1ccccc1[N+](=O)[O-])N1CCC[N@H+](Cc2ccccc2)CC1 ZINC000433606508 1019435980 /nfs/dbraw/zinc/43/59/80/1019435980.db2.gz GPBLWTPQKXPZGS-QGZVFWFLSA-N 1 0 339.439 3.864 20 5 EHBDRO COc1ccc(OCC[N@H+]([C@H](C)c2ccco2)C2CC2)c([N+](=O)[O-])c1 ZINC000119133536 1019451386 /nfs/dbraw/zinc/45/13/86/1019451386.db2.gz QPZHTXTVZZUHAD-CYBMUJFWSA-N 1 0 346.383 3.801 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@H]3CC[NH2+]C34CCCC4)o2)cc1 ZINC000592438463 1032844388 /nfs/dbraw/zinc/84/43/88/1032844388.db2.gz MQBHCDSLYBNNGV-SFHVURJKSA-N 1 0 341.411 3.619 20 5 EHBDRO CCC[NH+](CCC)Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058723444 1032869216 /nfs/dbraw/zinc/86/92/16/1032869216.db2.gz YIKOYDPZILUOLF-UHFFFAOYSA-N 1 0 332.347 3.827 20 5 EHBDRO CC1(C)C[C@@H](O)CC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000449616046 1032887752 /nfs/dbraw/zinc/88/77/52/1032887752.db2.gz BMSTXRAFPXJPKU-INIZCTEOSA-N 1 0 344.411 3.838 20 5 EHBDRO CC1(C)C[C@H](O)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449617288 1032901438 /nfs/dbraw/zinc/90/14/38/1032901438.db2.gz GRMHERDVTPMAIE-MRXNPFEDSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1C[C@H](c2cnn(C)c2)C(C)(C)C1 ZINC000581169791 1020498600 /nfs/dbraw/zinc/49/86/00/1020498600.db2.gz MGICBUAQHOGBFX-CXAGYDPISA-N 1 0 328.416 3.515 20 5 EHBDRO COc1cc(C[NH2+][C@H]2C[C@H](c3ccccc3)C2)c([N+](=O)[O-])cc1OC ZINC000280615262 1020526218 /nfs/dbraw/zinc/52/62/18/1020526218.db2.gz KLKNCYJEOHXBKR-KOMQPUFPSA-N 1 0 342.395 3.648 20 5 EHBDRO C[C@@H](c1ccc(Cl)cc1)[C@H](C)[N@H+](C)Cc1cn(C)nc1[N+](=O)[O-] ZINC000602488554 1032916132 /nfs/dbraw/zinc/91/61/32/1032916132.db2.gz ZHKFHFQPDXPOKO-NEPJUHHUSA-N 1 0 336.823 3.606 20 5 EHBDRO CCC(=O)c1ccc(N2CCC[C@H]([NH+]3CCCC3)CC2)c([N+](=O)[O-])c1 ZINC000280725635 1020614280 /nfs/dbraw/zinc/61/42/80/1020614280.db2.gz MRNMDIYUFPWTPU-INIZCTEOSA-N 1 0 345.443 3.642 20 5 EHBDRO O=C(CC[N@@H+]1CCCC12CCCCC2)Nc1ccccc1[N+](=O)[O-] ZINC000500983468 1020632692 /nfs/dbraw/zinc/63/26/92/1020632692.db2.gz KIICPFSCNZEBPV-UHFFFAOYSA-N 1 0 331.416 3.722 20 5 EHBDRO CC(C)(C)[NH+]1CCC(Nc2ccc([N+](=O)[O-])c3ncccc23)CC1 ZINC000413066918 1020638615 /nfs/dbraw/zinc/63/86/15/1020638615.db2.gz IGDQSERQVWWLPF-UHFFFAOYSA-N 1 0 328.416 3.818 20 5 EHBDRO CC[NH+](CC)Cc1cccc(CNc2ncc([N+](=O)[O-])cc2F)c1 ZINC000413070967 1020639735 /nfs/dbraw/zinc/63/97/35/1020639735.db2.gz FPZXMEBBFLHJLC-UHFFFAOYSA-N 1 0 332.379 3.583 20 5 EHBDRO CCCC(=O)Nc1cccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)c1 ZINC000602514011 1032951029 /nfs/dbraw/zinc/95/10/29/1032951029.db2.gz JXIVXLGDUYXWQV-UHFFFAOYSA-N 1 0 341.411 3.666 20 5 EHBDRO CCOc1cc(NCCc2cn3cccc(C)c3n2)ccc1[N+](=O)[O-] ZINC000610515854 1021172369 /nfs/dbraw/zinc/17/23/69/1021172369.db2.gz ATNUKASFPNOLRI-UHFFFAOYSA-N 1 0 340.383 3.604 20 5 EHBDRO Cc1cccc(OC[C@@H](C)[NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)c1 ZINC000602526473 1032959378 /nfs/dbraw/zinc/95/93/78/1032959378.db2.gz JVTYTYODMSAWFM-CYBMUJFWSA-N 1 0 341.367 3.602 20 5 EHBDRO C[C@H]([NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-])[C@H]1CCCOC1 ZINC000507430732 1021261166 /nfs/dbraw/zinc/26/11/66/1021261166.db2.gz UILNLJHBDMYBEA-UOVPBQLFSA-N 1 0 332.444 3.711 20 5 EHBDRO CCc1nc(C)c(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])o1 ZINC000426324783 1021264336 /nfs/dbraw/zinc/26/43/36/1021264336.db2.gz RWCNGGVEJVVKQH-GOEBONIOSA-N 1 0 343.427 3.955 20 5 EHBDRO CC[N@H+](CCc1ccccn1)Cc1cc([N+](=O)[O-])ccc1OC(C)C ZINC000729473807 1021268895 /nfs/dbraw/zinc/26/88/95/1021268895.db2.gz TVORQYGFKQHNPH-UHFFFAOYSA-N 1 0 343.427 3.842 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+](C)CCC1CCCCC1 ZINC000507601305 1021390351 /nfs/dbraw/zinc/39/03/51/1021390351.db2.gz REKQHKGXVMXLRD-UHFFFAOYSA-N 1 0 333.432 3.744 20 5 EHBDRO C[C@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1nc2c(s1)CCCC2 ZINC000090909890 1021691394 /nfs/dbraw/zinc/69/13/94/1021691394.db2.gz SZIHIUOGQUYUAW-LBPRGKRZSA-N 1 0 331.441 3.823 20 5 EHBDRO CC[C@@H](CSC)[NH2+]Cc1cc(Br)c([N+](=O)[O-])s1 ZINC000602580039 1032997816 /nfs/dbraw/zinc/99/78/16/1032997816.db2.gz CDRFCEKJRYCXIR-ZETCQYMHSA-N 1 0 339.280 3.650 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H](C)c2cccc([N+](=O)[O-])c2)cc(OC)c1 ZINC000506705389 1021784065 /nfs/dbraw/zinc/78/40/65/1021784065.db2.gz GHVBPMFZJAIISQ-ZDUSSCGKSA-N 1 0 330.384 3.805 20 5 EHBDRO COc1ccc(C[N@H+](C)C/C=C/c2ccccc2[N+](=O)[O-])c(OC)c1 ZINC000506771381 1021985043 /nfs/dbraw/zinc/98/50/43/1021985043.db2.gz DSJQZFIHRQDWHS-SOFGYWHQSA-N 1 0 342.395 3.757 20 5 EHBDRO C[C@H]1CC[NH2+]C[C@H]1NCc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000414910393 1022022967 /nfs/dbraw/zinc/02/29/67/1022022967.db2.gz COSOXRMXUBGYDE-MEDUHNTESA-N 1 0 349.818 3.596 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[C@H]2CCOC2)o1 ZINC000449680399 1033031302 /nfs/dbraw/zinc/03/13/02/1033031302.db2.gz GLOMNLDPYBAOAW-AWEZNQCLSA-N 1 0 330.384 3.761 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCC[C@@H]2CCOC2)o1 ZINC000449680400 1033032774 /nfs/dbraw/zinc/03/27/74/1033032774.db2.gz GLOMNLDPYBAOAW-CQSZACIVSA-N 1 0 330.384 3.761 20 5 EHBDRO COc1cccc2c1CC[C@@H]([NH2+][C@H](C)c1cccc([N+](=O)[O-])c1)C2 ZINC000425934805 1022267712 /nfs/dbraw/zinc/26/77/12/1022267712.db2.gz ATWQDPNNCCLJTF-CZUORRHYSA-N 1 0 326.396 3.812 20 5 EHBDRO CC(=O)c1cc(NCC2([NH+](C)C)CCCCCC2)ccc1[N+](=O)[O-] ZINC000550340308 1022277383 /nfs/dbraw/zinc/27/73/83/1022277383.db2.gz ZXMQKFOTDXABLP-UHFFFAOYSA-N 1 0 333.432 3.864 20 5 EHBDRO CC[C@@H](CC(F)(F)F)[NH2+][C@@H](C)CC(=O)Nc1ccc([N+](=O)[O-])cc1 ZINC000546268342 1022306677 /nfs/dbraw/zinc/30/66/77/1022306677.db2.gz WPDJZFDDLKTYFX-QWRGUYRKSA-N 1 0 347.337 3.633 20 5 EHBDRO CCC(O)(CC)CC[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000471817328 1022400807 /nfs/dbraw/zinc/40/08/07/1022400807.db2.gz SWQCZIWOEHPBPI-UHFFFAOYSA-N 1 0 332.400 3.886 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCCSC1 ZINC000602661320 1033060406 /nfs/dbraw/zinc/06/04/06/1033060406.db2.gz CXKLNPQKXJCWQG-SNVBAGLBSA-N 1 0 334.363 3.846 20 5 EHBDRO C[C@@H](CCc1ccccc1)C[NH+]1CCC(n2ccc([N+](=O)[O-])n2)CC1 ZINC000425997854 1022647179 /nfs/dbraw/zinc/64/71/79/1022647179.db2.gz ZKSJZSFZWJAXSM-INIZCTEOSA-N 1 0 342.443 3.697 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H](C)c2ccc(F)c(C)c2)c1[N+](=O)[O-] ZINC000894668426 1022685354 /nfs/dbraw/zinc/68/53/54/1022685354.db2.gz VFDYCDMKMMUZHC-LLVKDONJSA-N 1 0 334.347 3.607 20 5 EHBDRO COc1cccc([C@H]2CCC[N@@H+]2CCOc2cccc([N+](=O)[O-])c2)c1 ZINC000058932543 1033086889 /nfs/dbraw/zinc/08/68/89/1033086889.db2.gz FDHXMDMTPRCGKJ-LJQANCHMSA-N 1 0 342.395 3.819 20 5 EHBDRO Cc1c(C[N@H+](CCCO)[C@@H]2CCc3ccccc32)cccc1[N+](=O)[O-] ZINC000510686557 1022886239 /nfs/dbraw/zinc/88/62/39/1022886239.db2.gz QCWRQZGESOCVRQ-HXUWFJFHSA-N 1 0 340.423 3.775 20 5 EHBDRO CC[C@@]1(C)CCC[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000072803160 1022963929 /nfs/dbraw/zinc/96/39/29/1022963929.db2.gz AZVOCWVVGYFKJF-KRWDZBQOSA-N 1 0 330.388 3.657 20 5 EHBDRO C[C@]1(C[NH2+]Cc2cc(Br)c([N+](=O)[O-])s2)CC1(F)F ZINC000602712512 1033097337 /nfs/dbraw/zinc/09/73/37/1033097337.db2.gz YXGDMDAANYDXSI-SECBINFHSA-N 1 0 341.177 3.554 20 5 EHBDRO Cc1ccncc1CC[NH2+]Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-] ZINC000602709938 1033098030 /nfs/dbraw/zinc/09/80/30/1033098030.db2.gz KYTOZIBWXAGAHG-UHFFFAOYSA-N 1 0 339.317 3.649 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cn2)[NH+]2CCCC2)cc1 ZINC000060862613 1033095259 /nfs/dbraw/zinc/09/52/59/1033095259.db2.gz OUUGPTHYKZTENF-KRWDZBQOSA-N 1 0 326.400 3.547 20 5 EHBDRO C[N@H+](CCc1ccccc1)Cc1cc([N+](=O)[O-])ccc1OC(F)F ZINC000506381861 1023044341 /nfs/dbraw/zinc/04/43/41/1023044341.db2.gz PFQCEXBDFFSOQN-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2c(c1)CCO2 ZINC000507123284 1023141236 /nfs/dbraw/zinc/14/12/36/1023141236.db2.gz YMSOURFKRCQDLE-UHFFFAOYSA-N 1 0 326.396 3.940 20 5 EHBDRO COC(=O)c1ccc(C[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)cc1 ZINC000507155009 1023160789 /nfs/dbraw/zinc/16/07/89/1023160789.db2.gz MRPVJXCUNMYUOC-UHFFFAOYSA-N 1 0 340.379 3.546 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@H](CO)CC2CCCC2)cc1[N+](=O)[O-] ZINC000510944343 1023525485 /nfs/dbraw/zinc/52/54/85/1023525485.db2.gz JLORAVFSXGDMRL-BBRMVZONSA-N 1 0 336.432 3.585 20 5 EHBDRO C[N@@H+]1CCC[C@@H](CCNC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000458159333 1023606196 /nfs/dbraw/zinc/60/61/96/1023606196.db2.gz FBKWQFPWVABHDD-INIZCTEOSA-N 1 0 347.462 3.850 20 5 EHBDRO COc1cccc2c1OC[C@@H]([NH2+][C@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000610809795 1023694943 /nfs/dbraw/zinc/69/49/43/1023694943.db2.gz GDXAVGHLCZEZNZ-HIFRSBDPSA-N 1 0 342.395 3.566 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+](Cc2ccc(F)cc2)C2CCOCC2)cc1 ZINC000277024192 1023707188 /nfs/dbraw/zinc/70/71/88/1023707188.db2.gz LVLBBGPYKRLGQQ-UHFFFAOYSA-N 1 0 344.386 3.915 20 5 EHBDRO C[C@H]1CC2(CC([NH2+]Cc3cc(Cl)cc(Cl)c3[N+](=O)[O-])C2)CO1 ZINC000897775358 1033163382 /nfs/dbraw/zinc/16/33/82/1033163382.db2.gz CFUPZDAHHRCIFZ-AAYUTKSQSA-N 1 0 345.226 3.949 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1C(=O)Nc1ccc(C[NH+](C)C)c(C)c1 ZINC000458269099 1023841924 /nfs/dbraw/zinc/84/19/24/1023841924.db2.gz GZAIWOCMDKNGTP-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCO[C@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000610930448 1023878140 /nfs/dbraw/zinc/87/81/40/1023878140.db2.gz HRVWIZYAIPLIKF-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO Cc1ccc(Sc2ccc(C[NH2+][C@@H](C)CO)cc2[N+](=O)[O-])cc1 ZINC000121209769 1024275342 /nfs/dbraw/zinc/27/53/42/1024275342.db2.gz NLZVMKFOGVUPKV-ZDUSSCGKSA-N 1 0 332.425 3.525 20 5 EHBDRO CC1(C)CC(Nc2ccc([N+](=O)[O-])c3cnccc23)CC(C)(C)[NH2+]1 ZINC000141587394 1024409121 /nfs/dbraw/zinc/40/91/21/1024409121.db2.gz GYOXRNYLSAOFEE-UHFFFAOYSA-N 1 0 328.416 3.864 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@@H+]3CCC[C@@H](c4cccnc4)C3)nc2c1 ZINC000602857404 1033212160 /nfs/dbraw/zinc/21/21/60/1033212160.db2.gz VZHRRYOYPXWILR-CQSZACIVSA-N 1 0 338.367 3.511 20 5 EHBDRO CC(=O)c1cc(NC[C@H](C)[N@H+](C)Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000342232315 1024498218 /nfs/dbraw/zinc/49/82/18/1024498218.db2.gz YCYNPBUTAGAKOU-AWEZNQCLSA-N 1 0 341.411 3.730 20 5 EHBDRO Cc1ccc(CN(c2ccccn2)[C@H]2CC[C@H]([NH3+])CC2)cc1[N+](=O)[O-] ZINC000895112035 1024505112 /nfs/dbraw/zinc/50/51/12/1024505112.db2.gz SSCORKLRSFNFGB-QAQDUYKDSA-N 1 0 340.427 3.575 20 5 EHBDRO CCOC(=O)C[C@@H](C)[N@H+](C)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000346319060 1024619366 /nfs/dbraw/zinc/61/93/66/1024619366.db2.gz DGJNAZASLOLAEC-CYBMUJFWSA-N 1 0 346.383 3.628 20 5 EHBDRO CCOC(=O)C[C@H](C)[N@H+](C)Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000346343884 1024666617 /nfs/dbraw/zinc/66/66/17/1024666617.db2.gz WDPPMVPAQJPMLM-ZDUSSCGKSA-N 1 0 346.383 3.628 20 5 EHBDRO CC(C)([NH2+]CCCc1ccc2c(c1)CCO2)c1ccccc1[N+](=O)[O-] ZINC000430127844 1024673867 /nfs/dbraw/zinc/67/38/67/1024673867.db2.gz XJEHQOBUPWHCQM-UHFFFAOYSA-N 1 0 340.423 3.987 20 5 EHBDRO C[NH+]1CCC(C)(CNC(=O)c2cc3ccccc3c3cccnc23)CC1 ZINC000507852559 1024731792 /nfs/dbraw/zinc/73/17/92/1024731792.db2.gz QMKNAIFIVLKAES-UHFFFAOYSA-N 1 0 347.462 3.850 20 5 EHBDRO C[N@H+](CCCOc1ccc(F)cc1)CCOc1ccccc1[N+](=O)[O-] ZINC000520785388 1024780235 /nfs/dbraw/zinc/78/02/35/1024780235.db2.gz OQLGMGPAJODIQR-UHFFFAOYSA-N 1 0 348.374 3.514 20 5 EHBDRO COc1cc(C[NH2+]CC[C@@H](C)c2ccccc2)c([N+](=O)[O-])cc1OC ZINC000507942047 1024788652 /nfs/dbraw/zinc/78/86/52/1024788652.db2.gz PNZRFAFMNVVTKF-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[N@@H+]1CC[C@@H]([C@@H]2CCCO2)C1 ZINC000895844049 1024891864 /nfs/dbraw/zinc/89/18/64/1024891864.db2.gz LOBOKPPTPOVYLV-DOMZBBRYSA-N 1 0 344.333 3.615 20 5 EHBDRO CC(C)OC(=O)C[C@H]1CCC[N@@H+]([C@H](C)c2cccc([N+](=O)[O-])c2)C1 ZINC000248618747 1025041298 /nfs/dbraw/zinc/04/12/98/1025041298.db2.gz JWGNADFEJGZPTM-HUUCEWRRSA-N 1 0 334.416 3.710 20 5 EHBDRO COc1ccc(C[C@@H](C)C[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1F ZINC000545004964 1025081290 /nfs/dbraw/zinc/08/12/90/1025081290.db2.gz STNPCHMWCJXBSW-CYBMUJFWSA-N 1 0 332.375 3.711 20 5 EHBDRO Cc1ccccc1[C@H](CO)[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000515203792 1025089038 /nfs/dbraw/zinc/08/90/38/1025089038.db2.gz NNSTWEJVRMKVHE-MOPGFXCFSA-N 1 0 326.396 3.604 20 5 EHBDRO CC[N@@H+]1C[C@H](C)N(C(=O)c2cc3ccccc3c3cccnc23)C[C@H]1C ZINC000346782352 1025093587 /nfs/dbraw/zinc/09/35/87/1025093587.db2.gz YFRBDNSSSVLVKL-CVEARBPZSA-N 1 0 347.462 3.943 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1)C[C@H]1CCCOC1 ZINC000119773113 1025181237 /nfs/dbraw/zinc/18/12/37/1025181237.db2.gz QNVZBFUFISIMCK-CQSZACIVSA-N 1 0 330.384 3.713 20 5 EHBDRO C[N@H+](CCc1ccccc1[N+](=O)[O-])Cc1cccc(OC(F)F)c1 ZINC000511071243 1025219574 /nfs/dbraw/zinc/21/95/74/1025219574.db2.gz BJSVRAOOYAVWNK-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO CSC1CC[NH+]([C@H](C)c2nnc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000602922230 1033268063 /nfs/dbraw/zinc/26/80/63/1033268063.db2.gz DQJCAHYTPVLLLN-LLVKDONJSA-N 1 0 348.428 3.533 20 5 EHBDRO CN(CCC[NH+]1CCCC1)C(=O)c1cc2ccccc2c2cccnc12 ZINC000281650399 1025329933 /nfs/dbraw/zinc/32/99/33/1025329933.db2.gz IBZDJLADKJPUPR-UHFFFAOYSA-N 1 0 347.462 3.946 20 5 EHBDRO CC(C)OC(=O)C[C@@H]1CCC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000185582989 1025442466 /nfs/dbraw/zinc/44/24/66/1025442466.db2.gz DQXYVPNYDFFAQC-FSNWXROXSA-N 1 0 346.427 3.662 20 5 EHBDRO COc1ccc([C@H]2C[C@@H]2[C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])cc2)cc1 ZINC000551790141 1025457647 /nfs/dbraw/zinc/45/76/47/1025457647.db2.gz WOSUYTYSTFCTCM-UPRAQXHNSA-N 1 0 326.396 3.885 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]C1CCN(CC(F)(F)F)CC1 ZINC000515684440 1025471173 /nfs/dbraw/zinc/47/11/73/1025471173.db2.gz OPEDOXCZILYFSC-GFCCVEGCSA-N 1 0 345.365 3.581 20 5 EHBDRO C[C@@H](c1ccccc1)[C@H](O)C[NH2+]C(C)(C)c1ccccc1[N+](=O)[O-] ZINC000451057559 1025481398 /nfs/dbraw/zinc/48/13/98/1025481398.db2.gz UBQJIRRJWXGPFN-KBXCAEBGSA-N 1 0 328.412 3.584 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)cc1C ZINC000451108518 1025543647 /nfs/dbraw/zinc/54/36/47/1025543647.db2.gz WJXOFOPEACTXNB-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO C[C@H](C[N@@H+]1CCC[C@@H](C)C1)Nc1cc(C(F)(F)F)ncc1[N+](=O)[O-] ZINC000436318938 1025581402 /nfs/dbraw/zinc/58/14/02/1025581402.db2.gz PXQAMXQWYDQGOR-GHMZBOCLSA-N 1 0 346.353 3.541 20 5 EHBDRO CC(C)O[C@H]1C[C@H]([NH2+]Cc2ccc([N+](=O)[O-])c(Cl)c2)C1(C)C ZINC000783676025 1025861272 /nfs/dbraw/zinc/86/12/72/1025861272.db2.gz LIZPSQLJIJHDBJ-GJZGRUSLSA-N 1 0 326.824 3.930 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[NH2+][C@@H]1CCC12CCCC2 ZINC000451464270 1026010212 /nfs/dbraw/zinc/01/02/12/1026010212.db2.gz YRQKSAWIKPCUGI-MRXNPFEDSA-N 1 0 331.416 3.544 20 5 EHBDRO CC(C)[C@@H](CO)[NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000530694853 1026224089 /nfs/dbraw/zinc/22/40/89/1026224089.db2.gz IYFTUFYMSUIRLI-MRXNPFEDSA-N 1 0 348.374 3.633 20 5 EHBDRO CC[C@@H]1CC[C@H](C)[N@H+](Cc2nc(-c3cccc([N+](=O)[O-])c3)no2)C1 ZINC000451963208 1026398852 /nfs/dbraw/zinc/39/88/52/1026398852.db2.gz IMLDTFIWSBAXCW-QWHCGFSZSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1cccc(CC[NH2+][C@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])n1 ZINC000475284232 1026441803 /nfs/dbraw/zinc/44/18/03/1026441803.db2.gz WEKCWWGMHXPTLX-APWZRJJASA-N 1 0 339.439 3.842 20 5 EHBDRO COc1cc(C[NH2+]C[C@]2(C)C[C@H]2c2ccccc2)c([N+](=O)[O-])cc1O ZINC000339446276 1026565262 /nfs/dbraw/zinc/56/52/62/1026565262.db2.gz SOUWWHOEGVXOIB-KXBFYZLASA-N 1 0 342.395 3.592 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@@H+](CCCO)[C@@H]2CCCc3ccccc32)c1 ZINC000531164427 1026638474 /nfs/dbraw/zinc/63/84/74/1026638474.db2.gz NZMKIVXXADUGGY-HXUWFJFHSA-N 1 0 340.423 3.857 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H](O)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000161337182 1026729674 /nfs/dbraw/zinc/72/96/74/1026729674.db2.gz YNSAAFBVNGHTFA-RBUKOAKNSA-N 1 0 344.411 3.768 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@@H](O)c1cccc(OC)c1)c1cccc([N+](=O)[O-])c1 ZINC000161337305 1026740192 /nfs/dbraw/zinc/74/01/92/1026740192.db2.gz YNSAAFBVNGHTFA-RTBURBONSA-N 1 0 344.411 3.768 20 5 EHBDRO CC1CC[NH+](CCCCNc2ncc([N+](=O)[O-])cc2Cl)CC1 ZINC000301284152 1026750298 /nfs/dbraw/zinc/75/02/98/1026750298.db2.gz PSWBFMJWZHFMRH-UHFFFAOYSA-N 1 0 326.828 3.567 20 5 EHBDRO COc1ccc(C[NH2+]C2(Cc3cccc(F)c3)CCC2)cc1[N+](=O)[O-] ZINC000479872611 1026866995 /nfs/dbraw/zinc/86/69/95/1026866995.db2.gz KNEVVJHGALABHW-UHFFFAOYSA-N 1 0 344.386 3.998 20 5 EHBDRO CCC(CC)([NH2+]CCn1cc([N+](=O)[O-])cn1)c1ccc(Cl)cc1 ZINC000472245441 1027010703 /nfs/dbraw/zinc/01/07/03/1027010703.db2.gz WFTQUKNEUDVHSD-UHFFFAOYSA-N 1 0 336.823 3.750 20 5 EHBDRO COC[C@H]([NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1)C1CC1 ZINC000121334077 1027053734 /nfs/dbraw/zinc/05/37/34/1027053734.db2.gz SMCHDEBTNCFVJI-INIZCTEOSA-N 1 0 332.425 3.838 20 5 EHBDRO C[C@H](C[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1)N1CCc2sccc2C1 ZINC000178643316 1027197359 /nfs/dbraw/zinc/19/73/59/1027197359.db2.gz ZEOSKRPJNDLEFX-ZIAGYGMSSA-N 1 0 345.468 3.754 20 5 EHBDRO CC[S@](=O)[C@@H]1CCC[C@H]([NH2+][C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC000531725933 1027247114 /nfs/dbraw/zinc/24/71/14/1027247114.db2.gz LLNSEAKZWSTOLP-JJPXPPDRSA-N 1 0 338.473 3.634 20 5 EHBDRO CCC(=O)c1ccc(NC2CC([NH+]3CCCCC3)C2)c([N+](=O)[O-])c1 ZINC000366521811 1027326694 /nfs/dbraw/zinc/32/66/94/1027326694.db2.gz BPMVKKYXKPSGJL-UHFFFAOYSA-N 1 0 331.416 3.616 20 5 EHBDRO Cc1cc([N+](=O)[O-])c(C)cc1NC(=O)NC[C@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000475556003 1027597211 /nfs/dbraw/zinc/59/72/11/1027597211.db2.gz ZRJJDNKSXBPNMV-GJZGRUSLSA-N 1 0 348.447 3.596 20 5 EHBDRO CC(=O)Nc1cccc([C@H](C)[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)c1 ZINC000293761151 1027662501 /nfs/dbraw/zinc/66/25/01/1027662501.db2.gz OXEUHSIFRNSDDK-NWDGAFQWSA-N 1 0 342.399 3.547 20 5 EHBDRO Cc1nc(N[C@H](C)[C@@H]2CC[N@H+](Cc3ccccc3)C2)ccc1[N+](=O)[O-] ZINC000310781587 1027789203 /nfs/dbraw/zinc/78/92/03/1027789203.db2.gz BQOJWUNUAQKKFM-RHSMWYFYSA-N 1 0 340.427 3.621 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](Oc2cccc(F)c2)C1 ZINC000612174538 1027911733 /nfs/dbraw/zinc/91/17/33/1027911733.db2.gz FTRCTTWJOZAUOI-FZKQIMNGSA-N 1 0 330.359 3.948 20 5 EHBDRO O=[N+]([O-])c1ccccc1OCC[NH2+][C@H](CC(F)F)c1ccccc1 ZINC000420998108 1027976925 /nfs/dbraw/zinc/97/69/25/1027976925.db2.gz SXQDNABGEMLTDY-CQSZACIVSA-N 1 0 336.338 3.960 20 5 EHBDRO CC(C)c1ccc(C(=O)Nc2ccc([C@H](C)[NH3+])cc2)cc1[N+](=O)[O-] ZINC000422870792 1028027945 /nfs/dbraw/zinc/02/79/45/1028027945.db2.gz CGPMPJUZYWJBNC-LBPRGKRZSA-N 1 0 327.384 3.990 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH+]2CCC(COc3ccccc3)CC2)cc1 ZINC000065612768 1028108843 /nfs/dbraw/zinc/10/88/43/1028108843.db2.gz YCMDBRGEUIZVGB-UHFFFAOYSA-N 1 0 326.396 3.886 20 5 EHBDRO C[C@@H]([NH2+]Cc1nc2cc([N+](=O)[O-])ccc2[nH]1)C(C)(C)c1ccccc1 ZINC000444674260 1028145747 /nfs/dbraw/zinc/14/57/47/1028145747.db2.gz OPEABPLRJQNJAO-CYBMUJFWSA-N 1 0 338.411 3.927 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCCC2(O)CCC2)o1 ZINC000421372164 1028332737 /nfs/dbraw/zinc/33/27/37/1028332737.db2.gz KNNBSQHXCZKFJN-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO COc1ccc(C[NH2+]Cc2cccc(C(F)(F)F)c2)cc1[N+](=O)[O-] ZINC000237238742 1028561079 /nfs/dbraw/zinc/56/10/79/1028561079.db2.gz AEULBLQDVOAQBH-UHFFFAOYSA-N 1 0 340.301 3.912 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cnn(C2CCCC2)c1 ZINC000502710881 1028606382 /nfs/dbraw/zinc/60/63/82/1028606382.db2.gz DVYRXHAOSCVZDH-AWEZNQCLSA-N 1 0 328.416 3.800 20 5 EHBDRO C[C@@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1cnn(C2CCCC2)c1 ZINC000502710882 1028607060 /nfs/dbraw/zinc/60/70/60/1028607060.db2.gz DVYRXHAOSCVZDH-CQSZACIVSA-N 1 0 328.416 3.800 20 5 EHBDRO COc1ccc(CC[C@H](C)[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000237254279 1028713073 /nfs/dbraw/zinc/71/30/73/1028713073.db2.gz IRRSHKOWVAIJFK-HNNXBMFYSA-N 1 0 328.412 3.757 20 5 EHBDRO C[NH+](C)[C@@H]1CCc2cc(NC(=O)Nc3ccc([N+](=O)[O-])cc3)ccc21 ZINC000454332719 1028785154 /nfs/dbraw/zinc/78/51/54/1028785154.db2.gz VVDJRFLVSQLUFR-QGZVFWFLSA-N 1 0 340.383 3.788 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1ccc([N+](=O)[O-])cc1 ZINC000162463853 1028832092 /nfs/dbraw/zinc/83/20/92/1028832092.db2.gz YNSOUXLKJDFRDA-OAHLLOKOSA-N 1 0 340.427 3.831 20 5 EHBDRO C[C@H](Sc1ccc([N+](=O)[O-])cc1)c1nc(C2([NH3+])CCCCC2)no1 ZINC000424338519 1029014110 /nfs/dbraw/zinc/01/41/10/1029014110.db2.gz AKHNPUHADCOBNS-NSHDSACASA-N 1 0 348.428 3.949 20 5 EHBDRO CCOc1ccc([C@H](C)NC[C@@H](C(C)C)[NH+]2CCCC2)cc1[N+](=O)[O-] ZINC000504906031 1029049441 /nfs/dbraw/zinc/04/94/41/1029049441.db2.gz RQQSDTYTUNCIDO-YJBOKZPZSA-N 1 0 349.475 3.765 20 5 EHBDRO CCOc1ccc([C@H](C)NCC[N@H+](C)C2CCCCC2)cc1[N+](=O)[O-] ZINC000504911322 1029052089 /nfs/dbraw/zinc/05/20/89/1029052089.db2.gz DTPOKLWSMGJLFH-HNNXBMFYSA-N 1 0 349.475 3.909 20 5 EHBDRO CCC[C@@](C)(O)C[NH2+][C@@H](CC)CSc1ccccc1[N+](=O)[O-] ZINC000504912417 1029055806 /nfs/dbraw/zinc/05/58/06/1029055806.db2.gz VYOCRIWNPWZXNL-XJKSGUPXSA-N 1 0 326.462 3.606 20 5 EHBDRO C[NH+](C)C1CCC(Oc2ccc(Br)cc2[N+](=O)[O-])CC1 ZINC001225660350 1029331820 /nfs/dbraw/zinc/33/18/20/1029331820.db2.gz CPEIKUUCQCVKBK-UHFFFAOYSA-N 1 0 343.221 3.609 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1CCCNc1ccc2cc([N+](=O)[O-])ccc2n1 ZINC000324882191 1029358766 /nfs/dbraw/zinc/35/87/66/1029358766.db2.gz QRRLXVIMQJPTJJ-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO C[C@H](Cc1ccncc1)[NH2+][C@@H]1CCC[C@H]1Cc1ccccc1[N+](=O)[O-] ZINC000513825675 1029524740 /nfs/dbraw/zinc/52/47/40/1029524740.db2.gz HPNKTRREZDITDW-HHXXYDBFSA-N 1 0 339.439 3.922 20 5 EHBDRO CCC[N@H+](Cc1cccc([N+](=O)[O-])c1C)[C@@H]1[C@H]2CCO[C@@H]2C1(C)C ZINC000524894994 1029587499 /nfs/dbraw/zinc/58/74/99/1029587499.db2.gz ZHDFBNKVZALTKC-NXHRZFHOSA-N 1 0 332.444 3.929 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)NCC(C)(C)[N@@H+]1CCC[C@@H](C)C1 ZINC000446488544 1029659471 /nfs/dbraw/zinc/65/94/71/1029659471.db2.gz NVYYDQFDQDUMAW-CYBMUJFWSA-N 1 0 348.447 3.535 20 5 EHBDRO COc1ccc2oc(C[NH2+]Cc3ccc(OC)c([N+](=O)[O-])c3)cc2c1 ZINC000343188010 1029680676 /nfs/dbraw/zinc/68/06/76/1029680676.db2.gz NERPXQZQBYEVNL-UHFFFAOYSA-N 1 0 342.351 3.648 20 5 EHBDRO C[C@H]1C[C@@H](Nc2ncc([N+](=O)[O-])s2)CC[N@@H+]1Cc1ccccc1 ZINC000192480582 1029684666 /nfs/dbraw/zinc/68/46/66/1029684666.db2.gz HDPGSRLYTSFHNX-JSGCOSHPSA-N 1 0 332.429 3.516 20 5 EHBDRO CC[C@@H](C[C@H](C)CO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000525246128 1029755924 /nfs/dbraw/zinc/75/59/24/1029755924.db2.gz NMPWJKFSHMQQCY-KBPBESRZSA-N 1 0 332.400 3.742 20 5 EHBDRO CCn1nc(C)c([N+](=O)[O-])c1NCc1cccc(C[NH+](CC)CC)c1 ZINC000192507731 1029814166 /nfs/dbraw/zinc/81/41/66/1029814166.db2.gz WHGTWMXMKIMGMB-UHFFFAOYSA-N 1 0 345.447 3.574 20 5 EHBDRO CCO[C@H]1C[C@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC000525407734 1029839634 /nfs/dbraw/zinc/83/96/34/1029839634.db2.gz HLAMISMXLMIVHU-GJZGRUSLSA-N 1 0 326.824 3.884 20 5 EHBDRO CCOC(=O)[C@@]1(C(C)C)CC[N@H+](C/C=C/c2ccccc2[N+](=O)[O-])C1 ZINC000446890944 1029842557 /nfs/dbraw/zinc/84/25/57/1029842557.db2.gz RKEAYSJBNSWOIL-XSBJJCPUSA-N 1 0 346.427 3.519 20 5 EHBDRO COc1ccc(CC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c(OC)c1 ZINC000481739428 1029897397 /nfs/dbraw/zinc/89/73/97/1029897397.db2.gz GJLNGMZJFOPVML-CQSZACIVSA-N 1 0 344.411 3.814 20 5 EHBDRO Cc1nccn1CCCCSCCOc1ccc([N+](=O)[O-])cc1 ZINC000600568526 1029998375 /nfs/dbraw/zinc/99/83/75/1029998375.db2.gz IFCFQJBWWCTYGW-UHFFFAOYSA-N 1 0 335.429 3.692 20 5 EHBDRO CC(C)[C@@H]1C[C@H](C[NH2+][C@@H](Cc2ccccc2[N+](=O)[O-])C2CC2)CCO1 ZINC000453318876 1030098012 /nfs/dbraw/zinc/09/80/12/1030098012.db2.gz MEZBVTYBFFTMFO-BPAFIMBUSA-N 1 0 346.471 3.957 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)c1 ZINC000531937730 1030100571 /nfs/dbraw/zinc/10/05/71/1030100571.db2.gz HZVPEOJFULLREX-ZDUSSCGKSA-N 1 0 327.384 3.794 20 5 EHBDRO Cc1ccc([C@H](C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)N(C)C)cc1 ZINC000481956220 1030133321 /nfs/dbraw/zinc/13/33/21/1030133321.db2.gz CBDLHGSNLVKVCV-BEFAXECRSA-N 1 0 327.428 3.857 20 5 EHBDRO CCn1nc(C)c(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)c1C ZINC000531965817 1030153287 /nfs/dbraw/zinc/15/32/87/1030153287.db2.gz DZRSXIWNGNRNJW-GOSISDBHSA-N 1 0 342.443 3.539 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@H+](CCc1ccc2c(c1)CCO2)C1CC1 ZINC000441248425 1030154755 /nfs/dbraw/zinc/15/47/55/1030154755.db2.gz AISPZZBLFROJPN-UHFFFAOYSA-N 1 0 338.407 3.737 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(C)cn2)cc1[N+](=O)[O-] ZINC000453406264 1030214471 /nfs/dbraw/zinc/21/44/71/1030214471.db2.gz CKQVUUFYAIHHEU-AWEZNQCLSA-N 1 0 329.400 3.590 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@@H]2[NH2+]CCc2cccc(Cl)c2)n1 ZINC000447519121 1030242425 /nfs/dbraw/zinc/24/24/25/1030242425.db2.gz XSZNLTNZEZWXHC-HOTGVXAUSA-N 1 0 348.834 3.761 20 5 EHBDRO COc1ccccc1CC[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000447506437 1030252701 /nfs/dbraw/zinc/25/27/01/1030252701.db2.gz CNAMROGAZVIVJR-SFHVURJKSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]Cc2cccc(Cl)c2)n1 ZINC000447510959 1030258086 /nfs/dbraw/zinc/25/80/86/1030258086.db2.gz REUCWOSPOHWTRB-HUUCEWRRSA-N 1 0 334.807 3.718 20 5 EHBDRO C[C@H](C[NH2+][C@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1)c1ccccc1 ZINC000447513083 1030260218 /nfs/dbraw/zinc/26/02/18/1030260218.db2.gz SOFRRUCLHNFPER-PVAVHDDUSA-N 1 0 328.416 3.668 20 5 EHBDRO CO[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccccc1 ZINC000447559612 1030301623 /nfs/dbraw/zinc/30/16/23/1030301623.db2.gz AEQFEGGEJQQCTL-MOPGFXCFSA-N 1 0 326.396 3.950 20 5 EHBDRO Cc1cccc(C)c1CC[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000447587234 1030323853 /nfs/dbraw/zinc/32/38/53/1030323853.db2.gz QNJSDEWREJIVPC-ZWKOTPCHSA-N 1 0 342.443 3.724 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC3(CC2)OCCc2ccccc23)c1 ZINC000453570662 1030340423 /nfs/dbraw/zinc/34/04/23/1030340423.db2.gz DFLGXRGLUQHUNK-UHFFFAOYSA-N 1 0 338.407 3.659 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cnn1C(C)(C)C ZINC000526050468 1030372977 /nfs/dbraw/zinc/37/29/77/1030372977.db2.gz RARVCDLGMOQAJY-CYBMUJFWSA-N 1 0 346.431 3.584 20 5 EHBDRO C[C@@H]1C[N@H+](CCc2ncc(-c3cccc([N+](=O)[O-])c3)o2)C(C)(C)C1 ZINC000472297620 1030381079 /nfs/dbraw/zinc/38/10/79/1030381079.db2.gz WBIXLBSAGRSCPS-ZDUSSCGKSA-N 1 0 329.400 3.913 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+]C[C@@H]3CC[C@H](C)O3)o2)c([N+](=O)[O-])c1 ZINC000453631583 1030432570 /nfs/dbraw/zinc/43/25/70/1030432570.db2.gz OAMWBRBKAKUCFQ-JSGCOSHPSA-N 1 0 346.383 3.521 20 5 EHBDRO CCC(=O)Nc1cccc(C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000532194205 1030469206 /nfs/dbraw/zinc/46/92/06/1030469206.db2.gz MWZRTTCVGCLFRP-ZDUSSCGKSA-N 1 0 327.384 3.794 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]Cc1cc(F)ccc1F)C1CC1 ZINC000482550258 1030522624 /nfs/dbraw/zinc/52/26/24/1030522624.db2.gz BKECMNOTCBEVFG-KRWDZBQOSA-N 1 0 332.350 3.984 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C2CCN(C(=O)CC(C)C)CC2)cc1[N+](=O)[O-] ZINC000163429202 1030557612 /nfs/dbraw/zinc/55/76/12/1030557612.db2.gz CFEMBSNGHHIJSS-OAHLLOKOSA-N 1 0 347.459 3.591 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CC3(O)CCCCC3)o2)cc1 ZINC000171052229 1030571434 /nfs/dbraw/zinc/57/14/34/1030571434.db2.gz BBMPFBFGCQWEPN-UHFFFAOYSA-N 1 0 330.384 3.640 20 5 EHBDRO CC(C)N(Cc1cn2ccsc2n1)Cc1ccc([N+](=O)[O-])cc1 ZINC000171079578 1030837958 /nfs/dbraw/zinc/83/79/58/1030837958.db2.gz HJYUXFZCMTUVEZ-UHFFFAOYSA-N 1 0 330.413 3.715 20 5 EHBDRO C[N@H+](CC[C@@H]1CCCO1)Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000343440271 1030900474 /nfs/dbraw/zinc/90/04/74/1030900474.db2.gz JFLAKDJQKYNELE-INIZCTEOSA-N 1 0 330.384 3.856 20 5 EHBDRO C[N@H+](CC[C@H]1CCCO1)Cc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000343458384 1030974780 /nfs/dbraw/zinc/97/47/80/1030974780.db2.gz CRRKQLGESBGNNC-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO C[C@@H](CCNc1ccc([N+](=O)[O-])c2cccnc12)[NH+]1CCCCC1 ZINC000302164311 1030987196 /nfs/dbraw/zinc/98/71/96/1030987196.db2.gz OMXDXIABFQJEDG-AWEZNQCLSA-N 1 0 328.416 3.819 20 5 EHBDRO CC1(C)C[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C[C@H]1O ZINC000448373542 1031008529 /nfs/dbraw/zinc/00/85/29/1031008529.db2.gz QXENEWKJHXDPNB-MRXNPFEDSA-N 1 0 332.425 3.526 20 5 EHBDRO COc1ccc(C[NH+]2CCCC2)cc1OCc1ccc([N+](=O)[O-])cc1 ZINC000127932159 1031137834 /nfs/dbraw/zinc/13/78/34/1031137834.db2.gz RXYJMOFCMREMJL-UHFFFAOYSA-N 1 0 342.395 3.778 20 5 EHBDRO C[C@@H](CO)CCC[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000536163988 1031141337 /nfs/dbraw/zinc/14/13/37/1031141337.db2.gz YMMUKAPUKATRIN-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc([N+](=O)[O-])cc2)[C@H]1c1ccc(Cl)cc1 ZINC000551351982 1031241281 /nfs/dbraw/zinc/24/12/81/1031241281.db2.gz NORXQVIFOHBHHJ-ZWKOTPCHSA-N 1 0 345.830 3.783 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]CCc2ccc3c(c2)OCO3)cccc1[N+](=O)[O-] ZINC000161128970 1031349358 /nfs/dbraw/zinc/34/93/58/1031349358.db2.gz XBMJGNOFVHSSLF-CYBMUJFWSA-N 1 0 328.368 3.525 20 5 EHBDRO CC(C)[NH2+]C1CCN(c2c(Cl)cc(Cl)cc2[N+](=O)[O-])CC1 ZINC000584032119 1031509339 /nfs/dbraw/zinc/50/93/39/1031509339.db2.gz SDXMDZYTAJJEPQ-UHFFFAOYSA-N 1 0 332.231 3.868 20 5 EHBDRO CC1(C)C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CC[C@@H]1C(F)(F)F ZINC000484340120 1031535782 /nfs/dbraw/zinc/53/57/82/1031535782.db2.gz MPDNKLKYRMMMNR-AWEZNQCLSA-N 1 0 346.349 3.884 20 5 EHBDRO Cc1ccc([C@@H](C)[N@H+](C)CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000052907657 1032000727 /nfs/dbraw/zinc/00/07/27/1032000727.db2.gz APTCORVEGMEDKO-OAHLLOKOSA-N 1 0 341.411 3.559 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H](CO)c1ccc(Cl)cc1 ZINC000594516708 1033421861 /nfs/dbraw/zinc/42/18/61/1033421861.db2.gz CWGJDTPVHJNWLK-CXAGYDPISA-N 1 0 346.814 3.601 20 5 EHBDRO COc1cccc2c1OCC[C@H]2[NH2+]Cc1ccc([N+](=O)[O-])cc1C ZINC000594522504 1033428507 /nfs/dbraw/zinc/42/85/07/1033428507.db2.gz JGDBDJNXZPHINJ-MRXNPFEDSA-N 1 0 328.368 3.525 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CCCN2CCCC[C@@H]12 ZINC000594520389 1033429534 /nfs/dbraw/zinc/42/95/34/1033429534.db2.gz OCCPLGCGJVBRNV-SUMDDJOVSA-N 1 0 331.460 3.522 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@H]2CCC[N@@H+]3CCCC[C@@H]23)c2ccncc21 ZINC000594596696 1033444448 /nfs/dbraw/zinc/44/44/48/1033444448.db2.gz BEDQPNFWQPHNQO-WMZOPIPTSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(N[C@H]3CCC[N@@H+]4CCCC[C@H]34)c2c1 ZINC000594599886 1033445874 /nfs/dbraw/zinc/44/58/74/1033445874.db2.gz KAYVLJIRRCHUNT-DLBZAZTESA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCc2ccc(Br)s2)cc1 ZINC000063560206 1033452419 /nfs/dbraw/zinc/45/24/19/1033452419.db2.gz AUPNPYLDFIBZBN-UHFFFAOYSA-N 1 0 341.230 3.751 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H](C)CCc1ccc(O)cc1 ZINC000595014995 1033608937 /nfs/dbraw/zinc/60/89/37/1033608937.db2.gz XFVJYXOFUGNZFS-UONOGXRCSA-N 1 0 344.411 3.981 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+][C@@H]1CCOC2(CCCC2)C1 ZINC000595021347 1033614982 /nfs/dbraw/zinc/61/49/82/1033614982.db2.gz CGIPJXJLLIWKQT-ZIAGYGMSSA-N 1 0 334.416 3.746 20 5 EHBDRO C[C@H]1CCC[C@@H](C[NH2+]Cc2csc(-c3cccc([N+](=O)[O-])c3)n2)O1 ZINC000594986226 1033619725 /nfs/dbraw/zinc/61/97/25/1033619725.db2.gz UMEVLBBIXNOVHE-LRDDRELGSA-N 1 0 347.440 3.766 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@@H]2CCN2C(C)(C)C)cc1[N+](=O)[O-] ZINC000595054952 1033632094 /nfs/dbraw/zinc/63/20/94/1033632094.db2.gz XRZZHCUCIULDMU-ZFWWWQNUSA-N 1 0 335.448 3.517 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]Cc2cccnc2N2CCCC2)cccc1[N+](=O)[O-] ZINC000595067169 1033644621 /nfs/dbraw/zinc/64/46/21/1033644621.db2.gz KEEJTMZBNQZZMU-OAHLLOKOSA-N 1 0 340.427 3.749 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)C12CCC2 ZINC000595027127 1033648277 /nfs/dbraw/zinc/64/82/77/1033648277.db2.gz PZEJMXUMYVIQNR-JCURWCKSSA-N 1 0 334.416 3.602 20 5 EHBDRO CCc1cnccc1[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595029585 1033650954 /nfs/dbraw/zinc/65/09/54/1033650954.db2.gz ZREGFAXQTFPQSW-OLZOCXBDSA-N 1 0 329.400 3.973 20 5 EHBDRO Cc1cc(N[C@H](C)C2CC[NH+](C)CC2)c2cccc([N+](=O)[O-])c2n1 ZINC000599045106 1033676107 /nfs/dbraw/zinc/67/61/07/1033676107.db2.gz VBLDCLLXFQESOH-CYBMUJFWSA-N 1 0 328.416 3.594 20 5 EHBDRO C[C@@H]([NH2+]C[C@H]1CCN1Cc1ccccc1)c1ccc([N+](=O)[O-])cc1 ZINC000595103625 1033691325 /nfs/dbraw/zinc/69/13/25/1033691325.db2.gz NFWLVERKDCCDOM-DNVCBOLYSA-N 1 0 325.412 3.520 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](O)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595104918 1033691964 /nfs/dbraw/zinc/69/19/64/1033691964.db2.gz AETSHWYITOEDCG-JSNMRZPZSA-N 1 0 340.423 3.726 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2C[C@H](O)C23CCC3)c2ccccc2)c1 ZINC000595088857 1033698104 /nfs/dbraw/zinc/69/81/04/1033698104.db2.gz DYDPPYUBRFPYHZ-GBESFXJTSA-N 1 0 338.407 3.577 20 5 EHBDRO COc1cccc([C@H](C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])OC)c1 ZINC000599058769 1033698725 /nfs/dbraw/zinc/69/87/25/1033698725.db2.gz UZNOHCOSIILPBV-MJGOQNOKSA-N 1 0 342.395 3.568 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@H](CSc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595327386 1033728549 /nfs/dbraw/zinc/72/85/49/1033728549.db2.gz RDXQXUQOGUIZPT-ZDUSSCGKSA-N 1 0 333.413 3.505 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@@H](CSc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595327385 1033729665 /nfs/dbraw/zinc/72/96/65/1033729665.db2.gz RDXQXUQOGUIZPT-CYBMUJFWSA-N 1 0 333.413 3.505 20 5 EHBDRO COc1ccc([C@H]2CC[N@H+](Cc3ccc(F)cc3[N+](=O)[O-])C2)cc1 ZINC000595304125 1033738455 /nfs/dbraw/zinc/73/84/55/1033738455.db2.gz NUUAWWUZWAIALO-AWEZNQCLSA-N 1 0 330.359 3.732 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+]C1(c2ccc(F)cc2)CCOCC1 ZINC000595374136 1033783225 /nfs/dbraw/zinc/78/32/25/1033783225.db2.gz YHWDEXUZNDIJCV-UHFFFAOYSA-N 1 0 348.349 3.669 20 5 EHBDRO Cc1noc(C[NH2+][C@@H](C)C2(c3ccccc3)CCCC2)c1[N+](=O)[O-] ZINC000595442499 1033806583 /nfs/dbraw/zinc/80/65/83/1033806583.db2.gz UIERGBNFSVFXCD-AWEZNQCLSA-N 1 0 329.400 3.881 20 5 EHBDRO CC[C@H]([NH2+]Cc1cnc(C(F)(F)F)nc1)c1cccc([N+](=O)[O-])c1 ZINC000593017845 1033817916 /nfs/dbraw/zinc/81/79/16/1033817916.db2.gz CELXTKLRPGLQRV-ZDUSSCGKSA-N 1 0 340.305 3.645 20 5 EHBDRO CC[C@H]([NH2+]C[C@]1(CO)CCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000593714895 1033821548 /nfs/dbraw/zinc/82/15/48/1033821548.db2.gz GBKGSKTWQIAMQW-PMACEKPBSA-N 1 0 340.423 3.512 20 5 EHBDRO CC(C)c1ccc(C[NH2+]CCN(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000603633416 1033823046 /nfs/dbraw/zinc/82/30/46/1033823046.db2.gz DRVOJOLMKALFRI-UHFFFAOYSA-N 1 0 327.428 3.944 20 5 EHBDRO Cc1ccccc1[C@@H]1C[C@H]1[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1 ZINC000593721527 1033847244 /nfs/dbraw/zinc/84/72/44/1033847244.db2.gz VSOSCFYQYKGURR-WNRNVDISSA-N 1 0 340.427 3.729 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)N1CCC[N@@H+](C(C)(C)C)CC1 ZINC000547332436 1033882019 /nfs/dbraw/zinc/88/20/19/1033882019.db2.gz KYRUKLZDRZJSPC-UHFFFAOYSA-N 1 0 348.447 3.550 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccc(F)cc3)CC2)s1 ZINC000064029356 1033944309 /nfs/dbraw/zinc/94/43/09/1033944309.db2.gz ONNNBDFPNASOKL-UHFFFAOYSA-N 1 0 335.404 3.508 20 5 EHBDRO CC[C@@H]1CC[C@@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000595783462 1033998072 /nfs/dbraw/zinc/99/80/72/1033998072.db2.gz ONSLEMHHASMHTA-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1ccc(C(C)(C)[NH2+]CCOc2ccccc2[N+](=O)[O-])cc1F ZINC000599599740 1034042495 /nfs/dbraw/zinc/04/24/95/1034042495.db2.gz SAMZODMMVQTPBQ-UHFFFAOYSA-N 1 0 348.374 3.646 20 5 EHBDRO C[NH2+]C[C@H](C)NCc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000596106334 1034064360 /nfs/dbraw/zinc/06/43/60/1034064360.db2.gz OKYVHILNUZGHOW-LBPRGKRZSA-N 1 0 349.818 3.738 20 5 EHBDRO C[NH2+]C[C@H](C)NCc1ccc(Oc2ccc(Cl)cc2[N+](=O)[O-])cc1 ZINC000596105245 1034064839 /nfs/dbraw/zinc/06/48/39/1034064839.db2.gz ICPLEMGWZMEIMQ-LBPRGKRZSA-N 1 0 349.818 3.738 20 5 EHBDRO C[N@@H+]1CCC[C@@H]2CN(c3ccc(C(F)(F)F)c([N+](=O)[O-])c3)CC[C@H]21 ZINC000596168105 1034116019 /nfs/dbraw/zinc/11/60/19/1034116019.db2.gz KREUFOZHKROQKL-BXUZGUMPSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(NCC2CC[NH+](Cc3ccccc3)CC2)cc1 ZINC000060082130 1034169525 /nfs/dbraw/zinc/16/95/25/1034169525.db2.gz BYAXEYYUJYRZRI-UHFFFAOYSA-N 1 0 325.412 3.919 20 5 EHBDRO O=[N+]([O-])c1ccccc1NCC1CC[NH+](Cc2ccccc2)CC1 ZINC000060082133 1034169678 /nfs/dbraw/zinc/16/96/78/1034169678.db2.gz KWEXORQFJQPPPB-UHFFFAOYSA-N 1 0 325.412 3.919 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]Cc2ccc([C@@H](C)O)cc2)cc1[N+](=O)[O-] ZINC000179406792 1034279363 /nfs/dbraw/zinc/27/93/63/1034279363.db2.gz LUEIYBIKKWIFHM-ZIAGYGMSSA-N 1 0 344.411 3.898 20 5 EHBDRO C[C@@H](NCC12CC(C1)C[NH2+]2)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000596655886 1034330059 /nfs/dbraw/zinc/33/00/59/1034330059.db2.gz ZDMPELIFBZGXLF-WHENESEISA-N 1 0 343.452 3.726 20 5 EHBDRO CCN1CCC[C@@H]1C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000604538789 1034416624 /nfs/dbraw/zinc/41/66/24/1034416624.db2.gz JTJSYWHPVAWLLO-CQSZACIVSA-N 1 0 345.468 3.897 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1OC ZINC000120106179 1034448198 /nfs/dbraw/zinc/44/81/98/1034448198.db2.gz NPFLQXSMLUGRKU-AWEZNQCLSA-N 1 0 344.411 3.814 20 5 EHBDRO CC(C)[NH2+]C1CCN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000179833410 1034737336 /nfs/dbraw/zinc/73/73/36/1034737336.db2.gz MGRXNXIRQPTRBI-UHFFFAOYSA-N 1 0 343.427 3.817 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@@H](Oc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000612403793 1034894579 /nfs/dbraw/zinc/89/45/79/1034894579.db2.gz CUADPUGCSXSWJX-QGZVFWFLSA-N 1 0 330.359 3.696 20 5 EHBDRO C[N@H+](CCCOCc1ccccc1)CCc1cccc([N+](=O)[O-])c1 ZINC000548935474 1034997310 /nfs/dbraw/zinc/99/73/10/1034997310.db2.gz MTKMZKUGZSQIIB-UHFFFAOYSA-N 1 0 328.412 3.676 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@@H](C)c2cc(C)sc2C)c1[N+](=O)[O-] ZINC000892510248 1035175117 /nfs/dbraw/zinc/17/51/17/1035175117.db2.gz VOZZQXCCTFOHHD-JTQLQIEISA-N 1 0 336.413 3.838 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+]CCCn2cccn2)c2ccccc2)c1 ZINC000180053439 1035300119 /nfs/dbraw/zinc/30/01/19/1035300119.db2.gz IPHHFAPVTKPNPV-IBGZPJMESA-N 1 0 336.395 3.561 20 5 EHBDRO CC1(C)C[C@H](N[C@H]2CC[N@@H+]3CCCC[C@H]23)c2cc([N+](=O)[O-])ccc21 ZINC000580390420 1035434340 /nfs/dbraw/zinc/43/43/40/1035434340.db2.gz XJCHAXOGYFCURI-OKZBNKHCSA-N 1 0 329.444 3.534 20 5 EHBDRO O=[N+]([O-])c1ccc(NC2CC[NH+](CCc3ccccc3)CC2)s1 ZINC000066410768 1035448011 /nfs/dbraw/zinc/44/80/11/1035448011.db2.gz HSTVGTQJYSGYJO-UHFFFAOYSA-N 1 0 331.441 3.775 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+]1CCCN(c2ccccc2)CC1 ZINC000511460749 1035473043 /nfs/dbraw/zinc/47/30/43/1035473043.db2.gz MUDQTTOAUDYIRC-RMKNXTFCSA-N 1 0 337.423 3.820 20 5 EHBDRO CC[C@@H](CN[C@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F)[NH+]1CCCC1 ZINC000581315203 1035483843 /nfs/dbraw/zinc/48/38/43/1035483843.db2.gz VQPBSINOEVVULO-DZGCQCFKSA-N 1 0 345.365 3.662 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CSc2ccccc2O1)c1cccc([N+](=O)[O-])c1 ZINC000571761246 1035623387 /nfs/dbraw/zinc/62/33/87/1035623387.db2.gz CNTHVQUVMYBDLJ-IUODEOHRSA-N 1 0 330.409 3.799 20 5 EHBDRO CCOc1cc(C[NH+]2CCC(C3CCOCC3)CC2)ccc1[N+](=O)[O-] ZINC000581868308 1035645617 /nfs/dbraw/zinc/64/56/17/1035645617.db2.gz RVBSEGNQPNHQMD-UHFFFAOYSA-N 1 0 348.443 3.632 20 5 EHBDRO CCO[C@@H]1C[C@H]([NH2+]CCc2c[nH]c3ccc([N+](=O)[O-])cc23)C12CCC2 ZINC000581967310 1035662876 /nfs/dbraw/zinc/66/28/76/1035662876.db2.gz NDQWVNBNLWZVCO-ZWKOTPCHSA-N 1 0 343.427 3.556 20 5 EHBDRO CCC1([NH2+]Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCOCC1 ZINC000534902028 1035764099 /nfs/dbraw/zinc/76/40/99/1035764099.db2.gz XZYDIMIXHGVDAN-UHFFFAOYSA-N 1 0 330.384 3.904 20 5 EHBDRO Cc1cc(NCc2noc3ccccc23)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000571817543 1035768184 /nfs/dbraw/zinc/76/81/84/1035768184.db2.gz ZDHHJDKMAGZVDY-UHFFFAOYSA-N 1 0 334.335 3.627 20 5 EHBDRO CC(C)(C)Oc1cc(N[C@H]2CC[N@@H+]3CCC[C@H]3C2)ccc1[N+](=O)[O-] ZINC000443422987 1035777930 /nfs/dbraw/zinc/77/79/30/1035777930.db2.gz AIPVKCZTZVDCHD-GJZGRUSLSA-N 1 0 333.432 3.811 20 5 EHBDRO C[C@@H](CCCO)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000088762811 1035908276 /nfs/dbraw/zinc/90/82/76/1035908276.db2.gz XAXBXBZTVOUTAT-HNNXBMFYSA-N 1 0 343.427 3.613 20 5 EHBDRO COc1cccc2c1C[C@@H]([NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1)C2 ZINC000414193266 1035990431 /nfs/dbraw/zinc/99/04/31/1035990431.db2.gz SVXLLASZUISAHV-CJNGLKHVSA-N 1 0 326.396 3.730 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH+]2CCC3(CC2)OCCc2ccsc23)c1 ZINC000492603368 1036057759 /nfs/dbraw/zinc/05/77/59/1036057759.db2.gz SYXFJQDONIVUEX-UHFFFAOYSA-N 1 0 344.436 3.720 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC2(CCC2)[C@@H]1[C@H]1CCCO1 ZINC000589300214 1036329080 /nfs/dbraw/zinc/32/90/80/1036329080.db2.gz DZPLUVRBFZUSFE-QGTPRVQTSA-N 1 0 330.428 3.998 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2CCC[C@@]3(CC=CCC3)C2)c1 ZINC000589500077 1036440807 /nfs/dbraw/zinc/44/08/07/1036440807.db2.gz QXFGMDVUMSYHOA-IBGZPJMESA-N 1 0 344.411 3.704 20 5 EHBDRO CC(C)CC[C@H](O)C[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000572632485 1036457870 /nfs/dbraw/zinc/45/78/70/1036457870.db2.gz HBRCAMYDLGJHNQ-AWEZNQCLSA-N 1 0 334.338 3.500 20 5 EHBDRO COc1cc(C[NH2+][C@H](C)[C@@H]2Oc3ccccc3[C@@H]2C)ccc1[N+](=O)[O-] ZINC000541685003 1036570430 /nfs/dbraw/zinc/57/04/30/1036570430.db2.gz JMLOCNBYQGEDKJ-XEKQOVJPSA-N 1 0 342.395 3.646 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)c([N+](=O)[O-])cc1F ZINC000464681205 1036656647 /nfs/dbraw/zinc/65/66/47/1036656647.db2.gz ZNLMJFWDZZBWSE-ZDUSSCGKSA-N 1 0 348.349 3.871 20 5 EHBDRO Cc1cc(N[C@@H]2CC[N@@H+]3CCC[C@H]3C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590135534 1036785349 /nfs/dbraw/zinc/78/53/49/1036785349.db2.gz OASBPCYQDKYZBE-NEPJUHHUSA-N 1 0 343.349 3.961 20 5 EHBDRO CSc1ccc(NC(=O)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000180439380 1036826895 /nfs/dbraw/zinc/82/68/95/1036826895.db2.gz WKKWHNNJYFZLRN-LBPRGKRZSA-N 1 0 345.424 3.606 20 5 EHBDRO CC(C)[C@](C)(O)C[NH2+][C@@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180528183 1036918926 /nfs/dbraw/zinc/91/89/26/1036918926.db2.gz KDLNFJOAUYJPJO-RBUKOAKNSA-N 1 0 328.412 3.681 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccccc3)CC2)c(Cl)c1 ZINC000166154010 1036931605 /nfs/dbraw/zinc/93/16/05/1036931605.db2.gz HROHAZDULIOATJ-UHFFFAOYSA-N 1 0 345.830 3.961 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]CCCOc2ccc(F)cc2)cc1Cl ZINC000761521501 1037097780 /nfs/dbraw/zinc/09/77/80/1037097780.db2.gz IDBIOJKABJREID-UHFFFAOYSA-N 1 0 338.766 3.946 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2ccc(C[NH+]3CCC(CCCO)CC3)o2)c1 ZINC000542174166 1037135878 /nfs/dbraw/zinc/13/58/78/1037135878.db2.gz HNCOLNFSCSTVMY-UHFFFAOYSA-N 1 0 344.411 3.839 20 5 EHBDRO CC(C)C[C@H]1CCC[N@@H+]1Cc1nc(-c2cccc([N+](=O)[O-])c2)no1 ZINC000130247309 1037219840 /nfs/dbraw/zinc/21/98/40/1037219840.db2.gz HSUGGOVKZYAFTP-CQSZACIVSA-N 1 0 330.388 3.655 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@]1(C)CCCc2ccccc21 ZINC000539807754 1037220353 /nfs/dbraw/zinc/22/03/53/1037220353.db2.gz HUMIMNOWZWIHDE-IBGZPJMESA-N 1 0 326.396 3.945 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CN[C@@H]3CC[NH2+]C4(CCC4)C3)o2)cc1 ZINC000591282640 1037318905 /nfs/dbraw/zinc/31/89/05/1037318905.db2.gz ITXFLOFHSNEOMK-OAHLLOKOSA-N 1 0 341.411 3.619 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H]([NH2+][C@@H]2CCc3n[nH]cc3C2)c2ccccc2)c1 ZINC000180949640 1037341080 /nfs/dbraw/zinc/34/10/80/1037341080.db2.gz BYSAXISKHRIREP-XLIONFOSSA-N 1 0 348.406 3.554 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)Cc2cc(C)cc(C)c2)cc1[N+](=O)[O-] ZINC000462735768 1037341701 /nfs/dbraw/zinc/34/17/01/1037341701.db2.gz DOQPPKSHHPLGFZ-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(OCCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000532465006 1037370394 /nfs/dbraw/zinc/37/03/94/1037370394.db2.gz AWBPQZSZJNQPME-CQSZACIVSA-N 1 0 330.384 3.723 20 5 EHBDRO CC[NH+](CC)CCC[C@@H](C)Nc1nc(-c2ccc([N+](=O)[O-])cc2)no1 ZINC000152892923 1037375016 /nfs/dbraw/zinc/37/50/16/1037375016.db2.gz SYJRFXFLXMGWIF-CYBMUJFWSA-N 1 0 347.419 3.567 20 5 EHBDRO Cc1cc(N2CCC[C@]3(CC[NH2+]C3)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000591440632 1037408722 /nfs/dbraw/zinc/40/87/22/1037408722.db2.gz AQCPZOVJUAATIB-OAHLLOKOSA-N 1 0 343.349 3.502 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2cc([N+](=O)[O-])ccc2F)cc1 ZINC000129725273 1037423752 /nfs/dbraw/zinc/42/37/52/1037423752.db2.gz DJACYBGSVWNCES-ZDUSSCGKSA-N 1 0 345.374 3.722 20 5 EHBDRO Cc1ccc(Sc2ccc(C[N@@H+](C)C[C@@H](C)O)cc2[N+](=O)[O-])cc1 ZINC000462830259 1037433532 /nfs/dbraw/zinc/43/35/32/1037433532.db2.gz BMBLDALHLYUYJE-CQSZACIVSA-N 1 0 346.452 3.867 20 5 EHBDRO C[C@@H]([NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1c(F)cccc1Cl ZINC000271839863 1037434274 /nfs/dbraw/zinc/43/42/74/1037434274.db2.gz ZBMAQOVLQRHPLV-BMIGLBTASA-N 1 0 338.766 3.772 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc(F)cc1Cl ZINC000271844838 1037474582 /nfs/dbraw/zinc/47/45/82/1037474582.db2.gz WQJSHGWMRMFBFI-QLJPJBMISA-N 1 0 338.766 3.772 20 5 EHBDRO CCOc1cc(C[N@H+](CCOC)[C@@H]2CC[C@@H](C)C2)ccc1[N+](=O)[O-] ZINC000493601345 1037486301 /nfs/dbraw/zinc/48/63/01/1037486301.db2.gz BOXHHPOAESDGLA-GDBMZVCRSA-N 1 0 336.432 3.631 20 5 EHBDRO CC1(C)[C@@H](O)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000462871957 1037500820 /nfs/dbraw/zinc/50/08/20/1037500820.db2.gz RTAWQAVWLLEQSQ-INIZCTEOSA-N 1 0 332.425 3.669 20 5 EHBDRO CCc1ccc([C@H](NCCC[NH2+]C(C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591577284 1037515618 /nfs/dbraw/zinc/51/56/18/1037515618.db2.gz LUFKIIXSRWWJKZ-LJQANCHMSA-N 1 0 345.443 3.817 20 5 EHBDRO Cc1ccnc(NC[C@@H]2CCC[N@H+](Cc3ccccc3)C2)c1[N+](=O)[O-] ZINC000311171153 1037516672 /nfs/dbraw/zinc/51/66/72/1037516672.db2.gz SUQSETMRCZAANT-KRWDZBQOSA-N 1 0 340.427 3.622 20 5 EHBDRO CC[NH+](CC)[C@@H](CNc1ncc(C)cc1[N+](=O)[O-])Cc1ccccc1 ZINC000463053129 1037704142 /nfs/dbraw/zinc/70/41/42/1037704142.db2.gz IKFVKPMWHZFXQV-QGZVFWFLSA-N 1 0 342.443 3.663 20 5 EHBDRO CC[C@@H](C)[C@@H]1CCCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000532587416 1037709478 /nfs/dbraw/zinc/70/94/78/1037709478.db2.gz ZHWWHSHKFOILSK-HIFRSBDPSA-N 1 0 333.432 3.742 20 5 EHBDRO CN(CC[C@@H]1CCCC[N@@H+]1C)c1ccc([N+](=O)[O-])c(OC(F)F)c1 ZINC000463080537 1037727320 /nfs/dbraw/zinc/72/73/20/1037727320.db2.gz ZNOAWBRTYTWJPJ-LBPRGKRZSA-N 1 0 343.374 3.507 20 5 EHBDRO O=C(Nc1cccc(C[NH+]2CCCCC2)c1)c1ccc([N+](=O)[O-])s1 ZINC000031620983 1037745377 /nfs/dbraw/zinc/74/53/77/1037745377.db2.gz NADCOSOCZFIHEX-UHFFFAOYSA-N 1 0 345.424 3.895 20 5 EHBDRO C[NH2+]Cc1ccc(NC(=O)N[C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000415970084 1037756261 /nfs/dbraw/zinc/75/62/61/1037756261.db2.gz GZHUPSMSCKGROJ-CYBMUJFWSA-N 1 0 342.399 3.505 20 5 EHBDRO CC[C@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1 ZINC000341220236 1037784485 /nfs/dbraw/zinc/78/44/85/1037784485.db2.gz PMBXVCVRYONYBR-KRWDZBQOSA-N 1 0 327.384 3.664 20 5 EHBDRO COC(=O)CC(C)(C)C[C@@H](C)[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897459515 1037837355 /nfs/dbraw/zinc/83/73/55/1037837355.db2.gz ACURGCGITCJUFW-UONOGXRCSA-N 1 0 336.432 3.656 20 5 EHBDRO C[N@H+](CCC(C)(C)C)CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000592145362 1037866443 /nfs/dbraw/zinc/86/64/43/1037866443.db2.gz WFSGMZKCMKVNSF-UHFFFAOYSA-N 1 0 327.812 3.555 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+][C@H](c2ccccc2)C2(CO)CC=CC2)c1 ZINC000592175283 1037916714 /nfs/dbraw/zinc/91/67/14/1037916714.db2.gz JSJQRTIGKRVTGE-LJQANCHMSA-N 1 0 338.407 3.754 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@H]1[NH2+]Cc1ccc(CO)cc1 ZINC000592392856 1037934299 /nfs/dbraw/zinc/93/42/99/1037934299.db2.gz AADBUJSDBJPUSJ-IEBWSBKVSA-N 1 0 340.423 3.588 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@H]1CCc2ccccc2C1 ZINC000110243891 1038122312 /nfs/dbraw/zinc/12/23/12/1038122312.db2.gz JYJYKBGRXFLRLW-KRWDZBQOSA-N 1 0 326.396 3.641 20 5 EHBDRO Cc1cc(C)c([N+](=O)[O-])cc1NC(=O)NCC[N@@H+](C)C1CCCCC1 ZINC000443365803 1038125249 /nfs/dbraw/zinc/12/52/49/1038125249.db2.gz AHTXBHAITLYRFS-UHFFFAOYSA-N 1 0 348.447 3.598 20 5 EHBDRO CC[C@@H]1C[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CCCO1 ZINC000467553709 1038365597 /nfs/dbraw/zinc/36/55/97/1038365597.db2.gz KHEJSCKKFSNPGU-MRXNPFEDSA-N 1 0 330.384 3.856 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCC[C@@H]1O ZINC000538812485 1038548421 /nfs/dbraw/zinc/54/84/21/1038548421.db2.gz RSVXKRXWDSVLFW-DYVFJYSZSA-N 1 0 346.452 3.916 20 5 EHBDRO C[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccc(F)cc1F ZINC000181597313 1038638131 /nfs/dbraw/zinc/63/81/31/1038638131.db2.gz ZEMPTVMGAAMVKI-LLVKDONJSA-N 1 0 349.337 3.552 20 5 EHBDRO CC[C@@H]([NH2+][C@H]1CN(C)Cc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000539049343 1038654033 /nfs/dbraw/zinc/65/40/33/1038654033.db2.gz OXFMZCLTSOHXGH-MOPGFXCFSA-N 1 0 325.412 3.822 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@H](Cc2ccccc2)N(C)C)cccc1[N+](=O)[O-] ZINC000479863148 1038837721 /nfs/dbraw/zinc/83/77/21/1038837721.db2.gz QVIPTSWMEUZCKY-WMZOPIPTSA-N 1 0 341.455 3.727 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2c3ccccc3CC[C@@H]2C)c1[N+](=O)[O-] ZINC000893269352 1038942080 /nfs/dbraw/zinc/94/20/80/1038942080.db2.gz NWJZKKHFDURHLP-YVEFUNNKSA-N 1 0 342.395 3.722 20 5 EHBDRO Cc1csc(C2([NH2+]CCc3ccc([N+](=O)[O-])cc3)CCCC2)n1 ZINC000175021860 1039003255 /nfs/dbraw/zinc/00/32/55/1039003255.db2.gz LRAIWFIKOVIGJK-UHFFFAOYSA-N 1 0 331.441 3.961 20 5 EHBDRO CC[N@H+](Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1)[C@@H](C)CO ZINC000552124418 1039006282 /nfs/dbraw/zinc/00/62/82/1039006282.db2.gz RWQOWPAJMNUDKQ-NSHDSACASA-N 1 0 338.791 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H](CO)CC2)s1 ZINC000552146504 1039023707 /nfs/dbraw/zinc/02/37/07/1039023707.db2.gz LHSAWLJQGQMDJW-CQSZACIVSA-N 1 0 346.452 3.918 20 5 EHBDRO CCc1ccccc1NC(=O)[C@H](C)[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000905852619 1039156846 /nfs/dbraw/zinc/15/68/46/1039156846.db2.gz KDOCUGVTWCEVHD-KGLIPLIRSA-N 1 0 341.411 3.835 20 5 EHBDRO Cc1ccc(NC(=O)[C@H](C)[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c(F)c1 ZINC000905852651 1039160130 /nfs/dbraw/zinc/16/01/30/1039160130.db2.gz LTJHPJZQCYLXNG-OLZOCXBDSA-N 1 0 345.374 3.720 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000485772918 1039526565 /nfs/dbraw/zinc/52/65/65/1039526565.db2.gz OAAIJRWMLUGSSP-KRWDZBQOSA-N 1 0 326.396 3.811 20 5 EHBDRO COc1ccc(C[NH2+]C[C@H]2CCC3(CCCCC3)O2)cc1[N+](=O)[O-] ZINC000480444408 1039564017 /nfs/dbraw/zinc/56/40/17/1039564017.db2.gz MCCFVGXAARMQOL-OAHLLOKOSA-N 1 0 334.416 3.575 20 5 EHBDRO Cc1cccc(C[NH+]2CCN(Cc3cccc([N+](=O)[O-])c3C)CC2)c1 ZINC000554843699 1039799824 /nfs/dbraw/zinc/79/98/24/1039799824.db2.gz QCHAZVFRWKOCLX-UHFFFAOYSA-N 1 0 339.439 3.529 20 5 EHBDRO CN(CCc1cccc([N+](=O)[O-])c1)Cc1coc(-c2cccs2)n1 ZINC000554848645 1039830363 /nfs/dbraw/zinc/83/03/63/1039830363.db2.gz QEWUZDZIPIHFPY-UHFFFAOYSA-N 1 0 343.408 3.986 20 5 EHBDRO CC(C)[N@H+](Cc1ccc([N+](=O)[O-])cc1)Cc1ccc2[nH]c(=O)[nH]c2c1 ZINC000893946298 1039869846 /nfs/dbraw/zinc/86/98/46/1039869846.db2.gz WISQTLCGCRTYSH-UHFFFAOYSA-N 1 0 340.383 3.587 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](NCCC[NH+]2CCCCC2)C(F)(F)F)cc1 ZINC000584474439 1039936070 /nfs/dbraw/zinc/93/60/70/1039936070.db2.gz RMHGNUUAFDOFKC-OAHLLOKOSA-N 1 0 345.365 3.664 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@H](c3ccc(F)cc3)C2)ccc1[N+](=O)[O-] ZINC000490031074 1040298652 /nfs/dbraw/zinc/29/86/52/1040298652.db2.gz NKLOBAOYFVQVLA-HNNXBMFYSA-N 1 0 330.359 3.732 20 5 EHBDRO CC1(C)C[C@@H](NC2CC([NH+]3CCCCC3)C2)c2cc([N+](=O)[O-])ccc21 ZINC000479514584 1040332138 /nfs/dbraw/zinc/33/21/38/1040332138.db2.gz JXPURABHHBTMRP-GSQSYGFSSA-N 1 0 343.471 3.924 20 5 EHBDRO COc1cc(C[N@H+](CCC(F)(F)F)CC2CC2)ccc1[N+](=O)[O-] ZINC000490105807 1040344357 /nfs/dbraw/zinc/34/43/57/1040344357.db2.gz ZLNQKXAYPJQYCH-UHFFFAOYSA-N 1 0 332.322 3.768 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+][C@@H]2C[C@H]3OCCC[C@H]23)o1 ZINC000190339138 1040381471 /nfs/dbraw/zinc/38/14/71/1040381471.db2.gz QJUCHUPTKQSBCL-DDUZABMNSA-N 1 0 328.368 3.512 20 5 EHBDRO CC(C)CC[C@@H]1CCC[N@@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000500070901 1040425939 /nfs/dbraw/zinc/42/59/39/1040425939.db2.gz SHXDMCSZTJPNKH-HNNXBMFYSA-N 1 0 333.432 3.824 20 5 EHBDRO C[N@H+](Cc1ccc([N+](=O)[O-])cc1F)[C@H]1CCCN(c2ccccc2)C1 ZINC000490366293 1040516096 /nfs/dbraw/zinc/51/60/96/1040516096.db2.gz KMBOUHGWJJVUCQ-SFHVURJKSA-N 1 0 343.402 3.835 20 5 EHBDRO CO[C@H](C[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1)CC(C)C ZINC000418090040 1040564531 /nfs/dbraw/zinc/56/45/31/1040564531.db2.gz CEIJCZBKVHCACK-INIZCTEOSA-N 1 0 349.456 3.869 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]C[C@@H]1CCO[C@H]1c1ccccc1 ZINC000588590875 1040804477 /nfs/dbraw/zinc/80/44/77/1040804477.db2.gz NXMMWGCFWAOERS-TVZRVCQQSA-N 1 0 338.407 3.975 20 5 EHBDRO CC[C@H](C)[C@H](O)C[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000237006702 1040928750 /nfs/dbraw/zinc/92/87/50/1040928750.db2.gz BVSUVOGHAYQZOI-BLLLJJGKSA-N 1 0 334.441 3.820 20 5 EHBDRO CC(C)[C@@H](C[NH3+])C(=O)Nc1cccc(Oc2ccc([N+](=O)[O-])cc2)c1 ZINC000433159194 1040930594 /nfs/dbraw/zinc/93/05/94/1040930594.db2.gz DASVAXCYRSVXSP-QGZVFWFLSA-N 1 0 343.383 3.557 20 5 EHBDRO CN(C)[C@H](C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1ccco1 ZINC000433157844 1040940855 /nfs/dbraw/zinc/94/08/55/1040940855.db2.gz NVXBQRSEEVIWMN-DLBZAZTESA-N 1 0 343.427 3.803 20 5 EHBDRO C[C@H](COCC(F)(F)F)[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21 ZINC000433165013 1040951685 /nfs/dbraw/zinc/95/16/85/1040951685.db2.gz HCNAUDOAGVEAFI-YGRLFVJLSA-N 1 0 346.349 3.874 20 5 EHBDRO CC1(C)C[C@H]([NH2+]CCc2ccc(O)cc2)c2cc([N+](=O)[O-])ccc21 ZINC000433167312 1040955062 /nfs/dbraw/zinc/95/50/62/1040955062.db2.gz MZVLTCKRYCWBMG-SFHVURJKSA-N 1 0 326.396 3.855 20 5 EHBDRO COc1cc(C[NH+]2CCC(c3ncc(C)s3)CC2)ccc1[N+](=O)[O-] ZINC000433176132 1040984865 /nfs/dbraw/zinc/98/48/65/1040984865.db2.gz RKIKEDGSJZHWBF-UHFFFAOYSA-N 1 0 347.440 3.748 20 5 EHBDRO COC(=O)c1cc([C@@H](C)[N@H+](C)CCc2cccc([N+](=O)[O-])c2)oc1C ZINC000433202496 1041054213 /nfs/dbraw/zinc/05/42/13/1041054213.db2.gz RBTQPBKBJYBRJY-GFCCVEGCSA-N 1 0 346.383 3.518 20 5 EHBDRO CC1(C)C[C@H]([NH2+][C@@H](CO)c2ccsc2)c2cc([N+](=O)[O-])ccc21 ZINC000433231745 1041119706 /nfs/dbraw/zinc/11/97/06/1041119706.db2.gz KAKXFBSMEPXLTO-HOTGVXAUSA-N 1 0 332.425 3.702 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[N@@H+]2CCC[C@]3(C2)OCc2ccccc23)cc1 ZINC000481682994 1041230460 /nfs/dbraw/zinc/23/04/60/1041230460.db2.gz BWZIIGNESLIDGG-HXUWFJFHSA-N 1 0 338.407 3.659 20 5 EHBDRO Cc1c(NC(=O)[C@H](C)[NH2+][C@@H]2CCC[C@@H](C)[C@H]2C)cccc1[N+](=O)[O-] ZINC000600470751 1041248009 /nfs/dbraw/zinc/24/80/09/1041248009.db2.gz IHKGLNMGZZFVLM-RJZRQDKASA-N 1 0 333.432 3.645 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)[C@@H]1CCCOC1 ZINC000571448074 1041294923 /nfs/dbraw/zinc/29/49/23/1041294923.db2.gz QHPWVFHGWZYTHI-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C(C)(C)COCc1ccccc1 ZINC000500417612 1041407926 /nfs/dbraw/zinc/40/79/26/1041407926.db2.gz UKDLPDVINGBAKN-UHFFFAOYSA-N 1 0 328.412 3.988 20 5 EHBDRO Cc1ccc(C[N@H+](C)C[C@H]2OCCc3ccccc32)cc1[N+](=O)[O-] ZINC000511674080 1041452091 /nfs/dbraw/zinc/45/20/91/1041452091.db2.gz XJBJWVNYFIHJSW-LJQANCHMSA-N 1 0 326.396 3.649 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CC1 ZINC000125225928 1041920665 /nfs/dbraw/zinc/92/06/65/1041920665.db2.gz HDFRGVNEAMHLNP-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO CC[NH+]1CCC(N(C)Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000125250222 1041927144 /nfs/dbraw/zinc/92/71/44/1041927144.db2.gz VXPZCOQJPQPCPW-UHFFFAOYSA-N 1 0 343.427 3.771 20 5 EHBDRO Cc1nc2c(s1)[C@@H]([N@H+](C)CCc1ccc([N+](=O)[O-])cc1)CCC2 ZINC000111312369 1042261104 /nfs/dbraw/zinc/26/11/04/1042261104.db2.gz IVMKGCAFDLAYOZ-INIZCTEOSA-N 1 0 331.441 3.912 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@H]2CCCC[C@H]2O)cc1F ZINC000291235464 1042789060 /nfs/dbraw/zinc/78/90/60/1042789060.db2.gz UMBLVXLIQURAOC-QGPMSJSTSA-N 1 0 336.407 3.640 20 5 EHBDRO CCOc1cc(C[N@@H+]2CC[C@@H](CC(F)(F)F)C2)ccc1[N+](=O)[O-] ZINC000278918713 1042945765 /nfs/dbraw/zinc/94/57/65/1042945765.db2.gz WNJLOHKCQXIRIN-LBPRGKRZSA-N 1 0 332.322 3.768 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(Cc2ccccc2[N+](=O)[O-])C1 ZINC000512210856 1044163667 /nfs/dbraw/zinc/16/36/67/1044163667.db2.gz FWIQXLHOROAZRZ-DLBZAZTESA-N 1 0 331.460 3.681 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+]CC(=O)N(C)c2ccc([N+](=O)[O-])cc2)c1C ZINC000183725346 1125747499 /nfs/dbraw/zinc/74/74/99/1125747499.db2.gz TUPXOORHSIBRGD-HNNXBMFYSA-N 1 0 341.411 3.525 20 5 EHBDRO CC(C)[N@H+](CCCCCn1cccn1)Cc1ccc([N+](=O)[O-])cc1 ZINC000170913950 1126924061 /nfs/dbraw/zinc/92/40/61/1126924061.db2.gz NZILRGBKKHOPEM-UHFFFAOYSA-N 1 0 330.432 3.872 20 5 EHBDRO Cc1cc(CC[NH2+][C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)on1 ZINC000552099696 1127578244 /nfs/dbraw/zinc/57/82/44/1127578244.db2.gz QOORYYCOJBPGTJ-LJQANCHMSA-N 1 0 337.379 3.813 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]CCSC(F)(F)F)C1CC1 ZINC000765240508 1127587952 /nfs/dbraw/zinc/58/79/52/1127587952.db2.gz SZACGLMXPCAVJF-GFCCVEGCSA-N 1 0 334.363 3.759 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc3cc([N+](=O)[O-])ccc3n2)CC1 ZINC000301335908 1127738367 /nfs/dbraw/zinc/73/83/67/1127738367.db2.gz CWJVKCYUBHTIAZ-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO CC1(C)C[C@@H]([NH2+]Cc2cnn3ccccc23)c2cc([N+](=O)[O-])ccc21 ZINC000552318897 1127749428 /nfs/dbraw/zinc/74/94/28/1127749428.db2.gz AEDZFXWWHNABQN-QGZVFWFLSA-N 1 0 336.395 3.755 20 5 EHBDRO COCCC[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1)c1ccc(F)cc1 ZINC000282156301 1127892403 /nfs/dbraw/zinc/89/24/03/1127892403.db2.gz DCXUEZYZURNWSP-GOSISDBHSA-N 1 0 332.375 3.991 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H]2CCC[C@H](C3CCOCC3)C2)cc1 ZINC001649111933 1128290936 /nfs/dbraw/zinc/29/09/36/1128290936.db2.gz GKXLLPZXJALEKQ-DLBZAZTESA-N 1 0 348.443 3.549 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)[C@H](O)c1cccc(F)c1 ZINC000273063591 1128438834 /nfs/dbraw/zinc/43/88/34/1128438834.db2.gz IBMNWEWMGDRDMM-HWPZZCPQSA-N 1 0 338.766 3.599 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CC[C@H]1Nc1ccc([N+](=O)[O-])cc1 ZINC000301506897 1128484254 /nfs/dbraw/zinc/48/42/54/1128484254.db2.gz CYWKYZJRUCPULH-HNAYVOBHSA-N 1 0 325.412 3.917 20 5 EHBDRO COc1cccc([C@@H](CNc2cc(C)ccc2[N+](=O)[O-])[NH+](C)C)c1 ZINC000301586501 1128500557 /nfs/dbraw/zinc/50/05/57/1128500557.db2.gz VSNUGEPOUQCGCV-GOSISDBHSA-N 1 0 329.400 3.627 20 5 EHBDRO C[C@@H](O)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819739 1128661280 /nfs/dbraw/zinc/66/12/80/1128661280.db2.gz AQBUEXDDIUHGNW-HIFRSBDPSA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1nc(NC[C@H]2CCC[N@H+](Cc3cccs3)C2)ccc1[N+](=O)[O-] ZINC000301626269 1128762929 /nfs/dbraw/zinc/76/29/29/1128762929.db2.gz HKRXUJCIUSJDKB-CQSZACIVSA-N 1 0 346.456 3.684 20 5 EHBDRO COCC[N@H+](Cc1cc([N+](=O)[O-])ccc1OC(C)C)C1CCCC1 ZINC000609193899 1120543070 /nfs/dbraw/zinc/54/30/70/1120543070.db2.gz AHNJTCXCJMAHRV-UHFFFAOYSA-N 1 0 336.432 3.773 20 5 EHBDRO Cc1c(C[NH2+]C2CC(OCc3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000494510229 1120584561 /nfs/dbraw/zinc/58/45/61/1120584561.db2.gz ORADREAJCNANQM-UHFFFAOYSA-N 1 0 326.396 3.741 20 5 EHBDRO CC(C)[NH+](CCNC(=O)c1ccc(C(C)(C)C)c([N+](=O)[O-])c1)C(C)C ZINC000032244845 1121084296 /nfs/dbraw/zinc/08/42/96/1121084296.db2.gz VBYACHJGJMSDLC-UHFFFAOYSA-N 1 0 349.475 3.741 20 5 EHBDRO CC(C)Sc1ccc([C@H](C)[NH2+]CCn2cc([N+](=O)[O-])cn2)cc1 ZINC000090538181 1121148126 /nfs/dbraw/zinc/14/81/26/1121148126.db2.gz ZEMLMVFEEUJXDU-ZDUSSCGKSA-N 1 0 334.445 3.643 20 5 EHBDRO C[N@@H+]1CCN(c2ccc([N+](=O)[O-])c3cnccc32)[C@H](c2ccccc2)C1 ZINC000301066215 1121298111 /nfs/dbraw/zinc/29/81/11/1121298111.db2.gz JTHGGNYVZYEQCQ-FQEVSTJZSA-N 1 0 348.406 3.636 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1CC[NH2+][C@@H]1CC[C@H]2COCC[C@@H]2C1 ZINC000921976305 1128988875 /nfs/dbraw/zinc/98/88/75/1128988875.db2.gz NBAVAFAASXDRKM-IJEWVQPXSA-N 1 0 338.835 3.586 20 5 EHBDRO C[N@@H+]1CCC[C@H]2CN(c3ccc([N+](=O)[O-])c(C(F)(F)F)c3)CC[C@H]21 ZINC000301726917 1128998526 /nfs/dbraw/zinc/99/85/26/1128998526.db2.gz VMMSMZOUGUFLHJ-SMDDNHRTSA-N 1 0 343.349 3.534 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000488104696 1122140887 /nfs/dbraw/zinc/14/08/87/1122140887.db2.gz MUMZYTAUJITPBA-UHFFFAOYSA-N 1 0 342.443 3.701 20 5 EHBDRO Cc1ccc([C@H](CNc2ccc([N+](=O)[O-])cc2F)[NH+]2CCCC2)o1 ZINC000301165182 1122218772 /nfs/dbraw/zinc/21/87/72/1122218772.db2.gz VFFQADDTUXOYET-INIZCTEOSA-N 1 0 333.363 3.884 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1NC1CC[NH+](Cc2ccc(F)cc2)CC1 ZINC000301187610 1122317650 /nfs/dbraw/zinc/31/76/50/1122317650.db2.gz KTLVGJOKRUWENC-UHFFFAOYSA-N 1 0 344.390 3.514 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)ccc1N1CC[C@H]2[C@@H](CCC[N@@H+]2C2CC2)C1 ZINC000301788532 1129073219 /nfs/dbraw/zinc/07/32/19/1129073219.db2.gz PWIIBULWHPASRI-WFASDCNBSA-N 1 0 335.835 3.701 20 5 EHBDRO CC(C)COc1ccc(C[NH2+]CCc2ccc([N+](=O)[O-])cc2)cc1 ZINC000609288253 1122933315 /nfs/dbraw/zinc/93/33/15/1122933315.db2.gz GVTGNRKDSPCJMT-UHFFFAOYSA-N 1 0 328.412 3.962 20 5 EHBDRO COc1ccc(CNC[C@H](C(C)C)[NH+]2CCCCCC2)cc1[N+](=O)[O-] ZINC000609287729 1122939728 /nfs/dbraw/zinc/93/97/28/1122939728.db2.gz XSRPGSSTZJKQQP-GOSISDBHSA-N 1 0 349.475 3.594 20 5 EHBDRO COc1ccccc1[C@H](C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)N(C)C ZINC000154970112 1123054418 /nfs/dbraw/zinc/05/44/18/1123054418.db2.gz UEFSTCPBWYESPG-KSSFIOAISA-N 1 0 343.427 3.557 20 5 EHBDRO Cc1nn(C[N@@H+](CCc2ccccc2)CC(C)C)c(C)c1[N+](=O)[O-] ZINC000921056182 1123459620 /nfs/dbraw/zinc/45/96/20/1123459620.db2.gz CAEMYKHLYQAKEU-UHFFFAOYSA-N 1 0 330.432 3.566 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@@H]2CCCC[C@H]21 ZINC000609631771 1123635072 /nfs/dbraw/zinc/63/50/72/1123635072.db2.gz WFDQFRPVCDOBBW-CWRNSKLLSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]([NH2+]CC1(C)OCCO1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000179576498 1123803626 /nfs/dbraw/zinc/80/36/26/1123803626.db2.gz YJDPHEUASLOMKA-GFCCVEGCSA-N 1 0 348.424 3.737 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[N@@H+]1CCC[C@H](n2ccnc2)C1 ZINC000615834450 1123883949 /nfs/dbraw/zinc/88/39/49/1123883949.db2.gz VBABGCYVUULLML-KAPURRDVSA-N 1 0 326.400 3.532 20 5 EHBDRO Cc1ncsc1CN(C)c1cc(C)[nH+]c2ccc([N+](=O)[O-])cc21 ZINC000181503465 1124898885 /nfs/dbraw/zinc/89/88/85/1124898885.db2.gz YVULBYXEDVGHKN-UHFFFAOYSA-N 1 0 328.397 3.853 20 5 EHBDRO CC[NH+](CC)CCCC1CCN(c2cc(C)c([N+](=O)[O-])cn2)CC1 ZINC000181831857 1125053907 /nfs/dbraw/zinc/05/39/07/1125053907.db2.gz QKYOKNLTBFMLGS-UHFFFAOYSA-N 1 0 334.464 3.637 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccnn1C ZINC000618577759 1125114706 /nfs/dbraw/zinc/11/47/06/1125114706.db2.gz NWIFNOUWGVYOEQ-ZWKOTPCHSA-N 1 0 342.443 3.735 20 5 EHBDRO CC[C@H]([NH2+]CCCOc1ccc([N+](=O)[O-])cc1)c1c(C)noc1C ZINC000182418813 1125277260 /nfs/dbraw/zinc/27/72/60/1125277260.db2.gz QUSQVSJCKLTLQK-INIZCTEOSA-N 1 0 333.388 3.709 20 5 EHBDRO CO[C@@H]1C[C@@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C12CCC2 ZINC000453212482 1129181348 /nfs/dbraw/zinc/18/13/48/1129181348.db2.gz HYINARBATSVLEE-ZIAGYGMSSA-N 1 0 344.333 3.661 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@H](C)C(=O)Nc2ccccc2[N+](=O)[O-])c1C ZINC000115602944 1129278083 /nfs/dbraw/zinc/27/80/83/1129278083.db2.gz OOZBPHORPQZRLD-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO Cc1c(NC(=O)NCCC[NH+](C(C)C)C(C)C)cccc1[N+](=O)[O-] ZINC000080728976 1129376721 /nfs/dbraw/zinc/37/67/21/1129376721.db2.gz QRWWBGMGCGOQDA-UHFFFAOYSA-N 1 0 336.436 3.534 20 5 EHBDRO CCC(CC)(CC)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000081156443 1129403048 /nfs/dbraw/zinc/40/30/48/1129403048.db2.gz WIZXWRPWPOESSI-UHFFFAOYSA-N 1 0 327.812 3.745 20 5 EHBDRO Cc1nc(N[C@H]2C[N@@H+](Cc3ccccc3)CC[C@H]2C)ccc1[N+](=O)[O-] ZINC000716229532 1131372226 /nfs/dbraw/zinc/37/22/26/1131372226.db2.gz NMPVILUDZPTSDS-PBHICJAKSA-N 1 0 340.427 3.621 20 5 EHBDRO CCOc1cccc(NCc2ccc(CC[NH+](C)C)cc2)c1[N+](=O)[O-] ZINC000466441990 1129454186 /nfs/dbraw/zinc/45/41/86/1129454186.db2.gz PGNFFZDNQVUAEJ-UHFFFAOYSA-N 1 0 343.427 3.710 20 5 EHBDRO CCc1ccc([C@@H]([NH2+]C[C@@]2(C)CCOC2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543402327 1129461839 /nfs/dbraw/zinc/46/18/39/1129461839.db2.gz HLDLIRTTZUEUNM-RBUKOAKNSA-N 1 0 344.411 3.856 20 5 EHBDRO CCc1ccc([C@H]([NH2+][C@@H]2CCO[C@H](C)C2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000543422851 1129477513 /nfs/dbraw/zinc/47/75/13/1129477513.db2.gz IPKYFUJMTDGJOF-ZXYWRSMDSA-N 1 0 344.411 3.997 20 5 EHBDRO Cn1cc(C[N@@H+]2CCC[C@H]2C2CCC2)c(-c2ccc([N+](=O)[O-])cc2)n1 ZINC000092780764 1129560996 /nfs/dbraw/zinc/56/09/96/1129560996.db2.gz HJCBCZLAMHUJHV-SFHVURJKSA-N 1 0 340.427 3.760 20 5 EHBDRO C[C@H]([NH2+][C@H]1CN(Cc2ccccc2)C[C@H]1C)c1cccc([N+](=O)[O-])c1 ZINC000389875897 1129593611 /nfs/dbraw/zinc/59/36/11/1129593611.db2.gz UEJMUDWLKJFOQG-GUXCAODWSA-N 1 0 339.439 3.766 20 5 EHBDRO CC(C)C[N@@H+](Cc1cccc([N+](=O)[O-])c1)C[C@H](O)c1ccc(F)cc1 ZINC000735872693 1131384984 /nfs/dbraw/zinc/38/49/84/1131384984.db2.gz QKEPYWBOEBLFCQ-IBGZPJMESA-N 1 0 346.402 3.926 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H]1CCCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000390518311 1129621602 /nfs/dbraw/zinc/62/16/02/1129621602.db2.gz DUSIKLDDVRSAPL-UZLBHIALSA-N 1 0 339.439 3.910 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CC[C@@H]1CC[C@H](C(F)(F)F)O1 ZINC000922680884 1129621894 /nfs/dbraw/zinc/62/18/94/1129621894.db2.gz ZICBUZAPNBDVJD-HFBOFBSRSA-N 1 0 344.333 3.698 20 5 EHBDRO CC[C@H]1CCCC[C@@H]1[N@H+](C)CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000331304728 1129659880 /nfs/dbraw/zinc/65/98/80/1129659880.db2.gz UJLAKCPTEFGDAT-GJZGRUSLSA-N 1 0 333.432 3.742 20 5 EHBDRO Cc1nc2ccccc2n1CCC[NH2+][C@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000155899242 1129677165 /nfs/dbraw/zinc/67/71/65/1129677165.db2.gz OIUPYAMLBHEWQN-CQSZACIVSA-N 1 0 338.411 3.994 20 5 EHBDRO C[C@@H]1CCC[C@@H](C)[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)C1 ZINC000125434078 1129691849 /nfs/dbraw/zinc/69/18/49/1129691849.db2.gz FOXKSGOKCFWXCY-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)CCc1ccccc1[N+](=O)[O-])c1ccc(C)o1 ZINC000156534004 1129722933 /nfs/dbraw/zinc/72/29/33/1129722933.db2.gz YBPJBHAWOHZKHF-CZUORRHYSA-N 1 0 332.400 3.795 20 5 EHBDRO O=[N+]([O-])c1cc(Cl)c(N2CC[C@H]([NH+]3CCCC3)C2)c(Cl)c1 ZINC000302011782 1129763636 /nfs/dbraw/zinc/76/36/36/1129763636.db2.gz CRKFMGWZPLHOOZ-JTQLQIEISA-N 1 0 330.215 3.576 20 5 EHBDRO Cc1cc(NC[C@@H](c2ccco2)[NH+](C)C)c2cccc([N+](=O)[O-])c2n1 ZINC000302048354 1129765428 /nfs/dbraw/zinc/76/54/28/1129765428.db2.gz ZBKDWUKXQQKVCZ-INIZCTEOSA-N 1 0 340.383 3.759 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1)C(=O)Nc1c(F)cccc1F ZINC000056196506 1129805882 /nfs/dbraw/zinc/80/58/82/1129805882.db2.gz UUEJOIWTNDOEBG-WDEREUQCSA-N 1 0 349.337 3.551 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1C ZINC000056196223 1129806283 /nfs/dbraw/zinc/80/62/83/1129806283.db2.gz ZMCQIYUTEXXKSS-LSDHHAIUSA-N 1 0 341.411 3.889 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC([C@H](O)c2ccc(F)cc2)CC1 ZINC000304007737 1129875627 /nfs/dbraw/zinc/87/56/27/1129875627.db2.gz UAKFOGJXERLAPL-LJQANCHMSA-N 1 0 344.386 3.680 20 5 EHBDRO CC(C)[C@@H](CO)[NH2+][C@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000162728000 1129902132 /nfs/dbraw/zinc/90/21/32/1129902132.db2.gz NKQJUZLWOCASQW-TZMCWYRMSA-N 1 0 334.441 3.991 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCN2CCc3sccc3C2)cccc1[N+](=O)[O-] ZINC000132869318 1129920838 /nfs/dbraw/zinc/92/08/38/1129920838.db2.gz HLUNUZNSKPBFFV-AWEZNQCLSA-N 1 0 345.468 3.674 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]C[C@]2(C)CCCC[C@H]2O)cc1[N+](=O)[O-] ZINC000245510739 1130224558 /nfs/dbraw/zinc/22/45/58/1130224558.db2.gz WVVZUPJNOFTLBZ-VHSSKADRSA-N 1 0 336.432 3.585 20 5 EHBDRO C[C@H]([NH2+]C[C@H](c1c(F)cccc1F)N(C)C)c1cccc([N+](=O)[O-])c1 ZINC000173419157 1130228116 /nfs/dbraw/zinc/22/81/16/1130228116.db2.gz SLTHKKUGMNNEBO-YVEFUNNKSA-N 1 0 349.381 3.827 20 5 EHBDRO COc1cccc(O[C@@H](C)C[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)c1 ZINC000173449824 1130232109 /nfs/dbraw/zinc/23/21/09/1130232109.db2.gz JYOIWEMNVIIJRR-KBPBESRZSA-N 1 0 330.384 3.722 20 5 EHBDRO CC1(C)[C@H]([NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])[C@H]2CCO[C@H]21 ZINC000245556730 1130237805 /nfs/dbraw/zinc/23/78/05/1130237805.db2.gz SDHAOCBRJSFQAQ-IGIMTQTPSA-N 1 0 344.455 3.709 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H]2CCC[C@@H](O)C2)c2ccccc2)c1 ZINC000245953405 1130334329 /nfs/dbraw/zinc/33/43/29/1130334329.db2.gz LMXDYXDCLQPVJV-CDHQVMDDSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H]([NH+]3CCCCC3)C2)c(C(F)(F)F)c1 ZINC000730806956 1130741754 /nfs/dbraw/zinc/74/17/54/1130741754.db2.gz PJYVCHBPLMXMLP-ZDUSSCGKSA-N 1 0 343.349 3.678 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccccc1[N+](=O)[O-])c1ccc2c(c1)CCO2 ZINC000766190781 1130796007 /nfs/dbraw/zinc/79/60/07/1130796007.db2.gz AGOBROXTWCFVTH-KRWDZBQOSA-N 1 0 326.396 3.813 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+]Cc2cc(Cl)cc(Cl)c2)cc1 ZINC000731677875 1130831929 /nfs/dbraw/zinc/83/19/29/1130831929.db2.gz ARUZMUDEFVKSSN-HNNXBMFYSA-N 1 0 341.194 3.725 20 5 EHBDRO C[N@H+](CCc1ccc(Cl)cc1)Cn1ncc2ccc([N+](=O)[O-])cc21 ZINC000733300582 1131018787 /nfs/dbraw/zinc/01/87/87/1131018787.db2.gz SPWDFKAHTVADJV-UHFFFAOYSA-N 1 0 344.802 3.730 20 5 EHBDRO C[C@@H]([NH2+][C@@H](C)c1cccc(-n2ccnn2)c1)c1cccc([N+](=O)[O-])c1 ZINC000348082832 1131150223 /nfs/dbraw/zinc/15/02/23/1131150223.db2.gz TZTHCZVPPGSGMK-UONOGXRCSA-N 1 0 337.383 3.587 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+]Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)o1 ZINC000741261502 1131591151 /nfs/dbraw/zinc/59/11/51/1131591151.db2.gz OFMQUXPOUQDKNG-INIZCTEOSA-N 1 0 342.351 3.579 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cc(F)ccc1F)CC2 ZINC001172897917 1131880979 /nfs/dbraw/zinc/88/09/79/1131880979.db2.gz DKNDREOFFWOBAX-INIZCTEOSA-N 1 0 332.350 3.910 20 5 EHBDRO [NH3+]Cc1cnc2c(ccn2[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172898123 1131882022 /nfs/dbraw/zinc/88/20/22/1131882022.db2.gz GRJPBLUWBVGQBV-KRWDZBQOSA-N 1 0 336.395 3.523 20 5 EHBDRO C[C@H](Cc1cccc(O)c1)[NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172898452 1131882280 /nfs/dbraw/zinc/88/22/80/1131882280.db2.gz AYNONCFHJKZZHH-RDTXWAMCSA-N 1 0 340.423 3.769 20 5 EHBDRO [NH2+]=C(N[C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccc(Cl)nc1 ZINC001172900470 1131883640 /nfs/dbraw/zinc/88/36/40/1131883640.db2.gz UCYHQPIKJOJREJ-CQSZACIVSA-N 1 0 344.802 3.506 20 5 EHBDRO CC[C@H]([NH2+][C@@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccn1 ZINC001172901170 1131883937 /nfs/dbraw/zinc/88/39/37/1131883937.db2.gz KIZOVSIVXMSBFK-AEFFLSMTSA-N 1 0 325.412 3.978 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]Cc1cccc3nccnc13)CC2 ZINC001172899989 1131883951 /nfs/dbraw/zinc/88/39/51/1131883951.db2.gz AXJJRXFSRWDTJS-KRWDZBQOSA-N 1 0 348.406 3.575 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+][C@@H]1CCCc3ncccc31)CC2 ZINC001172900827 1131884108 /nfs/dbraw/zinc/88/41/08/1131884108.db2.gz GCNHWJXULXJJOM-OXJNMPFZSA-N 1 0 337.423 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([NH2+]C1(CC3CC3)CCOCC1)CC2 ZINC001172906532 1131887901 /nfs/dbraw/zinc/88/79/01/1131887901.db2.gz XVVMSOUUNHVKGH-SFHVURJKSA-N 1 0 344.455 3.781 20 5 EHBDRO COCC[C@H]1CCCC[N@@H+]1[C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172914775 1131902835 /nfs/dbraw/zinc/90/28/35/1131902835.db2.gz ISFWITFZGABKJF-MSOLQXFVSA-N 1 0 332.444 3.733 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@@H]([N@@H+]1CCc3ccsc3C1)CC2 ZINC001172914604 1131903032 /nfs/dbraw/zinc/90/30/32/1131903032.db2.gz IFCFVGBJZLZNSZ-INIZCTEOSA-N 1 0 328.437 3.962 20 5 EHBDRO COc1cc(F)ccc1C[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1 ZINC001172911215 1131918040 /nfs/dbraw/zinc/91/80/40/1131918040.db2.gz HPTKEGGDIBCRIN-KRWDZBQOSA-N 1 0 344.386 3.780 20 5 EHBDRO O=C(CC[NH2+][C@H]1CCc2ccc([N+](=O)[O-])cc2CC1)c1ccccc1 ZINC001172911572 1131918144 /nfs/dbraw/zinc/91/81/44/1131918144.db2.gz JWEWNUMZKKPOHI-SFHVURJKSA-N 1 0 338.407 3.705 20 5 EHBDRO O=[N+]([O-])c1cc(F)c(N2CCC([NH2+][C@H]3CC=CCC3)CC2)c(F)c1 ZINC001173013048 1131936193 /nfs/dbraw/zinc/93/61/93/1131936193.db2.gz OHRZUTFETLVMAR-LBPRGKRZSA-N 1 0 337.370 3.540 20 5 EHBDRO CC1CC[NH+](C2CCN(c3c(F)cc([N+](=O)[O-])cc3F)CC2)CC1 ZINC001173014440 1131936197 /nfs/dbraw/zinc/93/61/97/1131936197.db2.gz QXLMSYAKXLCQJI-UHFFFAOYSA-N 1 0 339.386 3.574 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@H](C)c2cc(C)ccn2)c1F ZINC001173179262 1131992611 /nfs/dbraw/zinc/99/26/11/1131992611.db2.gz OPKKVJXXZSMCEE-CHWSQXEVSA-N 1 0 347.390 3.728 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@H](C)[N@@H+]2CCc3ccccc3C2)c1F ZINC001173184440 1131993964 /nfs/dbraw/zinc/99/39/64/1131993964.db2.gz NHODXDAGIXSQNL-ZDUSSCGKSA-N 1 0 344.386 3.732 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+][C@@H]2C[C@H]2c2ccccc2)c1F ZINC001173194211 1131994575 /nfs/dbraw/zinc/99/45/75/1131994575.db2.gz YTZPEULTTIGPDG-IVMMDQJWSA-N 1 0 344.386 3.819 20 5 EHBDRO COc1ccc2c(c1)CC[C@@H]2[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173220638 1132004329 /nfs/dbraw/zinc/00/43/29/1132004329.db2.gz GIFVGNGEZUPMRC-DJJJIMSYSA-N 1 0 326.396 3.812 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](C)c1ccc2c(c1)OCO2 ZINC001173224985 1132005150 /nfs/dbraw/zinc/00/51/50/1132005150.db2.gz QGUCYCPHRFXLHD-CHWSQXEVSA-N 1 0 328.368 3.605 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CCc2nc(Cl)ccc2C1 ZINC001173226136 1132006410 /nfs/dbraw/zinc/00/64/10/1132006410.db2.gz HUTWEKMCTRLATB-LBPRGKRZSA-N 1 0 331.803 3.633 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[N@@H+]1CC[C@H]1COCc1ccccc1 ZINC001173225934 1132006443 /nfs/dbraw/zinc/00/64/43/1132006443.db2.gz GTJQWEGJIAHDJY-JXFKEZNVSA-N 1 0 340.423 3.817 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C[C@@H](O)c1cc2ccccc2o1 ZINC001173231078 1132009096 /nfs/dbraw/zinc/00/90/96/1132009096.db2.gz XDCOSKKNRDPTLE-SUMWQHHRSA-N 1 0 340.379 3.595 20 5 EHBDRO COc1cccc2c1CC[C@H]2[NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1 ZINC001173233510 1132010683 /nfs/dbraw/zinc/01/06/83/1132010683.db2.gz JJTNOVRPHXUVGK-SCLBCKFNSA-N 1 0 326.396 3.812 20 5 EHBDRO C/C=C\C[C@@H]1CCC[N@@H+]([C@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)C1 ZINC001175054559 1132551260 /nfs/dbraw/zinc/55/12/60/1132551260.db2.gz SRISFMQUXGQWFE-LPUOJRKPSA-N 1 0 331.416 3.600 20 5 EHBDRO C[C@@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccc(Br)cc1F ZINC001168986232 1132620440 /nfs/dbraw/zinc/62/04/40/1132620440.db2.gz XGQMLEIAQVXUFH-FOGDFJRCSA-N 1 0 345.212 3.684 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC001168970161 1132622707 /nfs/dbraw/zinc/62/27/07/1132622707.db2.gz GUJNUFAWTACHMM-NEPJUHHUSA-N 1 0 334.363 3.834 20 5 EHBDRO CC(C)([NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(C(F)(F)F)cc1 ZINC001168975975 1132625007 /nfs/dbraw/zinc/62/50/07/1132625007.db2.gz XVHLSLUBWGREFY-FZMZJTMJSA-N 1 0 330.350 3.976 20 5 EHBDRO CCOc1ccc(C[NH2+][C@@H]2CC[C@@H](C[N+](=O)[O-])C2)cc1C(F)(F)F ZINC001168998267 1132627749 /nfs/dbraw/zinc/62/77/49/1132627749.db2.gz KQKGINDPYZQTCD-CHWSQXEVSA-N 1 0 346.349 3.639 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1ccc(OC(F)(F)F)cc1 ZINC001168986676 1132633615 /nfs/dbraw/zinc/63/36/15/1132633615.db2.gz YGHBOMBLAWUNNW-NTZNESFSSA-N 1 0 332.322 3.681 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H](n2cc(C3CC[NH2+]CC3)c3ccccc32)C1 ZINC001169027885 1132634681 /nfs/dbraw/zinc/63/46/81/1132634681.db2.gz RLIHNUSCRVVHNH-HOCLYGCPSA-N 1 0 327.428 3.726 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2cccc(Br)c2Cl)C1 ZINC001168990268 1132634719 /nfs/dbraw/zinc/63/47/19/1132634719.db2.gz ZKECFOVVINFFAC-ONGXEEELSA-N 1 0 347.640 3.638 20 5 EHBDRO Cc1c2ccccc2sc1[C@@H](C)[NH2+]CCn1cc([N+](=O)[O-])cn1 ZINC001169033692 1132635805 /nfs/dbraw/zinc/63/58/05/1132635805.db2.gz SJWBOAKIPIEROJ-GFCCVEGCSA-N 1 0 330.413 3.665 20 5 EHBDRO CC1(C)C[C@H](Nc2cnc(Cl)cc2[N+](=O)[O-])C[C@@](C)(C[NH3+])C1 ZINC001169149094 1132677572 /nfs/dbraw/zinc/67/75/72/1132677572.db2.gz YWIZOFNPVRBGPH-ZUZCIYMTSA-N 1 0 326.828 3.599 20 5 EHBDRO CCOc1ncc(Nc2ccc3cc4ccc(N)cc4[nH+]c3c2)cn1 ZINC001175559289 1132710899 /nfs/dbraw/zinc/71/08/99/1132710899.db2.gz WWUMJLZCSOMLHS-UHFFFAOYSA-N 1 0 331.379 3.903 20 5 EHBDRO COc1ccc(Cl)cc1C[N@H+](C)CCc1cccc([N+](=O)[O-])c1 ZINC001169666838 1132814069 /nfs/dbraw/zinc/81/40/69/1132814069.db2.gz PEQPLUXRJJWMQH-UHFFFAOYSA-N 1 0 334.803 3.931 20 5 EHBDRO O=[N+]([O-])c1cc2c(cc1N[C@@H]1CCO[C@@H](c3ccccc3)C1)C[NH2+]C2 ZINC001169757250 1132847357 /nfs/dbraw/zinc/84/73/57/1132847357.db2.gz UXXRPYYCSVMWKF-VQIMIIECSA-N 1 0 339.395 3.530 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C1CCC(C)(O)CC1 ZINC000768104605 1133095750 /nfs/dbraw/zinc/09/57/50/1133095750.db2.gz BAEXDYIYKMDEIK-TUBUQKNSSA-N 1 0 338.473 3.749 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+]C[C@@H](C)CCc1ccccc1 ZINC001178295831 1133154792 /nfs/dbraw/zinc/15/47/92/1133154792.db2.gz WYRVQWIYGRGQQM-HNNXBMFYSA-N 1 0 328.412 3.962 20 5 EHBDRO C[C@@H](O)C[N@H+](Cc1ccccc1)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000768555190 1133155281 /nfs/dbraw/zinc/15/52/81/1133155281.db2.gz OCMHGKBYLOKVAI-CYBMUJFWSA-N 1 0 334.803 3.631 20 5 EHBDRO COc1ccc(COCC[NH2+]Cc2c(C)ccc([N+](=O)[O-])c2C)cc1 ZINC001178346747 1133158099 /nfs/dbraw/zinc/15/80/99/1133158099.db2.gz LOGTZNDSJNPWNR-UHFFFAOYSA-N 1 0 344.411 3.527 20 5 EHBDRO C[N@@H+](Cc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C[C@@H]1CCCC[C@H]1O ZINC001180332805 1133362474 /nfs/dbraw/zinc/36/24/74/1133362474.db2.gz UMTRUPSFZBQVBH-SWLSCSKDSA-N 1 0 346.349 3.597 20 5 EHBDRO CCN(CCC[NH+](CC)CC)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC001181506987 1133495300 /nfs/dbraw/zinc/49/53/00/1133495300.db2.gz XWBGJCGLCOQGMN-UHFFFAOYSA-N 1 0 327.856 3.802 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+]C[C@@H](O)c1c(F)cccc1F)CCC2 ZINC000774249542 1133643407 /nfs/dbraw/zinc/64/34/07/1133643407.db2.gz BUIJDVPDHDRKSJ-DLBZAZTESA-N 1 0 348.349 3.574 20 5 EHBDRO CSCCCCCC[NH2+][C@@H]1CCCC[C@@H]1n1ccc([N+](=O)[O-])n1 ZINC000774355225 1133669424 /nfs/dbraw/zinc/66/94/24/1133669424.db2.gz PVRFQPUTIJDYQL-CABCVRRESA-N 1 0 340.493 3.788 20 5 EHBDRO COCc1cc([N+](=O)[O-])ccc1N1CCC[C@H]([NH+]2[C@@H](C)CC[C@@H]2C)C1 ZINC000774517574 1133702651 /nfs/dbraw/zinc/70/26/51/1133702651.db2.gz HNBGPFDUYJUPOT-MPGHIAIKSA-N 1 0 347.459 3.583 20 5 EHBDRO Cc1ccc(C[NH2+]C[C@H](O)c2cc(F)cc(Cl)c2)cc1[N+](=O)[O-] ZINC000785608241 1133726598 /nfs/dbraw/zinc/72/65/98/1133726598.db2.gz FUJJEOMZLWVXMW-INIZCTEOSA-N 1 0 338.766 3.519 20 5 EHBDRO O=C(OCc1ccc([N+](=O)[O-])cc1)c1cccc(C[NH+]2CCCC2)c1 ZINC000785719063 1133746928 /nfs/dbraw/zinc/74/69/28/1133746928.db2.gz ZYAQLOFNXNZSBK-UHFFFAOYSA-N 1 0 340.379 3.548 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+]C[C@@H]1C[C@@H]2CCC[C@@H]2O1 ZINC001183642017 1133835203 /nfs/dbraw/zinc/83/52/03/1133835203.db2.gz GPWIVYTYVWSTGB-OBUPLIBYSA-N 1 0 344.455 3.853 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]Cc1ccc([N+](=O)[O-])cc1 ZINC000786809872 1133909593 /nfs/dbraw/zinc/90/95/93/1133909593.db2.gz ADCCVCGNGUTZFX-LCYFTJDESA-N 1 0 327.340 3.696 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC[C@](C)(O)c1ccccc1 ZINC000786820004 1133910912 /nfs/dbraw/zinc/91/09/12/1133910912.db2.gz GLCMDCAWWQZLLR-JDQHYLEWSA-N 1 0 340.423 3.886 20 5 EHBDRO C[NH+](C)C1(CNc2ncc([N+](=O)[O-])c3ccccc32)CCCCC1 ZINC001184536675 1133950380 /nfs/dbraw/zinc/95/03/80/1133950380.db2.gz VTCHYOZJPRQSAT-UHFFFAOYSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1CN1CCC[C@@H]([NH+]2CCCC2)CC1 ZINC000746676141 1133992980 /nfs/dbraw/zinc/99/29/80/1133992980.db2.gz ZWGNGXZTTAVIDL-MRXNPFEDSA-N 1 0 337.851 3.699 20 5 EHBDRO CC[N@H+](CCc1ccccn1)C/C(C)=C/c1cccc([N+](=O)[O-])c1 ZINC000787408103 1134003750 /nfs/dbraw/zinc/00/37/50/1134003750.db2.gz YNRDEGSOVCALKS-DTQAZKPQSA-N 1 0 325.412 3.958 20 5 EHBDRO C[C@@H](C[NH+]1C[C@H](C)C[C@@H](C)C1)Nc1ccc2ncccc2c1[N+](=O)[O-] ZINC001184998590 1134017841 /nfs/dbraw/zinc/01/78/41/1134017841.db2.gz FIDYFXUKQMUMRD-KFWWJZLASA-N 1 0 342.443 3.921 20 5 EHBDRO CC(C)C[C@@H](CNc1c([N+](=O)[O-])cnn1C)[NH2+][C@@H](C)c1ccccc1 ZINC001185338511 1134074134 /nfs/dbraw/zinc/07/41/34/1134074134.db2.gz LCONPRYTIGJKIE-HOCLYGCPSA-N 1 0 345.447 3.506 20 5 EHBDRO Cc1ccc(OCCCC[NH2+][C@H](C)c2ccc(N)c([N+](=O)[O-])c2)cc1 ZINC000788541496 1134140191 /nfs/dbraw/zinc/14/01/91/1134140191.db2.gz DJTSJMRLBCWPQW-OAHLLOKOSA-N 1 0 343.427 3.995 20 5 EHBDRO Cc1ccccc1O[C@@H](C)C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788611376 1134145577 /nfs/dbraw/zinc/14/55/77/1134145577.db2.gz KEGYVOMTOBUEFP-UONOGXRCSA-N 1 0 329.400 3.604 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](c1ccccc1)N(C)C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000788754592 1134165073 /nfs/dbraw/zinc/16/50/73/1134165073.db2.gz QLSRDTJRWYCVOD-NJSLBKSFSA-N 1 0 342.443 3.519 20 5 EHBDRO CN(CC[NH+]1CCCCC1)c1ccc([N+](=O)[O-])c(C(F)(F)F)c1 ZINC001186789941 1134258056 /nfs/dbraw/zinc/25/80/56/1134258056.db2.gz DYDDXBVZQKXVLD-UHFFFAOYSA-N 1 0 331.338 3.536 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[N@H+](C)Cc1ccc(Cl)c([N+](=O)[O-])c1 ZINC000789455109 1134276921 /nfs/dbraw/zinc/27/69/21/1134276921.db2.gz IGJUKDHAXRUGEA-MRXNPFEDSA-N 1 0 348.830 3.938 20 5 EHBDRO O=[N+]([O-])c1c(NC[C@H]2CC[N@@H+]2C2CCCCC2)ccc2cnccc21 ZINC001187063621 1134291374 /nfs/dbraw/zinc/29/13/74/1134291374.db2.gz KQQLRVQOHNTLFB-MRXNPFEDSA-N 1 0 340.427 3.962 20 5 EHBDRO C[C@H]1CN(c2nc3ccc([N+](=O)[O-])cc3s2)CC[N@@H+]1C1CCCC1 ZINC001187624173 1134357422 /nfs/dbraw/zinc/35/74/22/1134357422.db2.gz ASYOSGKBFHFGSC-LBPRGKRZSA-N 1 0 346.456 3.658 20 5 EHBDRO CCOC(=O)C1(C[NH2+]C/C(C)=C\c2cccc([N+](=O)[O-])c2)CCCC1 ZINC000792196021 1134667319 /nfs/dbraw/zinc/66/73/19/1134667319.db2.gz POOZHHVFVXNCQZ-PTNGSMBKSA-N 1 0 346.427 3.711 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2ccc(C)cc2C)c([N+](=O)[O-])c1 ZINC001170295185 1134736315 /nfs/dbraw/zinc/73/63/15/1134736315.db2.gz APEWVENHRMQNFU-HNNXBMFYSA-N 1 0 328.412 3.941 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@@H](C)c2ccc(C)cn2)c([N+](=O)[O-])c1 ZINC001170306424 1134739186 /nfs/dbraw/zinc/73/91/86/1134739186.db2.gz UWYLLMMTZMRZFI-KBPBESRZSA-N 1 0 329.400 3.589 20 5 EHBDRO COC[C@H]([NH2+][C@H](C)Cc1ccc(OC)cc1[N+](=O)[O-])c1ccccc1 ZINC001170317304 1134746307 /nfs/dbraw/zinc/74/63/07/1134746307.db2.gz FDJIFDRAWSXGLZ-KDOFPFPSSA-N 1 0 344.411 3.512 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]C2(c3ccc(F)cc3)CC2)c([N+](=O)[O-])c1 ZINC001170316946 1134746790 /nfs/dbraw/zinc/74/67/90/1134746790.db2.gz AMZDNGISFFZBMG-ZDUSSCGKSA-N 1 0 344.386 3.952 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+]Cc2cnc(C(C)C)s2)c([N+](=O)[O-])c1 ZINC001170318897 1134746846 /nfs/dbraw/zinc/74/68/46/1134746846.db2.gz RZIICYFEPIOZRE-LBPRGKRZSA-N 1 0 349.456 3.904 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCc3ccsc3C2)c([N+](=O)[O-])c1 ZINC001170348450 1134759746 /nfs/dbraw/zinc/75/97/46/1134759746.db2.gz XBUUVKXJTJUNPW-GFCCVEGCSA-N 1 0 332.425 3.654 20 5 EHBDRO COc1ccc(C[C@H](C)[N@@H+]2CCc3c(F)cccc3C2)c([N+](=O)[O-])c1 ZINC001170351729 1134760495 /nfs/dbraw/zinc/76/04/95/1134760495.db2.gz HIEJGDNUWRGUHS-ZDUSSCGKSA-N 1 0 344.386 3.732 20 5 EHBDRO Cc1c(CN2CC[NH+](C3CCC(C)CC3)CC2)cccc1[N+](=O)[O-] ZINC001191040095 1134779235 /nfs/dbraw/zinc/77/92/35/1134779235.db2.gz VWTGFJNFQXETST-UHFFFAOYSA-N 1 0 331.460 3.600 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[N@@H+]2[C@H](C)C[C@H]3CCCC[C@H]32)c1 ZINC001191075715 1134788436 /nfs/dbraw/zinc/78/84/36/1134788436.db2.gz CLXJFNCSLIKQJW-XJKCOSOUSA-N 1 0 332.400 3.534 20 5 EHBDRO CO[C@@]1(C)C[C@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202045 1134815373 /nfs/dbraw/zinc/81/53/73/1134815373.db2.gz DVWWPENSWUUDDL-HOCLYGCPSA-N 1 0 326.824 3.884 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@@H](C)NC(=O)OC(C)(C)C ZINC000793222783 1134876866 /nfs/dbraw/zinc/87/68/66/1134876866.db2.gz DPTBYHFZQVDCAQ-RNQWEJQRSA-N 1 0 349.431 3.501 20 5 EHBDRO COc1ccc(OCC[NH2+][C@@H]2CCC(C)(C)C[C@H]2C)c([N+](=O)[O-])c1 ZINC001193660453 1135168201 /nfs/dbraw/zinc/16/82/01/1135168201.db2.gz DJWGTQLVNJAUCD-UKRRQHHQSA-N 1 0 336.432 3.787 20 5 EHBDRO COc1ccc(OCC[NH2+]C(C)(C)C2CCCCC2)c([N+](=O)[O-])c1 ZINC001193848267 1135195060 /nfs/dbraw/zinc/19/50/60/1135195060.db2.gz DJUJGPVCBRTFSQ-UHFFFAOYSA-N 1 0 336.432 3.931 20 5 EHBDRO C[C@@H](c1ccccc1)[N@H+](Cc1cn(C)nc1[N+](=O)[O-])C1CCCC1 ZINC001194176595 1135237800 /nfs/dbraw/zinc/23/78/00/1135237800.db2.gz OMVVTGCARCXUED-AWEZNQCLSA-N 1 0 328.416 3.834 20 5 EHBDRO CO[C@@H]1[C@@H](C)[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C1(C)C ZINC001194458723 1135270451 /nfs/dbraw/zinc/27/04/51/1135270451.db2.gz TULWHEYSGKDACG-QCZZGDTMSA-N 1 0 346.349 3.763 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H](C)c1cc2ccccc2[nH]1 ZINC000775625726 1135346470 /nfs/dbraw/zinc/34/64/70/1135346470.db2.gz CYYKSXLHEMLMJG-LBPRGKRZSA-N 1 0 325.368 3.936 20 5 EHBDRO C[C@@H]1C[N@H+](CCOc2cccc([N+](=O)[O-])c2)CCc2ccccc21 ZINC001195809868 1135474130 /nfs/dbraw/zinc/47/41/30/1135474130.db2.gz OSVACOKPYYDYOE-OAHLLOKOSA-N 1 0 326.396 3.635 20 5 EHBDRO C[C@@H]1CCCN(Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])[C@@H]1CCO ZINC001195939167 1135486932 /nfs/dbraw/zinc/48/69/32/1135486932.db2.gz WXYJXKKZGOANJM-QMTHXVAHSA-N 1 0 347.242 3.885 20 5 EHBDRO CC(=O)c1ccc([N+](=O)[O-])cc1NCc1ccc(CC[NH+](C)C)cc1 ZINC000808045985 1135613517 /nfs/dbraw/zinc/61/35/17/1135613517.db2.gz VCMXUMJOHXQVAD-UHFFFAOYSA-N 1 0 341.411 3.514 20 5 EHBDRO Cc1c(C[NH2+][C@@H](Cn2ccnc2)c2ccccc2)cccc1[N+](=O)[O-] ZINC001197263914 1135667012 /nfs/dbraw/zinc/66/70/12/1135667012.db2.gz GBELDLXNYHIVNF-SFHVURJKSA-N 1 0 336.395 3.631 20 5 EHBDRO COC(=O)CC[C@@H]1CCC[N@@H+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)C1 ZINC001197468854 1135693455 /nfs/dbraw/zinc/69/34/55/1135693455.db2.gz OMFCEDPZEFFEGA-CABCVRRESA-N 1 0 334.416 3.629 20 5 EHBDRO CCC1(CC)CCC[N@@H+]1CCC(=O)Nc1ccc(OC)cc1[N+](=O)[O-] ZINC001197514708 1135697135 /nfs/dbraw/zinc/69/71/35/1135697135.db2.gz QKCOIFUDXWIGLB-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO CC[N@@H+](Cc1ccc([N+](=O)[O-])cc1F)C[C@H](O)c1ccc(C)cc1 ZINC000747531237 1135744119 /nfs/dbraw/zinc/74/41/19/1135744119.db2.gz SVYTUTIBLDVKCU-SFHVURJKSA-N 1 0 332.375 3.598 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)N1C[C@]23C[N@H+](C)C[C@@]2(C1)CCCC3 ZINC001198818840 1135859659 /nfs/dbraw/zinc/85/96/59/1135859659.db2.gz BRJRALKJMCHOJR-AHRSYUTCSA-N 1 0 343.471 3.772 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC[C@@H]2COCC[C@@H]21 ZINC000809954154 1135905787 /nfs/dbraw/zinc/90/57/87/1135905787.db2.gz QHUDKABSEGTORW-YGRLFVJLSA-N 1 0 345.226 3.903 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])[C@H]1CCCO1 ZINC000809975718 1135907487 /nfs/dbraw/zinc/90/74/87/1135907487.db2.gz SIPIMPVNJOVDJP-QWHCGFSZSA-N 1 0 333.215 3.949 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]CCCCn3ccnc3)o2)cc1 ZINC001199648112 1135916863 /nfs/dbraw/zinc/91/68/63/1135916863.db2.gz DBDBYRIOPSVNNN-UHFFFAOYSA-N 1 0 340.383 3.621 20 5 EHBDRO COc1ccccc1C1(C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC001199972661 1135942105 /nfs/dbraw/zinc/94/21/05/1135942105.db2.gz XEQCKBQAXVYBOQ-UHFFFAOYSA-N 1 0 326.396 3.733 20 5 EHBDRO CC(C)c1ccc(C(=O)NC2CCC(C)([NH+](C)C)CC2)cc1[N+](=O)[O-] ZINC001132698761 1136065105 /nfs/dbraw/zinc/06/51/05/1136065105.db2.gz ZYOJPAHYJDUDCH-UHFFFAOYSA-N 1 0 347.459 3.711 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]CC1(CCO)CCC1 ZINC000811484033 1136092034 /nfs/dbraw/zinc/09/20/34/1136092034.db2.gz OKWRVVFZTCOXOS-UHFFFAOYSA-N 1 0 333.215 3.544 20 5 EHBDRO CCC[N@@H+]1CC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811476039 1136096355 /nfs/dbraw/zinc/09/63/55/1136096355.db2.gz WKFSFKPNLSHIIS-NSHDSACASA-N 1 0 346.258 3.723 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@@H]2[C@H]3CCO[C@H]3C23CCCC3)ccc1Cl ZINC000776252056 1136101938 /nfs/dbraw/zinc/10/19/38/1136101938.db2.gz MFJKBFRCGYLJOH-DAXOMENPSA-N 1 0 336.819 3.686 20 5 EHBDRO CN1CC[C@H]([NH2+]Cc2ccc(Cl)c([N+](=O)[O-])c2)[C@@H]1c1ccccc1 ZINC000776253679 1136102207 /nfs/dbraw/zinc/10/22/07/1136102207.db2.gz NTUIXWSWFNSLCP-WMZOPIPTSA-N 1 0 345.830 3.783 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[N@@H+]2CCC[C@@H]2c2cccc(F)c2)cc1 ZINC000776276942 1136130484 /nfs/dbraw/zinc/13/04/84/1136130484.db2.gz LXKCYTDSODXMBI-MSOLQXFVSA-N 1 0 330.359 3.604 20 5 EHBDRO CC[N@@H+](Cc1cccc(Cl)c1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776277925 1136131020 /nfs/dbraw/zinc/13/10/20/1136131020.db2.gz QVGNDOKYQUYEKI-QGZVFWFLSA-N 1 0 334.803 3.804 20 5 EHBDRO CC[N@H+](Cc1ccc(OC)c([N+](=O)[O-])c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812847475 1136259792 /nfs/dbraw/zinc/25/97/92/1136259792.db2.gz DDMSFPDZTCEGED-LIRRHRJNSA-N 1 0 344.411 3.547 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+][C@H](C)[C@H](O)c1cccc(F)c1 ZINC000850444406 1136259798 /nfs/dbraw/zinc/25/97/98/1136259798.db2.gz JFUZKKSGQMVWSO-IUUKEHGRSA-N 1 0 348.374 3.515 20 5 EHBDRO CC[N@H+](Cc1ccc([N+](=O)[O-])c(OC)c1)[C@@H](C)[C@H](O)c1ccccc1 ZINC000812849009 1136260218 /nfs/dbraw/zinc/26/02/18/1136260218.db2.gz NSPWHADXAJSQLL-LIRRHRJNSA-N 1 0 344.411 3.547 20 5 EHBDRO C[C@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000850520627 1136276475 /nfs/dbraw/zinc/27/64/75/1136276475.db2.gz DKELIGIYFUUJTH-NSHDSACASA-N 1 0 345.374 3.708 20 5 EHBDRO CC(C)[C@H](O)[C@H]([NH2+][C@@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1 ZINC000850553737 1136284409 /nfs/dbraw/zinc/28/44/09/1136284409.db2.gz CACWDPNOHAMSAL-BKTGTZMESA-N 1 0 343.427 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC[N@H+](Cc3ccc(Cl)cc3)CC2)cc1 ZINC000813312797 1136317598 /nfs/dbraw/zinc/31/75/98/1136317598.db2.gz JTSLZCCZVBCNOW-UHFFFAOYSA-N 1 0 345.830 3.961 20 5 EHBDRO O=[N+]([O-])c1cc(F)ccc1C[NH2+][C@@H](c1ccccc1)C1CCOCC1 ZINC000851901006 1136417816 /nfs/dbraw/zinc/41/78/16/1136417816.db2.gz BZCHTGNNYROCQO-IBGZPJMESA-N 1 0 344.386 3.991 20 5 EHBDRO CCC[N@@H+](Cc1ccc(C)cc1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776575503 1136439075 /nfs/dbraw/zinc/43/90/75/1136439075.db2.gz RODRITJXFKKGNT-LJQANCHMSA-N 1 0 328.412 3.849 20 5 EHBDRO C[C@@H]1C[C@@H](c2ccc(F)cc2)C[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585280 1136442608 /nfs/dbraw/zinc/44/26/08/1136442608.db2.gz SXEMQMUQDHNZJK-VVFCZOMOSA-N 1 0 344.386 3.645 20 5 EHBDRO CC[N@H+](C[C@@H](O)c1ccc([N+](=O)[O-])cc1)[C@@H](C)c1cccc(OC)c1 ZINC000776579581 1136444591 /nfs/dbraw/zinc/44/45/91/1136444591.db2.gz NRNUGIQQOYBPDW-IFXJQAMLSA-N 1 0 344.411 3.720 20 5 EHBDRO CCC[N@@H+](Cc1ccc(OC)cc1)C[C@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776580008 1136444712 /nfs/dbraw/zinc/44/47/12/1136444712.db2.gz QLDZYKZRYACGCZ-IBGZPJMESA-N 1 0 344.411 3.549 20 5 EHBDRO C[C@@H]1[C@H](Cc2ccccc2)CC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776592486 1136454092 /nfs/dbraw/zinc/45/40/92/1136454092.db2.gz OXCPKEBBPPXBKE-MOXGXCLJSA-N 1 0 340.423 3.581 20 5 EHBDRO Cc1cccc2c1CCC[C@@H]2[NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000853126083 1136512392 /nfs/dbraw/zinc/51/23/92/1136512392.db2.gz AHALUVLNYBODHI-RBUKOAKNSA-N 1 0 326.396 3.604 20 5 EHBDRO C[C@@H](OC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000815448826 1136596913 /nfs/dbraw/zinc/59/69/13/1136596913.db2.gz VGJNTCBBHHMVRF-RDTXWAMCSA-N 1 0 346.427 3.996 20 5 EHBDRO C[C@H]([NH2+]CCc1ccc2ccccc2n1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000815570430 1136612682 /nfs/dbraw/zinc/61/26/82/1136612682.db2.gz BYWRHEMVCQRLIT-ZDUSSCGKSA-N 1 0 336.395 3.619 20 5 EHBDRO C[C@@H]([NH2+]C[C@@H](O)c1cccc([N+](=O)[O-])c1)c1ccc2ncsc2c1 ZINC000776815344 1136698729 /nfs/dbraw/zinc/69/87/29/1136698729.db2.gz IXQRXLGKHCJNRX-BDJLRTHQSA-N 1 0 343.408 3.589 20 5 EHBDRO C[C@H]([NH2+]Cc1ccnc(N2CCCCC2)c1)c1cccc([N+](=O)[O-])c1 ZINC000173329462 1136765596 /nfs/dbraw/zinc/76/55/96/1136765596.db2.gz SOGIRAZPOVOVRY-HNNXBMFYSA-N 1 0 340.427 3.831 20 5 EHBDRO CCC(CC)C(=O)N1CCC([NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)CC1 ZINC000173333677 1136773503 /nfs/dbraw/zinc/77/35/03/1136773503.db2.gz DQQHAPBDLOATCD-AWEZNQCLSA-N 1 0 347.459 3.673 20 5 EHBDRO CC(C)(C[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1)c1ccccc1Cl ZINC000819012938 1136900502 /nfs/dbraw/zinc/90/05/02/1136900502.db2.gz MFORBKLHRALQAS-KRWDZBQOSA-N 1 0 348.830 3.849 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+][C@@H]2CCCc3c(F)cc(F)cc32)cc1 ZINC000819333765 1136932388 /nfs/dbraw/zinc/93/23/88/1136932388.db2.gz ROOWDICFPQSVLW-QZTJIDSGSA-N 1 0 348.349 3.574 20 5 EHBDRO C[C@@H](c1ccncc1)[NH+]1CCC(Nc2cccc(F)c2[N+](=O)[O-])CC1 ZINC000819922838 1136966549 /nfs/dbraw/zinc/96/65/49/1136966549.db2.gz MNFLSZODOXNIOC-ZDUSSCGKSA-N 1 0 344.390 3.766 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C(=O)Nc1ccc(C[NH+](C)C)c(F)c1 ZINC000820597094 1136999488 /nfs/dbraw/zinc/99/94/88/1136999488.db2.gz RNHKEWSMXNUMST-UHFFFAOYSA-N 1 0 345.374 3.665 20 5 EHBDRO C[C@@H](C[N@H+](C)[C@@H](C)c1ccccc1[N+](=O)[O-])NC(=O)OC(C)(C)C ZINC000860093525 1137043906 /nfs/dbraw/zinc/04/39/06/1137043906.db2.gz CSSSCTKJTPVJBS-STQMWFEESA-N 1 0 337.420 3.501 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H](O)C[NH2+]C2(c3c(F)cccc3F)CCC2)cc1 ZINC000860203962 1137049391 /nfs/dbraw/zinc/04/93/91/1137049391.db2.gz VEWXKZHXOVMCHK-MRXNPFEDSA-N 1 0 348.349 3.575 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@@](C)(O)c1ccccc1 ZINC000822516254 1137064086 /nfs/dbraw/zinc/06/40/86/1137064086.db2.gz JHXVENZBQQPACQ-QGZVFWFLSA-N 1 0 334.803 3.588 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)c([N+](=O)[O-])c1)C[C@](C)(O)c1ccccc1 ZINC000822516253 1137064125 /nfs/dbraw/zinc/06/41/25/1137064125.db2.gz JHXVENZBQQPACQ-KRWDZBQOSA-N 1 0 334.803 3.588 20 5 EHBDRO Cc1cc(-c2noc([C@@H]3C[C@@H]4CCCC[C@@H]4[NH2+]3)n2)cc([N+](=O)[O-])c1 ZINC000823270838 1137092539 /nfs/dbraw/zinc/09/25/39/1137092539.db2.gz VYWKXZGZCLSWPH-CQDKDKBSSA-N 1 0 328.372 3.546 20 5 EHBDRO C[N@@H+]1CCCC[C@@H](CNCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000862481997 1137146290 /nfs/dbraw/zinc/14/62/90/1137146290.db2.gz CFEWSYSUCVMEJH-NSHDSACASA-N 1 0 346.258 3.723 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@@H](O)c2ccc(Cl)cc2)cccc1[N+](=O)[O-] ZINC000120481618 1137276050 /nfs/dbraw/zinc/27/60/50/1137276050.db2.gz PDQDPJRXHWBGLF-SJKOYZFVSA-N 1 0 334.803 3.941 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C\C[NH2+]CCSCCC(F)(F)F ZINC000865788507 1137311971 /nfs/dbraw/zinc/31/19/71/1137311971.db2.gz TWNTUVOUGSORGL-HYXAFXHYSA-N 1 0 334.363 3.883 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](Cn1ccnc1)C(C)(C)C ZINC000866238593 1137337899 /nfs/dbraw/zinc/33/78/99/1137337899.db2.gz PZLWRYNNLCRIBK-DYVFJYSZSA-N 1 0 348.422 3.566 20 5 EHBDRO C[C@]1(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C[C@]1(F)Cl ZINC000846185579 1137340540 /nfs/dbraw/zinc/34/05/40/1137340540.db2.gz SNIBEEDOHFGMAR-PAPYEOQZSA-N 1 0 344.818 3.569 20 5 EHBDRO COC[C@@H]([NH2+][C@@H](C)Cc1ccc(F)cc1[N+](=O)[O-])c1ccc(C)o1 ZINC000866278181 1137342149 /nfs/dbraw/zinc/34/21/49/1137342149.db2.gz WHSNQPQCIHHSCV-XHDPSFHLSA-N 1 0 336.363 3.544 20 5 EHBDRO C[C@H](CCc1cccnc1)[NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12 ZINC000866358222 1137349192 /nfs/dbraw/zinc/34/91/92/1137349192.db2.gz IXNRXTUEVXJMCN-CQSZACIVSA-N 1 0 338.411 3.625 20 5 EHBDRO CSCC1(CC[NH2+][C@H](C)Cc2ccc(F)cc2[N+](=O)[O-])CC1 ZINC000866386532 1137350833 /nfs/dbraw/zinc/35/08/33/1137350833.db2.gz FZNHZKKRYUXTET-GFCCVEGCSA-N 1 0 326.437 3.788 20 5 EHBDRO COCCc1nc(C)c([C@H](C)[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)s1 ZINC000866539816 1137363083 /nfs/dbraw/zinc/36/30/83/1137363083.db2.gz HNFHHZUVJBGYNQ-LBPRGKRZSA-N 1 0 349.456 3.708 20 5 EHBDRO Cn1cc([C@H]2C[N@H+](Cc3cc(Cl)ccc3[N+](=O)[O-])CC2(C)C)cn1 ZINC000846932793 1137376125 /nfs/dbraw/zinc/37/61/25/1137376125.db2.gz UJDXWKRGWBLTDS-OAHLLOKOSA-N 1 0 348.834 3.607 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1cccc([N+](=O)[O-])c1 ZINC000773121195 1137466905 /nfs/dbraw/zinc/46/69/05/1137466905.db2.gz UZSFXSYQEYYECH-QGZVFWFLSA-N 1 0 329.356 3.786 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@@H]2CC[C@H]3SCCS[C@H]23)cccc1[N+](=O)[O-] ZINC000773140352 1137468546 /nfs/dbraw/zinc/46/85/46/1137468546.db2.gz VPDZPVOPQHKYKT-KSZJFAHPSA-N 1 0 338.498 3.933 20 5 EHBDRO Cc1c([C@@H](C)[NH2+][C@@H]2CCc3ccccc3OC2)cccc1[N+](=O)[O-] ZINC000510980112 1137471213 /nfs/dbraw/zinc/47/12/13/1137471213.db2.gz QLRJLKFOGRYOIW-GDBMZVCRSA-N 1 0 326.396 3.948 20 5 EHBDRO C[N@H+](Cc1ccc(Cl)cc1[N+](=O)[O-])C[C@]1(O)CCc2ccccc21 ZINC001171436729 1137483244 /nfs/dbraw/zinc/48/32/44/1137483244.db2.gz XJCLRUNKBJJLEO-GOSISDBHSA-N 1 0 346.814 3.514 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCc2ccccc2[C@@H](C)C1 ZINC001171740830 1137511126 /nfs/dbraw/zinc/51/11/26/1137511126.db2.gz IIMQJDBWPTYHSA-AWEZNQCLSA-N 1 0 326.396 3.765 20 5 EHBDRO Cc1nc2ccccc2n1CC[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872018915 1137564860 /nfs/dbraw/zinc/56/48/60/1137564860.db2.gz QZQORWBWZQEGAL-LBPRGKRZSA-N 1 0 342.374 3.743 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCCn1ccnc1C ZINC000872025334 1137565655 /nfs/dbraw/zinc/56/56/55/1137565655.db2.gz KXUKAGHNBLVWLC-LBPRGKRZSA-N 1 0 334.445 3.563 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@@H](C)c1cn(C)nc1C ZINC000872030721 1137566339 /nfs/dbraw/zinc/56/63/39/1137566339.db2.gz BBSPXCQHEHIJOQ-QWRGUYRKSA-N 1 0 334.445 3.770 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CC1(CCO)CCCC1 ZINC000872038902 1137566988 /nfs/dbraw/zinc/56/69/88/1137566988.db2.gz AYUGAXUZHKVAAG-CYBMUJFWSA-N 1 0 338.473 3.910 20 5 EHBDRO CC[C@@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)[C@@H]1CCCOC1 ZINC000872065716 1137569382 /nfs/dbraw/zinc/56/93/82/1137569382.db2.gz AIQIVWMAACTFSS-IUODEOHRSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCO[C@@H](c2ccccn2)C1)c1c(F)cccc1[N+](=O)[O-] ZINC000872077400 1137569990 /nfs/dbraw/zinc/56/99/90/1137569990.db2.gz HSFCXLKXBKJTLG-PBFPGSCMSA-N 1 0 345.374 3.700 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+][C@H]1CCCn2nccc21 ZINC000872095224 1137571011 /nfs/dbraw/zinc/57/10/11/1137571011.db2.gz RTMHTBLUAJQTRQ-RISCZKNCSA-N 1 0 332.429 3.699 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccc(F)cc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129846 1137573057 /nfs/dbraw/zinc/57/30/57/1137573057.db2.gz YXPGREOAGBOLEB-STQMWFEESA-N 1 0 345.374 3.802 20 5 EHBDRO C[C@@H](CC(=O)Nc1ccccc1)[NH2+][C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000872129589 1137573147 /nfs/dbraw/zinc/57/31/47/1137573147.db2.gz QLOMZECIFYVOHZ-KBPBESRZSA-N 1 0 327.384 3.663 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nccnc1C ZINC000872133456 1137573505 /nfs/dbraw/zinc/57/35/05/1137573505.db2.gz MUJNYDNKMCBGII-UONOGXRCSA-N 1 0 346.456 3.915 20 5 EHBDRO Cc1c(C[NH2+][C@H]2CCO[C@H](c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000873108507 1137590276 /nfs/dbraw/zinc/59/02/76/1137590276.db2.gz YUCJKMHMXSZBDS-HKUYNNGSSA-N 1 0 326.396 3.913 20 5 EHBDRO C[C@H]1CCc2c(F)cccc2[C@H]1[NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1 ZINC000877077456 1137669656 /nfs/dbraw/zinc/66/96/56/1137669656.db2.gz IQSFYMHCWGBETM-WZBSNXKDSA-N 1 0 344.390 3.547 20 5 EHBDRO CCO[P@](C)(=O)CC[C@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000877472317 1137677427 /nfs/dbraw/zinc/67/74/27/1137677427.db2.gz PNEYRPNOQYOTEO-YTEVENLXSA-N 1 0 328.349 3.716 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(Cc2ccc([N+](=O)[O-])c(Cl)c2)CC1 ZINC000877673994 1137685409 /nfs/dbraw/zinc/68/54/09/1137685409.db2.gz LBAMGHBWXYRTSM-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO C[C@@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1 ZINC000878447924 1137716532 /nfs/dbraw/zinc/71/65/32/1137716532.db2.gz OVZLGIYKROZIIL-OCCSQVGLSA-N 1 0 344.415 3.949 20 5 EHBDRO CC[C@@H]([NH2+]Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@H]1CC1(C)C ZINC000878717751 1137726187 /nfs/dbraw/zinc/72/61/87/1137726187.db2.gz HMOVDFAQZNHOBT-CHWSQXEVSA-N 1 0 330.388 3.559 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1nnc(C[N@@H+]2CCCC[C@@H]2C2CCC2)o1 ZINC000878771858 1137727806 /nfs/dbraw/zinc/72/78/06/1137727806.db2.gz XXADHGIQHSROFB-OAHLLOKOSA-N 1 0 342.399 3.799 20 5 EHBDRO C/C=C/C[C@H]1CCC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000879066648 1137736876 /nfs/dbraw/zinc/73/68/76/1137736876.db2.gz QMBGXUOBVWUHQV-HSWBROFVSA-N 1 0 342.399 3.823 20 5 EHBDRO C[C@@H]1c2sccc2CC[N@H+]1CCC(=O)Nc1ccccc1[N+](=O)[O-] ZINC000880376967 1137777129 /nfs/dbraw/zinc/77/71/29/1137777129.db2.gz NBDHJYBJCBLCOW-GFCCVEGCSA-N 1 0 345.424 3.604 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC(C)C)[C@@H]1CCCOC1 ZINC000880466728 1137779447 /nfs/dbraw/zinc/77/94/47/1137779447.db2.gz QLOUJWZVKYIATD-PBHICJAKSA-N 1 0 336.432 3.677 20 5 EHBDRO C[C@H]1CN(c2ccc([N+](=O)[O-])cc2C(F)F)CCN1c1cc[nH+]cc1 ZINC000882820746 1137835184 /nfs/dbraw/zinc/83/51/84/1137835184.db2.gz ZDNDLRCBPCCFKP-LBPRGKRZSA-N 1 0 348.353 3.643 20 5 EHBDRO C[C@@H](NC(=O)[C@H]1CCCC[N@@H+]1C1CCCC1)c1cccc([N+](=O)[O-])c1 ZINC000331708411 1137917859 /nfs/dbraw/zinc/91/78/59/1137917859.db2.gz BWGDENVWHVUCBW-RDTXWAMCSA-N 1 0 345.443 3.569 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2C)c(OC)c1 ZINC000118959643 1137936737 /nfs/dbraw/zinc/93/67/37/1137936737.db2.gz XCDFUQPWPNFXSI-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO COc1ccc([C@H](CCO)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2C)cc1 ZINC000120324495 1137948603 /nfs/dbraw/zinc/94/86/03/1137948603.db2.gz FDNGOAAVGDLNBH-KSSFIOAISA-N 1 0 344.411 3.686 20 5 EHBDRO C[C@H]1CC(C)(C)CC[C@@H]1[NH2+]Cc1nnc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000120775275 1137952249 /nfs/dbraw/zinc/95/22/49/1137952249.db2.gz NBQBXQLKNNLRII-WFASDCNBSA-N 1 0 344.415 3.949 20 5 EHBDRO C[C@H]([NH2+]Cc1ccc(F)c(C[NH+](C)C)c1)c1ccc([N+](=O)[O-])cc1 ZINC000120958231 1137953953 /nfs/dbraw/zinc/95/39/53/1137953953.db2.gz CQKHGNGACFPSAH-ZDUSSCGKSA-N 1 0 331.391 3.646 20 5 EHBDRO O=[N+]([O-])c1cccc(C[N@H+]2CCC[C@@H]2C[C@H](O)c2ccc(F)cc2)c1 ZINC000134802680 1137960799 /nfs/dbraw/zinc/96/07/99/1137960799.db2.gz CWZZOVNBHGBCGR-MJGOQNOKSA-N 1 0 344.386 3.822 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H]2CC[C@]3(CO[C@H](C)C3)O2)cc1[N+](=O)[O-] ZINC000886333431 1138068669 /nfs/dbraw/zinc/06/86/69/1138068669.db2.gz IJHZSSOPARUFMP-OGWOLHLISA-N 1 0 348.443 3.534 20 5 EHBDRO Cc1nc(C2CC[NH+]([C@@H](C)c3cccc([N+](=O)[O-])c3)CC2)[nH]c1C ZINC000886670042 1138112096 /nfs/dbraw/zinc/11/20/96/1138112096.db2.gz ILRUNIMYYMBUCQ-AWEZNQCLSA-N 1 0 328.416 3.875 20 5 EHBDRO CCOc1cc(C[NH2+][C@H]2CCc3c2cccc3F)ccc1[N+](=O)[O-] ZINC000886923063 1138172739 /nfs/dbraw/zinc/17/27/39/1138172739.db2.gz KKYYHNVDMHYLTG-INIZCTEOSA-N 1 0 330.359 3.910 20 5 EHBDRO CCC[C@@H]([NH2+]CCCOC1CCOCC1)c1cccc([N+](=O)[O-])c1 ZINC000090082492 1138209187 /nfs/dbraw/zinc/20/91/87/1138209187.db2.gz GHLOKFXLIBNVQB-GOSISDBHSA-N 1 0 336.432 3.611 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@](C)(O)c2ccc(F)cc2)cccc1[N+](=O)[O-] ZINC000090890989 1138214281 /nfs/dbraw/zinc/21/42/81/1138214281.db2.gz LMDOECBMQZHYIC-ACJLOTCBSA-N 1 0 332.375 3.601 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@H]3CCOC3)o2)c(Cl)c1 ZINC000263810492 1138371999 /nfs/dbraw/zinc/37/19/99/1138371999.db2.gz MUMYZTJLAXXTKZ-LLVKDONJSA-N 1 0 336.775 3.634 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@@H]1CCC[C@@H]1OC(F)F)CCC2 ZINC000337551464 1138602944 /nfs/dbraw/zinc/60/29/44/1138602944.db2.gz ORVNUGWTISKETG-KFWWJZLASA-N 1 0 326.343 3.722 20 5 EHBDRO C[N@H+](CCc1cccc([N+](=O)[O-])c1)Cc1cnc([C@H]2CCCO2)s1 ZINC000283026490 1138879727 /nfs/dbraw/zinc/87/97/27/1138879727.db2.gz MPWDMRZLMLBJGG-MRXNPFEDSA-N 1 0 347.440 3.577 20 5 EHBDRO CC(C)[NH+]1CCC(N(C)Cc2cc([N+](=O)[O-])ccc2Cl)CC1 ZINC000265450771 1138902842 /nfs/dbraw/zinc/90/28/42/1138902842.db2.gz KKVDPBSHBFCKEQ-UHFFFAOYSA-N 1 0 325.840 3.553 20 5 EHBDRO CCOc1ccc([C@@H](C)NC2CC[NH+](C(C)C)CC2)cc1[N+](=O)[O-] ZINC000180403445 1139832199 /nfs/dbraw/zinc/83/21/99/1139832199.db2.gz WLVXRACUKDAIRG-CQSZACIVSA-N 1 0 335.448 3.517 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]CC[C@H]3CCCCO3)cs2)c1 ZINC000181252329 1139895415 /nfs/dbraw/zinc/89/54/15/1139895415.db2.gz DGHLKXWIIJIZHT-MRXNPFEDSA-N 1 0 347.440 3.767 20 5 EHBDRO CC[C@H]([NH2+]CC(=O)N[C@H](C)c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000181551192 1139914613 /nfs/dbraw/zinc/91/46/13/1139914613.db2.gz NHDBNDFEALAWAJ-KDOFPFPSSA-N 1 0 341.411 3.513 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[N@@H+]1CCCN(c2nccs2)CC1 ZINC000182693056 1139986848 /nfs/dbraw/zinc/98/68/48/1139986848.db2.gz DLINWJOSWTVKKN-CQSZACIVSA-N 1 0 346.456 3.633 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCC[C@@H]2CCCCO2)cc1[N+](=O)[O-] ZINC000183986398 1140071701 /nfs/dbraw/zinc/07/17/01/1140071701.db2.gz PZYVTLZSIALICJ-HOCLYGCPSA-N 1 0 336.432 3.993 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[N@H+](C)C[C@@H](C)c1nccs1 ZINC000184004013 1140073393 /nfs/dbraw/zinc/07/33/93/1140073393.db2.gz DHEDWPUIICLGAF-GFCCVEGCSA-N 1 0 335.429 3.686 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH+]1CCC(O)(c2ccccc2)CC1 ZINC000185640113 1140159860 /nfs/dbraw/zinc/15/98/60/1140159860.db2.gz AGOYOLKEXBUURD-SOFGYWHQSA-N 1 0 338.407 3.592 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)N(C)c2ccccc2)cc1[N+](=O)[O-] ZINC000268789373 1140992948 /nfs/dbraw/zinc/99/29/48/1140992948.db2.gz FLVRRTGMFBRZCF-HNNXBMFYSA-N 1 0 341.411 3.607 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)c2ccc(F)cc2N(C)C)cc1[N+](=O)[O-] ZINC000268827337 1141001563 /nfs/dbraw/zinc/00/15/63/1141001563.db2.gz NPCDBAMWLAIHFO-LBPRGKRZSA-N 1 0 347.390 3.659 20 5 EHBDRO C[C@H](CCO)C[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000268950007 1141032703 /nfs/dbraw/zinc/03/27/03/1141032703.db2.gz RUWBQRJGTLUGKD-OLZOCXBDSA-N 1 0 334.441 3.992 20 5 EHBDRO C[C@H](c1ccc(F)c(F)c1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000269636330 1141129846 /nfs/dbraw/zinc/12/98/46/1141129846.db2.gz AOPCBQVRUAMYFF-PIGZYNQJSA-N 1 0 336.338 3.599 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CC(CC)(CC)CCO)cc1[N+](=O)[O-] ZINC000271140926 1141313296 /nfs/dbraw/zinc/31/32/96/1141313296.db2.gz OJWRXZBXFIKRLB-AWEZNQCLSA-N 1 0 338.448 3.833 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]CCc1c(C)noc1C ZINC000271176602 1141319283 /nfs/dbraw/zinc/31/92/83/1141319283.db2.gz VCEQXHMNIFOCGU-AWEZNQCLSA-N 1 0 349.456 3.903 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1nnc(C(C)(C)C)s1 ZINC000271430664 1141364915 /nfs/dbraw/zinc/36/49/15/1141364915.db2.gz BWZNGUUDZPRMJF-GFCCVEGCSA-N 1 0 348.472 3.855 20 5 EHBDRO COc1ccc(C[NH2+][C@H](C)[C@@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548315 1141394928 /nfs/dbraw/zinc/39/49/28/1141394928.db2.gz UEFSGFWVDMEDHW-KZULUSFZSA-N 1 0 348.374 3.608 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](C)[C@@H](OC)c2ccc(F)cc2)cc1[N+](=O)[O-] ZINC000271548311 1141394943 /nfs/dbraw/zinc/39/49/43/1141394943.db2.gz UEFSGFWVDMEDHW-KPZWWZAWSA-N 1 0 348.374 3.608 20 5 EHBDRO COc1cc(C[N@H+](C)[C@@H]2CC[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000429575520 1141521162 /nfs/dbraw/zinc/52/11/62/1141521162.db2.gz VOGCUFNGAHPJMZ-CMPLNLGQSA-N 1 0 344.358 3.825 20 5 EHBDRO [NH3+]CCN(Cc1ccc(C(F)(F)F)cc1)c1ccccc1[N+](=O)[O-] ZINC000348936272 1141612131 /nfs/dbraw/zinc/61/21/31/1141612131.db2.gz SAVWRAFRGVUESR-UHFFFAOYSA-N 1 0 339.317 3.579 20 5 EHBDRO [NH3+]CCN(Cc1cccc(-c2ccccn2)c1)c1ccccc1[N+](=O)[O-] ZINC000348934416 1141612152 /nfs/dbraw/zinc/61/21/52/1141612152.db2.gz MVLWCFKZGYNWOZ-UHFFFAOYSA-N 1 0 348.406 3.622 20 5 EHBDRO COc1cccc([C@@H]2CCC[N@@H+]2Cc2ccc(OC)c([N+](=O)[O-])c2)c1 ZINC000051180361 214081512 /nfs/dbraw/zinc/08/15/12/214081512.db2.gz MLBKTIFDQIYMPD-KRWDZBQOSA-N 1 0 342.395 3.949 20 5 EHBDRO C[C@H](C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1)Oc1ccccc1 ZINC000537985418 1032061302 /nfs/dbraw/zinc/06/13/02/1032061302.db2.gz AYHRIGKVTKKBNO-DNVCBOLYSA-N 1 0 340.423 3.973 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]CCCn1cnc2ccccc21 ZINC000449064207 1032109836 /nfs/dbraw/zinc/10/98/36/1032109836.db2.gz SZCVQTNCXDSKKQ-OAHLLOKOSA-N 1 0 338.411 3.555 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H](O)c1ccc(Cl)cc1 ZINC000120480813 1015267983 /nfs/dbraw/zinc/26/79/83/1015267983.db2.gz YPXZMERCPGVOHX-SJCJKPOMSA-N 1 0 334.803 3.941 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+]CCc2ccc(Cl)nc2)cc1[N+](=O)[O-] ZINC000154248300 1015296565 /nfs/dbraw/zinc/29/65/65/1015296565.db2.gz WEUKBRRQZFRVIZ-LBPRGKRZSA-N 1 0 349.818 3.935 20 5 EHBDRO Cc1ncc([N+](=O)[O-])n1CC[N@H+](C1CC1)[C@H]1CCCc2ccccc21 ZINC001167707977 1016408315 /nfs/dbraw/zinc/40/83/15/1016408315.db2.gz IXFSSFGTNQFINF-SFHVURJKSA-N 1 0 340.427 3.642 20 5 EHBDRO COc1c(O)ccc(C[NH2+][C@H]2CCc3c2cccc3Cl)c1[N+](=O)[O-] ZINC000892679956 1016571886 /nfs/dbraw/zinc/57/18/86/1016571886.db2.gz KJZMXMMZEGVENQ-AWEZNQCLSA-N 1 0 348.786 3.740 20 5 EHBDRO CC(C)c1ccc(C[NH+]2CCC(c3ccncn3)CC2)cc1[N+](=O)[O-] ZINC000414473783 1016767885 /nfs/dbraw/zinc/76/78/85/1016767885.db2.gz WHRKECJWNKNMIU-UHFFFAOYSA-N 1 0 340.427 3.888 20 5 EHBDRO CC1(C)C[N@H+](Cc2cc(=O)oc3ccc4ccccc4c23)CC[C@@H]1O ZINC000275435429 1016771611 /nfs/dbraw/zinc/77/16/11/1016771611.db2.gz JPPADSZWJPZAOK-SFHVURJKSA-N 1 0 337.419 3.539 20 5 EHBDRO CC(C)c1nc(CC[NH2+][C@H](C)Cc2ccccc2[N+](=O)[O-])cs1 ZINC000449111455 1032192323 /nfs/dbraw/zinc/19/23/23/1032192323.db2.gz MCJXDMMIIXUATJ-CYBMUJFWSA-N 1 0 333.457 3.938 20 5 EHBDRO COc1cccc(C[C@H](C)[NH2+][C@@H](C)Cc2ccccc2[N+](=O)[O-])c1 ZINC000449145402 1032248499 /nfs/dbraw/zinc/24/84/99/1032248499.db2.gz XTEMKDGDWVHPNY-GJZGRUSLSA-N 1 0 328.412 3.755 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOc2ccccc21 ZINC000449150220 1032251052 /nfs/dbraw/zinc/25/10/52/1032251052.db2.gz ZCOGRDQEYSNKTM-ZBFHGGJFSA-N 1 0 326.396 3.682 20 5 EHBDRO CC[C@@H](Cc1ccc([N+](=O)[O-])cc1)c1nc([C@H]([NH3+])CC(C)C)no1 ZINC000414626514 1017077729 /nfs/dbraw/zinc/07/77/29/1017077729.db2.gz YDWDRRHQFYDRDI-DZGCQCFKSA-N 1 0 332.404 3.760 20 5 EHBDRO COC[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1ccc(F)cc1 ZINC000449168830 1032261639 /nfs/dbraw/zinc/26/16/39/1032261639.db2.gz BQQHQBULUFVTJH-CXAGYDPISA-N 1 0 332.375 3.642 20 5 EHBDRO COc1cccc(OCC[NH2+][C@@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000538279591 1032266806 /nfs/dbraw/zinc/26/68/06/1032266806.db2.gz NUGCOZFKNZDHKM-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO COc1cccc(OCC[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)c1 ZINC000538279594 1032266947 /nfs/dbraw/zinc/26/69/47/1032266947.db2.gz NUGCOZFKNZDHKM-CQSZACIVSA-N 1 0 330.384 3.641 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)COCc1ccccc1 ZINC000449176129 1032269917 /nfs/dbraw/zinc/26/99/17/1032269917.db2.gz SCVSYEHTKFDIQX-CVEARBPZSA-N 1 0 328.412 3.721 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](C[C@H](C)O)c1ccccc1 ZINC000449192678 1032289404 /nfs/dbraw/zinc/28/94/04/1032289404.db2.gz UUQNPOFUQJFAGA-JTDSTZFVSA-N 1 0 342.439 3.670 20 5 EHBDRO CCC1(CC)C[NH+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C1 ZINC000459593914 1032314950 /nfs/dbraw/zinc/31/49/50/1032314950.db2.gz JRFASCQUBTWJAX-UHFFFAOYSA-N 1 0 328.416 3.617 20 5 EHBDRO C[C@@H]1CCCC[C@]1(C)[NH2+]CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl ZINC000459620313 1032332384 /nfs/dbraw/zinc/33/23/84/1032332384.db2.gz VORGGMARBNDKMV-BZNIZROVSA-N 1 0 339.823 3.745 20 5 EHBDRO COc1ccc2c(c1)OC[C@H]([NH2+][C@@H](C)c1cc([N+](=O)[O-])ccc1C)C2 ZINC000536842897 1032338750 /nfs/dbraw/zinc/33/87/50/1032338750.db2.gz BDCZPCICLMFIKW-DZGCQCFKSA-N 1 0 342.395 3.566 20 5 EHBDRO CC(C)[C@@H]([NH2+][C@H](C)Cc1ccccc1[N+](=O)[O-])c1nc(C2CC2)no1 ZINC000449223160 1032339327 /nfs/dbraw/zinc/33/93/27/1032339327.db2.gz JJFCNZVLJXUWHV-MLGOLLRUSA-N 1 0 344.415 3.773 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+]C3CC(c4cccc(F)c4)C3)nc2c1 ZINC000278753216 1032341792 /nfs/dbraw/zinc/34/17/92/1032341792.db2.gz SHMDAGWNDPVUAJ-UHFFFAOYSA-N 1 0 340.358 3.646 20 5 EHBDRO COc1ccc(C)cc1[C@H](C)[NH2+]CCOc1ccc([N+](=O)[O-])cc1 ZINC000536855656 1032352817 /nfs/dbraw/zinc/35/28/17/1032352817.db2.gz AVKDSFNBQKCLLU-AWEZNQCLSA-N 1 0 330.384 3.641 20 5 EHBDRO COc1ccc([C@H](C)[C@@H](C)[NH2+]CCOc2ccc([N+](=O)[O-])cc2)cc1 ZINC000536856859 1032354552 /nfs/dbraw/zinc/35/45/52/1032354552.db2.gz GYJLXIZCJXMAMO-HUUCEWRRSA-N 1 0 344.411 3.764 20 5 EHBDRO C[C@@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)c1nc2c(s1)CCC2 ZINC000459645384 1032366676 /nfs/dbraw/zinc/36/66/76/1032366676.db2.gz GKDWITWLUBHBKE-RYUDHWBXSA-N 1 0 331.441 3.822 20 5 EHBDRO C[C@H](Cc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@H]1OCCc2sccc21 ZINC000449341121 1032457372 /nfs/dbraw/zinc/45/73/72/1032457372.db2.gz RVMABCVOGBMVQO-FHSNZYRGSA-N 1 0 346.452 3.879 20 5 EHBDRO CO[C@H]1C[C@H]([NH2+]Cc2cc([N+](=O)[O-])ccc2C(F)(F)F)C12CCC2 ZINC000459777493 1032463875 /nfs/dbraw/zinc/46/38/75/1032463875.db2.gz WBAGSUGENWSUKP-KBPBESRZSA-N 1 0 344.333 3.661 20 5 EHBDRO Cc1cc(C[NH2+][C@@H]2CCC[C@@H]2Cc2ccccc2[N+](=O)[O-])ccn1 ZINC000449401460 1032524357 /nfs/dbraw/zinc/52/43/57/1032524357.db2.gz HCVQZJTUUPQPPN-SJLPKXTDSA-N 1 0 325.412 3.799 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@@H](C)C(=O)NCC2CCCCC2)cc1[N+](=O)[O-] ZINC000537173940 1032547975 /nfs/dbraw/zinc/54/79/75/1032547975.db2.gz POFZTQJOPBDIPY-CABCVRRESA-N 1 0 347.459 3.639 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CC(=O)N(CC(C)C)CC(C)C)cc1[N+](=O)[O-] ZINC000537175595 1032548741 /nfs/dbraw/zinc/54/87/41/1032548741.db2.gz RKNUOAYACXKCLH-INIZCTEOSA-N 1 0 349.475 3.694 20 5 EHBDRO CC(C)[C@H](O)C1(C[NH2+][C@@H]2CCC[C@H]2Cc2ccccc2[N+](=O)[O-])CC1 ZINC000537307303 1032613879 /nfs/dbraw/zinc/61/38/79/1032613879.db2.gz PJNGFFZFRSMZQY-WDYCEAGBSA-N 1 0 346.471 3.693 20 5 EHBDRO COC[C@@H](C[NH2+]Cc1csc([N+](=O)[O-])c1)c1ccc(Cl)cc1 ZINC000449482434 1032629457 /nfs/dbraw/zinc/62/94/57/1032629457.db2.gz YMOALJRKUUUIJV-CYBMUJFWSA-N 1 0 340.832 3.830 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H]2CCC[N@H+](Cc3cccc4nccn43)C2)cc1 ZINC000449497632 1032668044 /nfs/dbraw/zinc/66/80/44/1032668044.db2.gz ISNPWGZRWUEOGL-MRXNPFEDSA-N 1 0 336.395 3.622 20 5 EHBDRO COCc1nc(CN2CCC[C@H](c3ccc([N+](=O)[O-])cc3)C2)cs1 ZINC000449501944 1032677402 /nfs/dbraw/zinc/67/74/02/1032677402.db2.gz QNPANMIQKOLNCY-AWEZNQCLSA-N 1 0 347.440 3.577 20 5 EHBDRO CC(C)[N@H+](C)CC1CCN(c2ccnc3cc([N+](=O)[O-])ccc32)CC1 ZINC000593459077 1032703015 /nfs/dbraw/zinc/70/30/15/1032703015.db2.gz XDHNLGHACKTDQW-UHFFFAOYSA-N 1 0 342.443 3.700 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)[C@@H](C)c1ccccc1)C(=O)Nc1cccc([N+](=O)[O-])c1 ZINC000177479488 1017678385 /nfs/dbraw/zinc/67/83/85/1017678385.db2.gz YSCUYAHJWPQHCF-ILXRZTDVSA-N 1 0 341.411 3.704 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+][C@@H](C)c2cc[nH]c(=O)c2)cc1[N+](=O)[O-] ZINC000340448121 1017863988 /nfs/dbraw/zinc/86/39/88/1017863988.db2.gz GDUPUWUVPYTMNF-NEPJUHHUSA-N 1 0 331.372 3.506 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2noc([C@H]3CCC[N@@H+]3C3CCCC3)n2)cc1 ZINC000275643007 1017874538 /nfs/dbraw/zinc/87/45/38/1017874538.db2.gz ORTIKRVOXRALMZ-OAHLLOKOSA-N 1 0 328.372 3.724 20 5 EHBDRO CC[C@H]([NH2+]Cc1ccc(Oc2ccc(F)cc2)c([N+](=O)[O-])c1)[C@H](C)O ZINC000449545698 1032735138 /nfs/dbraw/zinc/73/51/38/1032735138.db2.gz UCLODQUDXLHCEM-LRDDRELGSA-N 1 0 348.374 3.775 20 5 EHBDRO CCc1ccc([C@H](C[NH2+]Cc2ccc(C)c([N+](=O)[O-])c2)N(C)C)cc1 ZINC000517524747 1018260028 /nfs/dbraw/zinc/26/00/28/1018260028.db2.gz IANXPBWQQKVFNR-FQEVSTJZSA-N 1 0 341.455 3.858 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH2+]CCN2CCCCC2)s1 ZINC000517542188 1018296833 /nfs/dbraw/zinc/29/68/33/1018296833.db2.gz OTFQLUULZRAQEY-UHFFFAOYSA-N 1 0 345.468 3.899 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[NH+]3C4CCCC3CCC4)n2)c1 ZINC000610370031 1018543660 /nfs/dbraw/zinc/54/36/60/1018543660.db2.gz QIIRVXOEDHSTST-UHFFFAOYSA-N 1 0 328.372 3.552 20 5 EHBDRO Cc1cc(N[C@H]2CCO[C@H](C(C)(C)C)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000541191201 1018635425 /nfs/dbraw/zinc/63/54/25/1018635425.db2.gz SGXFLCQYBDUSOX-UGSOOPFHSA-N 1 0 343.427 3.879 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCC(=O)Nc2ccc([N+](=O)[O-])cc2)cc1 ZINC000182324864 1019060140 /nfs/dbraw/zinc/06/01/40/1019060140.db2.gz RXRUZHJMABIVLN-AWEZNQCLSA-N 1 0 327.384 3.583 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)N1CC[C@H]([N@H+](C)Cc2ccccc2)C1 ZINC000610433516 1019126576 /nfs/dbraw/zinc/12/65/76/1019126576.db2.gz PJCFFHQZCSWPFS-JXFKEZNVSA-N 1 0 339.439 3.862 20 5 EHBDRO Cc1ccccc1C1CC[NH+](C[C@H](O)c2cccc([N+](=O)[O-])c2)CC1 ZINC000178861385 1019307604 /nfs/dbraw/zinc/30/76/04/1019307604.db2.gz VKFALJVRWIHKBN-FQEVSTJZSA-N 1 0 340.423 3.816 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H](O)C[NH2+]C2(c3ccc(F)cc3)CCCC2)c1 ZINC000178868939 1019319564 /nfs/dbraw/zinc/31/95/64/1019319564.db2.gz IHGFQGBMKAATHT-GOSISDBHSA-N 1 0 344.386 3.826 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+]CCC[C@H]1CCCC[C@@H]1O)C1CC1 ZINC000090544256 1019387275 /nfs/dbraw/zinc/38/72/75/1019387275.db2.gz ALEURVDILDGAKT-KPFFTGBYSA-N 1 0 346.471 3.837 20 5 EHBDRO CC[C@@H]([NH2+]Cc1ccc(C(N)=O)cc1[N+](=O)[O-])c1cccc(Cl)c1 ZINC000182585015 1019712977 /nfs/dbraw/zinc/71/29/77/1019712977.db2.gz OWXKCQDNMMPWJA-OAHLLOKOSA-N 1 0 347.802 3.588 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@H]3CCCOCC3)o2)c([N+](=O)[O-])c1 ZINC000345693113 1020436558 /nfs/dbraw/zinc/43/65/58/1020436558.db2.gz ODTPKVUZTVSQNE-ZDUSSCGKSA-N 1 0 346.383 3.522 20 5 EHBDRO CC1(C)C[C@@H](O)CC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000449617287 1032903041 /nfs/dbraw/zinc/90/30/41/1032903041.db2.gz GRMHERDVTPMAIE-INIZCTEOSA-N 1 0 344.411 3.838 20 5 EHBDRO CC1(C)C[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC(C)(C)C1 ZINC000501030966 1020651101 /nfs/dbraw/zinc/65/11/01/1020651101.db2.gz HOSOLTQSANSIHW-UHFFFAOYSA-N 1 0 333.432 3.682 20 5 EHBDRO CC[C@@H](C)[C@@H](C)[N@H+](CCC(=O)Nc1ccccc1[N+](=O)[O-])C1CC1 ZINC000501138307 1020727744 /nfs/dbraw/zinc/72/77/44/1020727744.db2.gz XTNUSENHHZKUON-ZIAGYGMSSA-N 1 0 333.432 3.822 20 5 EHBDRO Cc1nn(C)cc1[C@@H](C)[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000279622705 1020783179 /nfs/dbraw/zinc/78/31/79/1020783179.db2.gz YIWKJCZSVSOENQ-SECBINFHSA-N 1 0 342.321 3.506 20 5 EHBDRO O=C(CC[N@@H+](Cc1ccccc1[N+](=O)[O-])C1CC1)Nc1ccccc1 ZINC000135226289 1020919251 /nfs/dbraw/zinc/91/92/51/1020919251.db2.gz HYJZXUOCVSRGLG-UHFFFAOYSA-N 1 0 339.395 3.588 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]Cc2ccc([N+](=O)[O-])c(F)c2)cc1[N+](=O)[O-] ZINC000276328784 1021042536 /nfs/dbraw/zinc/04/25/36/1021042536.db2.gz QPYFGOPTQCDYTN-LLVKDONJSA-N 1 0 333.319 3.801 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+]CCc2nnc(C(C)C)s2)cc1[N+](=O)[O-] ZINC000426302950 1021222821 /nfs/dbraw/zinc/22/28/21/1021222821.db2.gz VIPCZSWALZHWOW-LBPRGKRZSA-N 1 0 334.445 3.771 20 5 EHBDRO Cc1c(C(=O)N(CC[NH+]2CCCCCC2)C(C)C)cccc1[N+](=O)[O-] ZINC000345995352 1021486892 /nfs/dbraw/zinc/48/68/92/1021486892.db2.gz LSGHYRGAMPDNSC-UHFFFAOYSA-N 1 0 347.459 3.630 20 5 EHBDRO CC[C@@H]([NH2+]CCc1cccc([N+](=O)[O-])c1)c1ccc(OC)c(OC)c1 ZINC000090910083 1021715119 /nfs/dbraw/zinc/71/51/19/1021715119.db2.gz SGQQTUZUWDROCC-QGZVFWFLSA-N 1 0 344.411 3.895 20 5 EHBDRO O=C(CC[NH2+][C@H](c1ccccc1)C1CC1)Nc1ccccc1[N+](=O)[O-] ZINC000179107405 1033018368 /nfs/dbraw/zinc/01/83/68/1033018368.db2.gz JBFGVJWXMGDFGM-LJQANCHMSA-N 1 0 339.395 3.664 20 5 EHBDRO CCc1ccc([C@@H](NC[C@@H](C)C[NH+](C)C)c2ccc([N+](=O)[O-])cc2)o1 ZINC000425941609 1022326418 /nfs/dbraw/zinc/32/64/18/1022326418.db2.gz CBYDUJPNXICIAY-KUHUBIRLSA-N 1 0 345.443 3.627 20 5 EHBDRO CC[C@H]([NH2+]CCc1ccc([N+](=O)[O-])cc1)c1ccc2c(c1)OCCO2 ZINC000341587334 1022421184 /nfs/dbraw/zinc/42/11/84/1022421184.db2.gz JGIJVNXLWIYCKN-KRWDZBQOSA-N 1 0 342.395 3.649 20 5 EHBDRO COc1ccccc1C[C@@H](C)[N@H+](C)CCOc1cccc([N+](=O)[O-])c1 ZINC000441429212 1022533920 /nfs/dbraw/zinc/53/39/20/1022533920.db2.gz NQMMMCVNPUAKIZ-OAHLLOKOSA-N 1 0 344.411 3.545 20 5 EHBDRO CC[C@@H](C[NH2+]Cc1nc2cc([N+](=O)[O-])ccc2o1)CC(F)(F)F ZINC000602692222 1033071011 /nfs/dbraw/zinc/07/10/11/1033071011.db2.gz WLCWDZCXZTYFKE-SECBINFHSA-N 1 0 331.294 3.804 20 5 EHBDRO C[C@H]([NH2+][C@@H](C)c1ccc(-n2cncn2)cc1)c1ccc([N+](=O)[O-])cc1 ZINC000178325483 1022667961 /nfs/dbraw/zinc/66/79/61/1022667961.db2.gz IVXIAYLPIPWLEZ-KBPBESRZSA-N 1 0 337.383 3.587 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@@H]1NC(=O)c1cc([N+](=O)[O-])ccc1C ZINC000430819338 1022723599 /nfs/dbraw/zinc/72/35/99/1022723599.db2.gz BJFMVZSJXAONIX-YJBOKZPZSA-N 1 0 347.459 3.534 20 5 EHBDRO CC(C)(C)[C@H]1CCC[C@@H]1[NH2+]C1CCN(c2ccc([N+](=O)[O-])nc2)CC1 ZINC000602695448 1033075595 /nfs/dbraw/zinc/07/55/95/1033075595.db2.gz WGVJKGKGWLJMLT-IRXDYDNUSA-N 1 0 346.475 3.763 20 5 EHBDRO O=[N+]([O-])c1ccc2oc(C[N@H+](C[C@H]3CCCO3)C3CCCC3)nc2c1 ZINC000610582759 1022824588 /nfs/dbraw/zinc/82/45/88/1022824588.db2.gz VSTDMEQYGZDITG-OAHLLOKOSA-N 1 0 345.399 3.660 20 5 EHBDRO CCOCCC[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000518248178 1023156449 /nfs/dbraw/zinc/15/64/49/1023156449.db2.gz LANTWSVHJASRAI-UHFFFAOYSA-N 1 0 343.427 3.879 20 5 EHBDRO C[C@H]([NH2+]C1CCN(c2ccccc2)CC1)c1cccc([N+](=O)[O-])c1 ZINC000266841725 1023174531 /nfs/dbraw/zinc/17/45/31/1023174531.db2.gz GYMRIYQVJGGXBN-HNNXBMFYSA-N 1 0 325.412 3.914 20 5 EHBDRO CCC1(C)CC[NH+]([C@H](C)C(=O)Nc2cccc([N+](=O)[O-])c2C)CC1 ZINC000507197370 1023175636 /nfs/dbraw/zinc/17/56/36/1023175636.db2.gz PXBIHRMQGGRVDL-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+]Cc2ccccc2OCC2CC2)cc1 ZINC000518275350 1023186303 /nfs/dbraw/zinc/18/63/03/1023186303.db2.gz QWSJBJYTBMQSAK-UHFFFAOYSA-N 1 0 326.396 3.716 20 5 EHBDRO Cc1nc(N[C@H](C[NH+]2CCCCC2)c2ccccc2)ccc1[N+](=O)[O-] ZINC000610755082 1023454426 /nfs/dbraw/zinc/45/44/26/1023454426.db2.gz HVWXGXBRZPJEEI-QGZVFWFLSA-N 1 0 340.427 3.937 20 5 EHBDRO C[C@@H]1CC[N@H+](Cc2cn(C)nc2-c2ccc([N+](=O)[O-])cc2)C[C@@H](C)C1 ZINC000535799467 1023646293 /nfs/dbraw/zinc/64/62/93/1023646293.db2.gz QDNHRWUFFNRLCY-CABCVRRESA-N 1 0 342.443 3.863 20 5 EHBDRO CCOC[C@H]([NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C(C)C ZINC000474097933 1024163836 /nfs/dbraw/zinc/16/38/36/1024163836.db2.gz SXNHWDHDNUPQLN-NJAFHUGGSA-N 1 0 334.460 3.957 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+][C@H]3CC34CC(O)C4)o2)c(Cl)c1 ZINC000897851103 1033209107 /nfs/dbraw/zinc/20/91/07/1033209107.db2.gz PHJMXVIIMUZYEX-BROWOHMESA-N 1 0 348.786 3.511 20 5 EHBDRO Cc1ccc(C[NH2+]CCc2cn(C)c3cc(F)ccc23)cc1[N+](=O)[O-] ZINC000472045518 1024472024 /nfs/dbraw/zinc/47/20/24/1024472024.db2.gz TYQOKLCCMOVZPO-UHFFFAOYSA-N 1 0 341.386 3.866 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2nccc3c2cccc3[N+](=O)[O-])C1 ZINC000450381271 1024511898 /nfs/dbraw/zinc/51/18/98/1024511898.db2.gz ULDKJSBLZKZNHY-AWEZNQCLSA-N 1 0 328.416 3.533 20 5 EHBDRO C[C@@H]([NH2+]CCc1c[nH]c2ccc([N+](=O)[O-])cc12)c1cccc(O)c1 ZINC000514628269 1024617665 /nfs/dbraw/zinc/61/76/65/1024617665.db2.gz MMIZZLXSRFZAIC-GFCCVEGCSA-N 1 0 325.368 3.675 20 5 EHBDRO Cn1cnc([N+](=O)[O-])c1C[NH2+]C1(c2cccc(Cl)c2)CCCC1 ZINC000342265735 1024625441 /nfs/dbraw/zinc/62/54/41/1024625441.db2.gz OGSCRWADCIXAFC-UHFFFAOYSA-N 1 0 334.807 3.541 20 5 EHBDRO O=[N+]([O-])c1cc(C(F)(F)F)ccc1C[NH2+]C[C@H]1CCC2(CCC2)O1 ZINC000895677912 1024708639 /nfs/dbraw/zinc/70/86/39/1024708639.db2.gz TXEYKAFEIQFBTK-CYBMUJFWSA-N 1 0 344.333 3.805 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nc(-c3ccc([N+](=O)[O-])cc3)no2)[C@@H]2CCCC[C@H]21 ZINC000248454931 1024768942 /nfs/dbraw/zinc/76/89/42/1024768942.db2.gz ZOMHRVPJMGIDPC-UHOFOFEASA-N 1 0 342.399 3.655 20 5 EHBDRO COCC[C@H](C)[NH2+]Cc1ccc(N(C)c2ccccc2)c([N+](=O)[O-])c1 ZINC000507942948 1024788446 /nfs/dbraw/zinc/78/84/46/1024788446.db2.gz VZONIMICYHLMPF-HNNXBMFYSA-N 1 0 343.427 3.877 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CC2(CCC2)[C@H]1C1CCOCC1 ZINC000425373054 1024901617 /nfs/dbraw/zinc/90/16/17/1024901617.db2.gz PGLCYOMVBYFQCY-GOSISDBHSA-N 1 0 330.428 3.684 20 5 EHBDRO Cc1nn(C(C)(C)C)cc1[C@@H](C)[NH2+]CCOc1ccccc1[N+](=O)[O-] ZINC000157562357 1024954102 /nfs/dbraw/zinc/95/41/02/1024954102.db2.gz WZZGTGQNVNLTIW-CYBMUJFWSA-N 1 0 346.431 3.584 20 5 EHBDRO O=[N+]([O-])c1ccc(NC[C@@H]2CC[N@H+](Cc3ccccc3)C2)c(F)c1 ZINC000310359403 1025131294 /nfs/dbraw/zinc/13/12/94/1025131294.db2.gz JMDZSCXHTSNBFJ-HNNXBMFYSA-N 1 0 329.375 3.668 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@@H+](Cc2ccccc2)C[C@@H]2CCCO2)cc1 ZINC000053232645 1025193029 /nfs/dbraw/zinc/19/30/29/1025193029.db2.gz KYNJOTKUFOIWAG-IBGZPJMESA-N 1 0 326.396 3.776 20 5 EHBDRO Cc1cc(N2C[C@@H]([NH+]3CCCC3)C[C@H]2C)c2cccc([N+](=O)[O-])c2n1 ZINC000515392845 1025203350 /nfs/dbraw/zinc/20/33/50/1025203350.db2.gz BOJFNZMLJZMNNF-CABCVRRESA-N 1 0 340.427 3.514 20 5 EHBDRO C[NH+](C)CCc1ccccc1NC(=O)c1cc(Cl)cc([N+](=O)[O-])c1 ZINC000474614177 1025221947 /nfs/dbraw/zinc/22/19/47/1025221947.db2.gz BHXXKAHJWCOZHG-UHFFFAOYSA-N 1 0 347.802 3.605 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]Cc1cnc(Cl)s1 ZINC000895154419 1025223824 /nfs/dbraw/zinc/22/38/24/1025223824.db2.gz ZBXCMNUSMRISID-JTQLQIEISA-N 1 0 325.821 3.816 20 5 EHBDRO CC(=O)c1ccc(NCCCC[NH+]2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])c1 ZINC000515550770 1025344070 /nfs/dbraw/zinc/34/40/70/1025344070.db2.gz ITCHDEQCZDZGEO-GJZGRUSLSA-N 1 0 347.459 3.967 20 5 EHBDRO C[N@H+](CCCOc1ccc(F)cc1)CCOc1cccc([N+](=O)[O-])c1 ZINC000521423277 1025372637 /nfs/dbraw/zinc/37/26/37/1025372637.db2.gz HZFIOAPDOURLCS-UHFFFAOYSA-N 1 0 348.374 3.514 20 5 EHBDRO CCOC(=O)[C@@H]1CC[C@H]([NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)C1 ZINC000436293312 1025557126 /nfs/dbraw/zinc/55/71/26/1025557126.db2.gz CSOHZFVCSWQACI-IGCXYCKISA-N 1 0 346.427 3.639 20 5 EHBDRO Cc1ccccc1NC(=O)[C@@H](C)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1 ZINC000451098549 1025558995 /nfs/dbraw/zinc/55/89/95/1025558995.db2.gz IIBVOHNXKMBGOF-UONOGXRCSA-N 1 0 327.384 3.581 20 5 EHBDRO C[NH+](C)[C@@H]1CCC[C@@H](NC(=O)c2cc3ccccc3c3cccnc23)C1 ZINC000487423002 1025669505 /nfs/dbraw/zinc/66/95/05/1025669505.db2.gz VEJMGQQWTSVOJI-IAGOWNOFSA-N 1 0 347.462 3.991 20 5 EHBDRO CCN(CC)[C@H](C[NH2+]Cc1cccc([N+](=O)[O-])c1)Cc1ccccc1 ZINC000521819155 1025706059 /nfs/dbraw/zinc/70/60/59/1025706059.db2.gz UHKHHWMBKMTBLC-FQEVSTJZSA-N 1 0 341.455 3.638 20 5 EHBDRO CN(CCC[NH3+])Cc1ccc(Oc2ccccc2Cl)c([N+](=O)[O-])c1 ZINC000521875203 1025753134 /nfs/dbraw/zinc/75/31/34/1025753134.db2.gz UKHKUVWUECJQOM-UHFFFAOYSA-N 1 0 349.818 3.821 20 5 EHBDRO C/C=C/C[C@H](CO)[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000185822769 1025948697 /nfs/dbraw/zinc/94/86/97/1025948697.db2.gz MBEXILMJOAEBSM-BAABZTOOSA-N 1 0 332.425 3.740 20 5 EHBDRO C[C@@H](O)[C@@H]1C[C@H](C)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)o1 ZINC000443789394 1026044522 /nfs/dbraw/zinc/04/45/22/1026044522.db2.gz MCQOUCOXQPPUKP-LBTNJELSSA-N 1 0 344.411 3.836 20 5 EHBDRO COCCSCCC[N@@H+]1CCC[C@@H](c2ccc([N+](=O)[O-])cc2)C1 ZINC000451550452 1026102137 /nfs/dbraw/zinc/10/21/37/1026102137.db2.gz RTLUEPSCFZWVPI-MRXNPFEDSA-N 1 0 338.473 3.544 20 5 EHBDRO C[C@H](CCCc1cccnc1)[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1 ZINC000840775541 1026148719 /nfs/dbraw/zinc/14/87/19/1026148719.db2.gz QGPSJWAUCZXWGE-ZIAGYGMSSA-N 1 0 328.416 3.634 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[N@@H+]1CCCN(c2ccccc2F)CC1 ZINC000582453525 1026309193 /nfs/dbraw/zinc/30/91/93/1026309193.db2.gz ONUCUVRPKHEFRU-UHFFFAOYSA-N 1 0 343.402 3.755 20 5 EHBDRO COc1ccc([N+](=O)[O-])cc1C[N@@H+]1CC[C@H](Cc2ccc(F)cc2)C1 ZINC000523010914 1026357284 /nfs/dbraw/zinc/35/72/84/1026357284.db2.gz ZSNBQSLSJYTZNR-OAHLLOKOSA-N 1 0 344.386 3.807 20 5 EHBDRO CCOC(=O)C1(C)CCC([NH2+]Cc2cccc([N+](=O)[O-])c2C)CC1 ZINC000475223428 1026399697 /nfs/dbraw/zinc/39/96/97/1026399697.db2.gz HEVRFMKNAQYXIU-UHFFFAOYSA-N 1 0 334.416 3.505 20 5 EHBDRO COc1cccc(N[C@@H]2CC[N@@H+]([C@@H](C)c3ccccc3)C2)c1[N+](=O)[O-] ZINC000475354945 1026509757 /nfs/dbraw/zinc/50/97/57/1026509757.db2.gz SYEYGSMTLNSUBY-GOEBONIOSA-N 1 0 341.411 3.851 20 5 EHBDRO CCC(=O)c1ccc(NC[C@@H](C)C[NH+]2CCCCC2)c([N+](=O)[O-])c1 ZINC000479375511 1026617322 /nfs/dbraw/zinc/61/73/22/1026617322.db2.gz ZGJSRBRVFXUTQQ-CQSZACIVSA-N 1 0 333.432 3.721 20 5 EHBDRO CC(C)C[C@H](CNc1c([N+](=O)[O-])ncn1C)[NH2+][C@@H](C)c1ccccc1 ZINC000347326209 1026900508 /nfs/dbraw/zinc/90/05/08/1026900508.db2.gz WWRZQWCBGVLCKN-GOEBONIOSA-N 1 0 345.447 3.506 20 5 EHBDRO C[C@@H]1COCC[C@H]1[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000277826146 1027066652 /nfs/dbraw/zinc/06/66/52/1027066652.db2.gz LIPAXUMUQNHJBQ-MLGOLLRUSA-N 1 0 332.425 3.838 20 5 EHBDRO Cc1c([C@H](C)[NH2+]CCc2nn(C)c3ccccc23)cccc1[N+](=O)[O-] ZINC000186485278 1027374729 /nfs/dbraw/zinc/37/47/29/1027374729.db2.gz DBNPRAXDIRZIDL-AWEZNQCLSA-N 1 0 338.411 3.683 20 5 EHBDRO O=[N+]([O-])c1ccc2ccnc(NC3CC([NH+]4CCCCC4)C3)c2c1 ZINC000413270597 1027407598 /nfs/dbraw/zinc/40/75/98/1027407598.db2.gz QPONDNHFUMEZBM-UHFFFAOYSA-N 1 0 326.400 3.572 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+][C@H]2CC[C@H](CO)CC2)c2ccccc2)c1 ZINC000453139209 1027447072 /nfs/dbraw/zinc/44/70/72/1027447072.db2.gz MKXATHSMUHLFEJ-XFQXTVEOSA-N 1 0 340.423 3.825 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)cc1C[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000783597400 1027627358 /nfs/dbraw/zinc/62/73/58/1027627358.db2.gz MRGYVHMMRDAZTI-CQSZACIVSA-N 1 0 331.803 3.708 20 5 EHBDRO Cc1ccc(C[N@@H+]2CC[C@H](Oc3cccc(F)c3)C2)cc1[N+](=O)[O-] ZINC000612403792 1028075366 /nfs/dbraw/zinc/07/53/66/1028075366.db2.gz CUADPUGCSXSWJX-KRWDZBQOSA-N 1 0 330.359 3.696 20 5 EHBDRO C[C@H]1C[C@@H](c2ccccc2)C[N@@H+]1Cc1nc2cc([N+](=O)[O-])ccc2[nH]1 ZINC000444648632 1028111956 /nfs/dbraw/zinc/11/19/56/1028111956.db2.gz HKHOHHZCBJCWGN-DZGCQCFKSA-N 1 0 336.395 3.849 20 5 EHBDRO CCOC(=O)C1CCC([NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)CC1 ZINC000237160905 1028112678 /nfs/dbraw/zinc/11/26/78/1028112678.db2.gz WRCOMWUIBQACHA-VQCLRJIVSA-N 1 0 334.416 3.676 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[NH2+][C@H](Cc3ccccc3)C3CC3)nc2c1 ZINC000444688390 1028160945 /nfs/dbraw/zinc/16/09/45/1028160945.db2.gz JKWIZOWWEYRLLA-QGZVFWFLSA-N 1 0 336.395 3.582 20 5 EHBDRO COCC[C@@H]1CCC[C@@H]1[NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1 ZINC000502433132 1028200737 /nfs/dbraw/zinc/20/07/37/1028200737.db2.gz HADIDYOVOXODTB-WFASDCNBSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@H](N[C@H]1CCC[NH2+]C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000423178622 1028247466 /nfs/dbraw/zinc/24/74/66/1028247466.db2.gz CEWQDLKJGBPAFE-STQMWFEESA-N 1 0 331.441 3.726 20 5 EHBDRO CC[C@@H](CSc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H](N)c1ccccc1 ZINC000423231343 1028297295 /nfs/dbraw/zinc/29/72/95/1028297295.db2.gz ATJJXOJRWLWFCJ-JKSUJKDBSA-N 1 0 345.468 3.755 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](N)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000423232352 1028299950 /nfs/dbraw/zinc/29/99/50/1028299950.db2.gz BYTXJAFFSWWZLW-ROUUACIJSA-N 1 0 325.412 3.607 20 5 EHBDRO CCc1nc2c(s1)[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1OC)CCC2 ZINC000178729526 1028377827 /nfs/dbraw/zinc/37/78/27/1028377827.db2.gz HWOHEPQHQVERLZ-CYBMUJFWSA-N 1 0 347.440 3.790 20 5 EHBDRO O=[N+]([O-])c1ccc(CC[NH2+][C@@H](c2ccccc2)c2ccncc2)cc1 ZINC000327304230 1028432115 /nfs/dbraw/zinc/43/21/15/1028432115.db2.gz RQLDVTDVFKGWNB-FQEVSTJZSA-N 1 0 333.391 3.912 20 5 EHBDRO CCc1ccccc1[C@H](N)C[NH2+][C@H](C)c1ccc(C)c([N+](=O)[O-])c1 ZINC000423498602 1028464040 /nfs/dbraw/zinc/46/40/40/1028464040.db2.gz IHTHBDVDRFCBNK-RDTXWAMCSA-N 1 0 327.428 3.816 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@@H+]1CC[C@H](Cc2ccncc2)C1 ZINC000613179300 1028578420 /nfs/dbraw/zinc/57/84/20/1028578420.db2.gz SLKYQLLHTDNKSB-DOTOQJQBSA-N 1 0 325.412 3.924 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCc3cccnc3CC2)cc1[N+](=O)[O-] ZINC000421832677 1028822859 /nfs/dbraw/zinc/82/28/59/1028822859.db2.gz GRJDGCMMPFMPJI-WMLDXEAASA-N 1 0 325.412 3.896 20 5 EHBDRO CCc1ccc([N+](=O)[O-])cc1NC(=O)NC[C@@H](C)[N@@H+]1CCCC[C@@H]1C ZINC000514892761 1029047724 /nfs/dbraw/zinc/04/77/24/1029047724.db2.gz BAPUVPWRCTZNCY-UONOGXRCSA-N 1 0 348.447 3.542 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2cccc(OC)c2)cc1[N+](=O)[O-] ZINC000504905162 1029050693 /nfs/dbraw/zinc/05/06/93/1029050693.db2.gz DKXOBAINTIIVCP-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO CCOc1ccc([C@@H](C)NC[C@@H](C)C[NH+]2CCCCC2)cc1[N+](=O)[O-] ZINC000504927452 1029073104 /nfs/dbraw/zinc/07/31/04/1029073104.db2.gz PAQMFSIPRGYPME-HZPDHXFCSA-N 1 0 349.475 3.766 20 5 EHBDRO C[N@H+](CCc1ccc([N+](=O)[O-])cc1)Cc1ccc(OC(F)F)cc1 ZINC000524425762 1029180889 /nfs/dbraw/zinc/18/08/89/1029180889.db2.gz SVEZVYPPBAHLMT-UHFFFAOYSA-N 1 0 336.338 3.871 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CCOc1cccc(C(F)(F)F)c1 ZINC000237850722 1029455840 /nfs/dbraw/zinc/45/58/40/1029455840.db2.gz UGVYUMUTBWAHGK-UHFFFAOYSA-N 1 0 340.301 3.782 20 5 EHBDRO CCCC[NH+]1CCC(Nc2ccc([N+](=O)[O-])c(OC(F)F)c2)CC1 ZINC000525186131 1029732851 /nfs/dbraw/zinc/73/28/51/1029732851.db2.gz BJMPGHFTFYMZGQ-UHFFFAOYSA-N 1 0 343.374 3.873 20 5 EHBDRO C[C@@H]1[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3[nH]2)C[C@H]1c1ccccc1 ZINC000446848001 1029817262 /nfs/dbraw/zinc/81/72/62/1029817262.db2.gz CVZLEWACHFLIHZ-XGWLTEMNSA-N 1 0 336.395 3.753 20 5 EHBDRO Cc1ccc2[nH]c(C[NH2+]Cc3nc4cc([N+](=O)[O-])ccc4[nH]3)cc2c1C ZINC000446844143 1029824870 /nfs/dbraw/zinc/82/48/70/1029824870.db2.gz DVKIVVWSJUUEEA-UHFFFAOYSA-N 1 0 349.394 3.859 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+]2CCC[C@@H]2CCO)s1 ZINC000428466034 1029909214 /nfs/dbraw/zinc/90/92/14/1029909214.db2.gz URZGXCKTZRTJKH-CYBMUJFWSA-N 1 0 332.425 3.670 20 5 EHBDRO CC[C@@H](C)[NH2+][C@H](CNc1nc(C)cc(C)c1[N+](=O)[O-])c1ccco1 ZINC000343258797 1029959359 /nfs/dbraw/zinc/95/93/59/1029959359.db2.gz WDZPYGKJWYWTFV-TZMCWYRMSA-N 1 0 332.404 3.741 20 5 EHBDRO CCC(C)(C)[C@H]1CCC[N@@H+]1CC(=O)Nc1c(C)cccc1[N+](=O)[O-] ZINC000156875953 1030086871 /nfs/dbraw/zinc/08/68/71/1030086871.db2.gz DOELQVPQOVMRMG-OAHLLOKOSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H](CC(C)(C)O)[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000453325784 1030109493 /nfs/dbraw/zinc/10/94/93/1030109493.db2.gz RQJFXFMWAADXJG-RDTXWAMCSA-N 1 0 328.412 3.823 20 5 EHBDRO Cc1c([C@H](C)[NH2+][C@H]2CCO[C@@H](c3ccncc3)C2)cccc1[N+](=O)[O-] ZINC000453340684 1030124538 /nfs/dbraw/zinc/12/45/38/1030124538.db2.gz HXMRYHUBEQEOPA-URLQWDBASA-N 1 0 341.411 3.869 20 5 EHBDRO CCOc1ccc([C@H](C)[N@@H+]2CCC[C@]3(CCOC3)C2)cc1[N+](=O)[O-] ZINC000453365345 1030180570 /nfs/dbraw/zinc/18/05/70/1030180570.db2.gz LVARIAAIFKWXAN-KSSFIOAISA-N 1 0 334.416 3.557 20 5 EHBDRO COc1ccc(OCC[N@H+](C)[C@@H](C)c2ccc(F)cc2)c([N+](=O)[O-])c1 ZINC000441268173 1030211919 /nfs/dbraw/zinc/21/19/19/1030211919.db2.gz YADADBSJLUBKHC-ZDUSSCGKSA-N 1 0 348.374 3.814 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCCC[C@H]2OCC)cc1[N+](=O)[O-] ZINC000453396260 1030248377 /nfs/dbraw/zinc/24/83/77/1030248377.db2.gz HJXAQVHCTQBEMU-YSVLISHTSA-N 1 0 336.432 3.992 20 5 EHBDRO CC(C)(C[NH2+][C@H]1CCCC[C@H]1n1ccc([N+](=O)[O-])n1)c1cccs1 ZINC000447529085 1030250843 /nfs/dbraw/zinc/25/08/43/1030250843.db2.gz LBMPAUBUZRGHTB-UONOGXRCSA-N 1 0 348.472 3.904 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCn1cnc3ccccc31)CCC2 ZINC000447536406 1030270756 /nfs/dbraw/zinc/27/07/56/1030270756.db2.gz NAPFVXLHXRUSDU-QGZVFWFLSA-N 1 0 336.395 3.612 20 5 EHBDRO C[C@@H](CC(C)(C)C)[NH2+][C@H](c1nccn1C)c1ccc([N+](=O)[O-])cc1 ZINC000453430002 1030284934 /nfs/dbraw/zinc/28/49/34/1030284934.db2.gz QCYWCWJAUHGVON-BBRMVZONSA-N 1 0 330.432 3.832 20 5 EHBDRO CCc1ccc([C@H](CO)[NH2+][C@@H]2CCCc3ccc([N+](=O)[O-])cc32)cc1 ZINC000447575020 1030295157 /nfs/dbraw/zinc/29/51/57/1030295157.db2.gz PTEHBWRBHBSBPE-UXHICEINSA-N 1 0 340.423 3.858 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@@H]([NH2+][C@@H](CCO)C1CCCCC1)CCC2 ZINC000447577649 1030339129 /nfs/dbraw/zinc/33/91/29/1030339129.db2.gz ASYRKHDWDMJGCT-OALUTQOASA-N 1 0 332.444 3.893 20 5 EHBDRO Cc1c([C@H](C)NC2CC[NH+](C3CCCC3)CC2)cccc1[N+](=O)[O-] ZINC000160481673 1030787170 /nfs/dbraw/zinc/78/71/70/1030787170.db2.gz IRSXAKWDBWUFPS-HNNXBMFYSA-N 1 0 331.460 3.961 20 5 EHBDRO C[N@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])o1)[C@@H](CO)C(C)(C)C ZINC000537658640 1030885515 /nfs/dbraw/zinc/88/55/15/1030885515.db2.gz NLRUOQDKOIRFIG-KRWDZBQOSA-N 1 0 332.400 3.694 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2noc(C[N@H+](CC3CC3)CC3CCC3)n2)c1 ZINC000483259469 1031070374 /nfs/dbraw/zinc/07/03/74/1031070374.db2.gz FGIIXGJZOLXWRN-UHFFFAOYSA-N 1 0 342.399 3.657 20 5 EHBDRO C[C@H](Nc1cccc(OCC[NH+](C)C)c1)c1cccc([N+](=O)[O-])c1 ZINC000325117457 1031129433 /nfs/dbraw/zinc/12/94/33/1031129433.db2.gz OZEVTJSIFJTNFW-AWEZNQCLSA-N 1 0 329.400 3.708 20 5 EHBDRO COc1cc(N[C@H](C)C[N@H+](C)Cc2ccccc2)c(F)cc1[N+](=O)[O-] ZINC000385862918 1031274721 /nfs/dbraw/zinc/27/47/21/1031274721.db2.gz XEFWZDOPBHZFGG-CYBMUJFWSA-N 1 0 347.390 3.675 20 5 EHBDRO CC(C)CC[C@@](C)(O)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000484137811 1031476182 /nfs/dbraw/zinc/47/61/82/1031476182.db2.gz UBYWTDDZHQEGEO-IEBWSBKVSA-N 1 0 334.460 3.693 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCCc3c(OC)cccc32)cc1[N+](=O)[O-] ZINC000584032320 1031504859 /nfs/dbraw/zinc/50/48/59/1031504859.db2.gz HHEHDWZNIFIMQQ-MRXNPFEDSA-N 1 0 342.395 3.779 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1ccc(Cl)cc1[N+](=O)[O-] ZINC000475740200 1031737552 /nfs/dbraw/zinc/73/75/52/1031737552.db2.gz AXWZDOUMUIVVDQ-KRWDZBQOSA-N 1 0 348.830 3.938 20 5 EHBDRO C[C@H]([NH2+]Cc1cc([N+](=O)[O-])cc(C(F)(F)F)c1)c1cccnc1 ZINC000278674735 1031947291 /nfs/dbraw/zinc/94/72/91/1031947291.db2.gz HBASJLBTXWJGHY-JTQLQIEISA-N 1 0 325.290 3.859 20 5 EHBDRO CSc1cc(C[NH2+][C@H](C)CCc2ccccc2[N+](=O)[O-])ccn1 ZINC000537936211 1032020926 /nfs/dbraw/zinc/02/09/26/1032020926.db2.gz GMAAFRPFYIQKFG-CYBMUJFWSA-N 1 0 331.441 3.823 20 5 EHBDRO C[C@@H](COCC(F)(F)F)[NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000278699041 1032053779 /nfs/dbraw/zinc/05/37/79/1032053779.db2.gz KVQLHVRKUBJWIX-HZMBPMFUSA-N 1 0 332.322 3.529 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]C[C@@H]3CCC=CCCC3)CC2)cn1 ZINC000898031550 1033295984 /nfs/dbraw/zinc/29/59/84/1033295984.db2.gz FNLGFOGVVLQWFT-MRXNPFEDSA-N 1 0 344.459 3.685 20 5 EHBDRO CCS[C@@H]1CC[C@@H]([N@H+](C)Cn2ncc3cc([N+](=O)[O-])ccc32)C1 ZINC000173487868 1033369043 /nfs/dbraw/zinc/36/90/43/1033369043.db2.gz NYBDKGJUYQAWRW-UKRRQHHQSA-N 1 0 334.445 3.508 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C1CC1)[C@@H]1CCCCO1 ZINC000594510173 1033415390 /nfs/dbraw/zinc/41/53/90/1033415390.db2.gz HYIYBPVVVGLGRP-CCKFTAQKSA-N 1 0 332.444 3.853 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)C[NH2+]CCc1ncc(C)cc1C ZINC000594519216 1033425474 /nfs/dbraw/zinc/42/54/74/1033425474.db2.gz FGFCKFRCYUHCJW-XNTDXEJSSA-N 1 0 325.412 3.842 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@H]1CCC2(CCCC2)O1 ZINC000594519915 1033427666 /nfs/dbraw/zinc/42/76/66/1033427666.db2.gz MPXAJHWHCMHZRD-DOTOQJQBSA-N 1 0 332.444 3.997 20 5 EHBDRO C[C@@H](CCc1ccccc1[N+](=O)[O-])[NH2+]C[C@@H]1CCC2(CCCC2)O1 ZINC000594519917 1033427810 /nfs/dbraw/zinc/42/78/10/1033427810.db2.gz MPXAJHWHCMHZRD-RDJZCZTQSA-N 1 0 332.444 3.997 20 5 EHBDRO O=[N+]([O-])c1ccc(N[C@@H]2CCC[N@@H+]3CCCC[C@@H]23)cc1OC(F)F ZINC000594597683 1033444314 /nfs/dbraw/zinc/44/43/14/1033444314.db2.gz DXMKCTXRFCIURB-OLZOCXBDSA-N 1 0 341.358 3.625 20 5 EHBDRO C[C@H](Nc1ccc(C(F)(F)F)cc1[N+](=O)[O-])C1=CC[N@H+](C)CC1 ZINC000511307901 1033549949 /nfs/dbraw/zinc/54/99/49/1033549949.db2.gz NMJHOMKSIXYKHK-JTQLQIEISA-N 1 0 329.322 3.676 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+]C[C@@H]1C[C@H](c2ccccc2)CO1 ZINC000594975425 1033581250 /nfs/dbraw/zinc/58/12/50/1033581250.db2.gz UWUWYTCKBGPFGP-HKUYNNGSSA-N 1 0 326.396 3.566 20 5 EHBDRO COC[C@H](C)Oc1ccc(C[NH2+]Cc2cccc([N+](=O)[O-])c2C)cc1 ZINC000594939258 1033587810 /nfs/dbraw/zinc/58/78/10/1033587810.db2.gz UDEUNZKXHKIRDB-AWEZNQCLSA-N 1 0 344.411 3.607 20 5 EHBDRO O=[N+]([O-])c1cccc(C[NH2+]C[C@@H]2CCN(c3ccccc3Cl)C2)c1 ZINC000594956873 1033597590 /nfs/dbraw/zinc/59/75/90/1033597590.db2.gz WCCNVLRWNHWARC-HNNXBMFYSA-N 1 0 345.830 3.864 20 5 EHBDRO COC[C@@H](Cc1ccccc1)[NH2+][C@@H](C)c1ccc([N+](=O)[O-])cc1OC ZINC000595011467 1033604506 /nfs/dbraw/zinc/60/45/06/1033604506.db2.gz HOQPSTJSHXREKQ-GOEBONIOSA-N 1 0 344.411 3.512 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCCNc1ccccc1 ZINC000595011079 1033606637 /nfs/dbraw/zinc/60/66/37/1033606637.db2.gz WUZGMUPPLJYXKI-AWEZNQCLSA-N 1 0 329.400 3.756 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1C[NH2+][C@H](c1ccccc1)[C@H](O)C(C)C ZINC000594991081 1033622337 /nfs/dbraw/zinc/62/23/37/1033622337.db2.gz ZHFWSYVYYRAZTL-RTBURBONSA-N 1 0 328.412 3.751 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]C[C@H](O)[C@H](C)c1ccccc1 ZINC000594999582 1033626649 /nfs/dbraw/zinc/62/66/49/1033626649.db2.gz CAPRUGYZUJASPS-OUAFYBQWSA-N 1 0 340.423 3.752 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)[NH2+]C[C@@H](c1ccccc1)N(C)C ZINC000595003161 1033628779 /nfs/dbraw/zinc/62/87/79/1033628779.db2.gz FKWJXWFHEUCCAW-KDOFPFPSSA-N 1 0 343.427 3.557 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]C[C@H](c1ccsc1)N(C)C ZINC000595002980 1033629096 /nfs/dbraw/zinc/62/90/96/1033629096.db2.gz AMTRFQWLQNIGDN-BLLLJJGKSA-N 1 0 349.456 3.618 20 5 EHBDRO COc1ccc(CC[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1F ZINC000595009162 1033633373 /nfs/dbraw/zinc/63/33/73/1033633373.db2.gz ANAVOEPYAFCUPP-LBPRGKRZSA-N 1 0 348.374 3.644 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CCO[C@H]2CC2(F)F)c2ccccc2)c1 ZINC000595067688 1033644348 /nfs/dbraw/zinc/64/43/48/1033644348.db2.gz GHOLBDHDTJUNRH-DLBZAZTESA-N 1 0 348.349 3.698 20 5 EHBDRO CCOC1CCC([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])CC1 ZINC000595034683 1033654931 /nfs/dbraw/zinc/65/49/31/1033654931.db2.gz SJZGDNQYLLVWRW-UHFFFAOYSA-N 1 0 326.824 3.728 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CCc1cccc2[nH]ccc21 ZINC000595040763 1033660427 /nfs/dbraw/zinc/66/04/27/1033660427.db2.gz WSTIAGSAGAFIGS-ZDUSSCGKSA-N 1 0 339.395 3.978 20 5 EHBDRO C[C@H](Nc1ccc(C(F)(F)F)c([N+](=O)[O-])c1)C1CC[NH+](C)CC1 ZINC000599044353 1033672764 /nfs/dbraw/zinc/67/27/64/1033672764.db2.gz PNPNSCJKDVKZDC-JTQLQIEISA-N 1 0 331.338 3.756 20 5 EHBDRO C[C@H]([NH2+]C[C@H]1CCN1Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000595101251 1033691684 /nfs/dbraw/zinc/69/16/84/1033691684.db2.gz CPRMHLBZSKSZKX-HNAYVOBHSA-N 1 0 325.412 3.520 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@@H]2Cc2cnn(C)c2)cc1[N+](=O)[O-] ZINC000595083757 1033699322 /nfs/dbraw/zinc/69/93/22/1033699322.db2.gz CAMGBAPOOJLOKC-BMGDILEWSA-N 1 0 342.443 3.699 20 5 EHBDRO O=[N+]([O-])c1cccc2c1CC[C@H]2[NH2+]C[C@H]1CCN1C1CCCCC1 ZINC000599064264 1033702939 /nfs/dbraw/zinc/70/29/39/1033702939.db2.gz LXEGXCNRDGFZFE-CRAIPNDOSA-N 1 0 329.444 3.579 20 5 EHBDRO Cc1ccc(C(C)(C)C[NH2+][C@@H]2CCc3c2cccc3[N+](=O)[O-])nc1 ZINC000599068340 1033709347 /nfs/dbraw/zinc/70/93/47/1033709347.db2.gz NGFGRHOMNYDFDW-MRXNPFEDSA-N 1 0 325.412 3.853 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]C[C@@H]1CCN1C1CCCC1)CCC2 ZINC000599074673 1033717691 /nfs/dbraw/zinc/71/76/91/1033717691.db2.gz UFNNVVQHAAJIFI-PKOBYXMFSA-N 1 0 329.444 3.579 20 5 EHBDRO COc1ccc([C@H]([NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2)C2CC2)cn1 ZINC000599093023 1033730616 /nfs/dbraw/zinc/73/06/16/1033730616.db2.gz MEDBTRPCEIIGQC-KPZWWZAWSA-N 1 0 327.384 3.800 20 5 EHBDRO Cc1noc(C[N@@H+]2CC[C@@](C)(CCc3ccccc3)C2)c1[N+](=O)[O-] ZINC000595340897 1033733583 /nfs/dbraw/zinc/73/35/83/1033733583.db2.gz YNGPCEUNNPKQLO-GOSISDBHSA-N 1 0 329.400 3.736 20 5 EHBDRO COC(=O)c1ccc([N+](=O)[O-])c(C[NH2+]C(C)(C)c2cccc(C)c2)c1 ZINC000593017865 1033817045 /nfs/dbraw/zinc/81/70/45/1033817045.db2.gz COGBWLOJZBNSCX-UHFFFAOYSA-N 1 0 342.395 3.715 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@@H+]1CCC[C@@H](CCF)C1 ZINC000595754773 1033983535 /nfs/dbraw/zinc/98/35/35/1033983535.db2.gz BULVCDAIMWZLBJ-OLZOCXBDSA-N 1 0 348.378 3.777 20 5 EHBDRO C[C@H](c1cccc([N+](=O)[O-])c1)[N@@H+]1CC[C@@H](C(=O)OC(C)(C)C)[C@H](C)C1 ZINC000599594352 1034035324 /nfs/dbraw/zinc/03/53/24/1034035324.db2.gz GGPISTBYGQZJIB-CKEIUWERSA-N 1 0 348.443 3.956 20 5 EHBDRO COc1cccc(C[C@@H]2CCC[N@@H+]2Cc2csc([N+](=O)[O-])c2)c1 ZINC000603936113 1034049889 /nfs/dbraw/zinc/04/98/89/1034049889.db2.gz FVQFIFJQMKFMRD-HNNXBMFYSA-N 1 0 332.425 3.872 20 5 EHBDRO C/C=C/C[C@@H]1CCC[N@H+](Cc2nnc(-c3ccc([N+](=O)[O-])cc3)o2)C1 ZINC000599691141 1034095698 /nfs/dbraw/zinc/09/56/98/1034095698.db2.gz QSLZBPZLRWGHBB-BAABZTOOSA-N 1 0 342.399 3.823 20 5 EHBDRO CN(Cc1c(Cl)cccc1[N+](=O)[O-])[C@@H](CCO)c1ccccc1 ZINC000119241717 1034119591 /nfs/dbraw/zinc/11/95/91/1034119591.db2.gz KFDVJVYXXPXYDS-INIZCTEOSA-N 1 0 334.803 3.804 20 5 EHBDRO CC[C@H](CCO)C[NH2+]Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000152655260 1034127324 /nfs/dbraw/zinc/12/73/24/1034127324.db2.gz KXZJVNGBJSGSTL-CYBMUJFWSA-N 1 0 334.441 3.822 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])s2)CCCO1 ZINC000179397378 1034279242 /nfs/dbraw/zinc/27/92/42/1034279242.db2.gz IVNIQRFEIFZRBQ-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO C[C@@H]1CCC[N@@H+]1Cc1cccc(-c2cc([N+](=O)[O-])ccc2CO)c1 ZINC000596634288 1034338982 /nfs/dbraw/zinc/33/89/82/1034338982.db2.gz IIXYFJAZHUAKRP-CQSZACIVSA-N 1 0 326.396 3.738 20 5 EHBDRO CCc1cc(CCC[N@H+](Cc2cccc([N+](=O)[O-])c2)C2CC2)on1 ZINC000450495940 1034429764 /nfs/dbraw/zinc/42/97/64/1034429764.db2.gz CGPBTFRIVZFCNC-UHFFFAOYSA-N 1 0 329.400 3.742 20 5 EHBDRO O=[N+]([O-])c1ccn([C@H]2CCCC[C@H]2[NH2+]Cc2cccc3[nH]ccc32)n1 ZINC000601321003 1034452841 /nfs/dbraw/zinc/45/28/41/1034452841.db2.gz MQXQDGNQYZGNKK-SJORKVTESA-N 1 0 339.399 3.546 20 5 EHBDRO C/C(=C\c1cccc([N+](=O)[O-])c1)CN1CCOc2ccc(O)cc2C1 ZINC000597232758 1034612656 /nfs/dbraw/zinc/61/26/56/1034612656.db2.gz WWWXWLHJKCQHDP-NTEUORMPSA-N 1 0 340.379 3.598 20 5 EHBDRO CCCO[C@H]1CCC[N@H+](Cc2ccc([N+](=O)[O-])c(OCC)c2)CC1 ZINC000365191457 1034956249 /nfs/dbraw/zinc/95/62/49/1034956249.db2.gz SEDBGUAMKFEAHG-INIZCTEOSA-N 1 0 336.432 3.775 20 5 EHBDRO C[C@@H](Cc1ccc(O)cc1)[NH2+]CCCCc1ccc([N+](=O)[O-])cc1 ZINC000511428219 1035402563 /nfs/dbraw/zinc/40/25/63/1035402563.db2.gz WUZRFLHKZIKKQO-HNNXBMFYSA-N 1 0 328.412 3.844 20 5 EHBDRO CC(C)(C)[C@H](CCO)[NH2+]Cc1ccc(-c2ccccc2[N+](=O)[O-])o1 ZINC000581282679 1035483288 /nfs/dbraw/zinc/48/32/88/1035483288.db2.gz LQOLWZFYLXABDF-KRWDZBQOSA-N 1 0 332.400 3.742 20 5 EHBDRO CC[NH+](CC)C[C@H](C)N[C@@H](c1ccc([N+](=O)[O-])cc1)C(F)(F)F ZINC000581612116 1035529364 /nfs/dbraw/zinc/52/93/64/1035529364.db2.gz CPOFWSYTJAVJBV-FZMZJTMJSA-N 1 0 333.354 3.518 20 5 EHBDRO CC[C@H](CSc1ccccc1[N+](=O)[O-])[NH2+][C@@H]1CSC[C@H]1C ZINC000571528589 1035545191 /nfs/dbraw/zinc/54/51/91/1035545191.db2.gz YSVKVPSZRMFLAC-JHJVBQTASA-N 1 0 326.487 3.807 20 5 EHBDRO CC[N@H+](CCc1ccccc1)Cc1cc(OC)c(F)cc1[N+](=O)[O-] ZINC000463488892 1035554905 /nfs/dbraw/zinc/55/49/05/1035554905.db2.gz FTOAAUUJTPRYQV-UHFFFAOYSA-N 1 0 332.375 3.807 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+][C@H]2CCN(C(=O)OC(C)(C)C)C2)cc1[N+](=O)[O-] ZINC000164526117 1035652617 /nfs/dbraw/zinc/65/26/17/1035652617.db2.gz KHVVKDNCTPWAQD-HIFRSBDPSA-N 1 0 349.431 3.563 20 5 EHBDRO C[N@@H+]1CC[C@@H]2[C@H](CCCN2c2ccc(C(F)(F)F)c([N+](=O)[O-])c2)C1 ZINC000589113832 1036258043 /nfs/dbraw/zinc/25/80/43/1036258043.db2.gz ZOXJYGLTYCGZAP-BXUZGUMPSA-N 1 0 343.349 3.534 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]1CCC[C@@H]1[NH2+][C@@H](CO)c1ccccc1 ZINC000130206895 1036347680 /nfs/dbraw/zinc/34/76/80/1036347680.db2.gz QVVRQNNWCZEGAY-NEWSRXKRSA-N 1 0 340.423 3.629 20 5 EHBDRO CC(C)Oc1ccc([N+](=O)[O-])cc1CN1CCS[C@@H](C(C)C)C1 ZINC000464768907 1036758852 /nfs/dbraw/zinc/75/88/52/1036758852.db2.gz CKODGWTZWSKJFR-QGZVFWFLSA-N 1 0 338.473 3.955 20 5 EHBDRO Cc1cc(N2CCC[C@H]([NH2+]C(C)C)C2)c([N+](=O)[O-])cc1C(F)(F)F ZINC000590134324 1036783902 /nfs/dbraw/zinc/78/39/02/1036783902.db2.gz JDVGQOVGPHPXFW-LBPRGKRZSA-N 1 0 345.365 3.889 20 5 EHBDRO O=[N+]([O-])c1ccc(C(F)(F)F)c(C[NH+]2CCC3(CCOC3)CC2)c1 ZINC000590169318 1036784430 /nfs/dbraw/zinc/78/44/30/1036784430.db2.gz NRHPIDOGPNRLNH-UHFFFAOYSA-N 1 0 344.333 3.616 20 5 EHBDRO CC1(C)[C@H]([NH2+]CCCCc2ccc([N+](=O)[O-])cc2)[C@H]2CCCO[C@H]21 ZINC000539507465 1036828326 /nfs/dbraw/zinc/82/83/26/1036828326.db2.gz CLVCBCBZOWLMCV-KZNAEPCWSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[NH2+]CCc1ccc2ccccc2n1 ZINC000539497815 1036831296 /nfs/dbraw/zinc/83/12/96/1036831296.db2.gz YSLUPUILUISFMV-VMPITWQZSA-N 1 0 333.391 3.989 20 5 EHBDRO O=[N+]([O-])c1ccc2c(cnn2C[N@@H+]2CCC[C@@H]2Cc2ccccc2)c1 ZINC000026233084 1036837929 /nfs/dbraw/zinc/83/79/29/1036837929.db2.gz XBHVZMWIYTWYAC-QGZVFWFLSA-N 1 0 336.395 3.609 20 5 EHBDRO CC[NH+](CC)C[C@@H]1CCCC[C@H]1NCc1csc([N+](=O)[O-])c1 ZINC000539531025 1036886566 /nfs/dbraw/zinc/88/65/66/1036886566.db2.gz OYEIKQQHERQRTO-LSDHHAIUSA-N 1 0 325.478 3.647 20 5 EHBDRO COc1cc(NC[C@H](c2ccco2)[NH+]2CCCC2)c([N+](=O)[O-])cc1C ZINC000590570293 1036954623 /nfs/dbraw/zinc/95/46/23/1036954623.db2.gz YJYDEPFWFKWLQZ-MRXNPFEDSA-N 1 0 345.399 3.754 20 5 EHBDRO C[C@@H]1C[C@H](N[C@H](c2ccccc2)c2cccc([N+](=O)[O-])c2)CC[N@@H+]1C ZINC000493233796 1036958207 /nfs/dbraw/zinc/95/82/07/1036958207.db2.gz UYHZXTBHFAACFG-XFQXTVEOSA-N 1 0 339.439 3.757 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]C[C@@H]2CCC[C@H](O)C2)c2ccccc2)c1 ZINC000180621647 1037017290 /nfs/dbraw/zinc/01/72/90/1037017290.db2.gz LMXDYXDCLQPVJV-UIAACRFSSA-N 1 0 340.423 3.825 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)CC[N@H+]1C[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000542049072 1037026980 /nfs/dbraw/zinc/02/69/80/1037026980.db2.gz QBNUFHDVKNYMBN-LESCRADOSA-N 1 0 345.443 3.742 20 5 EHBDRO CC(C)C[N@@H+]1CC[C@@H](CNc2ccc([N+](=O)[O-])c(OC(F)F)c2)C1 ZINC000465052460 1037089952 /nfs/dbraw/zinc/08/99/52/1037089952.db2.gz ITNDUCREBREZMK-LBPRGKRZSA-N 1 0 343.374 3.586 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H](CCO)c2cccs2)cc1Cl ZINC000761527379 1037105277 /nfs/dbraw/zinc/10/52/77/1037105277.db2.gz UMEUNJGQJNFHRP-LBPRGKRZSA-N 1 0 326.805 3.523 20 5 EHBDRO CC[C@H](CCO)C[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000180738933 1037134622 /nfs/dbraw/zinc/13/46/22/1037134622.db2.gz MHZBLGFFSLEZNF-DNVCBOLYSA-N 1 0 328.412 3.682 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+](C)C[C@H]2CC=CCC2)cccc1[N+](=O)[O-] ZINC000542252164 1037200981 /nfs/dbraw/zinc/20/09/81/1037200981.db2.gz VNWNGCSEMUGCLC-HNNXBMFYSA-N 1 0 331.416 3.520 20 5 EHBDRO COc1ccc(-c2ccc(C[NH2+][C@]3(C)CCO[C@@H]3C)o2)c([N+](=O)[O-])c1 ZINC000542316625 1037281869 /nfs/dbraw/zinc/28/18/69/1037281869.db2.gz WUQDVDGPPMAKMV-KZULUSFZSA-N 1 0 346.383 3.521 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]4COCC[C@H]43)o2)cc1 ZINC000539891303 1037313774 /nfs/dbraw/zinc/31/37/74/1037313774.db2.gz RUDYXGBYVIUFIZ-CRAIPNDOSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@@H+]3CCC[C@@H]4COCC[C@@H]43)o2)cc1 ZINC000539891305 1037314626 /nfs/dbraw/zinc/31/46/26/1037314626.db2.gz RUDYXGBYVIUFIZ-QAPCUYQASA-N 1 0 342.395 3.856 20 5 EHBDRO C[C@H](c1ccccc1)[C@@H](O)C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21 ZINC000595104921 1037361068 /nfs/dbraw/zinc/36/10/68/1037361068.db2.gz AETSHWYITOEDCG-XMCHAPAWSA-N 1 0 340.423 3.726 20 5 EHBDRO CC1(C)[C@H](O)CC[N@@H+]1Cc1ccc(-c2ccc([N+](=O)[O-])cc2)s1 ZINC000462871958 1037500776 /nfs/dbraw/zinc/50/07/76/1037500776.db2.gz RTAWQAVWLLEQSQ-MRXNPFEDSA-N 1 0 332.425 3.669 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]CCN(C)Cc1ccccc1 ZINC000532477031 1037508155 /nfs/dbraw/zinc/50/81/55/1037508155.db2.gz HJLSPGUVETYEHD-INIZCTEOSA-N 1 0 327.428 3.686 20 5 EHBDRO CCc1ccc([C@H](NC[C@H]2CCCC[NH2+]2)c2ccc([N+](=O)[O-])cc2)o1 ZINC000591578053 1037514585 /nfs/dbraw/zinc/51/45/85/1037514585.db2.gz PUYIIQRLMNBUCR-DNVCBOLYSA-N 1 0 343.427 3.571 20 5 EHBDRO COC(=O)[C@@H](C)[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1C)c1ccccc1 ZINC000177415299 1037523252 /nfs/dbraw/zinc/52/32/52/1037523252.db2.gz DAZLGBNQFLQYAC-KSSFIOAISA-N 1 0 342.395 3.543 20 5 EHBDRO COc1cc(C[NH2+]C[C@@H]2CCCCC(F)(F)C2)c([N+](=O)[O-])cc1O ZINC000491599203 1037578498 /nfs/dbraw/zinc/57/84/98/1037578498.db2.gz PAPHHIBAQDNBLO-LLVKDONJSA-N 1 0 344.358 3.614 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+]CC(C)(C)N1CCCCC1 ZINC000468638905 1037602433 /nfs/dbraw/zinc/60/24/33/1037602433.db2.gz CSASZBUGIGLMQI-VBKFSLOCSA-N 1 0 331.460 3.852 20 5 EHBDRO O=[N+]([O-])c1ccc(OCC[NH2+][C@@H](Cc2ccccc2)C2CC2)cc1 ZINC000540168302 1037637031 /nfs/dbraw/zinc/63/70/31/1037637031.db2.gz IEPURVDDELXHGW-IBGZPJMESA-N 1 0 326.396 3.585 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)N[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000415921114 1037643054 /nfs/dbraw/zinc/64/30/54/1037643054.db2.gz QGLZVEBURCRITP-CYBMUJFWSA-N 1 0 342.399 3.587 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)CC[N@@H+]1C[C@@H](C)CCC[C@@H]1C ZINC000532571304 1037671493 /nfs/dbraw/zinc/67/14/93/1037671493.db2.gz LWZWJXVAISYVKV-ZFWWWQNUSA-N 1 0 333.432 3.742 20 5 EHBDRO CC[C@H](CC(F)(F)F)[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000760903265 1037687560 /nfs/dbraw/zinc/68/75/60/1037687560.db2.gz QFPVLPSWIWODRH-GFCCVEGCSA-N 1 0 345.365 3.884 20 5 EHBDRO CC[NH2+]Cc1ccccc1NC(=O)N[C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000415944038 1037692804 /nfs/dbraw/zinc/69/28/04/1037692804.db2.gz NMWHNRLDGDUFTC-ZDUSSCGKSA-N 1 0 342.399 3.587 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@@H]1[NH2+][C@@H]1CCC[C@H]2OCC[C@@H]21 ZINC000130513648 1037704801 /nfs/dbraw/zinc/70/48/01/1037704801.db2.gz OZUKGUZJUILZFB-UNWJWSRZSA-N 1 0 344.455 3.853 20 5 EHBDRO CC(C)(C[NH2+]Cc1ccc([N+](=O)[O-])c(Cl)c1)C1CCOCC1 ZINC000897448885 1037761943 /nfs/dbraw/zinc/76/19/43/1037761943.db2.gz ZHTASHKBTQUVMO-UHFFFAOYSA-N 1 0 326.824 3.791 20 5 EHBDRO CC[C@H]([NH2+][C@@H](C)C(=O)Nc1cccc([N+](=O)[O-])c1)c1ccccc1 ZINC000341220568 1037781706 /nfs/dbraw/zinc/78/17/06/1037781706.db2.gz NVGNGAFCBIGPCG-GUYCJALGSA-N 1 0 327.384 3.663 20 5 EHBDRO CCC[C@H]([NH2+]C[C@H](O)c1cccc(F)c1)c1cccc([N+](=O)[O-])c1 ZINC000157658656 1037796051 /nfs/dbraw/zinc/79/60/51/1037796051.db2.gz CCTQZLLSPLHGJU-ROUUACIJSA-N 1 0 332.375 3.898 20 5 EHBDRO Cc1nn(C(C)C)c(C)c1C[NH2+]C[C@H](C)c1ccccc1[N+](=O)[O-] ZINC000897458717 1037797536 /nfs/dbraw/zinc/79/75/36/1037797536.db2.gz CVLFOLZLHLDMON-ZDUSSCGKSA-N 1 0 330.432 3.882 20 5 EHBDRO CC[C@H]1CCCC[N@@H+]1Cc1cc(OC)c(OC(F)F)cc1[N+](=O)[O-] ZINC000058452117 1037917843 /nfs/dbraw/zinc/91/78/43/1037917843.db2.gz OUVUTAFDCXTQLD-LBPRGKRZSA-N 1 0 344.358 3.969 20 5 EHBDRO COc1cc(C[NH+]2C[C@@H](C)C[C@H](C)C2)c([N+](=O)[O-])cc1OC(F)F ZINC000058452154 1037917883 /nfs/dbraw/zinc/91/78/83/1037917883.db2.gz DRRSURSTSGYQBE-QWRGUYRKSA-N 1 0 344.358 3.683 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH2+]CC[C@@H]1CSc2ccccc2O1 ZINC000592373104 1037922711 /nfs/dbraw/zinc/92/27/11/1037922711.db2.gz UIUMLNCGYLQPNO-CQSZACIVSA-N 1 0 330.409 3.628 20 5 EHBDRO O=[N+]([O-])c1ccn([C@@H]2CCCC[C@H]2[NH2+]C[C@H]2C[C@@H]2c2ccccc2)n1 ZINC000592393134 1037934062 /nfs/dbraw/zinc/93/40/62/1037934062.db2.gz FKBQORGHIHZAQX-BRSBDYLESA-N 1 0 340.427 3.668 20 5 EHBDRO COc1ccc(C[NH2+][C@@H](CC(C)C)c2ccncc2)cc1[N+](=O)[O-] ZINC000592387237 1037953378 /nfs/dbraw/zinc/95/33/78/1037953378.db2.gz AGNFMYDOBDCGOK-INIZCTEOSA-N 1 0 329.400 3.875 20 5 EHBDRO COCCOc1ccccc1C[NH2+]C[C@@H](C)c1ccccc1[N+](=O)[O-] ZINC000897469603 1038109128 /nfs/dbraw/zinc/10/91/28/1038109128.db2.gz NEEHOCXEMVXTSB-OAHLLOKOSA-N 1 0 344.411 3.513 20 5 EHBDRO COc1cc(CN2CC[C@](F)(c3ccccc3F)C2)ccc1[N+](=O)[O-] ZINC000549415742 1038454408 /nfs/dbraw/zinc/45/44/08/1038454408.db2.gz PKKLOWZBIVQXQN-GOSISDBHSA-N 1 0 348.349 3.813 20 5 EHBDRO C[C@H]1C[N@H+](C)CCN1Cc1ccc(-c2ccc([N+](=O)[O-])cc2Cl)o1 ZINC000538730127 1038497498 /nfs/dbraw/zinc/49/74/98/1038497498.db2.gz IGCPDLKCHAJVQI-LBPRGKRZSA-N 1 0 349.818 3.644 20 5 EHBDRO C[N@@H+](Cc1ccc(-c2ccccc2[N+](=O)[O-])s1)C[C@H]1CCC[C@H]1O ZINC000538812484 1038548341 /nfs/dbraw/zinc/54/83/41/1038548341.db2.gz RSVXKRXWDSVLFW-CXAGYDPISA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1cccc(C(=O)Nc2cccc3c2C[N@@H+](C2CC2)C3)c1[N+](=O)[O-] ZINC000378527090 1038700770 /nfs/dbraw/zinc/70/07/70/1038700770.db2.gz SNLZFRHCQRCHQO-UHFFFAOYSA-N 1 0 337.379 3.634 20 5 EHBDRO Cc1cccc([C@H](C)[NH2+][C@@H](C)C(=O)Nc2ccc([N+](=O)[O-])cc2)c1C ZINC000539290611 1038763094 /nfs/dbraw/zinc/76/30/94/1038763094.db2.gz ARCFYBURAKYVCX-GJZGRUSLSA-N 1 0 341.411 3.889 20 5 EHBDRO CC[C@@]1(CO)CCC[N@H+](Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000190224129 1038772932 /nfs/dbraw/zinc/77/29/32/1038772932.db2.gz FYSLLEUGKPXIDC-LJQANCHMSA-N 1 0 344.411 3.839 20 5 EHBDRO CC(C)(CNc1ccccc1[N+](=O)[O-])[N@@H+]1CCc2ccccc2C1 ZINC000026725626 1038818355 /nfs/dbraw/zinc/81/83/55/1038818355.db2.gz PYOLEDQSUJJXDV-UHFFFAOYSA-N 1 0 325.412 3.844 20 5 EHBDRO Cc1c([C@H](C)[NH2+]C[C@](C)(CO)Cc2ccccc2)cccc1[N+](=O)[O-] ZINC000477861703 1038972482 /nfs/dbraw/zinc/97/24/82/1038972482.db2.gz NDTWNOJKLIIYPE-OXJNMPFZSA-N 1 0 342.439 3.795 20 5 EHBDRO Cc1c(C[NH2+][C@@H]2CCN([C@H](C)c3ccccc3)C2)cccc1[N+](=O)[O-] ZINC000478494831 1039483187 /nfs/dbraw/zinc/48/31/87/1039483187.db2.gz BEICKWFBVRKEGU-VQIMIIECSA-N 1 0 339.439 3.828 20 5 EHBDRO COc1cc(C[N@@H+]2CCC[C@@H]2Cc2ccccc2)ccc1[N+](=O)[O-] ZINC000485772919 1039526461 /nfs/dbraw/zinc/52/64/61/1039526461.db2.gz OAAIJRWMLUGSSP-QGZVFWFLSA-N 1 0 326.396 3.811 20 5 EHBDRO O=[N+]([O-])c1cccc(-c2nc(C[NH2+]C[C@H]3CCSC3)cs2)c1 ZINC000279941933 1039592277 /nfs/dbraw/zinc/59/22/77/1039592277.db2.gz JKGBXMGACQUEAW-LLVKDONJSA-N 1 0 335.454 3.561 20 5 EHBDRO COc1cc(C[N@@H+]2CC[C@@H](c3ccccc3C)C2)ccc1[N+](=O)[O-] ZINC000489093887 1039618058 /nfs/dbraw/zinc/61/80/58/1039618058.db2.gz HPBQPIAVJOVSPD-MRXNPFEDSA-N 1 0 326.396 3.901 20 5 EHBDRO Cc1nccn1CCC[NH2+][C@@H]1CCCCc2ccc([N+](=O)[O-])cc21 ZINC000417302857 1039646135 /nfs/dbraw/zinc/64/61/35/1039646135.db2.gz BYUSKSAVSDSADJ-GOSISDBHSA-N 1 0 328.416 3.547 20 5 EHBDRO CC(C)(C)Oc1cc(NCCNc2ccccn2)ccc1[N+](=O)[O-] ZINC000485895304 1039662507 /nfs/dbraw/zinc/66/25/07/1039662507.db2.gz KTRZILWOWPJBDG-UHFFFAOYSA-N 1 0 330.388 3.691 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+]CCCOC[C@H]1CCCO1)CCCC2 ZINC000417309997 1039663940 /nfs/dbraw/zinc/66/39/40/1039663940.db2.gz GSSCNKWTKADRGR-IEBWSBKVSA-N 1 0 348.443 3.538 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCO[C@H](C3CC3)C1)CCCC2 ZINC000417346586 1039708440 /nfs/dbraw/zinc/70/84/40/1039708440.db2.gz ULPSZSCQRDUJIA-IPELMVKDSA-N 1 0 330.428 3.910 20 5 EHBDRO CCCN(CC[NH+]1CCCCC1)C(=O)Nc1ccc([N+](=O)[O-])c(C)c1 ZINC000480687271 1039885207 /nfs/dbraw/zinc/88/52/07/1039885207.db2.gz WZTXKDBPBSPSDU-UHFFFAOYSA-N 1 0 348.447 3.633 20 5 EHBDRO O=C(CC[NH2+]Cc1ccc(C2CC2)cc1)Nc1ccccc1[N+](=O)[O-] ZINC000584834562 1040026385 /nfs/dbraw/zinc/02/63/85/1040026385.db2.gz CIPJXUOLDQMSIC-UHFFFAOYSA-N 1 0 339.395 3.591 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000072726100 1040318714 /nfs/dbraw/zinc/31/87/14/1040318714.db2.gz HLGLUPZHSVRCRQ-KRWDZBQOSA-N 1 0 331.416 3.704 20 5 EHBDRO CC(C)c1ccc(C[NH2+]C[C@H](c2ccco2)N(C)C)cc1[N+](=O)[O-] ZINC000072726101 1040319400 /nfs/dbraw/zinc/31/94/00/1040319400.db2.gz HLGLUPZHSVRCRQ-QGZVFWFLSA-N 1 0 331.416 3.704 20 5 EHBDRO O=[N+]([O-])c1cccc([C@H]([NH2+]CC2(O)CCCCC2)c2ccccc2)c1 ZINC000490179015 1040369349 /nfs/dbraw/zinc/36/93/49/1040369349.db2.gz UNICNKXETQBXPZ-LJQANCHMSA-N 1 0 340.423 3.969 20 5 EHBDRO CC[C@H]1CCCC[C@H]1[NH2+]CCC(=O)Nc1cccc([N+](=O)[O-])c1C ZINC000481195218 1040471862 /nfs/dbraw/zinc/47/18/62/1040471862.db2.gz XHNHGADCQNLUDO-GOEBONIOSA-N 1 0 333.432 3.790 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1NC(=O)C[N@H+]1CCC[C@H]1CCC(C)C ZINC000486805188 1040475021 /nfs/dbraw/zinc/47/50/21/1040475021.db2.gz YWIPFGDGGREUQI-HNNXBMFYSA-N 1 0 333.432 3.742 20 5 EHBDRO C[C@H]1CC2(CCC2)C[N@@H+]1Cc1cn(C)nc1-c1ccc([N+](=O)[O-])cc1 ZINC000433025968 1040490191 /nfs/dbraw/zinc/49/01/91/1040490191.db2.gz NJHPGRRHCAXDPG-AWEZNQCLSA-N 1 0 340.427 3.760 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(Oc2cccc(-n3ccnc3)c2)c1 ZINC000092656025 1040504778 /nfs/dbraw/zinc/50/47/78/1040504778.db2.gz CUFAXHHDZJQFLN-UHFFFAOYSA-N 1 0 329.287 3.721 20 5 EHBDRO CC1(C)C[C@@H]([NH2+][C@H](CO)Cc2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433101647 1040739606 /nfs/dbraw/zinc/73/96/06/1040739606.db2.gz POJXNUQHAYCYIX-HNAYVOBHSA-N 1 0 340.423 3.510 20 5 EHBDRO CC[C@@H]1COCCN1Cc1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000509796933 1040835541 /nfs/dbraw/zinc/83/55/41/1040835541.db2.gz FAVHCOGAYRRVFF-CYBMUJFWSA-N 1 0 332.425 3.934 20 5 EHBDRO C[C@@H](CN[C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)C[NH+]1CCCC1 ZINC000433150153 1040927176 /nfs/dbraw/zinc/92/71/76/1040927176.db2.gz VRRFTATWRBMZSS-KSSFIOAISA-N 1 0 331.460 3.639 20 5 EHBDRO COc1ccc(C[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)cn1 ZINC000433167572 1040954593 /nfs/dbraw/zinc/95/45/93/1040954593.db2.gz JFZTXAWZNHACLK-INIZCTEOSA-N 1 0 327.384 3.511 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[NH+]1CCC(COc2ccccc2)CC1 ZINC000055081917 1041110030 /nfs/dbraw/zinc/11/00/30/1041110030.db2.gz JMLAEPJFAJZGEN-UHFFFAOYSA-N 1 0 326.396 3.886 20 5 EHBDRO CC1=CCN(CC[NH2+][C@H]2CC(C)(C)c3ccc([N+](=O)[O-])cc32)CC1 ZINC000433225842 1041111709 /nfs/dbraw/zinc/11/17/09/1041111709.db2.gz DOKQVTXLFJRUGA-SFHVURJKSA-N 1 0 329.444 3.559 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@H](CO)c2ccccc2)c2cc([N+](=O)[O-])ccc21 ZINC000433280613 1041191954 /nfs/dbraw/zinc/19/19/54/1041191954.db2.gz CYWKJKAEVKYTSO-BEFAXECRSA-N 1 0 340.423 3.683 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@]2(C)CCCC[C@H]2O)c2cc([N+](=O)[O-])ccc21 ZINC000433305203 1041246646 /nfs/dbraw/zinc/24/66/46/1041246646.db2.gz PDLXVBIACBOBTL-YQVWRLOYSA-N 1 0 332.444 3.848 20 5 EHBDRO CC[C@H]([NH2+]Cc1nc(-c2cccc([N+](=O)[O-])c2)no1)[C@H]1CC1(C)C ZINC000419314210 1041253465 /nfs/dbraw/zinc/25/34/65/1041253465.db2.gz HOLVBZFZVWIMCZ-KGLIPLIRSA-N 1 0 330.388 3.559 20 5 EHBDRO CC[C@@H]1CCCC[N@@H+]1CCNc1ccc2ncccc2c1[N+](=O)[O-] ZINC000500425583 1041438184 /nfs/dbraw/zinc/43/81/84/1041438184.db2.gz UMTRTEUVERITSI-CQSZACIVSA-N 1 0 328.416 3.819 20 5 EHBDRO O=[N+]([O-])c1cccc2c(NC[C@@H]3CCCC[N@@H+]3C3CC3)ccnc21 ZINC000432152549 1041653863 /nfs/dbraw/zinc/65/38/63/1041653863.db2.gz KBPCWMDEGNUOFR-AWEZNQCLSA-N 1 0 326.400 3.572 20 5 EHBDRO COc1cc(C[N@@H+]2CCCC[C@@H]2C)c([N+](=O)[O-])cc1OC(F)F ZINC000053778608 1041851173 /nfs/dbraw/zinc/85/11/73/1041851173.db2.gz IUGFEZCFLJOAFT-JTQLQIEISA-N 1 0 330.331 3.579 20 5 EHBDRO CC1CC[NH+](CCNc2ccc([N+](=O)[O-])cc2C(F)(F)F)CC1 ZINC000108742527 1042091424 /nfs/dbraw/zinc/09/14/24/1042091424.db2.gz GFBXXBQEKCEPSK-UHFFFAOYSA-N 1 0 331.338 3.757 20 5 EHBDRO CN(C(=O)C[NH2+][C@@H]1CCCC[C@H]1C(C)(C)C)c1ccc([N+](=O)[O-])cc1 ZINC000111173956 1042238007 /nfs/dbraw/zinc/23/80/07/1042238007.db2.gz VUJLBZQUEIBBMJ-IAGOWNOFSA-N 1 0 347.459 3.752 20 5 EHBDRO CCOc1ccc([N+](=O)[O-])cc1C[NH2+][C@@H]1CCOC2(CCCCC2)C1 ZINC000136718591 1042523095 /nfs/dbraw/zinc/52/30/95/1042523095.db2.gz KPPLLKSSUTUSKL-MRXNPFEDSA-N 1 0 348.443 3.965 20 5 EHBDRO [NH3+]CCc1nnn(-c2c3ccccc3cc3c4ccccc4ccc32)n1 ZINC001167792126 1042595370 /nfs/dbraw/zinc/59/53/70/1042595370.db2.gz WPHPIUOHUAYITE-UHFFFAOYSA-N 1 0 339.402 3.623 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]CCCCNc1ccccn1 ZINC000162873905 1042603465 /nfs/dbraw/zinc/60/34/65/1042603465.db2.gz MIBFZZAIZDYIIA-OAHLLOKOSA-N 1 0 328.416 3.841 20 5 EHBDRO O=[N+]([O-])c1cccc2c(N3CCC[C@@H]([NH+]4CCCC4)CC3)ccnc21 ZINC000432306709 1042656472 /nfs/dbraw/zinc/65/64/72/1042656472.db2.gz JBPPCHVUXMFJEO-OAHLLOKOSA-N 1 0 340.427 3.598 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CCN(Cc2ccccc2)C1)c1ccc([N+](=O)[O-])cc1 ZINC000382326916 1042890837 /nfs/dbraw/zinc/89/08/37/1042890837.db2.gz UOVZSBGVJKDLNR-CRAIPNDOSA-N 1 0 325.412 3.520 20 5 EHBDRO C[C@H](c1nnc(-c2ccc([N+](=O)[O-])cc2)o1)[N@H+](C)C[C@H]1CC=CCC1 ZINC000344030521 1043125325 /nfs/dbraw/zinc/12/53/25/1043125325.db2.gz BUJRFLLTAWBUPM-KGLIPLIRSA-N 1 0 342.399 3.994 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000178544040 1043635560 /nfs/dbraw/zinc/63/55/60/1043635560.db2.gz DNNMZXOSQKHVHP-AUUYWEPGSA-N 1 0 340.423 3.759 20 5 EHBDRO Cn1cnc2cc(C[N@H+](Cc3ccc([N+](=O)[O-])cc3)C3CC3)ccc21 ZINC000342682118 1043716972 /nfs/dbraw/zinc/71/69/72/1043716972.db2.gz VPNMSQMOCZYWHF-UHFFFAOYSA-N 1 0 336.395 3.646 20 5 EHBDRO CC(C)[N@@H+](C)C[C@@H](C)NCc1ccc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000572083610 1043892311 /nfs/dbraw/zinc/89/23/11/1043892311.db2.gz POSZPILMHMIOPM-CQSZACIVSA-N 1 0 331.416 3.673 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CCC[C@@]2(CC=CCC2)C1 ZINC000512212893 1044173852 /nfs/dbraw/zinc/17/38/52/1044173852.db2.gz MFSWSWYNDNOWLH-IBGZPJMESA-N 1 0 343.427 3.664 20 5 EHBDRO CO[C@@H](CC[NH2+]C/C(C)=C/c1cccc([N+](=O)[O-])c1)C(F)(F)F ZINC000344799256 1044433551 /nfs/dbraw/zinc/43/35/51/1044433551.db2.gz SNXMOYNUZFBUHQ-ZHZWZMEUSA-N 1 0 332.322 3.555 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C[C@H](c2ccco2)N2CCCC2)c(Cl)c1 ZINC000183383794 1125549788 /nfs/dbraw/zinc/54/97/88/1125549788.db2.gz MPEBUPLQKHZRRO-MRXNPFEDSA-N 1 0 349.818 3.768 20 5 EHBDRO Cc1c(C[NH2+][C@@H](C)c2cccc(-n3cccn3)c2)cccc1[N+](=O)[O-] ZINC000183592710 1125608362 /nfs/dbraw/zinc/60/83/62/1125608362.db2.gz MWNGFIGFWKGOOZ-HNNXBMFYSA-N 1 0 336.395 3.940 20 5 EHBDRO C[C@@H]1CCC[C@H]([NH2+]C2CCN(c3ccc([N+](=O)[O-])cc3)CC2)[C@@H]1C ZINC000764434254 1127493839 /nfs/dbraw/zinc/49/38/39/1127493839.db2.gz VSZQTDUYNXQJDG-CLCXKQKWSA-N 1 0 331.460 3.978 20 5 EHBDRO Cc1nn(C[N@@H+]2CC[C@@H](c3ccccc3)C2)c2ccc([N+](=O)[O-])cc12 ZINC000764946921 1127558186 /nfs/dbraw/zinc/55/81/86/1127558186.db2.gz YVCKSHGHAKJKHG-MRXNPFEDSA-N 1 0 336.395 3.700 20 5 EHBDRO Cc1cc([N+](=O)[O-])ccc1N1CC[NH+]([C@H](C)c2ccsc2)CC1 ZINC000765088726 1127572226 /nfs/dbraw/zinc/57/22/26/1127572226.db2.gz UDLFOIOHSJACJE-CQSZACIVSA-N 1 0 331.441 3.848 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@H]1COc2ccccc2C1 ZINC000765331383 1127599119 /nfs/dbraw/zinc/59/91/19/1127599119.db2.gz BYKOQORFEQLLHY-GJZGRUSLSA-N 1 0 326.396 3.805 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H]2COc3ccccc3C2)cccc1[N+](=O)[O-] ZINC000765333902 1127599687 /nfs/dbraw/zinc/59/96/87/1127599687.db2.gz NAEMEIGYMGQGHH-CABCVRRESA-N 1 0 326.396 3.805 20 5 EHBDRO C[C@H]1CCCC[N@@H+]1C[C@@H]1CCCN(c2ccc(F)cc2[N+](=O)[O-])C1 ZINC000301302454 1127735533 /nfs/dbraw/zinc/73/55/33/1127735533.db2.gz VWTSCTYGMWVORQ-GJZGRUSLSA-N 1 0 335.423 3.825 20 5 EHBDRO Cc1ccnc(NCc2ccccc2C[NH+]2CCCCC2)c1[N+](=O)[O-] ZINC000301310617 1127737301 /nfs/dbraw/zinc/73/73/01/1127737301.db2.gz ZZDBLTOOKKYZAR-UHFFFAOYSA-N 1 0 340.427 3.896 20 5 EHBDRO COc1cc(F)c([N+](=O)[O-])c(NC[C@H](c2ccco2)[NH+]2CCCC2)c1 ZINC000301349205 1127739032 /nfs/dbraw/zinc/73/90/32/1127739032.db2.gz LYXYDEPYHIIDIY-OAHLLOKOSA-N 1 0 349.362 3.585 20 5 EHBDRO O=[N+]([O-])c1c(F)cccc1N[C@H](C[NH+]1CCCC1)c1ccccc1 ZINC000301371203 1127740049 /nfs/dbraw/zinc/74/00/49/1127740049.db2.gz VHACGHCBSUSVLW-QGZVFWFLSA-N 1 0 329.375 3.983 20 5 EHBDRO CCC[N@@H+]1CCC[C@H]1CN[C@@H](C)c1ccc(OCC)c([N+](=O)[O-])c1 ZINC000552336578 1127750319 /nfs/dbraw/zinc/75/03/19/1127750319.db2.gz FYIQYYADWXGVFM-HOCLYGCPSA-N 1 0 335.448 3.519 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(NCc2cccc(C[NH+]3CCCC3)c2)c1 ZINC000338643869 1127965381 /nfs/dbraw/zinc/96/53/81/1127965381.db2.gz BIVVPDATAYZBJU-UHFFFAOYSA-N 1 0 341.411 3.811 20 5 EHBDRO C[NH+](C)[C@H]1CCCC[C@@H]1Nc1ccc(OC(F)(F)F)c([N+](=O)[O-])c1 ZINC001168600845 1128278611 /nfs/dbraw/zinc/27/86/11/1128278611.db2.gz FUABKNLQZROIIX-RYUDHWBXSA-N 1 0 347.337 3.778 20 5 EHBDRO CCC[C@@H]([NH2+]CCOC1CCSCC1)c1cccc([N+](=O)[O-])c1 ZINC000903444380 1128513741 /nfs/dbraw/zinc/51/37/41/1128513741.db2.gz PNFSUNJFKUAGDS-QGZVFWFLSA-N 1 0 338.473 3.938 20 5 EHBDRO Cc1cc([N+](=O)[O-])cnc1N[C@@H]1CC[N@@H+](Cc2ccccc2)C[C@@H]1C ZINC000301602884 1128519795 /nfs/dbraw/zinc/51/97/95/1128519795.db2.gz WQSNJLKTWAHSHV-MAUKXSAKSA-N 1 0 340.427 3.621 20 5 EHBDRO Cc1ccc([C@@H](C)[NH2+]C[C@]2(O)CCCc3ccccc32)cc1[N+](=O)[O-] ZINC000765879115 1128636246 /nfs/dbraw/zinc/63/62/46/1128636246.db2.gz UAJXXOHBBPDZSO-FOIQADDNSA-N 1 0 340.423 3.778 20 5 EHBDRO CC[C@H]([NH2+]C[C@]1(O)CCCc2ccccc21)c1cccc([N+](=O)[O-])c1 ZINC000765881479 1128637251 /nfs/dbraw/zinc/63/72/51/1128637251.db2.gz RPKZJYZFVGOLPK-VQTJNVASSA-N 1 0 340.423 3.860 20 5 EHBDRO C[C@H](O)[C@H]1CCC[N@H+](Cc2ccc(-c3ccc([N+](=O)[O-])cc3)s2)C1 ZINC000542819743 1128661196 /nfs/dbraw/zinc/66/11/96/1128661196.db2.gz AQBUEXDDIUHGNW-ZFWWWQNUSA-N 1 0 346.452 3.916 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+](C)[C@H](C)C1CCCCC1 ZINC000554839629 1128712640 /nfs/dbraw/zinc/71/26/40/1128712640.db2.gz KHKKFINUKZPARO-CQSZACIVSA-N 1 0 333.432 3.742 20 5 EHBDRO CO[C@](C)(C[NH2+][C@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000462801894 1128718133 /nfs/dbraw/zinc/71/81/33/1128718133.db2.gz DVCFRCPFOALLIO-DKSSEZFCSA-N 1 0 332.444 3.711 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CCC([NH2+]CCc3ccc(F)cc3)CC2)cc1 ZINC000131725750 1128722999 /nfs/dbraw/zinc/72/29/99/1128722999.db2.gz ALBVLVNWGLJHLE-UHFFFAOYSA-N 1 0 343.402 3.535 20 5 EHBDRO Cc1ccc(NC2CC[NH+](Cc3ccccc3)CC2)c([N+](=O)[O-])c1 ZINC000148574850 1120187051 /nfs/dbraw/zinc/18/70/51/1120187051.db2.gz CSPVZRNOWQCVSZ-UHFFFAOYSA-N 1 0 325.412 3.980 20 5 EHBDRO Cc1ccc(C[NH2+]Cc2ccc(Br)cc2[N+](=O)[O-])cc1 ZINC000162118449 1120197913 /nfs/dbraw/zinc/19/79/13/1120197913.db2.gz ZRNDGGBUBFXUBF-UHFFFAOYSA-N 1 0 335.201 3.956 20 5 EHBDRO Cc1ccc2[nH]c3c(c2c1)C[N@H+](CCc1ccc([N+](=O)[O-])cc1)CC3 ZINC000609195911 1120548633 /nfs/dbraw/zinc/54/86/33/1120548633.db2.gz KPYRCLIEBSNMIL-UHFFFAOYSA-N 1 0 335.407 3.985 20 5 EHBDRO CCOC(=O)N(C)C1CC[NH+]([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC000494658904 1120714126 /nfs/dbraw/zinc/71/41/26/1120714126.db2.gz JOICQZWAOXXOGI-CQSZACIVSA-N 1 0 349.431 3.517 20 5 EHBDRO C[C@@H](CO)CCC[NH2+][C@H](c1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000494956153 1120914026 /nfs/dbraw/zinc/91/40/26/1120914026.db2.gz UHCZUWMOCCCTMC-DNVCBOLYSA-N 1 0 328.412 3.682 20 5 EHBDRO C[C@H]([NH2+]CC(=O)Nc1ccccc1[N+](=O)[O-])[C@@H](C)C1CCCCC1 ZINC000542533558 1120933529 /nfs/dbraw/zinc/93/35/29/1120933529.db2.gz UDHXTSOXLREZJZ-KGLIPLIRSA-N 1 0 333.432 3.728 20 5 EHBDRO O=[N+]([O-])c1cnc2c(c1)C[N@@H+](CCSc1ccc(Cl)cc1)CC2 ZINC000542550684 1121098831 /nfs/dbraw/zinc/09/88/31/1121098831.db2.gz MPRNETVFPRUQBW-UHFFFAOYSA-N 1 0 349.843 3.794 20 5 EHBDRO CCO[C@@H]1C[C@@H]([NH2+]CCc2ccc(Cl)cc2[N+](=O)[O-])C12CCC2 ZINC000495373679 1121144941 /nfs/dbraw/zinc/14/49/41/1121144941.db2.gz HGVBSARCUBIXLM-HZPDHXFCSA-N 1 0 338.835 3.728 20 5 EHBDRO Cc1cc(NCCCCn2ccnc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000326217833 1121150616 /nfs/dbraw/zinc/15/06/16/1121150616.db2.gz ZHWUOMVKPNSCSU-UHFFFAOYSA-N 1 0 325.372 3.540 20 5 EHBDRO O=[N+]([O-])c1ccccc1N1C[C@@H]2CC[N@H+](Cc3ccccc3)C[C@H]2C1 ZINC000311001846 1128975478 /nfs/dbraw/zinc/97/54/78/1128975478.db2.gz INDGZJRTCYIUPE-ROUUACIJSA-N 1 0 337.423 3.553 20 5 EHBDRO CCC[C@H]([NH2+]CC(=O)Nc1cc([N+](=O)[O-])ccc1C)c1ccccc1 ZINC000193630399 1121514751 /nfs/dbraw/zinc/51/47/51/1121514751.db2.gz XAYUXTXJKAYUDV-KRWDZBQOSA-N 1 0 341.411 3.973 20 5 EHBDRO COC1(C)CC[NH+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)CC1 ZINC000272339861 1121528494 /nfs/dbraw/zinc/52/84/94/1121528494.db2.gz HPTNZHILPAWGKP-UHFFFAOYSA-N 1 0 330.384 3.856 20 5 EHBDRO CC[N@H+](CCC(=O)Nc1cc([N+](=O)[O-])ccc1OC)C1CCCCC1 ZINC000027286590 1121625324 /nfs/dbraw/zinc/62/53/24/1121625324.db2.gz JLHORVIROYFEPP-UHFFFAOYSA-N 1 0 349.431 3.587 20 5 EHBDRO C[C@H](C[C@@H]1CCCO1)[NH2+]Cc1csc(-c2cccc([N+](=O)[O-])c2)n1 ZINC000113333106 1129002560 /nfs/dbraw/zinc/00/25/60/1129002560.db2.gz WGRUHMROZABVMO-WBMJQRKESA-N 1 0 347.440 3.766 20 5 EHBDRO Cc1ccc([C@@H](O)C[NH2+][C@H](Cc2ccccc2[N+](=O)[O-])C2CC2)cc1 ZINC000130626126 1121954366 /nfs/dbraw/zinc/95/43/66/1121954366.db2.gz WVUODFOSEWKOBK-QUCCMNQESA-N 1 0 340.423 3.548 20 5 EHBDRO CC1(C)CCCC[C@H]1[NH2+]CCC(=O)Nc1cc([N+](=O)[O-])ccc1F ZINC000132039028 1129040770 /nfs/dbraw/zinc/04/07/70/1129040770.db2.gz QYZCHMSROKINJV-OAHLLOKOSA-N 1 0 337.395 3.621 20 5 EHBDRO CC(C)[C@H]1CN(Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)CCO1 ZINC000497176369 1122356902 /nfs/dbraw/zinc/35/69/02/1122356902.db2.gz AJDHYCUBDAYEHU-GOSISDBHSA-N 1 0 330.384 3.712 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@H](c2ccccc2)C2CCC2)c1 ZINC000154523046 1122684499 /nfs/dbraw/zinc/68/44/99/1122684499.db2.gz VRTMSMSSAABKJP-RBUKOAKNSA-N 1 0 326.396 3.759 20 5 EHBDRO O=[N+]([O-])c1ccc([C@H]2CCC[N@H+](Cc3ccc4[nH]cnc4c3)C2)cc1 ZINC000556165306 1122853199 /nfs/dbraw/zinc/85/31/99/1122853199.db2.gz MGRSVIYHPIHTCP-INIZCTEOSA-N 1 0 336.395 3.851 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C[C@@H](c1cccs1)N(C)C ZINC000155069984 1123130057 /nfs/dbraw/zinc/13/00/57/1123130057.db2.gz KOZOUQVCKGFFEZ-BBRMVZONSA-N 1 0 333.457 3.918 20 5 EHBDRO O=[N+]([O-])c1c(NCCCCCCC[NH+]2CCCC2)nc2ccccn21 ZINC000920337875 1123358879 /nfs/dbraw/zinc/35/88/79/1123358879.db2.gz UQFWOFCYFGLKEL-UHFFFAOYSA-N 1 0 345.447 3.701 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+]1CCNc1ccc([N+](=O)[O-])c2cccnc12 ZINC000609354281 1123553691 /nfs/dbraw/zinc/55/36/91/1123553691.db2.gz NLXOCADLNIOGCH-OKILXGFUSA-N 1 0 328.416 3.818 20 5 EHBDRO Cc1cccc([N+](=O)[O-])c1NC(=O)C[N@H+]1CC[C@H](C)[C@H]2CCCC[C@@H]21 ZINC000609631772 1123634700 /nfs/dbraw/zinc/63/47/00/1123634700.db2.gz WFDQFRPVCDOBBW-IMJJTQAJSA-N 1 0 345.443 3.742 20 5 EHBDRO C[C@@H]1c2ccc(F)cc2CC[N@H+]1CCOc1cccc([N+](=O)[O-])c1 ZINC000610003990 1123711320 /nfs/dbraw/zinc/71/13/20/1123711320.db2.gz WXJLZTDKVMKZEJ-CYBMUJFWSA-N 1 0 330.359 3.732 20 5 EHBDRO C[C@H]1C[N@H+](Cc2ccccc2)CCCN1Cc1ccccc1[N+](=O)[O-] ZINC000610133868 1123738989 /nfs/dbraw/zinc/73/89/89/1123738989.db2.gz BFANPTYLBITACB-KRWDZBQOSA-N 1 0 339.439 3.691 20 5 EHBDRO CC(C)[C@H](C[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl)c1ccnn1C ZINC000615943453 1123912799 /nfs/dbraw/zinc/91/27/99/1123912799.db2.gz LMXBBDDDKJKRSJ-AWEZNQCLSA-N 1 0 336.823 3.511 20 5 EHBDRO CC(C)[C@H](C[NH2+][C@@H](C)CCc1ccccc1[N+](=O)[O-])c1ccnn1C ZINC000615966868 1123919357 /nfs/dbraw/zinc/91/93/57/1123919357.db2.gz KPPLDTDTTPLLTH-RDJZCZTQSA-N 1 0 344.459 3.679 20 5 EHBDRO CCC1(CC)[C@H]([NH2+]Cc2nc3cc([N+](=O)[O-])ccc3o2)[C@@H](C)[C@H]1OC ZINC000617549837 1124648559 /nfs/dbraw/zinc/64/85/59/1124648559.db2.gz NKVAACKMBDSRIP-SSKCKEOISA-N 1 0 347.415 3.665 20 5 EHBDRO CC(C)[C@@H](C[NH2+][C@@H]1CCCc2ccc([N+](=O)[O-])cc21)c1ccnn1C ZINC000618577757 1125114859 /nfs/dbraw/zinc/11/48/59/1125114859.db2.gz NWIFNOUWGVYOEQ-QZTJIDSGSA-N 1 0 342.443 3.735 20 5 EHBDRO CO[C@H]1CCC[C@H]([NH2+]Cc2cc([N+](=O)[O-])cc(C(F)(F)F)c2)C1 ZINC000619430962 1125348560 /nfs/dbraw/zinc/34/85/60/1125348560.db2.gz TXVZCWCRIAKLMP-JSGCOSHPSA-N 1 0 332.322 3.661 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1C[NH2+]C1(c2ccc(F)cc2)CCC1 ZINC000619531759 1125358423 /nfs/dbraw/zinc/35/84/23/1125358423.db2.gz ICLCUCAPCVVPEV-UHFFFAOYSA-N 1 0 330.359 3.912 20 5 EHBDRO C[C@@H]1CC[C@H](O)[C@@H]([C@@H]2CCCC[N@@H+]2Cc2cccc([N+](=O)[O-])c2)C1 ZINC000619569531 1125363779 /nfs/dbraw/zinc/36/37/79/1125363779.db2.gz FMHJDRJJZXLORY-OAOYMFHYSA-N 1 0 332.444 3.746 20 5 EHBDRO CC[C@H](C)[C@H](C)[NH2+]Cc1cc(OC)c(OCC(F)F)cc1[N+](=O)[O-] ZINC000183074213 1125432371 /nfs/dbraw/zinc/43/23/71/1125432371.db2.gz PQJTYNUMOXYZAB-QWRGUYRKSA-N 1 0 346.374 3.772 20 5 EHBDRO CC(C)N(C)C[C@H](C)[NH2+][C@@H]1CCC[C@@H]1Cc1ccccc1[N+](=O)[O-] ZINC000554990960 1129185889 /nfs/dbraw/zinc/18/58/89/1129185889.db2.gz HEUIXBDWCXXSOL-LZLYRXPVSA-N 1 0 333.476 3.624 20 5 EHBDRO COc1ccc(C2(C[NH2+]Cc3cccc([N+](=O)[O-])c3)CCC2)cc1 ZINC000543229757 1129357350 /nfs/dbraw/zinc/35/73/50/1129357350.db2.gz XDEMURGEGCSULB-UHFFFAOYSA-N 1 0 326.396 3.815 20 5 EHBDRO COc1cc(C)cc(C[NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)c1OC ZINC000922539764 1129563769 /nfs/dbraw/zinc/56/37/69/1129563769.db2.gz DRDGNNCNFONLOE-CYBMUJFWSA-N 1 0 330.384 3.771 20 5 EHBDRO Cc1cccc(F)c1C[NH2+]C1CCN(c2ccc([N+](=O)[O-])cc2)CC1 ZINC000766214562 1131383124 /nfs/dbraw/zinc/38/31/24/1131383124.db2.gz XKISCSGVOBZXLW-UHFFFAOYSA-N 1 0 343.402 3.801 20 5 EHBDRO O=[N+]([O-])c1ccccc1/C=C/C[N@@H+](CCO)[C@H]1CCc2ccccc21 ZINC000093387553 1129586664 /nfs/dbraw/zinc/58/66/64/1129586664.db2.gz BIQNSRBUGIDAHR-FKIZTMCRSA-N 1 0 338.407 3.590 20 5 EHBDRO Cc1c([C@@H](C)[NH2+]C[C@H](c2cccs2)N(C)C)cccc1[N+](=O)[O-] ZINC000155070478 1129610226 /nfs/dbraw/zinc/61/02/26/1129610226.db2.gz CESJTZRVXGBWEH-CZUORRHYSA-N 1 0 333.457 3.918 20 5 EHBDRO C[C@@H]([NH2+]Cc1ccc2c(c1)OC(F)(F)O2)c1cccc([N+](=O)[O-])c1 ZINC000509005680 1129637319 /nfs/dbraw/zinc/63/73/19/1129637319.db2.gz FGLWPSIKMAJCPV-SNVBAGLBSA-N 1 0 336.294 3.767 20 5 EHBDRO CCc1noc([C@@H]2CC[C@@H]([NH2+]Cc3c(C)ccc([N+](=O)[O-])c3C)C2)n1 ZINC000922861575 1129696901 /nfs/dbraw/zinc/69/69/01/1129696901.db2.gz DRDUHGCYTBGNGK-ZIAGYGMSSA-N 1 0 344.415 3.583 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC[C@@H]1[C@@H]1CCCC[C@@H]1O ZINC000281116675 1129703541 /nfs/dbraw/zinc/70/35/41/1129703541.db2.gz XFGUYLVWYCAWSQ-JQHSSLGASA-N 1 0 336.407 3.640 20 5 EHBDRO O=[N+]([O-])c1ccc(F)cc1C[N@H+]1CCCC[C@@H]1[C@H]1CCCC[C@H]1O ZINC000281116678 1129703570 /nfs/dbraw/zinc/70/35/70/1129703570.db2.gz XFGUYLVWYCAWSQ-KBAYOESNSA-N 1 0 336.407 3.640 20 5 EHBDRO C[C@@H](CO)[C@@H](C)[NH2+][C@@H](C)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000157180263 1129751791 /nfs/dbraw/zinc/75/17/91/1129751791.db2.gz VDKPWUURKNCPEE-XQQFMLRXSA-N 1 0 334.441 3.991 20 5 EHBDRO Cc1cc(N2CCO[C@@H](c3ccco3)C2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302097869 1129767769 /nfs/dbraw/zinc/76/77/69/1129767769.db2.gz TVCXVJNRYULLDX-GOSISDBHSA-N 1 0 339.351 3.622 20 5 EHBDRO Cc1cc(NC[C@@H](O)c2ccsc2)c2cc([N+](=O)[O-])ccc2[nH+]1 ZINC000302177743 1129771828 /nfs/dbraw/zinc/77/18/28/1129771828.db2.gz NGGHOTNLXZHDIG-MRXNPFEDSA-N 1 0 329.381 3.658 20 5 EHBDRO Cc1ccc(NC(=O)[C@@H](C)[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)c(F)c1 ZINC000056196392 1129806020 /nfs/dbraw/zinc/80/60/20/1129806020.db2.gz QFQBOBCLDYJMOH-CHWSQXEVSA-N 1 0 345.374 3.720 20 5 EHBDRO C[N@H+](CCCNc1ncc([N+](=O)[O-])cc1Cl)Cc1ccccc1 ZINC000303091791 1129816169 /nfs/dbraw/zinc/81/61/69/1129816169.db2.gz DWXFICJPQCRAJJ-UHFFFAOYSA-N 1 0 334.807 3.577 20 5 EHBDRO CC(C)C[C@@H]1OCCC[C@H]1[NH2+]Cc1c(F)cc([N+](=O)[O-])cc1F ZINC000509142643 1129842298 /nfs/dbraw/zinc/84/22/98/1129842298.db2.gz UNFBVSMUCLIZEF-CVEARBPZSA-N 1 0 328.359 3.556 20 5 EHBDRO CCC[C@@H]([NH2+]C[C@H](O)Cc1ccccc1)c1cccc([N+](=O)[O-])c1 ZINC000132102387 1129875454 /nfs/dbraw/zinc/87/54/54/1129875454.db2.gz CFBOFYQGOWCHAU-RTBURBONSA-N 1 0 328.412 3.629 20 5 EHBDRO COc1ccc(C[NH2+]Cc2ccc(C(C)C)c([N+](=O)[O-])c2)cc1O ZINC000171134997 1130016885 /nfs/dbraw/zinc/01/68/85/1130016885.db2.gz RFNQCLLEQJPPDQ-UHFFFAOYSA-N 1 0 330.384 3.722 20 5 EHBDRO C[C@H](NCc1csc(-c2cccc([N+](=O)[O-])c2)n1)c1ccccn1 ZINC000172111683 1130106521 /nfs/dbraw/zinc/10/65/21/1130106521.db2.gz QKPLZLYKDUINRT-LBPRGKRZSA-N 1 0 340.408 3.964 20 5 EHBDRO C[N@H+](CC(=O)Nc1ccc([N+](=O)[O-])cc1Cl)C1CCCCCC1 ZINC000039536604 1130139704 /nfs/dbraw/zinc/13/97/04/1130139704.db2.gz RWXBYVLXUSYLOY-UHFFFAOYSA-N 1 0 339.823 3.841 20 5 EHBDRO COc1ccc(CCC[NH2+][C@H](C)c2cccc([N+](=O)[O-])c2)cc1OC ZINC000173353723 1130216646 /nfs/dbraw/zinc/21/66/46/1130216646.db2.gz ZWBNTJWEWXXSLS-CQSZACIVSA-N 1 0 344.411 3.895 20 5 EHBDRO COc1ccccc1O[C@H](C)C[NH2+][C@@H](C)c1cccc([N+](=O)[O-])c1 ZINC000173451324 1130231967 /nfs/dbraw/zinc/23/19/67/1130231967.db2.gz NOEXCQILTHUYBJ-KGLIPLIRSA-N 1 0 330.384 3.722 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[NH2+]C[C@@H]3CCC[C@H](O)C3)s2)cc1 ZINC000174430072 1130358788 /nfs/dbraw/zinc/35/87/88/1130358788.db2.gz AVOQGTKDBNYRQY-CJNGLKHVSA-N 1 0 346.452 3.964 20 5 EHBDRO C[C@@H]1CO[C@H](c2ccccc2)[C@H](C)[N@@H+]1CCc1ccc([N+](=O)[O-])cc1 ZINC000731892952 1130857734 /nfs/dbraw/zinc/85/77/34/1130857734.db2.gz LDMRXZVQNJNGRD-GUXCAODWSA-N 1 0 340.423 3.988 20 5 EHBDRO C[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)c1ccc(F)c(Cl)c1 ZINC000732917908 1130970446 /nfs/dbraw/zinc/97/04/46/1130970446.db2.gz SDDCWTSVKIHBIR-MGPLVRAMSA-N 1 0 338.766 3.772 20 5 EHBDRO CCC[N@H+](Cc1cc(F)ccc1[N+](=O)[O-])[C@@H]1[C@H]2CCO[C@H]2C1(C)C ZINC000740881777 1131552565 /nfs/dbraw/zinc/55/25/65/1131552565.db2.gz CWSQXBYFLXWXKI-DJIMGWMZSA-N 1 0 336.407 3.759 20 5 EHBDRO Cc1ccc([C@H](O)C[NH2+]Cc2ccc(-c3ccc([N+](=O)[O-])cc3)o2)o1 ZINC000741261955 1131591216 /nfs/dbraw/zinc/59/12/16/1131591216.db2.gz SJZLYURZBDRPRZ-MRXNPFEDSA-N 1 0 342.351 3.579 20 5 EHBDRO CC1(C)CCC[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000741804244 1131652812 /nfs/dbraw/zinc/65/28/12/1131652812.db2.gz FRZCHIZZCZKSAT-UHFFFAOYSA-N 1 0 339.823 3.699 20 5 EHBDRO CN(CC[C@H]1CCCC[N@@H+]1C)c1nc2ccc([N+](=O)[O-])cc2s1 ZINC000742420127 1131722229 /nfs/dbraw/zinc/72/22/29/1131722229.db2.gz ZGHRLRWKKKDEEM-GFCCVEGCSA-N 1 0 334.445 3.515 20 5 EHBDRO COc1ccc(C[NH2+][C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c(F)c1 ZINC001172903598 1131886469 /nfs/dbraw/zinc/88/64/69/1131886469.db2.gz RUCYVZIUMBJMLT-MRXNPFEDSA-N 1 0 344.386 3.780 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([N@@H+]1CCCC(F)(F)[C@@H](F)C1)CC2 ZINC001172905336 1131886733 /nfs/dbraw/zinc/88/67/33/1131886733.db2.gz RFKALELCSMBZLM-ZBFHGGJFSA-N 1 0 342.361 3.911 20 5 EHBDRO O=C1CC[N@@H+]([C@@H]2CCc3ccc([N+](=O)[O-])cc3CC2)[C@H]2CCCC[C@H]12 ZINC001172908402 1131888139 /nfs/dbraw/zinc/88/81/39/1131888139.db2.gz MDOITLZGSHBJDY-NEWSRXKRSA-N 1 0 342.439 3.676 20 5 EHBDRO C[NH2+]Cc1cccc(N[C@H]2CCc3ccc([N+](=O)[O-])cc3CC2)c1 ZINC001172920974 1131905491 /nfs/dbraw/zinc/90/54/91/1131905491.db2.gz MXWYLWUFPZIAKN-KRWDZBQOSA-N 1 0 325.412 3.674 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)CC[C@H]([NH2+][C@@H](c1ccncc1)C1CC1)CC2 ZINC001172912081 1131917798 /nfs/dbraw/zinc/91/77/98/1131917798.db2.gz LNYKRBOBIRZLGD-UYAOXDASSA-N 1 0 337.423 3.978 20 5 EHBDRO CC[C@@H](C)[N@H+](C)C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1 ZINC001173011932 1131935635 /nfs/dbraw/zinc/93/56/35/1131935635.db2.gz AYZLGINLTQGOJA-LLVKDONJSA-N 1 0 327.375 3.572 20 5 EHBDRO C[N@H+](C1CCN(c2c(F)cc([N+](=O)[O-])cc2F)CC1)C(C)(C)C ZINC001173012643 1131936227 /nfs/dbraw/zinc/93/62/27/1131936227.db2.gz HYNBOJIFEZUMIK-UHFFFAOYSA-N 1 0 327.375 3.572 20 5 EHBDRO COc1ccc([N+](=O)[O-])c(C[C@@H](C)[NH2+]Cc2ccccc2C)c1F ZINC001173175703 1131991764 /nfs/dbraw/zinc/99/17/64/1131991764.db2.gz RCBPZFVGFDZVBC-CYBMUJFWSA-N 1 0 332.375 3.772 20 5 EHBDRO C[NH2+]Cc1cccc(N[C@H](C)Cc2c(F)c(OC)ccc2[N+](=O)[O-])c1 ZINC001173195886 1131996519 /nfs/dbraw/zinc/99/65/19/1131996519.db2.gz JWMYWQLZLXLABI-GFCCVEGCSA-N 1 0 347.390 3.505 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1cccc(-n2cccn2)c1 ZINC001173215566 1132001325 /nfs/dbraw/zinc/00/13/25/1132001325.db2.gz WTAJGRKLYMKTDX-HNNXBMFYSA-N 1 0 336.395 3.501 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1(c2ccc(Cl)cc2)COC1 ZINC001173219072 1132003317 /nfs/dbraw/zinc/00/33/17/1132003317.db2.gz WPDFTRPKJXXVPB-ZDUSSCGKSA-N 1 0 346.814 3.695 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]C1([C@@H]2CCOC(C)(C)C2)CC1 ZINC001173224919 1132005015 /nfs/dbraw/zinc/00/50/15/1132005015.db2.gz IFVWBDPKMRAYDH-GDBMZVCRSA-N 1 0 332.444 3.853 20 5 EHBDRO C[C@@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)Cc1ccccn1 ZINC001173224958 1132005140 /nfs/dbraw/zinc/00/51/40/1132005140.db2.gz PUWKBYJKCNAOQX-HNNXBMFYSA-N 1 0 327.428 3.779 20 5 EHBDRO Cc1noc2ccc(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)cc12 ZINC001173222619 1132005779 /nfs/dbraw/zinc/00/57/79/1132005779.db2.gz XTFAWFLQWZROCO-LBPRGKRZSA-N 1 0 325.368 3.765 20 5 EHBDRO Cc1ccnc(C(C)(C)C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173226176 1132006605 /nfs/dbraw/zinc/00/66/05/1132006605.db2.gz VTRHJFNJRGXKMM-HNNXBMFYSA-N 1 0 327.428 3.797 20 5 EHBDRO Cc1ccc(C2(C[NH2+][C@@H](C)Cc3ccc([N+](=O)[O-])cc3)CC2)nc1 ZINC001173225212 1132006689 /nfs/dbraw/zinc/00/66/89/1132006689.db2.gz RCAMPMAQASHLQJ-HNNXBMFYSA-N 1 0 325.412 3.551 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+]Cc1ccc(C(F)(F)F)o1 ZINC001173227531 1132007607 /nfs/dbraw/zinc/00/76/07/1132007607.db2.gz GSWSFFZSVHEIKV-SNVBAGLBSA-N 1 0 328.290 3.927 20 5 EHBDRO C[C@H](Cc1ccc([N+](=O)[O-])cc1)[NH2+][C@H](c1ncccc1F)C1CC1 ZINC001173230555 1132008257 /nfs/dbraw/zinc/00/82/57/1132008257.db2.gz RXMFQNAMAZRWFE-PXAZEXFGSA-N 1 0 329.375 3.801 20 5 EHBDRO Cc1cccnc1C1(C[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)CC1 ZINC001173231448 1132009405 /nfs/dbraw/zinc/00/94/05/1132009405.db2.gz ZJOPEFLJMANMHY-HNNXBMFYSA-N 1 0 325.412 3.551 20 5 EHBDRO Cc1cccnc1[C@H]([NH2+][C@@H](C)Cc1ccc([N+](=O)[O-])cc1)C1CC1 ZINC001173232040 1132009625 /nfs/dbraw/zinc/00/96/25/1132009625.db2.gz CKUCCYLVGBVPKA-IFXJQAMLSA-N 1 0 325.412 3.970 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173213179 1132013832 /nfs/dbraw/zinc/01/38/32/1132013832.db2.gz GCOYZIREPMPBKK-HNNXBMFYSA-N 1 0 344.411 3.593 20 5 EHBDRO COc1cccc(OCCC[NH2+][C@H](C)Cc2ccc([N+](=O)[O-])cc2)c1 ZINC001173213182 1132014106 /nfs/dbraw/zinc/01/41/06/1132014106.db2.gz GCOYZIREPMPBKK-OAHLLOKOSA-N 1 0 344.411 3.593 20 5 EHBDRO Nc1c2cccnc2c2ncccc2c1Nc1ccc2[nH+]ccn2c1 ZINC001174277365 1132310094 /nfs/dbraw/zinc/31/00/94/1132310094.db2.gz CRHANDHEMGFZKS-UHFFFAOYSA-N 1 0 326.363 3.757 20 5 EHBDRO C[C@@H]([NH2+][C@@H]1CC[C@H](C[N+](=O)[O-])C1)c1cccc(Br)c1 ZINC001168978352 1132618140 /nfs/dbraw/zinc/61/81/40/1132618140.db2.gz RGFSIMHQTFYVMG-UHIISALHSA-N 1 0 327.222 3.545 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@H]([NH2+]CCCc2ccc(C(F)(F)F)cc2)C1 ZINC001168978152 1132618292 /nfs/dbraw/zinc/61/82/92/1132618292.db2.gz OXOJHUDHNUKMPT-HIFRSBDPSA-N 1 0 330.350 3.673 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCCCCCCCCCCCO)C1 ZINC001168983792 1132619273 /nfs/dbraw/zinc/61/92/73/1132619273.db2.gz LFBNOWTZPWLROY-QZTJIDSGSA-N 1 0 328.497 3.915 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+][C@H]1CC[C@@H](C[N+](=O)[O-])C1)c1ccncc1 ZINC001168958866 1132620568 /nfs/dbraw/zinc/62/05/68/1132620568.db2.gz QNBHUNSISRCSCI-HHXXYDBFSA-N 1 0 325.412 3.514 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]CCSCc2ccccc2Cl)C1 ZINC001168970218 1132622035 /nfs/dbraw/zinc/62/20/35/1132622035.db2.gz GVFUDVICWSAVJO-TZMCWYRMSA-N 1 0 328.865 3.608 20 5 EHBDRO CC(C)(C)OC(=O)Nc1ccccc1C[NH2+][C@H]1CC[C@H](C[N+](=O)[O-])C1 ZINC001168968522 1132622131 /nfs/dbraw/zinc/62/21/31/1132622131.db2.gz ZUPTZOUXHROYSM-ZFWWWQNUSA-N 1 0 349.431 3.569 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH2+]Cc2ccc(SC(F)(F)F)cc2)C1 ZINC001168970168 1132622339 /nfs/dbraw/zinc/62/23/39/1132622339.db2.gz GUJNUFAWTACHMM-RYUDHWBXSA-N 1 0 334.363 3.834 20 5 EHBDRO O=[N+]([O-])C[C@@H]1CC[C@@H]([NH2+]Cc2cccc(C(F)(F)F)c2Cl)C1 ZINC001168972677 1132623458 /nfs/dbraw/zinc/62/34/58/1132623458.db2.gz NQULLJBABBLTDH-MWLCHTKSSA-N 1 0 336.741 3.894 20 5 EHBDRO C[C@H](c1ccccc1)[C@H](CO)[NH2+]Cc1ccc([N+](=O)[O-])cc1Cl ZINC001168991818 1132626227 /nfs/dbraw/zinc/62/62/27/1132626227.db2.gz CERNDIOBGIMJKF-PXAZEXFGSA-N 1 0 334.803 3.502 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@@H]([NH2+][C@@H]2CCc3ccc(C(F)(F)F)cc32)C1 ZINC001168997595 1132627205 /nfs/dbraw/zinc/62/72/05/1132627205.db2.gz DVMIGJLCBANAIO-PSOPSSQASA-N 1 0 328.334 3.728 20 5 EHBDRO O=[N+]([O-])C[C@H]1CC[C@H]([NH+]2CCC(Oc3ccc(Cl)cc3)CC2)C1 ZINC001169014417 1132632717 /nfs/dbraw/zinc/63/27/17/1132632717.db2.gz ZLICRSIWJAYVBF-ZFWWWQNUSA-N 1 0 338.835 3.629 20 5 EHBDRO C[C@H]([NH3+])c1ccn(-c2ccc(Sc3ccc([N+](=O)[O-])cc3)cc2)n1 ZINC001169232671 1132703102 /nfs/dbraw/zinc/70/31/02/1132703102.db2.gz ICCXLGOMIFCFDK-LBPRGKRZSA-N 1 0 340.408 3.951 20 5 EHBDRO C[NH+]1CCC(Oc2ccc(Nc3cc([N+](=O)[O-])ccc3F)cc2)CC1 ZINC001175738593 1132749385 /nfs/dbraw/zinc/74/93/85/1132749385.db2.gz MPIXTHPXSDZVKX-UHFFFAOYSA-N 1 0 345.374 3.951 20 5 EHBDRO CCC1(CC)CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC001169420293 1132749915 /nfs/dbraw/zinc/74/99/15/1132749915.db2.gz OVNYDKRZDFQHQA-UHFFFAOYSA-N 1 0 333.432 3.826 20 5 EHBDRO CC[N+](C)(C)Cc1ccccc1N[C@H]1CCc2ccccc2[C@H]1O ZINC001169619495 1132807982 /nfs/dbraw/zinc/80/79/82/1132807982.db2.gz ISTZFBUCEKRVAL-LEWJYISDSA-N 1 0 325.476 3.743 20 5 EHBDRO CCC1([NH+]2CCC2)CCN([C@H](C)c2cc([N+](=O)[O-])ccc2C)CC1 ZINC001176234851 1132883179 /nfs/dbraw/zinc/88/31/79/1132883179.db2.gz JCYZTAAERRFJOP-MRXNPFEDSA-N 1 0 331.460 3.915 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(Cc2ccc([N+](=O)[O-])cc2Cl)CC1 ZINC001176234873 1132883644 /nfs/dbraw/zinc/88/36/44/1132883644.db2.gz JJZSNPJJFCTTDK-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(CNCCC[NH+]3CCCCC3)o2)cc1 ZINC001177133023 1133033737 /nfs/dbraw/zinc/03/37/37/1133033737.db2.gz PNKQWPYFXKVPHM-UHFFFAOYSA-N 1 0 343.427 3.820 20 5 EHBDRO C/C(=C/c1cccc([N+](=O)[O-])c1)C[NH2+][C@H](C)CN1CCC[C@@H](C)C1 ZINC001177474816 1133066368 /nfs/dbraw/zinc/06/63/68/1133066368.db2.gz HCKJYVKLBDDKOT-ZTUONRJZSA-N 1 0 331.460 3.708 20 5 EHBDRO CNC(=O)[C@@H]1CCC[N@H+](Cc2c3ccccc3cc3ccccc32)C1 ZINC000769402990 1133277563 /nfs/dbraw/zinc/27/75/63/1133277563.db2.gz GEZAAXMJSYDNEU-GOSISDBHSA-N 1 0 332.447 3.951 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+][C@@H]2CCN(c3ccc(Cl)cc3)C2)c(F)c1 ZINC001180332764 1133363087 /nfs/dbraw/zinc/36/30/87/1133363087.db2.gz SUZZUPXIGLCGPF-CQSZACIVSA-N 1 0 349.793 3.756 20 5 EHBDRO CC(C)[C@@H]1C[C@@H](C[NH2+]Cc2ccc(Cl)cc2[N+](=O)[O-])CCO1 ZINC001181880665 1133546665 /nfs/dbraw/zinc/54/66/65/1133546665.db2.gz YETXRPVHPOQYFK-LRDDRELGSA-N 1 0 326.824 3.789 20 5 EHBDRO C[C@H]([NH2+][C@H]1CCCc2ccc([N+](=O)[O-])cc21)[C@H](O)c1cccc(F)c1 ZINC000774258972 1133647497 /nfs/dbraw/zinc/64/74/97/1133647497.db2.gz PLIQGSZWYIZHLP-NXXSPTCGSA-N 1 0 344.386 3.823 20 5 EHBDRO Cc1ccccc1[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)C ZINC000774411883 1133673583 /nfs/dbraw/zinc/67/35/83/1133673583.db2.gz SMRTXRYOIYWLMX-RTBURBONSA-N 1 0 328.412 3.924 20 5 EHBDRO C[NH+](C)[C@@H](CNc1ccc(N)cc1[N+](=O)[O-])c1ccccc1Cl ZINC000786575914 1133876496 /nfs/dbraw/zinc/87/64/96/1133876496.db2.gz YQATZJYSCIVRPW-INIZCTEOSA-N 1 0 334.807 3.545 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[N@@H+]1CCCC[C@@H]([C@H]2CCOC2)C1 ZINC001184252510 1133915961 /nfs/dbraw/zinc/91/59/61/1133915961.db2.gz QEIBLZXQABJSQE-SJORKVTESA-N 1 0 332.444 3.850 20 5 EHBDRO Cc1ccccc1C[NH+]1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC001184572115 1133959863 /nfs/dbraw/zinc/95/98/63/1133959863.db2.gz KQDNWBNAXLZCFL-UHFFFAOYSA-N 1 0 345.830 3.879 20 5 EHBDRO CC[NH+](CC)[C@H](CNc1ncc([N+](=O)[O-])cc1C)Cc1ccccc1 ZINC001184802366 1133992448 /nfs/dbraw/zinc/99/24/48/1133992448.db2.gz IAJOFMWIIMWVBV-KRWDZBQOSA-N 1 0 342.443 3.663 20 5 EHBDRO C[N@H+](CCc1ccc(Cl)cc1)Cc1ccc([N+](=O)[O-])cc1[N+](=O)[O-] ZINC000774865900 1134077385 /nfs/dbraw/zinc/07/73/85/1134077385.db2.gz ZCOGCJTUKDEMEK-UHFFFAOYSA-N 1 0 349.774 3.831 20 5 EHBDRO Cc1ccc(C[NH2+][C@H](C(C)C)[C@@H](O)c2ccccc2)cc1[N+](=O)[O-] ZINC000788541826 1134140120 /nfs/dbraw/zinc/14/01/20/1134140120.db2.gz YSJFKIGVTBQSRK-MOPGFXCFSA-N 1 0 328.412 3.751 20 5 EHBDRO C[C@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000788583393 1134147785 /nfs/dbraw/zinc/14/77/85/1134147785.db2.gz SSUWAKFHZGHGTD-YJBOKZPZSA-N 1 0 346.452 3.876 20 5 EHBDRO C[C@@](O)(C[NH2+][C@H]1CC(C)(C)c2ccc([N+](=O)[O-])cc21)c1cccs1 ZINC000788583391 1134148062 /nfs/dbraw/zinc/14/80/62/1134148062.db2.gz SSUWAKFHZGHGTD-MAUKXSAKSA-N 1 0 346.452 3.876 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C[C@@H](O)c2ccccc2F)c2cc([N+](=O)[O-])ccc21 ZINC000788580596 1134148227 /nfs/dbraw/zinc/14/82/27/1134148227.db2.gz NRNJOBPQKMEBDJ-ZWKOTPCHSA-N 1 0 344.386 3.780 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@H](C)c2ccc(C)c([N+](=O)[O-])c2)cc1 ZINC000789366164 1134263654 /nfs/dbraw/zinc/26/36/54/1134263654.db2.gz MZWUVRYPOGZWQO-AUUYWEPGSA-N 1 0 328.412 3.850 20 5 EHBDRO COC[C@H](Cc1ccccc1)[N@H+](C)Cc1cc(Cl)ccc1[N+](=O)[O-] ZINC000789457006 1134278101 /nfs/dbraw/zinc/27/81/01/1134278101.db2.gz PZYVNJZTYSWLJK-KRWDZBQOSA-N 1 0 348.830 3.938 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H](C)c2nc(C)cs2)c([N+](=O)[O-])c1 ZINC001170297601 1134737360 /nfs/dbraw/zinc/73/73/60/1134737360.db2.gz QPHNAKGPHUIHCJ-CMPLNLGQSA-N 1 0 335.429 3.650 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+]C[C@H]2CCC(F)(F)C2)c([N+](=O)[O-])c1 ZINC001170299555 1134738127 /nfs/dbraw/zinc/73/81/27/1134738127.db2.gz UYIJCJWTYHVEJM-NEPJUHHUSA-N 1 0 328.359 3.559 20 5 EHBDRO COc1ccc(C[C@@H](C)[NH2+][C@H]2CCc3ccc(F)cc32)c([N+](=O)[O-])c1 ZINC001170305646 1134739745 /nfs/dbraw/zinc/73/97/45/1134739745.db2.gz OLEOIZLNZQICMF-XIKOKIGWSA-N 1 0 344.386 3.951 20 5 EHBDRO COc1ccc(C[C@H](C)[NH2+][C@H]2CCc3c2cccc3O)c([N+](=O)[O-])c1 ZINC001170328252 1134749135 /nfs/dbraw/zinc/74/91/35/1134749135.db2.gz IPLPAMYHZXNYEC-SJCJKPOMSA-N 1 0 342.395 3.517 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@@H+]2CCC(F)(F)[C@H](C)C2)c([N+](=O)[O-])c1 ZINC001170329843 1134749829 /nfs/dbraw/zinc/74/98/29/1134749829.db2.gz VRCMLUXFOADKFF-VXGBXAGGSA-N 1 0 328.359 3.512 20 5 EHBDRO COc1ccc(C[C@@H](C)[N@H+]2C[C@H]3[C@H](CCC3(F)F)C2)c([N+](=O)[O-])c1 ZINC001170334091 1134751385 /nfs/dbraw/zinc/75/13/85/1134751385.db2.gz BDHZDVCKBOOIAA-KYOSRNDESA-N 1 0 340.370 3.512 20 5 EHBDRO C[C@@H]1CCC[C@H](C)[N@H+](CC(=O)Nc2cc(Cl)ccc2[N+](=O)[O-])C1 ZINC001191069299 1134786342 /nfs/dbraw/zinc/78/63/42/1134786342.db2.gz GLVOZPMMMNVWSN-NEPJUHHUSA-N 1 0 339.823 3.697 20 5 EHBDRO CO[C@]1(C)C[C@@H]([N@H+](C)Cc2ccc(Cl)cc2[N+](=O)[O-])C1(C)C ZINC001191202043 1134814763 /nfs/dbraw/zinc/81/47/63/1134814763.db2.gz DVWWPENSWUUDDL-GDBMZVCRSA-N 1 0 326.824 3.884 20 5 EHBDRO C[NH+]1C(C)(C)CC(Nc2ncnc3sc([N+](=O)[O-])cc32)CC1(C)C ZINC001170450053 1135065704 /nfs/dbraw/zinc/06/57/04/1135065704.db2.gz FGTYIEJCEDWTTC-UHFFFAOYSA-N 1 0 349.460 3.663 20 5 EHBDRO C[NH+](C)CCCC1CCN(c2cc(Cl)ccc2[N+](=O)[O-])CC1 ZINC000804587401 1135126388 /nfs/dbraw/zinc/12/63/88/1135126388.db2.gz MYVKSBSPVHNCJK-UHFFFAOYSA-N 1 0 325.840 3.806 20 5 EHBDRO C[C@@H](C[NH+](C)C)Nc1cc(Cl)c(C(F)(F)F)cc1[N+](=O)[O-] ZINC000804854374 1135212841 /nfs/dbraw/zinc/21/28/41/1135212841.db2.gz FRSXIDMMFHUUNO-ZETCQYMHSA-N 1 0 325.718 3.629 20 5 EHBDRO CC[C@@H](c1ccccc1OC)[N@H+](C)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000805834346 1135332382 /nfs/dbraw/zinc/33/23/82/1135332382.db2.gz FWOAMEDKWYVDSD-ZWKOTPCHSA-N 1 0 344.411 3.720 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccc([N+](=O)[O-])cc1)c1ccccc1F ZINC001195623308 1135444300 /nfs/dbraw/zinc/44/43/00/1135444300.db2.gz ZLLOOJKJLYHRCU-QGZVFWFLSA-N 1 0 345.374 3.803 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3CC[C@H](C4CCCCC4)C3)nc2c1 ZINC001195892631 1135481798 /nfs/dbraw/zinc/48/17/98/1135481798.db2.gz IKLZXVHIBXXBDI-AWEZNQCLSA-N 1 0 328.416 3.873 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[N@@H+](CC[C@H](O)c1ccccc1)C1CC1 ZINC000808740904 1135734385 /nfs/dbraw/zinc/73/43/85/1135734385.db2.gz RMTMTOLBRVOGEL-IBGZPJMESA-N 1 0 326.396 3.683 20 5 EHBDRO O=[N+]([O-])c1cc(C[N@@H+]2CCCC[C@@H]([C@H]3CCOC3)C2)ccc1Cl ZINC001198563865 1135831192 /nfs/dbraw/zinc/83/11/92/1135831192.db2.gz TXPOPYPMTOLTCL-CABCVRRESA-N 1 0 338.835 3.887 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1CN1CCC[C@H]2COCC[C@H]21 ZINC000809954148 1135906129 /nfs/dbraw/zinc/90/61/29/1135906129.db2.gz QHUDKABSEGTORW-IINYFYTJSA-N 1 0 345.226 3.903 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1CNc1ccc(CC[NH+](C)C)cc1 ZINC001201192644 1135994566 /nfs/dbraw/zinc/99/45/66/1135994566.db2.gz VCHLZTCKFMRNCB-UHFFFAOYSA-N 1 0 327.428 3.928 20 5 EHBDRO CC(C)(C)c1ccc(C(=O)O[C@@H]2CC[N@@H+]3CCC[C@H]3C2)cc1[N+](=O)[O-] ZINC000810847385 1136014386 /nfs/dbraw/zinc/01/43/86/1136014386.db2.gz OHCIFOMJJGDRAO-LSDHHAIUSA-N 1 0 346.427 3.676 20 5 EHBDRO Nc1c(Cl)cccc1C[NH2+]CCc1ccc(Cl)cc1[N+](=O)[O-] ZINC001201692878 1136057136 /nfs/dbraw/zinc/05/71/36/1136057136.db2.gz IMNTVJWJMAFNFS-UHFFFAOYSA-N 1 0 340.210 3.816 20 5 EHBDRO C[NH+](C)[C@H]1CCC[C@H](NCc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1 ZINC000811482898 1136091308 /nfs/dbraw/zinc/09/13/08/1136091308.db2.gz WQNMISQFJUQGPI-STQMWFEESA-N 1 0 346.258 3.864 20 5 EHBDRO CO[C@H]1C[C@@H]([NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])C1(C)C ZINC000811483476 1136091745 /nfs/dbraw/zinc/09/17/45/1136091745.db2.gz JYKADJLSOLKYEW-NEPJUHHUSA-N 1 0 333.215 3.805 20 5 EHBDRO CCC(CC)(CO)C[NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-] ZINC000811485184 1136091960 /nfs/dbraw/zinc/09/19/60/1136091960.db2.gz BRJRJSPTFABRER-UHFFFAOYSA-N 1 0 335.231 3.790 20 5 EHBDRO Cc1cccc(CC[NH2+]Cc2cc(Cl)cc(Cl)c2[N+](=O)[O-])n1 ZINC000811498184 1136094305 /nfs/dbraw/zinc/09/43/05/1136094305.db2.gz NOBQLFWKEFAERU-UHFFFAOYSA-N 1 0 340.210 3.937 20 5 EHBDRO C[C@H]([NH3+])c1ncc(-c2ccccc2)n1-c1cc2cc[nH]c2c([N+](=O)[O-])c1 ZINC001170682204 1136230644 /nfs/dbraw/zinc/23/06/44/1136230644.db2.gz MUZTYODSCZYHGX-LBPRGKRZSA-N 1 0 347.378 3.949 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@@H](C)Nc1ccc(C[NH+](C)C)c(F)c1 ZINC000850456322 1136262617 /nfs/dbraw/zinc/26/26/17/1136262617.db2.gz DIRKPMGRJJTDPJ-GFCCVEGCSA-N 1 0 347.390 3.977 20 5 EHBDRO CCc1ccc([C@H](O)C[NH2+][C@@H](C)c2ccc([N+](=O)[O-])cc2OC)cc1 ZINC000850470243 1136265287 /nfs/dbraw/zinc/26/52/87/1136265287.db2.gz ZVKFZCPSWDFQDQ-SCLBCKFNSA-N 1 0 344.411 3.550 20 5 EHBDRO COc1cc([N+](=O)[O-])ccc1[C@H](C)[NH2+]CC[C@]1(C)C[C@@]1(F)Cl ZINC000850476938 1136266758 /nfs/dbraw/zinc/26/67/58/1136266758.db2.gz OZFINOVOVYHIGZ-VQISRLSMSA-N 1 0 330.787 3.959 20 5 EHBDRO C[C@@H]([NH2+]Cc1cccc(OC2CC2)c1F)c1ccc(N)c([N+](=O)[O-])c1 ZINC000850520626 1136276433 /nfs/dbraw/zinc/27/64/33/1136276433.db2.gz DKELIGIYFUUJTH-LLVKDONJSA-N 1 0 345.374 3.708 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]1CCC[C@H]1[NH2+][C@H]1COC2(CCC2)C1 ZINC000850524902 1136277310 /nfs/dbraw/zinc/27/73/10/1136277310.db2.gz JNMJQAIXKVQGLC-USXIJHARSA-N 1 0 330.428 3.607 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@H]1C[C@H](O)c2ccccc21 ZINC000850528909 1136279043 /nfs/dbraw/zinc/27/90/43/1136279043.db2.gz OEBDOXVGDXKTLM-FMEYXAORSA-N 1 0 326.396 3.684 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@H]([NH2+][C@H]1C[C@@H](O)c2ccccc21)C1CC1 ZINC000850529604 1136279144 /nfs/dbraw/zinc/27/91/44/1136279144.db2.gz SKJJBFZAERGAPY-CMKODMSKSA-N 1 0 338.407 3.684 20 5 EHBDRO C[C@@H]([NH2+]C1CCC2(CC2(F)F)CC1)c1ccc(N)c([N+](=O)[O-])c1 ZINC000850549026 1136283265 /nfs/dbraw/zinc/28/32/65/1136283265.db2.gz CNWZYIAFKIALTD-CKQAKLJMSA-N 1 0 325.359 3.796 20 5 EHBDRO CC[N@@H+](Cc1ccc(F)cc1[N+](=O)[O-])C[C@@H](O)c1ccc(C)cc1 ZINC000851791486 1136407734 /nfs/dbraw/zinc/40/77/34/1136407734.db2.gz BZBMFAYHEFXLBV-GOSISDBHSA-N 1 0 332.375 3.598 20 5 EHBDRO O=[N+]([O-])c1c(Cl)cc(Cl)cc1C[NH2+]C1(CCO)CCCC1 ZINC000852120634 1136435526 /nfs/dbraw/zinc/43/55/26/1136435526.db2.gz VJTHZJPSUGTKTO-UHFFFAOYSA-N 1 0 333.215 3.686 20 5 EHBDRO Cc1ccccc1C[C@H]1CCC[N@@H+]1C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776585580 1136448195 /nfs/dbraw/zinc/44/81/95/1136448195.db2.gz XDJNZWMDQFOBOV-WOJBJXKFSA-N 1 0 340.423 3.644 20 5 EHBDRO C[N@@H+](Cc1cc2ccccc2o1)C[C@@H](O)c1ccc([N+](=O)[O-])cc1 ZINC000776590375 1136453170 /nfs/dbraw/zinc/45/31/70/1136453170.db2.gz DCCSQKBBFMACOP-QGZVFWFLSA-N 1 0 326.352 3.506 20 5 EHBDRO CC[C@H]([NH2+]C[C@@H](O)c1ccc([N+](=O)[O-])cc1)C(C)(C)c1ccccc1 ZINC000776606650 1136470644 /nfs/dbraw/zinc/47/06/44/1136470644.db2.gz YVFFMIDYHKVJFT-MOPGFXCFSA-N 1 0 342.439 3.974 20 5 EHBDRO CC(C)(CO)[C@@H]([NH2+]Cc1cc(Cl)cc(Cl)c1[N+](=O)[O-])C1CC1 ZINC000815247637 1136572901 /nfs/dbraw/zinc/57/29/01/1136572901.db2.gz FASYSCSIQFTMDR-AWEZNQCLSA-N 1 0 347.242 3.788 20 5 EHBDRO CC[C@@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000815559010 1136610569 /nfs/dbraw/zinc/61/05/69/1136610569.db2.gz URXKTPMVCKDUKW-MLGOLLRUSA-N 1 0 329.400 3.988 20 5 EHBDRO CC[C@H]([NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccccc1OC ZINC000815559011 1136610862 /nfs/dbraw/zinc/61/08/62/1136610862.db2.gz URXKTPMVCKDUKW-WBMJQRKESA-N 1 0 329.400 3.988 20 5 EHBDRO C[C@@H](C[NH2+][C@H](C)c1ccc(N)c([N+](=O)[O-])c1)c1ccc(F)cc1F ZINC000815584966 1136614510 /nfs/dbraw/zinc/61/45/10/1136614510.db2.gz UANRRLXVYMJSSA-WDEREUQCSA-N 1 0 335.354 3.910 20 5 EHBDRO CCOC(=O)N1CCC[C@H]([C@@H](C)[NH2+][C@H](C)c2ccccc2[N+](=O)[O-])C1 ZINC000776753786 1136643035 /nfs/dbraw/zinc/64/30/35/1136643035.db2.gz GYDDVGSMQSCXRL-KFWWJZLASA-N 1 0 349.431 3.502 20 5 EHBDRO C[C@@H]1CCc2ccccc2[C@H]1[NH2+]C[C@H](O)c1cccc([N+](=O)[O-])c1 ZINC000819196333 1136922193 /nfs/dbraw/zinc/92/21/93/1136922193.db2.gz AARYUUGPHAEKEB-VMDGZTHMSA-N 1 0 326.396 3.541 20 5 EHBDRO Cc1c(C[NH2+]C[C@@H](O)c2ccc(F)cc2Cl)cccc1[N+](=O)[O-] ZINC000819261321 1136929613 /nfs/dbraw/zinc/92/96/13/1136929613.db2.gz JIIQRLNMUITVNP-MRXNPFEDSA-N 1 0 338.766 3.519 20 5 EHBDRO CC(F)(F)c1ccc(C[NH2+]C[C@@H](O)c2ccc([N+](=O)[O-])cc2)cc1 ZINC000819331085 1136931976 /nfs/dbraw/zinc/93/19/76/1136931976.db2.gz JVVDNZONGANDJN-MRXNPFEDSA-N 1 0 336.338 3.530 20 5 EHBDRO O=[N+]([O-])c1ccc2[nH]c(C[N@@H+]3C[C@@H]4C[C@@H](c5ccccc5)[C@@H]4C3)nc2c1 ZINC000859928677 1137037326 /nfs/dbraw/zinc/03/73/26/1137037326.db2.gz NVTNRZAUNXJRRL-BHYGNILZSA-N 1 0 348.406 3.707 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[N@H+](C)C[C@@](C)(O)c1ccccc1 ZINC000823606946 1137106574 /nfs/dbraw/zinc/10/65/74/1137106574.db2.gz XTVZZIRTUBBQCD-HNAYVOBHSA-N 1 0 328.412 3.804 20 5 EHBDRO O=[N+]([O-])c1ccc(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)cc1Cl ZINC000824696980 1137147223 /nfs/dbraw/zinc/14/72/23/1137147223.db2.gz WUUHAZPOHMBJTC-YSVLISHTSA-N 1 0 338.835 3.764 20 5 EHBDRO O=[N+]([O-])c1ccc(Cl)c(C[N@H+]2CCCC[C@@H]2[C@@H]2CCC[C@H]2O)c1 ZINC000824696058 1137148703 /nfs/dbraw/zinc/14/87/03/1137148703.db2.gz GWWMZPCYPOIPOE-USXIJHARSA-N 1 0 338.835 3.764 20 5 EHBDRO COc1ccc(C[NH2+]CC[C@]2(C)CC2(Cl)Cl)cc1[N+](=O)[O-] ZINC000824971676 1137160585 /nfs/dbraw/zinc/16/05/85/1137160585.db2.gz WPTQCLYSRANCDS-CYBMUJFWSA-N 1 0 333.215 3.667 20 5 EHBDRO O=[N+]([O-])c1ccc(C[NH2+]C2CCC(OC(F)F)CC2)cc1Cl ZINC000825145244 1137167240 /nfs/dbraw/zinc/16/72/40/1137167240.db2.gz XQJLXVTWSZWLBS-UHFFFAOYSA-N 1 0 334.750 3.888 20 5 EHBDRO O=[N+]([O-])c1cccc([C@@H](O)C[NH2+][C@@H]2CCCc3ccc(Cl)cc32)c1 ZINC000863590931 1137193138 /nfs/dbraw/zinc/19/31/38/1137193138.db2.gz PRWJGQAMUGBLIU-MSOLQXFVSA-N 1 0 346.814 3.949 20 5 EHBDRO C[C@H](CSc1ccccc1)[N@H+](C)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000844362094 1137215281 /nfs/dbraw/zinc/21/52/81/1137215281.db2.gz XSEZFLYHLCEVTM-RDTXWAMCSA-N 1 0 346.452 3.741 20 5 EHBDRO Cc1nn(C[N@H+](CC2CC2)CC2CCC2)c2cc([N+](=O)[O-])ccc12 ZINC000794715741 1137243113 /nfs/dbraw/zinc/24/31/13/1137243113.db2.gz XADYESUQJKOCNN-UHFFFAOYSA-N 1 0 328.416 3.723 20 5 EHBDRO O=[N+]([O-])c1ccc(N2CC[C@H](C[NH+]3CCCCC3)C2)c(C(F)F)c1 ZINC000865561387 1137295494 /nfs/dbraw/zinc/29/54/94/1137295494.db2.gz MFLTXEHNVLDDGH-CYBMUJFWSA-N 1 0 339.386 3.845 20 5 EHBDRO CC[C@H]([NH2+]Cc1cccc([N+](=O)[O-])c1)c1cccc(OC)c1OC ZINC000865759694 1137309201 /nfs/dbraw/zinc/30/92/01/1137309201.db2.gz ZWGUHBLMRCWJAV-INIZCTEOSA-N 1 0 330.384 3.853 20 5 EHBDRO O=[N+]([O-])c1cc(C[NH2+][C@H](Cc2cccnc2)C2CCCC2)cs1 ZINC000865833119 1137315038 /nfs/dbraw/zinc/31/50/38/1137315038.db2.gz AQQIROAVUJSGNL-MRXNPFEDSA-N 1 0 331.441 3.942 20 5 EHBDRO C[C@H](CCc1ccccc1[N+](=O)[O-])[NH2+][C@@H](C)[C@](C)(O)c1ccccc1 ZINC000846038371 1137328944 /nfs/dbraw/zinc/32/89/44/1137328944.db2.gz PUCOYSKBFSRVIC-GUXCAODWSA-N 1 0 342.439 3.802 20 5 EHBDRO C[C@@H](O)c1ccc(C[NH2+][C@@H](C)Cc2ccc(F)cc2[N+](=O)[O-])cc1 ZINC000866244772 1137338708 /nfs/dbraw/zinc/33/87/08/1137338708.db2.gz UIYRJBRZOJEVMI-QWHCGFSZSA-N 1 0 332.375 3.508 20 5 EHBDRO C[C@@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H]1CCc2c1cccc2O ZINC000866260870 1137340277 /nfs/dbraw/zinc/34/02/77/1137340277.db2.gz OBXAZRBNPQTUBR-MEDUHNTESA-N 1 0 330.359 3.648 20 5 EHBDRO C[C@]1(CC[NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C[C@@]1(F)Cl ZINC000846185578 1137340458 /nfs/dbraw/zinc/34/04/58/1137340458.db2.gz SNIBEEDOHFGMAR-DHMWGJHJSA-N 1 0 344.818 3.569 20 5 EHBDRO C[C@@H]([NH2+]CCC[C@H]1CC1(Cl)Cl)c1ccc(N)c([N+](=O)[O-])c1 ZINC000846215280 1137341817 /nfs/dbraw/zinc/34/18/17/1137341817.db2.gz NQJVBTSHPWNIBV-KOLCDFICSA-N 1 0 332.231 3.802 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+][C@@H](C)C[C@@H](O)c1ccccc1 ZINC000866288083 1137342802 /nfs/dbraw/zinc/34/28/02/1137342802.db2.gz UCKIRUNZBFNGSQ-BIENJYKASA-N 1 0 346.402 3.767 20 5 EHBDRO C[C@H](Cc1ccc(F)cc1[N+](=O)[O-])[NH2+]C[C@@H]1CCOC2(CCC2)C1 ZINC000866367754 1137349964 /nfs/dbraw/zinc/34/99/64/1137349964.db2.gz OHFGTQBAFBLNSJ-ZIAGYGMSSA-N 1 0 336.407 3.604 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1NC(=O)C[N@@H+]1CC[C@H](CC(C)(C)C)C1 ZINC001171227666 1137353902 /nfs/dbraw/zinc/35/39/02/1137353902.db2.gz ANIDFVWVHQMOPH-CQSZACIVSA-N 1 0 333.432 3.600 20 5 EHBDRO Cc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+]C1CCN(C(=O)OC(C)C)CC1 ZINC000772975339 1137392108 /nfs/dbraw/zinc/39/21/08/1137392108.db2.gz CKGDWJQXCJFWPF-AWEZNQCLSA-N 1 0 349.431 3.563 20 5 EHBDRO O=[N+]([O-])c1cc(CN2CC[C@H](C[NH+]3CCCCC3)C2)ccc1Cl ZINC000122699976 1137461177 /nfs/dbraw/zinc/46/11/77/1137461177.db2.gz RWFCCALFRUVOIP-OAHLLOKOSA-N 1 0 337.851 3.556 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]CCc2cnc(C)s2)cc1[N+](=O)[O-] ZINC000773081118 1137464201 /nfs/dbraw/zinc/46/42/01/1137464201.db2.gz KUTPKRLSBXADNP-LLVKDONJSA-N 1 0 335.429 3.652 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@@H](C)[NH2+]Cc1cccc(CO)c1 ZINC000872033781 1137566693 /nfs/dbraw/zinc/56/66/93/1137566693.db2.gz JKQXQQRLLKURPD-GFCCVEGCSA-N 1 0 332.425 3.660 20 5 EHBDRO C[C@H](C[C@H](O)c1ccccc1)[NH2+][C@@H](C)c1c(F)cccc1[N+](=O)[O-] ZINC000872042377 1137567282 /nfs/dbraw/zinc/56/72/82/1137567282.db2.gz BZSVAPIEGCCEGA-IGCXYCKISA-N 1 0 332.375 3.897 20 5 EHBDRO C[C@H]([NH2+][C@@H](CO)[C@@H](C)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872045534 1137567554 /nfs/dbraw/zinc/56/75/54/1137567554.db2.gz NXLXXVWJPRQEOX-XEZPLFJOSA-N 1 0 332.375 3.549 20 5 EHBDRO CSc1ccc([N+](=O)[O-])cc1[C@H](C)[NH2+][C@H](C)Cc1cc(C)n[nH]1 ZINC000872049627 1137567786 /nfs/dbraw/zinc/56/77/86/1137567786.db2.gz UHWNETMYKFWAGM-PWSUYJOCSA-N 1 0 334.445 3.630 20 5 EHBDRO C[C@H]([NH2+]CC[C@@](C)(O)c1ccccc1)c1c(F)cccc1[N+](=O)[O-] ZINC000872064606 1137569142 /nfs/dbraw/zinc/56/91/42/1137569142.db2.gz IUHWAWQZYATFBP-SCLBCKFNSA-N 1 0 332.375 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc([C@@H](O)C[NH2+][C@H]2C[C@H](Sc3ccccc3)C2)cc1 ZINC000872224604 1137576025 /nfs/dbraw/zinc/57/60/25/1137576025.db2.gz GLDINVFUCHWBSW-WBAXXEDZSA-N 1 0 344.436 3.541 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]Cc1cccc2c1OCCCO2 ZINC000873081909 1137589657 /nfs/dbraw/zinc/58/96/57/1137589657.db2.gz VSWCFRXQAXDHGL-UHFFFAOYSA-N 1 0 342.395 3.663 20 5 EHBDRO Cc1c(C[NH2+]CC2([C@@H](O)c3ccccc3)CC2)cccc1[N+](=O)[O-] ZINC000873095646 1137590040 /nfs/dbraw/zinc/59/00/40/1137590040.db2.gz GZFQYWAWBWIFFV-SFHVURJKSA-N 1 0 326.396 3.507 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+][C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000873097791 1137590116 /nfs/dbraw/zinc/59/01/16/1137590116.db2.gz FZHGVGQKFVNBHC-JBEBIEQOSA-N 1 0 346.452 3.800 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(C)c1C[NH2+]C1CCC(OC(F)F)CC1 ZINC000873129665 1137590931 /nfs/dbraw/zinc/59/09/31/1137590931.db2.gz PPIZACTWOATZPD-UHFFFAOYSA-N 1 0 328.359 3.852 20 5 EHBDRO O=[N+]([O-])c1cnn(C2CC([NH2+][C@H](c3ccccc3)C3CCC3)C2)c1 ZINC000877011253 1137667578 /nfs/dbraw/zinc/66/75/78/1137667578.db2.gz BUKWMRPUADTWNK-LEOMRAHMSA-N 1 0 326.400 3.626 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1ccc(F)cc1F ZINC000877050986 1137668736 /nfs/dbraw/zinc/66/87/36/1137668736.db2.gz QFFAKHAXDSRZQY-PPUFBPAQSA-N 1 0 336.342 3.514 20 5 EHBDRO CCO[P@](C)(=O)CC[C@@H](C)[NH2+]Cc1cccc([N+](=O)[O-])c1C ZINC000877472315 1137677343 /nfs/dbraw/zinc/67/73/43/1137677343.db2.gz PNEYRPNOQYOTEO-IPQOISQHSA-N 1 0 328.349 3.716 20 5 EHBDRO CC[C@H]([NH2+]C1CC(n2cc([N+](=O)[O-])cn2)C1)c1cc(C)ccc1C ZINC000877658145 1137684604 /nfs/dbraw/zinc/68/46/04/1137684604.db2.gz VBRJRMCOBKSKBV-JMLCCBQJSA-N 1 0 328.416 3.853 20 5 EHBDRO CC1([NH+]2CCCC2)CCN(Cc2ccc(Cl)c([N+](=O)[O-])c2)CC1 ZINC000877675407 1137685550 /nfs/dbraw/zinc/68/55/50/1137685550.db2.gz YWVVNJNUFUHLDC-UHFFFAOYSA-N 1 0 337.851 3.699 20 5 EHBDRO CC(C)(O)[C@@H]1CCC[N@H+](Cc2ccc(-c3cccc([N+](=O)[O-])c3)o2)C1 ZINC000877796723 1137690210 /nfs/dbraw/zinc/69/02/10/1137690210.db2.gz KTEXTLABFYQGKB-OAHLLOKOSA-N 1 0 344.411 3.838 20 5 EHBDRO C[C@@H]1CCC[C@@H]([N@H+](C)Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)C1 ZINC000877966238 1137697425 /nfs/dbraw/zinc/69/74/25/1137697425.db2.gz DXQYDBVYFMXNAO-CHWSQXEVSA-N 1 0 330.388 3.655 20 5 EHBDRO C[C@@H]1C[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC(C)(C)C1 ZINC000878403668 1137714587 /nfs/dbraw/zinc/71/45/87/1137714587.db2.gz DSGFYWZZABGBCX-LBPRGKRZSA-N 1 0 330.388 3.513 20 5 EHBDRO C[C@H]1CC[N@H+](Cc2nnc(-c3ccccc3[N+](=O)[O-])o2)CC1(C)C ZINC000878432927 1137715729 /nfs/dbraw/zinc/71/57/29/1137715729.db2.gz MNLGRBWALMVLAF-LBPRGKRZSA-N 1 0 330.388 3.513 20 5 EHBDRO C[N@H+](Cc1nnc(-c2ccccc2[N+](=O)[O-])o1)[C@@H]1CCC(C)(C)C1 ZINC000878541794 1137719543 /nfs/dbraw/zinc/71/95/43/1137719543.db2.gz UATMRUCJMXKSDR-GFCCVEGCSA-N 1 0 330.388 3.655 20 5 EHBDRO Cc1ccc(C[NH+]2CCC(c3ccc(F)cn3)CC2)cc1[N+](=O)[O-] ZINC000879004723 1137735036 /nfs/dbraw/zinc/73/50/36/1137735036.db2.gz HDRJQUWUEDJLDG-UHFFFAOYSA-N 1 0 329.375 3.817 20 5 EHBDRO CCOc1cc(C[NH2+][C@@H]2CC=CC[C@H]2C(F)(F)F)ccc1[N+](=O)[O-] ZINC000879672188 1137754777 /nfs/dbraw/zinc/75/47/77/1137754777.db2.gz PFLVSPWOKCBLII-CHWSQXEVSA-N 1 0 344.333 3.980 20 5 EHBDRO Cc1nc(C2C[C@H]3CC[C@@H](C2)[N@H+]3Cc2cccc([N+](=O)[O-])c2C)no1 ZINC000879681590 1137755265 /nfs/dbraw/zinc/75/52/65/1137755265.db2.gz YDHYRZFSZVQUKM-MQVJKMGUSA-N 1 0 342.399 3.505 20 5 EHBDRO CC[C@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1C(F)(F)F)[C@@H]1CCCOC1 ZINC000880469014 1137779613 /nfs/dbraw/zinc/77/96/13/1137779613.db2.gz HOPXTISAXDIUCI-ABAIWWIYSA-N 1 0 346.349 3.908 20 5 EHBDRO C[C@H](CC(=O)Nc1ccc([N+](=O)[O-])cc1)[NH2+]CC(C)(C)CC(F)F ZINC000883258558 1137851109 /nfs/dbraw/zinc/85/11/09/1137851109.db2.gz GWQCOISGIUOGEM-LLVKDONJSA-N 1 0 343.374 3.583 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]C[C@H]1CCC2(CCC2)O1)C1CC1 ZINC000883356421 1137857247 /nfs/dbraw/zinc/85/72/47/1137857247.db2.gz NLBXLAAKNAOKMR-IAGOWNOFSA-N 1 0 330.428 3.607 20 5 EHBDRO CCOc1ccc([C@H](C)[NH2+][C@@H]2CCC[C@]23CCCO3)cc1[N+](=O)[O-] ZINC000883365643 1137857686 /nfs/dbraw/zinc/85/76/86/1137857686.db2.gz DUGHGBFCYBBMEI-VHSSKADRSA-N 1 0 334.416 3.746 20 5 EHBDRO CC1(C)C[C@H]([NH2+]C2CCC3(COC3)CC2)c2cc([N+](=O)[O-])ccc21 ZINC000883381984 1137858490 /nfs/dbraw/zinc/85/84/90/1137858490.db2.gz XKTKRZZJPXRNGN-KRWDZBQOSA-N 1 0 330.428 3.866 20 5 EHBDRO Cc1occc1C[N@H+](C)CCc1ncc(-c2cccc([N+](=O)[O-])c2)o1 ZINC000104676531 1137879128 /nfs/dbraw/zinc/87/91/28/1137879128.db2.gz BJMNGDJDCJOEHF-UHFFFAOYSA-N 1 0 341.367 3.826 20 5 EHBDRO CS[C@@H]1CCC[C@H]([NH2+][C@@H]2CCCC[C@@H]2n2ccc([N+](=O)[O-])n2)C1 ZINC000331849610 1137922797 /nfs/dbraw/zinc/92/27/97/1137922797.db2.gz CURAICFXJMVQFA-YJNKXOJESA-N 1 0 338.477 3.539 20 5 EHBDRO Cc1cccnc1[C@@H]([NH2+]CCOc1ccccc1[N+](=O)[O-])C(C)C ZINC000120847723 1137952866 /nfs/dbraw/zinc/95/28/66/1137952866.db2.gz AGKYCBMVSUNIHB-KRWDZBQOSA-N 1 0 329.400 3.664 20 5 EHBDRO CCC1([NH+]2CCC2)CCN(c2c3ccccc3ncc2[N+](=O)[O-])CC1 ZINC000884717093 1137970865 /nfs/dbraw/zinc/97/08/65/1137970865.db2.gz RTUAPAGRUOVEBL-UHFFFAOYSA-N 1 0 340.427 3.598 20 5 EHBDRO C[N@@H+](Cc1cccc2ccccc21)C[C@@H](O)c1cccc([N+](=O)[O-])c1 ZINC000136954677 1138044164 /nfs/dbraw/zinc/04/41/64/1138044164.db2.gz MGOMJPBEDNMVDL-HXUWFJFHSA-N 1 0 336.391 3.913 20 5 EHBDRO Cc1ccc(NC(=O)c2cc([N+](=O)[O-])ccc2C)c(C[NH+](C)C)c1 ZINC000072840948 1138108133 /nfs/dbraw/zinc/10/81/33/1138108133.db2.gz OUWQOUAKCKWOKR-UHFFFAOYSA-N 1 0 327.384 3.526 20 5 EHBDRO CCC[C@H]([NH2+]C[C@@H]1CC[C@]2(CO[C@H](C)C2)O1)c1cccc([N+](=O)[O-])c1 ZINC000886761903 1138134191 /nfs/dbraw/zinc/13/41/91/1138134191.db2.gz MZYXBBVEIJDQEN-FCLVOEFKSA-N 1 0 348.443 3.752 20 5 EHBDRO C[C@@H]1C[C@@H](N(C)Cc2ccc(-c3ccccc3[N+](=O)[O-])o2)CC[N@@H+]1C ZINC000093644281 1138238889 /nfs/dbraw/zinc/23/88/89/1138238889.db2.gz QVJALBYKUFALHM-CABCVRRESA-N 1 0 343.427 3.769 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[NH+]2CCC(CO)CC2)s1 ZINC000127066484 1138345933 /nfs/dbraw/zinc/34/59/33/1138345933.db2.gz KSKFBYJGOZYGBG-UHFFFAOYSA-N 1 0 332.425 3.528 20 5 EHBDRO O=[N+]([O-])c1ccc2cnn(C[NH+]3CCC(c4ccccc4)CC3)c2c1 ZINC000887559313 1138428041 /nfs/dbraw/zinc/42/80/41/1138428041.db2.gz LMQRRTCVPAQFRL-UHFFFAOYSA-N 1 0 336.395 3.782 20 5 EHBDRO O=[N+]([O-])c1ccc(-c2ccc(C[N@H+](C[C@H]3CCOC3)C3CC3)o2)cc1 ZINC000129948774 1138428865 /nfs/dbraw/zinc/42/88/65/1138428865.db2.gz MSNIXDCYKRBHOV-CQSZACIVSA-N 1 0 342.395 3.856 20 5 EHBDRO O=[N+]([O-])c1ccccc1-c1ccc(C[N@H+](C[C@H]2CCOC2)C2CC2)o1 ZINC000129968465 1138429852 /nfs/dbraw/zinc/42/98/52/1138429852.db2.gz ZSBFLRMHAIXUDB-CQSZACIVSA-N 1 0 342.395 3.856 20 5 EHBDRO CC(C)C1(C)CC[NH+](CCC(=O)Nc2ccccc2[N+](=O)[O-])CC1 ZINC000337405392 1138558592 /nfs/dbraw/zinc/55/85/92/1138558592.db2.gz JDKZNTRIOGSFSW-UHFFFAOYSA-N 1 0 333.432 3.682 20 5 EHBDRO O=[N+]([O-])c1ccc2c(c1)[C@H]([NH2+][C@H]1CCC[C@@H]1OC(F)F)CCC2 ZINC000337551462 1138603052 /nfs/dbraw/zinc/60/30/52/1138603052.db2.gz ORVNUGWTISKETG-ILXRZTDVSA-N 1 0 326.343 3.722 20 5 EHBDRO C[C@H]([NH2+][C@@H]1C=C[C@H](CO)C1)c1ccc(-c2ccccc2[N+](=O)[O-])s1 ZINC000134640958 1138699351 /nfs/dbraw/zinc/69/93/51/1138699351.db2.gz LKGTVSHSUDJSNO-MELADBBJSA-N 1 0 344.436 3.911 20 5 EHBDRO COc1ccccc1N1CC[C@H]([NH2+][C@H](C)c2ccc([N+](=O)[O-])cc2)C1 ZINC000151857354 1139060958 /nfs/dbraw/zinc/06/09/58/1139060958.db2.gz CLBMFHUTJQAXRK-ZBFHGGJFSA-N 1 0 341.411 3.533 20 5 EHBDRO CC(=O)Nc1ccc([C@@H](C)[NH2+][C@@H](C)c2cccc([N+](=O)[O-])c2)cc1 ZINC000182004573 1139944682 /nfs/dbraw/zinc/94/46/82/1139944682.db2.gz LVMMPFBQSBWWDZ-OLZOCXBDSA-N 1 0 327.384 3.965 20 5 EHBDRO O=[N+]([O-])c1ccccc1C[C@@H]([NH2+]Cc1ccc(Cl)cn1)C1CC1 ZINC000182127200 1139952809 /nfs/dbraw/zinc/95/28/09/1139952809.db2.gz MDBNSKJSXULSIK-MRXNPFEDSA-N 1 0 331.803 3.754 20 5 EHBDRO C[C@@H](c1cccc([N+](=O)[O-])c1)[NH+]1CCC(Oc2ccc(F)nc2)CC1 ZINC000190502014 1140407547 /nfs/dbraw/zinc/40/75/47/1140407547.db2.gz DTTDDRHXCMFHLR-ZDUSSCGKSA-N 1 0 345.374 3.733 20 5 EHBDRO CC[NH+](CC)Cc1ccc(NC(=O)c2ccc([N+](=O)[O-])s2)cc1 ZINC000190570204 1140409390 /nfs/dbraw/zinc/40/93/90/1140409390.db2.gz VBLPTRHEBQNSIN-UHFFFAOYSA-N 1 0 333.413 3.750 20 5 EHBDRO CCC1(O)CC[NH+](Cc2cc(=O)oc3ccc4ccccc4c23)CC1 ZINC000266719926 1140718573 /nfs/dbraw/zinc/71/85/73/1140718573.db2.gz HEKYHAIZDBFPCB-UHFFFAOYSA-N 1 0 337.419 3.683 20 5 EHBDRO C[C@@H]([NH2+]Cc1cc([N+](=O)[O-])ccc1Cl)[C@H](O)c1cccc(F)c1 ZINC000267252559 1140772348 /nfs/dbraw/zinc/77/23/48/1140772348.db2.gz ZSSGJPFCSOWWBK-HWPZZCPQSA-N 1 0 338.766 3.599 20 5 EHBDRO Cc1noc(C2CCC([NH2+][C@H](C)c3ccccc3[N+](=O)[O-])CC2)n1 ZINC000267778432 1140831917 /nfs/dbraw/zinc/83/19/17/1140831917.db2.gz MRNBDJGDMBJCLB-LMWSTFAQSA-N 1 0 330.388 3.663 20 5 EHBDRO Cc1c(C[N@@H+]2CCC[C@H]2C[C@@H](O)c2ccco2)cccc1[N+](=O)[O-] ZINC000268309592 1140918913 /nfs/dbraw/zinc/91/89/13/1140918913.db2.gz XAKOPLIAXABHPX-DOTOQJQBSA-N 1 0 330.384 3.584 20 5 EHBDRO CCC(CC)(CCO)C[NH2+][C@H](Cc1ccccc1[N+](=O)[O-])C1CC1 ZINC000268884825 1141017007 /nfs/dbraw/zinc/01/70/07/1141017007.db2.gz BQWOOPZFLMGVKQ-QGZVFWFLSA-N 1 0 334.460 3.694 20 5 EHBDRO Cc1ccc([N+](=O)[O-])c(NC2CC[NH+]([C@H](C)c3ccncc3)CC2)c1 ZINC000269750577 1141141730 /nfs/dbraw/zinc/14/17/30/1141141730.db2.gz ZUBVKXUTIWMZMJ-OAHLLOKOSA-N 1 0 340.427 3.936 20 5 EHBDRO CCOc1ccc([C@@H](C)[NH2+]C[C@@H](CCO)CC(C)C)cc1[N+](=O)[O-] ZINC000271199138 1141323945 /nfs/dbraw/zinc/32/39/45/1141323945.db2.gz ZAOGXJHFACVVPJ-CABCVRRESA-N 1 0 338.448 3.689 20 5 EHBDRO Cc1ccc([C@H](C)[NH2+][C@@H](C)[C@H](O)c2cccc(F)c2)cc1[N+](=O)[O-] ZINC000271455149 1141371953 /nfs/dbraw/zinc/37/19/53/1141371953.db2.gz GNLKVLYAMACJPU-LXIYXOSZSA-N 1 0 332.375 3.815 20 5 EHBDRO CC[C@@H]([NH2+]CCC(=O)Nc1ccccc1[N+](=O)[O-])c1ccccc1 ZINC000271684351 1141417802 /nfs/dbraw/zinc/41/78/02/1141417802.db2.gz POGHCYJDNACNJU-OAHLLOKOSA-N 1 0 327.384 3.664 20 5 EHBDRO Cc1c(NC(=O)CC[N@@H+]2CC[C@@H]2c2ccccc2)cccc1[N+](=O)[O-] ZINC000348526348 1141545236 /nfs/dbraw/zinc/54/52/36/1141545236.db2.gz UTVBSTPPPOPEMM-GOSISDBHSA-N 1 0 339.395 3.679 20 5 EHBDRO